A0A087YDC3_POEFO Loading...

Thrombospondin type laminin G domain and EAR repeats

AlphaFold DB , UniProt , Accession A0A087YDC3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 590 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	28.5	Very low	246 Å²	246	140.1 Å²	140.1	100%	1.212	83%	0.828	S	S	*	*				0	118.3	0	-75.6	172.7	-177.2	0	0	106.7
2	G	30.8	Very low	28.2	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	83%	0.826	S	S	*	*			trans	-66.9	-167.5	170.4	0	0	0	0	0	111.6
3	P	38.3	Very low	27.9	Very low	127 Å²	127	147 Å²	147	83%	0.825	83%	0.833	S	S	*	*			cis	-133.3	-162.1	24	42.9	-23.1	0	0	0	110.5
4	S	27.5	Very low	27.9	Very low	100 Å²	100	150.9 Å²	150.9	70%	0.699	84%	0.837	S	S	*	*			cis	-170.7	132.1	16.4	34.5	0	0	0	0	108.8
5	N	26.9	Very low	27.8	Very low	149 Å²	149	153.9 Å²	153.9	80%	0.797	84%	0.842	S	S	*	*			trans	11.7	138.1	139.2	-61.2	-7.5	0	0	0	120.4
6	L	28.1	Very low	27.9	Very low	170 Å²	170	154.3 Å²	154.3	89%	0.89	84%	0.843	S	S	*	*				-162.6	130.9	101.6	-122.1	92.7	0	0	0	111.5
7	E	25.8	Very low	27.9	Very low	174 Å²	174	156.7 Å²	156.7	81%	0.813	85%	0.847	S	S	*	*			trans	-78.3	152.8	166.4	-72.7	172.6	134.9	0	0	110.9
8	T	26.2	Very low	28.1	Very low	142 Å²	142	158.7 Å²	158.7	87%	0.871	85%	0.85	S	S	*	*			trans	-151.6	134.8	143.1	-27.9	0	0	0	0	109.8
9	V	26.1	Very low	28.1	Very low	121 Å²	121	156.3 Å²	156.3	73%	0.733	85%	0.847	S	S	*	*			trans	-111.9	141.1	-174.1	169.7	0	0	0	0	109.9
10	A	25.1	Very low	28.1	Very low	86 Å²	86	154.4 Å²	154.4	71%	0.711	84%	0.843	S	S	*	*			trans	172.7	116.8	142.2	0	0	0	0	0	108.6
11	L	23.9	Very low	28.3	Very low	153 Å²	153	159 Å²	159	80%	0.801	85%	0.848	S	S	*	*				49.9	130.9	84.2	-65	174.6	0	0	0	112.3
12	E	24.8	Very low	28	Very low	172 Å²	172	156.7 Å²	156.7	80%	0.804	83%	0.831	S	S	*	*			cis	-172.5	143.7	-2.7	-144.3	178.5	-171.7	0	0	103.1
13	E	24.3	Very low	28.3	Very low	198 Å²	198	163 Å²	163	93%	0.925	84%	0.838	S	S	*	*			trans	-173.8	124.3	142.8	-107.6	170	-166.9	0	0	110.7
14	K	27.5	Very low	27.8	Very low	202 Å²	202	165.6 Å²	165.6	88%	0.878	84%	0.839	S	S	*	*			trans	-93.6	130.3	169	-85	177.8	171.4	178	0	107.6
15	E	26.9	Very low	28.1	Very low	195 Å²	195	167 Å²	167	91%	0.911	84%	0.843	S	S	*	*			trans	-128.9	120.3	148.5	-79.6	-169.9	149.5	0	0	109.3
16	D	28.9	Very low	28.2	Very low	161 Å²	161	169.8 Å²	169.8	86%	0.861	85%	0.848	S	S	*	*			trans	-72.2	128	166.6	-95.9	-44.5	0	0	0	108.8
17	E	27.6	Very low	28.5	Very low	195 Å²	195	172.7 Å²	172.7	91%	0.911	85%	0.848	S	S	*	*			trans	-141	118.2	150.6	-118.9	-174.4	178	0	0	111.4
18	Q	31.4	Very low	29.2	Very low	193 Å²	193	171 Å²	171	90%	0.902	84%	0.844	S	S	*	*			trans	-66.9	133.6	177.8	-73.1	169.7	-3.5	0	0	111.3
19	S	27.6	Very low	29.7	Very low	113 Å²	113	173.4 Å²	173.4	79%	0.79	85%	0.845	S	S	*	*			trans	-146.5	145.8	155.7	125.8	0	0	0	0	111.6
20	P	29.5	Very low	30.5	Very low	118 Å²	118	174.9 Å²	174.9	77%	0.766	84%	0.842	S	S	*	*			trans	-89	146.3	-146.7	31.4	-28.6	0	0	0	114	K22	P20-K22 PolarHBondContact O-N 2.89Å
21	R	32.8	Very low	31.9	Very low	252 Å²	252	173.6 Å²	173.6	95%	0.951	82%	0.821	S	S	*	*			trans	-48.4	106	171.4	-74.9	175.7	170.4	176.4	-2.4	112.2
22	K	28.8	Very low	33.1	Very low	197 Å²	197	171.7 Å²	171.7	86%	0.857	83%	0.827	S	S	*	*			trans	-77	118.1	153.2	-84.9	-177.9	-179.9	175.1	0	108.6	P20 E24	P20-K22 PolarHBondContact O-N 2.89Å; K22-E24 VanDerWaalsContact C-N 3.32Å; K22-E24 PolarHBondContact O-N 3.18Å
23	K	36	Very low	35	Very low	206 Å²	206	166.9 Å²	166.9	90%	0.896	82%	0.824	S	S	*	*			trans	-61.8	94.3	162.9	-85.6	176.5	173	173.6	0	108.1	T25	K23-T25 PolarHBondContact O-N 3.39Å
24	E	28	Very low	37	Very low	180 Å²	180	159.8 Å²	159.8	84%	0.841	79%	0.792	S	S	*	*			trans	-77.7	110.3	161.4	-86.7	-174.8	160.7	0	0	109.1	K22 K26	K22-E24 VanDerWaalsContact C-N 3.32Å; K22-E24 PolarHBondContact O-N 3.18Å; E24-K26 PolarHBondContact O-N 3.22Å; E24-K26 VanDerWaalsContact O-N 3.07Å
25	T	32.9	Very low	39.2	Very low	131 Å²	131	152.6 Å²	152.6	80%	0.804	76%	0.763	S	S	*	*			trans	-54	108.1	160.8	-25.2	0	0	0	0	107.4	K23 R27	K23-T25 PolarHBondContact O-N 3.39Å; T25-R27 VanDerWaalsContact C-N 3.35Å; T25-R27 PolarHBondContact O-N 3.39Å
26	K	30.1	Very low	41.8	Very low	207 Å²	207	146.3 Å²	146.3	90%	0.9	74%	0.735	S	S	*	*			trans	-52.9	97.8	171.1	-89.1	-177.9	172.7	176.7	0	109.1	E24	E24-K26 PolarHBondContact O-N 3.22Å; E24-K26 VanDerWaalsContact O-N 3.07Å
27	R	33.4	Very low	44.1	Very low	231 Å²	231	139 Å²	139	87%	0.872	70%	0.697	S	S	*	*			trans	-68.8	133.1	163	-83.2	-179.1	169.6	-177.1	-2.3	107.6	T25 E29	T25-R27 VanDerWaalsContact C-N 3.35Å; T25-R27 PolarHBondContact O-N 3.39Å; R27-E29 PolarHBondContact O-N 3.37Å
28	D	41.1	Very low	46.7	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	68%	0.676	S	S	*	*			trans	-58.6	92.7	177.1	-82.3	-49.1	0	0	0	111.5	K30	D28-K30 PolarHBondContact O-N 3.19Å
29	E	36.1	Very low	49	Very low	192 Å²	192	128.5 Å²	128.5	90%	0.897	65%	0.649	S	S	*	*			trans	-74.4	35.6	179.5	-98.8	-173.4	163.2	0	0	115.2	R27	R27-E29 PolarHBondContact O-N 3.37Å
30	K	44	Very low	51.5	Low	153 Å²	153	126.6 Å²	126.6	67%	0.665	63%	0.63	S	S	*	*			trans	-141.5	46.9	179.4	-77.9	-164.8	174.7	-162.5	0	115.5	D28 K121	D28-K30 PolarHBondContact O-N 3.19Å; K30-K121 VanDerWaalsContact CD-CE 3.45Å
31	H	54	Low	53.8	Low	59 Å²	59	123.3 Å²	123.3	27%	0.273	61%	0.61	S	S	.	*			trans	-102.5	4.8	176	-71.1	-50.6	0	0	0	115.5	G33 W120	H31-G33 PolarHBondContact O-N 3.12Å; H31-W120 AromaticContact CE1-NE1 3.9Å
32	A	49.5	Very low	56	Low	113 Å²	113	117.5 Å²	117.5	93%	0.934	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	98.7	-179.4	0	0	0	0	0	111.4
33	G	63.7	Low	58.7	Low	71 Å²	71	112.1 Å²	112.1	73%	0.732	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	127.5	-3.2	167.7	0	0	0	0	0	117.3	H31 I35	H31-G33 PolarHBondContact O-N 3.12Å; G33-I35 PolarHBondContact O-N 2.82Å
34	I	66.5	Low	61.1	Low	48 Å²	48	102.7 Å²	102.7	25%	0.246	53%	0.534	C	S	.	.			trans	-84.5	110.8	179.1	-61.5	168.6	0	0	0	109.8	W120	I34-W120 HydrophobicContact CD1-CD2 3.8Å; I34-W120 HydrophobicContact CD1-CE3 3.57Å; I34-W120 HydrophobicContact CD1-CG 4.48Å; I34-W120 HydrophobicContact CD1-CH2 4.11Å; I34-W120 HydrophobicContact CD1-CZ2 4.28Å; I34-W120 HydrophobicContact CD1-CZ3 3.74Å; I34-W120 HydrophobicContact CG2-CH2 4.46Å
35	I	74.6	Confident	64	Low	52 Å²	52	94.6 Å²	94.6	27%	0.267	50%	0.496	S	S	.	.	S	Bend	trans	-81.9	-41.2	174.7	-63.3	170.1	0	0	0	110.5	G33 F49 N50 L105 I107 S110	G33-I35 PolarHBondContact O-N 2.82Å; I35-F49 CarbonylContact O-C 3.55Å; I35-F49 VanDerWaalsContact O-CA 3.32Å; I35-F49 WeakPolarHBondContact O-CA 3.39Å; I35-N50 PolarHBondContact O-N 3.3Å; I35-L105 HydrophobicContact CG2-CD1 3.82Å; I35-L105 HydrophobicContact CG2-CD2 4.14Å; I35-L105 HydrophobicContact CG2-CG 3.92Å; I35-I107 HydrophobicContact CG2-CG2 4.36Å; I35-S110 WeakPolarHBondContact CD1-OG 3.47Å
36	L	80.3	Confident	66.5	Low	63 Å²	63	90.5 Å²	90.5	33%	0.33	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	142.1	178.8	-169.4	125.4	0	0	0	109	F47 V48 F101 L105	L36-F47 HydrophobicContact CD1-CE2 3.6Å; L36-F47 HydrophobicContact CD1-CZ 3.48Å; L36-F47 VanDerWaalsContact CD1-CZ 3.48Å; L36-F47 HydrophobicContact CD2-CE2 3.99Å; L36-F47 HydrophobicContact CG-CE2 3.62Å; L36-F47 HydrophobicContact CG-CZ 4Å; L36-V48 CarbonylContact C-O 3.55Å; L36-V48 WeakPolarHBondContact CA-O 3.43Å; L36-F101 HydrophobicContact CD1-CZ 4.32Å; L36-L105 HydrophobicContact CD1-CD2 4.33Å
37	G	78.9	Confident	69.2	Low	7 Å²	7	81 Å²	81	7%	0.072	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	147.1	-174.6	0	0	0	0	0	113.1	V48	G37-V48 PolarHBondContact N-O 2.75Å; G37-V48 PolarHBondContact O-N 2.87Å
38	L	81.1	Confident	71.7	Confident	88 Å²	88	70.1 Å²	70.1	46%	0.461	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.3	177.4	-74.3	167.2	0	0	0	109.3	L45 H46 F47 L76	L38-L45 HydrophobicContact CD2-CD2 3.95Å; L38-L45 HydrophobicContact CD2-CG 4.47Å; L38-H46 CarbonylContact C-O 3.21Å; L38-H46 WeakPolarHBondContact CA-O 3.32Å; L38-F47 HydrophobicContact CD2-CB 4.16Å; L38-F47 HydrophobicContact CD2-CD2 3.66Å; L38-F47 HydrophobicContact CD2-CG 4.4Å; L38-F47 HydrophobicContact CG-CD2 4.26Å; L38-L76 HydrophobicContact CD2-CD2 3.59Å
39	K	79.9	Confident	73.7	Confident	79 Å²	79	63.6 Å²	63.6	34%	0.343	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.5	174.4	166.7	172.6	177.2	166.3	0	109	H46 G118	K39-H46 HydrophobicContact CB-CB 4.14Å; K39-H46 PolarHBondContact N-O 2.74Å; K39-H46 PolarHBondContact O-N 3.3Å; K39-G118 VanDerWaalsContact CD-O 3.31Å; K39-G118 WeakPolarHBondContact CD-O 3.5Å; K39-G118 WeakPolarHBondContact CE-O 3.35Å; K39-G118 PolarHBondContact NZ-O 2.83Å
40	L	79.6	Confident	75.9	Confident	74 Å²	74	56.6 Å²	56.6	39%	0.387	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138.6	-179.9	-158.7	63	0	0	0	111.1	L45 I64 L66 L74	L40-L45 HydrophobicContact CD1-CB 3.92Å; L40-L45 HydrophobicContact CD1-CD1 3.91Å; L40-L45 HydrophobicContact CD1-CG 4.09Å; L40-I64 HydrophobicContact CD1-CD1 3.91Å; L40-L66 HydrophobicContact CD1-CD1 3.7Å; L40-L66 HydrophobicContact CD2-CD1 3.49Å; L40-L66 VanDerWaalsContact CD2-CD1 3.49Å; L40-L66 HydrophobicContact CG-CD1 3.48Å; L40-L66 VanDerWaalsContact CG-CD1 3.48Å; L40-L74 HydrophobicContact CD1-CD2 3.64Å; L40-L74 HydrophobicContact CD2-CD2 4.27Å
41	S	78.4	Confident	77.3	Confident	48 Å²	48	49.6 Å²	49.6	34%	0.336	29%	0.291	S	S	.	.			trans	-132	170.8	168.5	91.9	0	0	0	0	109.4	N43 S44 L66	S41-N43 PolarHBondContact O-N 2.86Å; S41-N43 VanDerWaalsContact O-N 3.13Å; S41-N43 PolarHBondContact OG-N 3.12Å; S41-S44 PolarHBondContact N-O 3.45Å; S41-S44 PolarHBondContact OG-N 2.71Å; S41-S44 PolarHBondContact OG-O 2.98Å; S41-S44 PolarHBondContact OG-OG 2.74Å; S41-L66 WeakPolarHBondContact O-CD1 3.35Å
42	Q	79.6	Confident	78.1	Confident	130 Å²	130	52.3 Å²	52.3	61%	0.607	30%	0.304	S	S	*	.	S	Bend	trans	-56.7	-31.5	-178.7	-163.4	179.8	-7.2	0	0	113.3	L66	Q42-L66 WeakPolarHBondContact CG-O 3.14Å; Q42-L66 PolarHBondContact O-N 2.88Å; Q42-L66 VanDerWaalsContact O-N 3.11Å
43	N	85.2	Confident	79	Confident	84 Å²	84	58.1 Å²	58.1	45%	0.449	30%	0.302	S	S	.	.	S	Bend	trans	-124.6	3.2	-174.7	-160.7	55.8	0	0	0	114.5	S41 G63 I64	S41-N43 PolarHBondContact O-N 2.86Å; S41-N43 VanDerWaalsContact O-N 3.13Å; S41-N43 PolarHBondContact OG-N 3.12Å; N43-G63 PolarHBondContact O-N 2.69Å; N43-I64 VanDerWaalsContact CA-O 3.25Å; N43-I64 WeakPolarHBondContact CA-O 3.43Å; N43-I64 PolarHBondContact OD1-O 3.31Å
44	S	85.9	Confident	79.1	Confident	9 Å²	9	63.4 Å²	63.4	6%	0.063	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	146.5	-179.3	71.6	0	0	0	0	114	S41 H46 F61 I64	S41-S44 PolarHBondContact N-O 3.45Å; S41-S44 PolarHBondContact OG-N 2.71Å; S41-S44 PolarHBondContact OG-O 2.98Å; S41-S44 PolarHBondContact OG-OG 2.74Å; S44-H46 PolarHBondContact OG-CD2 2.86Å; S44-H46 PolarHBondContact OG-NE2 3.29Å; S44-F61 CarbonylContact C-O 3.59Å; S44-F61 WeakPolarHBondContact CA-O 3.34Å; S44-F61 WeakPolarHBondContact CB-O 3.31Å; S44-I64 VanDerWaalsContact N-CG1 3.35Å
45	L	88.3	Confident	79.4	Confident	9 Å²	9	63.3 Å²	63.3	5%	0.047	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.1	165.2	-177.7	152.6	0	0	0	108.3	L38 L40 F47 S60 F61 I64 L74 L76 L85	L38-L45 HydrophobicContact CD2-CD2 3.95Å; L38-L45 HydrophobicContact CD2-CG 4.47Å; L40-L45 HydrophobicContact CD1-CB 3.92Å; L40-L45 HydrophobicContact CD1-CD1 3.91Å; L40-L45 HydrophobicContact CD1-CG 4.09Å; L45-F47 HydrophobicContact CD2-CB 4.38Å; L45-S60 WeakPolarHBondContact O-CA 3.22Å; L45-F61 HydrophobicContact CB-CB 4.43Å; L45-F61 HydrophobicContact CD2-CD2 3.85Å; L45-F61 HydrophobicContact CD2-CE2 4.31Å; L45-F61 PolarHBondContact N-O 3.27Å; L45-F61 PolarHBondContact O-N 2.94Å; L45-I64 HydrophobicContact CB-CD1 4.04Å; L45-L74 HydrophobicContact CD1-CD2 3.86Å; L45-L76 HydrophobicContact CD2-CD2 4.25Å; L45-L85 HydrophobicContact CB-CD2 3.95Å; L45-L85 HydrophobicContact CD1-CD1 3.93Å; L45-L85 HydrophobicContact CD1-CD2 4.17Å; L45-L85 HydrophobicContact CG-CD2 4.48Å
46	H	86.5	Confident	79.7	Confident	46 Å²	46	63.5 Å²	63.5	21%	0.213	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.2	173.9	-57.5	-88.4	0	0	0	109.6	L38 K39 S44 W59 S60	L38-H46 CarbonylContact C-O 3.21Å; L38-H46 WeakPolarHBondContact CA-O 3.32Å; K39-H46 HydrophobicContact CB-CB 4.14Å; K39-H46 PolarHBondContact N-O 2.74Å; K39-H46 PolarHBondContact O-N 3.3Å; S44-H46 PolarHBondContact OG-CD2 2.86Å; S44-H46 PolarHBondContact OG-NE2 3.29Å; H46-W59 CarbonylContact C-O 3.56Å; H46-W59 VanDerWaalsContact CA-O 3.31Å; H46-W59 WeakPolarHBondContact CA-O 3.49Å; H46-S60 PolarHBondContact ND1-OG 3.44Å
47	F	87	Confident	79.8	Confident	7 Å²	7	61.7 Å²	61.7	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.4	171.2	177.9	-115.4	0	0	0	108.9	L36 L38 L45 F49 H58 W59 L76 V78 F101	L36-F47 HydrophobicContact CD1-CE2 3.6Å; L36-F47 HydrophobicContact CD1-CZ 3.48Å; L36-F47 VanDerWaalsContact CD1-CZ 3.48Å; L36-F47 HydrophobicContact CD2-CE2 3.99Å; L36-F47 HydrophobicContact CG-CE2 3.62Å; L36-F47 HydrophobicContact CG-CZ 4Å; L38-F47 HydrophobicContact CD2-CB 4.16Å; L38-F47 HydrophobicContact CD2-CD2 3.66Å; L38-F47 HydrophobicContact CD2-CG 4.4Å; L38-F47 HydrophobicContact CG-CD2 4.26Å; L45-F47 HydrophobicContact CD2-CB 4.38Å; F47-F49 AromaticContact CD1-CD1 3.7Å; F47-F49 HydrophobicContact CD1-CD1 3.7Å; F47-F49 HydrophobicContact CD1-CE1 4.2Å; F47-F49 HydrophobicContact CE1-CB 4.26Å; F47-F49 AromaticContact CE1-CD1 3.53Å; F47-F49 HydrophobicContact CE1-CD1 3.53Å; F47-F49 HydrophobicContact CE1-CE1 4.2Å; F47-F49 HydrophobicContact CE1-CG 4.12Å; F47-F49 HydrophobicContact CZ-CB 4.37Å; F47-F49 HydrophobicContact CZ-CD1 4.43Å; F47-H58 CarbonylContact O-C 3.6Å; F47-H58 WeakPolarHBondContact O-CA 3.47Å; F47-W59 HydrophobicContact CB-CB 4.3Å; F47-W59 HydrophobicContact CD1-CB 4.45Å; F47-W59 HydrophobicContact CD1-CD2 4.27Å; F47-W59 AromaticContact CD1-CE3 3.76Å; F47-W59 HydrophobicContact CD1-CE3 3.76Å; F47-W59 HydrophobicContact CD1-CZ3 4.44Å; F47-W59 HydrophobicContact CE1-CE3 4.19Å; F47-W59 HydrophobicContact CE1-CZ3 4.44Å; F47-W59 PolarHBondContact N-O 3.37Å; F47-W59 PolarHBondContact O-N 3.29Å; F47-L76 HydrophobicContact CB-CD2 4.04Å; F47-L76 HydrophobicContact CD2-CD2 3.71Å; F47-L76 HydrophobicContact CE2-CD2 4.27Å; F47-L76 HydrophobicContact CG-CD2 3.92Å; F47-V78 HydrophobicContact CD1-CG2 4.25Å; F47-V78 HydrophobicContact CE1-CG1 4.19Å; F47-V78 HydrophobicContact CE1-CG2 3.82Å; F47-V78 HydrophobicContact CZ-CG2 3.97Å; F47-F101 HydrophobicContact CE1-CD2 4.11Å; F47-F101 AromaticContact CE1-CE2 3.64Å; F47-F101 HydrophobicContact CE1-CE2 3.64Å; F47-F101 AromaticContact CZ-CE2 3.79Å; F47-F101 HydrophobicContact CZ-CE2 3.79Å; F47-F101 HydrophobicContact CZ-CZ 4.33Å
48	V	85.3	Confident	80.1	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.1	-175	-174.1	0	0	0	0	108.1	L36 G37 T56 E57 H58 W120	L36-V48 CarbonylContact C-O 3.55Å; L36-V48 WeakPolarHBondContact CA-O 3.43Å; G37-V48 PolarHBondContact N-O 2.75Å; G37-V48 PolarHBondContact O-N 2.87Å; V48-T56 HydrophobicContact CG1-CG2 3.38Å; V48-E57 WeakPolarHBondContact CA-O 3.2Å; V48-H58 VanDerWaalsContact CG2-ND1 3.33Å; V48-H58 WeakPolarHBondContact CG2-ND1 3.2Å; V48-W120 HydrophobicContact CB-CZ2 4.45Å; V48-W120 HydrophobicContact CG2-CZ2 4.03Å
49	F	82.9	Confident	80.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	163	179.7	63.4	-83.2	0	0	0	111.5	I35 F47 E57 W59 F101 P102	I35-F49 CarbonylContact O-C 3.55Å; I35-F49 VanDerWaalsContact O-CA 3.32Å; I35-F49 WeakPolarHBondContact O-CA 3.39Å; F47-F49 AromaticContact CD1-CD1 3.7Å; F47-F49 HydrophobicContact CD1-CD1 3.7Å; F47-F49 HydrophobicContact CD1-CE1 4.2Å; F47-F49 HydrophobicContact CE1-CB 4.26Å; F47-F49 AromaticContact CE1-CD1 3.53Å; F47-F49 HydrophobicContact CE1-CD1 3.53Å; F47-F49 HydrophobicContact CE1-CE1 4.2Å; F47-F49 HydrophobicContact CE1-CG 4.12Å; F47-F49 HydrophobicContact CZ-CB 4.37Å; F47-F49 HydrophobicContact CZ-CD1 4.43Å; F49-E57 HydrophobicContact CD1-CB 4.33Å; F49-E57 HydrophobicContact CD2-CB 4.29Å; F49-E57 HydrophobicContact CE1-CB 3.78Å; F49-E57 HydrophobicContact CE2-CB 3.73Å; F49-E57 HydrophobicContact CE2-CG 4.23Å; F49-E57 HydrophobicContact CZ-CB 3.45Å; F49-E57 VanDerWaalsContact CZ-CB 3.45Å; F49-E57 HydrophobicContact CZ-CG 4.25Å; F49-E57 WeakPolarHBondContact CZ-OE2 3.48Å; F49-E57 PolarHBondContact N-O 3.49Å; F49-E57 PolarHBondContact O-N 3.39Å; F49-W59 AromaticContact CE1-CD1 3.79Å; F49-W59 AromaticContact CE1-CD2 3.71Å; F49-W59 HydrophobicContact CE1-CD2 3.71Å; F49-W59 AromaticContact CE1-CE2 3.49Å; F49-W59 VanDerWaalsContact CE1-CE2 3.49Å; F49-W59 HydrophobicContact CE1-CE3 4.37Å; F49-W59 AromaticContact CE1-CG 3.93Å; F49-W59 HydrophobicContact CE1-CG 3.93Å; F49-W59 HydrophobicContact CE1-CZ2 4.02Å; F49-W59 AromaticContact CE1-NE1 3.51Å; F49-W59 HydrophobicContact CZ-CD2 4.32Å; F49-W59 AromaticContact CZ-CE2 3.62Å; F49-W59 AromaticContact CZ-CZ2 3.81Å; F49-W59 HydrophobicContact CZ-CZ2 3.81Å; F49-W59 AromaticContact CZ-NE1 3.57Å; F49-F101 HydrophobicContact CB-CE2 4.06Å; F49-F101 HydrophobicContact CD1-CD2 4.43Å; F49-F101 HydrophobicContact CD1-CE2 4.25Å; F49-F101 HydrophobicContact CD2-CD2 4.03Å; F49-F101 AromaticContact CD2-CE2 3.88Å; F49-F101 HydrophobicContact CD2-CE2 3.88Å; F49-F101 HydrophobicContact CE1-CD2 4.48Å; F49-F101 HydrophobicContact CE2-CD2 4.08Å; F49-F101 HydrophobicContact CE2-CE2 4.4Å; F49-F101 HydrophobicContact CG-CD2 4.21Å; F49-F101 AromaticContact CG-CE2 3.8Å; F49-F101 HydrophobicContact CG-CE2 3.8Å; F49-F101 HydrophobicContact CZ-CD2 4.31Å; F49-P102 HydrophobicContact CD2-CG 4.1Å; F49-P102 HydrophobicContact CE2-CG 4.3Å
50	N	82.4	Confident	80.8	Confident	45 Å²	45	60.9 Å²	60.9	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.3	175.4	-162.6	23.3	0	0	0	110.5	I35 K54 L105	I35-N50 PolarHBondContact O-N 3.3Å; N50-K54 WeakPolarHBondContact OD1-CA 3.23Å; N50-K54 PolarHBondContact OD1-O 3.26Å; N50-L105 HydrophobicContact CB-CD1 4.1Å; N50-L105 WeakPolarHBondContact O-CD1 3.49Å
51	G	74.5	Confident	81.2	Confident	6 Å²	6	57.8 Å²	57.8	6%	0.062	29%	0.286	C	S	.	.			trans	-82	178.1	-178.9	0	0	0	0	0	114.1	R53 K54 A55	G51-R53 PolarHBondContact O-N 2.82Å; G51-K54 PolarHBondContact O-N 3.11Å; G51-A55 PolarHBondContact N-O 2.02Å
52	H	69.2	Low	81.6	Confident	117 Å²	117	60.7 Å²	60.7	54%	0.542	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-10.1	-174.8	-69.2	-70	0	0	0	116.9	P102 D104	H52-P102 VanDerWaalsContact CE1-CA 3.49Å; H52-P102 WeakPolarHBondContact CE1-CA 3.44Å; H52-D104 IonicContact CE1-OD1 3.84Å; H52-D104 IonicContact ND1-OD1 3.65Å
53	R	68.1	Low	81.7	Confident	235 Å²	235	56.8 Å²	56.8	89%	0.887	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	24.9	178.1	-65.3	-171.9	179.6	-175.1	-0.2	114	G51 A55	G51-R53 PolarHBondContact O-N 2.82Å; R53-A55 PolarHBondContact O-N 3.34Å; R53-A55 VanDerWaalsContact O-N 3.11Å
54	K	66	Low	81.7	Confident	181 Å²	181	53 Å²	53	79%	0.787	27%	0.268	S	S	*	.	S	Bend	trans	57	19.8	-169.5	-59.9	-177.9	179	178.1	0	113.7	N50 G51	N50-K54 WeakPolarHBondContact OD1-CA 3.23Å; N50-K54 PolarHBondContact OD1-O 3.26Å; G51-K54 PolarHBondContact O-N 3.11Å
55	A	74.5	Confident	81.5	Confident	47 Å²	47	62.6 Å²	62.6	39%	0.388	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-87.8	131.2	175.1	0	0	0	0	0	108.4	G51 R53 E57	G51-A55 PolarHBondContact N-O 2.02Å; R53-A55 PolarHBondContact O-N 3.34Å; R53-A55 VanDerWaalsContact O-N 3.11Å; A55-E57 PolarHBondContact O-N 3.13Å
56	T	79	Confident	81.3	Confident	55 Å²	55	63 Å²	63	34%	0.337	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	119.3	173.5	-49.9	0	0	0	0	109.4	V48 H58	V48-T56 HydrophobicContact CG1-CG2 3.38Å; T56-H58 WeakPolarHBondContact CG2-NE2 3.39Å
57	E	83.3	Confident	81.1	Confident	26 Å²	26	63.9 Å²	63.9	12%	0.121	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	150.3	173.9	-64.7	-153.2	174.1	0	0	110.7	V48 F49 A55 R99	V48-E57 WeakPolarHBondContact CA-O 3.2Å; F49-E57 HydrophobicContact CD1-CB 4.33Å; F49-E57 HydrophobicContact CD2-CB 4.29Å; F49-E57 HydrophobicContact CE1-CB 3.78Å; F49-E57 HydrophobicContact CE2-CB 3.73Å; F49-E57 HydrophobicContact CE2-CG 4.23Å; F49-E57 HydrophobicContact CZ-CB 3.45Å; F49-E57 VanDerWaalsContact CZ-CB 3.45Å; F49-E57 HydrophobicContact CZ-CG 4.25Å; F49-E57 WeakPolarHBondContact CZ-OE2 3.48Å; F49-E57 PolarHBondContact N-O 3.49Å; F49-E57 PolarHBondContact O-N 3.39Å; A55-E57 PolarHBondContact O-N 3.13Å; E57-R99 WeakPolarHBondContact OE1-CD 3.35Å; E57-R99 IonicContact OE1-CZ 3.91Å; E57-R99 IonicContact OE1-NE 3.77Å; E57-R99 IonicContact OE1-NH1 2.71Å; E57-R99 PolarHBondContact OE1-NH1 3.13Å
58	H	85	Confident	80.4	Confident	100 Å²	100	67.4 Å²	67.4	46%	0.463	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	120.8	-175.7	-59	-91.9	0	0	0	110.3	F47 V48 T56	F47-H58 CarbonylContact O-C 3.6Å; F47-H58 WeakPolarHBondContact O-CA 3.47Å; V48-H58 VanDerWaalsContact CG2-ND1 3.33Å; V48-H58 WeakPolarHBondContact CG2-ND1 3.2Å; T56-H58 WeakPolarHBondContact CG2-NE2 3.39Å
59	W	87.7	Confident	79.7	Confident	7 Å²	7	70.4 Å²	70.4	3%	0.027	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.3	170.9	-68.7	-3.4	0	0	0	109.7	H46 F47 F49 V78 R83 P97 F101	H46-W59 CarbonylContact C-O 3.56Å; H46-W59 VanDerWaalsContact CA-O 3.31Å; H46-W59 WeakPolarHBondContact CA-O 3.49Å; F47-W59 HydrophobicContact CB-CB 4.3Å; F47-W59 HydrophobicContact CD1-CB 4.45Å; F47-W59 HydrophobicContact CD1-CD2 4.27Å; F47-W59 AromaticContact CD1-CE3 3.76Å; F47-W59 HydrophobicContact CD1-CE3 3.76Å; F47-W59 HydrophobicContact CD1-CZ3 4.44Å; F47-W59 HydrophobicContact CE1-CE3 4.19Å; F47-W59 HydrophobicContact CE1-CZ3 4.44Å; F47-W59 PolarHBondContact N-O 3.37Å; F47-W59 PolarHBondContact O-N 3.29Å; F49-W59 AromaticContact CE1-CD1 3.79Å; F49-W59 AromaticContact CE1-CD2 3.71Å; F49-W59 HydrophobicContact CE1-CD2 3.71Å; F49-W59 AromaticContact CE1-CE2 3.49Å; F49-W59 VanDerWaalsContact CE1-CE2 3.49Å; F49-W59 HydrophobicContact CE1-CE3 4.37Å; F49-W59 AromaticContact CE1-CG 3.93Å; F49-W59 HydrophobicContact CE1-CG 3.93Å; F49-W59 HydrophobicContact CE1-CZ2 4.02Å; F49-W59 AromaticContact CE1-NE1 3.51Å; F49-W59 HydrophobicContact CZ-CD2 4.32Å; F49-W59 AromaticContact CZ-CE2 3.62Å; F49-W59 AromaticContact CZ-CZ2 3.81Å; F49-W59 HydrophobicContact CZ-CZ2 3.81Å; F49-W59 AromaticContact CZ-NE1 3.57Å; W59-V78 HydrophobicContact CH2-CG1 4.22Å; W59-V78 HydrophobicContact CZ3-CG1 3.75Å; W59-V78 HydrophobicContact CZ3-CG2 4.27Å; W59-R83 HydrophobicContact CE3-CB 3.93Å; W59-R83 HydrophobicContact CE3-CG 4.36Å; W59-R83 VanDerWaalsContact CG-NH1 3.26Å; W59-R83 HydrophobicContact CZ3-CB 3.74Å; W59-R83 HydrophobicContact CZ3-CG 4.48Å; W59-P97 HydrophobicContact CD2-CB 4.45Å; W59-P97 HydrophobicContact CH2-CB 3.97Å; W59-P97 HydrophobicContact CH2-CG 3.83Å; W59-P97 HydrophobicContact CZ2-CB 3.47Å; W59-P97 VanDerWaalsContact CZ2-CB 3.47Å; W59-P97 HydrophobicContact CZ2-CG 3.75Å; W59-F101 HydrophobicContact CH2-CB 3.82Å; W59-F101 HydrophobicContact CH2-CD2 4.14Å; W59-F101 HydrophobicContact CH2-CG 4.42Å; W59-F101 HydrophobicContact CZ2-CB 4.4Å; W59-F101 HydrophobicContact CZ3-CD2 4.46Å
60	S	87.4	Confident	79.3	Confident	50 Å²	50	75.7 Å²	75.7	35%	0.35	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.8	-176	-50.9	0	0	0	0	110.2	L45 H46	L45-S60 WeakPolarHBondContact O-CA 3.22Å; H46-S60 PolarHBondContact ND1-OG 3.44Å
61	F	88.9	Confident	79	Confident	8 Å²	8	77.1 Å²	77.1	4%	0.035	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.4	167.2	-62.1	-96.6	0	0	0	107.6	S44 L45 L76 R83 L85 L93	S44-F61 CarbonylContact C-O 3.59Å; S44-F61 WeakPolarHBondContact CA-O 3.34Å; S44-F61 WeakPolarHBondContact CB-O 3.31Å; L45-F61 HydrophobicContact CB-CB 4.43Å; L45-F61 HydrophobicContact CD2-CD2 3.85Å; L45-F61 HydrophobicContact CD2-CE2 4.31Å; L45-F61 PolarHBondContact N-O 3.27Å; L45-F61 PolarHBondContact O-N 2.94Å; F61-L76 HydrophobicContact CD2-CD1 4.39Å; F61-L76 HydrophobicContact CE2-CD1 3.46Å; F61-L76 VanDerWaalsContact CE2-CD1 3.46Å; F61-L76 HydrophobicContact CZ-CD1 3.61Å; F61-R83 HydrophobicContact CE1-CG 4.13Å; F61-R83 HydrophobicContact CZ-CB 3.9Å; F61-R83 HydrophobicContact CZ-CG 3.74Å; F61-L85 HydrophobicContact CB-CD2 3.48Å; F61-L85 VanDerWaalsContact CB-CD2 3.48Å; F61-L85 HydrophobicContact CD1-CB 3.5Å; F61-L85 VanDerWaalsContact CD1-CB 3.5Å; F61-L85 HydrophobicContact CD1-CD2 3.99Å; F61-L85 HydrophobicContact CD1-CG 4.41Å; F61-L85 HydrophobicContact CD2-CB 4.4Å; F61-L85 HydrophobicContact CD2-CD2 4.1Å; F61-L85 HydrophobicContact CE1-CB 3.57Å; F61-L85 HydrophobicContact CE2-CB 4.46Å; F61-L85 HydrophobicContact CG-CB 3.93Å; F61-L85 HydrophobicContact CG-CD2 3.61Å; F61-L85 HydrophobicContact CG-CG 4.43Å; F61-L85 HydrophobicContact CZ-CB 4.06Å; F61-L93 HydrophobicContact CD1-CB 4.28Å
62	Q	87.4	Confident	79.4	Confident	110 Å²	110	78.8 Å²	78.8	51%	0.514	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	155.2	-178.3	-62.8	-64.6	-25.7	0	0	110	I64	Q62-I64 VanDerWaalsContact C-N 3.33Å
63	G	81.5	Confident	80	Confident	47 Å²	47	74.5 Å²	74.5	49%	0.485	37%	0.368	S	S	.	.			trans	79.9	13.8	176.8	0	0	0	0	0	114.2	N43	N43-G63 PolarHBondContact O-N 2.69Å
64	I	85.4	Confident	81	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	34%	0.339	C	S	.	.			trans	-66.9	144.1	166.2	64.8	169.3	0	0	0	108.8	L40 N43 S44 L45 Q62 L66 L85 V87 L93	L40-I64 HydrophobicContact CD1-CD1 3.91Å; N43-I64 VanDerWaalsContact CA-O 3.25Å; N43-I64 WeakPolarHBondContact CA-O 3.43Å; N43-I64 PolarHBondContact OD1-O 3.31Å; S44-I64 VanDerWaalsContact N-CG1 3.35Å; L45-I64 HydrophobicContact CB-CD1 4.04Å; Q62-I64 VanDerWaalsContact C-N 3.33Å; I64-L66 HydrophobicContact CD1-CD1 3.92Å; I64-L66 HydrophobicContact CD1-CG 4.03Å; I64-L66 HydrophobicContact CG1-CG 4.47Å; I64-L85 HydrophobicContact CG2-CD2 3.67Å; I64-V87 HydrophobicContact CB-CG2 4.3Å; I64-V87 HydrophobicContact CG2-CG2 3.93Å; I64-L93 HydrophobicContact CG2-CD1 3.91Å
65	R	82.1	Confident	82.1	Confident	212 Å²	212	57.6 Å²	57.6	80%	0.8	30%	0.304	S	S	*	.			trans	-115.9	88.3	179.2	-69.2	-175	178.1	-174.9	0.5	109.8
66	L	83.9	Confident	82.8	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.094	30%	0.297	C	S	.	.			trans	-90.2	112.8	173	-56.1	-178.6	0	0	0	109.1	L40 S41 Q42 I64 P68 H72 L74 V87	L40-L66 HydrophobicContact CD1-CD1 3.7Å; L40-L66 HydrophobicContact CD2-CD1 3.49Å; L40-L66 VanDerWaalsContact CD2-CD1 3.49Å; L40-L66 HydrophobicContact CG-CD1 3.48Å; L40-L66 VanDerWaalsContact CG-CD1 3.48Å; S41-L66 WeakPolarHBondContact O-CD1 3.35Å; Q42-L66 WeakPolarHBondContact CG-O 3.14Å; Q42-L66 PolarHBondContact O-N 2.88Å; Q42-L66 VanDerWaalsContact O-N 3.11Å; I64-L66 HydrophobicContact CD1-CD1 3.92Å; I64-L66 HydrophobicContact CD1-CG 4.03Å; I64-L66 HydrophobicContact CG1-CG 4.47Å; L66-P68 WeakPolarHBondContact O-CD 3.08Å; L66-H72 HydrophobicContact CD2-CB 3.92Å; L66-L74 HydrophobicContact CD2-CD1 4.27Å; L66-L74 HydrophobicContact CD2-CD2 4.37Å; L66-V87 HydrophobicContact CD2-CG1 3.94Å
67	T	81.3	Confident	83.4	Confident	64 Å²	64	56.2 Å²	56.2	39%	0.393	29%	0.289	S	S	.	.			trans	-75.7	123.1	175.3	-51.5	0	0	0	0	108.8	N69 Q70 H72	T67-N69 PolarHBondContact O-N 3.33Å; T67-Q70 HydrophobicContact CG2-CG 3.99Å; T67-Q70 PolarHBondContact O-N 3.39Å; T67-Q70 PolarHBondContact OG1-OE1 3.11Å; T67-H72 PolarHBondContact N-CE1 3.48Å; T67-H72 VanDerWaalsContact N-CE1 3.29Å; T67-H72 PolarHBondContact N-NE2 2.87Å; T67-H72 PolarHBondContact O-NE2 3.37Å
68	P	73.5	Confident	83.7	Confident	80 Å²	80	57.1 Å²	57.1	52%	0.519	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	143.5	173.7	-23.3	33.6	0	0	0	110.7	L66 Q70	L66-P68 WeakPolarHBondContact O-CD 3.08Å; P68-Q70 PolarHBondContact O-N 3.19Å
69	N	69	Low	83.7	Confident	66 Å²	66	53.8 Å²	53.8	35%	0.353	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	16.2	176.8	-57.1	-18.6	0	0	0	115.6	T67 L163 P164	T67-N69 PolarHBondContact O-N 3.33Å; N69-L163 HydrophobicContact CB-CB 3.84Å; N69-L163 WeakPolarHBondContact CB-O 3.34Å; N69-P164 PolarHBondContact ND2-O 2.77Å
70	Q	74.3	Confident	83.6	Confident	111 Å²	111	57 Å²	57	52%	0.519	31%	0.309	S	S	.	.	S	Bend	trans	-114.1	154.4	168.4	-67.6	-173.3	-26.3	0	0	110.5	T67 P68 H72	T67-Q70 HydrophobicContact CG2-CG 3.99Å; T67-Q70 PolarHBondContact O-N 3.39Å; T67-Q70 PolarHBondContact OG1-OE1 3.11Å; P68-Q70 PolarHBondContact O-N 3.19Å; Q70-H72 PolarHBondContact O-CD2 2.79Å
71	W	78	Confident	83.5	Confident	75 Å²	75	60.7 Å²	60.7	28%	0.284	32%	0.32	S	S	.	.			trans	-76	138.5	169.2	-71.1	87.4	0	0	0	109.9	L127 R129 V156 L160	W71-L127 HydrophobicContact CH2-CB 3.58Å; W71-L127 HydrophobicContact CZ2-CB 3.8Å; W71-L127 HydrophobicContact CZ2-CD1 3.95Å; W71-L127 HydrophobicContact CZ3-CB 4.42Å; W71-R129 HydrophobicContact CE3-CB 4.39Å; W71-R129 HydrophobicContact CH2-CB 3.96Å; W71-R129 HydrophobicContact CZ3-CB 3.56Å; W71-V156 HydrophobicContact CD2-CG1 4.17Å; W71-V156 HydrophobicContact CD2-CG2 3.74Å; W71-V156 VanDerWaalsContact CE2-CG1 3.45Å; W71-V156 HydrophobicContact CE3-CG2 3.95Å; W71-V156 HydrophobicContact CG-CG1 4.48Å; W71-V156 HydrophobicContact CG-CG2 4.22Å; W71-V156 HydrophobicContact CH2-CG1 4.49Å; W71-V156 HydrophobicContact CH2-CG2 4.2Å; W71-V156 HydrophobicContact CZ2-CG1 3.63Å; W71-V156 HydrophobicContact CZ2-CG2 4.04Å; W71-V156 HydrophobicContact CZ3-CG2 4.19Å; W71-L160 HydrophobicContact CZ2-CB 4.36Å; W71-L160 PolarHBondContact NE1-O 2.73Å
72	H	81.7	Confident	83.4	Confident	42 Å²	42	66.4 Å²	66.4	19%	0.194	34%	0.341	C	S	.	.			trans	-130	141.5	177.7	-70.3	-74.3	0	0	0	110.3	L66 T67 Q70 L74 D88	L66-H72 HydrophobicContact CD2-CB 3.92Å; T67-H72 PolarHBondContact N-CE1 3.48Å; T67-H72 VanDerWaalsContact N-CE1 3.29Å; T67-H72 PolarHBondContact N-NE2 2.87Å; T67-H72 PolarHBondContact O-NE2 3.37Å; Q70-H72 PolarHBondContact O-CD2 2.79Å; H72-L74 HydrophobicContact CB-CD1 3.82Å; H72-D88 VanDerWaalsContact CA-OD1 3.22Å; H72-D88 WeakPolarHBondContact CA-OD1 3.38Å; H72-D88 IonicContact CE1-OD2 2.63Å; H72-D88 IonicContact CG-OD1 3.92Å; H72-D88 IonicContact CG-OD2 2.75Å; H72-D88 IonicContact ND1-OD1 3.46Å; H72-D88 PolarHBondContact ND1-OD1 3.49Å; H72-D88 IonicContact ND1-OD2 3.83Å; H72-D88 PolarHBondContact ND1-OD2 3.33Å
73	T	83	Confident	83.6	Confident	26 Å²	26	63.2 Å²	63.2	16%	0.16	33%	0.325	C	S	.	.			trans	-104.2	121.7	171.7	-63.8	0	0	0	0	108.5	V75 V87 D88 L143	T73-V75 HydrophobicContact CG2-CG2 4.45Å; T73-V87 WeakPolarHBondContact O-CA 3.34Å; T73-D88 PolarHBondContact N-OD1 2.92Å; T73-D88 PolarHBondContact O-N 2.84Å; T73-L143 HydrophobicContact CG2-CD2 4.15Å
74	L	87.5	Confident	84.1	Confident	54 Å²	54	61.9 Å²	61.9	28%	0.283	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.7	178.1	-66.4	91.2	0	0	0	109.9	L40 L45 L66 H72 T86	L40-L74 HydrophobicContact CD1-CD2 3.64Å; L40-L74 HydrophobicContact CD2-CD2 4.27Å; L45-L74 HydrophobicContact CD1-CD2 3.86Å; L66-L74 HydrophobicContact CD2-CD1 4.27Å; L66-L74 HydrophobicContact CD2-CD2 4.37Å; H72-L74 HydrophobicContact CB-CD1 3.82Å; L74-T86 WeakPolarHBondContact CA-O 3.42Å
75	V	89.1	Confident	84.4	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	106.4	175	-161.4	0	0	0	0	109	T73 V77 L85 T86 A139 L143	T73-V75 HydrophobicContact CG2-CG2 4.45Å; V75-V77 HydrophobicContact CG1-CG2 4.3Å; V75-L85 WeakPolarHBondContact O-CA 3.49Å; V75-T86 PolarHBondContact N-O 3.33Å; V75-T86 PolarHBondContact O-N 2.99Å; V75-A139 HydrophobicContact CG1-CB 4.22Å; V75-L143 HydrophobicContact CB-CD1 4.22Å; V75-L143 HydrophobicContact CG1-CD1 3.89Å; V75-L143 HydrophobicContact CG2-CB 3.91Å; V75-L143 HydrophobicContact CG2-CD1 3.44Å; V75-L143 VanDerWaalsContact CG2-CD1 3.44Å; V75-L143 HydrophobicContact CG2-CG 4.2Å
76	L	90.5	Very high	84.8	Confident	46 Å²	46	52 Å²	52	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.9	172.9	177.3	68.4	0	0	0	109.5	L38 L45 F47 F61 V78 L85	L38-L76 HydrophobicContact CD2-CD2 3.59Å; L45-L76 HydrophobicContact CD2-CD2 4.25Å; F47-L76 HydrophobicContact CB-CD2 4.04Å; F47-L76 HydrophobicContact CD2-CD2 3.71Å; F47-L76 HydrophobicContact CE2-CD2 4.27Å; F47-L76 HydrophobicContact CG-CD2 3.92Å; F61-L76 HydrophobicContact CD2-CD1 4.39Å; F61-L76 HydrophobicContact CE2-CD1 3.46Å; F61-L76 VanDerWaalsContact CE2-CD1 3.46Å; F61-L76 HydrophobicContact CZ-CD1 3.61Å; L76-V78 HydrophobicContact CD1-CG2 4.38Å; L76-V78 HydrophobicContact CD2-CG2 4.16Å; L76-V78 HydrophobicContact CG-CG2 4.02Å; L76-L85 HydrophobicContact CB-CD1 4.28Å; L76-L85 HydrophobicContact CD1-CB 4.5Å
77	V	91	Very high	85	Confident	28 Å²	28	51.9 Å²	51.9	17%	0.17	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.7	175.1	-171.8	0	0	0	0	108.5	V75 R83 K84 D138	V75-V77 HydrophobicContact CG1-CG2 4.3Å; V77-R83 WeakPolarHBondContact O-CA 3.36Å; V77-K84 HydrophobicContact CB-CB 4.14Å; V77-K84 HydrophobicContact CG2-CD 4.37Å; V77-K84 PolarHBondContact N-O 3.3Å; V77-K84 PolarHBondContact O-N 2.96Å; V77-D138 HydrophobicContact CG1-CB 4.04Å; V77-D138 HydrophobicContact CG2-CB 4.43Å; V77-D138 WeakPolarHBondContact CG2-OD1 3.13Å
78	V	88.8	Confident	85.2	Confident	45 Å²	45	50.2 Å²	50.2	27%	0.273	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	114.7	-179.9	174.6	0	0	0	0	108.5	F47 W59 L76 F101	F47-V78 HydrophobicContact CD1-CG2 4.25Å; F47-V78 HydrophobicContact CE1-CG1 4.19Å; F47-V78 HydrophobicContact CE1-CG2 3.82Å; F47-V78 HydrophobicContact CZ-CG2 3.97Å; W59-V78 HydrophobicContact CH2-CG1 4.22Å; W59-V78 HydrophobicContact CZ3-CG1 3.75Å; W59-V78 HydrophobicContact CZ3-CG2 4.27Å; L76-V78 HydrophobicContact CD1-CG2 4.38Å; L76-V78 HydrophobicContact CD2-CG2 4.16Å; L76-V78 HydrophobicContact CG-CG2 4.02Å; V78-F101 HydrophobicContact CG1-CB 3.99Å; V78-F101 HydrophobicContact CG1-CD1 3.85Å; V78-F101 HydrophobicContact CG1-CD2 3.46Å; V78-F101 VanDerWaalsContact CG1-CD2 3.46Å; V78-F101 HydrophobicContact CG1-CE1 4.18Å; V78-F101 HydrophobicContact CG1-CE2 3.84Å; V78-F101 HydrophobicContact CG1-CG 3.47Å; V78-F101 VanDerWaalsContact CG1-CG 3.47Å; V78-F101 HydrophobicContact CG1-CZ 4.17Å
79	G	86.5	Confident	85.6	Confident	29 Å²	29	46.9 Å²	46.9	30%	0.299	24%	0.236	S	C	.	.			trans	-116.3	174.4	169.2	0	0	0	0	0	111.1	H81 R82	G79-H81 VanDerWaalsContact C-N 3.3Å; G79-H81 PolarHBondContact O-N 3.06Å; G79-R82 WeakPolarHBondContact CA-O 3.28Å; G79-R82 PolarHBondContact N-O 3.34Å
80	V	84.1	Confident	86.4	Confident	75 Å²	75	47.9 Å²	47.9	46%	0.455	24%	0.241	S	C	.	.	S	Bend	trans	-54.6	-45.1	-176.5	-175.5	0	0	0	0	111.9	A100 F101	V80-A100 HydrophobicContact CG1-CB 4.04Å; V80-A100 CarbonylContact O-C 3.6Å; V80-A100 WeakPolarHBondContact O-CA 3.44Å; V80-A100 WeakPolarHBondContact O-CB 3.31Å; V80-F101 PolarHBondContact O-N 3.28Å
81	H	85.2	Confident	87	Confident	127 Å²	127	48.2 Å²	48.2	59%	0.588	25%	0.253	S	S	*	.	S	Bend	trans	-125.3	14.9	-178.2	-58.7	-59.6	0	0	0	113.7	G79 P97	G79-H81 VanDerWaalsContact C-N 3.3Å; G79-H81 PolarHBondContact O-N 3.06Å; H81-P97 VanDerWaalsContact O-CD 3.3Å; H81-P97 WeakPolarHBondContact O-CD 3.07Å
82	R	88.1	Confident	87.5	Confident	128 Å²	128	47.2 Å²	47.2	48%	0.483	26%	0.256	S	S	.	.			trans	-140	136.7	-177.3	-171.2	177.1	-179.9	-166.2	1.7	109.6	G79 E94	G79-R82 WeakPolarHBondContact CA-O 3.28Å; G79-R82 PolarHBondContact N-O 3.34Å; R82-E94 IonicContact CZ-OE1 2.92Å; R82-E94 IonicContact CZ-OE2 2.74Å; R82-E94 VanDerWaalsContact CZ-OE2 3.26Å; R82-E94 IonicContact NE-OE1 3.83Å; R82-E94 IonicContact NE-OE2 2.78Å; R82-E94 PolarHBondContact NE-OE2 3.34Å; R82-E94 IonicContact NH2-OE1 3.96Å; R82-E94 PolarHBondContact NH2-OE1 2.77Å; R82-E94 IonicContact NH2-OE2 3.73Å; R82-E94 PolarHBondContact NH2-OE2 2.91Å
83	R	90.6	Very high	87.9	Confident	43 Å²	43	48.7 Å²	48.7	16%	0.162	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	136	167.6	68.4	-178	-178.5	-166	0.4	109.1	W59 F61 V77 S95	W59-R83 HydrophobicContact CE3-CB 3.93Å; W59-R83 HydrophobicContact CE3-CG 4.36Å; W59-R83 VanDerWaalsContact CG-NH1 3.26Å; W59-R83 HydrophobicContact CZ3-CB 3.74Å; W59-R83 HydrophobicContact CZ3-CG 4.48Å; F61-R83 HydrophobicContact CE1-CG 4.13Å; F61-R83 HydrophobicContact CZ-CB 3.9Å; F61-R83 HydrophobicContact CZ-CG 3.74Å; V77-R83 WeakPolarHBondContact O-CA 3.36Å; R83-S95 WeakPolarHBondContact CG-O 3.28Å; R83-S95 PolarHBondContact N-O 2.91Å; R83-S95 VanDerWaalsContact N-O 3.16Å; R83-S95 PolarHBondContact NE-OG 3.1Å; R83-S95 PolarHBondContact NH2-OG 2.78Å; R83-S95 PolarHBondContact O-N 3.31Å; R83-S95 VanDerWaalsContact O-N 3.09Å
84	K	92.1	Very high	88.2	Confident	19 Å²	19	51.7 Å²	51.7	8%	0.083	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.8	-174.3	170.4	-175.6	-177.5	-173.2	0	108.5	V77 P92 L93 E94 D138 S140	V77-K84 HydrophobicContact CB-CB 4.14Å; V77-K84 HydrophobicContact CG2-CD 4.37Å; V77-K84 PolarHBondContact N-O 3.3Å; V77-K84 PolarHBondContact O-N 2.96Å; K84-P92 HydrophobicContact CD-CB 4.16Å; K84-P92 VanDerWaalsContact CE-CB 3.47Å; K84-P92 HydrophobicContact CG-CB 3.72Å; K84-L93 WeakPolarHBondContact CA-O 3.48Å; K84-E94 HydrophobicContact CB-CG 3.95Å; K84-E94 HydrophobicContact CD-CG 4.33Å; K84-E94 VanDerWaalsContact CD-OE1 3.31Å; K84-E94 WeakPolarHBondContact CD-OE1 3.34Å; K84-E94 HydrophobicContact CG-CG 3.81Å; K84-D138 IonicContact NZ-OD2 3Å; K84-D138 PolarHBondContact NZ-OD2 2.85Å; K84-S140 PolarHBondContact NZ-OG 3.35Å
85	L	92.3	Very high	88	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.3	173.8	178	63.1	0	0	0	109.8	L45 F61 I64 V75 L76 V87 L93	L45-L85 HydrophobicContact CB-CD2 3.95Å; L45-L85 HydrophobicContact CD1-CD1 3.93Å; L45-L85 HydrophobicContact CD1-CD2 4.17Å; L45-L85 HydrophobicContact CG-CD2 4.48Å; F61-L85 HydrophobicContact CB-CD2 3.48Å; F61-L85 VanDerWaalsContact CB-CD2 3.48Å; F61-L85 HydrophobicContact CD1-CB 3.5Å; F61-L85 VanDerWaalsContact CD1-CB 3.5Å; F61-L85 HydrophobicContact CD1-CD2 3.99Å; F61-L85 HydrophobicContact CD1-CG 4.41Å; F61-L85 HydrophobicContact CD2-CB 4.4Å; F61-L85 HydrophobicContact CD2-CD2 4.1Å; F61-L85 HydrophobicContact CE1-CB 3.57Å; F61-L85 HydrophobicContact CE2-CB 4.46Å; F61-L85 HydrophobicContact CG-CB 3.93Å; F61-L85 HydrophobicContact CG-CD2 3.61Å; F61-L85 HydrophobicContact CG-CG 4.43Å; F61-L85 HydrophobicContact CZ-CB 4.06Å; I64-L85 HydrophobicContact CG2-CD2 3.67Å; V75-L85 WeakPolarHBondContact O-CA 3.49Å; L76-L85 HydrophobicContact CB-CD1 4.28Å; L76-L85 HydrophobicContact CD1-CB 4.5Å; L85-V87 HydrophobicContact CD1-CG2 4.4Å; L85-V87 HydrophobicContact CD2-CG2 4.26Å; L85-V87 HydrophobicContact CG-CG2 4.03Å; L85-L93 HydrophobicContact CB-CB 4.46Å; L85-L93 PolarHBondContact N-O 2.73Å; L85-L93 PolarHBondContact O-N 3.43Å
86	T	89.9	Confident	87.8	Confident	7 Å²	7	56.4 Å²	56.4	4%	0.043	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.6	171.6	-50.3	0	0	0	0	108.3	L74 V75 N90	L74-T86 WeakPolarHBondContact CA-O 3.42Å; V75-T86 PolarHBondContact N-O 3.33Å; V75-T86 PolarHBondContact O-N 2.99Å; T86-N90 WeakPolarHBondContact CG2-O 3.47Å
87	V	88.8	Confident	87.4	Confident	17 Å²	17	54.7 Å²	54.7	10%	0.103	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.8	176.7	-176.9	0	0	0	0	108.3	I64 L66 T73 L85 C89 N90	I64-V87 HydrophobicContact CB-CG2 4.3Å; I64-V87 HydrophobicContact CG2-CG2 3.93Å; L66-V87 HydrophobicContact CD2-CG1 3.94Å; T73-V87 WeakPolarHBondContact O-CA 3.34Å; L85-V87 HydrophobicContact CD1-CG2 4.4Å; L85-V87 HydrophobicContact CD2-CG2 4.26Å; L85-V87 HydrophobicContact CG-CG2 4.03Å; V87-C89 PolarHBondContact O-N 3.05Å; V87-N90 WeakPolarHBondContact O-CB 3.2Å; V87-N90 PolarHBondContact O-N 2.71Å; V87-N90 VanDerWaalsContact O-N 3.13Å; V87-N90 PolarHBondContact O-ND2 3.24Å
88	D	84.7	Confident	86.8	Confident	29 Å²	29	59.3 Å²	59.3	16%	0.155	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	44.5	-179.9	-52.7	-35.3	0	0	0	112.2	H72 T73 N90 P149	H72-D88 VanDerWaalsContact CA-OD1 3.22Å; H72-D88 WeakPolarHBondContact CA-OD1 3.38Å; H72-D88 IonicContact CE1-OD2 2.63Å; H72-D88 IonicContact CG-OD1 3.92Å; H72-D88 IonicContact CG-OD2 2.75Å; H72-D88 IonicContact ND1-OD1 3.46Å; H72-D88 PolarHBondContact ND1-OD1 3.49Å; H72-D88 IonicContact ND1-OD2 3.83Å; H72-D88 PolarHBondContact ND1-OD2 3.33Å; T73-D88 PolarHBondContact N-OD1 2.92Å; T73-D88 PolarHBondContact O-N 2.84Å; D88-N90 PolarHBondContact O-N 2.86Å; D88-N90 PolarHBondContact O-ND2 3.27Å; D88-P149 HydrophobicContact CB-CB 4.11Å; D88-P149 WeakPolarHBondContact O-CB 3.35Å
89	C	82.4	Confident	86.5	Confident	10 Å²	10	64.6 Å²	64.6	7%	0.068	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	16.4	178	-55.1	0	0	0	0	116.6	V87 C144 A152	V87-C89 PolarHBondContact O-N 3.05Å; C89-C144 WeakPolarHBondContact CA-SG 3.3Å; C89-C144 HydrophobicContact CB-CB 3.44Å; C89-C144 VanDerWaalsContact CB-CB 3.44Å; C89-C144 WeakPolarHBondContact CB-SG 3.15Å; C89-C144 WeakPolarHBondContact SG-CA 3.25Å; C89-C144 WeakPolarHBondContact SG-CB 3.12Å; C89-C144 CovalentContact SG-SG 2.03Å; C89-C144 PolarHBondContact SG-SG 3.11Å; C89-A152 WeakPolarHBondContact SG-CB 3.44Å
90	N	85.4	Confident	86.4	Confident	86 Å²	86	64.5 Å²	64.5	46%	0.46	35%	0.347	S	S	.	.	S	Bend	trans	-72.3	164.6	170.8	-69.2	-66.8	0	0	0	111.3	T86 V87 D88	T86-N90 WeakPolarHBondContact CG2-O 3.47Å; V87-N90 WeakPolarHBondContact O-CB 3.2Å; V87-N90 PolarHBondContact O-N 2.71Å; V87-N90 VanDerWaalsContact O-N 3.13Å; V87-N90 PolarHBondContact O-ND2 3.24Å; D88-N90 PolarHBondContact O-N 2.86Å; D88-N90 PolarHBondContact O-ND2 3.27Å
91	P	86.6	Confident	86.5	Confident	118 Å²	118	62.7 Å²	62.7	77%	0.766	33%	0.333	S	S	*	.	S	Bend	trans	-48.4	131.7	173.5	-29.4	36.2	0	0	0	112.3
92	P	88.6	Confident	86.4	Confident	54 Å²	54	56.9 Å²	56.9	35%	0.351	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-71.7	145.3	-169.9	27.3	-35.2	0	0	0	113.2	K84 E94	K84-P92 HydrophobicContact CD-CB 4.16Å; K84-P92 VanDerWaalsContact CE-CB 3.47Å; K84-P92 HydrophobicContact CG-CB 3.72Å; P92-E94 HydrophobicContact CB-CG 4.15Å; P92-E94 HydrophobicContact CG-CG 4.25Å; P92-E94 PolarHBondContact O-N 3.12Å
93	L	89.9	Confident	85.9	Confident	73 Å²	73	56.1 Å²	56.1	38%	0.382	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	103.6	166.2	-63.4	174.4	0	0	0	109.1	F61 I64 K84 L85	F61-L93 HydrophobicContact CD1-CB 4.28Å; I64-L93 HydrophobicContact CG2-CD1 3.91Å; K84-L93 WeakPolarHBondContact CA-O 3.48Å; L85-L93 HydrophobicContact CB-CB 4.46Å; L85-L93 PolarHBondContact N-O 2.73Å; L85-L93 PolarHBondContact O-N 3.43Å
94	E	89.8	Confident	85.3	Confident	89 Å²	89	59.5 Å²	59.5	42%	0.416	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.1	179.6	-64.8	-162.8	-172.4	0	0	112.4	R82 K84 P92	R82-E94 IonicContact CZ-OE1 2.92Å; R82-E94 IonicContact CZ-OE2 2.74Å; R82-E94 VanDerWaalsContact CZ-OE2 3.26Å; R82-E94 IonicContact NE-OE1 3.83Å; R82-E94 IonicContact NE-OE2 2.78Å; R82-E94 PolarHBondContact NE-OE2 3.34Å; R82-E94 IonicContact NH2-OE1 3.96Å; R82-E94 PolarHBondContact NH2-OE1 2.77Å; R82-E94 IonicContact NH2-OE2 3.73Å; R82-E94 PolarHBondContact NH2-OE2 2.91Å; K84-E94 HydrophobicContact CB-CG 3.95Å; K84-E94 HydrophobicContact CD-CG 4.33Å; K84-E94 VanDerWaalsContact CD-OE1 3.31Å; K84-E94 WeakPolarHBondContact CD-OE1 3.34Å; K84-E94 HydrophobicContact CG-CG 3.81Å; P92-E94 HydrophobicContact CB-CG 4.15Å; P92-E94 HydrophobicContact CG-CG 4.25Å; P92-E94 PolarHBondContact O-N 3.12Å
95	S	83.9	Confident	84.6	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	155.9	170.1	50.2	0	0	0	0	111.7	R83	R83-S95 WeakPolarHBondContact CG-O 3.28Å; R83-S95 PolarHBondContact N-O 2.91Å; R83-S95 VanDerWaalsContact N-O 3.16Å; R83-S95 PolarHBondContact NE-OG 3.1Å; R83-S95 PolarHBondContact NH2-OG 2.78Å; R83-S95 PolarHBondContact O-N 3.31Å; R83-S95 VanDerWaalsContact O-N 3.09Å
96	V	84.6	Confident	83.6	Confident	118 Å²	118	65.4 Å²	65.4	72%	0.715	38%	0.375	S	S	*	.			trans	-87.9	121.5	170.3	-179.4	0	0	0	0	107.6
97	P	82.6	Confident	82.7	Confident	10 Å²	10	69.6 Å²	69.6	7%	0.065	40%	0.396	C	S	.	.			trans	-71.9	146.2	178.5	31.9	-33.4	0	0	0	110.2	W59 H81 R99	W59-P97 HydrophobicContact CD2-CB 4.45Å; W59-P97 HydrophobicContact CH2-CB 3.97Å; W59-P97 HydrophobicContact CH2-CG 3.83Å; W59-P97 HydrophobicContact CZ2-CB 3.47Å; W59-P97 VanDerWaalsContact CZ2-CB 3.47Å; W59-P97 HydrophobicContact CZ2-CG 3.75Å; H81-P97 VanDerWaalsContact O-CD 3.3Å; H81-P97 WeakPolarHBondContact O-CD 3.07Å; P97-R99 WeakPolarHBondContact CB-O 3.3Å; P97-R99 WeakPolarHBondContact CG-O 3.48Å; P97-R99 PolarHBondContact O-N 2.76Å
98	S	78.4	Confident	81.7	Confident	125 Å²	125	76.5 Å²	76.5	87%	0.874	43%	0.427	S	S	*	.	S	Bend	trans	-65	-18.8	177.3	54.9	0	0	0	0	113.6
99	R	81.8	Confident	80.5	Confident	155 Å²	155	80 Å²	80	59%	0.585	46%	0.46	S	S	*	.	S	Bend	trans	-134.7	143.5	175.8	-68.8	-177	179.3	-173	0.4	109.2	E57 P97	E57-R99 WeakPolarHBondContact OE1-CD 3.35Å; E57-R99 IonicContact OE1-CZ 3.91Å; E57-R99 IonicContact OE1-NE 3.77Å; E57-R99 IonicContact OE1-NH1 2.71Å; E57-R99 PolarHBondContact OE1-NH1 3.13Å; P97-R99 WeakPolarHBondContact CB-O 3.3Å; P97-R99 WeakPolarHBondContact CG-O 3.48Å; P97-R99 PolarHBondContact O-N 2.76Å
100	A	83.7	Confident	79.8	Confident	28 Å²	28	81.7 Å²	81.7	23%	0.231	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-68.3	147.5	-179.6	0	0	0	0	0	111.6	V80	V80-A100 HydrophobicContact CG1-CB 4.04Å; V80-A100 CarbonylContact O-C 3.6Å; V80-A100 WeakPolarHBondContact O-CA 3.44Å; V80-A100 WeakPolarHBondContact O-CB 3.31Å
101	F	86.5	Confident	78.7	Confident	37 Å²	37	89 Å²	89	16%	0.162	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-68.7	134.1	168.4	-169.6	-105	0	0	0	109.6	L36 F47 F49 W59 V78 V80 S103 L105	L36-F101 HydrophobicContact CD1-CZ 4.32Å; F47-F101 HydrophobicContact CE1-CD2 4.11Å; F47-F101 AromaticContact CE1-CE2 3.64Å; F47-F101 HydrophobicContact CE1-CE2 3.64Å; F47-F101 AromaticContact CZ-CE2 3.79Å; F47-F101 HydrophobicContact CZ-CE2 3.79Å; F47-F101 HydrophobicContact CZ-CZ 4.33Å; F49-F101 HydrophobicContact CB-CE2 4.06Å; F49-F101 HydrophobicContact CD1-CD2 4.43Å; F49-F101 HydrophobicContact CD1-CE2 4.25Å; F49-F101 HydrophobicContact CD2-CD2 4.03Å; F49-F101 AromaticContact CD2-CE2 3.88Å; F49-F101 HydrophobicContact CD2-CE2 3.88Å; F49-F101 HydrophobicContact CE1-CD2 4.48Å; F49-F101 HydrophobicContact CE2-CD2 4.08Å; F49-F101 HydrophobicContact CE2-CE2 4.4Å; F49-F101 HydrophobicContact CG-CD2 4.21Å; F49-F101 AromaticContact CG-CE2 3.8Å; F49-F101 HydrophobicContact CG-CE2 3.8Å; F49-F101 HydrophobicContact CZ-CD2 4.31Å; W59-F101 HydrophobicContact CH2-CB 3.82Å; W59-F101 HydrophobicContact CH2-CD2 4.14Å; W59-F101 HydrophobicContact CH2-CG 4.42Å; W59-F101 HydrophobicContact CZ2-CB 4.4Å; W59-F101 HydrophobicContact CZ3-CD2 4.46Å; V78-F101 HydrophobicContact CG1-CB 3.99Å; V78-F101 HydrophobicContact CG1-CD1 3.85Å; V78-F101 HydrophobicContact CG1-CD2 3.46Å; V78-F101 VanDerWaalsContact CG1-CD2 3.46Å; V78-F101 HydrophobicContact CG1-CE1 4.18Å; V78-F101 HydrophobicContact CG1-CE2 3.84Å; V78-F101 HydrophobicContact CG1-CG 3.47Å; V78-F101 VanDerWaalsContact CG1-CG 3.47Å; V78-F101 HydrophobicContact CG1-CZ 4.17Å; V80-F101 PolarHBondContact O-N 3.28Å; F101-S103 PolarHBondContact O-N 3.35Å; F101-L105 HydrophobicContact CE1-CD2 4.42Å; F101-L105 HydrophobicContact CZ-CD2 3.77Å
102	P	84.3	Confident	77.8	Confident	4 Å²	4	90 Å²	90	3%	0.026	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-65	126.5	-178	24.1	-33.1	0	0	0	111.9	F49 H52 D104 L105	F49-P102 HydrophobicContact CD2-CG 4.1Å; F49-P102 HydrophobicContact CE2-CG 4.3Å; H52-P102 VanDerWaalsContact CE1-CA 3.49Å; H52-P102 WeakPolarHBondContact CE1-CA 3.44Å; P102-D104 VanDerWaalsContact C-N 3.28Å; P102-L105 HydrophobicContact CG-CB 4.25Å; P102-L105 HydrophobicContact CG-CD1 4.34Å
103	S	77.7	Confident	76.8	Confident	112 Å²	112	92 Å²	92	78%	0.783	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-14.1	177	54.5	0	0	0	0	113.6	F101	F101-S103 PolarHBondContact O-N 3.35Å
104	D	77	Confident	75.6	Confident	114 Å²	114	91.6 Å²	91.6	61%	0.61	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	16.4	-174.4	63	-36	0	0	0	113.2	H52 P102 N106	H52-D104 IonicContact CE1-OD1 3.84Å; H52-D104 IonicContact ND1-OD1 3.65Å; P102-D104 VanDerWaalsContact C-N 3.28Å; D104-N106 PolarHBondContact O-N 2.86Å
105	L	77.1	Confident	74.3	Confident	37 Å²	37	88.4 Å²	88.4	19%	0.194	48%	0.478	C	S	.	.			trans	-66.7	105.2	-179.2	-167.7	71.1	0	0	0	111	I35 L36 N50 F101 P102 I107	I35-L105 HydrophobicContact CG2-CD1 3.82Å; I35-L105 HydrophobicContact CG2-CD2 4.14Å; I35-L105 HydrophobicContact CG2-CG 3.92Å; L36-L105 HydrophobicContact CD1-CD2 4.33Å; N50-L105 HydrophobicContact CB-CD1 4.1Å; N50-L105 WeakPolarHBondContact O-CD1 3.49Å; F101-L105 HydrophobicContact CE1-CD2 4.42Å; F101-L105 HydrophobicContact CZ-CD2 3.77Å; P102-L105 HydrophobicContact CG-CB 4.25Å; P102-L105 HydrophobicContact CG-CD1 4.34Å; L105-I107 HydrophobicContact CD2-CG2 4.34Å; L105-I107 HydrophobicContact CG-CG2 4.38Å; L105-I107 PolarHBondContact O-N 2.92Å
106	N	71.9	Confident	73.4	Confident	108 Å²	108	87.5 Å²	87.5	58%	0.578	47%	0.472	S	S	*	.			trans	-75.7	113	175.8	-173	-6.8	0	0	0	110.9	D104 Q108	D104-N106 PolarHBondContact O-N 2.86Å; N106-Q108 WeakPolarHBondContact OD1-CB 3.24Å; N106-Q108 PolarHBondContact OD1-N 2.77Å
107	I	71.8	Confident	72.3	Confident	94 Å²	94	92.1 Å²	92.1	48%	0.482	48%	0.477	S	S	.	.			trans	-102.3	3.8	177.4	60.3	170.4	0	0	0	113.5	I35 L105 A109 S110	I35-I107 HydrophobicContact CG2-CG2 4.36Å; L105-I107 HydrophobicContact CD2-CG2 4.34Å; L105-I107 HydrophobicContact CG-CG2 4.38Å; L105-I107 PolarHBondContact O-N 2.92Å; I107-A109 PolarHBondContact O-N 2.9Å; I107-S110 VanDerWaalsContact C-OG 3.26Å; I107-S110 WeakPolarHBondContact CA-OG 3.45Å; I107-S110 WeakPolarHBondContact O-CB 3.26Å; I107-S110 PolarHBondContact O-N 3.38Å; I107-S110 VanDerWaalsContact O-N 3.1Å; I107-S110 PolarHBondContact O-OG 2.88Å
108	Q	66.6	Low	71.3	Confident	163 Å²	163	92.4 Å²	92.4	76%	0.762	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	132.3	-177.9	-166	174.9	2.7	0	0	111.1	N106 S110	N106-Q108 WeakPolarHBondContact OD1-CB 3.24Å; N106-Q108 PolarHBondContact OD1-N 2.77Å; Q108-S110 PolarHBondContact O-N 2.78Å
109	A	61	Low	70.8	Confident	102 Å²	102	94.7 Å²	94.7	84%	0.843	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	17.6	-176.1	0	0	0	0	0	115.8	I107	I107-A109 PolarHBondContact O-N 2.9Å
110	S	66.8	Low	69.9	Low	45 Å²	45	90.7 Å²	90.7	32%	0.315	46%	0.455	S	S	.	.			trans	-65.9	147	174.8	-62.6	0	0	0	0	111.9	I35 I107 Q108	I35-S110 WeakPolarHBondContact CD1-OG 3.47Å; I107-S110 VanDerWaalsContact C-OG 3.26Å; I107-S110 WeakPolarHBondContact CA-OG 3.45Å; I107-S110 WeakPolarHBondContact O-CB 3.26Å; I107-S110 PolarHBondContact O-N 3.38Å; I107-S110 VanDerWaalsContact O-N 3.1Å; I107-S110 PolarHBondContact O-OG 2.88Å; Q108-S110 PolarHBondContact O-N 2.78Å
111	R	62	Low	68.8	Low	241 Å²	241	96.1 Å²	96.1	91%	0.909	47%	0.474	S	S	*	.			trans	-107.6	130.3	173.1	-65.1	-177	-179.3	-176	-0.4	109.9
112	F	67.6	Low	67.6	Low	139 Å²	139	96.7 Å²	96.7	61%	0.61	49%	0.49	S	S	*	.			trans	-76.1	134.6	170.9	-66.1	-87	0	0	0	109.9	L133	F112-L133 HydrophobicContact CE1-CD2 4.33Å; F112-L133 HydrophobicContact CZ-CD2 3.82Å
113	H	68.4	Low	66.2	Low	95 Å²	95	104 Å²	104	44%	0.44	53%	0.528	S	S	.	.			trans	-118.9	129.3	172.8	-179	76.1	0	0	0	109.7	W120	H113-W120 PolarHBondContact NE2-O 3.44Å
114	I	64.4	Low	65.6	Low	65 Å²	65	102.6 Å²	102.6	33%	0.333	51%	0.508	S	S	.	.			trans	-120.8	108.1	176.8	-47.5	172.3	0	0	0	107.4	F124 M128 L131	I114-F124 HydrophobicContact CB-CB 4.14Å; I114-F124 HydrophobicContact CG2-CB 3.65Å; I114-F124 HydrophobicContact CG2-CD1 4.48Å; I114-F124 HydrophobicContact CG2-CD2 3.82Å; I114-F124 HydrophobicContact CG2-CG 3.75Å; I114-F124 WeakPolarHBondContact O-CB 3.44Å; I114-F124 PolarHBondContact O-N 3.01Å; I114-F124 VanDerWaalsContact O-N 3.11Å; I114-M128 HydrophobicContact CD1-CE 3.92Å; I114-M128 HydrophobicContact CD1-SD 3.69Å; I114-M128 HydrophobicContact CG2-CE 3.71Å; I114-L131 HydrophobicContact CD1-CD2 3.8Å; I114-L131 HydrophobicContact CG1-CD2 4.44Å
115	G	63.3	Low	64.8	Low	22 Å²	22	101.4 Å²	101.4	23%	0.227	51%	0.509	C	S	.	.			trans	-103.6	154.4	179.7	0	0	0	0	0	112.5	R119	G115-R119 WeakPolarHBondContact CA-O 3.42Å
116	S	63.2	Low	64.4	Low	24 Å²	24	101.6 Å²	101.6	17%	0.168	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-85.2	145.3	179.7	-170	0	0	0	0	112.4	G118 R119 L123 S125	S116-G118 VanDerWaalsContact C-N 3.25Å; S116-G118 PolarHBondContact O-N 3.19Å; S116-R119 WeakPolarHBondContact O-CB 3.17Å; S116-R119 PolarHBondContact O-N 2.92Å; S116-R119 VanDerWaalsContact O-N 3.07Å; S116-L123 WeakPolarHBondContact CB-O 3.25Å; S116-S125 PolarHBondContact OG-OG 2.92Å
117	R	63.4	Low	64.3	Low	215 Å²	215	100.7 Å²	100.7	81%	0.811	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	53	38.5	172.9	-60.2	178.7	177.7	-178.3	-0.6	114	R119	R117-R119 PolarHBondContact O-N 3.13Å
118	G	61.1	Low	64.4	Low	15 Å²	15	100.3 Å²	100.3	16%	0.155	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	65.2	23.4	178.9	0	0	0	0	0	114.8	K39 S116	K39-G118 VanDerWaalsContact CD-O 3.31Å; K39-G118 WeakPolarHBondContact CD-O 3.5Å; K39-G118 WeakPolarHBondContact CE-O 3.35Å; K39-G118 PolarHBondContact NZ-O 2.83Å; S116-G118 VanDerWaalsContact C-N 3.25Å; S116-G118 PolarHBondContact O-N 3.19Å
119	R	66.6	Low	64.6	Low	173 Å²	173	99.2 Å²	99.2	65%	0.653	50%	0.501	S	S	*	.			trans	-100	142	173.8	-60	-180	177.8	-175.5	-2.6	109.9	G115 S116 R117 K121	G115-R119 WeakPolarHBondContact CA-O 3.42Å; S116-R119 WeakPolarHBondContact O-CB 3.17Å; S116-R119 PolarHBondContact O-N 2.92Å; S116-R119 VanDerWaalsContact O-N 3.07Å; R117-R119 PolarHBondContact O-N 3.13Å; R119-K121 PolarHBondContact O-N 2.81Å
120	W	64.2	Low	65.1	Low	71 Å²	71	97.3 Å²	97.3	27%	0.269	47%	0.474	S	S	.	.	S	Bend	trans	-80.7	-0.9	172.4	-63.5	110.3	0	0	0	113.9	H31 I34 V48 H113	H31-W120 AromaticContact CE1-NE1 3.9Å; I34-W120 HydrophobicContact CD1-CD2 3.8Å; I34-W120 HydrophobicContact CD1-CE3 3.57Å; I34-W120 HydrophobicContact CD1-CG 4.48Å; I34-W120 HydrophobicContact CD1-CH2 4.11Å; I34-W120 HydrophobicContact CD1-CZ2 4.28Å; I34-W120 HydrophobicContact CD1-CZ3 3.74Å; I34-W120 HydrophobicContact CG2-CH2 4.46Å; V48-W120 HydrophobicContact CB-CZ2 4.45Å; V48-W120 HydrophobicContact CG2-CZ2 4.03Å; H113-W120 PolarHBondContact NE2-O 3.44Å
121	K	60.6	Low	65.6	Low	142 Å²	142	100 Å²	100	62%	0.617	48%	0.484	S	S	*	.	S	Bend	trans	-119.6	135.3	179.6	-66.8	-179	-175.8	169.4	0	109.2	K30 R119	K30-K121 VanDerWaalsContact CD-CE 3.45Å; R119-K121 PolarHBondContact O-N 2.81Å
122	G	60.6	Low	66.1	Low	50 Å²	50	91.1 Å²	91.1	52%	0.515	46%	0.457	S	S	.	.	S	Bend	trans	99.7	164.6	-179.3	0	0	0	0	0	112.5
123	L	55	Low	66.5	Low	157 Å²	157	89.4 Å²	89.4	82%	0.822	45%	0.454	S	S	*	.			trans	-83.2	146.1	175.6	-65.1	167.9	0	0	0	109.7	S116 S125	S116-L123 WeakPolarHBondContact CB-O 3.25Å; L123-S125 PolarHBondContact O-N 2.96Å
124	F	65	Low	66.7	Low	82 Å²	82	87.2 Å²	87.2	36%	0.36	45%	0.447	S	S	.	.			trans	-54	133	167.2	-178.6	-109.6	0	0	0	110.1	I114 G126 M128	I114-F124 HydrophobicContact CB-CB 4.14Å; I114-F124 HydrophobicContact CG2-CB 3.65Å; I114-F124 HydrophobicContact CG2-CD1 4.48Å; I114-F124 HydrophobicContact CG2-CD2 3.82Å; I114-F124 HydrophobicContact CG2-CG 3.75Å; I114-F124 WeakPolarHBondContact O-CB 3.44Å; I114-F124 PolarHBondContact O-N 3.01Å; I114-F124 VanDerWaalsContact O-N 3.11Å; F124-G126 WeakPolarHBondContact CD1-O 3.25Å; F124-G126 WeakPolarHBondContact CE1-O 3.45Å; F124-M128 HydrophobicContact CD1-CB 4.47Å; F124-M128 HydrophobicContact CE1-CB 3.76Å; F124-M128 HydrophobicContact CE1-CE 4.43Å; F124-M128 HydrophobicContact CZ-CB 4.37Å; F124-M128 HydrophobicContact CZ-CE 4.42Å
125	S	60.9	Low	67.2	Low	90 Å²	90	88.6 Å²	88.6	63%	0.629	46%	0.46	S	S	*	.			trans	-121	13.2	-174.6	71.2	0	0	0	0	112.4	S116 L123	S116-S125 PolarHBondContact OG-OG 2.92Å; L123-S125 PolarHBondContact O-N 2.96Å
126	G	68.5	Low	67.7	Low	41 Å²	41	96.1 Å²	96.1	42%	0.423	50%	0.495	S	S	.	.	S	Bend	trans	-99.5	-172.7	173	0	0	0	0	0	111	F124	F124-G126 WeakPolarHBondContact CD1-O 3.25Å; F124-G126 WeakPolarHBondContact CE1-O 3.45Å
127	L	70.2	Confident	68.5	Low	89 Å²	89	97.7 Å²	97.7	47%	0.466	51%	0.506	S	S	.	.			trans	-95.8	136.5	169.1	-59.1	179.6	0	0	0	109.2	W71 L160 L163	W71-L127 HydrophobicContact CH2-CB 3.58Å; W71-L127 HydrophobicContact CZ2-CB 3.8Å; W71-L127 HydrophobicContact CZ2-CD1 3.95Å; W71-L127 HydrophobicContact CZ3-CB 4.42Å; L127-L160 HydrophobicContact CD1-CD2 4.1Å; L127-L163 HydrophobicContact CD1-CD1 4.08Å; L127-L163 HydrophobicContact CD1-CD2 4.2Å
128	M	73.1	Confident	69.5	Low	85 Å²	85	90.2 Å²	90.2	42%	0.419	48%	0.483	S	S	.	.			trans	-135.5	118.3	174.2	179.7	178	-67	0	0	107.4	I114 F124 L131	I114-M128 HydrophobicContact CD1-CE 3.92Å; I114-M128 HydrophobicContact CD1-SD 3.69Å; I114-M128 HydrophobicContact CG2-CE 3.71Å; F124-M128 HydrophobicContact CD1-CB 4.47Å; F124-M128 HydrophobicContact CE1-CB 3.76Å; F124-M128 HydrophobicContact CE1-CE 4.43Å; F124-M128 HydrophobicContact CZ-CB 4.37Å; F124-M128 HydrophobicContact CZ-CE 4.42Å; M128-L131 HydrophobicContact SD-CB 3.87Å; M128-L131 HydrophobicContact SD-CD2 4.32Å
129	R	70	Confident	70.3	Confident	141 Å²	141	90 Å²	90	53%	0.532	48%	0.479	S	S	.	.			trans	-83.4	-42.9	-175.8	175.4	61.1	-176.2	104.7	-9.6	112.1	W71 L154 S155 V156	W71-R129 HydrophobicContact CE3-CB 4.39Å; W71-R129 HydrophobicContact CH2-CB 3.96Å; W71-R129 HydrophobicContact CZ3-CB 3.56Å; R129-L154 HydrophobicContact CG-CB 4.22Å; R129-L154 HydrophobicContact CG-CD1 4.49Å; R129-S155 PolarHBondContact NE-O 3Å; R129-S155 VanDerWaalsContact NE-O 3.1Å; R129-V156 HydrophobicContact CB-CG2 4.31Å; R129-V156 HydrophobicContact CG-CG2 4.22Å
130	Q	72.1	Confident	70.9	Confident	61 Å²	61	82 Å²	82	29%	0.285	45%	0.449	S	S	.	.			trans	-151.9	143.5	-176.6	-161.9	174.6	3.9	0	0	109.5	V132 L154 Q542	Q130-V132 HydrophobicContact CG-CG2 3.63Å; Q130-V132 VanDerWaalsContact NE2-CG2 3.34Å; Q130-L154 HydrophobicContact CB-CD1 3.53Å; Q130-L154 HydrophobicContact CG-CD1 4.37Å; Q130-Q542 PolarHBondContact NE2-O 3.39Å
131	L	77.4	Confident	71.2	Confident	101 Å²	101	84.5 Å²	84.5	53%	0.529	47%	0.468	S	S	.	.			trans	-136.1	115.8	169.3	175.5	64.2	0	0	0	106.9	I114 M128	I114-L131 HydrophobicContact CD1-CD2 3.8Å; I114-L131 HydrophobicContact CG1-CD2 4.44Å; M128-L131 HydrophobicContact SD-CB 3.87Å; M128-L131 HydrophobicContact SD-CD2 4.32Å
132	V	72.9	Confident	71.5	Confident	56 Å²	56	83.2 Å²	83.2	34%	0.339	47%	0.465	S	S	.	.			trans	-121.3	139.2	-178	-169.3	0	0	0	0	109.1	Q130 V134 E545	Q130-V132 HydrophobicContact CG-CG2 3.63Å; Q130-V132 VanDerWaalsContact NE2-CG2 3.34Å; V132-V134 HydrophobicContact CG1-CG2 3.81Å; V132-E545 WeakPolarHBondContact CG1-OE1 3.38Å
133	L	75.1	Confident	72	Confident	102 Å²	102	82 Å²	82	53%	0.534	45%	0.446	S	S	.	.			trans	-114.6	116.3	169	178.7	67.9	0	0	0	108.1	F112 P135	F112-L133 HydrophobicContact CE1-CD2 4.33Å; F112-L133 HydrophobicContact CZ-CD2 3.82Å; L133-P135 WeakPolarHBondContact O-CD 3.12Å
134	V	73.3	Confident	72.7	Confident	49 Å²	49	75.4 Å²	75.4	30%	0.297	41%	0.413	S	S	.	.			trans	-108.6	98.4	-179.3	-165.1	0	0	0	0	109.2	V132 A139 Y544	V132-V134 HydrophobicContact CG1-CG2 3.81Å; V134-A139 HydrophobicContact CG2-CB 4.41Å; V134-Y544 HydrophobicContact CG2-CE1 4.49Å
135	P	74.3	Confident	72.5	Confident	95 Å²	95	75.4 Å²	75.4	62%	0.617	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	142.7	177.9	27.7	-32.6	0	0	0	110.7	L133 S137	L133-P135 WeakPolarHBondContact O-CD 3.12Å; P135-S137 VanDerWaalsContact C-N 3.25Å; P135-S137 PolarHBondContact O-N 3.1Å
136	N	75.1	Confident	72.6	Confident	179 Å²	179	73.1 Å²	73.1	96%	0.957	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	23	174.3	-55.5	-36.3	0	0	0	116.2
137	S	78.3	Confident	72.4	Confident	58 Å²	58	76.1 Å²	76.1	41%	0.406	42%	0.419	S	S	.	.			trans	-139.4	146.7	178.8	-171	0	0	0	0	112.3	P135	P135-S137 VanDerWaalsContact C-N 3.25Å; P135-S137 PolarHBondContact O-N 3.1Å
138	D	85.3	Confident	72.1	Confident	58 Å²	58	73.4 Å²	73.4	31%	0.31	41%	0.405	S	S	.	.			trans	-92.8	102.8	164.6	-177.5	-8.6	0	0	0	108.8	V77 K84 S140	V77-D138 HydrophobicContact CG1-CB 4.04Å; V77-D138 HydrophobicContact CG2-CB 4.43Å; V77-D138 WeakPolarHBondContact CG2-OD1 3.13Å; K84-D138 IonicContact NZ-OD2 3Å; K84-D138 PolarHBondContact NZ-OD2 2.85Å; D138-S140 PolarHBondContact O-N 3.31Å; D138-S140 WeakPolarHBondContact OD1-CA 3.25Å; D138-S140 WeakPolarHBondContact OD1-CB 3.44Å; D138-S140 PolarHBondContact OD1-N 2.88Å; D138-S140 PolarHBondContact OD1-OG 3.06Å
139	A	77.8	Confident	71.5	Confident	10 Å²	10	71.9 Å²	71.9	8%	0.083	40%	0.402	C	S	.	.			trans	-71.1	-6	178.4	0	0	0	0	0	114.5	V75 V134 N141 Q142 L143 Y544	V75-A139 HydrophobicContact CG1-CB 4.22Å; V134-A139 HydrophobicContact CG2-CB 4.41Å; A139-N141 PolarHBondContact O-N 3.19Å; A139-Q142 PolarHBondContact O-N 3.31Å; A139-L143 HydrophobicContact CB-CD1 4.22Å; A139-L143 WeakPolarHBondContact O-CB 3.29Å; A139-L143 PolarHBondContact O-N 3.42Å; A139-Y544 WeakPolarHBondContact CA-OH 3.09Å; A139-Y544 HydrophobicContact CB-CE1 3.73Å; A139-Y544 WeakPolarHBondContact CB-OH 3.35Å; A139-Y544 PolarHBondContact O-OH 3.24Å
140	S	79.8	Confident	71	Confident	4 Å²	4	73.1 Å²	73.1	3%	0.028	41%	0.407	C	S	.	.	H	α-helix	trans	-58.5	-48.9	-168.5	-57.9	0	0	0	0	113.2	K84 D138 Q142 L143 C144	K84-S140 PolarHBondContact NZ-OG 3.35Å; D138-S140 PolarHBondContact O-N 3.31Å; D138-S140 WeakPolarHBondContact OD1-CA 3.25Å; D138-S140 WeakPolarHBondContact OD1-CB 3.44Å; D138-S140 PolarHBondContact OD1-N 2.88Å; D138-S140 PolarHBondContact OD1-OG 3.06Å; S140-Q142 VanDerWaalsContact C-N 3.28Å; S140-Q142 PolarHBondContact O-N 3.33Å; S140-L143 PolarHBondContact O-N 2.87Å; S140-C144 WeakPolarHBondContact O-CA 3.41Å; S140-C144 VanDerWaalsContact O-CB 3.3Å; S140-C144 WeakPolarHBondContact O-CB 3.35Å; S140-C144 PolarHBondContact O-N 2.86Å
141	N	71.1	Confident	70	Confident	124 Å²	124	71.5 Å²	71.5	66%	0.663	40%	0.4	S	S	*	.	H	α-helix	trans	-74.5	-21.7	-173.4	-65.4	-11.6	0	0	0	112.8	A139 C144 P145	A139-N141 PolarHBondContact O-N 3.19Å; N141-C144 CarbonylContact O-C 3.54Å; N141-P145 VanDerWaalsContact O-CA 3.25Å; N141-P145 WeakPolarHBondContact O-CA 3.42Å
142	Q	66.6	Low	68.8	Low	116 Å²	116	67.1 Å²	67.1	54%	0.542	38%	0.378	S	S	.	.	H	α-helix	trans	-84.3	-39.2	175.1	-66.8	170.8	5.9	0	0	109.9	A139 S140 C144 Y544	A139-Q142 PolarHBondContact O-N 3.31Å; S140-Q142 VanDerWaalsContact C-N 3.28Å; S140-Q142 PolarHBondContact O-N 3.33Å; Q142-C144 VanDerWaalsContact C-N 3.31Å; Q142-Y544 HydrophobicContact CB-CE2 3.45Å; Q142-Y544 VanDerWaalsContact CB-CE2 3.45Å; Q142-Y544 WeakPolarHBondContact CB-OH 3.5Å; Q142-Y544 PolarHBondContact OE1-OH 3.09Å
143	L	69.8	Low	68	Low	25 Å²	25	66.6 Å²	66.6	13%	0.131	38%	0.38	C	S	.	.	H	α-helix	trans	-70.1	-34.5	177.1	-95.9	161.3	0	0	0	110.5	T73 V75 A139 S140 P145 A152 Y544	T73-L143 HydrophobicContact CG2-CD2 4.15Å; V75-L143 HydrophobicContact CB-CD1 4.22Å; V75-L143 HydrophobicContact CG1-CD1 3.89Å; V75-L143 HydrophobicContact CG2-CB 3.91Å; V75-L143 HydrophobicContact CG2-CD1 3.44Å; V75-L143 VanDerWaalsContact CG2-CD1 3.44Å; V75-L143 HydrophobicContact CG2-CG 4.2Å; A139-L143 HydrophobicContact CB-CD1 4.22Å; A139-L143 WeakPolarHBondContact O-CB 3.29Å; A139-L143 PolarHBondContact O-N 3.42Å; S140-L143 PolarHBondContact O-N 2.87Å; L143-P145 VanDerWaalsContact C-CD 3.47Å; L143-A152 WeakPolarHBondContact O-CB 3.38Å; L143-Y544 VanDerWaalsContact CA-CE2 3.41Å; L143-Y544 HydrophobicContact CB-CD2 3.99Å; L143-Y544 HydrophobicContact CB-CE2 3.84Å; L143-Y544 HydrophobicContact CD1-CD1 4.07Å; L143-Y544 HydrophobicContact CD1-CD2 4.33Å; L143-Y544 HydrophobicContact CD1-CE1 3.9Å; L143-Y544 HydrophobicContact CD1-CE2 4.33Å; L143-Y544 HydrophobicContact CD1-CG 4.26Å; L143-Y544 HydrophobicContact CD2-CD1 3.96Å; L143-Y544 HydrophobicContact CD2-CD2 3.26Å; L143-Y544 HydrophobicContact CD2-CE1 4.43Å; L143-Y544 HydrophobicContact CD2-CE2 3.95Å; L143-Y544 HydrophobicContact CD2-CG 3.34Å; L143-Y544 HydrophobicContact CG-CD1 3.81Å; L143-Y544 HydrophobicContact CG-CD2 3.23Å; L143-Y544 HydrophobicContact CG-CE1 3.77Å; L143-Y544 HydrophobicContact CG-CE2 3.35Å; L143-Y544 HydrophobicContact CG-CG 3.55Å
144	C	71.3	Confident	67.2	Low	18 Å²	18	63.4 Å²	63.4	12%	0.122	36%	0.363	C	S	.	.			trans	-128	69	-176	-63.8	0	0	0	0	109.7	C89 S140 N141 Q142 S146	C89-C144 WeakPolarHBondContact CA-SG 3.3Å; C89-C144 HydrophobicContact CB-CB 3.44Å; C89-C144 VanDerWaalsContact CB-CB 3.44Å; C89-C144 WeakPolarHBondContact CB-SG 3.15Å; C89-C144 WeakPolarHBondContact SG-CA 3.25Å; C89-C144 WeakPolarHBondContact SG-CB 3.12Å; C89-C144 CovalentContact SG-SG 2.03Å; C89-C144 PolarHBondContact SG-SG 3.11Å; S140-C144 WeakPolarHBondContact O-CA 3.41Å; S140-C144 VanDerWaalsContact O-CB 3.3Å; S140-C144 WeakPolarHBondContact O-CB 3.35Å; S140-C144 PolarHBondContact O-N 2.86Å; N141-C144 CarbonylContact O-C 3.54Å; Q142-C144 VanDerWaalsContact C-N 3.31Å; C144-S146 PolarHBondContact O-N 2.8Å
145	P	59.5	Low	66.4	Low	81 Å²	81	63 Å²	63	53%	0.526	36%	0.362	S	S	.	.	S	Bend	trans	-69.7	-19.7	177.1	30.8	-34.6	0	0	0	111.5	N141 L143	N141-P145 VanDerWaalsContact O-CA 3.25Å; N141-P145 WeakPolarHBondContact O-CA 3.42Å; L143-P145 VanDerWaalsContact C-CD 3.47Å
146	S	63.9	Low	65.4	Low	43 Å²	43	59.2 Å²	59.2	30%	0.301	34%	0.337	S	S	.	.	S	Bend	trans	-125.7	157.4	175.6	-178.8	0	0	0	0	110.5	C144 D148	C144-S146 PolarHBondContact O-N 2.8Å; S146-D148 PolarHBondContact O-N 3.3Å; S146-D148 PolarHBondContact OG-N 3.06Å
147	S	63.3	Low	64.3	Low	103 Å²	103	52.1 Å²	52.1	72%	0.72	30%	0.301	S	S	*	.	S	Bend	trans	-76.4	-6.9	170	57.1	0	0	0	0	113	P149	S147-P149 VanDerWaalsContact O-CD 3.23Å; S147-P149 WeakPolarHBondContact O-CD 3.45Å
148	D	64.1	Low	63.2	Low	32 Å²	32	53.9 Å²	53.9	17%	0.171	31%	0.311	C	S	.	.			trans	-81.9	110.3	170.1	-170.4	-19.6	0	0	0	110.4	S146 R150 L151	S146-D148 PolarHBondContact O-N 3.3Å; S146-D148 PolarHBondContact OG-N 3.06Å; D148-R150 PolarHBondContact O-N 3.19Å; D148-R150 VanDerWaalsContact O-N 3.1Å; D148-R150 WeakPolarHBondContact OD1-CB 3.46Å; D148-R150 PolarHBondContact OD1-N 3.4Å; D148-R150 IonicContact OD1-NE 2.66Å; D148-R150 PolarHBondContact OD1-NE 2.96Å; D148-R150 IonicContact OD1-NH2 2.7Å; D148-R150 IonicContact OD2-CZ 3.96Å; D148-R150 IonicContact OD2-NE 2.61Å; D148-R150 PolarHBondContact OD2-NE 2.97Å; D148-R150 IonicContact OD2-NH2 3.8Å; D148-R150 PolarHBondContact OD2-NH2 3.2Å; D148-L151 HydrophobicContact CB-CD1 4.07Å; D148-L151 HydrophobicContact CB-CG 4.23Å; D148-L151 PolarHBondContact O-N 3Å
149	P	60.6	Low	61.7	Low	54 Å²	54	53 Å²	53	35%	0.351	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.4	179.9	18.7	-29	0	0	0	114.4	D88 S147 L151 A152 A153	D88-P149 HydrophobicContact CB-CB 4.11Å; D88-P149 WeakPolarHBondContact O-CB 3.35Å; S147-P149 VanDerWaalsContact O-CD 3.23Å; S147-P149 WeakPolarHBondContact O-CD 3.45Å; P149-L151 VanDerWaalsContact C-N 3.31Å; P149-L151 PolarHBondContact O-N 3.21Å; P149-A152 PolarHBondContact O-N 2.95Å; P149-A153 PolarHBondContact O-N 2.74Å
150	R	59.3	Low	60.7	Low	167 Å²	167	53.7 Å²	53.7	63%	0.63	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-29.1	-179.8	-64.3	176.6	-65.9	166.4	4.2	112.5	D148 A152 A153 S492	D148-R150 PolarHBondContact O-N 3.19Å; D148-R150 VanDerWaalsContact O-N 3.1Å; D148-R150 WeakPolarHBondContact OD1-CB 3.46Å; D148-R150 PolarHBondContact OD1-N 3.4Å; D148-R150 IonicContact OD1-NE 2.66Å; D148-R150 PolarHBondContact OD1-NE 2.96Å; D148-R150 IonicContact OD1-NH2 2.7Å; D148-R150 IonicContact OD2-CZ 3.96Å; D148-R150 IonicContact OD2-NE 2.61Å; D148-R150 PolarHBondContact OD2-NE 2.97Å; D148-R150 IonicContact OD2-NH2 3.8Å; D148-R150 PolarHBondContact OD2-NH2 3.2Å; R150-A152 VanDerWaalsContact C-N 3.3Å; R150-A153 PolarHBondContact O-N 3.18Å; R150-S492 PolarHBondContact NH2-OG 3.29Å
151	L	52.5	Low	59.8	Low	26 Å²	26	57.3 Å²	57.3	14%	0.136	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-22	177.6	-61.9	175.7	0	0	0	112.2	D148 P149 D490	D148-L151 HydrophobicContact CB-CD1 4.07Å; D148-L151 HydrophobicContact CB-CG 4.23Å; D148-L151 PolarHBondContact O-N 3Å; P149-L151 VanDerWaalsContact C-N 3.31Å; P149-L151 PolarHBondContact O-N 3.21Å; L151-D490 HydrophobicContact CD1-CB 4.27Å; L151-D490 HydrophobicContact CD2-CB 4.19Å
152	A	50.8	Low	58.9	Low	10 Å²	10	58 Å²	58	8%	0.083	33%	0.331	C	S	.	.	S	Bend	trans	-93	-8.5	176.4	0	0	0	0	0	113.7	C89 L143 P149 R150 L154	C89-A152 WeakPolarHBondContact SG-CB 3.44Å; L143-A152 WeakPolarHBondContact O-CB 3.38Å; P149-A152 PolarHBondContact O-N 2.95Å; R150-A152 VanDerWaalsContact C-N 3.3Å; A152-L154 PolarHBondContact O-N 3.37Å
153	A	57.5	Low	58.2	Low	44 Å²	44	55.5 Å²	55.5	36%	0.364	32%	0.321	S	S	.	.			trans	-67.6	117.9	-178.9	0	0	0	0	0	109.3	P149 R150 S155	P149-A153 PolarHBondContact O-N 2.74Å; R150-A153 PolarHBondContact O-N 3.18Å; A153-S155 PolarHBondContact O-N 2.83Å
154	L	58.3	Low	57	Low	35 Å²	35	59.4 Å²	59.4	18%	0.183	35%	0.348	C	S	.	.			trans	-55.5	140.7	169	-68.8	168.8	0	0	0	109	R129 Q130 A152 V156	R129-L154 HydrophobicContact CG-CB 4.22Å; R129-L154 HydrophobicContact CG-CD1 4.49Å; Q130-L154 HydrophobicContact CB-CD1 3.53Å; Q130-L154 HydrophobicContact CG-CD1 4.37Å; A152-L154 PolarHBondContact O-N 3.37Å; L154-V156 WeakPolarHBondContact O-CG2 3.47Å; L154-V156 PolarHBondContact O-N 2.97Å
155	S	54.4	Low	55.6	Low	40 Å²	40	64.3 Å²	64.3	28%	0.28	38%	0.377	S	S	.	.			trans	-56.9	106.9	178.4	-174.6	0	0	0	0	109.6	R129 A153	R129-S155 PolarHBondContact NE-O 3Å; R129-S155 VanDerWaalsContact NE-O 3.1Å; A153-S155 PolarHBondContact O-N 2.83Å
156	V	55.4	Low	54.6	Low	16 Å²	16	70.1 Å²	70.1	10%	0.097	39%	0.388	C	S	.	.			trans	-112	129.9	173.2	169.7	0	0	0	0	105.8	W71 R129 L154 L160 L161	W71-V156 HydrophobicContact CD2-CG1 4.17Å; W71-V156 HydrophobicContact CD2-CG2 3.74Å; W71-V156 VanDerWaalsContact CE2-CG1 3.45Å; W71-V156 HydrophobicContact CE3-CG2 3.95Å; W71-V156 HydrophobicContact CG-CG1 4.48Å; W71-V156 HydrophobicContact CG-CG2 4.22Å; W71-V156 HydrophobicContact CH2-CG1 4.49Å; W71-V156 HydrophobicContact CH2-CG2 4.2Å; W71-V156 HydrophobicContact CZ2-CG1 3.63Å; W71-V156 HydrophobicContact CZ2-CG2 4.04Å; W71-V156 HydrophobicContact CZ3-CG2 4.19Å; R129-V156 HydrophobicContact CB-CG2 4.31Å; R129-V156 HydrophobicContact CG-CG2 4.22Å; L154-V156 WeakPolarHBondContact O-CG2 3.47Å; L154-V156 PolarHBondContact O-N 2.97Å; V156-L160 HydrophobicContact CG1-CB 3.69Å; V156-L161 HydrophobicContact CB-CD2 3.99Å; V156-L161 HydrophobicContact CG1-CD2 4.04Å
157	P	51.4	Low	53	Low	30 Å²	30	78.6 Å²	78.6	20%	0.195	41%	0.413	C	S	.	.			trans	-47	130.8	175.3	-30.7	35.5	0	0	0	111.7	L159 L160 I217	P157-L159 PolarHBondContact O-N 3.28Å; P157-L160 HydrophobicContact CB-CD1 4.28Å; P157-L160 HydrophobicContact CB-CG 4.39Å; P157-L160 HydrophobicContact CG-CD1 4.17Å; P157-L160 WeakPolarHBondContact O-CB 3.41Å; P157-L160 PolarHBondContact O-N 2.84Å; P157-I217 HydrophobicContact CB-CG2 3.99Å; P157-I217 HydrophobicContact CG-CG2 4.48Å
158	P	55.2	Low	51.8	Low	95 Å²	95	85.8 Å²	85.8	62%	0.617	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-52	-32.5	-172.6	-31.7	35.9	0	0	0	115.4	L160 L161	P158-L160 PolarHBondContact O-N 2.99Å; P158-L161 HydrophobicContact CB-CD1 4.33Å; P158-L161 WeakPolarHBondContact O-CB 3.46Å; P158-L161 PolarHBondContact O-N 3.14Å; P158-L161 VanDerWaalsContact O-N 3.14Å
159	L	53	Low	50.2	Low	39 Å²	39	92.5 Å²	92.5	20%	0.204	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-64.3	-23.2	175.7	-70.4	165.3	0	0	0	115.3	P157 V210 C211 D212 I217	P157-L159 PolarHBondContact O-N 3.28Å; L159-V210 HydrophobicContact CB-CG1 4.43Å; L159-V210 HydrophobicContact CD1-CB 4.35Å; L159-V210 HydrophobicContact CD1-CG1 3.64Å; L159-V210 HydrophobicContact CD1-CG2 4.06Å; L159-C211 WeakPolarHBondContact CD1-O 3.5Å; L159-D212 VanDerWaalsContact CD1-CA 3.49Å; L159-D212 HydrophobicContact CD1-CB 3.5Å; L159-D212 VanDerWaalsContact CD1-CB 3.5Å; L159-D212 VanDerWaalsContact CD2-CA 3.48Å; L159-D212 HydrophobicContact CD2-CB 3.69Å; L159-D212 HydrophobicContact CG-CB 3.75Å; L159-I217 HydrophobicContact CD1-CB 4.34Å; L159-I217 HydrophobicContact CD1-CG1 3.79Å
160	L	57.5	Low	49.2	Very low	25 Å²	25	97.4 Å²	97.4	13%	0.131	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-91.9	-7.3	178.7	-60.3	178.2	0	0	0	111.5	W71 L127 V156 P157 P158	W71-L160 HydrophobicContact CZ2-CB 4.36Å; W71-L160 PolarHBondContact NE1-O 2.73Å; L127-L160 HydrophobicContact CD1-CD2 4.1Å; V156-L160 HydrophobicContact CG1-CB 3.69Å; P157-L160 HydrophobicContact CB-CD1 4.28Å; P157-L160 HydrophobicContact CB-CG 4.39Å; P157-L160 HydrophobicContact CG-CD1 4.17Å; P157-L160 WeakPolarHBondContact O-CB 3.41Å; P157-L160 PolarHBondContact O-N 2.84Å; P158-L160 PolarHBondContact O-N 2.99Å
161	L	59.3	Low	47.9	Very low	81 Å²	81	98.4 Å²	98.4	42%	0.424	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-35.7	178.3	-64.2	174.6	0	0	0	111.9	V156 P158	V156-L161 HydrophobicContact CB-CD2 3.99Å; V156-L161 HydrophobicContact CG1-CD2 4.04Å; P158-L161 HydrophobicContact CB-CD1 4.33Å; P158-L161 WeakPolarHBondContact O-CB 3.46Å; P158-L161 PolarHBondContact O-N 3.14Å; P158-L161 VanDerWaalsContact O-N 3.14Å
162	D	54.2	Low	47.3	Very low	139 Å²	139	108.6 Å²	108.6	74%	0.743	53%	0.527	S	S	*	.	S	Bend	trans	-112.4	86.2	178.8	-71	-34.9	0	0	0	111
163	L	51.3	Low	46.3	Very low	62 Å²	62	117 Å²	117	33%	0.325	56%	0.564	S	S	.	*			trans	-76.8	125.6	172.5	-72.8	169.2	0	0	0	109.8	N69 L127 V165	N69-L163 HydrophobicContact CB-CB 3.84Å; N69-L163 WeakPolarHBondContact CB-O 3.34Å; L127-L163 HydrophobicContact CD1-CD1 4.08Å; L127-L163 HydrophobicContact CD1-CD2 4.2Å; L163-V165 PolarHBondContact O-N 3.07Å
164	P	45	Very low	45.4	Very low	108 Å²	108	122.7 Å²	122.7	70%	0.701	59%	0.588	S	S	*	*			trans	-60.1	133.9	-174.4	18.8	-29	0	0	0	112.7	N69 R166	N69-P164 PolarHBondContact ND2-O 2.77Å; P164-R166 PolarHBondContact O-N 3.25Å
165	V	40	Very low	43.9	Very low	120 Å²	120	127.2 Å²	127.2	73%	0.727	62%	0.618	S	S	*	*			trans	-65.5	113.7	177.4	179	0	0	0	0	109.9	L163 R167	L163-V165 PolarHBondContact O-N 3.07Å; V165-R167 PolarHBondContact O-N 2.93Å
166	R	40	Very low	42.7	Very low	204 Å²	204	131.2 Å²	131.2	77%	0.77	65%	0.645	S	S	*	*			trans	-69.1	100.1	168.9	-140.7	-180	-177.6	-178.2	-0.3	108.2	P164 R168	P164-R166 PolarHBondContact O-N 3.25Å; R166-R168 PolarHBondContact O-N 2.72Å
167	R	30.6	Very low	41.6	Very low	220 Å²	220	135.9 Å²	135.9	83%	0.83	68%	0.679	S	S	*	*			trans	-55.2	122.3	166.8	-93.6	-177.4	171.3	172.9	-1.9	107.9	V165 Q169	V165-R167 PolarHBondContact O-N 2.93Å; R167-Q169 PolarHBondContact O-N 3.11Å
168	R	36.4	Very low	40.8	Very low	255 Å²	255	137.4 Å²	137.4	96%	0.962	70%	0.7	S	S	*	*			trans	-65.8	96.5	167.2	-87.9	-176.2	173.1	-179.2	-0.8	107.6	R166	R166-R168 PolarHBondContact O-N 2.72Å
169	Q	31.9	Very low	40	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	71%	0.71	S	S	*	*			trans	-89.5	107	162	-85.3	179	-22.1	0	0	108.3	R167 E171	R167-Q169 PolarHBondContact O-N 3.11Å; Q169-E171 PolarHBondContact O-N 3.11Å
170	N	39.6	Very low	39.6	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	74%	0.739	S	S	*	*			trans	-65.7	108.7	145.2	-89.1	-11	0	0	0	105.8
171	E	32.2	Very low	39.1	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	75%	0.754	S	S	*	*			trans	-176.7	134.8	144.7	-103.7	163.2	-163	0	0	110	Q169 H173	Q169-E171 PolarHBondContact O-N 3.11Å; E171-H173 PolarHBondContact O-N 3.49Å
172	R	38.8	Very low	38.6	Very low	239 Å²	239	149 Å²	149	90%	0.902	78%	0.777	S	S	*	*			trans	-68.9	108.6	171.7	-70	173.7	179.5	-175.6	-1.2	107.3
173	H	29.7	Very low	38.6	Very low	188 Å²	188	145 Å²	145	87%	0.87	76%	0.76	S	S	*	*			trans	-166.1	129.8	142.7	-97.3	-60.7	0	0	0	108.9	E171 T175	E171-H173 PolarHBondContact O-N 3.49Å; H173-T175 PolarHBondContact O-N 2.78Å
174	D	38.8	Very low	39.4	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	76%	0.755	S	S	*	*			trans	-56	121	171.7	-90.8	-46.1	0	0	0	110.5
175	T	26.5	Very low	40.6	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	75%	0.751	S	S	*	*			trans	-172.7	126.3	140.2	21.6	0	0	0	0	110.5	H173	H173-T175 PolarHBondContact O-N 2.78Å
176	S	29	Very low	42.1	Very low	123 Å²	123	139 Å²	139	86%	0.86	73%	0.731	S	S	*	*			trans	47.5	79.1	170.7	68.6	0	0	0	0	118.4
177	S	32.3	Very low	43.4	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	72%	0.721	S	S	*	*			trans	-77.1	116.3	158	-167.9	0	0	0	0	109.7
178	G	35.7	Very low	45.1	Very low	61 Å²	61	129 Å²	129	63%	0.629	71%	0.713	S	S	*	*			trans	150.4	95.6	163	0	0	0	0	0	115.6
179	A	38.1	Very low	46.8	Very low	101 Å²	101	122.4 Å²	122.4	84%	0.835	69%	0.688	S	S	*	*	S	Bend	trans	-147.9	56.7	160.5	0	0	0	0	0	111.1
180	A	44.5	Very low	48.9	Very low	98 Å²	98	119.2 Å²	119.2	81%	0.81	68%	0.683	S	S	*	*	S	Bend		-113.5	91.9	111.8	0	0	0	0	0	102.8	R182	A180-R182 PolarHBondContact O-N 3.45Å
181	G	47	Very low	50.8	Low	44 Å²	44	112.5 Å²	112.5	45%	0.454	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-55.6	142.4	-174.8	0	0	0	0	0	109.6
182	R	48.1	Very low	53	Low	240 Å²	240	105.7 Å²	105.7	91%	0.906	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-46.8	135.9	164.6	-84.4	179.5	172	173.3	-2.8	107.7	A180 S184	A180-R182 PolarHBondContact O-N 3.45Å; R182-S184 PolarHBondContact O-N 2.98Å; R182-S184 VanDerWaalsContact O-N 3.13Å
183	P	55.1	Low	54.8	Low	57 Å²	57	100.2 Å²	100.2	37%	0.37	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-50.6	127.3	176.8	-22.1	30.1	0	0	0	108.6	V185 L199 F201 L208	P183-V185 PolarHBondContact O-N 2.78Å; P183-L199 WeakPolarHBondContact CA-O 3.43Å; P183-L199 HydrophobicContact CB-CB 4.32Å; P183-F201 HydrophobicContact CB-CB 4.09Å; P183-L208 HydrophobicContact CB-CD1 4.15Å; P183-L208 HydrophobicContact CG-CD1 4.3Å
184	S	67.6	Low	57	Low	34 Å²	34	98.9 Å²	98.9	24%	0.238	60%	0.604	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.2	131.4	167	58.9	0	0	0	0	107.3	R182 L199 W200 F201	R182-S184 PolarHBondContact O-N 2.98Å; R182-S184 VanDerWaalsContact O-N 3.13Å; S184-L199 PolarHBondContact N-O 2.86Å; S184-L199 PolarHBondContact OG-O 2.83Å; S184-W200 CarbonylContact O-C 3.49Å; S184-W200 WeakPolarHBondContact O-CA 3.36Å; S184-F201 PolarHBondContact O-N 2.77Å
185	V	70.4	Confident	58.6	Low	102 Å²	102	91.7 Å²	91.7	62%	0.618	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.7	125.5	-176	-177.8	0	0	0	0	108.6	P183 F201 P203	P183-V185 PolarHBondContact O-N 2.78Å; V185-F201 WeakPolarHBondContact CA-O 3.34Å; V185-F201 HydrophobicContact CG1-CD1 4.23Å; V185-F201 HydrophobicContact CG2-CB 4.42Å; V185-F201 HydrophobicContact CG2-CD1 4.47Å; V185-P203 HydrophobicContact CG1-CG 3.55Å
186	G	72.2	Confident	60.9	Low	28 Å²	28	92.6 Å²	92.6	29%	0.289	55%	0.554	S	S	.	*	S	Bend	trans	166.1	-179.5	178.6	0	0	0	0	0	114.6	W200 F201 P203	G186-W200 PolarHBondContact O-NE1 2.77Å; G186-F201 PolarHBondContact N-O 2.82Å; G186-P203 WeakPolarHBondContact O-CD 3.37Å
187	A	67.7	Low	62.5	Low	68 Å²	68	89.1 Å²	89.1	56%	0.562	54%	0.538	S	S	*	.	S	Bend	trans	-68.7	172.9	176.3	0	0	0	0	0	112.5	R189 L204	A187-R189 PolarHBondContact O-N 2.64Å; A187-L204 HydrophobicContact CB-CD1 4.46Å
188	E	66.6	Low	64.6	Low	144 Å²	144	87.8 Å²	87.8	67%	0.673	52%	0.519	S	S	*	.			trans	-48.8	125.3	-170.7	-162.1	159.1	-128	0	0	113.2	W200 K205	E188-W200 HydrophobicContact CB-CH2 4.48Å; E188-W200 HydrophobicContact CG-CH2 4.36Å; E188-K205 IonicContact OE1-NZ 3.38Å; E188-K205 PolarHBondContact OE1-NZ 2.88Å
189	R	71	Confident	66.5	Low	117 Å²	117	87.3 Å²	87.3	44%	0.442	50%	0.502	S	S	.	.			trans	-128.4	138.9	-178.2	-172.5	179.8	-176.4	-173.1	1.2	109.2	A187 W216	A187-R189 PolarHBondContact O-N 2.64Å; R189-W216 PolarHBondContact O-NE1 2.74Å
190	P	75.2	Confident	68.6	Low	107 Å²	107	82.8 Å²	82.8	70%	0.695	46%	0.463	S	S	*	.			trans	-70.6	136.3	172.5	26.7	-32	0	0	0	111.1
191	C	80.1	Confident	70.2	Confident	16 Å²	16	81.6 Å²	81.6	11%	0.108	44%	0.44	C	S	.	.			trans	-72.3	150.7	167.3	169.6	0	0	0	0	109.1	C211 D212 G213 S214 A215 W216	C191-C211 HydrophobicContact CB-CB 3.86Å; C191-C211 WeakPolarHBondContact CB-SG 3.29Å; C191-C211 WeakPolarHBondContact SG-CA 3.42Å; C191-C211 WeakPolarHBondContact SG-CB 3.4Å; C191-C211 CovalentContact SG-SG 2.02Å; C191-C211 PolarHBondContact SG-SG 2.97Å; C191-D212 PolarHBondContact SG-N 2.76Å; C191-G213 PolarHBondContact SG-N 2.86Å; C191-G213 VanDerWaalsContact SG-N 3.43Å; C191-S214 VanDerWaalsContact SG-C 3.59Å; C191-S214 PolarHBondContact SG-N 3.43Å; C191-S214 VanDerWaalsContact SG-N 3.44Å; C191-A215 VanDerWaalsContact CB-C 3.42Å; C191-A215 PolarHBondContact SG-N 2.73Å; C191-A215 PolarHBondContact SG-O 3.12Å; C191-W216 HydrophobicContact CB-CD2 4.14Å; C191-W216 HydrophobicContact CB-CG 3.99Å
192	S	79.4	Confident	71.5	Confident	45 Å²	45	79.7 Å²	79.7	32%	0.315	42%	0.419	S	S	.	.			trans	-152.9	165.5	177.3	59.2	0	0	0	0	109.2	L194 L195 R196 C211 G213	S192-L194 PolarHBondContact O-N 3.14Å; S192-L194 VanDerWaalsContact O-N 3.11Å; S192-L195 CarbonylContact O-C 3.59Å; S192-L195 WeakPolarHBondContact O-CA 3.12Å; S192-L195 PolarHBondContact O-N 2.86Å; S192-R196 PolarHBondContact O-N 3.5Å; S192-C211 PolarHBondContact O-SG 2.76Å; S192-C211 VanDerWaalsContact O-SG 3.34Å; S192-G213 CarbonylContact C-O 3Å; S192-G213 VanDerWaalsContact CA-O 3.31Å; S192-G213 WeakPolarHBondContact CA-O 3.17Å
193	E	75.3	Confident	72.5	Confident	123 Å²	123	71.1 Å²	71.1	58%	0.575	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-55.1	-32.7	179.1	-77.6	-63.8	157.9	0	0	112.5	L195 R196 G213	E193-L195 PolarHBondContact O-N 2.77Å; E193-R196 WeakPolarHBondContact O-CB 3.41Å; E193-R196 PolarHBondContact O-N 3.09Å; E193-R196 IonicContact OE2-NH1 2.77Å; E193-G213 PolarHBondContact N-O 3.13Å
194	L	76.3	Confident	73	Confident	160 Å²	160	75.5 Å²	75.5	84%	0.838	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-66.5	-23	175.6	-69.8	163.8	0	0	0	113.7	S192	S192-L194 PolarHBondContact O-N 3.14Å; S192-L194 VanDerWaalsContact O-N 3.11Å
195	L	73.4	Confident	72.9	Confident	12 Å²	12	77.5 Å²	77.5	6%	0.063	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-103.1	2.6	-178.9	-60.8	176.3	0	0	0	112.3	S192 E193 G197 Q198 C211 W216	S192-L195 CarbonylContact O-C 3.59Å; S192-L195 WeakPolarHBondContact O-CA 3.12Å; S192-L195 PolarHBondContact O-N 2.86Å; E193-L195 PolarHBondContact O-N 2.77Å; L195-G197 PolarHBondContact O-N 3.01Å; L195-Q198 VanDerWaalsContact O-CB 3.24Å; L195-Q198 WeakPolarHBondContact O-CB 3.39Å; L195-Q198 WeakPolarHBondContact O-CG 3.36Å; L195-Q198 PolarHBondContact O-N 3.18Å; L195-C211 HydrophobicContact CB-CB 4.28Å; L195-C211 VanDerWaalsContact CB-SG 3.58Å; L195-C211 VanDerWaalsContact O-CB 3.26Å; L195-C211 WeakPolarHBondContact O-CB 3.29Å; L195-C211 PolarHBondContact O-SG 3.31Å; L195-C211 VanDerWaalsContact O-SG 3.39Å; L195-W216 HydrophobicContact CD1-CZ2 4.29Å
196	R	74.8	Confident	72.7	Confident	149 Å²	149	78 Å²	78	56%	0.562	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	129.6	-179.5	-174.9	168.5	-179.3	170.5	2.1	111.4	S192 E193 Q198 C211 D212	S192-R196 PolarHBondContact O-N 3.5Å; E193-R196 WeakPolarHBondContact O-CB 3.41Å; E193-R196 PolarHBondContact O-N 3.09Å; E193-R196 IonicContact OE2-NH1 2.77Å; R196-Q198 PolarHBondContact O-N 3.01Å; R196-C211 CarbonylContact C-O 3.46Å; R196-C211 WeakPolarHBondContact CA-O 3.44Å; R196-D212 VanDerWaalsContact CD-O 3.3Å; R196-D212 WeakPolarHBondContact CD-O 3.44Å; R196-D212 WeakPolarHBondContact CG-O 3.38Å; R196-D212 PolarHBondContact NE-O 3.39Å
197	G	62.8	Low	72.5	Confident	50 Å²	50	76.7 Å²	76.7	52%	0.515	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	-2.7	-176.6	0	0	0	0	0	115.3	L195 C211	L195-G197 PolarHBondContact O-N 3.01Å; G197-C211 PolarHBondContact N-O 2.83Å
198	Q	74.6	Confident	72.9	Confident	88 Å²	88	75.2 Å²	75.2	41%	0.411	38%	0.381	S	S	.	.			trans	-75	149	173.5	-64.9	-161.3	1.3	0	0	111.2	L195 R196 V210 C211 W216	L195-Q198 VanDerWaalsContact O-CB 3.24Å; L195-Q198 WeakPolarHBondContact O-CB 3.39Å; L195-Q198 WeakPolarHBondContact O-CG 3.36Å; L195-Q198 PolarHBondContact O-N 3.18Å; R196-Q198 PolarHBondContact O-N 3.01Å; Q198-V210 WeakPolarHBondContact O-CA 3.19Å; Q198-C211 PolarHBondContact O-N 3.1Å; Q198-C211 VanDerWaalsContact O-N 3.1Å; Q198-W216 VanDerWaalsContact O-CZ3 3.25Å; Q198-W216 WeakPolarHBondContact O-CZ3 3.48Å
199	L	76.6	Confident	73.3	Confident	50 Å²	50	68.9 Å²	68.9	26%	0.262	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	137	172.8	-70.1	168.8	0	0	0	110.3	P183 S184 L208 Y209 V210 V219	P183-L199 WeakPolarHBondContact CA-O 3.43Å; P183-L199 HydrophobicContact CB-CB 4.32Å; S184-L199 PolarHBondContact N-O 2.86Å; S184-L199 PolarHBondContact OG-O 2.83Å; L199-L208 HydrophobicContact CB-CD1 4.14Å; L199-L208 HydrophobicContact CD2-CD1 4.25Å; L199-L208 HydrophobicContact CD2-CD2 4.33Å; L199-L208 HydrophobicContact CD2-CG 4.19Å; L199-Y209 CarbonylContact C-O 3.54Å; L199-Y209 VanDerWaalsContact CA-O 3.29Å; L199-Y209 WeakPolarHBondContact CA-O 3.48Å; L199-V210 HydrophobicContact CD2-CB 3.99Å; L199-V210 HydrophobicContact CD2-CG2 4.33Å; L199-V219 HydrophobicContact CD2-CG2 4.28Å
200	W	81	Confident	73.7	Confident	7 Å²	7	63.5 Å²	63.5	3%	0.027	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.8	173.2	168.1	55.7	0	0	0	109.2	S184 G186 E188 N202 L208 Y209 W216	S184-W200 CarbonylContact O-C 3.49Å; S184-W200 WeakPolarHBondContact O-CA 3.36Å; G186-W200 PolarHBondContact O-NE1 2.77Å; E188-W200 HydrophobicContact CB-CH2 4.48Å; E188-W200 HydrophobicContact CG-CH2 4.36Å; W200-N202 HydrophobicContact CD2-CB 4.42Å; W200-N202 HydrophobicContact CH2-CB 3.78Å; W200-N202 WeakPolarHBondContact CH2-ND2 3.43Å; W200-N202 HydrophobicContact CZ2-CB 3.45Å; W200-N202 VanDerWaalsContact CZ2-CB 3.45Å; W200-N202 WeakPolarHBondContact CZ2-ND2 3.29Å; W200-N202 HydrophobicContact CZ3-CB 4.35Å; W200-L208 CarbonylContact O-C 3.51Å; W200-L208 WeakPolarHBondContact O-CA 3.49Å; W200-Y209 HydrophobicContact CD2-CD2 4.17Å; W200-Y209 AromaticContact CE3-CD2 3.37Å; W200-Y209 HydrophobicContact CE3-CD2 3.37Å; W200-Y209 HydrophobicContact CE3-CE2 4.08Å; W200-Y209 AromaticContact CE3-CG 3.81Å; W200-Y209 HydrophobicContact CE3-CG 3.81Å; W200-Y209 HydrophobicContact CH2-CE2 4.46Å; W200-Y209 AromaticContact CZ3-CD2 3.58Å; W200-Y209 HydrophobicContact CZ3-CD2 3.58Å; W200-Y209 AromaticContact CZ3-CE2 3.85Å; W200-Y209 HydrophobicContact CZ3-CE2 3.85Å; W200-Y209 HydrophobicContact CZ3-CG 4.05Å; W200-Y209 PolarHBondContact N-O 2.87Å; W200-Y209 PolarHBondContact O-N 2.8Å; W200-W216 HydrophobicContact CB-CD2 4.29Å; W200-W216 HydrophobicContact CB-CE3 3.84Å; W200-W216 HydrophobicContact CB-CH2 3.37Å; W200-W216 HydrophobicContact CB-CZ2 3.83Å; W200-W216 HydrophobicContact CB-CZ3 3.34Å; W200-W216 HydrophobicContact CE3-CB 4.48Å; W200-W216 AromaticContact CE3-CD2 3.83Å; W200-W216 HydrophobicContact CE3-CD2 3.83Å; W200-W216 HydrophobicContact CE3-CE3 4.25Å; W200-W216 AromaticContact CE3-CG 3.9Å; W200-W216 HydrophobicContact CE3-CG 3.9Å; W200-W216 HydrophobicContact CG-CH2 4.34Å; W200-W216 HydrophobicContact CG-CZ2 4.35Å; W200-W216 HydrophobicContact CG-CZ3 4.49Å; W200-W216 HydrophobicContact CZ3-CG 4.22Å
201	F	78.6	Confident	73.7	Confident	73 Å²	73	58.4 Å²	58.4	32%	0.32	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.9	169.6	-179.9	-106.7	0	0	0	108.7	P183 S184 V185 G186 P203 G207 L208	P183-F201 HydrophobicContact CB-CB 4.09Å; S184-F201 PolarHBondContact O-N 2.77Å; V185-F201 WeakPolarHBondContact CA-O 3.34Å; V185-F201 HydrophobicContact CG1-CD1 4.23Å; V185-F201 HydrophobicContact CG2-CB 4.42Å; V185-F201 HydrophobicContact CG2-CD1 4.47Å; G186-F201 PolarHBondContact N-O 2.82Å; F201-P203 HydrophobicContact CD1-CG 4.25Å; F201-P203 HydrophobicContact CE1-CB 4.28Å; F201-P203 HydrophobicContact CE1-CG 4.23Å; F201-P203 WeakPolarHBondContact O-CD 3.37Å; F201-G207 CarbonylContact C-O 3.58Å; F201-G207 WeakPolarHBondContact CA-O 3.2Å; F201-G207 WeakPolarHBondContact CD2-O 3.42Å; F201-L208 HydrophobicContact CB-CD1 4.19Å; F201-L208 HydrophobicContact CD2-CB 4.46Å
202	N	75.3	Confident	73.2	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	109.6	173.1	-172.5	-31.4	0	0	0	109.4	W200 L204 K205 K206 G207 Y209	W200-N202 HydrophobicContact CD2-CB 4.42Å; W200-N202 HydrophobicContact CH2-CB 3.78Å; W200-N202 WeakPolarHBondContact CH2-ND2 3.43Å; W200-N202 HydrophobicContact CZ2-CB 3.45Å; W200-N202 VanDerWaalsContact CZ2-CB 3.45Å; W200-N202 WeakPolarHBondContact CZ2-ND2 3.29Å; W200-N202 HydrophobicContact CZ3-CB 4.35Å; N202-L204 VanDerWaalsContact C-N 3.27Å; N202-L204 PolarHBondContact O-N 3.02Å; N202-L204 WeakPolarHBondContact OD1-CA 2.92Å; N202-L204 WeakPolarHBondContact OD1-CB 3.21Å; N202-L204 PolarHBondContact OD1-N 3.11Å; N202-K205 HydrophobicContact CB-CB 4.07Å; N202-K205 WeakPolarHBondContact ND2-CG 3.33Å; N202-K205 PolarHBondContact O-N 3.23Å; N202-K205 PolarHBondContact OD1-N 3.01Å; N202-K206 WeakPolarHBondContact O-CA 3.4Å; N202-K206 PolarHBondContact O-N 2.73Å; N202-G207 PolarHBondContact N-O 3.24Å; N202-G207 PolarHBondContact O-N 2.92Å; N202-G207 VanDerWaalsContact O-N 3.09Å; N202-Y209 HydrophobicContact CB-CD2 4.47Å; N202-Y209 HydrophobicContact CB-CE2 3.86Å
203	P	68.3	Low	72.6	Confident	60 Å²	60	57.9 Å²	57.9	39%	0.39	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-25.5	179.8	-18.9	33.1	0	0	0	113.6	V185 G186 F201	V185-P203 HydrophobicContact CG1-CG 3.55Å; G186-P203 WeakPolarHBondContact O-CD 3.37Å; F201-P203 HydrophobicContact CD1-CG 4.25Å; F201-P203 HydrophobicContact CE1-CB 4.28Å; F201-P203 HydrophobicContact CE1-CG 4.23Å; F201-P203 WeakPolarHBondContact O-CD 3.37Å
204	L	66.9	Low	72.4	Confident	148 Å²	148	56.4 Å²	56.4	78%	0.775	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-41	-179.9	-64.1	170.4	0	0	0	111.6	A187 N202 K206	A187-L204 HydrophobicContact CB-CD1 4.46Å; N202-L204 VanDerWaalsContact C-N 3.27Å; N202-L204 PolarHBondContact O-N 3.02Å; N202-L204 WeakPolarHBondContact OD1-CA 2.92Å; N202-L204 WeakPolarHBondContact OD1-CB 3.21Å; N202-L204 PolarHBondContact OD1-N 3.11Å; L204-K206 VanDerWaalsContact C-N 3.26Å
205	K	64.2	Low	72.3	Confident	77 Å²	77	50.8 Å²	50.8	34%	0.335	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-7.1	171.9	-61.9	-175.3	-174.5	-179.2	0	112.6	E188 N202 G207 Y209 E221	E188-K205 IonicContact OE1-NZ 3.38Å; E188-K205 PolarHBondContact OE1-NZ 2.88Å; N202-K205 HydrophobicContact CB-CB 4.07Å; N202-K205 WeakPolarHBondContact ND2-CG 3.33Å; N202-K205 PolarHBondContact O-N 3.23Å; N202-K205 PolarHBondContact OD1-N 3.01Å; K205-G207 PolarHBondContact O-N 2.79Å; K205-G207 VanDerWaalsContact O-N 3.14Å; K205-Y209 WeakPolarHBondContact CB-OH 3.31Å; K205-Y209 VanDerWaalsContact CD-OH 3.25Å; K205-Y209 WeakPolarHBondContact CD-OH 3.34Å; K205-E221 WeakPolarHBondContact O-CG 3.48Å
206	K	65.7	Low	72.3	Confident	112 Å²	112	52.2 Å²	52.2	49%	0.487	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.8	42.6	-167.3	-54.6	157.2	173.6	178.7	0	112.2	N202 L204 D222	N202-K206 WeakPolarHBondContact O-CA 3.4Å; N202-K206 PolarHBondContact O-N 2.73Å; L204-K206 VanDerWaalsContact C-N 3.26Å; K206-D222 HydrophobicContact CB-CB 3.99Å; K206-D222 HydrophobicContact CD-CB 3.95Å; K206-D222 WeakPolarHBondContact CD-OD2 3.33Å; K206-D222 WeakPolarHBondContact CE-OD2 3.17Å; K206-D222 IonicContact NZ-OD1 3.28Å; K206-D222 IonicContact NZ-OD2 3.87Å; K206-D222 PolarHBondContact NZ-OD2 3.47Å; K206-D222 PolarHBondContact O-N 3.15Å
207	G	69.1	Low	71.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143	-175.8	0	0	0	0	0	114	F201 N202 K205 Y209 L220	F201-G207 CarbonylContact C-O 3.58Å; F201-G207 WeakPolarHBondContact CA-O 3.2Å; F201-G207 WeakPolarHBondContact CD2-O 3.42Å; N202-G207 PolarHBondContact N-O 3.24Å; N202-G207 PolarHBondContact O-N 2.92Å; N202-G207 VanDerWaalsContact O-N 3.09Å; K205-G207 PolarHBondContact O-N 2.79Å; K205-G207 VanDerWaalsContact O-N 3.14Å; G207-Y209 WeakPolarHBondContact O-CD2 3.3Å; G207-Y209 WeakPolarHBondContact O-CE2 3.08Å; G207-L220 CarbonylContact C-O 3.57Å; G207-L220 VanDerWaalsContact C-O 3.26Å; G207-L220 WeakPolarHBondContact CA-O 3.49Å
208	L	75.8	Confident	72.1	Confident	38 Å²	38	47.3 Å²	47.3	20%	0.199	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	130.3	167.9	-173.1	67.5	0	0	0	109.6	P183 L199 W200 F201 V219 L220	P183-L208 HydrophobicContact CB-CD1 4.15Å; P183-L208 HydrophobicContact CG-CD1 4.3Å; L199-L208 HydrophobicContact CB-CD1 4.14Å; L199-L208 HydrophobicContact CD2-CD1 4.25Å; L199-L208 HydrophobicContact CD2-CD2 4.33Å; L199-L208 HydrophobicContact CD2-CG 4.19Å; W200-L208 CarbonylContact O-C 3.51Å; W200-L208 WeakPolarHBondContact O-CA 3.49Å; F201-L208 HydrophobicContact CB-CD1 4.19Å; F201-L208 HydrophobicContact CD2-CB 4.46Å; L208-V219 HydrophobicContact CB-CB 4.38Å; L208-V219 HydrophobicContact CD2-CB 4.24Å; L208-V219 HydrophobicContact CD2-CG1 3.97Å; L208-V219 HydrophobicContact CG-CB 4.15Å; L208-V219 HydrophobicContact CG-CG1 4.43Å; L208-V219 WeakPolarHBondContact O-CA 3.02Å; L208-V219 WeakPolarHBondContact O-CB 3.43Å; L208-V219 PolarHBondContact O-N 2.83Å; L208-L220 HydrophobicContact CB-CB 3.98Å; L208-L220 PolarHBondContact N-O 2.86Å; L208-L220 PolarHBondContact O-N 2.92Å; L208-L220 VanDerWaalsContact O-O 3.11Å
209	Y	75.3	Confident	71.7	Confident	10 Å²	10	45.5 Å²	45.5	4%	0.039	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.8	179	-52.6	-95.6	0	0	0	110.2	L199 W200 N202 K205 G207 W216 I217 T218 E221	L199-Y209 CarbonylContact C-O 3.54Å; L199-Y209 VanDerWaalsContact CA-O 3.29Å; L199-Y209 WeakPolarHBondContact CA-O 3.48Å; W200-Y209 HydrophobicContact CD2-CD2 4.17Å; W200-Y209 AromaticContact CE3-CD2 3.37Å; W200-Y209 HydrophobicContact CE3-CD2 3.37Å; W200-Y209 HydrophobicContact CE3-CE2 4.08Å; W200-Y209 AromaticContact CE3-CG 3.81Å; W200-Y209 HydrophobicContact CE3-CG 3.81Å; W200-Y209 HydrophobicContact CH2-CE2 4.46Å; W200-Y209 AromaticContact CZ3-CD2 3.58Å; W200-Y209 HydrophobicContact CZ3-CD2 3.58Å; W200-Y209 AromaticContact CZ3-CE2 3.85Å; W200-Y209 HydrophobicContact CZ3-CE2 3.85Å; W200-Y209 HydrophobicContact CZ3-CG 4.05Å; W200-Y209 PolarHBondContact N-O 2.87Å; W200-Y209 PolarHBondContact O-N 2.8Å; N202-Y209 HydrophobicContact CB-CD2 4.47Å; N202-Y209 HydrophobicContact CB-CE2 3.86Å; K205-Y209 WeakPolarHBondContact CB-OH 3.31Å; K205-Y209 VanDerWaalsContact CD-OH 3.25Å; K205-Y209 WeakPolarHBondContact CD-OH 3.34Å; G207-Y209 WeakPolarHBondContact O-CD2 3.3Å; G207-Y209 WeakPolarHBondContact O-CE2 3.08Å; Y209-W216 HydrophobicContact CD1-CB 4.38Å; Y209-W216 HydrophobicContact CG-CB 4.36Å; Y209-I217 CarbonylContact C-O 3.54Å; Y209-I217 WeakPolarHBondContact CA-O 3.46Å; Y209-T218 HydrophobicContact CD1-CG2 4.02Å; Y209-T218 HydrophobicContact CE1-CG2 3.74Å; Y209-T218 WeakPolarHBondContact CE1-OG1 3.43Å; Y209-E221 PolarHBondContact OH-OE1 2.63Å; Y209-E221 VanDerWaalsContact OH-OE1 3.12Å; Y209-E221 PolarHBondContact OH-OE2 3.06Å
210	V	79.3	Confident	71	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.024	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.4	172.2	64.2	0	0	0	0	109.9	L159 Q198 L199 I217 V219	L159-V210 HydrophobicContact CB-CG1 4.43Å; L159-V210 HydrophobicContact CD1-CB 4.35Å; L159-V210 HydrophobicContact CD1-CG1 3.64Å; L159-V210 HydrophobicContact CD1-CG2 4.06Å; Q198-V210 WeakPolarHBondContact O-CA 3.19Å; L199-V210 HydrophobicContact CD2-CB 3.99Å; L199-V210 HydrophobicContact CD2-CG2 4.33Å; V210-I217 HydrophobicContact CG1-CB 4Å; V210-I217 PolarHBondContact N-O 2.82Å; V210-I217 WeakPolarHBondContact O-CB 3.33Å; V210-I217 PolarHBondContact O-N 3.03Å; V210-V219 HydrophobicContact CB-CG2 3.71Å; V210-V219 HydrophobicContact CG1-CG2 3.51Å
211	C	75.1	Confident	70.1	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.7	-176.3	167.5	0	0	0	0	111.3	L159 C191 S192 L195 R196 G197 Q198 A215 W216	L159-C211 WeakPolarHBondContact CD1-O 3.5Å; C191-C211 HydrophobicContact CB-CB 3.86Å; C191-C211 WeakPolarHBondContact CB-SG 3.29Å; C191-C211 WeakPolarHBondContact SG-CA 3.42Å; C191-C211 WeakPolarHBondContact SG-CB 3.4Å; C191-C211 CovalentContact SG-SG 2.02Å; C191-C211 PolarHBondContact SG-SG 2.97Å; S192-C211 PolarHBondContact O-SG 2.76Å; S192-C211 VanDerWaalsContact O-SG 3.34Å; L195-C211 HydrophobicContact CB-CB 4.28Å; L195-C211 VanDerWaalsContact CB-SG 3.58Å; L195-C211 VanDerWaalsContact O-CB 3.26Å; L195-C211 WeakPolarHBondContact O-CB 3.29Å; L195-C211 PolarHBondContact O-SG 3.31Å; L195-C211 VanDerWaalsContact O-SG 3.39Å; R196-C211 CarbonylContact C-O 3.46Å; R196-C211 WeakPolarHBondContact CA-O 3.44Å; G197-C211 PolarHBondContact N-O 2.83Å; Q198-C211 PolarHBondContact O-N 3.1Å; Q198-C211 VanDerWaalsContact O-N 3.1Å; C211-A215 WeakPolarHBondContact CA-O 3.48Å; C211-W216 HydrophobicContact CB-CD2 3.96Å; C211-W216 HydrophobicContact CB-CE3 3.58Å; C211-W216 HydrophobicContact CB-CH2 3.66Å; C211-W216 HydrophobicContact CB-CZ2 4.05Å; C211-W216 HydrophobicContact CB-CZ3 3.44Å; C211-W216 VanDerWaalsContact CB-CZ3 3.44Å; C211-W216 VanDerWaalsContact N-CE3 3.33Å
212	D	69.8	Low	69	Low	45 Å²	45	50.5 Å²	50.5	24%	0.241	28%	0.275	C	S	.	.			trans	-90.6	-3.7	179.3	72.6	5.4	0	0	0	115.1	L159 C191 R196 S214 A215 I217	L159-D212 VanDerWaalsContact CD1-CA 3.49Å; L159-D212 HydrophobicContact CD1-CB 3.5Å; L159-D212 VanDerWaalsContact CD1-CB 3.5Å; L159-D212 VanDerWaalsContact CD2-CA 3.48Å; L159-D212 HydrophobicContact CD2-CB 3.69Å; L159-D212 HydrophobicContact CG-CB 3.75Å; C191-D212 PolarHBondContact SG-N 2.76Å; R196-D212 VanDerWaalsContact CD-O 3.3Å; R196-D212 WeakPolarHBondContact CD-O 3.44Å; R196-D212 WeakPolarHBondContact CG-O 3.38Å; R196-D212 PolarHBondContact NE-O 3.39Å; D212-S214 WeakPolarHBondContact OD1-CA 3.4Å; D212-S214 PolarHBondContact OD1-N 3.06Å; D212-S214 PolarHBondContact OD1-OG 2.91Å; D212-A215 PolarHBondContact N-O 3.49Å; D212-A215 PolarHBondContact OD1-N 3.35Å; D212-I217 HydrophobicContact CB-CD1 4.5Å; D212-I217 HydrophobicContact CB-CG1 4.1Å
213	G	67.4	Low	68.2	Low	5 Å²	5	54.7 Å²	54.7	5%	0.052	29%	0.294	C	S	.	.	S	Bend	trans	106.5	-17.3	-170.5	0	0	0	0	0	112.8	C191 S192 E193	C191-G213 PolarHBondContact SG-N 2.86Å; C191-G213 VanDerWaalsContact SG-N 3.43Å; S192-G213 CarbonylContact C-O 3Å; S192-G213 VanDerWaalsContact CA-O 3.31Å; S192-G213 WeakPolarHBondContact CA-O 3.17Å; E193-G213 PolarHBondContact N-O 3.13Å
214	S	70.1	Confident	67.8	Low	92 Å²	92	57.2 Å²	57.2	64%	0.643	30%	0.299	S	S	*	.	S	Bend	trans	-130.2	-39.7	179.3	69.9	0	0	0	0	113.5	C191 D212	C191-S214 VanDerWaalsContact SG-C 3.59Å; C191-S214 PolarHBondContact SG-N 3.43Å; C191-S214 VanDerWaalsContact SG-N 3.44Å; D212-S214 WeakPolarHBondContact OD1-CA 3.4Å; D212-S214 PolarHBondContact OD1-N 3.06Å; D212-S214 PolarHBondContact OD1-OG 2.91Å
215	A	73.6	Confident	68	Low	43 Å²	43	55.5 Å²	55.5	36%	0.355	28%	0.282	S	S	.	.	S	Bend	trans	-138.2	154.6	-175.2	0	0	0	0	0	112.2	C191 C211 D212	C191-A215 VanDerWaalsContact CB-C 3.42Å; C191-A215 PolarHBondContact SG-N 2.73Å; C191-A215 PolarHBondContact SG-O 3.12Å; C211-A215 WeakPolarHBondContact CA-O 3.48Å; D212-A215 PolarHBondContact N-O 3.49Å; D212-A215 PolarHBondContact OD1-N 3.35Å
216	W	73.6	Confident	69	Low	41 Å²	41	52.5 Å²	52.5	16%	0.155	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.5	169.9	-73	108.8	0	0	0	109.7	R189 C191 L195 Q198 W200 Y209 C211	R189-W216 PolarHBondContact O-NE1 2.74Å; C191-W216 HydrophobicContact CB-CD2 4.14Å; C191-W216 HydrophobicContact CB-CG 3.99Å; L195-W216 HydrophobicContact CD1-CZ2 4.29Å; Q198-W216 VanDerWaalsContact O-CZ3 3.25Å; Q198-W216 WeakPolarHBondContact O-CZ3 3.48Å; W200-W216 HydrophobicContact CB-CD2 4.29Å; W200-W216 HydrophobicContact CB-CE3 3.84Å; W200-W216 HydrophobicContact CB-CH2 3.37Å; W200-W216 HydrophobicContact CB-CZ2 3.83Å; W200-W216 HydrophobicContact CB-CZ3 3.34Å; W200-W216 HydrophobicContact CE3-CB 4.48Å; W200-W216 AromaticContact CE3-CD2 3.83Å; W200-W216 HydrophobicContact CE3-CD2 3.83Å; W200-W216 HydrophobicContact CE3-CE3 4.25Å; W200-W216 AromaticContact CE3-CG 3.9Å; W200-W216 HydrophobicContact CE3-CG 3.9Å; W200-W216 HydrophobicContact CG-CH2 4.34Å; W200-W216 HydrophobicContact CG-CZ2 4.35Å; W200-W216 HydrophobicContact CG-CZ3 4.49Å; W200-W216 HydrophobicContact CZ3-CG 4.22Å; Y209-W216 HydrophobicContact CD1-CB 4.38Å; Y209-W216 HydrophobicContact CG-CB 4.36Å; C211-W216 HydrophobicContact CB-CD2 3.96Å; C211-W216 HydrophobicContact CB-CE3 3.58Å; C211-W216 HydrophobicContact CB-CH2 3.66Å; C211-W216 HydrophobicContact CB-CZ2 4.05Å; C211-W216 HydrophobicContact CB-CZ3 3.44Å; C211-W216 VanDerWaalsContact CB-CZ3 3.44Å; C211-W216 VanDerWaalsContact N-CE3 3.33Å
217	I	66.9	Low	69.7	Low	53 Å²	53	51.4 Å²	51.4	27%	0.272	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.9	175.8	-49.9	-56.4	0	0	0	108.5	P157 L159 Y209 V210 D212 V219	P157-I217 HydrophobicContact CB-CG2 3.99Å; P157-I217 HydrophobicContact CG-CG2 4.48Å; L159-I217 HydrophobicContact CD1-CB 4.34Å; L159-I217 HydrophobicContact CD1-CG1 3.79Å; Y209-I217 CarbonylContact C-O 3.54Å; Y209-I217 WeakPolarHBondContact CA-O 3.46Å; V210-I217 HydrophobicContact CG1-CB 4Å; V210-I217 PolarHBondContact N-O 2.82Å; V210-I217 WeakPolarHBondContact O-CB 3.33Å; V210-I217 PolarHBondContact O-N 3.03Å; D212-I217 HydrophobicContact CB-CD1 4.5Å; D212-I217 HydrophobicContact CB-CG1 4.1Å; I217-V219 PolarHBondContact O-N 3.26Å
218	T	68.2	Low	70.5	Confident	44 Å²	44	56.3 Å²	56.3	27%	0.27	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.3	180	-43.4	0	0	0	0	111.2	Y209 E221 E517	Y209-T218 HydrophobicContact CD1-CG2 4.02Å; Y209-T218 HydrophobicContact CE1-CG2 3.74Å; Y209-T218 WeakPolarHBondContact CE1-OG1 3.43Å; T218-E221 HydrophobicContact CG2-CB 3.79Å; T218-E517 WeakPolarHBondContact CB-OE1 3.46Å; T218-E517 WeakPolarHBondContact CG2-OE1 3.38Å
219	V	66.1	Low	71.3	Confident	50 Å²	50	55.7 Å²	55.7	30%	0.303	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-35.9	176.5	-177.8	0	0	0	0	110.4	L199 L208 V210 I217	L199-V219 HydrophobicContact CD2-CG2 4.28Å; L208-V219 HydrophobicContact CB-CB 4.38Å; L208-V219 HydrophobicContact CD2-CB 4.24Å; L208-V219 HydrophobicContact CD2-CG1 3.97Å; L208-V219 HydrophobicContact CG-CB 4.15Å; L208-V219 HydrophobicContact CG-CG1 4.43Å; L208-V219 WeakPolarHBondContact O-CA 3.02Å; L208-V219 WeakPolarHBondContact O-CB 3.43Å; L208-V219 PolarHBondContact O-N 2.83Å; V210-V219 HydrophobicContact CB-CG2 3.71Å; V210-V219 HydrophobicContact CG1-CG2 3.51Å; I217-V219 PolarHBondContact O-N 3.26Å
220	L	61.5	Low	72.2	Confident	94 Å²	94	58.6 Å²	58.6	49%	0.492	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	135.5	176.9	-164.4	108.5	0	0	0	107.6	G207 L208	G207-L220 CarbonylContact C-O 3.57Å; G207-L220 VanDerWaalsContact C-O 3.26Å; G207-L220 WeakPolarHBondContact CA-O 3.49Å; L208-L220 HydrophobicContact CB-CB 3.98Å; L208-L220 PolarHBondContact N-O 2.86Å; L208-L220 PolarHBondContact O-N 2.92Å; L208-L220 VanDerWaalsContact O-O 3.11Å
221	E	62.5	Low	73	Confident	58 Å²	58	63.3 Å²	63.3	27%	0.271	32%	0.323	S	S	.	.			trans	-139.8	162.7	172.3	-169.3	166.6	173.5	0	0	110.8	K205 Y209 T218 H223	K205-E221 WeakPolarHBondContact O-CG 3.48Å; Y209-E221 PolarHBondContact OH-OE1 2.63Å; Y209-E221 VanDerWaalsContact OH-OE1 3.12Å; Y209-E221 PolarHBondContact OH-OE2 3.06Å; T218-E221 HydrophobicContact CG2-CB 3.79Å; E221-H223 PolarHBondContact O-N 2.78Å
222	D	53.7	Low	74	Confident	83 Å²	83	67.8 Å²	67.8	44%	0.444	34%	0.344	S	S	.	.			trans	-53.3	116.9	172.8	-144.6	21.1	0	0	0	108.4	K206 K224	K206-D222 HydrophobicContact CB-CB 3.99Å; K206-D222 HydrophobicContact CD-CB 3.95Å; K206-D222 WeakPolarHBondContact CD-OD2 3.33Å; K206-D222 WeakPolarHBondContact CE-OD2 3.17Å; K206-D222 IonicContact NZ-OD1 3.28Å; K206-D222 IonicContact NZ-OD2 3.87Å; K206-D222 PolarHBondContact NZ-OD2 3.47Å; K206-D222 PolarHBondContact O-N 3.15Å; D222-K224 PolarHBondContact O-N 2.69Å; D222-K224 VanDerWaalsContact O-N 3.12Å
223	H	59	Low	75.3	Confident	91 Å²	91	66.7 Å²	66.7	42%	0.421	34%	0.338	S	S	.	.			trans	-72.9	108.8	-172.6	-62.9	-64.2	0	0	0	109.4	E221 R225	E221-H223 PolarHBondContact O-N 2.78Å; H223-R225 HydrophobicContact CB-CB 4.44Å; H223-R225 PolarHBondContact O-N 3.44Å
224	K	59.9	Low	76.8	Confident	113 Å²	113	70.1 Å²	70.1	49%	0.491	36%	0.358	S	S	.	.			trans	-67.9	72	153.7	-73.6	-167.8	-178.7	-174.6	0	109	D222 T589 Y590	D222-K224 PolarHBondContact O-N 2.69Å; D222-K224 VanDerWaalsContact O-N 3.12Å; K224-T589 HydrophobicContact CB-CG2 4.08Å; K224-Y590 WeakPolarHBondContact CA-O 3.41Å
225	R	72.4	Confident	78.1	Confident	113 Å²	113	66.4 Å²	66.4	43%	0.426	33%	0.331	S	S	.	.			trans	-80.3	136.5	174.3	175.6	-179.1	179.1	-162	-3.5	108.6	H223 D227 E518 T589 Y590	H223-R225 HydrophobicContact CB-CB 4.44Å; H223-R225 PolarHBondContact O-N 3.44Å; R225-D227 PolarHBondContact O-N 2.9Å; R225-D227 VanDerWaalsContact O-N 3.16Å; R225-E518 WeakPolarHBondContact CA-OE2 3.3Å; R225-E518 WeakPolarHBondContact CG-OE2 3.47Å; R225-T589 VanDerWaalsContact O-CA 3.27Å; R225-T589 WeakPolarHBondContact O-CA 3.08Å; R225-Y590 HydrophobicContact CB-CD1 4.15Å; R225-Y590 HydrophobicContact CB-CE1 3.51Å; R225-Y590 HydrophobicContact CB-CE2 4.04Å; R225-Y590 VanDerWaalsContact CB-CZ 3.45Å; R225-Y590 WeakPolarHBondContact CD-OH 3.49Å; R225-Y590 HydrophobicContact CG-CE1 3.73Å; R225-Y590 PolarHBondContact NH1-OH 3.01Å; R225-Y590 PolarHBondContact O-N 2.93Å; R225-Y590 VanDerWaalsContact O-N 3.16Å
226	L	83.6	Confident	79.2	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.068	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	117.8	172.4	-177.9	66	0	0	0	109.5	V229 L515 E518 F520 L538 L587	L226-V229 HydrophobicContact CD1-CG2 4.39Å; L226-V229 HydrophobicContact CD2-CG2 4.18Å; L226-L515 HydrophobicContact CB-CD1 4.02Å; L226-L515 HydrophobicContact CD1-CD1 3.95Å; L226-L515 HydrophobicContact CG-CD1 4.43Å; L226-E518 PolarHBondContact N-OE2 3.43Å; L226-F520 HydrophobicContact CB-CE1 4.18Å; L226-F520 HydrophobicContact CB-CZ 3.81Å; L226-F520 HydrophobicContact CD2-CE1 3.93Å; L226-F520 HydrophobicContact CD2-CZ 4.31Å; L226-L538 HydrophobicContact CD2-CD2 3.49Å; L226-L538 VanDerWaalsContact CD2-CD2 3.49Å; L226-L587 HydrophobicContact CD1-CB 3.91Å; L226-L587 HydrophobicContact CD1-CD2 4.26Å
227	D	81.3	Confident	80.3	Confident	90 Å²	90	67 Å²	67	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-59.2	176.5	-167.9	10.1	0	0	0	109.5	R225 K588 Y590	R225-D227 PolarHBondContact O-N 2.9Å; R225-D227 VanDerWaalsContact O-N 3.16Å; D227-K588 PolarHBondContact N-O 3.01Å; D227-Y590 HydrophobicContact CB-CD1 4.13Å
228	Y	85.1	Confident	81.6	Confident	103 Å²	103	67.6 Å²	67.6	40%	0.404	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	162.3	178.1	54.6	-88.4	0	0	0	112.3	L230 K588	Y228-L230 HydrophobicContact CD2-CD1 4.35Å; Y228-L230 HydrophobicContact CD2-CD2 3.63Å; Y228-L230 HydrophobicContact CD2-CG 3.61Å; Y228-L230 HydrophobicContact CE2-CD1 3.66Å; Y228-L230 HydrophobicContact CE2-CD2 3.56Å; Y228-L230 HydrophobicContact CE2-CG 3.43Å; Y228-L230 VanDerWaalsContact CE2-CG 3.43Å; Y228-K588 HydrophobicContact CD2-CB 4.24Å; Y228-K588 HydrophobicContact CD2-CG 4.36Å; Y228-K588 HydrophobicContact CE1-CB 4.29Å; Y228-K588 HydrophobicContact CE2-CB 3.96Å; Y228-K588 HydrophobicContact CE2-CG 3.78Å; Y228-K588 PolarHBondContact O-N 2.82Å
229	V	93.6	Very high	82.9	Confident	25 Å²	25	65.9 Å²	65.9	15%	0.152	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.3	177.8	-177.2	0	0	0	0	108.8	L226 L538 L553 F585 L587	L226-V229 HydrophobicContact CD1-CG2 4.39Å; L226-V229 HydrophobicContact CD2-CG2 4.18Å; V229-L538 HydrophobicContact CG2-CD2 4.33Å; V229-L553 HydrophobicContact CB-CD2 4.24Å; V229-L553 HydrophobicContact CG1-CD2 3.96Å; V229-F585 HydrophobicContact CG1-CB 3.56Å; V229-F585 HydrophobicContact CG1-CD1 3.87Å; V229-F585 HydrophobicContact CG1-CG 3.95Å; V229-L587 HydrophobicContact CG1-CD2 4.16Å; V229-L587 HydrophobicContact CG2-CD2 3.94Å
230	L	94.1	Very high	84.4	Confident	70 Å²	70	65.4 Å²	65.4	37%	0.366	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.2	178.7	-71.7	-179.8	0	0	0	111.5	Y228 Q232 F585 K586 K588	Y228-L230 HydrophobicContact CD2-CD1 4.35Å; Y228-L230 HydrophobicContact CD2-CD2 3.63Å; Y228-L230 HydrophobicContact CD2-CG 3.61Å; Y228-L230 HydrophobicContact CE2-CD1 3.66Å; Y228-L230 HydrophobicContact CE2-CD2 3.56Å; Y228-L230 HydrophobicContact CE2-CG 3.43Å; Y228-L230 VanDerWaalsContact CE2-CG 3.43Å; L230-Q232 PolarHBondContact O-N 2.86Å; L230-Q232 VanDerWaalsContact O-N 3.11Å; L230-F585 CarbonylContact O-C 3.47Å; L230-F585 WeakPolarHBondContact O-CA 3.14Å; L230-K586 HydrophobicContact CB-CB 4.42Å; L230-K586 PolarHBondContact N-O 2.92Å; L230-K586 PolarHBondContact O-N 2.98Å; L230-K588 HydrophobicContact CD1-CG 4.02Å; L230-K588 HydrophobicContact CG-CG 4.41Å
231	E	95.7	Very high	86.2	Confident	103 Å²	103	61 Å²	61	48%	0.481	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	113.4	165.8	-169.2	-179.7	99.7	0	0	109.1	V234 K583 F585	E231-V234 HydrophobicContact CG-CG2 4.39Å; E231-V234 WeakPolarHBondContact OE1-CG2 3.35Å; E231-K583 VanDerWaalsContact OE2-CD 3.28Å; E231-K583 WeakPolarHBondContact OE2-CD 3.14Å; E231-K583 WeakPolarHBondContact OE2-CE 3.3Å; E231-K583 IonicContact OE2-NZ 3.65Å; E231-K583 PolarHBondContact OE2-NZ 2.99Å; E231-F585 HydrophobicContact CB-CD1 4.15Å; E231-F585 HydrophobicContact CB-CE1 4.04Å; E231-F585 HydrophobicContact CG-CE1 4.24Å
232	Q	95.7	Very high	87.8	Confident	95 Å²	95	60.7 Å²	60.7	44%	0.444	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-35.3	-176	179.2	66.8	45.2	0	0	111.3	L230 F571 V584 K586	L230-Q232 PolarHBondContact O-N 2.86Å; L230-Q232 VanDerWaalsContact O-N 3.11Å; Q232-F571 HydrophobicContact CG-CE1 4.21Å; Q232-V584 HydrophobicContact CB-CG1 4.47Å; Q232-V584 PolarHBondContact N-O 2.88Å; Q232-K586 HydrophobicContact CB-CB 4.13Å
233	Q	97.8	Very high	90	Very high	22 Å²	22	57.8 Å²	57.8	10%	0.103	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	134.6	-177.7	-177.3	-178.4	8.8	0	0	110.8	L235 G276 F277 K583 V584	Q233-L235 HydrophobicContact CG-CB 4.44Å; Q233-G276 VanDerWaalsContact OE1-CA 3.29Å; Q233-F277 PolarHBondContact NE2-O 3.38Å; Q233-K583 CarbonylContact O-C 3.59Å; Q233-K583 VanDerWaalsContact O-CA 3.3Å; Q233-K583 WeakPolarHBondContact O-CA 3.37Å; Q233-V584 HydrophobicContact CB-CB 4Å; Q233-V584 HydrophobicContact CB-CG2 4.14Å; Q233-V584 PolarHBondContact N-O 2.85Å; Q233-V584 VanDerWaalsContact N-O 3.15Å; Q233-V584 PolarHBondContact O-N 3.3Å
234	V	97.8	Very high	91.9	Very high	77 Å²	77	53.5 Å²	53.5	47%	0.467	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	114.1	157.3	-176	0	0	0	0	107.4	E231 F581 K583	E231-V234 HydrophobicContact CG-CG2 4.39Å; E231-V234 WeakPolarHBondContact OE1-CG2 3.35Å; V234-F581 HydrophobicContact CG1-CB 4.35Å; V234-F581 HydrophobicContact CG1-CD2 4.34Å; V234-F581 HydrophobicContact CG1-CG 4.45Å; V234-K583 HydrophobicContact CG1-CG 4.44Å; V234-K583 HydrophobicContact CG2-CD 4.24Å; V234-K583 HydrophobicContact CG2-CG 4.26Å
235	L	97.7	Very high	93.7	Very high	14 Å²	14	49.3 Å²	49.3	7%	0.073	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	110.4	-178.9	177.4	67.2	0	0	0	109.3	Q233 T237 M258 Y270 F277 F581 S582	Q233-L235 HydrophobicContact CG-CB 4.44Å; L235-T237 PolarHBondContact O-N 3.44Å; L235-M258 HydrophobicContact CD2-CE 3.66Å; L235-M258 HydrophobicContact CD2-SD 3.97Å; L235-Y270 HydrophobicContact CD1-CD1 4.04Å; L235-Y270 HydrophobicContact CD1-CE1 3.91Å; L235-Y270 HydrophobicContact CD2-CD1 3.89Å; L235-Y270 HydrophobicContact CD2-CE1 3.95Å; L235-Y270 HydrophobicContact CD2-CG 4.27Å; L235-Y270 HydrophobicContact CG-CD1 4.49Å; L235-Y270 HydrophobicContact CG-CE1 4.24Å; L235-F277 HydrophobicContact CD2-CB 4.05Å; L235-F581 CarbonylContact O-C 3.56Å; L235-F581 WeakPolarHBondContact O-CA 3.46Å; L235-F581 WeakPolarHBondContact O-CB 3.12Å; L235-S582 PolarHBondContact N-O 3.37Å; L235-S582 PolarHBondContact O-N 3.2Å
236	A	97.1	Very high	94.9	Very high	82 Å²	82	44.9 Å²	44.9	68%	0.678	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.7	169.6	0	0	0	0	0	110.2
237	T	96.6	Very high	95.6	Very high	15 Å²	15	44.6 Å²	44.6	9%	0.092	24%	0.241	C	C	.	.			trans	-110	162.1	177	56	0	0	0	0	109.8	L235 S239 M258 P580 F581	L235-T237 PolarHBondContact O-N 3.44Å; T237-S239 WeakPolarHBondContact CB-O 3.45Å; T237-S239 PolarHBondContact O-N 3.17Å; T237-S239 PolarHBondContact OG1-O 2.88Å; T237-M258 HydrophobicContact CG2-SD 3.84Å; T237-P580 PolarHBondContact N-O 3.27Å; T237-P580 WeakPolarHBondContact OG1-CA 3.48Å; T237-P580 PolarHBondContact OG1-O 2.84Å; T237-F581 PolarHBondContact OG1-N 3.03Å
238	S	94.3	Very high	96.4	Very high	64 Å²	64	45.2 Å²	45.2	45%	0.448	24%	0.241	S	C	.	.	S	Bend	trans	-77.8	-9	-179.8	54	0	0	0	0	113.8	H260	S238-H260 PolarHBondContact OG-CE1 2.75Å; S238-H260 PolarHBondContact OG-ND1 2.75Å
239	S	96.3	Very high	97	Very high	8 Å²	8	40.5 Å²	40.5	6%	0.056	22%	0.223	C	C	.	.	S	Bend	trans	-160.9	169.1	175.5	-154.1	0	0	0	0	108.8	T237 T241 S262	T237-S239 WeakPolarHBondContact CB-O 3.45Å; T237-S239 PolarHBondContact O-N 3.17Å; T237-S239 PolarHBondContact OG1-O 2.88Å; S239-T241 PolarHBondContact O-OG1 3.16Å; S239-S262 VanDerWaalsContact OG-CB 3.22Å; S239-S262 WeakPolarHBondContact OG-CB 3.41Å; S239-S262 PolarHBondContact OG-N 3.47Å; S239-S262 VanDerWaalsContact OG-N 3.09Å
240	E	97.6	Very high	96.9	Very high	41 Å²	41	45 Å²	45	19%	0.192	24%	0.243	C	C	.	.			trans	-48.3	142.4	158.8	-47.8	96.3	125.2	0	0	110.4	H260 R261 S576	E240-H260 WeakPolarHBondContact O-CA 3.2Å; E240-R261 HydrophobicContact CB-CB 4.33Å; E240-R261 PolarHBondContact O-N 3.13Å; E240-R261 IonicContact OE1-CZ 3.87Å; E240-R261 IonicContact OE1-NH1 3.93Å; E240-R261 PolarHBondContact OE1-NH1 3.14Å; E240-S576 CarbonylContact C-O 3.54Å; E240-S576 WeakPolarHBondContact CA-O 3.32Å
241	T	97.9	Very high	96.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.8	-172.3	-55.1	0	0	0	0	107.9	S239 D243 M258 A259 H260 S559 S576 A577	S239-T241 PolarHBondContact O-OG1 3.16Å; T241-D243 WeakPolarHBondContact CG2-O 3.3Å; T241-M258 HydrophobicContact CG2-CB 3.75Å; T241-M258 HydrophobicContact CG2-CG 4.11Å; T241-A259 CarbonylContact C-O 3.45Å; T241-A259 WeakPolarHBondContact CA-O 3.16Å; T241-H260 PolarHBondContact OG1-CD2 2.87Å; T241-S559 PolarHBondContact O-OG 2.8Å; T241-S576 PolarHBondContact N-O 2.87Å; T241-S576 CarbonylContact O-C 3.54Å; T241-S576 VanDerWaalsContact O-O 3.12Å; T241-A577 PolarHBondContact O-N 3.43Å
242	H	97.8	Very high	96.7	Very high	53 Å²	53	45.6 Å²	45.6	25%	0.245	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-23.9	-179.4	-74.2	-56.1	0	0	0	113.3	A259 A288 L289 S559	H242-A259 HydrophobicContact CB-CB 4.4Å; H242-A259 PolarHBondContact N-O 2.66Å; H242-A288 PolarHBondContact CD2-O 3.16Å; H242-L289 WeakPolarHBondContact CB-O 3.37Å; H242-S559 VanDerWaalsContact O-CB 3.32Å; H242-S559 WeakPolarHBondContact O-CB 3.12Å
243	D	98.5	Very high	96.7	Very high	22 Å²	22	42 Å²	42	12%	0.118	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	147.5	-170.7	161.4	122	0	0	0	108.3	T241 M258 A259 L289 S290 W291 D560	T241-D243 WeakPolarHBondContact CG2-O 3.3Å; D243-M258 WeakPolarHBondContact O-CA 3.26Å; D243-A259 HydrophobicContact CB-CB 3.96Å; D243-A259 PolarHBondContact O-N 2.7Å; D243-L289 VanDerWaalsContact CB-O 3.31Å; D243-L289 WeakPolarHBondContact CB-O 3.2Å; D243-S290 VanDerWaalsContact CG-CA 3.42Å; D243-S290 WeakPolarHBondContact OD1-CA 3.23Å; D243-S290 VanDerWaalsContact OD1-CB 3.27Å; D243-S290 WeakPolarHBondContact OD1-CB 3.41Å; D243-S290 PolarHBondContact OD1-OG 2.93Å; D243-S290 WeakPolarHBondContact OD2-CA 3.3Å; D243-W291 PolarHBondContact OD2-N 3.38Å; D243-D560 WeakPolarHBondContact CA-OD2 3.42Å
244	V	98.6	Very high	96.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.6	174.2	55	0	0	0	0	108.1	V246 A256 A257 M258 D560 E562 I573	V244-V246 HydrophobicContact CG2-CG2 4.24Å; V244-A256 HydrophobicContact CG2-CB 3.98Å; V244-A257 CarbonylContact C-O 3.51Å; V244-A257 VanDerWaalsContact CA-O 3.29Å; V244-A257 WeakPolarHBondContact CA-O 3.28Å; V244-M258 HydrophobicContact CB-CE 4.44Å; V244-M258 HydrophobicContact CB-CG 4.3Å; V244-M258 HydrophobicContact CG2-CE 3.71Å; V244-M258 HydrophobicContact CG2-CG 4.02Å; V244-D560 HydrophobicContact CG1-CB 4.34Å; V244-D560 WeakPolarHBondContact CG1-OD2 3.3Å; V244-D560 PolarHBondContact N-OD2 2.99Å; V244-D560 VanDerWaalsContact O-OD2 3.1Å; V244-E562 HydrophobicContact CG1-CB 4.44Å; V244-E562 HydrophobicContact CG1-CG 3.93Å; V244-E562 WeakPolarHBondContact O-CG 3.33Å; V244-E562 VanDerWaalsContact O-OE1 3.06Å; V244-I573 HydrophobicContact CG1-CG2 4.33Å; V244-I573 HydrophobicContact CG2-CD1 4.26Å; V244-I573 HydrophobicContact CG2-CG2 4.34Å
245	E	98.5	Very high	96.8	Very high	25 Å²	25	38.1 Å²	38.1	12%	0.117	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.3	175.7	162	74.1	-134.2	0	0	108.6	F247 A256 A257 W291 K292 H293	E245-F247 HydrophobicContact CG-CD1 4.04Å; E245-F247 WeakPolarHBondContact O-CD1 3.24Å; E245-A256 CarbonylContact O-C 3.26Å; E245-A256 VanDerWaalsContact O-CA 3.25Å; E245-A256 WeakPolarHBondContact O-CA 3.44Å; E245-A257 PolarHBondContact N-O 2.82Å; E245-A257 PolarHBondContact O-N 2.85Å; E245-W291 HydrophobicContact CB-CB 3.87Å; E245-W291 WeakPolarHBondContact CB-O 3.47Å; E245-W291 HydrophobicContact CG-CB 4.48Å; E245-K292 WeakPolarHBondContact OE2-CA 3.02Å; E245-H293 HydrophobicContact CG-CB 3.9Å; E245-H293 WeakPolarHBondContact OE1-CB 3.23Å; E245-H293 PolarHBondContact OE2-N 2.95Å
246	V	98.6	Very high	96.8	Very high	20 Å²	20	37.4 Å²	37.4	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.9	-177.7	-178.1	0	0	0	0	111.5	V244 L254 M255 A256 E562 F564 I573	V244-V246 HydrophobicContact CG2-CG2 4.24Å; V246-L254 HydrophobicContact CG1-CD1 3.79Å; V246-L254 HydrophobicContact CG1-CD2 4.22Å; V246-L254 HydrophobicContact CG1-CG 4.06Å; V246-M255 WeakPolarHBondContact CA-O 3.32Å; V246-A256 HydrophobicContact CG2-CB 4.12Å; V246-E562 HydrophobicContact CB-CB 4.45Å; V246-E562 HydrophobicContact CG2-CB 3.75Å; V246-E562 HydrophobicContact CG2-CG 4.01Å; V246-F564 HydrophobicContact CG1-CB 3.76Å; V246-F564 HydrophobicContact CG1-CD1 4.24Å; V246-F564 HydrophobicContact CG1-CG 4.05Å; V246-F564 HydrophobicContact CG2-CD1 4.38Å; V246-I573 HydrophobicContact CG2-CG2 3.9Å
247	F	98.2	Very high	96.9	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.031	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.3	-174.2	60.2	-85.1	0	0	0	113.7	E245 I249 M255 A257 V269 H293 L302 F336	E245-F247 HydrophobicContact CG-CD1 4.04Å; E245-F247 WeakPolarHBondContact O-CD1 3.24Å; F247-I249 HydrophobicContact CD2-CD1 3.96Å; F247-I249 HydrophobicContact CD2-CG1 3.94Å; F247-I249 HydrophobicContact CE2-CD1 3.94Å; F247-I249 HydrophobicContact CE2-CG1 3.74Å; F247-M255 HydrophobicContact CD2-CB 4.28Å; F247-M255 HydrophobicContact CE1-CB 4.35Å; F247-M255 HydrophobicContact CE2-CB 3.75Å; F247-M255 HydrophobicContact CE2-CG 4.39Å; F247-M255 HydrophobicContact CE2-SD 4.21Å; F247-M255 HydrophobicContact CZ-CB 3.79Å; F247-M255 PolarHBondContact N-O 3.32Å; F247-M255 PolarHBondContact O-N 3.02Å; F247-M255 VanDerWaalsContact O-O 3.13Å; F247-A257 HydrophobicContact CE1-CB 3.79Å; F247-A257 HydrophobicContact CZ-CB 4.49Å; F247-V269 HydrophobicContact CZ-CG1 4.05Å; F247-H293 HydrophobicContact CB-CB 3.68Å; F247-H293 HydrophobicContact CD1-CB 3.95Å; F247-H293 AromaticContact CD2-CD2 3.68Å; F247-H293 HydrophobicContact CG-CB 3.79Å; F247-H293 AromaticContact CG-CD2 3.78Å; F247-H293 AromaticContact CG-CG 3.66Å; F247-L302 HydrophobicContact CD1-CD2 4.15Å; F247-L302 HydrophobicContact CE1-CD1 4.22Å; F247-L302 HydrophobicContact CE1-CD2 3.75Å; F247-L302 HydrophobicContact CZ-CD1 3.82Å; F247-L302 HydrophobicContact CZ-CD2 4.02Å; F247-L302 HydrophobicContact CZ-CG 4.3Å; F247-F336 AromaticContact CE2-CE2 3.71Å; F247-F336 HydrophobicContact CE2-CE2 3.71Å; F247-F336 AromaticContact CE2-CZ 3.64Å; F247-F336 HydrophobicContact CE2-CZ 3.64Å; F247-F336 AromaticContact CZ-CE2 3.81Å; F247-F336 HydrophobicContact CZ-CE2 3.81Å; F247-F336 HydrophobicContact CZ-CZ 4.02Å
248	Q	96.8	Very high	97	Very high	103 Å²	103	32.8 Å²	32.8	48%	0.481	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.3	178.7	-170.6	76.3	13.3	0	0	111.7	G253 L254	Q248-G253 VanDerWaalsContact CD-C 3.44Å; Q248-G253 VanDerWaalsContact NE2-C 3.29Å; Q248-L254 VanDerWaalsContact OE1-CB 3.3Å; Q248-L254 VanDerWaalsContact OE1-N 3.09Å
249	I	97.3	Very high	97.2	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.2	167.3	-61.5	-63.1	0	0	0	110.2	F247 D251 I252 G253 M255 A300 W329 F336	F247-I249 HydrophobicContact CD2-CD1 3.96Å; F247-I249 HydrophobicContact CD2-CG1 3.94Å; F247-I249 HydrophobicContact CE2-CD1 3.94Å; F247-I249 HydrophobicContact CE2-CG1 3.74Å; I249-D251 PolarHBondContact O-N 3.03Å; I249-I252 HydrophobicContact CB-CB 4.08Å; I249-I252 HydrophobicContact CB-CG1 4.46Å; I249-I252 HydrophobicContact CG2-CB 3.9Å; I249-I252 HydrophobicContact CG2-CG1 3.74Å; I249-I252 PolarHBondContact O-N 3.25Å; I249-I252 VanDerWaalsContact O-N 3.1Å; I249-G253 PolarHBondContact N-O 2.9Å; I249-G253 PolarHBondContact O-N 3.27Å; I249-M255 HydrophobicContact CB-SD 4.25Å; I249-M255 HydrophobicContact CG1-SD 3.75Å; I249-A300 HydrophobicContact CD1-CB 3.42Å; I249-A300 VanDerWaalsContact CD1-CB 3.42Å; I249-W329 HydrophobicContact CG2-CD2 4.03Å; I249-W329 HydrophobicContact CG2-CG 4.34Å; I249-W329 HydrophobicContact CG2-CZ2 4Å; I249-F336 HydrophobicContact CD1-CZ 3.87Å; I249-F336 HydrophobicContact CG1-CZ 4.4Å
250	Q	91.8	Very high	97.2	Very high	121 Å²	121	29.4 Å²	29.4	57%	0.565	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	134	176	-167.9	-178.5	9.6	0	0	110.8	I252	Q250-I252 PolarHBondContact O-N 2.82Å
251	D	90.3	Very high	97	Very high	138 Å²	138	33.8 Å²	33.8	74%	0.738	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	4.8	-179.5	-43.6	-46.3	0	0	0	115.7	I249	I249-D251 PolarHBondContact O-N 3.03Å
252	I	96.1	Very high	96.6	Very high	47 Å²	47	35.8 Å²	35.8	24%	0.241	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-53.1	178	-60.2	-64.8	0	0	0	111	I249 Q250 M255 L271 W329 K334	I249-I252 HydrophobicContact CB-CB 4.08Å; I249-I252 HydrophobicContact CB-CG1 4.46Å; I249-I252 HydrophobicContact CG2-CB 3.9Å; I249-I252 HydrophobicContact CG2-CG1 3.74Å; I249-I252 PolarHBondContact O-N 3.25Å; I249-I252 VanDerWaalsContact O-N 3.1Å; Q250-I252 PolarHBondContact O-N 2.82Å; I252-M255 HydrophobicContact CG2-SD 4.18Å; I252-L271 HydrophobicContact CG2-CD1 3.74Å; I252-W329 HydrophobicContact CD1-CZ2 4.01Å; I252-W329 HydrophobicContact CG1-CH2 4.17Å; I252-W329 HydrophobicContact CG1-CZ2 3.61Å; I252-K334 HydrophobicContact CD1-CD 4.23Å; I252-K334 HydrophobicContact CD1-CG 4.44Å
253	G	96	Very high	95.9	Very high	18 Å²	18	35.4 Å²	35.4	19%	0.186	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.2	-171.2	-176.5	0	0	0	0	0	113.2	Q248 I249	Q248-G253 VanDerWaalsContact CD-C 3.44Å; Q248-G253 VanDerWaalsContact NE2-C 3.29Å; I249-G253 PolarHBondContact N-O 2.9Å; I249-G253 PolarHBondContact O-N 3.27Å
254	L	98.4	Very high	95.3	Very high	18 Å²	18	39.2 Å²	39.2	9%	0.094	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	135.4	176.9	-172.7	78	0	0	0	109.6	V246 Q248 L271 W272 F277 F564	V246-L254 HydrophobicContact CG1-CD1 3.79Å; V246-L254 HydrophobicContact CG1-CD2 4.22Å; V246-L254 HydrophobicContact CG1-CG 4.06Å; Q248-L254 VanDerWaalsContact OE1-CB 3.3Å; Q248-L254 VanDerWaalsContact OE1-N 3.09Å; L254-L271 WeakPolarHBondContact O-CD1 3.39Å; L254-W272 HydrophobicContact CB-CB 3.86Å; L254-W272 HydrophobicContact CB-CG 4.47Å; L254-W272 HydrophobicContact CD2-CB 4.12Å; L254-W272 HydrophobicContact CD2-CG 4.15Å; L254-W272 HydrophobicContact CG-CB 4.35Å; L254-W272 WeakPolarHBondContact O-CB 3.36Å; L254-W272 PolarHBondContact O-N 3.03Å; L254-F277 HydrophobicContact CD2-CZ 4.34Å; L254-F564 HydrophobicContact CD2-CB 4.27Å; L254-F564 HydrophobicContact CD2-CD2 3.24Å; L254-F564 HydrophobicContact CD2-CE2 3.69Å; L254-F564 HydrophobicContact CD2-CG 3.94Å
255	M	98.6	Very high	94.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	161.6	-178.3	-56.2	-170.1	86.4	0	0	110.1	V246 F247 I249 I252 V269 Y270 L271 Y280	V246-M255 WeakPolarHBondContact CA-O 3.32Å; F247-M255 HydrophobicContact CD2-CB 4.28Å; F247-M255 HydrophobicContact CE1-CB 4.35Å; F247-M255 HydrophobicContact CE2-CB 3.75Å; F247-M255 HydrophobicContact CE2-CG 4.39Å; F247-M255 HydrophobicContact CE2-SD 4.21Å; F247-M255 HydrophobicContact CZ-CB 3.79Å; F247-M255 PolarHBondContact N-O 3.32Å; F247-M255 PolarHBondContact O-N 3.02Å; F247-M255 VanDerWaalsContact O-O 3.13Å; I249-M255 HydrophobicContact CB-SD 4.25Å; I249-M255 HydrophobicContact CG1-SD 3.75Å; I252-M255 HydrophobicContact CG2-SD 4.18Å; M255-V269 HydrophobicContact CB-CG1 4.13Å; M255-V269 HydrophobicContact CE-CG1 3.49Å; M255-V269 VanDerWaalsContact CE-CG1 3.49Å; M255-V269 HydrophobicContact SD-CG1 4.26Å; M255-Y270 CarbonylContact C-O 3.58Å; M255-Y270 WeakPolarHBondContact CA-O 3.47Å; M255-Y270 VanDerWaalsContact CB-O 3.3Å; M255-Y270 WeakPolarHBondContact CB-O 3.41Å; M255-L271 HydrophobicContact CE-CB 4.35Å; M255-L271 HydrophobicContact CE-CD1 4.34Å; M255-L271 HydrophobicContact CG-CD1 3.85Å; M255-Y280 HydrophobicContact CE-CD1 3.24Å; M255-Y280 HydrophobicContact CE-CD2 4.04Å; M255-Y280 HydrophobicContact CE-CE1 3.68Å; M255-Y280 HydrophobicContact CE-CE2 4.4Å; M255-Y280 HydrophobicContact CE-CG 3.43Å; M255-Y280 VanDerWaalsContact CE-CG 3.43Å
256	A	98.7	Very high	94.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	127.9	171.7	0	0	0	0	0	109.3	V244 E245 V246 M258 V269 Y270 F277	V244-A256 HydrophobicContact CG2-CB 3.98Å; E245-A256 CarbonylContact O-C 3.26Å; E245-A256 VanDerWaalsContact O-CA 3.25Å; E245-A256 WeakPolarHBondContact O-CA 3.44Å; V246-A256 HydrophobicContact CG2-CB 4.12Å; A256-M258 HydrophobicContact CB-CE 4.43Å; A256-V269 CarbonylContact O-C 3.54Å; A256-V269 VanDerWaalsContact O-CA 3.3Å; A256-V269 WeakPolarHBondContact O-CA 3.24Å; A256-Y270 PolarHBondContact N-O 2.78Å; A256-Y270 PolarHBondContact O-N 3.18Å; A256-F277 HydrophobicContact CB-CD1 4.14Å; A256-F277 HydrophobicContact CB-CE1 3.65Å; A256-F277 HydrophobicContact CB-CE2 4.44Å; A256-F277 HydrophobicContact CB-CZ 3.83Å
257	A	98.6	Very high	94.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.9	170	0	0	0	0	0	108.7	V244 E245 F247 V269 W291 L302	V244-A257 CarbonylContact C-O 3.51Å; V244-A257 VanDerWaalsContact CA-O 3.29Å; V244-A257 WeakPolarHBondContact CA-O 3.28Å; E245-A257 PolarHBondContact N-O 2.82Å; E245-A257 PolarHBondContact O-N 2.85Å; F247-A257 HydrophobicContact CE1-CB 3.79Å; F247-A257 HydrophobicContact CZ-CB 4.49Å; A257-V269 HydrophobicContact CB-CG2 4.25Å; A257-W291 HydrophobicContact CB-CB 4Å; A257-W291 HydrophobicContact CB-CD2 4.08Å; A257-W291 HydrophobicContact CB-CG 3.74Å; A257-L302 HydrophobicContact CB-CD1 4.27Å; A257-L302 HydrophobicContact CB-CD2 4.36Å
258	M	98.4	Very high	94.3	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122	-176.2	-70.7	-177.6	173.9	0	0	110.1	L235 T237 T241 D243 V244 A256 H260 S267 A268 Y270 W291 I573	L235-M258 HydrophobicContact CD2-CE 3.66Å; L235-M258 HydrophobicContact CD2-SD 3.97Å; T237-M258 HydrophobicContact CG2-SD 3.84Å; T241-M258 HydrophobicContact CG2-CB 3.75Å; T241-M258 HydrophobicContact CG2-CG 4.11Å; D243-M258 WeakPolarHBondContact O-CA 3.26Å; V244-M258 HydrophobicContact CB-CE 4.44Å; V244-M258 HydrophobicContact CB-CG 4.3Å; V244-M258 HydrophobicContact CG2-CE 3.71Å; V244-M258 HydrophobicContact CG2-CG 4.02Å; A256-M258 HydrophobicContact CB-CE 4.43Å; M258-H260 PolarHBondContact O-N 2.82Å; M258-H260 VanDerWaalsContact O-N 3.09Å; M258-S267 WeakPolarHBondContact O-CB 3.04Å; M258-S267 PolarHBondContact O-OG 3.29Å; M258-A268 PolarHBondContact N-O 3.43Å; M258-A268 PolarHBondContact O-N 3.12Å; M258-Y270 HydrophobicContact CB-CE2 4.12Å; M258-Y270 HydrophobicContact CE-CD2 4.39Å; M258-Y270 HydrophobicContact CG-CD2 4.07Å; M258-Y270 HydrophobicContact CG-CE2 4.01Å; M258-Y270 HydrophobicContact SD-CD2 3.67Å; M258-Y270 HydrophobicContact SD-CE2 3.42Å; M258-Y270 WeakPolarHBondContact SD-CE2 3.35Å; M258-W291 PolarHBondContact O-NE1 2.97Å; M258-I573 HydrophobicContact CE-CD1 3.55Å
259	A	97.9	Very high	94.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	87.1	178.3	0	0	0	0	0	110	T241 H242 D243 A288	T241-A259 CarbonylContact C-O 3.45Å; T241-A259 WeakPolarHBondContact CA-O 3.16Å; H242-A259 HydrophobicContact CB-CB 4.4Å; H242-A259 PolarHBondContact N-O 2.66Å; D243-A259 HydrophobicContact CB-CB 3.96Å; D243-A259 PolarHBondContact O-N 2.7Å; A259-A288 HydrophobicContact CB-CB 3.98Å
260	H	96.6	Very high	94.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	136.6	179.2	-65.2	158.1	0	0	0	111.8	S238 E240 T241 M258 S262 G266 S267	S238-H260 PolarHBondContact OG-CE1 2.75Å; S238-H260 PolarHBondContact OG-ND1 2.75Å; E240-H260 WeakPolarHBondContact O-CA 3.2Å; T241-H260 PolarHBondContact OG1-CD2 2.87Å; M258-H260 PolarHBondContact O-N 2.82Å; M258-H260 VanDerWaalsContact O-N 3.09Å; H260-S262 PolarHBondContact O-N 2.63Å; H260-G266 VanDerWaalsContact CB-O 3.26Å; H260-G266 WeakPolarHBondContact CB-O 3.12Å; H260-G266 PolarHBondContact ND1-O 3.43Å; H260-S267 PolarHBondContact N-OG 3.13Å
261	R	93.4	Very high	94.7	Very high	134 Å²	134	30.3 Å²	30.3	51%	0.506	18%	0.18	S	C	.	.	S	Bend	trans	-61	-44.2	179.6	-178	-179.2	177.2	-159	0.1	113.3	E240 S263	E240-R261 HydrophobicContact CB-CB 4.33Å; E240-R261 PolarHBondContact O-N 3.13Å; E240-R261 IonicContact OE1-CZ 3.87Å; E240-R261 IonicContact OE1-NH1 3.93Å; E240-R261 PolarHBondContact OE1-NH1 3.14Å; R261-S263 PolarHBondContact O-N 3.12Å
262	S	89.3	Confident	95.1	Very high	42 Å²	42	25.4 Å²	25.4	29%	0.294	15%	0.151	S	C	.	.			trans	-75.6	114.8	-175.6	178.9	0	0	0	0	112.2	S239 H260 A264 S265 G266	S239-S262 VanDerWaalsContact OG-CB 3.22Å; S239-S262 WeakPolarHBondContact OG-CB 3.41Å; S239-S262 PolarHBondContact OG-N 3.47Å; S239-S262 VanDerWaalsContact OG-N 3.09Å; H260-S262 PolarHBondContact O-N 2.63Å; S262-A264 PolarHBondContact O-N 2.87Å; S262-A264 PolarHBondContact OG-N 2.79Å; S262-S265 WeakPolarHBondContact CB-OG 3.09Å; S262-S265 PolarHBondContact O-N 3.31Å; S262-S265 PolarHBondContact O-OG 3.26Å; S262-G266 PolarHBondContact O-N 2.74Å
263	S	83.9	Confident	95.2	Very high	44 Å²	44	25.1 Å²	25.1	31%	0.308	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.3	172	-56.2	0	0	0	0	113.2	R261 G287	R261-S263 PolarHBondContact O-N 3.12Å; S263-G287 PolarHBondContact OG-N 2.93Å; S263-G287 VanDerWaalsContact OG-N 3.09Å
264	A	85.8	Confident	95	Very high	103 Å²	103	31.7 Å²	31.7	85%	0.851	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-38.9	-179.5	0	0	0	0	0	112.5	S262	S262-A264 PolarHBondContact O-N 2.87Å; S262-A264 PolarHBondContact OG-N 2.79Å
265	S	85.3	Confident	94.7	Very high	45 Å²	45	36.1 Å²	36.1	32%	0.315	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-25.8	172.3	47.6	0	0	0	0	112.2	S262	S262-S265 WeakPolarHBondContact CB-OG 3.09Å; S262-S265 PolarHBondContact O-N 3.31Å; S262-S265 PolarHBondContact O-OG 3.26Å
266	G	91.6	Very high	94.6	Very high	2 Å²	2	36.3 Å²	36.3	2%	0.021	21%	0.208	C	C	.	.			trans	68.8	-178.7	-172.7	0	0	0	0	0	112	H260 S262 I283	H260-G266 VanDerWaalsContact CB-O 3.26Å; H260-G266 WeakPolarHBondContact CB-O 3.12Å; H260-G266 PolarHBondContact ND1-O 3.43Å; S262-G266 PolarHBondContact O-N 2.74Å; G266-I283 CarbonylContact C-O 3.47Å
267	S	97	Very high	94.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	170.3	174.6	-65.9	0	0	0	0	111.9	M258 H260 I283 T285 A288	M258-S267 WeakPolarHBondContact O-CB 3.04Å; M258-S267 PolarHBondContact O-OG 3.29Å; H260-S267 PolarHBondContact N-OG 3.13Å; S267-I283 PolarHBondContact N-O 2.82Å; S267-I283 PolarHBondContact O-N 3.03Å; S267-T285 PolarHBondContact N-OG1 2.93Å; S267-T285 VanDerWaalsContact N-OG1 3.16Å; S267-T285 WeakPolarHBondContact OG-CG2 3.4Å; S267-T285 PolarHBondContact OG-OG1 2.9Å; S267-A288 VanDerWaalsContact OG-CB 3.3Å; S267-A288 WeakPolarHBondContact OG-CB 3.21Å
268	A	97.9	Very high	94.6	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	153.8	177.5	0	0	0	0	0	112.6	M258 Y270 L279 Q281	M258-A268 PolarHBondContact N-O 3.43Å; M258-A268 PolarHBondContact O-N 3.12Å; A268-Y270 HydrophobicContact CB-CD2 4.32Å; A268-Y270 HydrophobicContact CB-CE2 3.6Å; A268-L279 HydrophobicContact CB-CD1 3.56Å; A268-Q281 CarbonylContact C-O 3.5Å; A268-Q281 VanDerWaalsContact CA-O 3.31Å; A268-Q281 WeakPolarHBondContact CA-O 3.29Å
269	V	98.6	Very high	94.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.5	167.7	-176.4	0	0	0	0	107.9	F247 M255 A256 A257 Y280 Q281 I283 L302 F336	F247-V269 HydrophobicContact CZ-CG1 4.05Å; M255-V269 HydrophobicContact CB-CG1 4.13Å; M255-V269 HydrophobicContact CE-CG1 3.49Å; M255-V269 VanDerWaalsContact CE-CG1 3.49Å; M255-V269 HydrophobicContact SD-CG1 4.26Å; A256-V269 CarbonylContact O-C 3.54Å; A256-V269 VanDerWaalsContact O-CA 3.3Å; A256-V269 WeakPolarHBondContact O-CA 3.24Å; A257-V269 HydrophobicContact CB-CG2 4.25Å; V269-Y280 WeakPolarHBondContact O-CA 3.46Å; V269-Y280 VanDerWaalsContact O-CB 3.29Å; V269-Y280 WeakPolarHBondContact O-CB 3.46Å; V269-Y280 PolarHBondContact O-N 3.28Å; V269-Q281 HydrophobicContact CB-CB 4.31Å; V269-Q281 PolarHBondContact N-O 3.46Å; V269-Q281 PolarHBondContact O-N 3.25Å; V269-I283 HydrophobicContact CG2-CD1 3.71Å; V269-I283 HydrophobicContact CG2-CG1 4.5Å; V269-L302 HydrophobicContact CG2-CD1 4.28Å; V269-F336 HydrophobicContact CG2-CD2 4.44Å
270	Y	98.7	Very high	94.6	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.035	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.8	178.3	-63.5	-101.6	0	0	0	109.8	L235 M255 A256 M258 A268 R278 L279	L235-Y270 HydrophobicContact CD1-CD1 4.04Å; L235-Y270 HydrophobicContact CD1-CE1 3.91Å; L235-Y270 HydrophobicContact CD2-CD1 3.89Å; L235-Y270 HydrophobicContact CD2-CE1 3.95Å; L235-Y270 HydrophobicContact CD2-CG 4.27Å; L235-Y270 HydrophobicContact CG-CD1 4.49Å; L235-Y270 HydrophobicContact CG-CE1 4.24Å; M255-Y270 CarbonylContact C-O 3.58Å; M255-Y270 WeakPolarHBondContact CA-O 3.47Å; M255-Y270 VanDerWaalsContact CB-O 3.3Å; M255-Y270 WeakPolarHBondContact CB-O 3.41Å; A256-Y270 PolarHBondContact N-O 2.78Å; A256-Y270 PolarHBondContact O-N 3.18Å; M258-Y270 HydrophobicContact CB-CE2 4.12Å; M258-Y270 HydrophobicContact CE-CD2 4.39Å; M258-Y270 HydrophobicContact CG-CD2 4.07Å; M258-Y270 HydrophobicContact CG-CE2 4.01Å; M258-Y270 HydrophobicContact SD-CD2 3.67Å; M258-Y270 HydrophobicContact SD-CE2 3.42Å; M258-Y270 WeakPolarHBondContact SD-CE2 3.35Å; A268-Y270 HydrophobicContact CB-CD2 4.32Å; A268-Y270 HydrophobicContact CB-CE2 3.6Å; Y270-R278 CarbonylContact C-O 3.56Å; Y270-R278 WeakPolarHBondContact CA-O 3.45Å; Y270-L279 HydrophobicContact CD1-CB 4.28Å; Y270-L279 HydrophobicContact CE1-CB 4.1Å; Y270-L279 HydrophobicContact CE1-CD1 4.17Å
271	L	98.6	Very high	94.6	Very high	35 Å²	35	51.9 Å²	51.9	18%	0.183	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.7	175.1	179	68.7	0	0	0	109.2	I252 L254 M255 F277 R278 Y280	I252-L271 HydrophobicContact CG2-CD1 3.74Å; L254-L271 WeakPolarHBondContact O-CD1 3.39Å; M255-L271 HydrophobicContact CE-CB 4.35Å; M255-L271 HydrophobicContact CE-CD1 4.34Å; M255-L271 HydrophobicContact CG-CD1 3.85Å; L271-F277 CarbonylContact O-C 3.58Å; L271-F277 WeakPolarHBondContact O-CA 3.44Å; L271-R278 PolarHBondContact N-O 3.18Å; L271-R278 PolarHBondContact O-N 2.75Å; L271-Y280 HydrophobicContact CB-CD2 3.82Å; L271-Y280 HydrophobicContact CB-CG 4.22Å; L271-Y280 HydrophobicContact CD2-CD2 3.88Å; L271-Y280 HydrophobicContact CD2-CE2 4.07Å; L271-Y280 HydrophobicContact CG-CD2 4.4Å
272	W	98.4	Very high	94.8	Very high	36 Å²	36	50.4 Å²	50.4	14%	0.136	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.7	173.2	-174	-106.2	0	0	0	110.8	L254 F277 F564 S566 F571 V584	L254-W272 HydrophobicContact CB-CB 3.86Å; L254-W272 HydrophobicContact CB-CG 4.47Å; L254-W272 HydrophobicContact CD2-CB 4.12Å; L254-W272 HydrophobicContact CD2-CG 4.15Å; L254-W272 HydrophobicContact CG-CB 4.35Å; L254-W272 WeakPolarHBondContact O-CB 3.36Å; L254-W272 PolarHBondContact O-N 3.03Å; W272-F277 HydrophobicContact CB-CD1 4.15Å; W272-F277 HydrophobicContact CB-CE1 3.88Å; W272-F277 HydrophobicContact CB-CZ 4.47Å; W272-F277 HydrophobicContact CE3-CB 4.44Å; W272-F277 AromaticContact CE3-CD1 3.98Å; W272-F277 HydrophobicContact CE3-CD1 3.98Å; W272-F277 AromaticContact CE3-CD2 3.49Å; W272-F277 HydrophobicContact CE3-CD2 3.49Å; W272-F277 VanDerWaalsContact CE3-CD2 3.49Å; W272-F277 HydrophobicContact CE3-CE1 4.03Å; W272-F277 AromaticContact CE3-CE2 3.54Å; W272-F277 HydrophobicContact CE3-CE2 3.54Å; W272-F277 AromaticContact CE3-CG 3.7Å; W272-F277 HydrophobicContact CE3-CG 3.7Å; W272-F277 AromaticContact CE3-CZ 3.81Å; W272-F277 HydrophobicContact CE3-CZ 3.81Å; W272-F277 AromaticContact CZ3-CD2 3.66Å; W272-F277 HydrophobicContact CZ3-CD2 3.66Å; W272-F277 AromaticContact CZ3-CE2 3.82Å; W272-F277 HydrophobicContact CZ3-CE2 3.82Å; W272-F277 HydrophobicContact CZ3-CG 4.23Å; W272-F564 HydrophobicContact CD2-CE2 4.22Å; W272-F564 HydrophobicContact CE3-CE2 4.14Å; W272-F564 HydrophobicContact CE3-CZ 4.17Å; W272-F564 HydrophobicContact CH2-CE2 4.15Å; W272-F564 HydrophobicContact CH2-CZ 4.09Å; W272-F564 HydrophobicContact CZ2-CE2 4.23Å; W272-F564 HydrophobicContact CZ3-CE2 4.11Å; W272-F564 AromaticContact CZ3-CZ 3.85Å; W272-F564 HydrophobicContact CZ3-CZ 3.85Å; W272-S566 PolarHBondContact NE1-OG 2.97Å; W272-F571 HydrophobicContact CH2-CD1 4.25Å; W272-F571 HydrophobicContact CH2-CE1 4.2Å; W272-F571 HydrophobicContact CZ2-CD1 4.45Å; W272-F571 HydrophobicContact CZ2-CE1 4.08Å; W272-F571 HydrophobicContact CZ2-CE2 4.22Å; W272-F571 AromaticContact CZ2-CZ 3.97Å; W272-F571 HydrophobicContact CZ2-CZ 3.97Å; W272-V584 HydrophobicContact CH2-CG1 4.06Å; W272-V584 HydrophobicContact CZ3-CG1 4.1Å; W272-V584 HydrophobicContact CZ3-CG2 4.35Å
273	T	96.8	Very high	95.1	Very high	40 Å²	40	48.8 Å²	48.8	25%	0.245	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	177.2	178.7	70.3	0	0	0	0	110.3	L275 G276 R278	T273-L275 PolarHBondContact O-N 2.76Å; T273-L275 VanDerWaalsContact O-N 3.11Å; T273-L275 PolarHBondContact OG1-N 3.21Å; T273-L275 VanDerWaalsContact OG1-N 3.15Å; T273-G276 PolarHBondContact N-O 2.87Å; T273-G276 PolarHBondContact O-N 3.16Å; T273-G276 PolarHBondContact OG1-O 2.89Å; T273-R278 HydrophobicContact CG2-CB 4.38Å; T273-R278 HydrophobicContact CG2-CG 4.11Å
274	N	92.1	Very high	95.6	Very high	156 Å²	156	51.8 Å²	51.8	83%	0.834	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-17.1	169.8	63.9	-36.7	0	0	0	113.6
275	L	92.4	Very high	95.9	Very high	111 Å²	111	47.5 Å²	47.5	58%	0.581	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	14.8	176.6	-58.3	176.5	0	0	0	112.8	T273	T273-L275 PolarHBondContact O-N 2.76Å; T273-L275 VanDerWaalsContact O-N 3.11Å; T273-L275 PolarHBondContact OG1-N 3.21Å; T273-L275 VanDerWaalsContact OG1-N 3.15Å
276	G	96.7	Very high	96.1	Very high	4 Å²	4	46.7 Å²	46.7	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.3	-166.4	-174.2	0	0	0	0	0	113.7	Q233 T273	Q233-G276 VanDerWaalsContact OE1-CA 3.29Å; T273-G276 PolarHBondContact N-O 2.87Å; T273-G276 PolarHBondContact O-N 3.16Å; T273-G276 PolarHBondContact OG1-O 2.89Å
277	F	98.5	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	133.5	178.4	-79.6	-64.9	0	0	0	111.7	Q233 L235 L254 A256 L271 W272 F564 I573 V584	Q233-F277 PolarHBondContact NE2-O 3.38Å; L235-F277 HydrophobicContact CD2-CB 4.05Å; L254-F277 HydrophobicContact CD2-CZ 4.34Å; A256-F277 HydrophobicContact CB-CD1 4.14Å; A256-F277 HydrophobicContact CB-CE1 3.65Å; A256-F277 HydrophobicContact CB-CE2 4.44Å; A256-F277 HydrophobicContact CB-CZ 3.83Å; L271-F277 CarbonylContact O-C 3.58Å; L271-F277 WeakPolarHBondContact O-CA 3.44Å; W272-F277 HydrophobicContact CB-CD1 4.15Å; W272-F277 HydrophobicContact CB-CE1 3.88Å; W272-F277 HydrophobicContact CB-CZ 4.47Å; W272-F277 HydrophobicContact CE3-CB 4.44Å; W272-F277 AromaticContact CE3-CD1 3.98Å; W272-F277 HydrophobicContact CE3-CD1 3.98Å; W272-F277 AromaticContact CE3-CD2 3.49Å; W272-F277 HydrophobicContact CE3-CD2 3.49Å; W272-F277 VanDerWaalsContact CE3-CD2 3.49Å; W272-F277 HydrophobicContact CE3-CE1 4.03Å; W272-F277 AromaticContact CE3-CE2 3.54Å; W272-F277 HydrophobicContact CE3-CE2 3.54Å; W272-F277 AromaticContact CE3-CG 3.7Å; W272-F277 HydrophobicContact CE3-CG 3.7Å; W272-F277 AromaticContact CE3-CZ 3.81Å; W272-F277 HydrophobicContact CE3-CZ 3.81Å; W272-F277 AromaticContact CZ3-CD2 3.66Å; W272-F277 HydrophobicContact CZ3-CD2 3.66Å; W272-F277 AromaticContact CZ3-CE2 3.82Å; W272-F277 HydrophobicContact CZ3-CE2 3.82Å; W272-F277 HydrophobicContact CZ3-CG 4.23Å; F277-F564 AromaticContact CE2-CE1 3.89Å; F277-F564 HydrophobicContact CE2-CE1 3.89Å; F277-F564 HydrophobicContact CE2-CE2 4.35Å; F277-F564 AromaticContact CE2-CZ 3.63Å; F277-F564 HydrophobicContact CE2-CZ 3.63Å; F277-F564 HydrophobicContact CZ-CE1 4.33Å; F277-F564 HydrophobicContact CZ-CE2 4.42Å; F277-F564 HydrophobicContact CZ-CZ 4.08Å; F277-I573 HydrophobicContact CD2-CD1 3.97Å; F277-I573 HydrophobicContact CE2-CD1 3.96Å; F277-V584 HydrophobicContact CD2-CG2 3.87Å; F277-V584 HydrophobicContact CE2-CG2 4.3Å
278	R	98.1	Very high	95.9	Very high	133 Å²	133	46.9 Å²	46.9	50%	0.502	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.9	177.2	-63.6	-64.4	178.5	171.6	-3.6	110.3	Y270 L271 T273 Y280	Y270-R278 CarbonylContact C-O 3.56Å; Y270-R278 WeakPolarHBondContact CA-O 3.45Å; L271-R278 PolarHBondContact N-O 3.18Å; L271-R278 PolarHBondContact O-N 2.75Å; T273-R278 HydrophobicContact CG2-CB 4.38Å; T273-R278 HydrophobicContact CG2-CG 4.11Å; R278-Y280 PolarHBondContact O-N 3.36Å
279	L	98	Very high	95.9	Very high	96 Å²	96	48.3 Å²	48.3	50%	0.503	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	126.4	179.6	-178.9	62.1	0	0	0	110.5	A268 Y270 N282	A268-L279 HydrophobicContact CB-CD1 3.56Å; Y270-L279 HydrophobicContact CD1-CB 4.28Å; Y270-L279 HydrophobicContact CE1-CB 4.1Å; Y270-L279 HydrophobicContact CE1-CD1 4.17Å; L279-N282 WeakPolarHBondContact CD1-OD1 3.25Å
280	Y	98.3	Very high	95.9	Very high	73 Å²	73	48.7 Å²	48.7	29%	0.286	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-44	-179	-174.7	-95.7	0	0	0	112	M255 V269 L271 R278 W329 K334	M255-Y280 HydrophobicContact CE-CD1 3.24Å; M255-Y280 HydrophobicContact CE-CD2 4.04Å; M255-Y280 HydrophobicContact CE-CE1 3.68Å; M255-Y280 HydrophobicContact CE-CE2 4.4Å; M255-Y280 HydrophobicContact CE-CG 3.43Å; M255-Y280 VanDerWaalsContact CE-CG 3.43Å; V269-Y280 WeakPolarHBondContact O-CA 3.46Å; V269-Y280 VanDerWaalsContact O-CB 3.29Å; V269-Y280 WeakPolarHBondContact O-CB 3.46Å; V269-Y280 PolarHBondContact O-N 3.28Å; L271-Y280 HydrophobicContact CB-CD2 3.82Å; L271-Y280 HydrophobicContact CB-CG 4.22Å; L271-Y280 HydrophobicContact CD2-CD2 3.88Å; L271-Y280 HydrophobicContact CD2-CE2 4.07Å; L271-Y280 HydrophobicContact CG-CD2 4.4Å; R278-Y280 PolarHBondContact O-N 3.36Å; Y280-W329 AromaticContact CE1-CH2 3.88Å; Y280-W329 HydrophobicContact CE1-CH2 3.88Å; Y280-W329 HydrophobicContact CE1-CZ3 4.11Å; Y280-K334 VanDerWaalsContact CE1-O 3.29Å; Y280-K334 WeakPolarHBondContact CE1-O 3.4Å; Y280-K334 PolarHBondContact OH-O 3.26Å
281	Q	97.9	Very high	95.8	Very high	26 Å²	26	48.3 Å²	48.3	12%	0.121	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	132.6	-175.6	172.5	177.6	1.7	0	0	110.7	A268 V269 I283 F336	A268-Q281 CarbonylContact C-O 3.5Å; A268-Q281 VanDerWaalsContact CA-O 3.31Å; A268-Q281 WeakPolarHBondContact CA-O 3.29Å; V269-Q281 HydrophobicContact CB-CB 4.31Å; V269-Q281 PolarHBondContact N-O 3.46Å; V269-Q281 PolarHBondContact O-N 3.25Å; Q281-I283 HydrophobicContact CG-CD1 4.44Å; Q281-I283 HydrophobicContact CG-CG1 3.88Å; Q281-F336 PolarHBondContact NE2-O 3.38Å
282	N	97.3	Very high	95.9	Very high	102 Å²	102	48.9 Å²	48.9	55%	0.545	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	142.9	163.9	-67	-30.4	0	0	0	110.4	L279	L279-N282 WeakPolarHBondContact CD1-OD1 3.25Å
283	I	96.4	Very high	95.9	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	118.3	179.5	-56	-175.2	0	0	0	109	G266 S267 V269 Q281 T285 W291 Y327 F336	G266-I283 CarbonylContact C-O 3.47Å; S267-I283 PolarHBondContact N-O 2.82Å; S267-I283 PolarHBondContact O-N 3.03Å; V269-I283 HydrophobicContact CG2-CD1 3.71Å; V269-I283 HydrophobicContact CG2-CG1 4.5Å; Q281-I283 HydrophobicContact CG-CD1 4.44Å; Q281-I283 HydrophobicContact CG-CG1 3.88Å; I283-T285 HydrophobicContact CG2-CG2 4.27Å; I283-T285 PolarHBondContact O-N 2.85Å; I283-W291 HydrophobicContact CD1-CH2 4.2Å; I283-W291 HydrophobicContact CG2-CH2 4.02Å; I283-W291 HydrophobicContact CG2-CZ2 4.45Å; I283-Y327 HydrophobicContact CG2-CD1 4.26Å; I283-Y327 HydrophobicContact CG2-CE1 3.47Å; I283-Y327 VanDerWaalsContact CG2-CE1 3.47Å; I283-Y327 HydrophobicContact CG2-CE2 4.16Å; I283-Y327 VanDerWaalsContact CG2-CZ 3.42Å; I283-Y327 WeakPolarHBondContact CG2-OH 3.35Å; I283-F336 HydrophobicContact CD1-CB 4.31Å
284	S	93.3	Very high	96	Very high	108 Å²	108	47.3 Å²	47.3	76%	0.755	24%	0.244	S	C	*	.			trans	-63.8	126.3	172.1	-53.3	0	0	0	0	110.3	Y327	S284-Y327 PolarHBondContact O-OH 3.42Å; S284-Y327 VanDerWaalsContact O-OH 3.11Å
285	T	92.8	Very high	96.2	Very high	12 Å²	12	44.6 Å²	44.6	7%	0.074	23%	0.226	C	C	.	.			trans	-135.8	158.4	-179.5	50.2	0	0	0	0	109.8	S267 I283 A288 W291 V304	S267-T285 PolarHBondContact N-OG1 2.93Å; S267-T285 VanDerWaalsContact N-OG1 3.16Å; S267-T285 WeakPolarHBondContact OG-CG2 3.4Å; S267-T285 PolarHBondContact OG-OG1 2.9Å; I283-T285 HydrophobicContact CG2-CG2 4.27Å; I283-T285 PolarHBondContact O-N 2.85Å; T285-A288 HydrophobicContact CG2-CB 4.2Å; T285-W291 HydrophobicContact CG2-CH2 4.06Å; T285-W291 HydrophobicContact CG2-CZ2 3.62Å; T285-V304 HydrophobicContact CG2-CG1 4.38Å; T285-V304 HydrophobicContact CG2-CG2 3.99Å
286	N	88.6	Confident	96.4	Very high	28 Å²	28	40.5 Å²	40.5	15%	0.15	20%	0.204	C	C	.	.	S	Bend	trans	-114.4	84.7	-178	-172.8	2.8	0	0	0	110	N306 S307 G308	N286-N306 PolarHBondContact N-OD1 3.01Å; N286-N306 VanDerWaalsContact O-CB 3.32Å; N286-N306 WeakPolarHBondContact O-CB 3.34Å; N286-N306 PolarHBondContact O-OD1 3.22Å; N286-S307 PolarHBondContact O-N 3.25Å; N286-G308 PolarHBondContact O-N 2.91Å
287	G	90	Very high	96.2	Very high	6 Å²	6	43.4 Å²	43.4	6%	0.062	23%	0.234	C	C	.	.	S	Bend	trans	60.4	60.9	-173.9	0	0	0	0	0	111.8	S263 S307	S263-G287 PolarHBondContact OG-N 2.93Å; S263-G287 VanDerWaalsContact OG-N 3.09Å; G287-S307 WeakPolarHBondContact O-CB 3.41Å; G287-S307 PolarHBondContact O-N 3.14Å; G287-S307 PolarHBondContact O-OG 3.03Å
288	A	95.3	Very high	95.9	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	134.4	178.8	0	0	0	0	0	110.6	H242 A259 S267 T285 V304 S305	H242-A288 PolarHBondContact CD2-O 3.16Å; A259-A288 HydrophobicContact CB-CB 3.98Å; S267-A288 VanDerWaalsContact OG-CB 3.3Å; S267-A288 WeakPolarHBondContact OG-CB 3.21Å; T285-A288 HydrophobicContact CG2-CB 4.2Å; A288-V304 HydrophobicContact CB-CG2 3.67Å; A288-S305 CarbonylContact C-O 3.6Å; A288-S305 WeakPolarHBondContact CA-O 3.4Å
289	L	97	Very high	95.8	Very high	32 Å²	32	50.6 Å²	50.6	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-28.5	178.5	-66.6	-175.8	0	0	0	113.4	H242 D243 S305	H242-L289 WeakPolarHBondContact CB-O 3.37Å; D243-L289 VanDerWaalsContact CB-O 3.31Å; D243-L289 WeakPolarHBondContact CB-O 3.2Å; L289-S305 PolarHBondContact N-O 2.91Å
290	S	98.1	Very high	95.8	Very high	7 Å²	7	46.5 Å²	46.5	5%	0.049	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	154.7	176.5	168.2	0	0	0	0	111.3	D243 V304 S305 R348	D243-S290 VanDerWaalsContact CG-CA 3.42Å; D243-S290 WeakPolarHBondContact OD1-CA 3.23Å; D243-S290 VanDerWaalsContact OD1-CB 3.27Å; D243-S290 WeakPolarHBondContact OD1-CB 3.41Å; D243-S290 PolarHBondContact OD1-OG 2.93Å; D243-S290 WeakPolarHBondContact OD2-CA 3.3Å; S290-V304 WeakPolarHBondContact O-CA 3.22Å; S290-S305 PolarHBondContact O-N 3.12Å; S290-R348 WeakPolarHBondContact CB-O 3.22Å
291	W	98.6	Very high	95.8	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.9	166.1	-73.2	98.6	0	0	0	110.6	D243 E245 A257 M258 I283 T285 L302 V303 V304 Y327	D243-W291 PolarHBondContact OD2-N 3.38Å; E245-W291 HydrophobicContact CB-CB 3.87Å; E245-W291 WeakPolarHBondContact CB-O 3.47Å; E245-W291 HydrophobicContact CG-CB 4.48Å; A257-W291 HydrophobicContact CB-CB 4Å; A257-W291 HydrophobicContact CB-CD2 4.08Å; A257-W291 HydrophobicContact CB-CG 3.74Å; M258-W291 PolarHBondContact O-NE1 2.97Å; I283-W291 HydrophobicContact CD1-CH2 4.2Å; I283-W291 HydrophobicContact CG2-CH2 4.02Å; I283-W291 HydrophobicContact CG2-CZ2 4.45Å; T285-W291 HydrophobicContact CG2-CH2 4.06Å; T285-W291 HydrophobicContact CG2-CZ2 3.62Å; W291-L302 HydrophobicContact CE3-CB 3.95Å; W291-L302 HydrophobicContact CE3-CD1 4.49Å; W291-L302 HydrophobicContact CZ3-CB 3.96Å; W291-V303 WeakPolarHBondContact CA-O 3.36Å; W291-V304 HydrophobicContact CD2-CB 4.05Å; W291-V304 HydrophobicContact CD2-CG2 4.18Å; W291-V304 HydrophobicContact CE3-CB 3.75Å; W291-V304 HydrophobicContact CE3-CG2 4.39Å; W291-V304 HydrophobicContact CH2-CB 3.61Å; W291-V304 HydrophobicContact CH2-CG1 4.14Å; W291-V304 HydrophobicContact CH2-CG2 4.1Å; W291-V304 HydrophobicContact CZ2-CB 3.89Å; W291-V304 HydrophobicContact CZ2-CG2 3.85Å; W291-V304 HydrophobicContact CZ3-CB 3.55Å; W291-V304 HydrophobicContact CZ3-CG1 4.28Å; W291-V304 HydrophobicContact CZ3-CG2 4.38Å; W291-Y327 HydrophobicContact CH2-CD2 4.02Å; W291-Y327 AromaticContact CH2-CE2 3.71Å; W291-Y327 HydrophobicContact CH2-CE2 3.71Å; W291-Y327 AromaticContact CZ3-CD2 3.78Å; W291-Y327 HydrophobicContact CZ3-CD2 3.78Å; W291-Y327 AromaticContact CZ3-CE2 3.89Å; W291-Y327 HydrophobicContact CZ3-CE2 3.89Å
292	K	98.8	Very high	95.9	Very high	47 Å²	47	41.9 Å²	41.9	20%	0.204	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.1	165.2	-166.9	77.7	179.2	-163.6	0	111.4	E245 L302 V303 W350 E351 A352	E245-K292 WeakPolarHBondContact OE2-CA 3.02Å; K292-L302 CarbonylContact O-C 3.55Å; K292-L302 WeakPolarHBondContact O-CA 3.43Å; K292-V303 HydrophobicContact CB-CG1 3.78Å; K292-V303 PolarHBondContact N-O 2.92Å; K292-V303 PolarHBondContact O-N 3Å; K292-W350 HydrophobicContact CB-CB 4.01Å; K292-W350 WeakPolarHBondContact CB-O 3.44Å; K292-W350 WeakPolarHBondContact CD-O 3.19Å; K292-W350 WeakPolarHBondContact CG-O 3.35Å; K292-E351 WeakPolarHBondContact CE-OE2 3.27Å; K292-E351 IonicContact NZ-OE1 2.71Å; K292-E351 IonicContact NZ-OE2 3.22Å; K292-E351 PolarHBondContact NZ-OE2 3.49Å; K292-A352 HydrophobicContact CG-CB 3.95Å
293	H	98.7	Very high	95.9	Very high	32 Å²	32	37 Å²	37	15%	0.148	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	139.5	169.8	166	-95.4	0	0	0	111.3	E245 F247 Y301 L302	E245-H293 HydrophobicContact CG-CB 3.9Å; E245-H293 WeakPolarHBondContact OE1-CB 3.23Å; E245-H293 PolarHBondContact OE2-N 2.95Å; F247-H293 HydrophobicContact CB-CB 3.68Å; F247-H293 HydrophobicContact CD1-CB 3.95Å; F247-H293 AromaticContact CD2-CD2 3.68Å; F247-H293 HydrophobicContact CG-CB 3.79Å; F247-H293 AromaticContact CG-CD2 3.78Å; F247-H293 AromaticContact CG-CG 3.66Å; H293-Y301 PolarHBondContact CD2-O 2.85Å; H293-L302 HydrophobicContact CB-CD2 3.73Å
294	F	98.5	Very high	96	Very high	12 Å²	12	36.7 Å²	36.7	5%	0.053	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.8	173.5	66.3	-82.7	0	0	0	112.3	I296 Y301 V303 I326 A352 L361 F389	F294-I296 HydrophobicContact CD2-CG1 4.22Å; F294-I296 HydrophobicContact CE2-CD1 4.08Å; F294-I296 HydrophobicContact CE2-CG1 4.14Å; F294-Y301 HydrophobicContact CD2-CD2 4.43Å; F294-Y301 HydrophobicContact CD2-CG 4.47Å; F294-Y301 HydrophobicContact CE2-CD2 4.04Å; F294-Y301 AromaticContact CE2-CG 3.81Å; F294-Y301 HydrophobicContact CE2-CG 3.81Å; F294-Y301 HydrophobicContact CZ-CD1 4.39Å; F294-Y301 AromaticContact CZ-CG 3.91Å; F294-Y301 HydrophobicContact CZ-CG 3.91Å; F294-Y301 PolarHBondContact N-O 3.46Å; F294-Y301 VanDerWaalsContact N-O 3.13Å; F294-Y301 PolarHBondContact O-N 2.87Å; F294-V303 HydrophobicContact CD1-CG1 4.4Å; F294-V303 HydrophobicContact CE1-CB 4.16Å; F294-V303 HydrophobicContact CE1-CG1 4.06Å; F294-I326 HydrophobicContact CE1-CG2 4.31Å; F294-I326 HydrophobicContact CZ-CG2 3.89Å; F294-A352 HydrophobicContact CB-CB 3.56Å; F294-A352 HydrophobicContact CD1-CB 4.34Å; F294-A352 HydrophobicContact CG-CB 4.08Å; F294-L361 HydrophobicContact CD1-CD2 4Å; F294-L361 HydrophobicContact CD2-CD2 4.45Å; F294-L361 HydrophobicContact CE1-CD1 4.15Å; F294-L361 HydrophobicContact CE1-CD2 4.03Å; F294-L361 HydrophobicContact CE2-CD1 4.48Å; F294-L361 HydrophobicContact CE2-CD2 4.48Å; F294-L361 HydrophobicContact CG-CD2 4.22Å; F294-L361 HydrophobicContact CZ-CD1 3.9Å; F294-L361 HydrophobicContact CZ-CD2 4.26Å; F294-F389 AromaticContact CE2-CE2 3.72Å; F294-F389 HydrophobicContact CE2-CE2 3.72Å; F294-F389 AromaticContact CE2-CZ 3.66Å; F294-F389 HydrophobicContact CE2-CZ 3.66Å; F294-F389 AromaticContact CZ-CE2 3.82Å; F294-F389 HydrophobicContact CZ-CE2 3.82Å; F294-F389 HydrophobicContact CZ-CZ 4.09Å
295	Q	97.2	Very high	96.2	Very high	98 Å²	98	31.5 Å²	31.5	46%	0.458	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.1	-179.2	-61.3	-173.4	1.5	0	0	111.8	K299	Q295-K299 VanDerWaalsContact CA-O 3.31Å; Q295-K299 WeakPolarHBondContact CA-O 2.96Å
296	I	96.8	Very high	96.3	Very high	25 Å²	25	31 Å²	31	13%	0.128	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	100.6	168.7	-52.2	179.9	0	0	0	107.6	F294 K298 K299 Y301 T359 W382 F389	F294-I296 HydrophobicContact CD2-CG1 4.22Å; F294-I296 HydrophobicContact CE2-CD1 4.08Å; F294-I296 HydrophobicContact CE2-CG1 4.14Å; I296-K298 PolarHBondContact O-N 3.39Å; I296-K299 PolarHBondContact N-O 3.26Å; I296-K299 PolarHBondContact O-N 3.11Å; I296-Y301 HydrophobicContact CB-CE2 3.96Å; I296-Y301 HydrophobicContact CD1-CD2 4.45Å; I296-Y301 HydrophobicContact CD1-CE2 4.08Å; I296-Y301 HydrophobicContact CG1-CD2 4.19Å; I296-Y301 HydrophobicContact CG1-CE2 3.96Å; I296-T359 HydrophobicContact CG1-CG2 4.21Å; I296-W382 HydrophobicContact CD1-CB 4.4Å; I296-W382 HydrophobicContact CD1-CD2 3.51Å; I296-W382 HydrophobicContact CD1-CE3 3.62Å; I296-W382 HydrophobicContact CD1-CG 3.86Å; I296-W382 HydrophobicContact CD1-CH2 4.37Å; I296-W382 HydrophobicContact CD1-CZ2 4.3Å; I296-W382 HydrophobicContact CD1-CZ3 4.06Å; I296-F389 HydrophobicContact CD1-CE2 4.08Å; I296-F389 HydrophobicContact CD1-CZ 3.91Å
297	G	92.8	Very high	96.4	Very high	65 Å²	65	30.1 Å²	30.1	67%	0.67	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	-127.8	-165.4	0	0	0	0	0	110.4	K299	G297-K299 VanDerWaalsContact C-N 3.3Å; G297-K299 PolarHBondContact O-N 3.43Å
298	K	92.3	Very high	95.6	Very high	179 Å²	179	30 Å²	30	78%	0.778	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	15.2	-179.7	-59.5	-175.6	178.7	-178.3	0	114.7	I296	I296-K298 PolarHBondContact O-N 3.39Å
299	K	96	Very high	93.8	Very high	106 Å²	106	33.2 Å²	33.2	46%	0.461	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.9	-175.9	-66.9	168.7	-177	162.9	0	108.8	Q295 I296 G297 Y301	Q295-K299 VanDerWaalsContact CA-O 3.31Å; Q295-K299 WeakPolarHBondContact CA-O 2.96Å; I296-K299 PolarHBondContact N-O 3.26Å; I296-K299 PolarHBondContact O-N 3.11Å; G297-K299 VanDerWaalsContact C-N 3.3Å; G297-K299 PolarHBondContact O-N 3.43Å; K299-Y301 HydrophobicContact CB-CD2 4.38Å; K299-Y301 HydrophobicContact CB-CE2 3.52Å; K299-Y301 VanDerWaalsContact O-CD2 3.28Å; K299-Y301 WeakPolarHBondContact O-CD2 3.21Å; K299-Y301 WeakPolarHBondContact O-CE2 3.42Å
300	A	98	Very high	91.6	Very high	10 Å²	10	36.5 Å²	36.5	8%	0.083	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	143.1	175.6	0	0	0	0	0	111.6	I249 W329	I249-A300 HydrophobicContact CD1-CB 3.42Å; I249-A300 VanDerWaalsContact CD1-CB 3.42Å; A300-W329 HydrophobicContact CB-CB 4.06Å; A300-W329 WeakPolarHBondContact O-CB 3.03Å; A300-W329 PolarHBondContact O-N 3.17Å
301	Y	98.7	Very high	89	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	157.1	179.9	-63.3	-99.5	0	0	0	109.8	H293 F294 I296 K299 I326 Y327 K328 F339	H293-Y301 PolarHBondContact CD2-O 2.85Å; F294-Y301 HydrophobicContact CD2-CD2 4.43Å; F294-Y301 HydrophobicContact CD2-CG 4.47Å; F294-Y301 HydrophobicContact CE2-CD2 4.04Å; F294-Y301 AromaticContact CE2-CG 3.81Å; F294-Y301 HydrophobicContact CE2-CG 3.81Å; F294-Y301 HydrophobicContact CZ-CD1 4.39Å; F294-Y301 AromaticContact CZ-CG 3.91Å; F294-Y301 HydrophobicContact CZ-CG 3.91Å; F294-Y301 PolarHBondContact N-O 3.46Å; F294-Y301 VanDerWaalsContact N-O 3.13Å; F294-Y301 PolarHBondContact O-N 2.87Å; I296-Y301 HydrophobicContact CB-CE2 3.96Å; I296-Y301 HydrophobicContact CD1-CD2 4.45Å; I296-Y301 HydrophobicContact CD1-CE2 4.08Å; I296-Y301 HydrophobicContact CG1-CD2 4.19Å; I296-Y301 HydrophobicContact CG1-CE2 3.96Å; K299-Y301 HydrophobicContact CB-CD2 4.38Å; K299-Y301 HydrophobicContact CB-CE2 3.52Å; K299-Y301 VanDerWaalsContact O-CD2 3.28Å; K299-Y301 WeakPolarHBondContact O-CD2 3.21Å; K299-Y301 WeakPolarHBondContact O-CE2 3.42Å; Y301-I326 HydrophobicContact CD1-CG2 3.98Å; Y301-Y327 CarbonylContact C-O 3.58Å; Y301-Y327 WeakPolarHBondContact CA-O 3.12Å; Y301-Y327 WeakPolarHBondContact CB-O 3.48Å; Y301-K328 HydrophobicContact CD1-CB 3.74Å; Y301-K328 HydrophobicContact CD1-CG 3.96Å; Y301-K328 HydrophobicContact CE1-CB 3.69Å; Y301-K328 HydrophobicContact CE1-CD 3.7Å; Y301-K328 HydrophobicContact CE1-CG 3.57Å; Y301-F339 HydrophobicContact CD1-CD1 4.13Å; Y301-F339 HydrophobicContact CD1-CE1 4.49Å; Y301-F339 HydrophobicContact CD1-CG 4.44Å; Y301-F339 AromaticContact CE1-CD1 3.82Å; Y301-F339 HydrophobicContact CE1-CD1 3.82Å; Y301-F339 HydrophobicContact CE1-CD2 4.3Å; Y301-F339 AromaticContact CE1-CE1 3.86Å; Y301-F339 HydrophobicContact CE1-CE1 3.86Å; Y301-F339 HydrophobicContact CE1-CE2 4.34Å; Y301-F339 HydrophobicContact CE1-CG 4.04Å; Y301-F339 HydrophobicContact CE1-CZ 4.11Å
302	L	98.6	Very high	86.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.5	169.4	-77.6	172.3	0	0	0	107.8	F247 A257 V269 W291 K292 H293 I326 Y327 F336	F247-L302 HydrophobicContact CD1-CD2 4.15Å; F247-L302 HydrophobicContact CE1-CD1 4.22Å; F247-L302 HydrophobicContact CE1-CD2 3.75Å; F247-L302 HydrophobicContact CZ-CD1 3.82Å; F247-L302 HydrophobicContact CZ-CD2 4.02Å; F247-L302 HydrophobicContact CZ-CG 4.3Å; A257-L302 HydrophobicContact CB-CD1 4.27Å; A257-L302 HydrophobicContact CB-CD2 4.36Å; V269-L302 HydrophobicContact CG2-CD1 4.28Å; W291-L302 HydrophobicContact CE3-CB 3.95Å; W291-L302 HydrophobicContact CE3-CD1 4.49Å; W291-L302 HydrophobicContact CZ3-CB 3.96Å; K292-L302 CarbonylContact O-C 3.55Å; K292-L302 WeakPolarHBondContact O-CA 3.43Å; H293-L302 HydrophobicContact CB-CD2 3.73Å; L302-I326 CarbonylContact O-C 3.52Å; L302-I326 WeakPolarHBondContact O-CA 3.48Å; L302-Y327 PolarHBondContact N-O 3.36Å; L302-Y327 PolarHBondContact O-N 3.14Å; L302-F336 HydrophobicContact CB-CD1 4.31Å; L302-F336 HydrophobicContact CB-CE1 4.22Å; L302-F336 HydrophobicContact CD1-CD1 3.88Å; L302-F336 HydrophobicContact CD1-CD2 3.64Å; L302-F336 HydrophobicContact CD1-CE1 3.73Å; L302-F336 HydrophobicContact CD1-CE2 3.46Å; L302-F336 VanDerWaalsContact CD1-CE2 3.46Å; L302-F336 HydrophobicContact CD1-CG 3.84Å; L302-F336 HydrophobicContact CD1-CZ 3.49Å; L302-F336 VanDerWaalsContact CD1-CZ 3.49Å; L302-F336 HydrophobicContact CG-CD1 4.08Å; L302-F336 HydrophobicContact CG-CE1 3.63Å; L302-F336 HydrophobicContact CG-CE2 4.19Å; L302-F336 HydrophobicContact CG-CZ 3.68Å
303	V	98.8	Very high	83.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.9	168.8	59.3	0	0	0	0	109.5	W291 K292 F294 V325 I326 W350	W291-V303 WeakPolarHBondContact CA-O 3.36Å; K292-V303 HydrophobicContact CB-CG1 3.78Å; K292-V303 PolarHBondContact N-O 2.92Å; K292-V303 PolarHBondContact O-N 3Å; F294-V303 HydrophobicContact CD1-CG1 4.4Å; F294-V303 HydrophobicContact CE1-CB 4.16Å; F294-V303 HydrophobicContact CE1-CG1 4.06Å; V303-V325 WeakPolarHBondContact CA-O 3.23Å; V303-I326 HydrophobicContact CB-CG1 4.1Å; V303-I326 HydrophobicContact CG2-CG1 3.85Å; V303-W350 HydrophobicContact CB-CG 4.37Å; V303-W350 HydrophobicContact CG1-CB 3.57Å; V303-W350 HydrophobicContact CG1-CD2 4.16Å; V303-W350 HydrophobicContact CG1-CG 3.67Å; V303-W350 HydrophobicContact CG2-CD2 3.74Å; V303-W350 HydrophobicContact CG2-CE3 4.42Å; V303-W350 HydrophobicContact CG2-CG 3.78Å; V303-W350 HydrophobicContact CG2-CZ2 4.22Å
304	V	98.3	Very high	81.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.5	176.6	62.9	0	0	0	0	111.4	T285 A288 S290 W291 N306 S324 V325 Y327	T285-V304 HydrophobicContact CG2-CG1 4.38Å; T285-V304 HydrophobicContact CG2-CG2 3.99Å; A288-V304 HydrophobicContact CB-CG2 3.67Å; S290-V304 WeakPolarHBondContact O-CA 3.22Å; W291-V304 HydrophobicContact CD2-CB 4.05Å; W291-V304 HydrophobicContact CD2-CG2 4.18Å; W291-V304 HydrophobicContact CE3-CB 3.75Å; W291-V304 HydrophobicContact CE3-CG2 4.39Å; W291-V304 HydrophobicContact CH2-CB 3.61Å; W291-V304 HydrophobicContact CH2-CG1 4.14Å; W291-V304 HydrophobicContact CH2-CG2 4.1Å; W291-V304 HydrophobicContact CZ2-CB 3.89Å; W291-V304 HydrophobicContact CZ2-CG2 3.85Å; W291-V304 HydrophobicContact CZ3-CB 3.55Å; W291-V304 HydrophobicContact CZ3-CG1 4.28Å; W291-V304 HydrophobicContact CZ3-CG2 4.38Å; V304-N306 PolarHBondContact O-N 2.98Å; V304-S324 WeakPolarHBondContact O-CB 3.15Å; V304-S324 PolarHBondContact O-OG 2.73Å; V304-V325 HydrophobicContact CG1-CB 4.12Å; V304-V325 PolarHBondContact N-O 2.89Å; V304-V325 VanDerWaalsContact N-O 3.11Å; V304-Y327 HydrophobicContact CG1-CE2 3.98Å
305	S	97.6	Very high	78.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	108	164.5	-71.8	0	0	0	0	109.6	A288 L289 S290 A347 R348 D349	A288-S305 CarbonylContact C-O 3.6Å; A288-S305 WeakPolarHBondContact CA-O 3.4Å; L289-S305 PolarHBondContact N-O 2.91Å; S290-S305 PolarHBondContact O-N 3.12Å; S305-A347 WeakPolarHBondContact CB-O 3.45Å; S305-R348 VanDerWaalsContact CB-O 3.3Å; S305-R348 WeakPolarHBondContact CB-O 3.49Å; S305-R348 PolarHBondContact OG-O 3.43Å; S305-D349 VanDerWaalsContact OG-C 3.3Å; S305-D349 VanDerWaalsContact OG-CA 3.29Å; S305-D349 WeakPolarHBondContact OG-CA 3.32Å; S305-D349 PolarHBondContact OG-N 2.95Å
306	N	94.7	Very high	76.1	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.011	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.9	175.7	-73.6	-38.6	0	0	0	110	N286 V304 F323 S324 A347	N286-N306 PolarHBondContact N-OD1 3.01Å; N286-N306 VanDerWaalsContact O-CB 3.32Å; N286-N306 WeakPolarHBondContact O-CB 3.34Å; N286-N306 PolarHBondContact O-OD1 3.22Å; V304-N306 PolarHBondContact O-N 2.98Å; N306-F323 VanDerWaalsContact CB-O 3.24Å; N306-F323 WeakPolarHBondContact CB-O 3.48Å; N306-F323 PolarHBondContact ND2-O 2.89Å; N306-S324 PolarHBondContact N-OG 2.84Å; N306-A347 PolarHBondContact O-N 3.26Å; N306-A347 VanDerWaalsContact O-N 3.14Å
307	S	89.4	Confident	73.6	Confident	9 Å²	9	69 Å²	69	6%	0.063	38%	0.377	C	S	.	.			trans	-82.1	-18	176.7	58.4	0	0	0	0	114.4	N286 G287 T309	N286-S307 PolarHBondContact O-N 3.25Å; G287-S307 WeakPolarHBondContact O-CB 3.41Å; G287-S307 PolarHBondContact O-N 3.14Å; G287-S307 PolarHBondContact O-OG 3.03Å; S307-T309 PolarHBondContact O-N 3.4Å; S307-T309 VanDerWaalsContact O-N 3.15Å; S307-T309 PolarHBondContact OG-OG1 2.84Å
308	G	72.9	Confident	71.2	Confident	4 Å²	4	74.5 Å²	74.5	4%	0.041	39%	0.385	C	S	.	.			trans	69.2	5.6	177.9	0	0	0	0	0	115.6	N286 E310 K313 D322	N286-G308 PolarHBondContact O-N 2.91Å; G308-E310 PolarHBondContact O-N 3.49Å; G308-K313 PolarHBondContact O-NZ 2.8Å; G308-D322 WeakPolarHBondContact CA-OD1 3.48Å
309	T	58.5	Low	69.2	Low	66 Å²	66	70.9 Å²	70.9	41%	0.405	38%	0.38	S	S	.	.			trans	-91.2	87.3	176	52.7	0	0	0	0	110.9	S307 T311	S307-T309 PolarHBondContact O-N 3.4Å; S307-T309 VanDerWaalsContact O-N 3.15Å; S307-T309 PolarHBondContact OG-OG1 2.84Å; T309-T311 PolarHBondContact O-N 3.1Å
310	E	50.9	Low	67.3	Low	101 Å²	101	71.8 Å²	71.8	47%	0.472	39%	0.386	S	S	.	.			trans	-65.6	127.5	152.4	-72	-169.5	161	0	0	108.8	G308 N312	G308-E310 PolarHBondContact O-N 3.49Å; E310-N312 PolarHBondContact O-N 2.82Å; E310-N312 VanDerWaalsContact O-N 3.16Å
311	T	43.5	Very low	65.8	Low	138 Å²	138	74.7 Å²	74.7	85%	0.847	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-2	177.9	50.1	0	0	0	0	113.7	T309	T309-T311 PolarHBondContact O-N 3.1Å
312	N	41.8	Very low	65.1	Low	141 Å²	141	75.8 Å²	75.8	75%	0.754	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	43	-178.6	-73.2	-10.6	0	0	0	112.3	E310 S314	E310-N312 PolarHBondContact O-N 2.82Å; E310-N312 VanDerWaalsContact O-N 3.16Å; N312-S314 PolarHBondContact O-N 3.09Å; N312-S314 VanDerWaalsContact O-N 3.08Å
313	K	45.5	Very low	64.9	Low	99 Å²	99	78.5 Å²	78.5	43%	0.43	42%	0.423	S	S	.	.			trans	-74.3	101.1	168.7	-69.8	-173.3	-175.5	179.2	0	108.7	G308 V315	G308-K313 PolarHBondContact O-NZ 2.8Å; K313-V315 PolarHBondContact O-N 3.46Å
314	S	42.2	Very low	64.8	Low	73 Å²	73	78.6 Å²	78.6	51%	0.51	42%	0.423	S	S	.	.			trans	-53.7	136.3	155	57	0	0	0	0	107.8	N312 D316 K317	N312-S314 PolarHBondContact O-N 3.09Å; N312-S314 VanDerWaalsContact O-N 3.08Å; S314-D316 PolarHBondContact O-N 3.41Å; S314-K317 PolarHBondContact O-N 3.15Å
315	V	47.9	Very low	64.8	Low	144 Å²	144	78.7 Å²	78.7	87%	0.873	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-13.4	-168.3	177.6	0	0	0	0	114.2	K313	K313-V315 PolarHBondContact O-N 3.46Å
316	D	43.7	Very low	64.8	Low	151 Å²	151	78.7 Å²	78.7	81%	0.807	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	5.9	-170.8	-61.8	-39.5	0	0	0	116.7	S314	S314-D316 PolarHBondContact O-N 3.41Å
317	K	43.5	Very low	65	Low	160 Å²	160	79.6 Å²	79.6	70%	0.696	43%	0.428	S	S	*	.	S	Bend	trans	-98.1	122.4	172.9	-75.7	-172.4	178.5	-177.7	0	110.7	S314	S314-K317 PolarHBondContact O-N 3.15Å
318	Q	43	Very low	65.4	Low	179 Å²	179	82 Å²	82	84%	0.836	44%	0.437	S	S	*	.			trans	-43.8	138.2	165.7	-81	-178.5	-19.6	0	0	109.1	E320	Q318-E320 PolarHBondContact O-N 2.9Å
319	P	50.7	Low	66.6	Low	104 Å²	104	83 Å²	83	68%	0.675	44%	0.439	S	S	*	.			trans	-59.2	109.8	179.1	23.3	-30.3	0	0	0	108	S321	P319-S321 PolarHBondContact O-N 2.84Å
320	E	55.6	Low	68.5	Low	125 Å²	125	81 Å²	81	58%	0.584	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-50	126.6	164.6	-78.4	-174.7	168.4	0	0	106.7	Q318 D322	Q318-E320 PolarHBondContact O-N 2.9Å; E320-D322 PolarHBondContact O-N 3Å
321	S	66	Low	70.6	Confident	70 Å²	70	82.3 Å²	82.3	49%	0.49	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-53.7	127.1	179.1	53.3	0	0	0	0	109.3	P319 F323	P319-S321 PolarHBondContact O-N 2.84Å; S321-F323 VanDerWaalsContact O-CD1 3.24Å; S321-F323 WeakPolarHBondContact O-CD1 3.41Å; S321-F323 PolarHBondContact O-N 3.07Å
322	D	84.8	Confident	73.1	Confident	26 Å²	26	85.3 Å²	85.3	14%	0.139	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-60.4	140	174.9	-54.4	-21.9	0	0	0	109.4	G308 E320 T344 C346	G308-D322 WeakPolarHBondContact CA-OD1 3.48Å; E320-D322 PolarHBondContact O-N 3Å; D322-T344 CarbonylContact C-O 3.46Å; D322-T344 WeakPolarHBondContact CB-O 3.15Å; D322-T344 PolarHBondContact O-N 2.87Å; D322-C346 PolarHBondContact OD2-N 2.84Å
323	F	93.2	Very high	75.7	Confident	57 Å²	57	85.1 Å²	85.1	25%	0.25	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	141.5	179.1	58.4	-98.7	0	0	0	111.8	N306 S321 V325 T341 L342 T344	N306-F323 VanDerWaalsContact CB-O 3.24Å; N306-F323 WeakPolarHBondContact CB-O 3.48Å; N306-F323 PolarHBondContact ND2-O 2.89Å; S321-F323 VanDerWaalsContact O-CD1 3.24Å; S321-F323 WeakPolarHBondContact O-CD1 3.41Å; S321-F323 PolarHBondContact O-N 3.07Å; F323-V325 HydrophobicContact CD2-CG2 3.81Å; F323-V325 HydrophobicContact CE2-CG2 3.96Å; F323-T341 HydrophobicContact CB-CG2 3.7Å; F323-T341 HydrophobicContact CD2-CG2 3.68Å; F323-T341 HydrophobicContact CG-CG2 3.81Å; F323-L342 CarbonylContact C-O 3.54Å; F323-L342 VanDerWaalsContact CA-O 3.32Å; F323-L342 WeakPolarHBondContact CA-O 3.2Å; F323-L342 WeakPolarHBondContact CB-O 3.27Å; F323-T344 WeakPolarHBondContact CA-OG1 3.29Å
324	S	96.9	Very high	78.2	Confident	1 Å²	1	86.5 Å²	86.5	1%	0.007	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	154.2	168.1	-82	0	0	0	0	110.7	V304 N306 T341 L342 T344 W350	V304-S324 WeakPolarHBondContact O-CB 3.15Å; V304-S324 PolarHBondContact O-OG 2.73Å; N306-S324 PolarHBondContact N-OG 2.84Å; S324-T341 WeakPolarHBondContact O-CA 3.31Å; S324-L342 PolarHBondContact N-O 3.05Å; S324-L342 PolarHBondContact O-N 2.84Å; S324-T344 PolarHBondContact N-OG1 2.86Å; S324-T344 VanDerWaalsContact N-OG1 3.13Å; S324-W350 PolarHBondContact OG-NE1 3.1Å
325	V	97.8	Very high	80.8	Confident	3 Å²	3	89.5 Å²	89.5	2%	0.018	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.3	-176.3	-175.6	0	0	0	0	109.6	V303 V304 F323 Y327 R338	V303-V325 WeakPolarHBondContact CA-O 3.23Å; V304-V325 HydrophobicContact CG1-CB 4.12Å; V304-V325 PolarHBondContact N-O 2.89Å; V304-V325 VanDerWaalsContact N-O 3.11Å; F323-V325 HydrophobicContact CD2-CG2 3.81Å; F323-V325 HydrophobicContact CE2-CG2 3.96Å; V325-Y327 HydrophobicContact CB-CD2 4.47Å; V325-Y327 HydrophobicContact CB-CE2 3.71Å; V325-Y327 HydrophobicContact CG1-CD2 4.09Å; V325-Y327 HydrophobicContact CG1-CE1 4.25Å; V325-Y327 HydrophobicContact CG1-CE2 3.56Å; V325-R338 HydrophobicContact CG1-CB 4.36Å; V325-R338 HydrophobicContact CG1-CG 3.57Å
326	I	98.7	Very high	83.3	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	131.3	168.6	-54.7	177.8	0	0	0	107.6	F294 Y301 L302 V303 F339 Q340 L342 L361 F389	F294-I326 HydrophobicContact CE1-CG2 4.31Å; F294-I326 HydrophobicContact CZ-CG2 3.89Å; Y301-I326 HydrophobicContact CD1-CG2 3.98Å; L302-I326 CarbonylContact O-C 3.52Å; L302-I326 WeakPolarHBondContact O-CA 3.48Å; V303-I326 HydrophobicContact CB-CG1 4.1Å; V303-I326 HydrophobicContact CG2-CG1 3.85Å; I326-F339 HydrophobicContact CB-CD1 4.29Å; I326-F339 HydrophobicContact CG2-CD1 3.88Å; I326-F339 WeakPolarHBondContact O-CA 3.36Å; I326-F339 WeakPolarHBondContact O-CB 3.46Å; I326-F339 PolarHBondContact O-N 3.18Å; I326-Q340 HydrophobicContact CB-CB 4.22Å; I326-Q340 HydrophobicContact CD1-CB 4.33Å; I326-Q340 PolarHBondContact N-O 3.16Å; I326-Q340 PolarHBondContact O-N 3.42Å; I326-Q340 VanDerWaalsContact O-N 3.12Å; I326-L342 HydrophobicContact CD1-CD1 3.81Å; I326-L342 HydrophobicContact CD1-CG 4.45Å; I326-L342 HydrophobicContact CG1-CD1 4.44Å; I326-L361 HydrophobicContact CD1-CD1 3.8Å; I326-F389 HydrophobicContact CD1-CD2 3.48Å; I326-F389 VanDerWaalsContact CD1-CD2 3.48Å; I326-F389 HydrophobicContact CD1-CE2 3.96Å; I326-F389 HydrophobicContact CD1-CG 4.28Å
327	Y	98.7	Very high	85.8	Confident	21 Å²	21	77.6 Å²	77.6	8%	0.082	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.6	171.9	-57.8	-103	0	0	0	109.5	I283 S284 W291 Y301 L302 V304 V325 V337 R338	I283-Y327 HydrophobicContact CG2-CD1 4.26Å; I283-Y327 HydrophobicContact CG2-CE1 3.47Å; I283-Y327 VanDerWaalsContact CG2-CE1 3.47Å; I283-Y327 HydrophobicContact CG2-CE2 4.16Å; I283-Y327 VanDerWaalsContact CG2-CZ 3.42Å; I283-Y327 WeakPolarHBondContact CG2-OH 3.35Å; S284-Y327 PolarHBondContact O-OH 3.42Å; S284-Y327 VanDerWaalsContact O-OH 3.11Å; W291-Y327 HydrophobicContact CH2-CD2 4.02Å; W291-Y327 AromaticContact CH2-CE2 3.71Å; W291-Y327 HydrophobicContact CH2-CE2 3.71Å; W291-Y327 AromaticContact CZ3-CD2 3.78Å; W291-Y327 HydrophobicContact CZ3-CD2 3.78Å; W291-Y327 AromaticContact CZ3-CE2 3.89Å; W291-Y327 HydrophobicContact CZ3-CE2 3.89Å; Y301-Y327 CarbonylContact C-O 3.58Å; Y301-Y327 WeakPolarHBondContact CA-O 3.12Å; Y301-Y327 WeakPolarHBondContact CB-O 3.48Å; L302-Y327 PolarHBondContact N-O 3.36Å; L302-Y327 PolarHBondContact O-N 3.14Å; V304-Y327 HydrophobicContact CG1-CE2 3.98Å; V325-Y327 HydrophobicContact CB-CD2 4.47Å; V325-Y327 HydrophobicContact CB-CE2 3.71Å; V325-Y327 HydrophobicContact CG1-CD2 4.09Å; V325-Y327 HydrophobicContact CG1-CE1 4.25Å; V325-Y327 HydrophobicContact CG1-CE2 3.56Å; Y327-V337 CarbonylContact C-O 3.54Å; Y327-V337 VanDerWaalsContact CA-O 3.25Å; Y327-V337 WeakPolarHBondContact CA-O 3.45Å; Y327-R338 HydrophobicContact CD1-CB 4.34Å; Y327-R338 HydrophobicContact CE1-CB 4.3Å
328	K	98.4	Very high	88.4	Confident	60 Å²	60	77.3 Å²	77.3	26%	0.261	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.9	178.1	-179.7	-179	178.6	-175.9	0	110	Y301 S330 V337 F339	Y301-K328 HydrophobicContact CD1-CB 3.74Å; Y301-K328 HydrophobicContact CD1-CG 3.96Å; Y301-K328 HydrophobicContact CE1-CB 3.69Å; Y301-K328 HydrophobicContact CE1-CD 3.7Å; Y301-K328 HydrophobicContact CE1-CG 3.57Å; K328-S330 PolarHBondContact O-N 3.09Å; K328-V337 PolarHBondContact N-O 2.98Å; K328-V337 WeakPolarHBondContact O-CG2 3.44Å; K328-V337 PolarHBondContact O-N 2.92Å; K328-F339 HydrophobicContact CB-CB 3.75Å; K328-F339 HydrophobicContact CB-CD2 4.15Å; K328-F339 HydrophobicContact CB-CG 4.02Å; K328-F339 HydrophobicContact CD-CD2 3.89Å; K328-F339 HydrophobicContact CD-CE2 4.25Å
329	W	98.3	Very high	91.1	Very high	24 Å²	24	71.8 Å²	71.8	9%	0.091	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	123.4	173.9	-178.4	-112	0	0	0	111.6	I249 I252 Y280 A300 K334 F336	I249-W329 HydrophobicContact CG2-CD2 4.03Å; I249-W329 HydrophobicContact CG2-CG 4.34Å; I249-W329 HydrophobicContact CG2-CZ2 4Å; I252-W329 HydrophobicContact CD1-CZ2 4.01Å; I252-W329 HydrophobicContact CG1-CH2 4.17Å; I252-W329 HydrophobicContact CG1-CZ2 3.61Å; Y280-W329 AromaticContact CE1-CH2 3.88Å; Y280-W329 HydrophobicContact CE1-CH2 3.88Å; Y280-W329 HydrophobicContact CE1-CZ3 4.11Å; A300-W329 HydrophobicContact CB-CB 4.06Å; A300-W329 WeakPolarHBondContact O-CB 3.03Å; A300-W329 PolarHBondContact O-N 3.17Å; W329-K334 HydrophobicContact CH2-CB 4.29Å; W329-K334 WeakPolarHBondContact CH2-O 3.11Å; W329-K334 HydrophobicContact CZ2-CB 4.11Å; W329-F336 HydrophobicContact CB-CD1 4.3Å; W329-F336 HydrophobicContact CB-CE1 4Å; W329-F336 HydrophobicContact CB-CZ 4.5Å; W329-F336 HydrophobicContact CE3-CD1 4.39Å; W329-F336 AromaticContact CE3-CD2 3.74Å; W329-F336 HydrophobicContact CE3-CD2 3.74Å; W329-F336 HydrophobicContact CE3-CE1 4.35Å; W329-F336 AromaticContact CE3-CE2 3.71Å; W329-F336 HydrophobicContact CE3-CE2 3.71Å; W329-F336 HydrophobicContact CE3-CG 4.1Å; W329-F336 HydrophobicContact CE3-CZ 4.04Å; W329-F336 HydrophobicContact CZ3-CD2 4.03Å; W329-F336 HydrophobicContact CZ3-CE2 4.07Å
330	S	97.8	Very high	93.3	Very high	24 Å²	24	68.3 Å²	68.3	17%	0.168	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	102.3	174	-175.8	0	0	0	0	110.3	K328 R332 R333 K334 R335	K328-S330 PolarHBondContact O-N 3.09Å; S330-R332 PolarHBondContact O-N 2.94Å; S330-R333 PolarHBondContact O-N 3.44Å; S330-R333 VanDerWaalsContact O-N 3.11Å; S330-R333 PolarHBondContact OG-N 3.34Å; S330-K334 WeakPolarHBondContact O-CA 3.42Å; S330-K334 PolarHBondContact O-N 3.48Å; S330-R335 WeakPolarHBondContact CB-O 3.44Å; S330-R335 PolarHBondContact N-O 2.95Å
331	K	95.4	Very high	95.3	Very high	129 Å²	129	65 Å²	65	56%	0.561	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-38.1	176.3	-66.4	-165.5	176	-158.6	0	112.8
332	R	95.8	Very high	96.8	Very high	201 Å²	201	62.1 Å²	62.1	76%	0.758	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-43.1	178.1	-174.2	-179.5	69.3	88.5	-9.5	112.8	S330	S330-R332 PolarHBondContact O-N 2.94Å
333	R	96.8	Very high	97.3	Very high	136 Å²	136	65.9 Å²	65.9	51%	0.513	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-7.6	-176.6	-60.4	-177	177.7	-176.9	-1.2	113.4	S330 R335	S330-R333 PolarHBondContact O-N 3.44Å; S330-R333 VanDerWaalsContact O-N 3.11Å; S330-R333 PolarHBondContact OG-N 3.34Å; R333-R335 VanDerWaalsContact C-N 3.27Å; R333-R335 HydrophobicContact CB-CG 3.75Å; R333-R335 PolarHBondContact O-N 3.4Å; R333-R335 PolarHBondContact O-NE 3.44Å
334	K	97.1	Very high	97.4	Very high	128 Å²	128	63.1 Å²	63.1	56%	0.557	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.6	52.3	-171.6	-59.6	-175.2	177.5	-174.9	0	111.5	I252 Y280 W329 S330	I252-K334 HydrophobicContact CD1-CD 4.23Å; I252-K334 HydrophobicContact CD1-CG 4.44Å; Y280-K334 VanDerWaalsContact CE1-O 3.29Å; Y280-K334 WeakPolarHBondContact CE1-O 3.4Å; Y280-K334 PolarHBondContact OH-O 3.26Å; W329-K334 HydrophobicContact CH2-CB 4.29Å; W329-K334 WeakPolarHBondContact CH2-O 3.11Å; W329-K334 HydrophobicContact CZ2-CB 4.11Å; S330-K334 WeakPolarHBondContact O-CA 3.42Å; S330-K334 PolarHBondContact O-N 3.48Å
335	R	97.9	Very high	97.3	Very high	136 Å²	136	65.9 Å²	65.9	51%	0.513	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	159.1	178.7	68	-177.8	67.9	-173	-3.2	111	S330 R333 V337	S330-R335 WeakPolarHBondContact CB-O 3.44Å; S330-R335 PolarHBondContact N-O 2.95Å; R333-R335 VanDerWaalsContact C-N 3.27Å; R333-R335 HydrophobicContact CB-CG 3.75Å; R333-R335 PolarHBondContact O-N 3.4Å; R333-R335 PolarHBondContact O-NE 3.44Å; R335-V337 HydrophobicContact CG-CG1 4.23Å
336	F	98.4	Very high	97.1	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	136.3	169.2	-74.2	-81.1	0	0	0	110.8	F247 I249 V269 Q281 I283 L302 W329	F247-F336 AromaticContact CE2-CE2 3.71Å; F247-F336 HydrophobicContact CE2-CE2 3.71Å; F247-F336 AromaticContact CE2-CZ 3.64Å; F247-F336 HydrophobicContact CE2-CZ 3.64Å; F247-F336 AromaticContact CZ-CE2 3.81Å; F247-F336 HydrophobicContact CZ-CE2 3.81Å; F247-F336 HydrophobicContact CZ-CZ 4.02Å; I249-F336 HydrophobicContact CD1-CZ 3.87Å; I249-F336 HydrophobicContact CG1-CZ 4.4Å; V269-F336 HydrophobicContact CG2-CD2 4.44Å; Q281-F336 PolarHBondContact NE2-O 3.38Å; I283-F336 HydrophobicContact CD1-CB 4.31Å; L302-F336 HydrophobicContact CB-CD1 4.31Å; L302-F336 HydrophobicContact CB-CE1 4.22Å; L302-F336 HydrophobicContact CD1-CD1 3.88Å; L302-F336 HydrophobicContact CD1-CD2 3.64Å; L302-F336 HydrophobicContact CD1-CE1 3.73Å; L302-F336 HydrophobicContact CD1-CE2 3.46Å; L302-F336 VanDerWaalsContact CD1-CE2 3.46Å; L302-F336 HydrophobicContact CD1-CG 3.84Å; L302-F336 HydrophobicContact CD1-CZ 3.49Å; L302-F336 VanDerWaalsContact CD1-CZ 3.49Å; L302-F336 HydrophobicContact CG-CD1 4.08Å; L302-F336 HydrophobicContact CG-CE1 3.63Å; L302-F336 HydrophobicContact CG-CE2 4.19Å; L302-F336 HydrophobicContact CG-CZ 3.68Å; W329-F336 HydrophobicContact CB-CD1 4.3Å; W329-F336 HydrophobicContact CB-CE1 4Å; W329-F336 HydrophobicContact CB-CZ 4.5Å; W329-F336 HydrophobicContact CE3-CD1 4.39Å; W329-F336 AromaticContact CE3-CD2 3.74Å; W329-F336 HydrophobicContact CE3-CD2 3.74Å; W329-F336 HydrophobicContact CE3-CE1 4.35Å; W329-F336 AromaticContact CE3-CE2 3.71Å; W329-F336 HydrophobicContact CE3-CE2 3.71Å; W329-F336 HydrophobicContact CE3-CG 4.1Å; W329-F336 HydrophobicContact CE3-CZ 4.04Å; W329-F336 HydrophobicContact CZ3-CD2 4.03Å; W329-F336 HydrophobicContact CZ3-CE2 4.07Å
337	V	98.1	Very high	97	Very high	42 Å²	42	65.8 Å²	65.8	26%	0.255	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.6	176.6	-63.4	0	0	0	0	109.7	Y327 K328 R335 F339	Y327-V337 CarbonylContact C-O 3.54Å; Y327-V337 VanDerWaalsContact CA-O 3.25Å; Y327-V337 WeakPolarHBondContact CA-O 3.45Å; K328-V337 PolarHBondContact N-O 2.98Å; K328-V337 WeakPolarHBondContact O-CG2 3.44Å; K328-V337 PolarHBondContact O-N 2.92Å; R335-V337 HydrophobicContact CG-CG1 4.23Å; V337-F339 PolarHBondContact O-N 2.99Å
338	R	97.9	Very high	97	Very high	153 Å²	153	67.4 Å²	67.4	58%	0.577	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.8	134.9	177.7	-178.7	165.3	-178.4	175.9	0.1	110.3	V325 Y327 T341	V325-R338 HydrophobicContact CG1-CB 4.36Å; V325-R338 HydrophobicContact CG1-CG 3.57Å; Y327-R338 HydrophobicContact CD1-CB 4.34Å; Y327-R338 HydrophobicContact CE1-CB 4.3Å; R338-T341 VanDerWaalsContact CZ-OG1 3.28Å; R338-T341 PolarHBondContact NE-OG1 3.16Å; R338-T341 PolarHBondContact NH2-OG1 2.83Å
339	F	98.3	Very high	97	Very high	63 Å²	63	65.3 Å²	65.3	28%	0.276	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	-51.2	-172.6	171.3	-104	0	0	0	111.9	Y301 I326 K328 V337 W382 K387	Y301-F339 HydrophobicContact CD1-CD1 4.13Å; Y301-F339 HydrophobicContact CD1-CE1 4.49Å; Y301-F339 HydrophobicContact CD1-CG 4.44Å; Y301-F339 AromaticContact CE1-CD1 3.82Å; Y301-F339 HydrophobicContact CE1-CD1 3.82Å; Y301-F339 HydrophobicContact CE1-CD2 4.3Å; Y301-F339 AromaticContact CE1-CE1 3.86Å; Y301-F339 HydrophobicContact CE1-CE1 3.86Å; Y301-F339 HydrophobicContact CE1-CE2 4.34Å; Y301-F339 HydrophobicContact CE1-CG 4.04Å; Y301-F339 HydrophobicContact CE1-CZ 4.11Å; I326-F339 HydrophobicContact CB-CD1 4.29Å; I326-F339 HydrophobicContact CG2-CD1 3.88Å; I326-F339 WeakPolarHBondContact O-CA 3.36Å; I326-F339 WeakPolarHBondContact O-CB 3.46Å; I326-F339 PolarHBondContact O-N 3.18Å; K328-F339 HydrophobicContact CB-CB 3.75Å; K328-F339 HydrophobicContact CB-CD2 4.15Å; K328-F339 HydrophobicContact CB-CG 4.02Å; K328-F339 HydrophobicContact CD-CD2 3.89Å; K328-F339 HydrophobicContact CD-CE2 4.25Å; V337-F339 PolarHBondContact O-N 2.99Å; F339-W382 HydrophobicContact CE1-CH2 4.25Å; F339-W382 AromaticContact CE1-CZ3 3.84Å; F339-W382 HydrophobicContact CE1-CZ3 3.84Å; F339-W382 AromaticContact CZ-CH2 3.74Å; F339-W382 HydrophobicContact CZ-CH2 3.74Å; F339-W382 AromaticContact CZ-CZ3 3.79Å; F339-W382 HydrophobicContact CZ-CZ3 3.79Å; F339-K387 WeakPolarHBondContact CZ-O 3.42Å
340	Q	98.1	Very high	97	Very high	31 Å²	31	64.2 Å²	64.2	15%	0.145	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.4	-179.9	-176.4	172.5	3.4	0	0	110	I326 L342 F389	I326-Q340 HydrophobicContact CB-CB 4.22Å; I326-Q340 HydrophobicContact CD1-CB 4.33Å; I326-Q340 PolarHBondContact N-O 3.16Å; I326-Q340 PolarHBondContact O-N 3.42Å; I326-Q340 VanDerWaalsContact O-N 3.12Å; Q340-L342 HydrophobicContact CG-CD2 4.18Å; Q340-L342 HydrophobicContact CG-CG 4.41Å; Q340-L342 VanDerWaalsContact NE2-CD2 3.33Å; Q340-F389 PolarHBondContact NE2-O 3.19Å
341	T	97.1	Very high	97.1	Very high	56 Å²	56	63.6 Å²	63.6	34%	0.344	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.9	172.1	-62.2	0	0	0	0	108.5	F323 S324 R338	F323-T341 HydrophobicContact CB-CG2 3.7Å; F323-T341 HydrophobicContact CD2-CG2 3.68Å; F323-T341 HydrophobicContact CG-CG2 3.81Å; S324-T341 WeakPolarHBondContact O-CA 3.31Å; R338-T341 VanDerWaalsContact CZ-OG1 3.28Å; R338-T341 PolarHBondContact NE-OG1 3.16Å; R338-T341 PolarHBondContact NH2-OG1 2.83Å
342	L	96.8	Very high	97.2	Very high	10 Å²	10	58.5 Å²	58.5	5%	0.052	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.7	-178.1	-64.3	177.8	0	0	0	107.7	F323 S324 I326 Q340 T344 W350 Y380 F389	F323-L342 CarbonylContact C-O 3.54Å; F323-L342 VanDerWaalsContact CA-O 3.32Å; F323-L342 WeakPolarHBondContact CA-O 3.2Å; F323-L342 WeakPolarHBondContact CB-O 3.27Å; S324-L342 PolarHBondContact N-O 3.05Å; S324-L342 PolarHBondContact O-N 2.84Å; I326-L342 HydrophobicContact CD1-CD1 3.81Å; I326-L342 HydrophobicContact CD1-CG 4.45Å; I326-L342 HydrophobicContact CG1-CD1 4.44Å; Q340-L342 HydrophobicContact CG-CD2 4.18Å; Q340-L342 HydrophobicContact CG-CG 4.41Å; Q340-L342 VanDerWaalsContact NE2-CD2 3.33Å; L342-T344 PolarHBondContact O-N 2.75Å; L342-W350 HydrophobicContact CB-CH2 4.34Å; L342-W350 HydrophobicContact CD1-CH2 3.54Å; L342-W350 HydrophobicContact CD1-CZ2 4.28Å; L342-W350 HydrophobicContact CD1-CZ3 4.19Å; L342-Y380 HydrophobicContact CD1-CD1 4.24Å; L342-Y380 HydrophobicContact CD1-CD2 4.26Å; L342-Y380 HydrophobicContact CD1-CE1 4.22Å; L342-Y380 HydrophobicContact CD1-CE2 4.23Å; L342-Y380 HydrophobicContact CD1-CG 4.26Å; L342-Y380 HydrophobicContact CD2-CD1 4.16Å; L342-Y380 HydrophobicContact CD2-CE1 3.87Å; L342-Y380 HydrophobicContact CG-CE1 4.46Å; L342-F389 HydrophobicContact CD1-CB 4.34Å
343	Q	94.9	Very high	97.3	Very high	104 Å²	104	49.3 Å²	49.3	49%	0.486	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	131.3	173.2	-174.3	170.2	15.3	0	0	109	Y345 Y380	Q343-Y345 PolarHBondContact NE2-OH 3.34Å; Q343-Y380 PolarHBondContact O-OH 3.15Å
344	T	95.9	Very high	97.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.209	C	C	.	.			trans	-137.2	177.7	178.6	55.2	0	0	0	0	109.4	D322 F323 S324 L342 A347 W350 V363	D322-T344 CarbonylContact C-O 3.46Å; D322-T344 WeakPolarHBondContact CB-O 3.15Å; D322-T344 PolarHBondContact O-N 2.87Å; F323-T344 WeakPolarHBondContact CA-OG1 3.29Å; S324-T344 PolarHBondContact N-OG1 2.86Å; S324-T344 VanDerWaalsContact N-OG1 3.13Å; L342-T344 PolarHBondContact O-N 2.75Å; T344-A347 HydrophobicContact CG2-CB 4.23Å; T344-W350 HydrophobicContact CG2-CH2 4.39Å; T344-W350 HydrophobicContact CG2-CZ2 3.62Å; T344-V363 HydrophobicContact CG2-CG2 3.89Å
345	Y	94.9	Very high	97.4	Very high	59 Å²	59	40.1 Å²	40.1	23%	0.231	18%	0.183	C	C	.	.	S	Bend	trans	-138.5	95.2	-178.2	-61.1	-72.3	0	0	0	109.4	Q343 A347 N365 H366 R367 M368 I375	Q343-Y345 PolarHBondContact NE2-OH 3.34Å; Y345-A347 VanDerWaalsContact C-N 3.35Å; Y345-A347 PolarHBondContact O-N 2.74Å; Y345-N365 PolarHBondContact N-OD1 3.41Å; Y345-H366 PolarHBondContact O-N 2.92Å; Y345-H366 VanDerWaalsContact O-N 3.11Å; Y345-R367 CarbonylContact C-O 3.57Å; Y345-R367 VanDerWaalsContact CB-O 3.31Å; Y345-R367 WeakPolarHBondContact CB-O 3.3Å; Y345-R367 PolarHBondContact O-N 3.15Å; Y345-M368 HydrophobicContact CD1-CB 4.06Å; Y345-M368 HydrophobicContact CD1-CE 3.71Å; Y345-M368 HydrophobicContact CD1-CG 3.66Å; Y345-M368 HydrophobicContact CD1-SD 4.39Å; Y345-M368 HydrophobicContact CD2-CE 3.76Å; Y345-M368 HydrophobicContact CE1-CE 3.39Å; Y345-M368 HydrophobicContact CE1-CG 3.88Å; Y345-M368 HydrophobicContact CE1-SD 4.1Å; Y345-M368 HydrophobicContact CE2-CE 3.46Å; Y345-M368 VanDerWaalsContact CE2-CE 3.46Å; Y345-M368 HydrophobicContact CG-CB 4.28Å; Y345-M368 HydrophobicContact CG-CE 3.87Å; Y345-M368 HydrophobicContact CG-CG 4.32Å; Y345-I375 HydrophobicContact CG-CD1 4.39Å
346	C	94.1	Very high	97.2	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	19%	0.194	C	C	.	.	S	Bend	trans	41.4	60.4	-167.4	-177.3	0	0	0	0	111.8	D322 R348 H366 R367	D322-C346 PolarHBondContact OD2-N 2.84Å; C346-R348 PolarHBondContact O-N 2.82Å; C346-H366 HydrophobicContact CB-CB 4.47Å; C346-H366 WeakPolarHBondContact O-CB 3.39Å; C346-R367 HydrophobicContact CB-CG 3.78Å; C346-R367 PolarHBondContact SG-NH1 3Å; C346-R367 PolarHBondContact SG-NH2 3.41Å
347	A	96.8	Very high	96.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	133.1	-176.3	0	0	0	0	0	110.7	S305 N306 T344 Y345 V363 A364	S305-A347 WeakPolarHBondContact CB-O 3.45Å; N306-A347 PolarHBondContact O-N 3.26Å; N306-A347 VanDerWaalsContact O-N 3.14Å; T344-A347 HydrophobicContact CG2-CB 4.23Å; Y345-A347 VanDerWaalsContact C-N 3.35Å; Y345-A347 PolarHBondContact O-N 2.74Å; A347-V363 HydrophobicContact CB-CG2 3.74Å; A347-A364 WeakPolarHBondContact CA-O 3.49Å
348	R	97.7	Very high	96.9	Very high	54 Å²	54	47.4 Å²	47.4	20%	0.204	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-44.8	177.3	-66.8	-59.9	-164.8	115	10.7	112	S290 S305 C346 A364 H366 A400 Y401	S290-R348 WeakPolarHBondContact CB-O 3.22Å; S305-R348 VanDerWaalsContact CB-O 3.3Å; S305-R348 WeakPolarHBondContact CB-O 3.49Å; S305-R348 PolarHBondContact OG-O 3.43Å; C346-R348 PolarHBondContact O-N 2.82Å; R348-A364 HydrophobicContact CB-CB 4.41Å; R348-A364 PolarHBondContact N-O 3.04Å; R348-H366 HydrophobicContact CG-CB 3.57Å; R348-H366 PolarHBondContact NH2-CE1 3.29Å; R348-H366 VanDerWaalsContact NH2-CE1 3.33Å; R348-H366 PolarHBondContact NH2-NE2 2.74Å; R348-H366 VanDerWaalsContact NH2-NE2 3.18Å; R348-A400 WeakPolarHBondContact CG-O 3.42Å; R348-Y401 WeakPolarHBondContact CB-O 3.39Å; R348-Y401 HydrophobicContact CG-CD2 4.32Å; R348-Y401 HydrophobicContact CG-CG 4.48Å; R348-Y401 VanDerWaalsContact CZ-CZ 3.44Å; R348-Y401 VanDerWaalsContact NH1-CE1 3.28Å; R348-Y401 VanDerWaalsContact NH1-CZ 3.34Å; R348-Y401 PolarHBondContact NH2-OH 3.03Å
349	D	98.6	Very high	96.9	Very high	16 Å²	16	40.7 Å²	40.7	9%	0.086	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.5	-175	171.4	54.3	0	0	0	111.2	S305 A364 Y401 W403	S305-D349 VanDerWaalsContact OG-C 3.3Å; S305-D349 VanDerWaalsContact OG-CA 3.29Å; S305-D349 WeakPolarHBondContact OG-CA 3.32Å; S305-D349 PolarHBondContact OG-N 2.95Å; D349-A364 HydrophobicContact CB-CB 4Å; D349-A364 PolarHBondContact O-N 2.79Å; D349-Y401 WeakPolarHBondContact CB-O 3.06Å; D349-W403 PolarHBondContact OD2-N 2.83Å; D349-W403 VanDerWaalsContact OD2-N 3.16Å
350	W	98.8	Very high	96.9	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125.3	166.7	-79.2	94.5	0	0	0	111.1	K292 V303 S324 L342 T344 L361 A362 V363 Y380	K292-W350 HydrophobicContact CB-CB 4.01Å; K292-W350 WeakPolarHBondContact CB-O 3.44Å; K292-W350 WeakPolarHBondContact CD-O 3.19Å; K292-W350 WeakPolarHBondContact CG-O 3.35Å; V303-W350 HydrophobicContact CB-CG 4.37Å; V303-W350 HydrophobicContact CG1-CB 3.57Å; V303-W350 HydrophobicContact CG1-CD2 4.16Å; V303-W350 HydrophobicContact CG1-CG 3.67Å; V303-W350 HydrophobicContact CG2-CD2 3.74Å; V303-W350 HydrophobicContact CG2-CE3 4.42Å; V303-W350 HydrophobicContact CG2-CG 3.78Å; V303-W350 HydrophobicContact CG2-CZ2 4.22Å; S324-W350 PolarHBondContact OG-NE1 3.1Å; L342-W350 HydrophobicContact CB-CH2 4.34Å; L342-W350 HydrophobicContact CD1-CH2 3.54Å; L342-W350 HydrophobicContact CD1-CZ2 4.28Å; L342-W350 HydrophobicContact CD1-CZ3 4.19Å; T344-W350 HydrophobicContact CG2-CH2 4.39Å; T344-W350 HydrophobicContact CG2-CZ2 3.62Å; W350-L361 HydrophobicContact CE3-CB 3.82Å; W350-L361 HydrophobicContact CE3-CD1 4.48Å; W350-L361 HydrophobicContact CZ3-CB 3.74Å; W350-L361 HydrophobicContact CZ3-CD1 4.38Å; W350-A362 CarbonylContact C-O 3.45Å; W350-A362 VanDerWaalsContact CA-O 3.26Å; W350-A362 WeakPolarHBondContact CA-O 2.96Å; W350-V363 HydrophobicContact CD2-CB 3.85Å; W350-V363 HydrophobicContact CD2-CG2 4.02Å; W350-V363 HydrophobicContact CE3-CB 3.77Å; W350-V363 HydrophobicContact CE3-CG2 4.45Å; W350-V363 HydrophobicContact CH2-CB 3.62Å; W350-V363 HydrophobicContact CH2-CG1 4.08Å; W350-V363 HydrophobicContact CH2-CG2 4.17Å; W350-V363 HydrophobicContact CZ2-CB 3.66Å; W350-V363 HydrophobicContact CZ2-CG1 4.36Å; W350-V363 HydrophobicContact CZ2-CG2 3.67Å; W350-V363 HydrophobicContact CZ3-CB 3.67Å; W350-V363 HydrophobicContact CZ3-CG1 4.35Å; W350-Y380 AromaticContact CH2-CD2 3.84Å; W350-Y380 HydrophobicContact CH2-CD2 3.84Å; W350-Y380 AromaticContact CH2-CE2 3.53Å; W350-Y380 HydrophobicContact CH2-CE2 3.53Å; W350-Y380 AromaticContact CZ3-CD2 3.69Å; W350-Y380 HydrophobicContact CZ3-CD2 3.69Å; W350-Y380 AromaticContact CZ3-CE2 3.85Å; W350-Y380 HydrophobicContact CZ3-CE2 3.85Å
351	E	98.8	Very high	96.9	Very high	12 Å²	12	36.7 Å²	36.7	6%	0.056	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.9	173.5	-175.6	42.3	-134.3	0	0	111.7	K292 F353 L361 A362 W403 F405 L414	K292-E351 WeakPolarHBondContact CE-OE2 3.27Å; K292-E351 IonicContact NZ-OE1 2.71Å; K292-E351 IonicContact NZ-OE2 3.22Å; K292-E351 PolarHBondContact NZ-OE2 3.49Å; E351-F353 HydrophobicContact CG-CD1 4.16Å; E351-L361 CarbonylContact O-C 3.42Å; E351-L361 VanDerWaalsContact O-CA 3.29Å; E351-L361 WeakPolarHBondContact O-CA 3.43Å; E351-A362 HydrophobicContact CB-CB 4.47Å; E351-A362 PolarHBondContact N-O 3.33Å; E351-A362 PolarHBondContact O-N 3.19Å; E351-W403 HydrophobicContact CB-CB 3.56Å; E351-W403 VanDerWaalsContact CB-O 3.23Å; E351-W403 WeakPolarHBondContact CB-O 3.49Å; E351-W403 HydrophobicContact CG-CB 4.29Å; E351-W403 VanDerWaalsContact CG-O 3.3Å; E351-W403 WeakPolarHBondContact CG-O 3.26Å; E351-F405 HydrophobicContact CG-CB 3.71Å; E351-L414 HydrophobicContact CG-CD1 4.34Å
352	A	98.7	Very high	97	Very high	22 Å²	22	34 Å²	34	18%	0.182	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.4	-172.2	0	0	0	0	0	112	K292 F294 L361	K292-A352 HydrophobicContact CG-CB 3.95Å; F294-A352 HydrophobicContact CB-CB 3.56Å; F294-A352 HydrophobicContact CD1-CB 4.34Å; F294-A352 HydrophobicContact CG-CB 4.08Å; A352-L361 HydrophobicContact CB-CD2 3.45Å; A352-L361 VanDerWaalsContact CB-CD2 3.45Å
353	F	98.6	Very high	97.1	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	159.3	-170.9	55.6	-89.4	0	0	0	114.2	E351 I355 Y360 A362 I379 F405 L414 F439	E351-F353 HydrophobicContact CG-CD1 4.16Å; F353-I355 HydrophobicContact CD2-CD1 4.14Å; F353-I355 HydrophobicContact CD2-CG1 4.15Å; F353-I355 HydrophobicContact CE2-CD1 4.02Å; F353-I355 HydrophobicContact CE2-CG1 4.49Å; F353-Y360 HydrophobicContact CD2-CD2 4.36Å; F353-Y360 HydrophobicContact CD2-CG 4.38Å; F353-Y360 HydrophobicContact CE2-CD2 4.17Å; F353-Y360 AromaticContact CE2-CG 3.87Å; F353-Y360 HydrophobicContact CE2-CG 3.87Å; F353-Y360 HydrophobicContact CZ-CG 4.45Å; F353-Y360 PolarHBondContact N-O 2.82Å; F353-Y360 PolarHBondContact O-N 2.87Å; F353-A362 HydrophobicContact CE1-CB 3.9Å; F353-I379 HydrophobicContact CZ-CG2 4.07Å; F353-F405 HydrophobicContact CB-CB 3.85Å; F353-F405 HydrophobicContact CB-CD1 3.28Å; F353-F405 HydrophobicContact CB-CD2 3.67Å; F353-F405 HydrophobicContact CB-CE1 3.64Å; F353-F405 HydrophobicContact CB-CE2 3.99Å; F353-F405 HydrophobicContact CB-CG 3.28Å; F353-F405 HydrophobicContact CB-CZ 3.98Å; F353-F405 HydrophobicContact CD1-CB 3.88Å; F353-F405 AromaticContact CD1-CD2 3.98Å; F353-F405 HydrophobicContact CD1-CD2 3.98Å; F353-F405 AromaticContact CD1-CG 3.96Å; F353-F405 HydrophobicContact CD1-CG 3.96Å; F353-F405 AromaticContact CD2-CD2 3.56Å; F353-F405 HydrophobicContact CD2-CD2 3.56Å; F353-F405 AromaticContact CD2-CE2 3.58Å; F353-F405 HydrophobicContact CD2-CE2 3.58Å; F353-F405 HydrophobicContact CD2-CG 4.12Å; F353-F405 HydrophobicContact CD2-CZ 4.16Å; F353-F405 HydrophobicContact CE2-CD2 4.15Å; F353-F405 HydrophobicContact CE2-CE2 4.25Å; F353-F405 HydrophobicContact CG-CB 3.99Å; F353-F405 HydrophobicContact CG-CD1 4.06Å; F353-F405 AromaticContact CG-CD2 3.46Å; F353-F405 HydrophobicContact CG-CD2 3.46Å; F353-F405 VanDerWaalsContact CG-CD2 3.46Å; F353-F405 HydrophobicContact CG-CE1 4.44Å; F353-F405 AromaticContact CG-CE2 3.89Å; F353-F405 HydrophobicContact CG-CE2 3.89Å; F353-F405 AromaticContact CG-CG 3.54Å; F353-F405 HydrophobicContact CG-CG 3.54Å; F353-F405 HydrophobicContact CG-CZ 4.36Å; F353-L414 HydrophobicContact CE1-CD1 4.1Å; F353-L414 HydrophobicContact CZ-CD2 4.48Å; F353-F439 AromaticContact CE2-CE2 3.72Å; F353-F439 HydrophobicContact CE2-CE2 3.72Å; F353-F439 AromaticContact CE2-CZ 3.81Å; F353-F439 HydrophobicContact CE2-CZ 3.81Å; F353-F439 AromaticContact CZ-CE2 3.75Å; F353-F439 HydrophobicContact CZ-CE2 3.75Å; F353-F439 HydrophobicContact CZ-CZ 4.07Å
354	D	97.9	Very high	97.3	Very high	70 Å²	70	28.6 Å²	28.6	37%	0.374	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	127.4	177.2	-69.2	-56	0	0	0	112.1	Q358 T359 K407	D354-Q358 WeakPolarHBondContact CA-O 3.33Å; D354-T359 WeakPolarHBondContact OD1-CA 3.47Å; D354-T359 VanDerWaalsContact OD1-CB 3.28Å; D354-T359 WeakPolarHBondContact OD1-CB 3.43Å; D354-T359 PolarHBondContact OD1-N 2.82Å; D354-T359 PolarHBondContact OD1-OG1 3.24Å; D354-K407 WeakPolarHBondContact O-CE 3.49Å; D354-K407 PolarHBondContact O-NZ 3.41Å
355	I	97.6	Very high	97.4	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.8	171	-59.8	175.1	0	0	0	107.5	F353 E357 Q358 Y360 F405 H412 W434 F439	F353-I355 HydrophobicContact CD2-CD1 4.14Å; F353-I355 HydrophobicContact CD2-CG1 4.15Å; F353-I355 HydrophobicContact CE2-CD1 4.02Å; F353-I355 HydrophobicContact CE2-CG1 4.49Å; I355-E357 PolarHBondContact O-N 3.26Å; I355-Q358 PolarHBondContact N-O 2.96Å; I355-Q358 WeakPolarHBondContact O-CB 3.31Å; I355-Q358 PolarHBondContact O-N 3.3Å; I355-Y360 HydrophobicContact CB-CD2 4.47Å; I355-Y360 HydrophobicContact CB-CE2 4.09Å; I355-F405 HydrophobicContact CD1-CE2 4.04Å; I355-F405 HydrophobicContact CG1-CE2 4.03Å; I355-F405 HydrophobicContact CG1-CZ 4.04Å; I355-H412 HydrophobicContact CD1-CB 4.07Å; I355-H412 HydrophobicContact CG1-CB 4.25Å; I355-W434 HydrophobicContact CD1-CB 4.36Å; I355-W434 HydrophobicContact CD1-CD2 3.58Å; I355-W434 HydrophobicContact CD1-CE3 3.59Å; I355-W434 HydrophobicContact CD1-CG 3.95Å; I355-W434 HydrophobicContact CD1-CH2 4.35Å; I355-W434 HydrophobicContact CD1-CZ2 4.37Å; I355-W434 HydrophobicContact CD1-CZ3 4Å; I355-W434 HydrophobicContact CG2-CD2 4.43Å; I355-W434 HydrophobicContact CG2-CG 4.45Å; I355-W434 HydrophobicContact CG2-CZ2 4.38Å; I355-F439 HydrophobicContact CD1-CE2 4.29Å; I355-F439 HydrophobicContact CD1-CZ 3.83Å
356	N	93.7	Very high	97.5	Very high	137 Å²	137	26.2 Å²	26.2	73%	0.733	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	50.2	178.7	-58.2	-28.8	0	0	0	113.9	Q358	N356-Q358 PolarHBondContact O-N 3.43Å; N356-Q358 VanDerWaalsContact O-N 3.12Å
357	E	92.1	Very high	97.5	Very high	165 Å²	165	28.9 Å²	28.9	77%	0.771	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	19.2	-178.8	-53.7	-176.1	178.3	0	0	115.6	I355 R384	I355-E357 PolarHBondContact O-N 3.26Å; E357-R384 PolarHBondContact O-NH2 3.24Å
358	Q	96.8	Very high	97.2	Very high	32 Å²	32	32.4 Å²	32.4	15%	0.15	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.5	176.2	178.4	63.2	66.9	0	0	109.5	D354 I355 N356 Y360 K381 W382	D354-Q358 WeakPolarHBondContact CA-O 3.33Å; I355-Q358 PolarHBondContact N-O 2.96Å; I355-Q358 WeakPolarHBondContact O-CB 3.31Å; I355-Q358 PolarHBondContact O-N 3.3Å; N356-Q358 PolarHBondContact O-N 3.43Å; N356-Q358 VanDerWaalsContact O-N 3.12Å; Q358-Y360 HydrophobicContact CB-CE2 3.73Å; Q358-Y360 HydrophobicContact CG-CD2 4.17Å; Q358-Y360 HydrophobicContact CG-CE1 4.49Å; Q358-Y360 HydrophobicContact CG-CE2 3.39Å; Q358-Y360 WeakPolarHBondContact O-CD2 3.21Å; Q358-Y360 VanDerWaalsContact O-CE2 3.25Å; Q358-Y360 WeakPolarHBondContact O-CE2 3.27Å; Q358-K381 VanDerWaalsContact CD-CE 3.45Å; Q358-K381 HydrophobicContact CG-CD 4.07Å; Q358-K381 HydrophobicContact CG-CG 3.83Å; Q358-W382 PolarHBondContact NE2-O 2.95Å
359	T	98.3	Very high	96.5	Very high	12 Å²	12	32.2 Å²	32.2	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	136.9	178.6	-47.6	0	0	0	0	111.2	I296 D354 W382 F389	I296-T359 HydrophobicContact CG1-CG2 4.21Å; D354-T359 WeakPolarHBondContact OD1-CA 3.47Å; D354-T359 VanDerWaalsContact OD1-CB 3.28Å; D354-T359 WeakPolarHBondContact OD1-CB 3.43Å; D354-T359 PolarHBondContact OD1-N 2.82Å; D354-T359 PolarHBondContact OD1-OG1 3.24Å; T359-W382 WeakPolarHBondContact O-CB 3.26Å; T359-W382 PolarHBondContact O-N 3.39Å; T359-F389 HydrophobicContact CG2-CE1 4.39Å; T359-F389 HydrophobicContact CG2-CZ 4.24Å
360	Y	98.8	Very high	95.6	Very high	11 Å²	11	39.3 Å²	39.3	4%	0.043	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	158.2	177.7	-64.2	-95.2	0	0	0	110.5	F353 I355 Q358 I379 Y380 K381 H392 W434	F353-Y360 HydrophobicContact CD2-CD2 4.36Å; F353-Y360 HydrophobicContact CD2-CG 4.38Å; F353-Y360 HydrophobicContact CE2-CD2 4.17Å; F353-Y360 AromaticContact CE2-CG 3.87Å; F353-Y360 HydrophobicContact CE2-CG 3.87Å; F353-Y360 HydrophobicContact CZ-CG 4.45Å; F353-Y360 PolarHBondContact N-O 2.82Å; F353-Y360 PolarHBondContact O-N 2.87Å; I355-Y360 HydrophobicContact CB-CD2 4.47Å; I355-Y360 HydrophobicContact CB-CE2 4.09Å; Q358-Y360 HydrophobicContact CB-CE2 3.73Å; Q358-Y360 HydrophobicContact CG-CD2 4.17Å; Q358-Y360 HydrophobicContact CG-CE1 4.49Å; Q358-Y360 HydrophobicContact CG-CE2 3.39Å; Q358-Y360 WeakPolarHBondContact O-CD2 3.21Å; Q358-Y360 VanDerWaalsContact O-CE2 3.25Å; Q358-Y360 WeakPolarHBondContact O-CE2 3.27Å; Y360-I379 HydrophobicContact CD1-CG2 4.06Å; Y360-Y380 CarbonylContact C-O 3.56Å; Y360-Y380 WeakPolarHBondContact CA-O 3.3Å; Y360-Y380 WeakPolarHBondContact CB-O 3.3Å; Y360-Y380 WeakPolarHBondContact CD1-O 3.3Å; Y360-K381 HydrophobicContact CD1-CB 3.8Å; Y360-K381 HydrophobicContact CD1-CG 4.22Å; Y360-K381 HydrophobicContact CE1-CB 3.66Å; Y360-K381 HydrophobicContact CE1-CD 3.84Å; Y360-K381 HydrophobicContact CE1-CG 3.75Å; Y360-H392 HydrophobicContact CE1-CB 4.36Å; Y360-H392 AromaticContact CE1-CD2 3.9Å; Y360-H392 AromaticContact CE1-CG 3.79Å; Y360-H392 AromaticContact CE1-ND1 3.94Å; Y360-W434 HydrophobicContact CE1-CH2 4.02Å; Y360-W434 AromaticContact CZ-CH2 3.88Å
361	L	98.9	Very high	94.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.7	170.6	-67.5	176.5	0	0	0	108.7	F294 I326 W350 E351 A352 I379 Y380 F389	F294-L361 HydrophobicContact CD1-CD2 4Å; F294-L361 HydrophobicContact CD2-CD2 4.45Å; F294-L361 HydrophobicContact CE1-CD1 4.15Å; F294-L361 HydrophobicContact CE1-CD2 4.03Å; F294-L361 HydrophobicContact CE2-CD1 4.48Å; F294-L361 HydrophobicContact CE2-CD2 4.48Å; F294-L361 HydrophobicContact CG-CD2 4.22Å; F294-L361 HydrophobicContact CZ-CD1 3.9Å; F294-L361 HydrophobicContact CZ-CD2 4.26Å; I326-L361 HydrophobicContact CD1-CD1 3.8Å; W350-L361 HydrophobicContact CE3-CB 3.82Å; W350-L361 HydrophobicContact CE3-CD1 4.48Å; W350-L361 HydrophobicContact CZ3-CB 3.74Å; W350-L361 HydrophobicContact CZ3-CD1 4.38Å; E351-L361 CarbonylContact O-C 3.42Å; E351-L361 VanDerWaalsContact O-CA 3.29Å; E351-L361 WeakPolarHBondContact O-CA 3.43Å; A352-L361 HydrophobicContact CB-CD2 3.45Å; A352-L361 VanDerWaalsContact CB-CD2 3.45Å; L361-I379 CarbonylContact O-C 3.47Å; L361-I379 WeakPolarHBondContact O-CA 3.37Å; L361-Y380 PolarHBondContact N-O 3.1Å; L361-Y380 PolarHBondContact O-N 3.39Å; L361-F389 HydrophobicContact CB-CD1 4.46Å; L361-F389 HydrophobicContact CB-CE1 4.32Å; L361-F389 HydrophobicContact CD1-CD1 3.92Å; L361-F389 HydrophobicContact CD1-CD2 3.85Å; L361-F389 HydrophobicContact CD1-CE1 3.7Å; L361-F389 HydrophobicContact CD1-CE2 3.6Å; L361-F389 HydrophobicContact CD1-CG 3.99Å; L361-F389 HydrophobicContact CD1-CZ 3.51Å; L361-F389 HydrophobicContact CG-CD1 4.06Å; L361-F389 HydrophobicContact CG-CE1 3.57Å; L361-F389 HydrophobicContact CG-CE2 4.31Å; L361-F389 HydrophobicContact CG-CZ 3.69Å
362	A	98.9	Very high	94.5	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.8	169.5	0	0	0	0	0	109.6	W350 E351 F353 V378 I379 W403 L414	W350-A362 CarbonylContact C-O 3.45Å; W350-A362 VanDerWaalsContact CA-O 3.26Å; W350-A362 WeakPolarHBondContact CA-O 2.96Å; E351-A362 HydrophobicContact CB-CB 4.47Å; E351-A362 PolarHBondContact N-O 3.33Å; E351-A362 PolarHBondContact O-N 3.19Å; F353-A362 HydrophobicContact CE1-CB 3.9Å; A362-V378 WeakPolarHBondContact CA-O 3.42Å; A362-I379 HydrophobicContact CB-CG1 4.18Å; A362-W403 HydrophobicContact CB-CB 4.45Å; A362-W403 HydrophobicContact CB-CD2 4.39Å; A362-W403 HydrophobicContact CB-CG 4.07Å; A362-L414 HydrophobicContact CB-CD2 4.35Å
363	V	98.8	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	173	61.9	0	0	0	0	111	T344 A347 W350 N365 S377 V378 Y380 W403	T344-V363 HydrophobicContact CG2-CG2 3.89Å; A347-V363 HydrophobicContact CB-CG2 3.74Å; W350-V363 HydrophobicContact CD2-CB 3.85Å; W350-V363 HydrophobicContact CD2-CG2 4.02Å; W350-V363 HydrophobicContact CE3-CB 3.77Å; W350-V363 HydrophobicContact CE3-CG2 4.45Å; W350-V363 HydrophobicContact CH2-CB 3.62Å; W350-V363 HydrophobicContact CH2-CG1 4.08Å; W350-V363 HydrophobicContact CH2-CG2 4.17Å; W350-V363 HydrophobicContact CZ2-CB 3.66Å; W350-V363 HydrophobicContact CZ2-CG1 4.36Å; W350-V363 HydrophobicContact CZ2-CG2 3.67Å; W350-V363 HydrophobicContact CZ3-CB 3.67Å; W350-V363 HydrophobicContact CZ3-CG1 4.35Å; V363-N365 PolarHBondContact O-N 2.87Å; V363-S377 WeakPolarHBondContact O-CB 3.15Å; V363-S377 PolarHBondContact O-OG 2.74Å; V363-V378 HydrophobicContact CG1-CB 3.97Å; V363-V378 PolarHBondContact N-O 3.48Å; V363-Y380 HydrophobicContact CG1-CE2 3.98Å; V363-W403 VanDerWaalsContact C-CD1 3.45Å; V363-W403 VanDerWaalsContact C-NE1 3.29Å; V363-W403 PolarHBondContact O-NE1 2.66Å
364	A	98.6	Very high	94.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	98.2	170.3	0	0	0	0	0	109.6	A347 R348 D349 A400 W403	A347-A364 WeakPolarHBondContact CA-O 3.49Å; R348-A364 HydrophobicContact CB-CB 4.41Å; R348-A364 PolarHBondContact N-O 3.04Å; D349-A364 HydrophobicContact CB-CB 4Å; D349-A364 PolarHBondContact O-N 2.79Å; A364-A400 HydrophobicContact CB-CB 3.8Å; A364-W403 VanDerWaalsContact N-CD1 3.32Å
365	N	98.1	Very high	94.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	119	176.7	-77.7	-33.3	0	0	0	110.3	Y345 V363 I375 N376 S377	Y345-N365 PolarHBondContact N-OD1 3.41Å; V363-N365 PolarHBondContact O-N 2.87Å; N365-I375 HydrophobicContact CB-CD1 3.69Å; N365-I375 HydrophobicContact CB-CG1 4.19Å; N365-N376 PolarHBondContact ND2-O 2.91Å; N365-S377 PolarHBondContact N-OG 2.98Å; N365-S377 VanDerWaalsContact N-OG 3.16Å
366	H	96.5	Very high	94.2	Very high	9 Å²	9	50.7 Å²	50.7	4%	0.042	27%	0.272	C	S	.	.			trans	-92.1	-39.7	-172.2	168.6	-98.5	0	0	0	114.4	Y345 C346 R348 H373 G399 Y401	Y345-H366 PolarHBondContact O-N 2.92Å; Y345-H366 VanDerWaalsContact O-N 3.11Å; C346-H366 HydrophobicContact CB-CB 4.47Å; C346-H366 WeakPolarHBondContact O-CB 3.39Å; R348-H366 HydrophobicContact CG-CB 3.57Å; R348-H366 PolarHBondContact NH2-CE1 3.29Å; R348-H366 VanDerWaalsContact NH2-CE1 3.33Å; R348-H366 PolarHBondContact NH2-NE2 2.74Å; R348-H366 VanDerWaalsContact NH2-NE2 3.18Å; H366-H373 AromaticContact CE1-CE1 3.33Å; H366-H373 PolarHBondContact CE1-CE1 3.48Å; H366-H373 AromaticContact CE1-ND1 3.61Å; H366-H373 AromaticContact ND1-CE1 3.97Å; H366-H373 AromaticContact NE2-CE1 3.78Å; H366-H373 AromaticContact NE2-ND1 3.74Å; H366-H373 PolarHBondContact O-ND1 2.86Å; H366-H373 VanDerWaalsContact O-ND1 3.15Å; H366-G399 WeakPolarHBondContact O-CA 3.22Å; H366-Y401 AromaticContact CD2-CD2 3.74Å; H366-Y401 AromaticContact CD2-CE2 3.25Å; H366-Y401 WeakPolarHBondContact CD2-CE2 3.45Å; H366-Y401 AromaticContact NE2-CE2 3.46Å; H366-Y401 WeakPolarHBondContact NE2-CE2 3.41Å
367	R	94.3	Very high	94.5	Very high	56 Å²	56	44.2 Å²	44.2	21%	0.211	24%	0.238	C	C	.	.			trans	-158.7	146.8	178.4	71.5	177.2	-178.1	-79.8	-19.8	112.5	Y345 C346 N372	Y345-R367 CarbonylContact C-O 3.57Å; Y345-R367 VanDerWaalsContact CB-O 3.31Å; Y345-R367 WeakPolarHBondContact CB-O 3.3Å; Y345-R367 PolarHBondContact O-N 3.15Å; C346-R367 HydrophobicContact CB-CG 3.78Å; C346-R367 PolarHBondContact SG-NH1 3Å; C346-R367 PolarHBondContact SG-NH2 3.41Å; R367-N372 CarbonylContact C-O 3.58Å; R367-N372 VanDerWaalsContact CA-O 3.28Å; R367-N372 WeakPolarHBondContact CA-O 3.43Å
368	M	91	Very high	94.8	Very high	74 Å²	74	37.1 Å²	37.1	37%	0.365	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-111.8	127.6	170.3	-173.9	-175.1	-66	0	0	109.6	Y345 N372 I375	Y345-M368 HydrophobicContact CD1-CB 4.06Å; Y345-M368 HydrophobicContact CD1-CE 3.71Å; Y345-M368 HydrophobicContact CD1-CG 3.66Å; Y345-M368 HydrophobicContact CD1-SD 4.39Å; Y345-M368 HydrophobicContact CD2-CE 3.76Å; Y345-M368 HydrophobicContact CE1-CE 3.39Å; Y345-M368 HydrophobicContact CE1-CG 3.88Å; Y345-M368 HydrophobicContact CE1-SD 4.1Å; Y345-M368 HydrophobicContact CE2-CE 3.46Å; Y345-M368 VanDerWaalsContact CE2-CE 3.46Å; Y345-M368 HydrophobicContact CG-CB 4.28Å; Y345-M368 HydrophobicContact CG-CE 3.87Å; Y345-M368 HydrophobicContact CG-CG 4.32Å; M368-N372 PolarHBondContact N-O 3.11Å; M368-N372 WeakPolarHBondContact O-CB 3.44Å; M368-N372 PolarHBondContact O-N 3.45Å; M368-I375 HydrophobicContact CB-CD1 4.19Å; M368-I375 HydrophobicContact CB-CG2 3.9Å
369	G	83.7	Confident	94.9	Very high	51 Å²	51	35.6 Å²	35.6	53%	0.526	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-147.9	-174.6	0	0	0	0	0	112
370	N	77.7	Confident	94.9	Very high	164 Å²	164	35.7 Å²	35.7	88%	0.877	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-23.6	-169.4	-69.5	-8.6	0	0	0	114.8
371	N	82.4	Confident	94.9	Very high	113 Å²	113	38.8 Å²	38.8	60%	0.604	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-153.7	4.4	-172.6	-153.7	40.2	0	0	0	115.8	H373	N371-H373 PolarHBondContact O-CD2 3.34Å; N371-H373 PolarHBondContact O-N 3.2Å
372	N	93.2	Very high	94.9	Very high	82 Å²	82	39.8 Å²	39.8	44%	0.439	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-88.5	99.7	178.3	-173.4	12.4	0	0	0	110.4	R367 M368 T374 I375	R367-N372 CarbonylContact C-O 3.58Å; R367-N372 VanDerWaalsContact CA-O 3.28Å; R367-N372 WeakPolarHBondContact CA-O 3.43Å; M368-N372 PolarHBondContact N-O 3.11Å; M368-N372 WeakPolarHBondContact O-CB 3.44Å; M368-N372 PolarHBondContact O-N 3.45Å; N372-T374 PolarHBondContact OD1-N 2.83Å; N372-T374 PolarHBondContact OD1-O 3.19Å; N372-I375 HydrophobicContact CB-CG2 4.42Å
373	H	95.5	Very high	94.8	Very high	14 Å²	14	42 Å²	42	7%	0.065	23%	0.227	C	C	.	.			trans	-95.5	-15.6	-179.5	-73	-90.3	0	0	0	114	H366 N371 I375 S398 G399 F420	H366-H373 AromaticContact CE1-CE1 3.33Å; H366-H373 PolarHBondContact CE1-CE1 3.48Å; H366-H373 AromaticContact CE1-ND1 3.61Å; H366-H373 AromaticContact ND1-CE1 3.97Å; H366-H373 AromaticContact NE2-CE1 3.78Å; H366-H373 AromaticContact NE2-ND1 3.74Å; H366-H373 PolarHBondContact O-ND1 2.86Å; H366-H373 VanDerWaalsContact O-ND1 3.15Å; N371-H373 PolarHBondContact O-CD2 3.34Å; N371-H373 PolarHBondContact O-N 3.2Å; H373-I375 PolarHBondContact O-N 2.71Å; H373-S398 CarbonylContact O-C 3.54Å; H373-S398 WeakPolarHBondContact O-CA 3.2Å; H373-G399 PolarHBondContact O-N 2.87Å; H373-F420 WeakPolarHBondContact CB-O 3.47Å; H373-F420 AromaticContact CD2-CD1 3.97Å; H373-F420 AromaticContact CD2-CE1 3.88Å; H373-F420 AromaticContact CE1-CD1 3.7Å; H373-F420 AromaticContact CG-CD1 3.92Å; H373-F420 AromaticContact ND1-CD1 3.76Å; H373-F420 AromaticContact NE2-CD1 3.87Å; H373-F420 AromaticContact NE2-CE1 3.73Å
374	T	96.8	Very high	94.7	Very high	61 Å²	61	49.7 Å²	49.7	37%	0.374	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	93.5	175.3	-61	0	0	0	0	109.1	N372 I396 T397 S398	N372-T374 PolarHBondContact OD1-N 2.83Å; N372-T374 PolarHBondContact OD1-O 3.19Å; T374-I396 HydrophobicContact CG2-CG2 3.89Å; T374-T397 CarbonylContact C-O 3.52Å; T374-T397 WeakPolarHBondContact CA-O 3.46Å; T374-S398 PolarHBondContact OG1-OG 3.28Å; T374-S398 VanDerWaalsContact OG1-OG 3.11Å
375	I	96.9	Very high	94.6	Very high	11 Å²	11	55 Å²	55	6%	0.056	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	167.3	-171.5	60.8	170.2	0	0	0	111.1	Y345 N365 M368 N372 H373 S377 T397	Y345-I375 HydrophobicContact CG-CD1 4.39Å; N365-I375 HydrophobicContact CB-CD1 3.69Å; N365-I375 HydrophobicContact CB-CG1 4.19Å; M368-I375 HydrophobicContact CB-CD1 4.19Å; M368-I375 HydrophobicContact CB-CG2 3.9Å; N372-I375 HydrophobicContact CB-CG2 4.42Å; H373-I375 PolarHBondContact O-N 2.71Å; I375-S377 PolarHBondContact O-N 3.22Å; I375-T397 PolarHBondContact N-O 3.48Å; I375-T397 PolarHBondContact O-N 2.71Å; I375-T397 PolarHBondContact O-OG1 2.82Å; I375-T397 VanDerWaalsContact O-OG1 3.13Å
376	N	98.1	Very high	94.5	Very high	72 Å²	72	58.6 Å²	58.6	39%	0.385	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.2	176	-71.2	-31.6	0	0	0	111.2	N365 L395 I396	N365-N376 PolarHBondContact ND2-O 2.91Å; N376-L395 CarbonylContact C-O 3.52Å; N376-L395 WeakPolarHBondContact CA-O 3.12Å; N376-I396 WeakPolarHBondContact OD1-CG1 3.38Å
377	S	98.4	Very high	94.5	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	151.1	153.3	-74.6	0	0	0	0	109.6	V363 N365 I375 T394 L395 T397	V363-S377 WeakPolarHBondContact O-CB 3.15Å; V363-S377 PolarHBondContact O-OG 2.74Å; N365-S377 PolarHBondContact N-OG 2.98Å; N365-S377 VanDerWaalsContact N-OG 3.16Å; I375-S377 PolarHBondContact O-N 3.22Å; S377-T394 WeakPolarHBondContact O-CA 3.16Å; S377-L395 PolarHBondContact N-O 2.82Å; S377-L395 PolarHBondContact O-N 2.75Å; S377-T397 WeakPolarHBondContact CB-OG1 3.28Å; S377-T397 PolarHBondContact OG-OG1 2.75Å
378	V	98.8	Very high	94.7	Very high	16 Å²	16	63.4 Å²	63.4	10%	0.097	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	131.5	-167.5	-171.7	0	0	0	0	110.3	A362 V363 Y380 V391 T394	A362-V378 WeakPolarHBondContact CA-O 3.42Å; V363-V378 HydrophobicContact CG1-CB 3.97Å; V363-V378 PolarHBondContact N-O 3.48Å; V378-Y380 HydrophobicContact CB-CD2 4.35Å; V378-Y380 HydrophobicContact CB-CE2 3.67Å; V378-Y380 HydrophobicContact CG1-CD1 4.43Å; V378-Y380 HydrophobicContact CG1-CD2 4.02Å; V378-Y380 HydrophobicContact CG1-CE1 4.01Å; V378-Y380 HydrophobicContact CG1-CE2 3.57Å; V378-Y380 HydrophobicContact CG1-CG 4.43Å; V378-V391 HydrophobicContact CG1-CB 4.4Å; V378-V391 HydrophobicContact CG1-CG1 3.87Å; V378-V391 HydrophobicContact CG1-CG2 3.96Å; V378-T394 HydrophobicContact CG1-CG2 4.44Å; V378-T394 HydrophobicContact CG2-CG2 4.3Å
379	I	98.9	Very high	95	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.9	170.4	-55.5	178.6	0	0	0	107.3	F353 Y360 L361 A362 H392 Q393 L395 L414 F439	F353-I379 HydrophobicContact CZ-CG2 4.07Å; Y360-I379 HydrophobicContact CD1-CG2 4.06Å; L361-I379 CarbonylContact O-C 3.47Å; L361-I379 WeakPolarHBondContact O-CA 3.37Å; A362-I379 HydrophobicContact CB-CG1 4.18Å; I379-H392 WeakPolarHBondContact O-CA 3.43Å; I379-H392 WeakPolarHBondContact O-CB 3.36Å; I379-H392 PolarHBondContact O-N 3.11Å; I379-Q393 HydrophobicContact CB-CB 4.28Å; I379-Q393 HydrophobicContact CD1-CB 4.5Å; I379-Q393 PolarHBondContact N-O 2.95Å; I379-Q393 PolarHBondContact O-N 3.05Å; I379-Q393 VanDerWaalsContact O-N 3.11Å; I379-L395 HydrophobicContact CD1-CD1 3.83Å; I379-L395 HydrophobicContact CD1-CG 4.42Å; I379-L414 HydrophobicContact CD1-CD2 3.85Å; I379-F439 HydrophobicContact CD1-CD2 3.38Å; I379-F439 HydrophobicContact CD1-CE2 3.86Å; I379-F439 HydrophobicContact CD1-CG 4.31Å
380	Y	98.9	Very high	95.7	Very high	14 Å²	14	61.5 Å²	61.5	6%	0.055	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.6	176	-60.8	-93.9	0	0	0	110.4	L342 Q343 W350 Y360 L361 V363 V378 E390 V391	L342-Y380 HydrophobicContact CD1-CD1 4.24Å; L342-Y380 HydrophobicContact CD1-CD2 4.26Å; L342-Y380 HydrophobicContact CD1-CE1 4.22Å; L342-Y380 HydrophobicContact CD1-CE2 4.23Å; L342-Y380 HydrophobicContact CD1-CG 4.26Å; L342-Y380 HydrophobicContact CD2-CD1 4.16Å; L342-Y380 HydrophobicContact CD2-CE1 3.87Å; L342-Y380 HydrophobicContact CG-CE1 4.46Å; Q343-Y380 PolarHBondContact O-OH 3.15Å; W350-Y380 AromaticContact CH2-CD2 3.84Å; W350-Y380 HydrophobicContact CH2-CD2 3.84Å; W350-Y380 AromaticContact CH2-CE2 3.53Å; W350-Y380 HydrophobicContact CH2-CE2 3.53Å; W350-Y380 AromaticContact CZ3-CD2 3.69Å; W350-Y380 HydrophobicContact CZ3-CD2 3.69Å; W350-Y380 AromaticContact CZ3-CE2 3.85Å; W350-Y380 HydrophobicContact CZ3-CE2 3.85Å; Y360-Y380 CarbonylContact C-O 3.56Å; Y360-Y380 WeakPolarHBondContact CA-O 3.3Å; Y360-Y380 WeakPolarHBondContact CB-O 3.3Å; Y360-Y380 WeakPolarHBondContact CD1-O 3.3Å; L361-Y380 PolarHBondContact N-O 3.1Å; L361-Y380 PolarHBondContact O-N 3.39Å; V363-Y380 HydrophobicContact CG1-CE2 3.98Å; V378-Y380 HydrophobicContact CB-CD2 4.35Å; V378-Y380 HydrophobicContact CB-CE2 3.67Å; V378-Y380 HydrophobicContact CG1-CD1 4.43Å; V378-Y380 HydrophobicContact CG1-CD2 4.02Å; V378-Y380 HydrophobicContact CG1-CE1 4.01Å; V378-Y380 HydrophobicContact CG1-CE2 3.57Å; V378-Y380 HydrophobicContact CG1-CG 4.43Å; Y380-E390 CarbonylContact C-O 3.57Å; Y380-E390 WeakPolarHBondContact CA-O 3.42Å; Y380-V391 HydrophobicContact CD1-CG2 4.09Å; Y380-V391 HydrophobicContact CE1-CG2 3.71Å
381	K	98.6	Very high	96.7	Very high	76 Å²	76	58.1 Å²	58.1	33%	0.33	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.9	174.6	176.5	176.6	170.3	168.1	0	109.8	Q358 Y360 N383 F389 E390 H392	Q358-K381 VanDerWaalsContact CD-CE 3.45Å; Q358-K381 HydrophobicContact CG-CD 4.07Å; Q358-K381 HydrophobicContact CG-CG 3.83Å; Y360-K381 HydrophobicContact CD1-CB 3.8Å; Y360-K381 HydrophobicContact CD1-CG 4.22Å; Y360-K381 HydrophobicContact CE1-CB 3.66Å; Y360-K381 HydrophobicContact CE1-CD 3.84Å; Y360-K381 HydrophobicContact CE1-CG 3.75Å; K381-N383 PolarHBondContact O-N 3.35Å; K381-F389 WeakPolarHBondContact O-CA 3.42Å; K381-E390 PolarHBondContact N-O 2.97Å; K381-E390 PolarHBondContact O-N 2.8Å; K381-H392 HydrophobicContact CB-CB 3.77Å
382	W	98.5	Very high	97.5	Very high	20 Å²	20	55.8 Å²	55.8	8%	0.076	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	116.2	174.5	173.5	-107.7	0	0	0	111.7	I296 F339 Q358 T359 K387 F389	I296-W382 HydrophobicContact CD1-CB 4.4Å; I296-W382 HydrophobicContact CD1-CD2 3.51Å; I296-W382 HydrophobicContact CD1-CE3 3.62Å; I296-W382 HydrophobicContact CD1-CG 3.86Å; I296-W382 HydrophobicContact CD1-CH2 4.37Å; I296-W382 HydrophobicContact CD1-CZ2 4.3Å; I296-W382 HydrophobicContact CD1-CZ3 4.06Å; F339-W382 HydrophobicContact CE1-CH2 4.25Å; F339-W382 AromaticContact CE1-CZ3 3.84Å; F339-W382 HydrophobicContact CE1-CZ3 3.84Å; F339-W382 AromaticContact CZ-CH2 3.74Å; F339-W382 HydrophobicContact CZ-CH2 3.74Å; F339-W382 AromaticContact CZ-CZ3 3.79Å; F339-W382 HydrophobicContact CZ-CZ3 3.79Å; Q358-W382 PolarHBondContact NE2-O 2.95Å; T359-W382 WeakPolarHBondContact O-CB 3.26Å; T359-W382 PolarHBondContact O-N 3.39Å; W382-K387 VanDerWaalsContact CH2-CA 3.41Å; W382-K387 HydrophobicContact CH2-CB 3.79Å; W382-K387 WeakPolarHBondContact CH2-O 3.38Å; W382-K387 HydrophobicContact CZ2-CB 3.98Å; W382-K387 HydrophobicContact CZ2-CG 4.41Å; W382-K387 WeakPolarHBondContact CZ3-O 3.37Å; W382-F389 HydrophobicContact CB-CD1 4.21Å; W382-F389 HydrophobicContact CB-CE1 3.79Å; W382-F389 HydrophobicContact CB-CZ 4.16Å; W382-F389 AromaticContact CE3-CD2 3.87Å; W382-F389 HydrophobicContact CE3-CD2 3.87Å; W382-F389 AromaticContact CE3-CE2 3.77Å; W382-F389 HydrophobicContact CE3-CE2 3.77Å; W382-F389 HydrophobicContact CE3-CG 4.35Å; W382-F389 HydrophobicContact CE3-CZ 4.15Å; W382-F389 HydrophobicContact CZ3-CD2 4.32Å; W382-F389 HydrophobicContact CZ3-CE2 4.3Å
383	N	97.9	Very high	97.8	Very high	46 Å²	46	53.4 Å²	53.4	25%	0.246	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.1	173.3	-177.5	-32.7	0	0	0	110.1	K381 S385 T386 K387 S388 E390	K381-N383 PolarHBondContact O-N 3.35Å; N383-S385 VanDerWaalsContact C-N 3.3Å; N383-S385 PolarHBondContact O-N 3.34Å; N383-S385 WeakPolarHBondContact OD1-CA 3.27Å; N383-S385 WeakPolarHBondContact OD1-CB 3.35Å; N383-S385 PolarHBondContact OD1-N 3.5Å; N383-T386 WeakPolarHBondContact CB-OG1 3.48Å; N383-T386 PolarHBondContact OD1-N 3.36Å; N383-T386 PolarHBondContact OD1-OG1 3.15Å; N383-K387 VanDerWaalsContact O-CA 3.23Å; N383-K387 WeakPolarHBondContact O-CA 3.32Å; N383-K387 PolarHBondContact O-N 2.94Å; N383-S388 PolarHBondContact N-O 3.07Å; N383-S388 PolarHBondContact O-N 2.93Å; N383-E390 HydrophobicContact CB-CG 4.35Å; N383-E390 WeakPolarHBondContact CB-OE1 3.46Å; N383-E390 VanDerWaalsContact ND2-CD 3.3Å; N383-E390 PolarHBondContact ND2-OE1 3.17Å; N383-E390 VanDerWaalsContact ND2-OE1 3.12Å; N383-E390 PolarHBondContact ND2-OE2 3.16Å
384	R	95.2	Very high	97.9	Very high	162 Å²	162	56.1 Å²	56.1	61%	0.611	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.9	-177.5	-66	-174.3	-179.5	-160.1	2.6	113	E357	E357-R384 PolarHBondContact O-NH2 3.24Å
385	S	96.8	Very high	98	Very high	112 Å²	112	53.9 Å²	53.9	78%	0.783	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-50.3	-177.4	-58.5	0	0	0	0	111.2	N383 K387	N383-S385 VanDerWaalsContact C-N 3.3Å; N383-S385 PolarHBondContact O-N 3.34Å; N383-S385 WeakPolarHBondContact OD1-CA 3.27Å; N383-S385 WeakPolarHBondContact OD1-CB 3.35Å; N383-S385 PolarHBondContact OD1-N 3.5Å; S385-K387 VanDerWaalsContact C-N 3.33Å
386	T	96.9	Very high	98.1	Very high	76 Å²	76	59 Å²	59	47%	0.466	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.1	179.1	55.7	0	0	0	0	112.3	N383 S388 E390	N383-T386 WeakPolarHBondContact CB-OG1 3.48Å; N383-T386 PolarHBondContact OD1-N 3.36Å; N383-T386 PolarHBondContact OD1-OG1 3.15Å; T386-S388 VanDerWaalsContact C-N 3.28Å; T386-S388 WeakPolarHBondContact CB-OG 3.09Å; T386-S388 PolarHBondContact OG1-OG 2.84Å; T386-E390 WeakPolarHBondContact CG2-OE1 3.41Å; T386-E390 PolarHBondContact OG1-OE1 3.49Å
387	K	96.5	Very high	98.1	Very high	136 Å²	136	55.6 Å²	55.6	59%	0.591	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	46	-173.6	-57.8	172.3	-175.6	162.7	0	110.6	F339 W382 N383 S385	F339-K387 WeakPolarHBondContact CZ-O 3.42Å; W382-K387 VanDerWaalsContact CH2-CA 3.41Å; W382-K387 HydrophobicContact CH2-CB 3.79Å; W382-K387 WeakPolarHBondContact CH2-O 3.38Å; W382-K387 HydrophobicContact CZ2-CB 3.98Å; W382-K387 HydrophobicContact CZ2-CG 4.41Å; W382-K387 WeakPolarHBondContact CZ3-O 3.37Å; N383-K387 VanDerWaalsContact O-CA 3.23Å; N383-K387 WeakPolarHBondContact O-CA 3.32Å; N383-K387 PolarHBondContact O-N 2.94Å; S385-K387 VanDerWaalsContact C-N 3.33Å
388	S	97.9	Very high	98.1	Very high	30 Å²	30	56.7 Å²	56.7	21%	0.21	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	156.7	177.6	49.6	0	0	0	0	110.7	N383 T386	N383-S388 PolarHBondContact N-O 3.07Å; N383-S388 PolarHBondContact O-N 2.93Å; T386-S388 VanDerWaalsContact C-N 3.28Å; T386-S388 WeakPolarHBondContact CB-OG 3.09Å; T386-S388 PolarHBondContact OG1-OG 2.84Å
389	F	98.6	Very high	98	Very high	6 Å²	6	55.9 Å²	55.9	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	132.5	167.1	-77.6	-81.1	0	0	0	110.7	F294 I296 I326 Q340 L342 T359 L361 K381 W382	F294-F389 AromaticContact CE2-CE2 3.72Å; F294-F389 HydrophobicContact CE2-CE2 3.72Å; F294-F389 AromaticContact CE2-CZ 3.66Å; F294-F389 HydrophobicContact CE2-CZ 3.66Å; F294-F389 AromaticContact CZ-CE2 3.82Å; F294-F389 HydrophobicContact CZ-CE2 3.82Å; F294-F389 HydrophobicContact CZ-CZ 4.09Å; I296-F389 HydrophobicContact CD1-CE2 4.08Å; I296-F389 HydrophobicContact CD1-CZ 3.91Å; I326-F389 HydrophobicContact CD1-CD2 3.48Å; I326-F389 VanDerWaalsContact CD1-CD2 3.48Å; I326-F389 HydrophobicContact CD1-CE2 3.96Å; I326-F389 HydrophobicContact CD1-CG 4.28Å; Q340-F389 PolarHBondContact NE2-O 3.19Å; L342-F389 HydrophobicContact CD1-CB 4.34Å; T359-F389 HydrophobicContact CG2-CE1 4.39Å; T359-F389 HydrophobicContact CG2-CZ 4.24Å; L361-F389 HydrophobicContact CB-CD1 4.46Å; L361-F389 HydrophobicContact CB-CE1 4.32Å; L361-F389 HydrophobicContact CD1-CD1 3.92Å; L361-F389 HydrophobicContact CD1-CD2 3.85Å; L361-F389 HydrophobicContact CD1-CE1 3.7Å; L361-F389 HydrophobicContact CD1-CE2 3.6Å; L361-F389 HydrophobicContact CD1-CG 3.99Å; L361-F389 HydrophobicContact CD1-CZ 3.51Å; L361-F389 HydrophobicContact CG-CD1 4.06Å; L361-F389 HydrophobicContact CG-CE1 3.57Å; L361-F389 HydrophobicContact CG-CE2 4.31Å; L361-F389 HydrophobicContact CG-CZ 3.69Å; K381-F389 WeakPolarHBondContact O-CA 3.42Å; W382-F389 HydrophobicContact CB-CD1 4.21Å; W382-F389 HydrophobicContact CB-CE1 3.79Å; W382-F389 HydrophobicContact CB-CZ 4.16Å; W382-F389 AromaticContact CE3-CD2 3.87Å; W382-F389 HydrophobicContact CE3-CD2 3.87Å; W382-F389 AromaticContact CE3-CE2 3.77Å; W382-F389 HydrophobicContact CE3-CE2 3.77Å; W382-F389 HydrophobicContact CE3-CG 4.35Å; W382-F389 HydrophobicContact CE3-CZ 4.15Å; W382-F389 HydrophobicContact CZ3-CD2 4.32Å; W382-F389 HydrophobicContact CZ3-CE2 4.3Å
390	E	98.3	Very high	98	Very high	78 Å²	78	55.9 Å²	55.9	36%	0.364	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	150.1	179.6	-70.5	167.2	-165.2	0	0	109.3	Y380 K381 N383 T386 H392	Y380-E390 CarbonylContact C-O 3.57Å; Y380-E390 WeakPolarHBondContact CA-O 3.42Å; K381-E390 PolarHBondContact N-O 2.97Å; K381-E390 PolarHBondContact O-N 2.8Å; N383-E390 HydrophobicContact CB-CG 4.35Å; N383-E390 WeakPolarHBondContact CB-OE1 3.46Å; N383-E390 VanDerWaalsContact ND2-CD 3.3Å; N383-E390 PolarHBondContact ND2-OE1 3.17Å; N383-E390 VanDerWaalsContact ND2-OE1 3.12Å; N383-E390 PolarHBondContact ND2-OE2 3.16Å; T386-E390 WeakPolarHBondContact CG2-OE1 3.41Å; T386-E390 PolarHBondContact OG1-OE1 3.49Å; E390-H392 PolarHBondContact O-N 2.86Å
391	V	98.6	Very high	97.9	Very high	94 Å²	94	57.9 Å²	57.9	57%	0.57	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	127.2	-179.1	177.7	0	0	0	0	109.9	V378 Y380 T394	V378-V391 HydrophobicContact CG1-CB 4.4Å; V378-V391 HydrophobicContact CG1-CG1 3.87Å; V378-V391 HydrophobicContact CG1-CG2 3.96Å; Y380-V391 HydrophobicContact CD1-CG2 4.09Å; Y380-V391 HydrophobicContact CE1-CG2 3.71Å; V391-T394 HydrophobicContact CG1-CG2 4.36Å
392	H	98.5	Very high	98	Very high	63 Å²	63	55 Å²	55	29%	0.292	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-46.5	176.6	177.2	78.9	0	0	0	111.7	Y360 I379 K381 E390 W434 G437	Y360-H392 HydrophobicContact CE1-CB 4.36Å; Y360-H392 AromaticContact CE1-CD2 3.9Å; Y360-H392 AromaticContact CE1-CG 3.79Å; Y360-H392 AromaticContact CE1-ND1 3.94Å; I379-H392 WeakPolarHBondContact O-CA 3.43Å; I379-H392 WeakPolarHBondContact O-CB 3.36Å; I379-H392 PolarHBondContact O-N 3.11Å; K381-H392 HydrophobicContact CB-CB 3.77Å; E390-H392 PolarHBondContact O-N 2.86Å; H392-W434 AromaticContact NE2-CH2 3.41Å; H392-W434 WeakPolarHBondContact NE2-CH2 3.42Å; H392-W434 AromaticContact NE2-CZ3 3.96Å; H392-G437 PolarHBondContact CE1-O 3.33Å; H392-G437 VanDerWaalsContact CE1-O 3.28Å; H392-G437 PolarHBondContact NE2-O 2.74Å
393	Q	98.6	Very high	98	Very high	32 Å²	32	54.1 Å²	54.1	15%	0.15	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	151.3	-177.7	179.7	173.8	8	0	0	110.2	I379 L395 F439	I379-Q393 HydrophobicContact CB-CB 4.28Å; I379-Q393 HydrophobicContact CD1-CB 4.5Å; I379-Q393 PolarHBondContact N-O 2.95Å; I379-Q393 PolarHBondContact O-N 3.05Å; I379-Q393 VanDerWaalsContact O-N 3.11Å; Q393-L395 HydrophobicContact CG-CD2 4.3Å; Q393-L395 HydrophobicContact CG-CG 4.47Å; Q393-F439 PolarHBondContact NE2-O 3.38Å
394	T	98.6	Very high	98	Very high	71 Å²	71	53.2 Å²	53.2	44%	0.436	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.2	168.7	56.3	0	0	0	0	109.9	S377 V378 V391	S377-T394 WeakPolarHBondContact O-CA 3.16Å; V378-T394 HydrophobicContact CG1-CG2 4.44Å; V378-T394 HydrophobicContact CG2-CG2 4.3Å; V391-T394 HydrophobicContact CG1-CG2 4.36Å
395	L	98.6	Very high	98.2	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130	177	-63.9	176.2	0	0	0	108.6	N376 S377 I379 Q393 T397 W403 Y432 F439	N376-L395 CarbonylContact C-O 3.52Å; N376-L395 WeakPolarHBondContact CA-O 3.12Å; S377-L395 PolarHBondContact N-O 2.82Å; S377-L395 PolarHBondContact O-N 2.75Å; I379-L395 HydrophobicContact CD1-CD1 3.83Å; I379-L395 HydrophobicContact CD1-CG 4.42Å; Q393-L395 HydrophobicContact CG-CD2 4.3Å; Q393-L395 HydrophobicContact CG-CG 4.47Å; L395-T397 PolarHBondContact O-N 3.09Å; L395-W403 HydrophobicContact CB-CH2 4.36Å; L395-W403 HydrophobicContact CD1-CH2 3.69Å; L395-W403 HydrophobicContact CD1-CZ2 4.44Å; L395-W403 HydrophobicContact CD1-CZ3 4.32Å; L395-Y432 HydrophobicContact CD1-CD1 4.29Å; L395-Y432 HydrophobicContact CD1-CD2 4.21Å; L395-Y432 HydrophobicContact CD1-CE1 4.13Å; L395-Y432 HydrophobicContact CD1-CE2 4.04Å; L395-Y432 HydrophobicContact CD1-CG 4.34Å; L395-Y432 HydrophobicContact CD2-CD1 4.33Å; L395-Y432 HydrophobicContact CD2-CE1 3.9Å; L395-F439 HydrophobicContact CD1-CB 4.39Å
396	I	98.2	Very high	98.3	Very high	117 Å²	117	41.5 Å²	41.5	60%	0.6	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	128.5	175	-64.1	170.2	0	0	0	108.1	T374 N376	T374-I396 HydrophobicContact CG2-CG2 3.89Å; N376-I396 WeakPolarHBondContact OD1-CG1 3.38Å
397	T	98.4	Very high	98.2	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.4	179.6	53.8	0	0	0	0	110.1	T374 I375 S377 L395 A400 W403 V416	T374-T397 CarbonylContact C-O 3.52Å; T374-T397 WeakPolarHBondContact CA-O 3.46Å; I375-T397 PolarHBondContact N-O 3.48Å; I375-T397 PolarHBondContact O-N 2.71Å; I375-T397 PolarHBondContact O-OG1 2.82Å; I375-T397 VanDerWaalsContact O-OG1 3.13Å; S377-T397 WeakPolarHBondContact CB-OG1 3.28Å; S377-T397 PolarHBondContact OG-OG1 2.75Å; L395-T397 PolarHBondContact O-N 3.09Å; T397-A400 HydrophobicContact CG2-CB 4.41Å; T397-W403 HydrophobicContact CG2-CH2 4.07Å; T397-W403 HydrophobicContact CG2-CZ2 3.67Å; T397-V416 HydrophobicContact CG2-CB 4.48Å; T397-V416 HydrophobicContact CG2-CG1 4.39Å; T397-V416 HydrophobicContact CG2-CG2 3.87Å
398	S	98.1	Very high	97.8	Very high	24 Å²	24	36.5 Å²	36.5	17%	0.168	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	99.6	-178.1	-67.4	0	0	0	0	110	H373 T374 A400 N418 A419 F420	H373-S398 CarbonylContact O-C 3.54Å; H373-S398 WeakPolarHBondContact O-CA 3.2Å; T374-S398 PolarHBondContact OG1-OG 3.28Å; T374-S398 VanDerWaalsContact OG1-OG 3.11Å; S398-A400 PolarHBondContact O-N 3.08Å; S398-N418 PolarHBondContact N-OD1 2.97Å; S398-A419 PolarHBondContact O-N 3.26Å; S398-F420 CarbonylContact C-O 3.53Å; S398-F420 PolarHBondContact O-N 2.81Å
399	G	97.3	Very high	97.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	52.7	55.4	-176.3	0	0	0	0	0	110.8	H366 H373 Y401 A419 F420	H366-G399 WeakPolarHBondContact O-CA 3.22Å; H373-G399 PolarHBondContact O-N 2.87Å; G399-Y401 VanDerWaalsContact O-CD2 3.31Å; G399-Y401 WeakPolarHBondContact O-CD2 3.43Å; G399-Y401 PolarHBondContact O-N 3.46Å; G399-A419 VanDerWaalsContact O-CB 3.27Å; G399-A419 WeakPolarHBondContact O-CB 3.17Å; G399-A419 PolarHBondContact O-N 2.61Å; G399-A419 VanDerWaalsContact O-N 3.1Å; G399-F420 WeakPolarHBondContact CA-O 3.44Å; G399-F420 PolarHBondContact N-O 3.09Å
400	A	98.5	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	130.8	-178	0	0	0	0	0	110.1	R348 A364 T397 S398 V416 A417	R348-A400 WeakPolarHBondContact CG-O 3.42Å; A364-A400 HydrophobicContact CB-CB 3.8Å; T397-A400 HydrophobicContact CG2-CB 4.41Å; S398-A400 PolarHBondContact O-N 3.08Å; A400-V416 HydrophobicContact CB-CG2 3.85Å; A400-A417 WeakPolarHBondContact CA-O 3.42Å
401	Y	98.5	Very high	96.5	Very high	56 Å²	56	45.8 Å²	45.8	22%	0.22	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-36.2	175.1	-92.4	-131.4	0	0	0	112.1	R348 D349 H366 G399 A417 A419 T451	R348-Y401 WeakPolarHBondContact CB-O 3.39Å; R348-Y401 HydrophobicContact CG-CD2 4.32Å; R348-Y401 HydrophobicContact CG-CG 4.48Å; R348-Y401 VanDerWaalsContact CZ-CZ 3.44Å; R348-Y401 VanDerWaalsContact NH1-CE1 3.28Å; R348-Y401 VanDerWaalsContact NH1-CZ 3.34Å; R348-Y401 PolarHBondContact NH2-OH 3.03Å; D349-Y401 WeakPolarHBondContact CB-O 3.06Å; H366-Y401 AromaticContact CD2-CD2 3.74Å; H366-Y401 AromaticContact CD2-CE2 3.25Å; H366-Y401 WeakPolarHBondContact CD2-CE2 3.45Å; H366-Y401 AromaticContact NE2-CE2 3.46Å; H366-Y401 WeakPolarHBondContact NE2-CE2 3.41Å; G399-Y401 VanDerWaalsContact O-CD2 3.31Å; G399-Y401 WeakPolarHBondContact O-CD2 3.43Å; G399-Y401 PolarHBondContact O-N 3.46Å; Y401-A417 PolarHBondContact N-O 2.81Å; Y401-A419 HydrophobicContact CD1-CB 4.46Å; Y401-A419 HydrophobicContact CD2-CB 3.21Å; Y401-A419 HydrophobicContact CE2-CB 3.42Å; Y401-A419 VanDerWaalsContact CE2-CB 3.42Å; Y401-A419 HydrophobicContact CG-CB 3.77Å; Y401-T451 HydrophobicContact CD1-CG2 3.86Å; Y401-T451 HydrophobicContact CE1-CG2 4.08Å
402	D	98.8	Very high	96.4	Very high	16 Å²	16	42.4 Å²	42.4	9%	0.086	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.2	-169.8	168.6	60.1	0	0	0	111.3	V416 A417 T451 W453	D402-V416 WeakPolarHBondContact O-CA 3.15Å; D402-A417 HydrophobicContact CB-CB 3.75Å; D402-A417 PolarHBondContact O-N 3.17Å; D402-T451 WeakPolarHBondContact CB-O 3.02Å; D402-W453 PolarHBondContact OD2-N 3.45Å
403	W	98.8	Very high	96.4	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.9	166.7	-77.7	111.1	0	0	0	109.6	D349 E351 A362 V363 A364 L395 T397 L414 V415 V416 Y432	D349-W403 PolarHBondContact OD2-N 2.83Å; D349-W403 VanDerWaalsContact OD2-N 3.16Å; E351-W403 HydrophobicContact CB-CB 3.56Å; E351-W403 VanDerWaalsContact CB-O 3.23Å; E351-W403 WeakPolarHBondContact CB-O 3.49Å; E351-W403 HydrophobicContact CG-CB 4.29Å; E351-W403 VanDerWaalsContact CG-O 3.3Å; E351-W403 WeakPolarHBondContact CG-O 3.26Å; A362-W403 HydrophobicContact CB-CB 4.45Å; A362-W403 HydrophobicContact CB-CD2 4.39Å; A362-W403 HydrophobicContact CB-CG 4.07Å; V363-W403 VanDerWaalsContact C-CD1 3.45Å; V363-W403 VanDerWaalsContact C-NE1 3.29Å; V363-W403 PolarHBondContact O-NE1 2.66Å; A364-W403 VanDerWaalsContact N-CD1 3.32Å; L395-W403 HydrophobicContact CB-CH2 4.36Å; L395-W403 HydrophobicContact CD1-CH2 3.69Å; L395-W403 HydrophobicContact CD1-CZ2 4.44Å; L395-W403 HydrophobicContact CD1-CZ3 4.32Å; T397-W403 HydrophobicContact CG2-CH2 4.07Å; T397-W403 HydrophobicContact CG2-CZ2 3.67Å; W403-L414 HydrophobicContact CB-CD1 4.37Å; W403-L414 HydrophobicContact CD2-CD2 4.38Å; W403-L414 HydrophobicContact CD2-CG 4.43Å; W403-L414 HydrophobicContact CE3-CD1 3.97Å; W403-L414 HydrophobicContact CE3-CD2 3.69Å; W403-L414 HydrophobicContact CE3-CG 3.49Å; W403-L414 VanDerWaalsContact CE3-CG 3.49Å; W403-L414 HydrophobicContact CH2-CD2 4.41Å; W403-L414 HydrophobicContact CZ3-CD2 3.66Å; W403-L414 HydrophobicContact CZ3-CG 3.71Å; W403-V415 WeakPolarHBondContact CA-O 3.39Å; W403-V415 VanDerWaalsContact CE3-O 3.29Å; W403-V416 HydrophobicContact CD2-CB 4.1Å; W403-V416 HydrophobicContact CD2-CG2 4.22Å; W403-V416 HydrophobicContact CE3-CB 3.65Å; W403-V416 HydrophobicContact CE3-CG2 4.28Å; W403-V416 HydrophobicContact CH2-CB 3.58Å; W403-V416 HydrophobicContact CH2-CG1 4.16Å; W403-V416 HydrophobicContact CH2-CG2 4.07Å; W403-V416 HydrophobicContact CZ2-CB 3.99Å; W403-V416 HydrophobicContact CZ2-CG2 3.95Å; W403-V416 HydrophobicContact CZ3-CB 3.42Å; W403-V416 VanDerWaalsContact CZ3-CB 3.42Å; W403-V416 HydrophobicContact CZ3-CG1 4.2Å; W403-V416 HydrophobicContact CZ3-CG2 4.26Å; W403-Y432 HydrophobicContact CH2-CD2 4.36Å; W403-Y432 AromaticContact CH2-CE2 3.85Å; W403-Y432 HydrophobicContact CH2-CE2 3.85Å; W403-Y432 AromaticContact CZ3-CD2 3.98Å; W403-Y432 HydrophobicContact CZ3-CD2 3.98Å; W403-Y432 AromaticContact CZ3-CE2 3.86Å; W403-Y432 HydrophobicContact CZ3-CE2 3.86Å
404	E	98.8	Very high	96.5	Very high	27 Å²	27	38.3 Å²	38.3	13%	0.126	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.9	173.5	168.4	57.4	-170.7	0	0	111.3	F406 L414 V415 W453 M455	E404-F406 HydrophobicContact CG-CD1 4.5Å; E404-L414 CarbonylContact O-C 3.59Å; E404-L414 WeakPolarHBondContact O-CA 3.4Å; E404-V415 HydrophobicContact CB-CG1 3.71Å; E404-V415 HydrophobicContact CG-CG1 4.22Å; E404-V415 PolarHBondContact N-O 3.18Å; E404-V415 PolarHBondContact O-N 3.21Å; E404-W453 HydrophobicContact CB-CB 3.94Å; E404-W453 WeakPolarHBondContact CB-O 3.43Å; E404-W453 VanDerWaalsContact CG-O 3.27Å; E404-W453 WeakPolarHBondContact CG-O 3.48Å; E404-M455 HydrophobicContact CG-CB 4.22Å; E404-M455 WeakPolarHBondContact OE1-CB 3.31Å
405	F	98.8	Very high	96.5	Very high	25 Å²	25	35 Å²	35	11%	0.11	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.5	-179.1	173.4	-89.8	0	0	0	111.1	E351 F353 I355 K407 H412 F413 L414 F439	E351-F405 HydrophobicContact CG-CB 3.71Å; F353-F405 HydrophobicContact CB-CB 3.85Å; F353-F405 HydrophobicContact CB-CD1 3.28Å; F353-F405 HydrophobicContact CB-CD2 3.67Å; F353-F405 HydrophobicContact CB-CE1 3.64Å; F353-F405 HydrophobicContact CB-CE2 3.99Å; F353-F405 HydrophobicContact CB-CG 3.28Å; F353-F405 HydrophobicContact CB-CZ 3.98Å; F353-F405 HydrophobicContact CD1-CB 3.88Å; F353-F405 AromaticContact CD1-CD2 3.98Å; F353-F405 HydrophobicContact CD1-CD2 3.98Å; F353-F405 AromaticContact CD1-CG 3.96Å; F353-F405 HydrophobicContact CD1-CG 3.96Å; F353-F405 AromaticContact CD2-CD2 3.56Å; F353-F405 HydrophobicContact CD2-CD2 3.56Å; F353-F405 AromaticContact CD2-CE2 3.58Å; F353-F405 HydrophobicContact CD2-CE2 3.58Å; F353-F405 HydrophobicContact CD2-CG 4.12Å; F353-F405 HydrophobicContact CD2-CZ 4.16Å; F353-F405 HydrophobicContact CE2-CD2 4.15Å; F353-F405 HydrophobicContact CE2-CE2 4.25Å; F353-F405 HydrophobicContact CG-CB 3.99Å; F353-F405 HydrophobicContact CG-CD1 4.06Å; F353-F405 AromaticContact CG-CD2 3.46Å; F353-F405 HydrophobicContact CG-CD2 3.46Å; F353-F405 VanDerWaalsContact CG-CD2 3.46Å; F353-F405 HydrophobicContact CG-CE1 4.44Å; F353-F405 AromaticContact CG-CE2 3.89Å; F353-F405 HydrophobicContact CG-CE2 3.89Å; F353-F405 AromaticContact CG-CG 3.54Å; F353-F405 HydrophobicContact CG-CG 3.54Å; F353-F405 HydrophobicContact CG-CZ 4.36Å; I355-F405 HydrophobicContact CD1-CE2 4.04Å; I355-F405 HydrophobicContact CG1-CE2 4.03Å; I355-F405 HydrophobicContact CG1-CZ 4.04Å; F405-K407 HydrophobicContact CE1-CD 4.4Å; F405-K407 HydrophobicContact CE1-CG 3.91Å; F405-K407 HydrophobicContact CZ-CG 4.06Å; F405-H412 HydrophobicContact CE2-CB 3.95Å; F405-H412 HydrophobicContact CZ-CB 4.08Å; F405-H412 AromaticContact CZ-ND1 3.77Å; F405-F413 WeakPolarHBondContact CD2-O 3.35Å; F405-L414 HydrophobicContact CB-CD1 3.91Å; F405-L414 HydrophobicContact CD2-CD1 4.44Å; F405-F439 HydrophobicContact CD2-CZ 4.28Å; F405-F439 HydrophobicContact CE2-CZ 4.24Å
406	F	98.3	Very high	96.5	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.013	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	164.6	-180	63.5	-85.8	0	0	0	113.9	E404 V408 F413 V415 I431 M455 L464 F496	E404-F406 HydrophobicContact CG-CD1 4.5Å; F406-V408 HydrophobicContact CD2-CG2 4.06Å; F406-V408 HydrophobicContact CE2-CG2 4.12Å; F406-F413 HydrophobicContact CD1-CB 4.02Å; F406-F413 HydrophobicContact CD2-CB 3.84Å; F406-F413 HydrophobicContact CD2-CD2 4.09Å; F406-F413 HydrophobicContact CD2-CG 4.25Å; F406-F413 HydrophobicContact CE1-CB 3.61Å; F406-F413 HydrophobicContact CE2-CB 3.41Å; F406-F413 VanDerWaalsContact CE2-CB 3.41Å; F406-F413 HydrophobicContact CE2-CD1 4.43Å; F406-F413 AromaticContact CE2-CD2 3.7Å; F406-F413 HydrophobicContact CE2-CD2 3.7Å; F406-F413 AromaticContact CE2-CG 3.61Å; F406-F413 HydrophobicContact CE2-CG 3.61Å; F406-F413 HydrophobicContact CG-CB 4.12Å; F406-F413 HydrophobicContact CZ-CB 3.28Å; F406-F413 HydrophobicContact CZ-CD1 4.39Å; F406-F413 HydrophobicContact CZ-CD2 4.36Å; F406-F413 AromaticContact CZ-CG 3.8Å; F406-F413 HydrophobicContact CZ-CG 3.8Å; F406-F413 PolarHBondContact N-O 2.86Å; F406-F413 VanDerWaalsContact N-O 3.1Å; F406-F413 PolarHBondContact O-N 2.79Å; F406-V415 HydrophobicContact CE1-CB 4.37Å; F406-V415 HydrophobicContact CE1-CG1 4.09Å; F406-I431 HydrophobicContact CZ-CG2 4.23Å; F406-M455 HydrophobicContact CB-CB 3.79Å; F406-M455 HydrophobicContact CB-CE 3.54Å; F406-M455 HydrophobicContact CB-CG 3.55Å; F406-M455 HydrophobicContact CB-SD 4.36Å; F406-M455 HydrophobicContact CD1-CB 4.25Å; F406-M455 HydrophobicContact CD1-CG 4.21Å; F406-M455 HydrophobicContact CD2-CG 3.86Å; F406-M455 HydrophobicContact CG-CB 4.05Å; F406-M455 HydrophobicContact CG-CE 4.42Å; F406-M455 HydrophobicContact CG-CG 3.63Å; F406-L464 HydrophobicContact CD1-CD2 4.08Å; F406-L464 HydrophobicContact CE1-CD1 4.03Å; F406-L464 HydrophobicContact CE1-CD2 3.79Å; F406-L464 HydrophobicContact CE1-CG 4.45Å; F406-L464 HydrophobicContact CZ-CD1 3.8Å; F406-L464 HydrophobicContact CZ-CD2 4.14Å; F406-L464 HydrophobicContact CZ-CG 4.34Å; F406-F496 HydrophobicContact CE2-CE2 4.14Å; F406-F496 AromaticContact CE2-CZ 3.76Å; F406-F496 HydrophobicContact CE2-CZ 3.76Å; F406-F496 AromaticContact CZ-CE2 3.97Å; F406-F496 HydrophobicContact CZ-CE2 3.97Å; F406-F496 AromaticContact CZ-CZ 3.88Å; F406-F496 HydrophobicContact CZ-CZ 3.88Å
407	K	95	Very high	96.5	Very high	94 Å²	94	28.7 Å²	28.7	41%	0.409	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.8	179.7	-57.8	-174.1	-175.2	-179.7	0	110.4	D354 F405 Y411 H412	D354-K407 WeakPolarHBondContact O-CE 3.49Å; D354-K407 PolarHBondContact O-NZ 3.41Å; F405-K407 HydrophobicContact CE1-CD 4.4Å; F405-K407 HydrophobicContact CE1-CG 3.91Å; F405-K407 HydrophobicContact CZ-CG 4.06Å; K407-Y411 WeakPolarHBondContact CA-O 3.27Å; K407-H412 WeakPolarHBondContact CE-ND1 3.34Å
408	V	89.1	Confident	96.5	Very high	14 Å²	14	29 Å²	29	9%	0.085	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	104.3	168.4	-174.4	0	0	0	0	108.4	F406 Y411 F413 V462 L489 M491	F406-V408 HydrophobicContact CD2-CG2 4.06Å; F406-V408 HydrophobicContact CE2-CG2 4.12Å; V408-Y411 PolarHBondContact N-O 2.83Å; V408-Y411 PolarHBondContact O-N 3.41Å; V408-F413 HydrophobicContact CB-CD2 4.44Å; V408-F413 HydrophobicContact CB-CE2 3.89Å; V408-F413 HydrophobicContact CG2-CD2 4.13Å; V408-F413 HydrophobicContact CG2-CE2 3.94Å; V408-V462 HydrophobicContact CG1-CG2 4.25Å; V408-V462 HydrophobicContact CG2-CG1 3.92Å; V408-V462 HydrophobicContact CG2-CG2 4.31Å; V408-L489 HydrophobicContact CB-CD2 4.33Å; V408-L489 HydrophobicContact CG1-CD2 3.76Å; V408-L489 HydrophobicContact CG2-CD2 4Å; V408-M491 HydrophobicContact CG1-CE 4.16Å; V408-M491 HydrophobicContact CG1-SD 4.23Å
409	G	86.6	Confident	96.5	Very high	70 Å²	70	27.9 Å²	27.9	72%	0.722	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	-125.1	-170.8	0	0	0	0	0	111	Y411	G409-Y411 VanDerWaalsContact C-N 3.31Å
410	P	85.8	Confident	96.5	Very high	102 Å²	102	30 Å²	30	66%	0.662	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.2	178.7	35.9	-36.4	0	0	0	113.9
411	Y	93.9	Very high	96.3	Very high	137 Å²	137	32.4 Å²	32.4	54%	0.537	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.4	-175.3	-59.1	-80.5	0	0	0	110.6	K407 V408 G409 F413	K407-Y411 WeakPolarHBondContact CA-O 3.27Å; V408-Y411 PolarHBondContact N-O 2.83Å; V408-Y411 PolarHBondContact O-N 3.41Å; G409-Y411 VanDerWaalsContact C-N 3.31Å; Y411-F413 VanDerWaalsContact CB-CE2 3.47Å
412	H	98.1	Very high	96	Very high	22 Å²	22	30.8 Å²	30.8	10%	0.102	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.3	176.2	-55.1	-73.1	0	0	0	109.2	I355 F405 K407 V433 W434	I355-H412 HydrophobicContact CD1-CB 4.07Å; I355-H412 HydrophobicContact CG1-CB 4.25Å; F405-H412 HydrophobicContact CE2-CB 3.95Å; F405-H412 HydrophobicContact CZ-CB 4.08Å; F405-H412 AromaticContact CZ-ND1 3.77Å; K407-H412 WeakPolarHBondContact CE-ND1 3.34Å; H412-V433 WeakPolarHBondContact O-CA 3.48Å; H412-W434 HydrophobicContact CB-CB 3.82Å; H412-W434 PolarHBondContact O-N 2.83Å
413	F	98.7	Very high	95.7	Very high	10 Å²	10	36 Å²	36	4%	0.044	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	156.9	-179.2	-62.9	-92.2	0	0	0	110.4	F405 F406 V408 Y411 I431 Y432 V433 F442	F405-F413 WeakPolarHBondContact CD2-O 3.35Å; F406-F413 HydrophobicContact CD1-CB 4.02Å; F406-F413 HydrophobicContact CD2-CB 3.84Å; F406-F413 HydrophobicContact CD2-CD2 4.09Å; F406-F413 HydrophobicContact CD2-CG 4.25Å; F406-F413 HydrophobicContact CE1-CB 3.61Å; F406-F413 HydrophobicContact CE2-CB 3.41Å; F406-F413 VanDerWaalsContact CE2-CB 3.41Å; F406-F413 HydrophobicContact CE2-CD1 4.43Å; F406-F413 AromaticContact CE2-CD2 3.7Å; F406-F413 HydrophobicContact CE2-CD2 3.7Å; F406-F413 AromaticContact CE2-CG 3.61Å; F406-F413 HydrophobicContact CE2-CG 3.61Å; F406-F413 HydrophobicContact CG-CB 4.12Å; F406-F413 HydrophobicContact CZ-CB 3.28Å; F406-F413 HydrophobicContact CZ-CD1 4.39Å; F406-F413 HydrophobicContact CZ-CD2 4.36Å; F406-F413 AromaticContact CZ-CG 3.8Å; F406-F413 HydrophobicContact CZ-CG 3.8Å; F406-F413 PolarHBondContact N-O 2.86Å; F406-F413 VanDerWaalsContact N-O 3.1Å; F406-F413 PolarHBondContact O-N 2.79Å; V408-F413 HydrophobicContact CB-CD2 4.44Å; V408-F413 HydrophobicContact CB-CE2 3.89Å; V408-F413 HydrophobicContact CG2-CD2 4.13Å; V408-F413 HydrophobicContact CG2-CE2 3.94Å; Y411-F413 VanDerWaalsContact CB-CE2 3.47Å; F413-I431 HydrophobicContact CD1-CG2 4.13Å; F413-Y432 WeakPolarHBondContact CA-O 3.32Å; F413-Y432 WeakPolarHBondContact CB-O 3.44Å; F413-Y432 WeakPolarHBondContact CD1-O 3.49Å; F413-V433 HydrophobicContact CD1-CB 3.92Å; F413-V433 HydrophobicContact CD1-CG2 4.15Å; F413-V433 HydrophobicContact CE1-CB 3.8Å; F413-V433 HydrophobicContact CE1-CG2 3.78Å; F413-V433 HydrophobicContact CZ-CG2 4.13Å; F413-F442 HydrophobicContact CD1-CD1 4.38Å; F413-F442 HydrophobicContact CD1-CG 4.37Å; F413-F442 HydrophobicContact CE1-CD1 4.02Å; F413-F442 AromaticContact CE1-CD2 3.94Å; F413-F442 HydrophobicContact CE1-CD2 3.94Å; F413-F442 HydrophobicContact CE1-CE1 4.13Å; F413-F442 HydrophobicContact CE1-CE2 4.05Å; F413-F442 AromaticContact CE1-CG 3.91Å; F413-F442 HydrophobicContact CE1-CG 3.91Å; F413-F442 HydrophobicContact CE1-CZ 4.12Å
414	L	98.9	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126.6	174.9	-177	71.5	0	0	0	107.2	E351 F353 A362 I379 W403 E404 F405 Y432 F439	E351-L414 HydrophobicContact CG-CD1 4.34Å; F353-L414 HydrophobicContact CE1-CD1 4.1Å; F353-L414 HydrophobicContact CZ-CD2 4.48Å; A362-L414 HydrophobicContact CB-CD2 4.35Å; I379-L414 HydrophobicContact CD1-CD2 3.85Å; W403-L414 HydrophobicContact CB-CD1 4.37Å; W403-L414 HydrophobicContact CD2-CD2 4.38Å; W403-L414 HydrophobicContact CD2-CG 4.43Å; W403-L414 HydrophobicContact CE3-CD1 3.97Å; W403-L414 HydrophobicContact CE3-CD2 3.69Å; W403-L414 HydrophobicContact CE3-CG 3.49Å; W403-L414 VanDerWaalsContact CE3-CG 3.49Å; W403-L414 HydrophobicContact CH2-CD2 4.41Å; W403-L414 HydrophobicContact CZ3-CD2 3.66Å; W403-L414 HydrophobicContact CZ3-CG 3.71Å; E404-L414 CarbonylContact O-C 3.59Å; E404-L414 WeakPolarHBondContact O-CA 3.4Å; F405-L414 HydrophobicContact CB-CD1 3.91Å; F405-L414 HydrophobicContact CD2-CD1 4.44Å; L414-Y432 PolarHBondContact N-O 2.78Å; L414-Y432 WeakPolarHBondContact O-CB 3.23Å; L414-Y432 WeakPolarHBondContact O-CD2 3.37Å; L414-Y432 PolarHBondContact O-N 2.83Å; L414-F439 HydrophobicContact CB-CD1 3.82Å; L414-F439 HydrophobicContact CB-CE1 3.44Å; L414-F439 VanDerWaalsContact CB-CE1 3.44Å; L414-F439 HydrophobicContact CB-CE2 4.39Å; L414-F439 HydrophobicContact CB-CG 4.44Å; L414-F439 HydrophobicContact CB-CZ 3.74Å; L414-F439 HydrophobicContact CD2-CD2 4.14Å; L414-F439 HydrophobicContact CD2-CE1 4.47Å; L414-F439 HydrophobicContact CD2-CE2 3.98Å; L414-F439 HydrophobicContact CD2-CG 4.42Å; L414-F439 HydrophobicContact CD2-CZ 4.15Å; L414-F439 HydrophobicContact CG-CZ 4.48Å
415	V	98.9	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139	178.9	60.8	0	0	0	0	110.3	W403 E404 F406 V430 I431 W453	W403-V415 WeakPolarHBondContact CA-O 3.39Å; W403-V415 VanDerWaalsContact CE3-O 3.29Å; E404-V415 HydrophobicContact CB-CG1 3.71Å; E404-V415 HydrophobicContact CG-CG1 4.22Å; E404-V415 PolarHBondContact N-O 3.18Å; E404-V415 PolarHBondContact O-N 3.21Å; F406-V415 HydrophobicContact CE1-CB 4.37Å; F406-V415 HydrophobicContact CE1-CG1 4.09Å; V415-V430 WeakPolarHBondContact CA-O 3.19Å; V415-I431 HydrophobicContact CB-CG1 4.08Å; V415-I431 HydrophobicContact CG2-CB 4.49Å; V415-I431 HydrophobicContact CG2-CG1 3.65Å; V415-W453 HydrophobicContact CG1-CB 3.7Å; V415-W453 HydrophobicContact CG1-CD2 4.35Å; V415-W453 HydrophobicContact CG1-CG 3.82Å; V415-W453 HydrophobicContact CG2-CD2 3.9Å; V415-W453 HydrophobicContact CG2-CG 3.89Å; V415-W453 HydrophobicContact CG2-CZ2 4.37Å
416	V	98.9	Very high	95.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.1	173.9	61.2	0	0	0	0	111.6	T397 A400 D402 W403 N418 S429 V430 Y432 W453	T397-V416 HydrophobicContact CG2-CB 4.48Å; T397-V416 HydrophobicContact CG2-CG1 4.39Å; T397-V416 HydrophobicContact CG2-CG2 3.87Å; A400-V416 HydrophobicContact CB-CG2 3.85Å; D402-V416 WeakPolarHBondContact O-CA 3.15Å; W403-V416 HydrophobicContact CD2-CB 4.1Å; W403-V416 HydrophobicContact CD2-CG2 4.22Å; W403-V416 HydrophobicContact CE3-CB 3.65Å; W403-V416 HydrophobicContact CE3-CG2 4.28Å; W403-V416 HydrophobicContact CH2-CB 3.58Å; W403-V416 HydrophobicContact CH2-CG1 4.16Å; W403-V416 HydrophobicContact CH2-CG2 4.07Å; W403-V416 HydrophobicContact CZ2-CB 3.99Å; W403-V416 HydrophobicContact CZ2-CG2 3.95Å; W403-V416 HydrophobicContact CZ3-CB 3.42Å; W403-V416 VanDerWaalsContact CZ3-CB 3.42Å; W403-V416 HydrophobicContact CZ3-CG1 4.2Å; W403-V416 HydrophobicContact CZ3-CG2 4.26Å; V416-N418 PolarHBondContact O-N 3Å; V416-S429 WeakPolarHBondContact O-CB 3.37Å; V416-S429 PolarHBondContact O-OG 3.46Å; V416-V430 HydrophobicContact CG1-CB 4Å; V416-V430 HydrophobicContact CG1-CG2 4.42Å; V416-V430 PolarHBondContact N-O 3.36Å; V416-Y432 HydrophobicContact CG1-CE2 4.14Å; V416-W453 PolarHBondContact O-NE1 3.11Å
417	A	98.8	Very high	95.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	96.8	164.5	0	0	0	0	0	110.4	A400 Y401 D402 A419 A450	A400-A417 WeakPolarHBondContact CA-O 3.42Å; Y401-A417 PolarHBondContact N-O 2.81Å; D402-A417 HydrophobicContact CB-CB 3.75Å; D402-A417 PolarHBondContact O-N 3.17Å; A417-A419 PolarHBondContact O-N 2.88Å; A417-A450 HydrophobicContact CB-CB 3.75Å; A417-A450 WeakPolarHBondContact CB-O 3.48Å
418	N	98.8	Very high	95.3	Very high	8 Å²	8	36.7 Å²	36.7	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.1	173.4	-76.8	-37.2	0	0	0	109.9	S398 V416 L427 D428 S429	S398-N418 PolarHBondContact N-OD1 2.97Å; V416-N418 PolarHBondContact O-N 3Å; N418-L427 HydrophobicContact CB-CB 4.29Å; N418-L427 HydrophobicContact CB-CD1 4.37Å; N418-D428 PolarHBondContact ND2-O 3.11Å; N418-S429 PolarHBondContact N-OG 3.34Å
419	A	97.8	Very high	95.7	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.215	C	C	.	.			trans	-99.3	-41	-170.5	0	0	0	0	0	114.1	S398 G399 Y401 A417 T425 C449 A450	S398-A419 PolarHBondContact O-N 3.26Å; G399-A419 VanDerWaalsContact O-CB 3.27Å; G399-A419 WeakPolarHBondContact O-CB 3.17Å; G399-A419 PolarHBondContact O-N 2.61Å; G399-A419 VanDerWaalsContact O-N 3.1Å; Y401-A419 HydrophobicContact CD1-CB 4.46Å; Y401-A419 HydrophobicContact CD2-CB 3.21Å; Y401-A419 HydrophobicContact CE2-CB 3.42Å; Y401-A419 VanDerWaalsContact CE2-CB 3.42Å; Y401-A419 HydrophobicContact CG-CB 3.77Å; A417-A419 PolarHBondContact O-N 2.88Å; A419-T425 WeakPolarHBondContact O-CA 3.46Å; A419-C449 WeakPolarHBondContact O-CA 3.42Å; A419-A450 VanDerWaalsContact CB-O 3.31Å; A419-A450 WeakPolarHBondContact CB-O 3.33Å
420	F	96.3	Very high	96.3	Very high	46 Å²	46	33.5 Å²	33.5	20%	0.202	19%	0.186	C	C	.	.			trans	-158.7	132	-171	-178.4	-119.7	0	0	0	112.3	H373 S398 G399 G422 T424 T425 L427 L472	H373-F420 WeakPolarHBondContact CB-O 3.47Å; H373-F420 AromaticContact CD2-CD1 3.97Å; H373-F420 AromaticContact CD2-CE1 3.88Å; H373-F420 AromaticContact CE1-CD1 3.7Å; H373-F420 AromaticContact CG-CD1 3.92Å; H373-F420 AromaticContact ND1-CD1 3.76Å; H373-F420 AromaticContact NE2-CD1 3.87Å; H373-F420 AromaticContact NE2-CE1 3.73Å; S398-F420 CarbonylContact C-O 3.53Å; S398-F420 PolarHBondContact O-N 2.81Å; G399-F420 WeakPolarHBondContact CA-O 3.44Å; G399-F420 PolarHBondContact N-O 3.09Å; F420-G422 WeakPolarHBondContact CZ-O 3.41Å; F420-T424 VanDerWaalsContact CD2-O 3.3Å; F420-T424 WeakPolarHBondContact CD2-O 3.47Å; F420-T425 HydrophobicContact CD2-CG2 4.02Å; F420-L427 VanDerWaalsContact N-CD1 3.31Å; F420-L472 HydrophobicContact CD2-CD1 4.18Å; F420-L472 HydrophobicContact CE2-CD1 3.78Å
421	D	94.4	Very high	97	Very high	50 Å²	50	28.7 Å²	28.7	27%	0.267	15%	0.154	S	C	.	.			trans	-100.4	2.4	-177.9	67.7	-5.3	0	0	0	113.7	V423 T424 L427	D421-V423 WeakPolarHBondContact OD1-CA 3.49Å; D421-V423 PolarHBondContact OD1-N 3.28Å; D421-T424 PolarHBondContact N-O 3.01Å; D421-T424 PolarHBondContact OD1-N 3.13Å; D421-L427 HydrophobicContact CB-CD1 4.14Å; D421-L427 HydrophobicContact CB-CD2 3.86Å
422	G	92.5	Very high	97.2	Very high	21 Å²	21	22.8 Å²	22.8	22%	0.216	13%	0.131	C	C	.	.	S	Bend	trans	102.7	-13.4	-170.8	0	0	0	0	0	113.5	F420	F420-G422 WeakPolarHBondContact CZ-O 3.41Å
423	V	91.9	Very high	97.2	Very high	125 Å²	125	22.3 Å²	22.3	76%	0.758	13%	0.13	S	C	*	.	S	Bend	trans	-129.9	-45.7	-174.6	-176.3	0	0	0	0	112	D421	D421-V423 WeakPolarHBondContact OD1-CA 3.49Å; D421-V423 PolarHBondContact OD1-N 3.28Å
424	T	94.4	Very high	97.2	Very high	43 Å²	43	23.4 Å²	23.4	26%	0.264	13%	0.134	S	C	.	.			trans	-137.4	156	-175.5	-168.2	0	0	0	0	112.3	F420 D421 S426 L427	F420-T424 VanDerWaalsContact CD2-O 3.3Å; F420-T424 WeakPolarHBondContact CD2-O 3.47Å; D421-T424 PolarHBondContact N-O 3.01Å; D421-T424 PolarHBondContact OD1-N 3.13Å; T424-S426 PolarHBondContact OG1-N 3.19Å; T424-L427 HydrophobicContact CG2-CD2 3.83Å
425	T	96.2	Very high	97.1	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	15%	0.152	C	C	.	.	S	Bend	trans	-97.7	-1.4	169.1	59.6	0	0	0	0	113.3	A419 F420 L427 F448 C449 H470 R471 L472	A419-T425 WeakPolarHBondContact O-CA 3.46Å; F420-T425 HydrophobicContact CD2-CG2 4.02Å; T425-L427 PolarHBondContact O-N 3.48Å; T425-F448 CarbonylContact O-C 3.51Å; T425-F448 VanDerWaalsContact O-CA 3.27Å; T425-F448 WeakPolarHBondContact O-CA 3.17Å; T425-C449 HydrophobicContact CG2-CB 3.87Å; T425-C449 PolarHBondContact O-N 3.21Å; T425-H470 WeakPolarHBondContact CB-O 3.45Å; T425-H470 PolarHBondContact OG1-O 3.18Å; T425-R471 WeakPolarHBondContact OG1-CA 3.41Å; T425-L472 HydrophobicContact CG2-CD1 3.73Å; T425-L472 HydrophobicContact CG2-CG 3.67Å; T425-L472 PolarHBondContact OG1-N 2.88Å
426	S	96.1	Very high	96.9	Very high	29 Å²	29	34 Å²	34	20%	0.203	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	87.6	176.1	-176.3	0	0	0	0	108.9	T424 K446	T424-S426 PolarHBondContact OG1-N 3.19Å; S426-K446 VanDerWaalsContact C-CE 3.43Å; S426-K446 WeakPolarHBondContact O-CE 3.23Å; S426-K446 PolarHBondContact O-NZ 3.18Å; S426-K446 WeakPolarHBondContact OG-CE 3.02Å
427	L	96.8	Very high	96.7	Very high	16 Å²	16	35.6 Å²	35.6	8%	0.084	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	164	-171.4	-60.6	178.8	0	0	0	111.7	N418 F420 D421 T424 T425 T447	N418-L427 HydrophobicContact CB-CB 4.29Å; N418-L427 HydrophobicContact CB-CD1 4.37Å; F420-L427 VanDerWaalsContact N-CD1 3.31Å; D421-L427 HydrophobicContact CB-CD1 4.14Å; D421-L427 HydrophobicContact CB-CD2 3.86Å; T424-L427 HydrophobicContact CG2-CD2 3.83Å; T425-L427 PolarHBondContact O-N 3.48Å; L427-T447 PolarHBondContact N-O 3.33Å; L427-T447 VanDerWaalsContact N-O 3.12Å; L427-T447 PolarHBondContact O-N 3.33Å; L427-T447 PolarHBondContact O-OG1 2.81Å
428	D	98.3	Very high	96.7	Very high	76 Å²	76	40.6 Å²	40.6	41%	0.406	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.5	172.4	-64.6	-4.8	0	0	0	108.4	N418 I445 K446	N418-D428 PolarHBondContact ND2-O 3.11Å; D428-I445 CarbonylContact C-O 3.51Å; D428-I445 WeakPolarHBondContact CA-O 3.36Å; D428-K446 WeakPolarHBondContact OD1-CD 3.43Å; D428-K446 IonicContact OD1-NZ 2.69Å; D428-K446 PolarHBondContact OD1-NZ 3.35Å
429	S	98.6	Very high	96.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	148.6	162.6	-71.9	0	0	0	0	109.2	V416 N418 T444 I445 T447 A450	V416-S429 WeakPolarHBondContact O-CB 3.37Å; V416-S429 PolarHBondContact O-OG 3.46Å; N418-S429 PolarHBondContact N-OG 3.34Å; S429-T444 WeakPolarHBondContact O-CA 3.37Å; S429-I445 PolarHBondContact N-O 2.79Å; S429-I445 PolarHBondContact O-N 3.26Å; S429-T447 PolarHBondContact OG-OG1 2.99Å; S429-A450 WeakPolarHBondContact OG-CB 3.33Å
430	V	98.9	Very high	96.7	Very high	17 Å²	17	43.9 Å²	43.9	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.1	-170.1	-170.3	0	0	0	0	109.9	V415 V416 Y432 V441 T444	V415-V430 WeakPolarHBondContact CA-O 3.19Å; V416-V430 HydrophobicContact CG1-CB 4Å; V416-V430 HydrophobicContact CG1-CG2 4.42Å; V416-V430 PolarHBondContact N-O 3.36Å; V430-Y432 HydrophobicContact CB-CD2 4.43Å; V430-Y432 HydrophobicContact CB-CE2 3.69Å; V430-Y432 HydrophobicContact CG1-CD1 4.32Å; V430-Y432 HydrophobicContact CG1-CD2 4.14Å; V430-Y432 HydrophobicContact CG1-CE1 3.84Å; V430-Y432 HydrophobicContact CG1-CE2 3.64Å; V430-Y432 HydrophobicContact CG1-CG 4.45Å; V430-Y432 VanDerWaalsContact CG1-CZ 3.47Å; V430-V441 HydrophobicContact CG1-CB 4.41Å; V430-V441 HydrophobicContact CG1-CG1 3.89Å; V430-V441 HydrophobicContact CG1-CG2 3.96Å; V430-T444 HydrophobicContact CG1-CG2 4.3Å; V430-T444 HydrophobicContact CG2-CG2 4.21Å
431	I	98.9	Very high	96.8	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.9	169.2	-53.8	171.7	0	0	0	107	F406 F413 V415 F442 Q443 I445 L464 F496	F406-I431 HydrophobicContact CZ-CG2 4.23Å; F413-I431 HydrophobicContact CD1-CG2 4.13Å; V415-I431 HydrophobicContact CB-CG1 4.08Å; V415-I431 HydrophobicContact CG2-CB 4.49Å; V415-I431 HydrophobicContact CG2-CG1 3.65Å; I431-F442 HydrophobicContact CB-CD1 4.29Å; I431-F442 HydrophobicContact CG2-CB 4.37Å; I431-F442 HydrophobicContact CG2-CD1 3.88Å; I431-F442 WeakPolarHBondContact O-CA 3.37Å; I431-F442 WeakPolarHBondContact O-CB 3.16Å; I431-F442 PolarHBondContact O-N 2.85Å; I431-Q443 HydrophobicContact CB-CB 4.38Å; I431-Q443 HydrophobicContact CD1-CB 4.38Å; I431-Q443 PolarHBondContact N-O 2.85Å; I431-Q443 PolarHBondContact O-N 2.03Å; I431-Q443 VanDerWaalsContact O-N 3.12Å; I431-I445 HydrophobicContact CD1-CD1 3.72Å; I431-I445 HydrophobicContact CD1-CG1 4.46Å; I431-L464 HydrophobicContact CD1-CD1 3.87Å; I431-F496 HydrophobicContact CD1-CB 4.39Å; I431-F496 HydrophobicContact CD1-CD2 3.56Å; I431-F496 HydrophobicContact CD1-CE2 4.13Å; I431-F496 HydrophobicContact CD1-CG 4.17Å
432	Y	98.9	Very high	97	Very high	14 Å²	14	46.7 Å²	46.7	6%	0.055	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	152.4	175.6	-58.3	-93.1	0	0	0	110.6	L395 W403 F413 L414 V416 V430 F439 Q440 V441	L395-Y432 HydrophobicContact CD1-CD1 4.29Å; L395-Y432 HydrophobicContact CD1-CD2 4.21Å; L395-Y432 HydrophobicContact CD1-CE1 4.13Å; L395-Y432 HydrophobicContact CD1-CE2 4.04Å; L395-Y432 HydrophobicContact CD1-CG 4.34Å; L395-Y432 HydrophobicContact CD2-CD1 4.33Å; L395-Y432 HydrophobicContact CD2-CE1 3.9Å; W403-Y432 HydrophobicContact CH2-CD2 4.36Å; W403-Y432 AromaticContact CH2-CE2 3.85Å; W403-Y432 HydrophobicContact CH2-CE2 3.85Å; W403-Y432 AromaticContact CZ3-CD2 3.98Å; W403-Y432 HydrophobicContact CZ3-CD2 3.98Å; W403-Y432 AromaticContact CZ3-CE2 3.86Å; W403-Y432 HydrophobicContact CZ3-CE2 3.86Å; F413-Y432 WeakPolarHBondContact CA-O 3.32Å; F413-Y432 WeakPolarHBondContact CB-O 3.44Å; F413-Y432 WeakPolarHBondContact CD1-O 3.49Å; L414-Y432 PolarHBondContact N-O 2.78Å; L414-Y432 WeakPolarHBondContact O-CB 3.23Å; L414-Y432 WeakPolarHBondContact O-CD2 3.37Å; L414-Y432 PolarHBondContact O-N 2.83Å; V416-Y432 HydrophobicContact CG1-CE2 4.14Å; V430-Y432 HydrophobicContact CB-CD2 4.43Å; V430-Y432 HydrophobicContact CB-CE2 3.69Å; V430-Y432 HydrophobicContact CG1-CD1 4.32Å; V430-Y432 HydrophobicContact CG1-CD2 4.14Å; V430-Y432 HydrophobicContact CG1-CE1 3.84Å; V430-Y432 HydrophobicContact CG1-CE2 3.64Å; V430-Y432 HydrophobicContact CG1-CG 4.45Å; V430-Y432 VanDerWaalsContact CG1-CZ 3.47Å; Y432-F439 HydrophobicContact CD1-CB 4.48Å; Y432-F439 HydrophobicContact CG-CB 4.37Å; Y432-Q440 CarbonylContact C-O 3.51Å; Y432-Q440 WeakPolarHBondContact CA-O 3.16Å; Y432-Q440 WeakPolarHBondContact CB-O 3.3Å; Y432-V441 HydrophobicContact CD1-CG2 4.04Å; Y432-V441 HydrophobicContact CE1-CG2 3.68Å
433	V	98.5	Very high	97.2	Very high	11 Å²	11	47.2 Å²	47.2	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.3	171.9	62.4	0	0	0	0	110	H412 F413 I435 F439 Q440 F442	H412-V433 WeakPolarHBondContact O-CA 3.48Å; F413-V433 HydrophobicContact CD1-CB 3.92Å; F413-V433 HydrophobicContact CD1-CG2 4.15Å; F413-V433 HydrophobicContact CE1-CB 3.8Å; F413-V433 HydrophobicContact CE1-CG2 3.78Å; F413-V433 HydrophobicContact CZ-CG2 4.13Å; V433-I435 HydrophobicContact CG1-CD1 3.64Å; V433-I435 HydrophobicContact CG1-CG1 4.03Å; V433-I435 HydrophobicContact CG2-CG1 4.37Å; V433-I435 PolarHBondContact O-N 3.48Å; V433-F439 WeakPolarHBondContact O-CA 3.18Å; V433-Q440 PolarHBondContact N-O 3.03Å; V433-Q440 PolarHBondContact O-N 3.28Å; V433-F442 HydrophobicContact CB-CB 4Å; V433-F442 HydrophobicContact CB-CD2 4.32Å; V433-F442 HydrophobicContact CB-CG 4.44Å; V433-F442 HydrophobicContact CG1-CB 3.91Å; V433-F442 HydrophobicContact CG1-CD2 4.21Å
434	W	98.3	Very high	97.5	Very high	34 Å²	34	44.9 Å²	44.9	13%	0.129	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	113.6	178.1	-174.3	-95.5	0	0	0	111.7	I355 Y360 H392 H412 G437 K438 F439	I355-W434 HydrophobicContact CD1-CB 4.36Å; I355-W434 HydrophobicContact CD1-CD2 3.58Å; I355-W434 HydrophobicContact CD1-CE3 3.59Å; I355-W434 HydrophobicContact CD1-CG 3.95Å; I355-W434 HydrophobicContact CD1-CH2 4.35Å; I355-W434 HydrophobicContact CD1-CZ2 4.37Å; I355-W434 HydrophobicContact CD1-CZ3 4Å; I355-W434 HydrophobicContact CG2-CD2 4.43Å; I355-W434 HydrophobicContact CG2-CG 4.45Å; I355-W434 HydrophobicContact CG2-CZ2 4.38Å; Y360-W434 HydrophobicContact CE1-CH2 4.02Å; Y360-W434 AromaticContact CZ-CH2 3.88Å; H392-W434 AromaticContact NE2-CH2 3.41Å; H392-W434 WeakPolarHBondContact NE2-CH2 3.42Å; H392-W434 AromaticContact NE2-CZ3 3.96Å; H412-W434 HydrophobicContact CB-CB 3.82Å; H412-W434 PolarHBondContact O-N 2.83Å; W434-G437 VanDerWaalsContact CH2-C 3.49Å; W434-G437 WeakPolarHBondContact CH2-O 3.41Å; W434-G437 VanDerWaalsContact CZ2-CA 3.43Å; W434-G437 VanDerWaalsContact CZ2-O 3.3Å; W434-G437 WeakPolarHBondContact CZ2-O 3Å; W434-K438 WeakPolarHBondContact CA-O 3.29Å; W434-F439 HydrophobicContact CB-CD1 4.33Å; W434-F439 HydrophobicContact CB-CE1 4.14Å; W434-F439 HydrophobicContact CE3-CD1 4.15Å; W434-F439 AromaticContact CE3-CD2 3.49Å; W434-F439 HydrophobicContact CE3-CD2 3.49Å; W434-F439 VanDerWaalsContact CE3-CD2 3.49Å; W434-F439 HydrophobicContact CE3-CE1 4.09Å; W434-F439 AromaticContact CE3-CE2 3.44Å; W434-F439 HydrophobicContact CE3-CE2 3.44Å; W434-F439 VanDerWaalsContact CE3-CE2 3.44Å; W434-F439 AromaticContact CE3-CG 3.89Å; W434-F439 HydrophobicContact CE3-CG 3.89Å; W434-F439 AromaticContact CE3-CZ 3.77Å; W434-F439 HydrophobicContact CE3-CZ 3.77Å; W434-F439 AromaticContact CZ3-CD2 3.64Å; W434-F439 HydrophobicContact CZ3-CD2 3.64Å; W434-F439 AromaticContact CZ3-CE2 3.59Å; W434-F439 HydrophobicContact CZ3-CE2 3.59Å; W434-F439 HydrophobicContact CZ3-CG 4.43Å; W434-F439 HydrophobicContact CZ3-CZ 4.32Å
435	I	96.4	Very high	97.7	Very high	73 Å²	73	43.3 Å²	43.3	37%	0.374	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	129.4	179.5	-61.2	174.6	0	0	0	108.6	V433 G437 K438 Q440	V433-I435 HydrophobicContact CG1-CD1 3.64Å; V433-I435 HydrophobicContact CG1-CG1 4.03Å; V433-I435 HydrophobicContact CG2-CG1 4.37Å; V433-I435 PolarHBondContact O-N 3.48Å; I435-G437 VanDerWaalsContact C-N 3.3Å; I435-G437 PolarHBondContact O-N 3.46Å; I435-K438 PolarHBondContact N-O 3.27Å; I435-K438 WeakPolarHBondContact O-CG 3.22Å; I435-K438 PolarHBondContact O-N 3.4Å; I435-Q440 HydrophobicContact CB-CG 4.49Å; I435-Q440 PolarHBondContact O-NE2 3.13Å
436	D	94.5	Very high	97.8	Very high	148 Å²	148	47.9 Å²	47.9	79%	0.791	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	41.3	177.7	-55.5	-36.4	0	0	0	114	K438	D436-K438 PolarHBondContact O-N 3.48Å
437	G	95.5	Very high	97.8	Very high	35 Å²	35	46.5 Å²	46.5	36%	0.361	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	12.4	174.8	0	0	0	0	0	115.2	H392 W434 I435	H392-G437 PolarHBondContact CE1-O 3.33Å; H392-G437 VanDerWaalsContact CE1-O 3.28Å; H392-G437 PolarHBondContact NE2-O 2.74Å; W434-G437 VanDerWaalsContact CH2-C 3.49Å; W434-G437 WeakPolarHBondContact CH2-O 3.41Å; W434-G437 VanDerWaalsContact CZ2-CA 3.43Å; W434-G437 VanDerWaalsContact CZ2-O 3.3Å; W434-G437 WeakPolarHBondContact CZ2-O 3Å; I435-G437 VanDerWaalsContact C-N 3.3Å; I435-G437 PolarHBondContact O-N 3.46Å
438	K	98	Very high	97.8	Very high	105 Å²	105	48 Å²	48	46%	0.457	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.7	178.1	61.3	-178.6	-179.5	-179.1	0	111.5	W434 I435 D436 Q440	W434-K438 WeakPolarHBondContact CA-O 3.29Å; I435-K438 PolarHBondContact N-O 3.27Å; I435-K438 WeakPolarHBondContact O-CG 3.22Å; I435-K438 PolarHBondContact O-N 3.4Å; D436-K438 PolarHBondContact O-N 3.48Å; K438-Q440 HydrophobicContact CG-CG 4.2Å
439	F	98.8	Very high	97.8	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.022	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	133.7	170.1	-75.4	-74.7	0	0	0	110.9	F353 I355 I379 Q393 L395 F405 L414 Y432 V433 W434	F353-F439 AromaticContact CE2-CE2 3.72Å; F353-F439 HydrophobicContact CE2-CE2 3.72Å; F353-F439 AromaticContact CE2-CZ 3.81Å; F353-F439 HydrophobicContact CE2-CZ 3.81Å; F353-F439 AromaticContact CZ-CE2 3.75Å; F353-F439 HydrophobicContact CZ-CE2 3.75Å; F353-F439 HydrophobicContact CZ-CZ 4.07Å; I355-F439 HydrophobicContact CD1-CE2 4.29Å; I355-F439 HydrophobicContact CD1-CZ 3.83Å; I379-F439 HydrophobicContact CD1-CD2 3.38Å; I379-F439 HydrophobicContact CD1-CE2 3.86Å; I379-F439 HydrophobicContact CD1-CG 4.31Å; Q393-F439 PolarHBondContact NE2-O 3.38Å; L395-F439 HydrophobicContact CD1-CB 4.39Å; F405-F439 HydrophobicContact CD2-CZ 4.28Å; F405-F439 HydrophobicContact CE2-CZ 4.24Å; L414-F439 HydrophobicContact CB-CD1 3.82Å; L414-F439 HydrophobicContact CB-CE1 3.44Å; L414-F439 VanDerWaalsContact CB-CE1 3.44Å; L414-F439 HydrophobicContact CB-CE2 4.39Å; L414-F439 HydrophobicContact CB-CG 4.44Å; L414-F439 HydrophobicContact CB-CZ 3.74Å; L414-F439 HydrophobicContact CD2-CD2 4.14Å; L414-F439 HydrophobicContact CD2-CE1 4.47Å; L414-F439 HydrophobicContact CD2-CE2 3.98Å; L414-F439 HydrophobicContact CD2-CG 4.42Å; L414-F439 HydrophobicContact CD2-CZ 4.15Å; L414-F439 HydrophobicContact CG-CZ 4.48Å; Y432-F439 HydrophobicContact CD1-CB 4.48Å; Y432-F439 HydrophobicContact CG-CB 4.37Å; V433-F439 WeakPolarHBondContact O-CA 3.18Å; W434-F439 HydrophobicContact CB-CD1 4.33Å; W434-F439 HydrophobicContact CB-CE1 4.14Å; W434-F439 HydrophobicContact CE3-CD1 4.15Å; W434-F439 AromaticContact CE3-CD2 3.49Å; W434-F439 HydrophobicContact CE3-CD2 3.49Å; W434-F439 VanDerWaalsContact CE3-CD2 3.49Å; W434-F439 HydrophobicContact CE3-CE1 4.09Å; W434-F439 AromaticContact CE3-CE2 3.44Å; W434-F439 HydrophobicContact CE3-CE2 3.44Å; W434-F439 VanDerWaalsContact CE3-CE2 3.44Å; W434-F439 AromaticContact CE3-CG 3.89Å; W434-F439 HydrophobicContact CE3-CG 3.89Å; W434-F439 AromaticContact CE3-CZ 3.77Å; W434-F439 HydrophobicContact CE3-CZ 3.77Å; W434-F439 AromaticContact CZ3-CD2 3.64Å; W434-F439 HydrophobicContact CZ3-CD2 3.64Å; W434-F439 AromaticContact CZ3-CE2 3.59Å; W434-F439 HydrophobicContact CZ3-CE2 3.59Å; W434-F439 HydrophobicContact CZ3-CG 4.43Å; W434-F439 HydrophobicContact CZ3-CZ 4.32Å
440	Q	98.4	Very high	97.8	Very high	71 Å²	71	44.6 Å²	44.6	33%	0.332	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.4	176.5	-55.8	-171.1	42.2	0	0	109.1	Y432 V433 I435 K438 F442	Y432-Q440 CarbonylContact C-O 3.51Å; Y432-Q440 WeakPolarHBondContact CA-O 3.16Å; Y432-Q440 WeakPolarHBondContact CB-O 3.3Å; V433-Q440 PolarHBondContact N-O 3.03Å; V433-Q440 PolarHBondContact O-N 3.28Å; I435-Q440 HydrophobicContact CB-CG 4.49Å; I435-Q440 PolarHBondContact O-NE2 3.13Å; K438-Q440 HydrophobicContact CG-CG 4.2Å; Q440-F442 PolarHBondContact O-N 3.39Å
441	V	98.6	Very high	97.8	Very high	93 Å²	93	44.5 Å²	44.5	56%	0.564	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	126.2	-177.9	177.9	0	0	0	0	109.9	V430 Y432 T444	V430-V441 HydrophobicContact CG1-CB 4.41Å; V430-V441 HydrophobicContact CG1-CG1 3.89Å; V430-V441 HydrophobicContact CG1-CG2 3.96Å; Y432-V441 HydrophobicContact CD1-CG2 4.04Å; Y432-V441 HydrophobicContact CE1-CG2 3.68Å; V441-T444 HydrophobicContact CG1-CG2 4.36Å
442	F	98.2	Very high	97.8	Very high	63 Å²	63	45.2 Å²	45.2	28%	0.276	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-49.4	174.2	174.1	-105.7	0	0	0	110.9	F413 I431 V433 Q440 R494 F496	F413-F442 HydrophobicContact CD1-CD1 4.38Å; F413-F442 HydrophobicContact CD1-CG 4.37Å; F413-F442 HydrophobicContact CE1-CD1 4.02Å; F413-F442 AromaticContact CE1-CD2 3.94Å; F413-F442 HydrophobicContact CE1-CD2 3.94Å; F413-F442 HydrophobicContact CE1-CE1 4.13Å; F413-F442 HydrophobicContact CE1-CE2 4.05Å; F413-F442 AromaticContact CE1-CG 3.91Å; F413-F442 HydrophobicContact CE1-CG 3.91Å; F413-F442 HydrophobicContact CE1-CZ 4.12Å; I431-F442 HydrophobicContact CB-CD1 4.29Å; I431-F442 HydrophobicContact CG2-CB 4.37Å; I431-F442 HydrophobicContact CG2-CD1 3.88Å; I431-F442 WeakPolarHBondContact O-CA 3.37Å; I431-F442 WeakPolarHBondContact O-CB 3.16Å; I431-F442 PolarHBondContact O-N 2.85Å; V433-F442 HydrophobicContact CB-CB 4Å; V433-F442 HydrophobicContact CB-CD2 4.32Å; V433-F442 HydrophobicContact CB-CG 4.44Å; V433-F442 HydrophobicContact CG1-CB 3.91Å; V433-F442 HydrophobicContact CG1-CD2 4.21Å; Q440-F442 PolarHBondContact O-N 3.39Å; F442-R494 WeakPolarHBondContact CZ-O 3.37Å; F442-F496 HydrophobicContact CE1-CD2 4.15Å; F442-F496 HydrophobicContact CE1-CE2 4.35Å
443	Q	97.9	Very high	97.8	Very high	31 Å²	31	44.6 Å²	44.6	15%	0.145	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	150.3	-176.9	179.2	175.6	-3	0	0	110.3	I431 I445 F496	I431-Q443 HydrophobicContact CB-CB 4.38Å; I431-Q443 HydrophobicContact CD1-CB 4.38Å; I431-Q443 PolarHBondContact N-O 2.85Å; I431-Q443 PolarHBondContact O-N 2.03Å; I431-Q443 VanDerWaalsContact O-N 3.12Å; Q443-I445 HydrophobicContact CG-CG1 4.19Å; Q443-F496 PolarHBondContact NE2-O 3.1Å
444	T	98.4	Very high	97.8	Very high	77 Å²	77	45.7 Å²	45.7	47%	0.472	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.1	166.6	58.7	0	0	0	0	110.3	S429 V430 V441	S429-T444 WeakPolarHBondContact O-CA 3.37Å; V430-T444 HydrophobicContact CG1-CG2 4.3Å; V430-T444 HydrophobicContact CG2-CG2 4.21Å; V441-T444 HydrophobicContact CG1-CG2 4.36Å
445	I	97.7	Very high	97.8	Very high	10 Å²	10	45.9 Å²	45.9	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.9	179.6	-64.8	178.9	0	0	0	108.5	D428 S429 I431 Q443 T447 W453 Y487 F496	D428-I445 CarbonylContact C-O 3.51Å; D428-I445 WeakPolarHBondContact CA-O 3.36Å; S429-I445 PolarHBondContact N-O 2.79Å; S429-I445 PolarHBondContact O-N 3.26Å; I431-I445 HydrophobicContact CD1-CD1 3.72Å; I431-I445 HydrophobicContact CD1-CG1 4.46Å; Q443-I445 HydrophobicContact CG-CG1 4.19Å; I445-T447 HydrophobicContact CG2-CG2 4.23Å; I445-T447 PolarHBondContact O-N 3Å; I445-W453 HydrophobicContact CB-CH2 4.5Å; I445-W453 HydrophobicContact CD1-CH2 4.09Å; I445-W453 HydrophobicContact CG2-CH2 4.24Å; I445-Y487 HydrophobicContact CD1-CD1 4.17Å; I445-Y487 HydrophobicContact CD1-CD2 4.43Å; I445-Y487 HydrophobicContact CD1-CE1 4.25Å; I445-Y487 HydrophobicContact CD1-CE2 4.48Å; I445-Y487 HydrophobicContact CD1-CG 4.28Å; I445-Y487 HydrophobicContact CG2-CE1 3.88Å; I445-Y487 HydrophobicContact CG2-CE2 4.02Å; I445-Y487 VanDerWaalsContact CG2-CZ 3.44Å; I445-Y487 VanDerWaalsContact CG2-OH 3.22Å; I445-Y487 WeakPolarHBondContact CG2-OH 3.18Å; I445-F496 HydrophobicContact CD1-CB 4.27Å
446	K	97.6	Very high	97.8	Very high	97 Å²	97	42.5 Å²	42.5	42%	0.422	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	123.8	175.5	-169.4	69.7	-176.1	178.2	0	110.6	S426 D428	S426-K446 VanDerWaalsContact C-CE 3.43Å; S426-K446 WeakPolarHBondContact O-CE 3.23Å; S426-K446 PolarHBondContact O-NZ 3.18Å; S426-K446 WeakPolarHBondContact OG-CE 3.02Å; D428-K446 WeakPolarHBondContact OD1-CD 3.43Å; D428-K446 IonicContact OD1-NZ 2.69Å; D428-K446 PolarHBondContact OD1-NZ 3.35Å
447	T	97.8	Very high	97.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	168.9	-179.8	54.6	0	0	0	0	111.3	L427 S429 I445 A450 W453 V466	L427-T447 PolarHBondContact N-O 3.33Å; L427-T447 VanDerWaalsContact N-O 3.12Å; L427-T447 PolarHBondContact O-N 3.33Å; L427-T447 PolarHBondContact O-OG1 2.81Å; S429-T447 PolarHBondContact OG-OG1 2.99Å; I445-T447 HydrophobicContact CG2-CG2 4.23Å; I445-T447 PolarHBondContact O-N 3Å; T447-A450 HydrophobicContact CG2-CB 4.29Å; T447-W453 HydrophobicContact CG2-CH2 4.39Å; T447-W453 HydrophobicContact CG2-CZ2 3.74Å; T447-V466 HydrophobicContact CG2-CG1 4.38Å; T447-V466 HydrophobicContact CG2-CG2 3.95Å
448	F	96.8	Very high	96.8	Very high	47 Å²	47	38.3 Å²	38.3	21%	0.206	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	97.7	-175.3	-57.3	-76.2	0	0	0	110.5	T425 N468 G469 H470 R471 I482	T425-F448 CarbonylContact O-C 3.51Å; T425-F448 VanDerWaalsContact O-CA 3.27Å; T425-F448 WeakPolarHBondContact O-CA 3.17Å; F448-N468 HydrophobicContact CB-CB 4.43Å; F448-N468 PolarHBondContact N-OD1 2.96Å; F448-N468 WeakPolarHBondContact O-CA 3.43Å; F448-N468 PolarHBondContact O-OD1 2.83Å; F448-G469 PolarHBondContact O-N 2.79Å; F448-H470 CarbonylContact C-O 3.1Å; F448-R471 HydrophobicContact CD1-CG 4.17Å; F448-I482 HydrophobicContact CB-CD1 3.42Å; F448-I482 VanDerWaalsContact CB-CD1 3.42Å; F448-I482 HydrophobicContact CD2-CD1 3.79Å; F448-I482 HydrophobicContact CG-CD1 3.68Å
449	C	97.7	Very high	95.9	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.027	19%	0.186	C	C	.	.	S	Bend	trans	47.9	60.6	-167.7	-172	0	0	0	0	109.4	A419 T425 T451 G469 H470	A419-C449 WeakPolarHBondContact O-CA 3.42Å; T425-C449 HydrophobicContact CG2-CB 3.87Å; T425-C449 PolarHBondContact O-N 3.21Å; C449-T451 PolarHBondContact O-N 3.34Å; C449-T451 VanDerWaalsContact O-N 3.08Å; C449-G469 PolarHBondContact O-N 3.39Å; C449-H470 VanDerWaalsContact CB-O 3.22Å; C449-H470 WeakPolarHBondContact CB-O 3.5Å; C449-H470 PolarHBondContact SG-CE1 3.15Å; C449-H470 PolarHBondContact SG-ND1 2.85Å
450	A	98.6	Very high	94.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	118.5	176.5	0	0	0	0	0	107.9	A417 A419 S429 T447 V466 A467	A417-A450 HydrophobicContact CB-CB 3.75Å; A417-A450 WeakPolarHBondContact CB-O 3.48Å; A419-A450 VanDerWaalsContact CB-O 3.31Å; A419-A450 WeakPolarHBondContact CB-O 3.33Å; S429-A450 WeakPolarHBondContact OG-CB 3.33Å; T447-A450 HydrophobicContact CG2-CB 4.29Å; A450-V466 HydrophobicContact CB-CG2 3.86Å; A450-A467 WeakPolarHBondContact CA-O 3.25Å
451	T	98.4	Very high	93.9	Very high	15 Å²	15	37.4 Å²	37.4	9%	0.092	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-28.2	-177.2	35.8	0	0	0	0	111.8	Y401 D402 C449 A467 A507	Y401-T451 HydrophobicContact CD1-CG2 3.86Å; Y401-T451 HydrophobicContact CE1-CG2 4.08Å; D402-T451 WeakPolarHBondContact CB-O 3.02Å; C449-T451 PolarHBondContact O-N 3.34Å; C449-T451 VanDerWaalsContact O-N 3.08Å; T451-A467 PolarHBondContact N-O 2.95Å; T451-A467 VanDerWaalsContact OG1-CB 3.29Å; T451-A467 WeakPolarHBondContact OG1-CB 3.41Å; T451-A467 PolarHBondContact OG1-O 3.45Å; T451-A467 VanDerWaalsContact OG1-O 3.07Å; T451-A507 PolarHBondContact OG1-O 2.82Å
452	D	98.8	Very high	93.4	Very high	16 Å²	16	33.4 Å²	33.4	9%	0.086	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	148.6	-174.6	165	57.1	0	0	0	110.4	V466 A467 V508 W510	D452-V466 WeakPolarHBondContact O-CA 3.22Å; D452-A467 HydrophobicContact CB-CB 3.84Å; D452-A467 PolarHBondContact O-N 3.3Å; D452-V508 WeakPolarHBondContact CB-O 3.23Å; D452-W510 PolarHBondContact OD2-N 3.44Å
453	W	98.8	Very high	93.4	Very high	1 Å²	1	30.4 Å²	30.4	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.7	166.5	-79.3	103.4	0	0	0	109.7	D402 E404 V415 V416 I445 T447 L464 V465 V466 Y487	D402-W453 PolarHBondContact OD2-N 3.45Å; E404-W453 HydrophobicContact CB-CB 3.94Å; E404-W453 WeakPolarHBondContact CB-O 3.43Å; E404-W453 VanDerWaalsContact CG-O 3.27Å; E404-W453 WeakPolarHBondContact CG-O 3.48Å; V415-W453 HydrophobicContact CG1-CB 3.7Å; V415-W453 HydrophobicContact CG1-CD2 4.35Å; V415-W453 HydrophobicContact CG1-CG 3.82Å; V415-W453 HydrophobicContact CG2-CD2 3.9Å; V415-W453 HydrophobicContact CG2-CG 3.89Å; V415-W453 HydrophobicContact CG2-CZ2 4.37Å; V416-W453 PolarHBondContact O-NE1 3.11Å; I445-W453 HydrophobicContact CB-CH2 4.5Å; I445-W453 HydrophobicContact CD1-CH2 4.09Å; I445-W453 HydrophobicContact CG2-CH2 4.24Å; T447-W453 HydrophobicContact CG2-CH2 4.39Å; T447-W453 HydrophobicContact CG2-CZ2 3.74Å; W453-L464 HydrophobicContact CE3-CB 3.99Å; W453-L464 HydrophobicContact CZ3-CB 3.93Å; W453-V465 WeakPolarHBondContact CA-O 3.41Å; W453-V466 HydrophobicContact CD2-CB 3.88Å; W453-V466 HydrophobicContact CD2-CG2 4.05Å; W453-V466 HydrophobicContact CE3-CB 3.68Å; W453-V466 HydrophobicContact CE3-CG2 4.38Å; W453-V466 HydrophobicContact CH2-CB 3.62Å; W453-V466 HydrophobicContact CH2-CG1 4.06Å; W453-V466 HydrophobicContact CH2-CG2 4.21Å; W453-V466 HydrophobicContact CZ2-CB 3.78Å; W453-V466 HydrophobicContact CZ2-CG1 4.46Å; W453-V466 HydrophobicContact CZ2-CG2 3.84Å; W453-V466 HydrophobicContact CZ3-CB 3.57Å; W453-V466 HydrophobicContact CZ3-CG1 4.24Å; W453-V466 HydrophobicContact CZ3-CG2 4.46Å; W453-Y487 HydrophobicContact CH2-CD2 4.04Å; W453-Y487 AromaticContact CH2-CE2 3.81Å; W453-Y487 HydrophobicContact CH2-CE2 3.81Å; W453-Y487 AromaticContact CZ3-CD2 3.87Å; W453-Y487 HydrophobicContact CZ3-CD2 3.87Å; W453-Y487 HydrophobicContact CZ3-CE2 4.05Å
454	E	98.6	Very high	93.4	Very high	34 Å²	34	28.9 Å²	28.9	16%	0.159	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.3	175.5	171.1	63.2	-172.2	0	0	110.7	L464 V465 W510 F512	E454-L464 CarbonylContact O-C 3.51Å; E454-L464 WeakPolarHBondContact O-CA 3.45Å; E454-V465 HydrophobicContact CB-CG1 3.72Å; E454-V465 HydrophobicContact CG-CG1 4.29Å; E454-V465 PolarHBondContact N-O 3.49Å; E454-V465 PolarHBondContact O-N 3.48Å; E454-W510 HydrophobicContact CB-CB 4.08Å; E454-W510 WeakPolarHBondContact CB-O 3.42Å; E454-W510 VanDerWaalsContact CG-O 3.26Å; E454-W510 WeakPolarHBondContact CG-O 3.48Å; E454-F512 HydrophobicContact CG-CB 4.15Å; E454-F512 WeakPolarHBondContact OE1-CB 3.18Å
455	M	98.1	Very high	93.4	Very high	38 Å²	38	25.2 Å²	25.2	19%	0.187	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.6	174.4	-166.3	-76.4	-85.7	0	0	111.3	E404 F406 V462 F463 L464	E404-M455 HydrophobicContact CG-CB 4.22Å; E404-M455 WeakPolarHBondContact OE1-CB 3.31Å; F406-M455 HydrophobicContact CB-CB 3.79Å; F406-M455 HydrophobicContact CB-CE 3.54Å; F406-M455 HydrophobicContact CB-CG 3.55Å; F406-M455 HydrophobicContact CB-SD 4.36Å; F406-M455 HydrophobicContact CD1-CB 4.25Å; F406-M455 HydrophobicContact CD1-CG 4.21Å; F406-M455 HydrophobicContact CD2-CG 3.86Å; F406-M455 HydrophobicContact CG-CB 4.05Å; F406-M455 HydrophobicContact CG-CE 4.42Å; F406-M455 HydrophobicContact CG-CG 3.63Å; M455-V462 HydrophobicContact SD-CG1 4.13Å; M455-F463 WeakPolarHBondContact CG-O 3.48Å; M455-L464 HydrophobicContact CB-CD2 3.66Å; M455-L464 HydrophobicContact CG-CD2 3.83Å
456	F	97.1	Very high	93.5	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.013	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	159.1	171.6	63.5	-87.9	0	0	0	113.6	I458 F463 V465 I486 F512 L521 F547	F456-I458 HydrophobicContact CD2-CD1 4.35Å; F456-I458 HydrophobicContact CD2-CG1 4.26Å; F456-I458 HydrophobicContact CE2-CD1 4.19Å; F456-F463 HydrophobicContact CD1-CB 4.24Å; F456-F463 HydrophobicContact CD2-CB 3.9Å; F456-F463 AromaticContact CD2-CD2 3.89Å; F456-F463 HydrophobicContact CD2-CD2 3.89Å; F456-F463 HydrophobicContact CD2-CG 4.21Å; F456-F463 HydrophobicContact CE1-CB 3.81Å; F456-F463 HydrophobicContact CE2-CB 3.43Å; F456-F463 VanDerWaalsContact CE2-CB 3.43Å; F456-F463 HydrophobicContact CE2-CD1 4.45Å; F456-F463 AromaticContact CE2-CD2 3.53Å; F456-F463 HydrophobicContact CE2-CD2 3.53Å; F456-F463 HydrophobicContact CE2-CE2 4.39Å; F456-F463 AromaticContact CE2-CG 3.57Å; F456-F463 HydrophobicContact CE2-CG 3.57Å; F456-F463 HydrophobicContact CG-CB 4.28Å; F456-F463 HydrophobicContact CZ-CB 3.38Å; F456-F463 HydrophobicContact CZ-CD2 4.31Å; F456-F463 AromaticContact CZ-CG 3.88Å; F456-F463 HydrophobicContact CZ-CG 3.88Å; F456-F463 PolarHBondContact N-O 3.08Å; F456-F463 VanDerWaalsContact N-O 3.12Å; F456-F463 PolarHBondContact O-N 2.9Å; F456-V465 HydrophobicContact CD1-CG1 4.37Å; F456-V465 HydrophobicContact CE1-CB 4.08Å; F456-V465 HydrophobicContact CE1-CG1 3.95Å; F456-I486 HydrophobicContact CE1-CG2 4.38Å; F456-I486 HydrophobicContact CZ-CG2 3.82Å; F456-F512 HydrophobicContact CB-CB 3.76Å; F456-F512 HydrophobicContact CB-CD1 3.47Å; F456-F512 VanDerWaalsContact CB-CD1 3.47Å; F456-F512 HydrophobicContact CB-CD2 3.43Å; F456-F512 VanDerWaalsContact CB-CD2 3.43Å; F456-F512 HydrophobicContact CB-CE1 3.8Å; F456-F512 HydrophobicContact CB-CE2 3.76Å; F456-F512 HydrophobicContact CB-CG 3.25Å; F456-F512 HydrophobicContact CB-CZ 3.92Å; F456-F512 HydrophobicContact CD1-CB 4.45Å; F456-F512 HydrophobicContact CD1-CD2 4.19Å; F456-F512 HydrophobicContact CD1-CG 4.46Å; F456-F512 AromaticContact CD2-CD2 3.7Å; F456-F512 HydrophobicContact CD2-CD2 3.7Å; F456-F512 AromaticContact CD2-CE2 3.55Å; F456-F512 HydrophobicContact CD2-CE2 3.55Å; F456-F512 HydrophobicContact CD2-CG 4.42Å; F456-F512 HydrophobicContact CD2-CZ 4.18Å; F456-F512 HydrophobicContact CE2-CE2 4.38Å; F456-F512 HydrophobicContact CG-CB 4.28Å; F456-F512 HydrophobicContact CG-CD1 4.45Å; F456-F512 AromaticContact CG-CD2 3.5Å; F456-F512 HydrophobicContact CG-CD2 3.5Å; F456-F512 AromaticContact CG-CE2 3.82Å; F456-F512 HydrophobicContact CG-CE2 3.82Å; F456-F512 AromaticContact CG-CG 3.83Å; F456-F512 HydrophobicContact CG-CG 3.83Å; F456-F512 HydrophobicContact CG-CZ 4.4Å; F456-L521 HydrophobicContact CD1-CD2 4.11Å; F456-L521 HydrophobicContact CE1-CD1 3.87Å; F456-L521 HydrophobicContact CE1-CD2 4.12Å; F456-L521 HydrophobicContact CE1-CG 4.48Å; F456-L521 HydrophobicContact CZ-CD1 3.89Å; F456-F547 HydrophobicContact CD2-CZ 4.37Å; F456-F547 AromaticContact CE2-CE2 3.52Å; F456-F547 HydrophobicContact CE2-CE2 3.52Å; F456-F547 AromaticContact CE2-CZ 3.72Å; F456-F547 HydrophobicContact CE2-CZ 3.72Å; F456-F547 AromaticContact CZ-CE2 3.58Å; F456-F547 HydrophobicContact CZ-CE2 3.58Å; F456-F547 HydrophobicContact CZ-CZ 4.05Å
457	Q	87.7	Confident	93.5	Very high	91 Å²	91	20.1 Å²	20.1	43%	0.425	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.2	-178.3	-170.7	175.9	-22	0	0	111.1	G459 R461 V462	Q457-G459 WeakPolarHBondContact CG-O 2.95Å; Q457-G459 PolarHBondContact NE2-O 3.07Å; Q457-R461 WeakPolarHBondContact CA-O 3.1Å; Q457-R461 VanDerWaalsContact CG-O 3.28Å; Q457-R461 WeakPolarHBondContact CG-O 3.44Å; Q457-V462 HydrophobicContact CG-CG2 4.29Å
458	I	81.4	Confident	93.5	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	105.3	174.6	-59.9	177.8	0	0	0	108.5	F456 S460 R461 F463 F512 Y519 W541 F547	F456-I458 HydrophobicContact CD2-CD1 4.35Å; F456-I458 HydrophobicContact CD2-CG1 4.26Å; F456-I458 HydrophobicContact CE2-CD1 4.19Å; I458-S460 PolarHBondContact O-N 3.02Å; I458-R461 PolarHBondContact N-O 3.08Å; I458-R461 PolarHBondContact O-N 2.73Å; I458-R461 VanDerWaalsContact O-N 3.14Å; I458-F463 HydrophobicContact CB-CE2 4.13Å; I458-F463 HydrophobicContact CD1-CE2 4.49Å; I458-F463 HydrophobicContact CG1-CE2 4.38Å; I458-F512 HydrophobicContact CD1-CE2 4.45Å; I458-F512 HydrophobicContact CG1-CE2 4.31Å; I458-F512 HydrophobicContact CG1-CZ 4.24Å; I458-Y519 HydrophobicContact CD1-CD2 4.33Å; I458-Y519 HydrophobicContact CD1-CG 4.15Å; I458-Y519 HydrophobicContact CG1-CD1 4.2Å; I458-Y519 HydrophobicContact CG1-CD2 4.22Å; I458-Y519 HydrophobicContact CG1-CG 3.97Å; I458-Y519 HydrophobicContact CG2-CD2 3.75Å; I458-Y519 HydrophobicContact CG2-CE2 3.62Å; I458-Y519 HydrophobicContact CG2-CG 4.35Å; I458-W541 HydrophobicContact CD1-CB 4.19Å; I458-W541 HydrophobicContact CD1-CD2 3.42Å; I458-W541 VanDerWaalsContact CD1-CD2 3.42Å; I458-W541 HydrophobicContact CD1-CE3 3.64Å; I458-W541 HydrophobicContact CD1-CG 3.68Å; I458-W541 HydrophobicContact CD1-CH2 4.43Å; I458-W541 HydrophobicContact CD1-CZ2 4.27Å; I458-W541 HydrophobicContact CD1-CZ3 4.14Å; I458-F547 HydrophobicContact CD1-CE2 4.32Å; I458-F547 HydrophobicContact CD1-CZ 3.94Å
459	G	78.3	Confident	93.5	Very high	39 Å²	39	18.1 Å²	18.1	40%	0.402	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-120	-170.6	0	0	0	0	0	110.8	Q457	Q457-G459 WeakPolarHBondContact CG-O 2.95Å; Q457-G459 PolarHBondContact NE2-O 3.07Å
460	S	74.1	Confident	93.3	Very high	93 Å²	93	19.8 Å²	19.8	65%	0.65	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	0.5	176.6	61.9	0	0	0	0	114.3	I458	I458-S460 PolarHBondContact O-N 3.02Å
461	R	82.3	Confident	93	Very high	30 Å²	30	24.8 Å²	24.8	11%	0.113	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128	-175.8	-60.4	172.9	68.5	-165.3	-4.1	109.4	Q457 I458 F463 E488	Q457-R461 WeakPolarHBondContact CA-O 3.1Å; Q457-R461 VanDerWaalsContact CG-O 3.28Å; Q457-R461 WeakPolarHBondContact CG-O 3.44Å; I458-R461 PolarHBondContact N-O 3.08Å; I458-R461 PolarHBondContact O-N 2.73Å; I458-R461 VanDerWaalsContact O-N 3.14Å; R461-F463 HydrophobicContact CB-CD2 4.41Å; R461-F463 HydrophobicContact CB-CE2 3.42Å; R461-F463 VanDerWaalsContact CB-CE2 3.42Å; R461-F463 HydrophobicContact CB-CZ 3.59Å; R461-F463 WeakPolarHBondContact O-CE2 3.44Å; R461-E488 IonicContact CZ-OE1 2.9Å; R461-E488 IonicContact CZ-OE2 3.93Å; R461-E488 IonicContact NE-OE1 3.41Å; R461-E488 PolarHBondContact NE-OE1 2.9Å; R461-E488 IonicContact NE-OE2 3.98Å; R461-E488 VanDerWaalsContact NH2-CD 3.27Å; R461-E488 IonicContact NH2-OE1 2.75Å; R461-E488 PolarHBondContact NH2-OE1 3.27Å; R461-E488 IonicContact NH2-OE2 3.34Å; R461-E488 PolarHBondContact NH2-OE2 2.81Å
462	V	88.2	Confident	92.6	Very high	8 Å²	8	26.7 Å²	26.7	5%	0.048	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.7	-177	179	0	0	0	0	109	V408 M455 Q457 E488 L489 F496	V408-V462 HydrophobicContact CG1-CG2 4.25Å; V408-V462 HydrophobicContact CG2-CG1 3.92Å; V408-V462 HydrophobicContact CG2-CG2 4.31Å; M455-V462 HydrophobicContact SD-CG1 4.13Å; Q457-V462 HydrophobicContact CG-CG2 4.29Å; V462-E488 WeakPolarHBondContact O-CA 3.45Å; V462-L489 HydrophobicContact CB-CB 4.13Å; V462-L489 HydrophobicContact CB-CD2 4.42Å; V462-L489 PolarHBondContact O-N 2.94Å; V462-F496 HydrophobicContact CG1-CE1 4.39Å; V462-F496 HydrophobicContact CG1-CZ 4.46Å
463	F	96.9	Very high	91.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.5	-176.7	-55.9	-90.6	0	0	0	111.6	M455 F456 I458 R461 I486 Y487 E488 F499 W541	M455-F463 WeakPolarHBondContact CG-O 3.48Å; F456-F463 HydrophobicContact CD1-CB 4.24Å; F456-F463 HydrophobicContact CD2-CB 3.9Å; F456-F463 AromaticContact CD2-CD2 3.89Å; F456-F463 HydrophobicContact CD2-CD2 3.89Å; F456-F463 HydrophobicContact CD2-CG 4.21Å; F456-F463 HydrophobicContact CE1-CB 3.81Å; F456-F463 HydrophobicContact CE2-CB 3.43Å; F456-F463 VanDerWaalsContact CE2-CB 3.43Å; F456-F463 HydrophobicContact CE2-CD1 4.45Å; F456-F463 AromaticContact CE2-CD2 3.53Å; F456-F463 HydrophobicContact CE2-CD2 3.53Å; F456-F463 HydrophobicContact CE2-CE2 4.39Å; F456-F463 AromaticContact CE2-CG 3.57Å; F456-F463 HydrophobicContact CE2-CG 3.57Å; F456-F463 HydrophobicContact CG-CB 4.28Å; F456-F463 HydrophobicContact CZ-CB 3.38Å; F456-F463 HydrophobicContact CZ-CD2 4.31Å; F456-F463 AromaticContact CZ-CG 3.88Å; F456-F463 HydrophobicContact CZ-CG 3.88Å; F456-F463 PolarHBondContact N-O 3.08Å; F456-F463 VanDerWaalsContact N-O 3.12Å; F456-F463 PolarHBondContact O-N 2.9Å; I458-F463 HydrophobicContact CB-CE2 4.13Å; I458-F463 HydrophobicContact CD1-CE2 4.49Å; I458-F463 HydrophobicContact CG1-CE2 4.38Å; R461-F463 HydrophobicContact CB-CD2 4.41Å; R461-F463 HydrophobicContact CB-CE2 3.42Å; R461-F463 VanDerWaalsContact CB-CE2 3.42Å; R461-F463 HydrophobicContact CB-CZ 3.59Å; R461-F463 WeakPolarHBondContact O-CE2 3.44Å; F463-I486 HydrophobicContact CB-CG2 4.23Å; F463-I486 HydrophobicContact CD1-CG2 4.05Å; F463-Y487 CarbonylContact C-O 3.11Å; F463-Y487 WeakPolarHBondContact CA-O 2.99Å; F463-Y487 WeakPolarHBondContact CB-O 3.41Å; F463-E488 HydrophobicContact CD1-CB 3.71Å; F463-E488 HydrophobicContact CD1-CG 4.04Å; F463-E488 HydrophobicContact CE1-CB 3.68Å; F463-E488 HydrophobicContact CE1-CG 3.71Å; F463-E488 HydrophobicContact CZ-CG 4.32Å; F463-F499 HydrophobicContact CD1-CD1 4.45Å; F463-F499 HydrophobicContact CD1-CG 4.47Å; F463-F499 HydrophobicContact CE1-CD1 4.15Å; F463-F499 HydrophobicContact CE1-CD2 4.29Å; F463-F499 HydrophobicContact CE1-CE1 4.4Å; F463-F499 HydrophobicContact CE1-CG 4.11Å; F463-W541 HydrophobicContact CE1-CH2 4.49Å; F463-W541 HydrophobicContact CZ-CH2 4Å
464	L	98.4	Very high	90.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.8	166.4	-73.5	172.1	0	0	0	108.1	F406 I431 W453 E454 M455 I486 Y487 F496	F406-L464 HydrophobicContact CD1-CD2 4.08Å; F406-L464 HydrophobicContact CE1-CD1 4.03Å; F406-L464 HydrophobicContact CE1-CD2 3.79Å; F406-L464 HydrophobicContact CE1-CG 4.45Å; F406-L464 HydrophobicContact CZ-CD1 3.8Å; F406-L464 HydrophobicContact CZ-CD2 4.14Å; F406-L464 HydrophobicContact CZ-CG 4.34Å; I431-L464 HydrophobicContact CD1-CD1 3.87Å; W453-L464 HydrophobicContact CE3-CB 3.99Å; W453-L464 HydrophobicContact CZ3-CB 3.93Å; E454-L464 CarbonylContact O-C 3.51Å; E454-L464 WeakPolarHBondContact O-CA 3.45Å; M455-L464 HydrophobicContact CB-CD2 3.66Å; M455-L464 HydrophobicContact CG-CD2 3.83Å; L464-I486 CarbonylContact O-C 3.47Å; L464-I486 WeakPolarHBondContact O-CA 3.46Å; L464-Y487 PolarHBondContact N-O 3.25Å; L464-Y487 PolarHBondContact O-N 2.91Å; L464-F496 HydrophobicContact CB-CD1 4.4Å; L464-F496 HydrophobicContact CB-CE1 4.28Å; L464-F496 HydrophobicContact CD1-CD1 3.9Å; L464-F496 HydrophobicContact CD1-CD2 4.02Å; L464-F496 HydrophobicContact CD1-CE1 3.61Å; L464-F496 HydrophobicContact CD1-CE2 3.74Å; L464-F496 HydrophobicContact CD1-CG 4.08Å; L464-F496 HydrophobicContact CD1-CZ 3.52Å; L464-F496 HydrophobicContact CG-CD1 4.16Å; L464-F496 HydrophobicContact CG-CE1 3.65Å; L464-F496 HydrophobicContact CG-CZ 3.89Å
465	V	98.8	Very high	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.5	168.5	60.8	0	0	0	0	109.6	W453 E454 F456 T485 I486 W510 L521	W453-V465 WeakPolarHBondContact CA-O 3.41Å; E454-V465 HydrophobicContact CB-CG1 3.72Å; E454-V465 HydrophobicContact CG-CG1 4.29Å; E454-V465 PolarHBondContact N-O 3.49Å; E454-V465 PolarHBondContact O-N 3.48Å; F456-V465 HydrophobicContact CD1-CG1 4.37Å; F456-V465 HydrophobicContact CE1-CB 4.08Å; F456-V465 HydrophobicContact CE1-CG1 3.95Å; V465-T485 WeakPolarHBondContact CA-O 3.18Å; V465-I486 HydrophobicContact CB-CG1 4.04Å; V465-I486 HydrophobicContact CG2-CG1 3.78Å; V465-W510 HydrophobicContact CG1-CB 3.69Å; V465-W510 HydrophobicContact CG1-CD2 4.36Å; V465-W510 HydrophobicContact CG1-CG 3.82Å; V465-W510 HydrophobicContact CG2-CD2 3.92Å; V465-W510 HydrophobicContact CG2-CG 3.88Å; V465-W510 HydrophobicContact CG2-CZ2 4.41Å; V465-L521 HydrophobicContact CG1-CD2 4.37Å
466	V	98.8	Very high	88.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.6	171.7	62.7	0	0	0	0	110.8	T447 A450 D452 W453 N468 S484 T485 Y487	T447-V466 HydrophobicContact CG2-CG1 4.38Å; T447-V466 HydrophobicContact CG2-CG2 3.95Å; A450-V466 HydrophobicContact CB-CG2 3.86Å; D452-V466 WeakPolarHBondContact O-CA 3.22Å; W453-V466 HydrophobicContact CD2-CB 3.88Å; W453-V466 HydrophobicContact CD2-CG2 4.05Å; W453-V466 HydrophobicContact CE3-CB 3.68Å; W453-V466 HydrophobicContact CE3-CG2 4.38Å; W453-V466 HydrophobicContact CH2-CB 3.62Å; W453-V466 HydrophobicContact CH2-CG1 4.06Å; W453-V466 HydrophobicContact CH2-CG2 4.21Å; W453-V466 HydrophobicContact CZ2-CB 3.78Å; W453-V466 HydrophobicContact CZ2-CG1 4.46Å; W453-V466 HydrophobicContact CZ2-CG2 3.84Å; W453-V466 HydrophobicContact CZ3-CB 3.57Å; W453-V466 HydrophobicContact CZ3-CG1 4.24Å; W453-V466 HydrophobicContact CZ3-CG2 4.46Å; V466-N468 PolarHBondContact O-N 3.28Å; V466-S484 WeakPolarHBondContact O-CA 3.31Å; V466-S484 WeakPolarHBondContact O-CB 3.25Å; V466-S484 PolarHBondContact O-OG 3.26Å; V466-T485 PolarHBondContact N-O 3.02Å; V466-T485 PolarHBondContact O-N 3.29Å; V466-Y487 HydrophobicContact CG1-CE2 3.99Å
467	A	98.6	Very high	87.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	111.5	162.9	0	0	0	0	0	109.4	A450 T451 D452 A507	A450-A467 WeakPolarHBondContact CA-O 3.25Å; T451-A467 PolarHBondContact N-O 2.95Å; T451-A467 VanDerWaalsContact OG1-CB 3.29Å; T451-A467 WeakPolarHBondContact OG1-CB 3.41Å; T451-A467 PolarHBondContact OG1-O 3.45Å; T451-A467 VanDerWaalsContact OG1-O 3.07Å; D452-A467 HydrophobicContact CB-CB 3.84Å; D452-A467 PolarHBondContact O-N 3.3Å; A467-A507 HydrophobicContact CB-CB 3.82Å
468	N	98.4	Very high	88	Confident	3 Å²	3	43 Å²	43	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.6	170.8	-74.1	-51.6	0	0	0	109.5	F448 V466 I482 N483 S484	F448-N468 HydrophobicContact CB-CB 4.43Å; F448-N468 PolarHBondContact N-OD1 2.96Å; F448-N468 WeakPolarHBondContact O-CA 3.43Å; F448-N468 PolarHBondContact O-OD1 2.83Å; V466-N468 PolarHBondContact O-N 3.28Å; N468-I482 HydrophobicContact CB-CG1 4.42Å; N468-I482 HydrophobicContact CB-CG2 4.01Å; N468-I482 VanDerWaalsContact O-CG2 3.22Å; N468-I482 WeakPolarHBondContact O-CG2 3.49Å; N468-N483 PolarHBondContact ND2-O 3.06Å; N468-S484 PolarHBondContact N-OG 3.3Å
469	G	95.9	Very high	88.5	Confident	1 Å²	1	47 Å²	47	1%	0.01	29%	0.288	C	S	.	.			trans	-77.2	-60.6	-178	0	0	0	0	0	113.1	F448 C449 S506	F448-G469 PolarHBondContact O-N 2.79Å; C449-G469 PolarHBondContact O-N 3.39Å; G469-S506 WeakPolarHBondContact O-CA 3.46Å; G469-S506 WeakPolarHBondContact O-CB 3.25Å
470	H	94.2	Very high	89.3	Confident	39 Å²	39	48.1 Å²	48.1	18%	0.181	28%	0.28	C	S	.	.			trans	-164.8	159.6	-177.7	63.9	-74.6	0	0	0	112.4	T425 F448 C449 Q479 Y480	T425-H470 WeakPolarHBondContact CB-O 3.45Å; T425-H470 PolarHBondContact OG1-O 3.18Å; F448-H470 CarbonylContact C-O 3.1Å; C449-H470 VanDerWaalsContact CB-O 3.22Å; C449-H470 WeakPolarHBondContact CB-O 3.5Å; C449-H470 PolarHBondContact SG-CE1 3.15Å; C449-H470 PolarHBondContact SG-ND1 2.85Å; H470-Q479 CarbonylContact C-O 3.54Å; H470-Q479 VanDerWaalsContact CA-O 3.23Å; H470-Q479 WeakPolarHBondContact CA-O 3.49Å; H470-Q479 VanDerWaalsContact CB-O 3.3Å; H470-Q479 WeakPolarHBondContact CB-O 2.98Å; H470-Y480 HydrophobicContact CB-CD1 3.58Å; H470-Y480 HydrophobicContact CB-CE1 3.81Å; H470-Y480 HydrophobicContact CB-CG 4.32Å; H470-Y480 AromaticContact CG-CE1 3.94Å
471	R	92.2	Very high	90.4	Very high	106 Å²	106	47 Å²	47	40%	0.4	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-110.9	114.4	173.5	-171.5	174.7	179.6	-179.3	0.4	110.4	T425 F448 S478 Q479 I482	T425-R471 WeakPolarHBondContact OG1-CA 3.41Å; F448-R471 HydrophobicContact CD1-CG 4.17Å; R471-S478 WeakPolarHBondContact O-CA 3.16Å; R471-Q479 HydrophobicContact CB-CB 4.33Å; R471-Q479 PolarHBondContact N-O 3.38Å; R471-Q479 PolarHBondContact O-N 2.94Å; R471-I482 HydrophobicContact CB-CD1 4.08Å
472	L	89.6	Confident	91	Very high	54 Å²	54	46.4 Å²	46.4	28%	0.283	27%	0.269	S	S	.	.			trans	-68.1	131.8	167.6	-63.8	-179.8	0	0	0	109.3	F420 T425 S478	F420-L472 HydrophobicContact CD2-CD1 4.18Å; F420-L472 HydrophobicContact CE2-CD1 3.78Å; T425-L472 HydrophobicContact CG2-CD1 3.73Å; T425-L472 HydrophobicContact CG2-CG 3.67Å; T425-L472 PolarHBondContact OG1-N 2.88Å; L472-S478 VanDerWaalsContact CD2-OG 3.25Å; L472-S478 WeakPolarHBondContact CD2-OG 3.4Å
473	Q	76.8	Confident	91.3	Very high	79 Å²	79	48.7 Å²	48.7	37%	0.369	28%	0.28	S	S	.	.			trans	-113.2	110.5	169.8	-72.6	-173.3	57.1	0	0	107.9	N475 G476 Q479	Q473-N475 PolarHBondContact O-N 3.46Å; Q473-N475 VanDerWaalsContact O-N 3.16Å; Q473-G476 CarbonylContact O-C 3.56Å; Q473-G476 PolarHBondContact O-N 3.39Å; Q473-Q479 VanDerWaalsContact NE2-CG 3.34Å
474	G	74.9	Confident	91.4	Very high	83 Å²	83	48.7 Å²	48.7	86%	0.856	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-8.4	-89.6	-177.8	0	0	0	0	0	116.1
475	N	76.9	Confident	91.3	Very high	183 Å²	183	48.8 Å²	48.8	98%	0.979	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	5.2	178.7	-66.2	-1.5	0	0	0	114	Q473	Q473-N475 PolarHBondContact O-N 3.46Å; Q473-N475 VanDerWaalsContact O-N 3.16Å
476	G	78.9	Confident	91.3	Very high	35 Å²	35	48.9 Å²	48.9	36%	0.361	28%	0.282	S	S	.	.	S	Bend	trans	-102.3	172.6	-177.4	0	0	0	0	0	112.9	Q473	Q473-G476 CarbonylContact O-C 3.56Å; Q473-G476 PolarHBondContact O-N 3.39Å
477	P	84.1	Confident	91.1	Very high	111 Å²	111	49.6 Å²	49.6	72%	0.721	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-66.5	139.1	173.7	28.4	-33.5	0	0	0	111
478	S	89.8	Confident	90.8	Very high	35 Å²	35	50.3 Å²	50.3	25%	0.245	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-62.1	142.8	173.4	-54	0	0	0	0	111.4	R471 L472 Y480	R471-S478 WeakPolarHBondContact O-CA 3.16Å; L472-S478 VanDerWaalsContact CD2-OG 3.25Å; L472-S478 WeakPolarHBondContact CD2-OG 3.4Å; S478-Y480 WeakPolarHBondContact O-CD2 3.29Å
479	Q	93.4	Very high	90.3	Very high	87 Å²	87	50.8 Å²	50.8	41%	0.407	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-93.2	117.2	173.5	-75.8	171.4	-9.9	0	0	110.2	H470 R471 Q473	H470-Q479 CarbonylContact C-O 3.54Å; H470-Q479 VanDerWaalsContact CA-O 3.23Å; H470-Q479 WeakPolarHBondContact CA-O 3.49Å; H470-Q479 VanDerWaalsContact CB-O 3.3Å; H470-Q479 WeakPolarHBondContact CB-O 2.98Å; R471-Q479 HydrophobicContact CB-CB 4.33Å; R471-Q479 PolarHBondContact N-O 3.38Å; R471-Q479 PolarHBondContact O-N 2.94Å; Q473-Q479 VanDerWaalsContact NE2-CG 3.34Å
480	Y	94.9	Very high	89.6	Confident	63 Å²	63	51.9 Å²	51.9	25%	0.247	30%	0.296	C	S	.	.			trans	-103.3	-17.5	177.4	-61.5	-83.8	0	0	0	113.2	H470 S478 Y505 S506 Y527	H470-Y480 HydrophobicContact CB-CD1 3.58Å; H470-Y480 HydrophobicContact CB-CE1 3.81Å; H470-Y480 HydrophobicContact CB-CG 4.32Å; H470-Y480 AromaticContact CG-CE1 3.94Å; S478-Y480 WeakPolarHBondContact O-CD2 3.29Å; Y480-Y505 CarbonylContact O-C 3.51Å; Y480-Y505 WeakPolarHBondContact O-CA 2.98Å; Y480-S506 PolarHBondContact O-N 3.3Å; Y480-Y527 AromaticContact CD1-CD1 3.68Å; Y480-Y527 HydrophobicContact CD1-CD1 3.68Å; Y480-Y527 HydrophobicContact CD1-CE1 4.17Å; Y480-Y527 HydrophobicContact CD2-CD1 4.25Å; Y480-Y527 HydrophobicContact CD2-CE1 4.02Å; Y480-Y527 AromaticContact CE1-CD1 3.89Å; Y480-Y527 HydrophobicContact CE1-CD1 3.89Å; Y480-Y527 HydrophobicContact CE1-CE1 4.1Å; Y480-Y527 HydrophobicContact CE2-CD1 4.42Å; Y480-Y527 AromaticContact CE2-CE1 3.94Å; Y480-Y527 HydrophobicContact CE2-CE1 3.94Å; Y480-Y527 AromaticContact CG-CD1 3.88Å; Y480-Y527 HydrophobicContact CG-CD1 3.88Å; Y480-Y527 HydrophobicContact CG-CE1 4.13Å; Y480-Y527 AromaticContact CZ-CE1 3.98Å
481	T	95.7	Very high	88.7	Confident	70 Å²	70	56 Å²	56	43%	0.429	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	107.3	166.6	-55.8	0	0	0	0	107.9	V503 T504 Y505	T481-V503 HydrophobicContact CG2-CG1 3.75Å; T481-T504 WeakPolarHBondContact CA-O 3.35Å; T481-Y505 HydrophobicContact CG2-CD1 4Å; T481-Y505 HydrophobicContact CG2-CE1 3.59Å; T481-Y505 VanDerWaalsContact OG1-CD1 3.29Å; T481-Y505 WeakPolarHBondContact OG1-CD1 3.45Å; T481-Y505 VanDerWaalsContact OG1-CE1 3.3Å; T481-Y505 WeakPolarHBondContact OG1-CE1 3.25Å
482	I	94.4	Very high	87.8	Confident	18 Å²	18	53.9 Å²	53.9	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	152.3	-173.4	-170.7	160.7	0	0	0	110.6	F448 N468 R471 S484 T504	F448-I482 HydrophobicContact CB-CD1 3.42Å; F448-I482 VanDerWaalsContact CB-CD1 3.42Å; F448-I482 HydrophobicContact CD2-CD1 3.79Å; F448-I482 HydrophobicContact CG-CD1 3.68Å; N468-I482 HydrophobicContact CB-CG1 4.42Å; N468-I482 HydrophobicContact CB-CG2 4.01Å; N468-I482 VanDerWaalsContact O-CG2 3.22Å; N468-I482 WeakPolarHBondContact O-CG2 3.49Å; R471-I482 HydrophobicContact CB-CD1 4.08Å; I482-S484 PolarHBondContact O-N 3.11Å; I482-T504 PolarHBondContact N-O 2.8Å; I482-T504 CarbonylContact O-C 3.52Å; I482-T504 WeakPolarHBondContact O-CA 3.31Å; I482-T504 PolarHBondContact O-N 3.45Å; I482-T504 PolarHBondContact O-OG1 2.93Å
483	N	95.9	Very high	87	Confident	55 Å²	55	53.2 Å²	53.2	29%	0.294	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123	178.2	-68	-4.2	0	0	0	110.5	N468 D501 I502 V503	N468-N483 PolarHBondContact ND2-O 3.06Å; N483-D501 HydrophobicContact CB-CB 4.3Å; N483-D501 PolarHBondContact ND2-OD2 2.91Å; N483-I502 CarbonylContact C-O 3.55Å; N483-I502 VanDerWaalsContact CA-O 3.29Å; N483-I502 WeakPolarHBondContact CA-O 3.28Å; N483-V503 WeakPolarHBondContact OD1-CG2 3.38Å
484	S	98.3	Very high	87.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	149.8	149.9	-69.4	0	0	0	0	108.7	V466 N468 I482 I502 T504 A507 W510	V466-S484 WeakPolarHBondContact O-CA 3.31Å; V466-S484 WeakPolarHBondContact O-CB 3.25Å; V466-S484 PolarHBondContact O-OG 3.26Å; N468-S484 PolarHBondContact N-OG 3.3Å; I482-S484 PolarHBondContact O-N 3.11Å; S484-I502 PolarHBondContact N-O 2.89Å; S484-I502 PolarHBondContact O-N 2.88Å; S484-T504 PolarHBondContact N-OG1 3.26Å; S484-T504 WeakPolarHBondContact OG-CG2 3.39Å; S484-T504 PolarHBondContact OG-OG1 3.19Å; S484-A507 WeakPolarHBondContact OG-CB 3.38Å; S484-W510 PolarHBondContact OG-NE1 3.49Å
485	T	97.6	Very high	88	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	129	-172.7	-56.1	0	0	0	0	110.7	V465 V466 Y487 R498	V465-T485 WeakPolarHBondContact CA-O 3.18Å; V466-T485 PolarHBondContact N-O 3.02Å; V466-T485 PolarHBondContact O-N 3.29Å; T485-Y487 HydrophobicContact CG2-CD1 4.47Å; T485-Y487 HydrophobicContact CG2-CD2 4.09Å; T485-Y487 HydrophobicContact CG2-CE1 3.95Å; T485-Y487 HydrophobicContact CG2-CE2 3.53Å; T485-Y487 VanDerWaalsContact CG2-CZ 3.43Å; T485-R498 HydrophobicContact CG2-CG 3.66Å; T485-R498 VanDerWaalsContact CG2-CZ 3.47Å; T485-R498 PolarHBondContact OG1-NH1 2.74Å; T485-R498 PolarHBondContact OG1-NH2 3.03Å
486	I	97.8	Very high	88.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	131.3	169.5	-52.6	179.3	0	0	0	108.1	F456 F463 L464 V465 F499 Q500 I502 L521 F547	F456-I486 HydrophobicContact CE1-CG2 4.38Å; F456-I486 HydrophobicContact CZ-CG2 3.82Å; F463-I486 HydrophobicContact CB-CG2 4.23Å; F463-I486 HydrophobicContact CD1-CG2 4.05Å; L464-I486 CarbonylContact O-C 3.47Å; L464-I486 WeakPolarHBondContact O-CA 3.46Å; V465-I486 HydrophobicContact CB-CG1 4.04Å; V465-I486 HydrophobicContact CG2-CG1 3.78Å; I486-F499 HydrophobicContact CB-CD1 4.4Å; I486-F499 HydrophobicContact CG2-CB 4.42Å; I486-F499 HydrophobicContact CG2-CD1 4.03Å; I486-F499 WeakPolarHBondContact O-CA 3.43Å; I486-F499 WeakPolarHBondContact O-CB 3.47Å; I486-F499 PolarHBondContact O-N 3.12Å; I486-Q500 HydrophobicContact CB-CB 4.23Å; I486-Q500 HydrophobicContact CD1-CB 4.31Å; I486-Q500 PolarHBondContact N-O 2.79Å; I486-Q500 PolarHBondContact O-N 3.2Å; I486-Q500 VanDerWaalsContact O-N 3.1Å; I486-I502 HydrophobicContact CD1-CD1 3.89Å; I486-L521 HydrophobicContact CD1-CD1 3.92Å; I486-F547 HydrophobicContact CD1-CD2 3.54Å; I486-F547 HydrophobicContact CD1-CE2 4.13Å; I486-F547 HydrophobicContact CD1-CG 4.34Å
487	Y	95.3	Very high	89	Confident	16 Å²	16	50.9 Å²	50.9	6%	0.063	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.6	173.6	-58.8	-93.7	0	0	0	109.6	I445 W453 F463 L464 V466 T485 V497 R498	I445-Y487 HydrophobicContact CD1-CD1 4.17Å; I445-Y487 HydrophobicContact CD1-CD2 4.43Å; I445-Y487 HydrophobicContact CD1-CE1 4.25Å; I445-Y487 HydrophobicContact CD1-CE2 4.48Å; I445-Y487 HydrophobicContact CD1-CG 4.28Å; I445-Y487 HydrophobicContact CG2-CE1 3.88Å; I445-Y487 HydrophobicContact CG2-CE2 4.02Å; I445-Y487 VanDerWaalsContact CG2-CZ 3.44Å; I445-Y487 VanDerWaalsContact CG2-OH 3.22Å; I445-Y487 WeakPolarHBondContact CG2-OH 3.18Å; W453-Y487 HydrophobicContact CH2-CD2 4.04Å; W453-Y487 AromaticContact CH2-CE2 3.81Å; W453-Y487 HydrophobicContact CH2-CE2 3.81Å; W453-Y487 AromaticContact CZ3-CD2 3.87Å; W453-Y487 HydrophobicContact CZ3-CD2 3.87Å; W453-Y487 HydrophobicContact CZ3-CE2 4.05Å; F463-Y487 CarbonylContact C-O 3.11Å; F463-Y487 WeakPolarHBondContact CA-O 2.99Å; F463-Y487 WeakPolarHBondContact CB-O 3.41Å; L464-Y487 PolarHBondContact N-O 3.25Å; L464-Y487 PolarHBondContact O-N 2.91Å; V466-Y487 HydrophobicContact CG1-CE2 3.99Å; T485-Y487 HydrophobicContact CG2-CD1 4.47Å; T485-Y487 HydrophobicContact CG2-CD2 4.09Å; T485-Y487 HydrophobicContact CG2-CE1 3.95Å; T485-Y487 HydrophobicContact CG2-CE2 3.53Å; T485-Y487 VanDerWaalsContact CG2-CZ 3.43Å; Y487-V497 CarbonylContact C-O 3.52Å; Y487-V497 WeakPolarHBondContact CA-O 3.36Å; Y487-R498 HydrophobicContact CD1-CB 4.32Å; Y487-R498 HydrophobicContact CE1-CB 4.24Å
488	E	92.8	Very high	89.2	Confident	15 Å²	15	51.5 Å²	51.5	7%	0.07	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.5	173	-179.9	171.8	-166.6	0	0	109.8	R461 V462 F463 D490 F496 V497 F499	R461-E488 IonicContact CZ-OE1 2.9Å; R461-E488 IonicContact CZ-OE2 3.93Å; R461-E488 IonicContact NE-OE1 3.41Å; R461-E488 PolarHBondContact NE-OE1 2.9Å; R461-E488 IonicContact NE-OE2 3.98Å; R461-E488 VanDerWaalsContact NH2-CD 3.27Å; R461-E488 IonicContact NH2-OE1 2.75Å; R461-E488 PolarHBondContact NH2-OE1 3.27Å; R461-E488 IonicContact NH2-OE2 3.34Å; R461-E488 PolarHBondContact NH2-OE2 2.81Å; V462-E488 WeakPolarHBondContact O-CA 3.45Å; F463-E488 HydrophobicContact CD1-CB 3.71Å; F463-E488 HydrophobicContact CD1-CG 4.04Å; F463-E488 HydrophobicContact CE1-CB 3.68Å; F463-E488 HydrophobicContact CE1-CG 3.71Å; F463-E488 HydrophobicContact CZ-CG 4.32Å; E488-D490 PolarHBondContact O-N 2.95Å; E488-F496 CarbonylContact O-C 3.59Å; E488-F496 WeakPolarHBondContact O-CA 3.48Å; E488-V497 PolarHBondContact N-O 2.96Å; E488-V497 WeakPolarHBondContact O-CG2 3.33Å; E488-V497 PolarHBondContact O-N 2.75Å; E488-F499 HydrophobicContact CB-CB 4.04Å; E488-F499 HydrophobicContact CB-CD2 4.44Å; E488-F499 HydrophobicContact CB-CG 4.43Å; E488-F499 WeakPolarHBondContact OE2-CD2 3.14Å
489	L	86.9	Confident	89	Confident	13 Å²	13	52.1 Å²	52.1	7%	0.068	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	109.3	173.3	-177.6	59.7	0	0	0	110.7	V408 V462 M491 F496	V408-L489 HydrophobicContact CB-CD2 4.33Å; V408-L489 HydrophobicContact CG1-CD2 3.76Å; V408-L489 HydrophobicContact CG2-CD2 4Å; V462-L489 HydrophobicContact CB-CB 4.13Å; V462-L489 HydrophobicContact CB-CD2 4.42Å; V462-L489 PolarHBondContact O-N 2.94Å; L489-M491 HydrophobicContact CD2-SD 3.62Å; L489-M491 HydrophobicContact CG-SD 4.01Å; L489-M491 PolarHBondContact O-N 3.24Å; L489-F496 HydrophobicContact CB-CD1 4.02Å; L489-F496 HydrophobicContact CB-CE1 3.7Å; L489-F496 HydrophobicContact CB-CZ 4.04Å; L489-F496 HydrophobicContact CD1-CD2 4.09Å; L489-F496 HydrophobicContact CD1-CE1 4.49Å; L489-F496 HydrophobicContact CD1-CE2 3.98Å; L489-F496 HydrophobicContact CD1-CG 4.4Å; L489-F496 HydrophobicContact CD1-CZ 4.19Å; L489-F496 HydrophobicContact CD2-CZ 4.45Å; L489-F496 HydrophobicContact CG-CZ 4.46Å
490	D	81.3	Confident	88.7	Confident	24 Å²	24	49.8 Å²	49.8	13%	0.128	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	104.4	163.7	175.9	8.2	0	0	0	108.8	L151 E488 S492 G493 R494 M495 V497	L151-D490 HydrophobicContact CD1-CB 4.27Å; L151-D490 HydrophobicContact CD2-CB 4.19Å; E488-D490 PolarHBondContact O-N 2.95Å; D490-S492 PolarHBondContact O-N 2.8Å; D490-S492 WeakPolarHBondContact OD1-CB 3.38Å; D490-S492 PolarHBondContact OD1-N 3.02Å; D490-G493 PolarHBondContact OD1-N 2.59Å; D490-G493 VanDerWaalsContact OD1-N 3.14Å; D490-G493 WeakPolarHBondContact OD2-CA 3.24Å; D490-G493 PolarHBondContact OD2-N 2.87Å; D490-G493 VanDerWaalsContact OD2-N 3.13Å; D490-R494 VanDerWaalsContact O-CA 3.23Å; D490-R494 WeakPolarHBondContact O-CA 3.25Å; D490-R494 PolarHBondContact O-N 2.96Å; D490-M495 PolarHBondContact N-O 3.32Å; D490-M495 PolarHBondContact O-N 3.24Å; D490-V497 HydrophobicContact CB-CG1 4.32Å; D490-V497 HydrophobicContact CB-CG2 4.3Å
491	M	76.2	Confident	88.5	Confident	125 Å²	125	49.9 Å²	49.9	62%	0.616	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.4	179.6	-66.9	-70.2	-101	0	0	113.2	V408 L489	V408-M491 HydrophobicContact CG1-CE 4.16Å; V408-M491 HydrophobicContact CG1-SD 4.23Å; L489-M491 HydrophobicContact CD2-SD 3.62Å; L489-M491 HydrophobicContact CG-SD 4.01Å; L489-M491 PolarHBondContact O-N 3.24Å
492	S	72.9	Confident	88.4	Confident	61 Å²	61	47 Å²	47	43%	0.427	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-47.3	179.7	-55.1	0	0	0	0	110.9	R150 D490 R494	R150-S492 PolarHBondContact NH2-OG 3.29Å; D490-S492 PolarHBondContact O-N 2.8Å; D490-S492 WeakPolarHBondContact OD1-CB 3.38Å; D490-S492 PolarHBondContact OD1-N 3.02Å; S492-R494 PolarHBondContact O-N 2.96Å
493	G	72.6	Confident	88.5	Confident	40 Å²	40	49.6 Å²	49.6	41%	0.412	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.8	173.5	0	0	0	0	0	113.9	D490 M495	D490-G493 PolarHBondContact OD1-N 2.59Å; D490-G493 VanDerWaalsContact OD1-N 3.14Å; D490-G493 WeakPolarHBondContact OD2-CA 3.24Å; D490-G493 PolarHBondContact OD2-N 2.87Å; D490-G493 VanDerWaalsContact OD2-N 3.13Å; G493-M495 VanDerWaalsContact C-N 3.34Å
494	R	84.3	Confident	88.6	Confident	188 Å²	188	47 Å²	47	71%	0.709	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	50.6	-173.9	-57.2	-179.9	-176.5	-174.3	0.6	111.8	F442 D490 S492	F442-R494 WeakPolarHBondContact CZ-O 3.37Å; D490-R494 VanDerWaalsContact O-CA 3.23Å; D490-R494 WeakPolarHBondContact O-CA 3.25Å; D490-R494 PolarHBondContact O-N 2.96Å; S492-R494 PolarHBondContact O-N 2.96Å
495	M	87.3	Confident	88.6	Confident	88 Å²	88	50.9 Å²	50.9	43%	0.433	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	150.5	-179.8	60.1	-170.8	-60.9	0	0	110.9	D490 G493 V497	D490-M495 PolarHBondContact N-O 3.32Å; D490-M495 PolarHBondContact O-N 3.24Å; G493-M495 VanDerWaalsContact C-N 3.34Å; M495-V497 HydrophobicContact CG-CG1 4.06Å
496	F	91.4	Very high	88.6	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125	170.5	-75.2	-85.5	0	0	0	109.9	F406 I431 F442 Q443 I445 V462 L464 E488 L489	F406-F496 HydrophobicContact CE2-CE2 4.14Å; F406-F496 AromaticContact CE2-CZ 3.76Å; F406-F496 HydrophobicContact CE2-CZ 3.76Å; F406-F496 AromaticContact CZ-CE2 3.97Å; F406-F496 HydrophobicContact CZ-CE2 3.97Å; F406-F496 AromaticContact CZ-CZ 3.88Å; F406-F496 HydrophobicContact CZ-CZ 3.88Å; I431-F496 HydrophobicContact CD1-CB 4.39Å; I431-F496 HydrophobicContact CD1-CD2 3.56Å; I431-F496 HydrophobicContact CD1-CE2 4.13Å; I431-F496 HydrophobicContact CD1-CG 4.17Å; F442-F496 HydrophobicContact CE1-CD2 4.15Å; F442-F496 HydrophobicContact CE1-CE2 4.35Å; Q443-F496 PolarHBondContact NE2-O 3.1Å; I445-F496 HydrophobicContact CD1-CB 4.27Å; V462-F496 HydrophobicContact CG1-CE1 4.39Å; V462-F496 HydrophobicContact CG1-CZ 4.46Å; L464-F496 HydrophobicContact CB-CD1 4.4Å; L464-F496 HydrophobicContact CB-CE1 4.28Å; L464-F496 HydrophobicContact CD1-CD1 3.9Å; L464-F496 HydrophobicContact CD1-CD2 4.02Å; L464-F496 HydrophobicContact CD1-CE1 3.61Å; L464-F496 HydrophobicContact CD1-CE2 3.74Å; L464-F496 HydrophobicContact CD1-CG 4.08Å; L464-F496 HydrophobicContact CD1-CZ 3.52Å; L464-F496 HydrophobicContact CG-CD1 4.16Å; L464-F496 HydrophobicContact CG-CE1 3.65Å; L464-F496 HydrophobicContact CG-CZ 3.89Å; E488-F496 CarbonylContact O-C 3.59Å; E488-F496 WeakPolarHBondContact O-CA 3.48Å; L489-F496 HydrophobicContact CB-CD1 4.02Å; L489-F496 HydrophobicContact CB-CE1 3.7Å; L489-F496 HydrophobicContact CB-CZ 4.04Å; L489-F496 HydrophobicContact CD1-CD2 4.09Å; L489-F496 HydrophobicContact CD1-CE1 4.49Å; L489-F496 HydrophobicContact CD1-CE2 3.98Å; L489-F496 HydrophobicContact CD1-CG 4.4Å; L489-F496 HydrophobicContact CD1-CZ 4.19Å; L489-F496 HydrophobicContact CD2-CZ 4.45Å; L489-F496 HydrophobicContact CG-CZ 4.46Å
497	V	86.7	Confident	88.6	Confident	52 Å²	52	51.5 Å²	51.5	32%	0.315	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	147	179.1	-62.9	0	0	0	0	109.8	Y487 E488 D490 M495 F499	Y487-V497 CarbonylContact C-O 3.52Å; Y487-V497 WeakPolarHBondContact CA-O 3.36Å; E488-V497 PolarHBondContact N-O 2.96Å; E488-V497 WeakPolarHBondContact O-CG2 3.33Å; E488-V497 PolarHBondContact O-N 2.75Å; D490-V497 HydrophobicContact CB-CG1 4.32Å; D490-V497 HydrophobicContact CB-CG2 4.3Å; M495-V497 HydrophobicContact CG-CG1 4.06Å; V497-F499 PolarHBondContact O-N 3.24Å
498	R	87.1	Confident	88.7	Confident	123 Å²	123	52.6 Å²	52.6	46%	0.464	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	125.3	-179.4	-168.5	178.8	-162.9	89.6	-0.4	110	T485 Y487 D501	T485-R498 HydrophobicContact CG2-CG 3.66Å; T485-R498 VanDerWaalsContact CG2-CZ 3.47Å; T485-R498 PolarHBondContact OG1-NH1 2.74Å; T485-R498 PolarHBondContact OG1-NH2 3.03Å; Y487-R498 HydrophobicContact CD1-CB 4.32Å; Y487-R498 HydrophobicContact CE1-CB 4.24Å; R498-D501 IonicContact CZ-OD1 2.66Å; R498-D501 IonicContact CZ-OD2 3.37Å; R498-D501 IonicContact NE-OD1 3.26Å; R498-D501 PolarHBondContact NE-OD1 2.79Å; R498-D501 IonicContact NE-OD2 2.7Å; R498-D501 PolarHBondContact NE-OD2 3.43Å; R498-D501 IonicContact NH2-OD1 3.35Å; R498-D501 PolarHBondContact NH2-OD1 2.8Å; R498-D501 IonicContact NH2-OD2 2.91Å; R498-D501 PolarHBondContact NH2-OD2 2.99Å
499	F	85.6	Confident	89	Confident	49 Å²	49	52.5 Å²	52.5	22%	0.215	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-52.3	-179.8	175.7	-101.3	0	0	0	111.7	F463 I486 E488 V497 W541	F463-F499 HydrophobicContact CD1-CD1 4.45Å; F463-F499 HydrophobicContact CD1-CG 4.47Å; F463-F499 HydrophobicContact CE1-CD1 4.15Å; F463-F499 HydrophobicContact CE1-CD2 4.29Å; F463-F499 HydrophobicContact CE1-CE1 4.4Å; F463-F499 HydrophobicContact CE1-CG 4.11Å; I486-F499 HydrophobicContact CB-CD1 4.4Å; I486-F499 HydrophobicContact CG2-CB 4.42Å; I486-F499 HydrophobicContact CG2-CD1 4.03Å; I486-F499 WeakPolarHBondContact O-CA 3.43Å; I486-F499 WeakPolarHBondContact O-CB 3.47Å; I486-F499 PolarHBondContact O-N 3.12Å; E488-F499 HydrophobicContact CB-CB 4.04Å; E488-F499 HydrophobicContact CB-CD2 4.44Å; E488-F499 HydrophobicContact CB-CG 4.43Å; E488-F499 WeakPolarHBondContact OE2-CD2 3.14Å; V497-F499 PolarHBondContact O-N 3.24Å; F499-W541 AromaticContact CE1-CH2 3.9Å; F499-W541 HydrophobicContact CE1-CH2 3.9Å; F499-W541 AromaticContact CE1-CZ3 3.7Å; F499-W541 HydrophobicContact CE1-CZ3 3.7Å; F499-W541 AromaticContact CZ-CH2 3.67Å; F499-W541 HydrophobicContact CZ-CH2 3.67Å; F499-W541 AromaticContact CZ-CZ3 3.95Å; F499-W541 HydrophobicContact CZ-CZ3 3.95Å
500	Q	88.4	Confident	89.6	Confident	38 Å²	38	51.9 Å²	51.9	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	143.3	-176	-178.4	178.6	8.6	0	0	112	I486 I502 F547	I486-Q500 HydrophobicContact CB-CB 4.23Å; I486-Q500 HydrophobicContact CD1-CB 4.31Å; I486-Q500 PolarHBondContact N-O 2.79Å; I486-Q500 PolarHBondContact O-N 3.2Å; I486-Q500 VanDerWaalsContact O-N 3.1Å; Q500-I502 HydrophobicContact CG-CG1 4.23Å; Q500-F547 PolarHBondContact NE2-O 2.87Å
501	D	89.9	Confident	90.4	Very high	64 Å²	64	52.2 Å²	52.2	34%	0.342	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.4	169.9	-73.4	9.7	0	0	0	110.7	N483 R498	N483-D501 HydrophobicContact CB-CB 4.3Å; N483-D501 PolarHBondContact ND2-OD2 2.91Å; R498-D501 IonicContact CZ-OD1 2.66Å; R498-D501 IonicContact CZ-OD2 3.37Å; R498-D501 IonicContact NE-OD1 3.26Å; R498-D501 PolarHBondContact NE-OD1 2.79Å; R498-D501 IonicContact NE-OD2 2.7Å; R498-D501 PolarHBondContact NE-OD2 3.43Å; R498-D501 IonicContact NH2-OD1 3.35Å; R498-D501 PolarHBondContact NH2-OD1 2.8Å; R498-D501 IonicContact NH2-OD2 2.91Å; R498-D501 PolarHBondContact NH2-OD2 2.99Å
502	I	94.8	Very high	91.5	Very high	9 Å²	9	48 Å²	48	5%	0.046	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121	174.2	-58.5	-179.6	0	0	0	108	N483 S484 I486 Q500 T504 W510 Y539 F547	N483-I502 CarbonylContact C-O 3.55Å; N483-I502 VanDerWaalsContact CA-O 3.29Å; N483-I502 WeakPolarHBondContact CA-O 3.28Å; S484-I502 PolarHBondContact N-O 2.89Å; S484-I502 PolarHBondContact O-N 2.88Å; I486-I502 HydrophobicContact CD1-CD1 3.89Å; Q500-I502 HydrophobicContact CG-CG1 4.23Å; I502-T504 HydrophobicContact CG2-CG2 4.17Å; I502-T504 PolarHBondContact O-N 3.39Å; I502-W510 HydrophobicContact CB-CH2 4.35Å; I502-W510 HydrophobicContact CB-CZ2 4.38Å; I502-W510 HydrophobicContact CD1-CH2 3.78Å; I502-W510 HydrophobicContact CD1-CZ2 4.4Å; I502-W510 HydrophobicContact CG2-CH2 4.06Å; I502-W510 HydrophobicContact CG2-CZ2 4.35Å; I502-Y539 HydrophobicContact CD1-CD1 4.38Å; I502-Y539 HydrophobicContact CD1-CE1 4.39Å; I502-Y539 HydrophobicContact CG2-CE1 3.78Å; I502-Y539 HydrophobicContact CG2-CE2 4.22Å; I502-Y539 VanDerWaalsContact CG2-CZ 3.48Å; I502-Y539 WeakPolarHBondContact CG2-OH 3.44Å; I502-F547 HydrophobicContact CD1-CB 4.23Å
503	V	96.2	Very high	92.6	Very high	74 Å²	74	45.4 Å²	45.4	45%	0.448	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	123.5	174.5	-178.6	0	0	0	0	108.5	T481 N483	T481-V503 HydrophobicContact CG2-CG1 3.75Å; N483-V503 WeakPolarHBondContact OD1-CG2 3.38Å
504	T	98.1	Very high	93.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	167.1	-178.2	51.8	0	0	0	0	111.2	T481 I482 S484 I502 A507 W510 V523	T481-T504 WeakPolarHBondContact CA-O 3.35Å; I482-T504 PolarHBondContact N-O 2.8Å; I482-T504 CarbonylContact O-C 3.52Å; I482-T504 WeakPolarHBondContact O-CA 3.31Å; I482-T504 PolarHBondContact O-N 3.45Å; I482-T504 PolarHBondContact O-OG1 2.93Å; S484-T504 PolarHBondContact N-OG1 3.26Å; S484-T504 WeakPolarHBondContact OG-CG2 3.39Å; S484-T504 PolarHBondContact OG-OG1 3.19Å; I502-T504 HydrophobicContact CG2-CG2 4.17Å; I502-T504 PolarHBondContact O-N 3.39Å; T504-A507 HydrophobicContact CG2-CB 4.35Å; T504-W510 HydrophobicContact CG2-CH2 4.49Å; T504-W510 HydrophobicContact CG2-CZ2 3.76Å; T504-V523 HydrophobicContact CG2-CG1 4.43Å; T504-V523 HydrophobicContact CG2-CG2 3.92Å
505	Y	97.8	Very high	93.5	Very high	82 Å²	82	37.3 Å²	37.3	32%	0.322	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	93.2	-175	-58.3	-81.7	0	0	0	110.1	Y480 T481 A507 N525 S526 Y527 N528	Y480-Y505 CarbonylContact O-C 3.51Å; Y480-Y505 WeakPolarHBondContact O-CA 2.98Å; T481-Y505 HydrophobicContact CG2-CD1 4Å; T481-Y505 HydrophobicContact CG2-CE1 3.59Å; T481-Y505 VanDerWaalsContact OG1-CD1 3.29Å; T481-Y505 WeakPolarHBondContact OG1-CD1 3.45Å; T481-Y505 VanDerWaalsContact OG1-CE1 3.3Å; T481-Y505 WeakPolarHBondContact OG1-CE1 3.25Å; Y505-A507 VanDerWaalsContact C-N 3.31Å; Y505-A507 PolarHBondContact O-N 2.81Å; Y505-N525 PolarHBondContact N-OD1 2.96Å; Y505-N525 CarbonylContact O-C 3.6Å; Y505-N525 WeakPolarHBondContact O-CA 3.37Å; Y505-S526 PolarHBondContact O-N 2.92Å; Y505-S526 VanDerWaalsContact O-N 3.09Å; Y505-Y527 CarbonylContact C-O 3.52Å; Y505-Y527 PolarHBondContact O-N 3.4Å; Y505-N528 HydrophobicContact CD1-CB 3.64Å; Y505-N528 HydrophobicContact CE1-CB 4.43Å; Y505-N528 HydrophobicContact CG-CB 4.12Å
506	S	97.4	Very high	93	Very high	17 Å²	17	35.8 Å²	35.8	12%	0.119	19%	0.194	C	C	.	.	S	Bend	trans	42.9	61.7	-169.7	-171.8	0	0	0	0	111.7	G469 Y480 V508 S526 Y527	G469-S506 WeakPolarHBondContact O-CA 3.46Å; G469-S506 WeakPolarHBondContact O-CB 3.25Å; Y480-S506 PolarHBondContact O-N 3.3Å; S506-V508 PolarHBondContact O-N 2.69Å; S506-S526 WeakPolarHBondContact O-CB 3.37Å; S506-S526 PolarHBondContact O-N 3.28Å; S506-Y527 WeakPolarHBondContact CB-O 3.27Å; S506-Y527 PolarHBondContact N-O 3.35Å
507	A	98.3	Very high	92.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	132.5	174.6	0	0	0	0	0	108.7	T451 A467 S484 T504 Y505 V523 A524	T451-A507 PolarHBondContact OG1-O 2.82Å; A467-A507 HydrophobicContact CB-CB 3.82Å; S484-A507 WeakPolarHBondContact OG-CB 3.38Å; T504-A507 HydrophobicContact CG2-CB 4.35Å; Y505-A507 VanDerWaalsContact C-N 3.31Å; Y505-A507 PolarHBondContact O-N 2.81Å; A507-V523 HydrophobicContact CB-CG2 3.82Å; A507-A524 WeakPolarHBondContact CA-O 3.1Å
508	V	97.7	Very high	91.9	Very high	38 Å²	38	38.2 Å²	38.2	23%	0.23	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-19.2	179	-68.9	0	0	0	0	112.6	D452 S506 A524 C558 S559	D452-V508 WeakPolarHBondContact CB-O 3.23Å; S506-V508 PolarHBondContact O-N 2.69Å; V508-A524 HydrophobicContact CG2-CB 3.51Å; V508-A524 PolarHBondContact N-O 3.02Å; V508-A524 VanDerWaalsContact N-O 3.15Å; V508-C558 VanDerWaalsContact CG2-O 3.25Å; V508-C558 WeakPolarHBondContact CG2-O 3.3Å; V508-S559 WeakPolarHBondContact CG2-O 3.4Å
509	D	98.6	Very high	92	Very high	14 Å²	14	35.4 Å²	35.4	8%	0.075	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	146.2	-175.5	165.7	53.6	0	0	0	110.1	A524 W561	D509-A524 HydrophobicContact CB-CB 3.89Å; D509-A524 PolarHBondContact O-N 3.37Å; D509-W561 PolarHBondContact OD2-N 2.74Å
510	W	98.7	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.8	168.3	-81.2	102.9	0	0	0	110.3	D452 E454 V465 S484 I502 T504 L521 V522 V523 Y539	D452-W510 PolarHBondContact OD2-N 3.44Å; E454-W510 HydrophobicContact CB-CB 4.08Å; E454-W510 WeakPolarHBondContact CB-O 3.42Å; E454-W510 VanDerWaalsContact CG-O 3.26Å; E454-W510 WeakPolarHBondContact CG-O 3.48Å; V465-W510 HydrophobicContact CG1-CB 3.69Å; V465-W510 HydrophobicContact CG1-CD2 4.36Å; V465-W510 HydrophobicContact CG1-CG 3.82Å; V465-W510 HydrophobicContact CG2-CD2 3.92Å; V465-W510 HydrophobicContact CG2-CG 3.88Å; V465-W510 HydrophobicContact CG2-CZ2 4.41Å; S484-W510 PolarHBondContact OG-NE1 3.49Å; I502-W510 HydrophobicContact CB-CH2 4.35Å; I502-W510 HydrophobicContact CB-CZ2 4.38Å; I502-W510 HydrophobicContact CD1-CH2 3.78Å; I502-W510 HydrophobicContact CD1-CZ2 4.4Å; I502-W510 HydrophobicContact CG2-CH2 4.06Å; I502-W510 HydrophobicContact CG2-CZ2 4.35Å; T504-W510 HydrophobicContact CG2-CH2 4.49Å; T504-W510 HydrophobicContact CG2-CZ2 3.76Å; W510-L521 HydrophobicContact CE3-CB 3.91Å; W510-L521 HydrophobicContact CE3-CD1 4.45Å; W510-L521 HydrophobicContact CE3-CD2 4.35Å; W510-L521 HydrophobicContact CE3-CG 4.49Å; W510-L521 HydrophobicContact CZ3-CB 3.82Å; W510-L521 HydrophobicContact CZ3-CD1 4.44Å; W510-V522 WeakPolarHBondContact CA-O 3.36Å; W510-V523 HydrophobicContact CD2-CB 3.88Å; W510-V523 HydrophobicContact CD2-CG2 3.96Å; W510-V523 HydrophobicContact CE3-CB 3.72Å; W510-V523 HydrophobicContact CE3-CG2 4.33Å; W510-V523 HydrophobicContact CH2-CB 3.59Å; W510-V523 HydrophobicContact CH2-CG1 4.09Å; W510-V523 HydrophobicContact CH2-CG2 4.12Å; W510-V523 HydrophobicContact CZ2-CB 3.72Å; W510-V523 HydrophobicContact CZ2-CG1 4.43Å; W510-V523 HydrophobicContact CZ2-CG2 3.69Å; W510-V523 HydrophobicContact CZ3-CB 3.59Å; W510-V523 HydrophobicContact CZ3-CG1 4.32Å; W510-V523 HydrophobicContact CZ3-CG2 4.41Å; W510-Y539 AromaticContact CH2-CD2 3.99Å; W510-Y539 HydrophobicContact CH2-CD2 3.99Å; W510-Y539 AromaticContact CH2-CE2 3.63Å; W510-Y539 HydrophobicContact CH2-CE2 3.63Å; W510-Y539 AromaticContact CZ3-CD2 3.77Å; W510-Y539 HydrophobicContact CZ3-CD2 3.77Å; W510-Y539 AromaticContact CZ3-CE2 3.81Å; W510-Y539 HydrophobicContact CZ3-CE2 3.81Å
511	E	98.4	Very high	93	Very high	30 Å²	30	31.3 Å²	31.3	14%	0.14	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.8	177.9	170.8	64.9	178.5	0	0	110.8	L521 V522 W561 F563	E511-L521 CarbonylContact O-C 3.52Å; E511-L521 WeakPolarHBondContact O-CA 3.41Å; E511-V522 HydrophobicContact CB-CG1 3.73Å; E511-V522 HydrophobicContact CG-CG1 4.24Å; E511-V522 PolarHBondContact N-O 3.03Å; E511-V522 PolarHBondContact O-N 3.24Å; E511-W561 HydrophobicContact CB-CB 3.91Å; E511-W561 WeakPolarHBondContact CB-O 3.44Å; E511-W561 HydrophobicContact CG-CB 4.49Å; E511-F563 HydrophobicContact CG-CB 4.26Å; E511-F563 VanDerWaalsContact OE1-CB 3.27Å; E511-F563 WeakPolarHBondContact OE1-CB 3.35Å; E511-F563 PolarHBondContact OE1-N 2.93Å
512	F	98.3	Very high	93.5	Very high	37 Å²	37	28.2 Å²	28.2	16%	0.162	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.7	177.2	177.7	-96.6	0	0	0	112.4	E454 F456 I458 Y519 F520 L521 F547	E454-F512 HydrophobicContact CG-CB 4.15Å; E454-F512 WeakPolarHBondContact OE1-CB 3.18Å; F456-F512 HydrophobicContact CB-CB 3.76Å; F456-F512 HydrophobicContact CB-CD1 3.47Å; F456-F512 VanDerWaalsContact CB-CD1 3.47Å; F456-F512 HydrophobicContact CB-CD2 3.43Å; F456-F512 VanDerWaalsContact CB-CD2 3.43Å; F456-F512 HydrophobicContact CB-CE1 3.8Å; F456-F512 HydrophobicContact CB-CE2 3.76Å; F456-F512 HydrophobicContact CB-CG 3.25Å; F456-F512 HydrophobicContact CB-CZ 3.92Å; F456-F512 HydrophobicContact CD1-CB 4.45Å; F456-F512 HydrophobicContact CD1-CD2 4.19Å; F456-F512 HydrophobicContact CD1-CG 4.46Å; F456-F512 AromaticContact CD2-CD2 3.7Å; F456-F512 HydrophobicContact CD2-CD2 3.7Å; F456-F512 AromaticContact CD2-CE2 3.55Å; F456-F512 HydrophobicContact CD2-CE2 3.55Å; F456-F512 HydrophobicContact CD2-CG 4.42Å; F456-F512 HydrophobicContact CD2-CZ 4.18Å; F456-F512 HydrophobicContact CE2-CE2 4.38Å; F456-F512 HydrophobicContact CG-CB 4.28Å; F456-F512 HydrophobicContact CG-CD1 4.45Å; F456-F512 AromaticContact CG-CD2 3.5Å; F456-F512 HydrophobicContact CG-CD2 3.5Å; F456-F512 AromaticContact CG-CE2 3.82Å; F456-F512 HydrophobicContact CG-CE2 3.82Å; F456-F512 AromaticContact CG-CG 3.83Å; F456-F512 HydrophobicContact CG-CG 3.83Å; F456-F512 HydrophobicContact CG-CZ 4.4Å; I458-F512 HydrophobicContact CD1-CE2 4.45Å; I458-F512 HydrophobicContact CG1-CE2 4.31Å; I458-F512 HydrophobicContact CG1-CZ 4.24Å; F512-Y519 HydrophobicContact CE1-CD1 4.48Å; F512-Y519 HydrophobicContact CE2-CD1 4.36Å; F512-Y519 AromaticContact CZ-CD1 3.63Å; F512-Y519 HydrophobicContact CZ-CD1 3.63Å; F512-Y519 HydrophobicContact CZ-CG 4.24Å; F512-F520 WeakPolarHBondContact CD2-O 3.48Å; F512-L521 HydrophobicContact CB-CD2 3.71Å; F512-L521 HydrophobicContact CD2-CD2 3.9Å; F512-L521 HydrophobicContact CD2-CG 4.15Å; F512-L521 HydrophobicContact CG-CD2 4.31Å; F512-F547 HydrophobicContact CD2-CZ 4.48Å; F512-F547 HydrophobicContact CE2-CZ 4.26Å
513	F	96.2	Very high	93.6	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	169.2	173.4	66.3	-84.9	0	0	0	113.2	L515 F520 V522 L538 F563 L572 L587	F513-L515 HydrophobicContact CD2-CG 4.2Å; F513-L515 HydrophobicContact CE2-CD1 4.1Å; F513-L515 HydrophobicContact CE2-CG 4.01Å; F513-F520 HydrophobicContact CD1-CB 4.12Å; F513-F520 HydrophobicContact CD2-CB 4.15Å; F513-F520 HydrophobicContact CD2-CD2 4.24Å; F513-F520 HydrophobicContact CE1-CB 3.71Å; F513-F520 HydrophobicContact CE2-CB 3.74Å; F513-F520 AromaticContact CE2-CD2 3.82Å; F513-F520 HydrophobicContact CE2-CD2 3.82Å; F513-F520 AromaticContact CE2-CG 3.87Å; F513-F520 HydrophobicContact CE2-CG 3.87Å; F513-F520 HydrophobicContact CG-CB 4.34Å; F513-F520 HydrophobicContact CZ-CB 3.52Å; F513-F520 HydrophobicContact CZ-CD2 4.37Å; F513-F520 AromaticContact CZ-CG 3.95Å; F513-F520 HydrophobicContact CZ-CG 3.95Å; F513-F520 PolarHBondContact N-O 2.7Å; F513-F520 VanDerWaalsContact N-O 3.07Å; F513-F520 PolarHBondContact O-N 2.66Å; F513-V522 HydrophobicContact CE1-CG1 4.39Å; F513-L538 HydrophobicContact CE1-CD1 3.66Å; F513-L538 HydrophobicContact CZ-CD1 3.53Å; F513-F563 HydrophobicContact CB-CB 3.73Å; F513-F563 HydrophobicContact CB-CD1 3.7Å; F513-F563 HydrophobicContact CB-CD2 3.6Å; F513-F563 HydrophobicContact CB-CE1 4.17Å; F513-F563 HydrophobicContact CB-CE2 4.04Å; F513-F563 HydrophobicContact CB-CG 3.38Å; F513-F563 HydrophobicContact CB-CZ 4.31Å; F513-F563 HydrophobicContact CD1-CB 4.27Å; F513-F563 HydrophobicContact CD1-CD2 4.15Å; F513-F563 HydrophobicContact CD1-CG 4.41Å; F513-F563 AromaticContact CD2-CD2 3.47Å; F513-F563 HydrophobicContact CD2-CD2 3.47Å; F513-F563 VanDerWaalsContact CD2-CD2 3.47Å; F513-F563 AromaticContact CD2-CE2 3.48Å; F513-F563 HydrophobicContact CD2-CE2 3.48Å; F513-F563 VanDerWaalsContact CD2-CE2 3.48Å; F513-F563 HydrophobicContact CD2-CG 4.2Å; F513-F563 HydrophobicContact CD2-CZ 4.25Å; F513-F563 HydrophobicContact CE2-CD2 4.13Å; F513-F563 HydrophobicContact CE2-CE2 4.14Å; F513-F563 HydrophobicContact CG-CB 4.08Å; F513-F563 HydrophobicContact CG-CD1 4.49Å; F513-F563 AromaticContact CG-CD2 3.47Å; F513-F563 HydrophobicContact CG-CD2 3.47Å; F513-F563 VanDerWaalsContact CG-CD2 3.47Å; F513-F563 AromaticContact CG-CE2 3.93Å; F513-F563 HydrophobicContact CG-CE2 3.93Å; F513-F563 AromaticContact CG-CG 3.77Å; F513-F563 HydrophobicContact CG-CG 3.77Å; F513-L572 HydrophobicContact CD1-CD2 4.06Å; F513-L572 HydrophobicContact CE1-CD1 4.13Å; F513-L572 HydrophobicContact CE1-CD2 3.77Å; F513-L572 HydrophobicContact CE1-CG 4.44Å; F513-L572 HydrophobicContact CZ-CD1 4.07Å; F513-L572 HydrophobicContact CZ-CD2 4.21Å; F513-L572 HydrophobicContact CZ-CG 4.46Å; F513-L587 HydrophobicContact CD2-CD1 4.28Å; F513-L587 HydrophobicContact CE2-CD1 3.56Å; F513-L587 HydrophobicContact CZ-CD1 4Å
514	S	90.9	Very high	93.8	Very high	55 Å²	55	24.3 Å²	24.3	39%	0.385	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.7	175.5	59.8	0	0	0	0	112.3	E518	S514-E518 CarbonylContact C-O 3.45Å; S514-E518 WeakPolarHBondContact CA-O 3.49Å; S514-E518 WeakPolarHBondContact CB-O 3.37Å
515	L	86.1	Confident	93.8	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	98	169.4	-62.5	174.2	0	0	0	107.9	L226 F513 E517 E518 F520 F563 L587 T589	L226-L515 HydrophobicContact CB-CD1 4.02Å; L226-L515 HydrophobicContact CD1-CD1 3.95Å; L226-L515 HydrophobicContact CG-CD1 4.43Å; F513-L515 HydrophobicContact CD2-CG 4.2Å; F513-L515 HydrophobicContact CE2-CD1 4.1Å; F513-L515 HydrophobicContact CE2-CG 4.01Å; L515-E517 PolarHBondContact O-N 2.95Å; L515-E518 PolarHBondContact N-O 2.79Å; L515-E518 PolarHBondContact O-N 3.37Å; L515-E518 VanDerWaalsContact O-N 3.15Å; L515-F520 HydrophobicContact CB-CE2 3.96Å; L515-F520 HydrophobicContact CD1-CD2 4.4Å; L515-F520 HydrophobicContact CD1-CE2 3.9Å; L515-F520 HydrophobicContact CD1-CZ 4.32Å; L515-F520 HydrophobicContact CG-CD2 4.35Å; L515-F520 HydrophobicContact CG-CE2 4.05Å; L515-F563 HydrophobicContact CD2-CE2 4.07Å; L515-F563 HydrophobicContact CD2-CZ 4.28Å; L515-L587 HydrophobicContact CD1-CB 4.19Å; L515-L587 HydrophobicContact CD1-CD1 4.05Å; L515-L587 HydrophobicContact CD2-CD1 4.07Å; L515-L587 HydrophobicContact CG-CD1 4.46Å; L515-T589 HydrophobicContact CB-CG2 4.27Å; L515-T589 HydrophobicContact CD1-CG2 4.05Å; L515-T589 HydrophobicContact CD2-CG2 4.46Å
516	G	76.9	Confident	93.8	Very high	55 Å²	55	21 Å²	21	57%	0.567	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	-120.3	-170	0	0	0	0	0	110.8
517	E	72.4	Confident	93.8	Very high	82 Å²	82	22.5 Å²	22.5	38%	0.383	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	1.8	177.9	-57.8	-168.3	142.3	0	0	113.6	T218 L515 Y519	T218-E517 WeakPolarHBondContact CB-OE1 3.46Å; T218-E517 WeakPolarHBondContact CG2-OE1 3.38Å; L515-E517 PolarHBondContact O-N 2.95Å; E517-Y519 WeakPolarHBondContact O-CE2 3.46Å
518	E	81.3	Confident	93.6	Very high	26 Å²	26	24.6 Å²	24.6	12%	0.121	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.2	176.3	-61.6	-161.9	146.3	0	0	110.4	R225 L226 S514 L515 F520 R540	R225-E518 WeakPolarHBondContact CA-OE2 3.3Å; R225-E518 WeakPolarHBondContact CG-OE2 3.47Å; L226-E518 PolarHBondContact N-OE2 3.43Å; S514-E518 CarbonylContact C-O 3.45Å; S514-E518 WeakPolarHBondContact CA-O 3.49Å; S514-E518 WeakPolarHBondContact CB-O 3.37Å; L515-E518 PolarHBondContact N-O 2.79Å; L515-E518 PolarHBondContact O-N 3.37Å; L515-E518 VanDerWaalsContact O-N 3.15Å; E518-F520 HydrophobicContact CB-CD2 4.42Å; E518-F520 HydrophobicContact CB-CE2 3.47Å; E518-F520 VanDerWaalsContact CB-CE2 3.47Å; E518-F520 HydrophobicContact CB-CZ 3.84Å; E518-F520 WeakPolarHBondContact OE2-CZ 3.22Å; E518-R540 IonicContact OE1-CZ 3.18Å; E518-R540 VanDerWaalsContact OE1-CZ 3.28Å; E518-R540 IonicContact OE1-NE 3.45Å; E518-R540 IonicContact OE1-NH1 2.74Å; E518-R540 PolarHBondContact OE1-NH1 2.8Å; E518-R540 IonicContact OE1-NH2 3.34Å; E518-R540 IonicContact OE2-NH1 3.5Å
519	Y	90.9	Very high	93.4	Very high	63 Å²	63	24.2 Å²	24.2	25%	0.247	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.2	-178.9	-53.2	-81.1	0	0	0	110	I458 F512 E517 W541	I458-Y519 HydrophobicContact CD1-CD2 4.33Å; I458-Y519 HydrophobicContact CD1-CG 4.15Å; I458-Y519 HydrophobicContact CG1-CD1 4.2Å; I458-Y519 HydrophobicContact CG1-CD2 4.22Å; I458-Y519 HydrophobicContact CG1-CG 3.97Å; I458-Y519 HydrophobicContact CG2-CD2 3.75Å; I458-Y519 HydrophobicContact CG2-CE2 3.62Å; I458-Y519 HydrophobicContact CG2-CG 4.35Å; F512-Y519 HydrophobicContact CE1-CD1 4.48Å; F512-Y519 HydrophobicContact CE2-CD1 4.36Å; F512-Y519 AromaticContact CZ-CD1 3.63Å; F512-Y519 HydrophobicContact CZ-CD1 3.63Å; F512-Y519 HydrophobicContact CZ-CG 4.24Å; E517-Y519 WeakPolarHBondContact O-CE2 3.46Å; Y519-W541 WeakPolarHBondContact O-CB 3.48Å; Y519-W541 PolarHBondContact O-N 2.91Å
520	F	96.7	Very high	93.3	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.6	-174.4	-62.2	-93.4	0	0	0	111.4	L226 F512 F513 L515 E518 L538 Y539 R540 V550	L226-F520 HydrophobicContact CB-CE1 4.18Å; L226-F520 HydrophobicContact CB-CZ 3.81Å; L226-F520 HydrophobicContact CD2-CE1 3.93Å; L226-F520 HydrophobicContact CD2-CZ 4.31Å; F512-F520 WeakPolarHBondContact CD2-O 3.48Å; F513-F520 HydrophobicContact CD1-CB 4.12Å; F513-F520 HydrophobicContact CD2-CB 4.15Å; F513-F520 HydrophobicContact CD2-CD2 4.24Å; F513-F520 HydrophobicContact CE1-CB 3.71Å; F513-F520 HydrophobicContact CE2-CB 3.74Å; F513-F520 AromaticContact CE2-CD2 3.82Å; F513-F520 HydrophobicContact CE2-CD2 3.82Å; F513-F520 AromaticContact CE2-CG 3.87Å; F513-F520 HydrophobicContact CE2-CG 3.87Å; F513-F520 HydrophobicContact CG-CB 4.34Å; F513-F520 HydrophobicContact CZ-CB 3.52Å; F513-F520 HydrophobicContact CZ-CD2 4.37Å; F513-F520 AromaticContact CZ-CG 3.95Å; F513-F520 HydrophobicContact CZ-CG 3.95Å; F513-F520 PolarHBondContact N-O 2.7Å; F513-F520 VanDerWaalsContact N-O 3.07Å; F513-F520 PolarHBondContact O-N 2.66Å; L515-F520 HydrophobicContact CB-CE2 3.96Å; L515-F520 HydrophobicContact CD1-CD2 4.4Å; L515-F520 HydrophobicContact CD1-CE2 3.9Å; L515-F520 HydrophobicContact CD1-CZ 4.32Å; L515-F520 HydrophobicContact CG-CD2 4.35Å; L515-F520 HydrophobicContact CG-CE2 4.05Å; E518-F520 HydrophobicContact CB-CD2 4.42Å; E518-F520 HydrophobicContact CB-CE2 3.47Å; E518-F520 VanDerWaalsContact CB-CE2 3.47Å; E518-F520 HydrophobicContact CB-CZ 3.84Å; E518-F520 WeakPolarHBondContact OE2-CZ 3.22Å; F520-L538 HydrophobicContact CB-CD1 3.9Å; F520-L538 HydrophobicContact CD1-CD1 4.07Å; F520-L538 HydrophobicContact CD1-CD2 4.32Å; F520-L538 HydrophobicContact CD1-CG 4.15Å; F520-L538 HydrophobicContact CG-CD1 4.35Å; F520-Y539 WeakPolarHBondContact CA-O 3.23Å; F520-Y539 WeakPolarHBondContact CB-O 3.47Å; F520-Y539 WeakPolarHBondContact CD1-O 3.5Å; F520-R540 HydrophobicContact CD1-CB 3.97Å; F520-R540 HydrophobicContact CD1-CG 4.05Å; F520-R540 HydrophobicContact CE1-CB 3.77Å; F520-R540 HydrophobicContact CE1-CG 3.57Å; F520-R540 HydrophobicContact CZ-CG 3.92Å; F520-V550 HydrophobicContact CD1-CG2 4.47Å; F520-V550 HydrophobicContact CE1-CG2 4.34Å
521	L	98.4	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.4	166.4	-80.7	172.2	0	0	0	108	F456 V465 I486 W510 E511 F512 Y539 F547	F456-L521 HydrophobicContact CD1-CD2 4.11Å; F456-L521 HydrophobicContact CE1-CD1 3.87Å; F456-L521 HydrophobicContact CE1-CD2 4.12Å; F456-L521 HydrophobicContact CE1-CG 4.48Å; F456-L521 HydrophobicContact CZ-CD1 3.89Å; V465-L521 HydrophobicContact CG1-CD2 4.37Å; I486-L521 HydrophobicContact CD1-CD1 3.92Å; W510-L521 HydrophobicContact CE3-CB 3.91Å; W510-L521 HydrophobicContact CE3-CD1 4.45Å; W510-L521 HydrophobicContact CE3-CD2 4.35Å; W510-L521 HydrophobicContact CE3-CG 4.49Å; W510-L521 HydrophobicContact CZ3-CB 3.82Å; W510-L521 HydrophobicContact CZ3-CD1 4.44Å; E511-L521 CarbonylContact O-C 3.52Å; E511-L521 WeakPolarHBondContact O-CA 3.41Å; F512-L521 HydrophobicContact CB-CD2 3.71Å; F512-L521 HydrophobicContact CD2-CD2 3.9Å; F512-L521 HydrophobicContact CD2-CG 4.15Å; F512-L521 HydrophobicContact CG-CD2 4.31Å; L521-Y539 PolarHBondContact N-O 3.5Å; L521-Y539 PolarHBondContact O-N 2.9Å; L521-F547 HydrophobicContact CB-CD1 4.05Å; L521-F547 HydrophobicContact CB-CE1 4Å; L521-F547 HydrophobicContact CD1-CD1 3.91Å; L521-F547 HydrophobicContact CD1-CD2 3.67Å; L521-F547 HydrophobicContact CD1-CE1 3.75Å; L521-F547 HydrophobicContact CD1-CE2 3.49Å; L521-F547 VanDerWaalsContact CD1-CE2 3.49Å; L521-F547 HydrophobicContact CD1-CG 3.86Å; L521-F547 HydrophobicContact CD1-CZ 3.52Å; L521-F547 HydrophobicContact CG-CD1 4.04Å; L521-F547 HydrophobicContact CG-CE1 3.61Å; L521-F547 HydrophobicContact CG-CE2 4.2Å; L521-F547 HydrophobicContact CG-CG 4.49Å; L521-F547 HydrophobicContact CG-CZ 3.68Å
522	V	98.7	Very high	93.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	137.8	168.6	61.6	0	0	0	0	109.5	W510 E511 F513 I537 L538 W561 L572	W510-V522 WeakPolarHBondContact CA-O 3.36Å; E511-V522 HydrophobicContact CB-CG1 3.73Å; E511-V522 HydrophobicContact CG-CG1 4.24Å; E511-V522 PolarHBondContact N-O 3.03Å; E511-V522 PolarHBondContact O-N 3.24Å; F513-V522 HydrophobicContact CE1-CG1 4.39Å; V522-I537 WeakPolarHBondContact CA-O 3.31Å; V522-L538 HydrophobicContact CB-CD1 4.02Å; V522-W561 HydrophobicContact CG1-CB 3.78Å; V522-W561 HydrophobicContact CG1-CD2 4.21Å; V522-W561 HydrophobicContact CG1-CG 3.82Å; V522-W561 HydrophobicContact CG2-CD2 3.95Å; V522-W561 HydrophobicContact CG2-CG 4.05Å; V522-W561 HydrophobicContact CG2-CZ2 4.38Å; V522-L572 HydrophobicContact CG1-CD2 4.47Å
523	V	98.8	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.2	176.8	65	0	0	0	0	111.6	T504 A507 W510 N525 S536 I537 Y539	T504-V523 HydrophobicContact CG2-CG1 4.43Å; T504-V523 HydrophobicContact CG2-CG2 3.92Å; A507-V523 HydrophobicContact CB-CG2 3.82Å; W510-V523 HydrophobicContact CD2-CB 3.88Å; W510-V523 HydrophobicContact CD2-CG2 3.96Å; W510-V523 HydrophobicContact CE3-CB 3.72Å; W510-V523 HydrophobicContact CE3-CG2 4.33Å; W510-V523 HydrophobicContact CH2-CB 3.59Å; W510-V523 HydrophobicContact CH2-CG1 4.09Å; W510-V523 HydrophobicContact CH2-CG2 4.12Å; W510-V523 HydrophobicContact CZ2-CB 3.72Å; W510-V523 HydrophobicContact CZ2-CG1 4.43Å; W510-V523 HydrophobicContact CZ2-CG2 3.69Å; W510-V523 HydrophobicContact CZ3-CB 3.59Å; W510-V523 HydrophobicContact CZ3-CG1 4.32Å; W510-V523 HydrophobicContact CZ3-CG2 4.41Å; V523-N525 PolarHBondContact O-N 2.84Å; V523-S536 WeakPolarHBondContact O-CA 3.14Å; V523-S536 WeakPolarHBondContact O-CB 3.03Å; V523-S536 PolarHBondContact O-OG 3Å; V523-I537 HydrophobicContact CG1-CB 4.17Å; V523-I537 PolarHBondContact N-O 3.43Å; V523-I537 VanDerWaalsContact N-O 3.11Å; V523-Y539 HydrophobicContact CG1-CE2 3.88Å
524	A	98.6	Very high	93.1	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	92.7	166.7	0	0	0	0	0	110.6	A507 V508 D509 S526 C558	A507-A524 WeakPolarHBondContact CA-O 3.1Å; V508-A524 HydrophobicContact CG2-CB 3.51Å; V508-A524 PolarHBondContact N-O 3.02Å; V508-A524 VanDerWaalsContact N-O 3.15Å; D509-A524 HydrophobicContact CB-CB 3.89Å; D509-A524 PolarHBondContact O-N 3.37Å; A524-S526 PolarHBondContact O-N 2.78Å; A524-C558 HydrophobicContact CB-CB 4.09Å
525	N	98.4	Very high	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	110.7	171	-76.2	-42.4	0	0	0	109.9	Y505 V523 L534 N535	Y505-N525 PolarHBondContact N-OD1 2.96Å; Y505-N525 CarbonylContact O-C 3.6Å; Y505-N525 WeakPolarHBondContact O-CA 3.37Å; V523-N525 PolarHBondContact O-N 2.84Å; N525-L534 HydrophobicContact CB-CB 4.48Å; N525-L534 HydrophobicContact CB-CD1 4.33Å; N525-N535 WeakPolarHBondContact CB-O 3.09Å; N525-N535 PolarHBondContact ND2-O 2.89Å
526	S	97.7	Very high	94	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.091	23%	0.225	C	C	.	.			trans	-92.6	-43.2	-172.3	-155.2	0	0	0	0	113.6	Y505 S506 A524 Y532 C558	Y505-S526 PolarHBondContact O-N 2.92Å; Y505-S526 VanDerWaalsContact O-N 3.09Å; S506-S526 WeakPolarHBondContact O-CB 3.37Å; S506-S526 PolarHBondContact O-N 3.28Å; A524-S526 PolarHBondContact O-N 2.78Å; S526-Y532 WeakPolarHBondContact O-CA 3.22Å; S526-Y532 VanDerWaalsContact O-CD1 3.23Å; S526-Y532 WeakPolarHBondContact O-CD1 3.29Å; S526-C558 VanDerWaalsContact CB-O 3.24Å; S526-C558 WeakPolarHBondContact CB-O 3.07Å; S526-C558 PolarHBondContact OG-O 3.04Å
527	Y	97.7	Very high	95	Very high	48 Å²	48	38.7 Å²	38.7	19%	0.188	20%	0.202	C	C	.	.			trans	-156.9	135.6	-171.6	-177	-118.8	0	0	0	112.2	Y480 Y505 S506 G529 S531 Y532	Y480-Y527 AromaticContact CD1-CD1 3.68Å; Y480-Y527 HydrophobicContact CD1-CD1 3.68Å; Y480-Y527 HydrophobicContact CD1-CE1 4.17Å; Y480-Y527 HydrophobicContact CD2-CD1 4.25Å; Y480-Y527 HydrophobicContact CD2-CE1 4.02Å; Y480-Y527 AromaticContact CE1-CD1 3.89Å; Y480-Y527 HydrophobicContact CE1-CD1 3.89Å; Y480-Y527 HydrophobicContact CE1-CE1 4.1Å; Y480-Y527 HydrophobicContact CE2-CD1 4.42Å; Y480-Y527 AromaticContact CE2-CE1 3.94Å; Y480-Y527 HydrophobicContact CE2-CE1 3.94Å; Y480-Y527 AromaticContact CG-CD1 3.88Å; Y480-Y527 HydrophobicContact CG-CD1 3.88Å; Y480-Y527 HydrophobicContact CG-CE1 4.13Å; Y480-Y527 AromaticContact CZ-CE1 3.98Å; Y505-Y527 CarbonylContact C-O 3.52Å; Y505-Y527 PolarHBondContact O-N 3.4Å; S506-Y527 WeakPolarHBondContact CB-O 3.27Å; S506-Y527 PolarHBondContact N-O 3.35Å; Y527-G529 VanDerWaalsContact CZ-CA 3.43Å; Y527-G529 PolarHBondContact OH-O 2.71Å; Y527-S531 VanDerWaalsContact CD2-O 3.24Å; Y527-S531 WeakPolarHBondContact CD2-O 3.49Å; Y527-Y532 AromaticContact CD2-CD1 3.86Å; Y527-Y532 HydrophobicContact CD2-CD1 3.86Å; Y527-Y532 AromaticContact CD2-CD2 3.97Å; Y527-Y532 HydrophobicContact CD2-CD2 3.97Å; Y527-Y532 AromaticContact CD2-CE1 3.72Å; Y527-Y532 HydrophobicContact CD2-CE1 3.72Å; Y527-Y532 AromaticContact CD2-CE2 3.83Å; Y527-Y532 HydrophobicContact CD2-CE2 3.83Å; Y527-Y532 AromaticContact CD2-CG 3.98Å; Y527-Y532 HydrophobicContact CD2-CG 3.98Å; Y527-Y532 AromaticContact CD2-CZ 3.7Å; Y527-Y532 HydrophobicContact CE2-CD2 4.26Å; Y527-Y532 AromaticContact CE2-CE2 3.95Å; Y527-Y532 HydrophobicContact CE2-CE2 3.95Å; Y527-Y532 HydrophobicContact CG-CD1 4.22Å; Y527-Y532 AromaticContact CG-CE1 3.83Å; Y527-Y532 HydrophobicContact CG-CE1 3.83Å
528	N	94.4	Very high	96.2	Very high	44 Å²	44	34.8 Å²	34.8	24%	0.235	18%	0.184	C	C	.	.			trans	-103.5	1.3	-177.5	70.2	-9.9	0	0	0	114.2	Y505 E530 S531 L534	Y505-N528 HydrophobicContact CD1-CB 3.64Å; Y505-N528 HydrophobicContact CE1-CB 4.43Å; Y505-N528 HydrophobicContact CG-CB 4.12Å; N528-E530 PolarHBondContact OD1-N 3.3Å; N528-S531 PolarHBondContact N-O 2.93Å; N528-S531 PolarHBondContact OD1-N 2.83Å; N528-S531 PolarHBondContact OD1-O 3.4Å; N528-L534 HydrophobicContact CB-CD1 4.08Å; N528-L534 HydrophobicContact CB-CD2 3.88Å
529	G	94.3	Very high	96.9	Very high	30 Å²	30	34.1 Å²	34.1	31%	0.309	18%	0.18	S	C	.	.	S	Bend	trans	102.8	-10.6	-171.2	0	0	0	0	0	114.1	Y527	Y527-G529 VanDerWaalsContact CZ-CA 3.43Å; Y527-G529 PolarHBondContact OH-O 2.71Å
530	E	94.9	Very high	96.9	Very high	175 Å²	175	33 Å²	33	82%	0.818	18%	0.175	S	C	*	.	S	Bend	trans	-131.3	-44.2	-177.9	-62.6	179.4	174.1	0	0	112	N528	N528-E530 PolarHBondContact OD1-N 3.3Å
531	S	96.4	Very high	96.4	Very high	47 Å²	47	34.4 Å²	34.4	33%	0.329	18%	0.181	S	C	.	.			trans	-138.3	148.6	-171.7	-179.6	0	0	0	0	112.2	Y527 N528 S533	Y527-S531 VanDerWaalsContact CD2-O 3.24Å; Y527-S531 WeakPolarHBondContact CD2-O 3.49Å; N528-S531 PolarHBondContact N-O 2.93Å; N528-S531 PolarHBondContact OD1-N 2.83Å; N528-S531 PolarHBondContact OD1-O 3.4Å; S531-S533 PolarHBondContact OG-N 3.23Å
532	Y	97.6	Very high	95.3	Very high	89 Å²	89	37 Å²	37	35%	0.349	19%	0.193	S	C	.	.	S	Bend	trans	-91.3	-8.6	168	-66.9	-83.4	0	0	0	112.4	S526 Y527 L534 I556 G557 K578	S526-Y532 WeakPolarHBondContact O-CA 3.22Å; S526-Y532 VanDerWaalsContact O-CD1 3.23Å; S526-Y532 WeakPolarHBondContact O-CD1 3.29Å; Y527-Y532 AromaticContact CD2-CD1 3.86Å; Y527-Y532 HydrophobicContact CD2-CD1 3.86Å; Y527-Y532 AromaticContact CD2-CD2 3.97Å; Y527-Y532 HydrophobicContact CD2-CD2 3.97Å; Y527-Y532 AromaticContact CD2-CE1 3.72Å; Y527-Y532 HydrophobicContact CD2-CE1 3.72Å; Y527-Y532 AromaticContact CD2-CE2 3.83Å; Y527-Y532 HydrophobicContact CD2-CE2 3.83Å; Y527-Y532 AromaticContact CD2-CG 3.98Å; Y527-Y532 HydrophobicContact CD2-CG 3.98Å; Y527-Y532 AromaticContact CD2-CZ 3.7Å; Y527-Y532 HydrophobicContact CE2-CD2 4.26Å; Y527-Y532 AromaticContact CE2-CE2 3.95Å; Y527-Y532 HydrophobicContact CE2-CE2 3.95Å; Y527-Y532 HydrophobicContact CG-CD1 4.22Å; Y527-Y532 AromaticContact CG-CE1 3.83Å; Y527-Y532 HydrophobicContact CG-CE1 3.83Å; Y532-L534 PolarHBondContact O-N 2.81Å; Y532-I556 CarbonylContact O-C 3.43Å; Y532-I556 WeakPolarHBondContact O-CA 3.44Å; Y532-G557 PolarHBondContact O-N 2.91Å; Y532-K578 HydrophobicContact CD1-CD 4.2Å; Y532-K578 HydrophobicContact CD1-CG 3.82Å; Y532-K578 HydrophobicContact CD2-CD 4.39Å; Y532-K578 HydrophobicContact CD2-CG 4.39Å; Y532-K578 HydrophobicContact CE1-CD 4.3Å; Y532-K578 HydrophobicContact CE1-CG 4.39Å; Y532-K578 HydrophobicContact CE2-CD 4.48Å; Y532-K578 HydrophobicContact CG-CD 4.26Å; Y532-K578 HydrophobicContact CG-CG 3.83Å; Y532-K578 PolarHBondContact OH-NZ 2.84Å
533	S	97.6	Very high	93.9	Very high	83 Å²	83	37.4 Å²	37.4	58%	0.58	20%	0.198	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	96	175.7	-170.9	0	0	0	0	109.1	S531	S531-S533 PolarHBondContact OG-N 3.23Å
534	L	96.4	Very high	92	Very high	24 Å²	24	38.4 Å²	38.4	13%	0.126	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165.7	-171.9	-59.5	179.1	0	0	0	111	N525 N528 Y532 T555	N525-L534 HydrophobicContact CB-CB 4.48Å; N525-L534 HydrophobicContact CB-CD1 4.33Å; N528-L534 HydrophobicContact CB-CD1 4.08Å; N528-L534 HydrophobicContact CB-CD2 3.88Å; Y532-L534 PolarHBondContact O-N 2.81Å; L534-T555 PolarHBondContact N-O 2.98Å; L534-T555 CarbonylContact O-C 3.57Å; L534-T555 WeakPolarHBondContact O-CA 3.5Å; L534-T555 PolarHBondContact O-N 2.83Å; L534-T555 PolarHBondContact O-OG1 2.58Å
535	N	97.4	Very high	90.2	Very high	70 Å²	70	42.3 Å²	42.3	37%	0.374	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.2	167.3	-66.2	-43.6	0	0	0	110.3	N525 W552 L553 P554	N525-N535 WeakPolarHBondContact CB-O 3.09Å; N525-N535 PolarHBondContact ND2-O 2.89Å; N535-W552 HydrophobicContact CB-CB 4.02Å; N535-L553 CarbonylContact C-O 3.53Å; N535-L553 VanDerWaalsContact CA-O 3.3Å; N535-L553 WeakPolarHBondContact CA-O 3.39Å; N535-P554 WeakPolarHBondContact OD1-CA 3.44Å
536	S	98	Very high	89.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	144.8	152.5	-68.1	0	0	0	0	108.3	V523 L553 T555 C558 W561	V523-S536 WeakPolarHBondContact O-CA 3.14Å; V523-S536 WeakPolarHBondContact O-CB 3.03Å; V523-S536 PolarHBondContact O-OG 3Å; S536-L553 PolarHBondContact N-O 2.83Å; S536-L553 PolarHBondContact O-N 2.82Å; S536-T555 PolarHBondContact N-OG1 3.36Å; S536-T555 WeakPolarHBondContact OG-CG2 3.45Å; S536-T555 PolarHBondContact OG-OG1 3.35Å; S536-C558 PolarHBondContact OG-SG 3.07Å; S536-W561 PolarHBondContact OG-NE1 3.25Å
537	I	98	Very high	88.9	Confident	17 Å²	17	41.9 Å²	41.9	9%	0.087	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.7	-172.3	-55.3	177.5	0	0	0	108.8	V522 V523 Y539 P549	V522-I537 WeakPolarHBondContact CA-O 3.31Å; V523-I537 HydrophobicContact CG1-CB 4.17Å; V523-I537 PolarHBondContact N-O 3.43Å; V523-I537 VanDerWaalsContact N-O 3.11Å; I537-Y539 HydrophobicContact CB-CD2 4.44Å; I537-Y539 HydrophobicContact CB-CE2 3.63Å; I537-Y539 HydrophobicContact CG2-CD1 4.39Å; I537-Y539 HydrophobicContact CG2-CD2 4.11Å; I537-Y539 HydrophobicContact CG2-CE1 3.85Å; I537-Y539 HydrophobicContact CG2-CE2 3.56Å; I537-Y539 HydrophobicContact CG2-CG 4.48Å; I537-Y539 WeakPolarHBondContact O-CD2 3.18Å; I537-Y539 WeakPolarHBondContact O-CE2 3.32Å; I537-P549 HydrophobicContact CG2-CB 3.69Å
538	L	97.9	Very high	88.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.3	171.6	178.9	64.4	0	0	0	108.7	L226 V229 F513 F520 V522 V550 H551	L226-L538 HydrophobicContact CD2-CD2 3.49Å; L226-L538 VanDerWaalsContact CD2-CD2 3.49Å; V229-L538 HydrophobicContact CG2-CD2 4.33Å; F513-L538 HydrophobicContact CE1-CD1 3.66Å; F513-L538 HydrophobicContact CZ-CD1 3.53Å; F520-L538 HydrophobicContact CB-CD1 3.9Å; F520-L538 HydrophobicContact CD1-CD1 4.07Å; F520-L538 HydrophobicContact CD1-CD2 4.32Å; F520-L538 HydrophobicContact CD1-CG 4.15Å; F520-L538 HydrophobicContact CG-CD1 4.35Å; V522-L538 HydrophobicContact CB-CD1 4.02Å; L538-V550 HydrophobicContact CB-CG2 4.44Å; L538-V550 HydrophobicContact CD2-CG2 4.3Å; L538-V550 HydrophobicContact CG-CG2 4Å; L538-V550 VanDerWaalsContact O-CG2 3.25Å; L538-V550 WeakPolarHBondContact O-CG2 3.3Å; L538-V550 PolarHBondContact O-N 3.31Å; L538-H551 HydrophobicContact CB-CB 4.06Å; L538-H551 HydrophobicContact CD2-CB 4.38Å; L538-H551 PolarHBondContact N-O 3.36Å; L538-H551 PolarHBondContact O-N 2.74Å
539	Y	96.1	Very high	88	Confident	12 Å²	12	42 Å²	42	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.4	178.3	-56.6	-97.9	0	0	0	110.6	I502 W510 F520 L521 V523 I537 F547 V548 P549	I502-Y539 HydrophobicContact CD1-CD1 4.38Å; I502-Y539 HydrophobicContact CD1-CE1 4.39Å; I502-Y539 HydrophobicContact CG2-CE1 3.78Å; I502-Y539 HydrophobicContact CG2-CE2 4.22Å; I502-Y539 VanDerWaalsContact CG2-CZ 3.48Å; I502-Y539 WeakPolarHBondContact CG2-OH 3.44Å; W510-Y539 AromaticContact CH2-CD2 3.99Å; W510-Y539 HydrophobicContact CH2-CD2 3.99Å; W510-Y539 AromaticContact CH2-CE2 3.63Å; W510-Y539 HydrophobicContact CH2-CE2 3.63Å; W510-Y539 AromaticContact CZ3-CD2 3.77Å; W510-Y539 HydrophobicContact CZ3-CD2 3.77Å; W510-Y539 AromaticContact CZ3-CE2 3.81Å; W510-Y539 HydrophobicContact CZ3-CE2 3.81Å; F520-Y539 WeakPolarHBondContact CA-O 3.23Å; F520-Y539 WeakPolarHBondContact CB-O 3.47Å; F520-Y539 WeakPolarHBondContact CD1-O 3.5Å; L521-Y539 PolarHBondContact N-O 3.5Å; L521-Y539 PolarHBondContact O-N 2.9Å; V523-Y539 HydrophobicContact CG1-CE2 3.88Å; I537-Y539 HydrophobicContact CB-CD2 4.44Å; I537-Y539 HydrophobicContact CB-CE2 3.63Å; I537-Y539 HydrophobicContact CG2-CD1 4.39Å; I537-Y539 HydrophobicContact CG2-CD2 4.11Å; I537-Y539 HydrophobicContact CG2-CE1 3.85Å; I537-Y539 HydrophobicContact CG2-CE2 3.56Å; I537-Y539 HydrophobicContact CG2-CG 4.48Å; I537-Y539 WeakPolarHBondContact O-CD2 3.18Å; I537-Y539 WeakPolarHBondContact O-CE2 3.32Å; Y539-F547 HydrophobicContact CG-CB 4.43Å; Y539-V548 CarbonylContact C-O 3.56Å; Y539-V548 WeakPolarHBondContact CA-O 3.23Å; Y539-P549 HydrophobicContact CD1-CB 4Å; Y539-P549 HydrophobicContact CE1-CB 3.9Å; Y539-P549 HydrophobicContact CE1-CG 4.41Å
540	R	89.9	Confident	87.7	Confident	39 Å²	39	42.8 Å²	42.8	15%	0.147	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.2	173.3	-167.5	-179.8	92.7	157.1	14.6	110.2	E518 F520 Q542 F547 V548 V550	E518-R540 IonicContact OE1-CZ 3.18Å; E518-R540 VanDerWaalsContact OE1-CZ 3.28Å; E518-R540 IonicContact OE1-NE 3.45Å; E518-R540 IonicContact OE1-NH1 2.74Å; E518-R540 PolarHBondContact OE1-NH1 2.8Å; E518-R540 IonicContact OE1-NH2 3.34Å; E518-R540 IonicContact OE2-NH1 3.5Å; F520-R540 HydrophobicContact CD1-CB 3.97Å; F520-R540 HydrophobicContact CD1-CG 4.05Å; F520-R540 HydrophobicContact CE1-CB 3.77Å; F520-R540 HydrophobicContact CE1-CG 3.57Å; F520-R540 HydrophobicContact CZ-CG 3.92Å; R540-Q542 VanDerWaalsContact NH2-NE2 3.13Å; R540-F547 WeakPolarHBondContact O-CA 3.49Å; R540-V548 PolarHBondContact N-O 3.02Å; R540-V548 PolarHBondContact O-N 3.18Å; R540-V550 HydrophobicContact CB-CB 4.47Å; R540-V550 HydrophobicContact CB-CG1 3.59Å; R540-V550 HydrophobicContact CB-CG2 4.02Å
541	W	86.5	Confident	87.5	Confident	31 Å²	31	36.5 Å²	36.5	12%	0.117	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	129.3	170.9	-179.5	-107.4	0	0	0	111.8	I458 F463 F499 Y519 G543 F547	I458-W541 HydrophobicContact CD1-CB 4.19Å; I458-W541 HydrophobicContact CD1-CD2 3.42Å; I458-W541 VanDerWaalsContact CD1-CD2 3.42Å; I458-W541 HydrophobicContact CD1-CE3 3.64Å; I458-W541 HydrophobicContact CD1-CG 3.68Å; I458-W541 HydrophobicContact CD1-CH2 4.43Å; I458-W541 HydrophobicContact CD1-CZ2 4.27Å; I458-W541 HydrophobicContact CD1-CZ3 4.14Å; F463-W541 HydrophobicContact CE1-CH2 4.49Å; F463-W541 HydrophobicContact CZ-CH2 4Å; F499-W541 AromaticContact CE1-CH2 3.9Å; F499-W541 HydrophobicContact CE1-CH2 3.9Å; F499-W541 AromaticContact CE1-CZ3 3.7Å; F499-W541 HydrophobicContact CE1-CZ3 3.7Å; F499-W541 AromaticContact CZ-CH2 3.67Å; F499-W541 HydrophobicContact CZ-CH2 3.67Å; F499-W541 AromaticContact CZ-CZ3 3.95Å; F499-W541 HydrophobicContact CZ-CZ3 3.95Å; Y519-W541 WeakPolarHBondContact O-CB 3.48Å; Y519-W541 PolarHBondContact O-N 2.91Å; W541-G543 WeakPolarHBondContact CZ2-O 3.36Å; W541-F547 HydrophobicContact CB-CD1 4.35Å; W541-F547 HydrophobicContact CB-CE1 4Å; W541-F547 HydrophobicContact CB-CZ 4.34Å; W541-F547 AromaticContact CE3-CD2 3.66Å; W541-F547 HydrophobicContact CE3-CD2 3.66Å; W541-F547 HydrophobicContact CE3-CE1 4.44Å; W541-F547 AromaticContact CE3-CE2 3.47Å; W541-F547 HydrophobicContact CE3-CE2 3.47Å; W541-F547 VanDerWaalsContact CE3-CE2 3.47Å; W541-F547 HydrophobicContact CE3-CG 4.25Å; W541-F547 AromaticContact CE3-CZ 3.91Å; W541-F547 HydrophobicContact CE3-CZ 3.91Å; W541-F547 HydrophobicContact CZ3-CD2 4.02Å; W541-F547 AromaticContact CZ3-CE2 3.86Å; W541-F547 HydrophobicContact CZ3-CE2 3.86Å
542	Q	75.5	Confident	87.4	Confident	54 Å²	54	41 Å²	41	25%	0.252	20%	0.204	S	C	.	.			trans	-122.8	26.4	178.9	-62.8	-70.7	8.3	0	0	112.4	Q130 R540 Y544 E545 G546 V548	Q130-Q542 PolarHBondContact NE2-O 3.39Å; R540-Q542 VanDerWaalsContact NH2-NE2 3.13Å; Q542-Y544 PolarHBondContact O-N 3.2Å; Q542-E545 HydrophobicContact CB-CB 4.02Å; Q542-G546 PolarHBondContact N-O 3.33Å; Q542-V548 HydrophobicContact CB-CG1 4.41Å; Q542-V548 HydrophobicContact CG-CB 4.34Å; Q542-V548 HydrophobicContact CG-CG1 4Å; Q542-V548 HydrophobicContact CG-CG2 3.41Å; Q542-V548 VanDerWaalsContact CG-CG2 3.41Å
543	G	69.6	Low	87.3	Confident	10 Å²	10	37.3 Å²	37.3	10%	0.103	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	67.4	-108	-177.8	0	0	0	0	0	110.4	W541 E545 G546	W541-G543 WeakPolarHBondContact CZ2-O 3.36Å; G543-E545 PolarHBondContact O-N 3.34Å; G543-G546 PolarHBondContact O-N 2.95Å
544	Y	58.4	Low	87.2	Confident	21 Å²	21	37.7 Å²	37.7	8%	0.082	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-59.3	-42.6	-178.9	164.6	-123.9	0	0	0	113.8	V134 A139 Q142 L143 Q542 G546	V134-Y544 HydrophobicContact CG2-CE1 4.49Å; A139-Y544 WeakPolarHBondContact CA-OH 3.09Å; A139-Y544 HydrophobicContact CB-CE1 3.73Å; A139-Y544 WeakPolarHBondContact CB-OH 3.35Å; A139-Y544 PolarHBondContact O-OH 3.24Å; Q142-Y544 HydrophobicContact CB-CE2 3.45Å; Q142-Y544 VanDerWaalsContact CB-CE2 3.45Å; Q142-Y544 WeakPolarHBondContact CB-OH 3.5Å; Q142-Y544 PolarHBondContact OE1-OH 3.09Å; L143-Y544 VanDerWaalsContact CA-CE2 3.41Å; L143-Y544 HydrophobicContact CB-CD2 3.99Å; L143-Y544 HydrophobicContact CB-CE2 3.84Å; L143-Y544 HydrophobicContact CD1-CD1 4.07Å; L143-Y544 HydrophobicContact CD1-CD2 4.33Å; L143-Y544 HydrophobicContact CD1-CE1 3.9Å; L143-Y544 HydrophobicContact CD1-CE2 4.33Å; L143-Y544 HydrophobicContact CD1-CG 4.26Å; L143-Y544 HydrophobicContact CD2-CD1 3.96Å; L143-Y544 HydrophobicContact CD2-CD2 3.26Å; L143-Y544 HydrophobicContact CD2-CE1 4.43Å; L143-Y544 HydrophobicContact CD2-CE2 3.95Å; L143-Y544 HydrophobicContact CD2-CG 3.34Å; L143-Y544 HydrophobicContact CG-CD1 3.81Å; L143-Y544 HydrophobicContact CG-CD2 3.23Å; L143-Y544 HydrophobicContact CG-CE1 3.77Å; L143-Y544 HydrophobicContact CG-CE2 3.35Å; L143-Y544 HydrophobicContact CG-CG 3.55Å; Q542-Y544 PolarHBondContact O-N 3.2Å; Y544-G546 PolarHBondContact O-N 2.88Å
545	E	61.7	Low	87.3	Confident	81 Å²	81	36.7 Å²	36.7	38%	0.379	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-70.9	0.5	-178.3	-58.6	179.3	161.9	0	0	113.1	V132 Q542 G543 V548	V132-E545 WeakPolarHBondContact CG1-OE1 3.38Å; Q542-E545 HydrophobicContact CB-CB 4.02Å; G543-E545 PolarHBondContact O-N 3.34Å; E545-V548 HydrophobicContact CB-CG1 3.95Å
546	G	79.4	Confident	87.3	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.01	18%	0.183	C	C	.	.			trans	66.4	-142.4	-175.2	0	0	0	0	0	111.1	Q542 G543 Y544	Q542-G546 PolarHBondContact N-O 3.33Å; G543-G546 PolarHBondContact O-N 2.95Å; Y544-G546 PolarHBondContact O-N 2.88Å
547	F	88.3	Confident	87.3	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122	174.4	-77.5	-83.3	0	0	0	110.9	F456 I458 I486 Q500 I502 F512 L521 Y539 R540 W541	F456-F547 HydrophobicContact CD2-CZ 4.37Å; F456-F547 AromaticContact CE2-CE2 3.52Å; F456-F547 HydrophobicContact CE2-CE2 3.52Å; F456-F547 AromaticContact CE2-CZ 3.72Å; F456-F547 HydrophobicContact CE2-CZ 3.72Å; F456-F547 AromaticContact CZ-CE2 3.58Å; F456-F547 HydrophobicContact CZ-CE2 3.58Å; F456-F547 HydrophobicContact CZ-CZ 4.05Å; I458-F547 HydrophobicContact CD1-CE2 4.32Å; I458-F547 HydrophobicContact CD1-CZ 3.94Å; I486-F547 HydrophobicContact CD1-CD2 3.54Å; I486-F547 HydrophobicContact CD1-CE2 4.13Å; I486-F547 HydrophobicContact CD1-CG 4.34Å; Q500-F547 PolarHBondContact NE2-O 2.87Å; I502-F547 HydrophobicContact CD1-CB 4.23Å; F512-F547 HydrophobicContact CD2-CZ 4.48Å; F512-F547 HydrophobicContact CE2-CZ 4.26Å; L521-F547 HydrophobicContact CB-CD1 4.05Å; L521-F547 HydrophobicContact CB-CE1 4Å; L521-F547 HydrophobicContact CD1-CD1 3.91Å; L521-F547 HydrophobicContact CD1-CD2 3.67Å; L521-F547 HydrophobicContact CD1-CE1 3.75Å; L521-F547 HydrophobicContact CD1-CE2 3.49Å; L521-F547 VanDerWaalsContact CD1-CE2 3.49Å; L521-F547 HydrophobicContact CD1-CG 3.86Å; L521-F547 HydrophobicContact CD1-CZ 3.52Å; L521-F547 HydrophobicContact CG-CD1 4.04Å; L521-F547 HydrophobicContact CG-CE1 3.61Å; L521-F547 HydrophobicContact CG-CE2 4.2Å; L521-F547 HydrophobicContact CG-CG 4.49Å; L521-F547 HydrophobicContact CG-CZ 3.68Å; Y539-F547 HydrophobicContact CG-CB 4.43Å; R540-F547 WeakPolarHBondContact O-CA 3.49Å; W541-F547 HydrophobicContact CB-CD1 4.35Å; W541-F547 HydrophobicContact CB-CE1 4Å; W541-F547 HydrophobicContact CB-CZ 4.34Å; W541-F547 AromaticContact CE3-CD2 3.66Å; W541-F547 HydrophobicContact CE3-CD2 3.66Å; W541-F547 HydrophobicContact CE3-CE1 4.44Å; W541-F547 AromaticContact CE3-CE2 3.47Å; W541-F547 HydrophobicContact CE3-CE2 3.47Å; W541-F547 VanDerWaalsContact CE3-CE2 3.47Å; W541-F547 HydrophobicContact CE3-CG 4.25Å; W541-F547 AromaticContact CE3-CZ 3.91Å; W541-F547 HydrophobicContact CE3-CZ 3.91Å; W541-F547 HydrophobicContact CZ3-CD2 4.02Å; W541-F547 AromaticContact CZ3-CE2 3.86Å; W541-F547 HydrophobicContact CZ3-CE2 3.86Å
548	V	84.5	Confident	87.3	Confident	33 Å²	33	35.6 Å²	35.6	20%	0.2	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.4	177.6	-52.3	0	0	0	0	110.5	Y539 R540 Q542 E545 V550	Y539-V548 CarbonylContact C-O 3.56Å; Y539-V548 WeakPolarHBondContact CA-O 3.23Å; R540-V548 PolarHBondContact N-O 3.02Å; R540-V548 PolarHBondContact O-N 3.18Å; Q542-V548 HydrophobicContact CB-CG1 4.41Å; Q542-V548 HydrophobicContact CG-CB 4.34Å; Q542-V548 HydrophobicContact CG-CG1 4Å; Q542-V548 HydrophobicContact CG-CG2 3.41Å; Q542-V548 VanDerWaalsContact CG-CG2 3.41Å; E545-V548 HydrophobicContact CB-CG1 3.95Å; V548-V550 HydrophobicContact CG2-CG1 4.42Å; V548-V550 PolarHBondContact O-N 2.8Å
549	P	88.6	Confident	87.3	Confident	61 Å²	61	36.3 Å²	36.3	40%	0.396	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	134.6	-179	28.1	-35	0	0	0	110.5	I537 Y539 W552	I537-P549 HydrophobicContact CG2-CB 3.69Å; Y539-P549 HydrophobicContact CD1-CB 4Å; Y539-P549 HydrophobicContact CE1-CB 3.9Å; Y539-P549 HydrophobicContact CE1-CG 4.41Å; P549-W552 HydrophobicContact CB-CH2 4.11Å; P549-W552 HydrophobicContact CB-CZ2 3.82Å; P549-W552 HydrophobicContact CG-CH2 4.39Å; P549-W552 HydrophobicContact CG-CZ2 4.13Å
550	V	89.7	Confident	87.4	Confident	47 Å²	47	36.4 Å²	36.4	29%	0.285	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	-26.6	179	-68.8	0	0	0	0	113.2	F520 L538 R540 V548	F520-V550 HydrophobicContact CD1-CG2 4.47Å; F520-V550 HydrophobicContact CE1-CG2 4.34Å; L538-V550 HydrophobicContact CB-CG2 4.44Å; L538-V550 HydrophobicContact CD2-CG2 4.3Å; L538-V550 HydrophobicContact CG-CG2 4Å; L538-V550 VanDerWaalsContact O-CG2 3.25Å; L538-V550 WeakPolarHBondContact O-CG2 3.3Å; L538-V550 PolarHBondContact O-N 3.31Å; R540-V550 HydrophobicContact CB-CB 4.47Å; R540-V550 HydrophobicContact CB-CG1 3.59Å; R540-V550 HydrophobicContact CB-CG2 4.02Å; V548-V550 HydrophobicContact CG2-CG1 4.42Å; V548-V550 PolarHBondContact O-N 2.8Å
551	H	89.9	Confident	87.8	Confident	43 Å²	43	34.6 Å²	34.6	20%	0.199	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	149.7	174.4	-63	78.4	0	0	0	111.8	L538 L553	L538-H551 HydrophobicContact CB-CB 4.06Å; L538-H551 HydrophobicContact CD2-CB 4.38Å; L538-H551 PolarHBondContact N-O 3.36Å; L538-H551 PolarHBondContact O-N 2.74Å; H551-L553 HydrophobicContact CB-CD2 4.44Å
552	W	93.8	Very high	88.4	Confident	141 Å²	141	34.7 Å²	34.7	53%	0.534	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.3	172.3	-68.1	-97.8	0	0	0	108	N535 P549 P554	N535-W552 HydrophobicContact CB-CB 4.02Å; P549-W552 HydrophobicContact CB-CH2 4.11Å; P549-W552 HydrophobicContact CB-CZ2 3.82Å; P549-W552 HydrophobicContact CG-CH2 4.39Å; P549-W552 HydrophobicContact CG-CZ2 4.13Å; W552-P554 WeakPolarHBondContact O-CD 3.39Å
553	L	96.3	Very high	89.5	Confident	11 Å²	11	34.3 Å²	34.3	6%	0.058	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.5	-174.7	-57.5	177.7	0	0	0	108.6	V229 N535 S536 H551 T555 W561	V229-L553 HydrophobicContact CB-CD2 4.24Å; V229-L553 HydrophobicContact CG1-CD2 3.96Å; N535-L553 CarbonylContact C-O 3.53Å; N535-L553 VanDerWaalsContact CA-O 3.3Å; N535-L553 WeakPolarHBondContact CA-O 3.39Å; S536-L553 PolarHBondContact N-O 2.83Å; S536-L553 PolarHBondContact O-N 2.82Å; H551-L553 HydrophobicContact CB-CD2 4.44Å; L553-T555 PolarHBondContact O-N 2.95Å; L553-W561 HydrophobicContact CB-CH2 4.41Å; L553-W561 HydrophobicContact CB-CZ2 4.34Å; L553-W561 HydrophobicContact CD1-CH2 3.58Å; L553-W561 HydrophobicContact CD1-CZ2 3.92Å; L553-W561 HydrophobicContact CD1-CZ3 4.32Å
554	P	96.1	Very high	90.8	Very high	92 Å²	92	34.3 Å²	34.3	60%	0.597	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	119.3	177.7	-23.1	34.2	0	0	0	111.2	N535 W552	N535-P554 WeakPolarHBondContact OD1-CA 3.44Å; W552-P554 WeakPolarHBondContact O-CD 3.39Å
555	T	97.8	Very high	92.5	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157.3	-178	53.2	0	0	0	0	110.7	L534 S536 L553 C558 W561 Y574	L534-T555 PolarHBondContact N-O 2.98Å; L534-T555 CarbonylContact O-C 3.57Å; L534-T555 WeakPolarHBondContact O-CA 3.5Å; L534-T555 PolarHBondContact O-N 2.83Å; L534-T555 PolarHBondContact O-OG1 2.58Å; S536-T555 PolarHBondContact N-OG1 3.36Å; S536-T555 WeakPolarHBondContact OG-CG2 3.45Å; S536-T555 PolarHBondContact OG-OG1 3.35Å; L553-T555 PolarHBondContact O-N 2.95Å; T555-C558 HydrophobicContact CG2-CB 4.37Å; T555-W561 HydrophobicContact CG2-CZ2 3.76Å; T555-Y574 HydrophobicContact CG2-CD1 4.2Å; T555-Y574 HydrophobicContact CG2-CD2 3.92Å; T555-Y574 HydrophobicContact CG2-CE1 3.94Å; T555-Y574 HydrophobicContact CG2-CE2 3.78Å; T555-Y574 HydrophobicContact CG2-CG 4.12Å
556	I	97.6	Very high	93.9	Very high	64 Å²	64	33.4 Å²	33.4	33%	0.328	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	112	177.3	-59.6	177.3	0	0	0	107.8	Y532 C558 S576 K578 F581	Y532-I556 CarbonylContact O-C 3.43Å; Y532-I556 WeakPolarHBondContact O-CA 3.44Å; I556-C558 PolarHBondContact O-N 2.97Å; I556-S576 WeakPolarHBondContact O-CB 3.41Å; I556-S576 PolarHBondContact O-OG 2.91Å; I556-K578 HydrophobicContact CG2-CB 4.22Å; I556-F581 HydrophobicContact CD1-CE1 4.35Å; I556-F581 HydrophobicContact CD1-CZ 4.1Å
557	G	97.3	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	48.3	49.4	-179	0	0	0	0	0	111.2	Y532 S559 A577	Y532-G557 PolarHBondContact O-N 2.91Å; G557-S559 PolarHBondContact O-N 2.95Å; G557-A577 PolarHBondContact O-N 2.79Å
558	C	98.3	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	129.9	-178.9	-160.2	0	0	0	0	108.3	V508 A524 S526 S536 T555 I556 W561 Y574	V508-C558 VanDerWaalsContact CG2-O 3.25Å; V508-C558 WeakPolarHBondContact CG2-O 3.3Å; A524-C558 HydrophobicContact CB-CB 4.09Å; S526-C558 VanDerWaalsContact CB-O 3.24Å; S526-C558 WeakPolarHBondContact CB-O 3.07Å; S526-C558 PolarHBondContact OG-O 3.04Å; S536-C558 PolarHBondContact OG-SG 3.07Å; T555-C558 HydrophobicContact CG2-CB 4.37Å; I556-C558 PolarHBondContact O-N 2.97Å; C558-W561 PolarHBondContact SG-NE1 3.43Å; C558-Y574 HydrophobicContact CB-CD2 4.39Å; C558-Y574 VanDerWaalsContact SG-CD2 3.59Å
559	S	97.6	Very high	94.5	Very high	16 Å²	16	46.1 Å²	46.1	11%	0.112	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-24.3	-179.2	36.1	0	0	0	0	113.3	T241 H242 V508 G557 S575 A577	T241-S559 PolarHBondContact O-OG 2.8Å; H242-S559 VanDerWaalsContact O-CB 3.32Å; H242-S559 WeakPolarHBondContact O-CB 3.12Å; V508-S559 WeakPolarHBondContact CG2-O 3.4Å; G557-S559 PolarHBondContact O-N 2.95Å; S559-S575 PolarHBondContact N-O 3.38Å; S559-S575 VanDerWaalsContact OG-C 3.31Å; S559-S575 PolarHBondContact OG-O 2.77Å; S559-S575 VanDerWaalsContact OG-O 3.08Å; S559-S575 PolarHBondContact OG-OG 3.16Å; S559-A577 PolarHBondContact OG-N 2.89Å
560	D	98.6	Very high	94.8	Very high	14 Å²	14	44.3 Å²	44.3	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	150.8	-171.6	-166.2	14.7	0	0	0	111	D243 V244 Y574 S575	D243-D560 WeakPolarHBondContact CA-OD2 3.42Å; V244-D560 HydrophobicContact CG1-CB 4.34Å; V244-D560 WeakPolarHBondContact CG1-OD2 3.3Å; V244-D560 PolarHBondContact N-OD2 2.99Å; V244-D560 VanDerWaalsContact O-OD2 3.1Å; D560-Y574 WeakPolarHBondContact O-CA 3.39Å; D560-Y574 WeakPolarHBondContact O-CB 3.25Å; D560-S575 VanDerWaalsContact CB-OG 3.23Å; D560-S575 WeakPolarHBondContact CB-OG 3.31Å; D560-S575 PolarHBondContact N-OG 3.26Å; D560-S575 PolarHBondContact O-N 2.91Å; D560-S575 VanDerWaalsContact O-N 3.09Å
561	W	98.6	Very high	95.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	138.4	171.9	-80.7	102.7	0	0	0	111.1	D509 E511 V522 S536 L553 T555 C558 L572 I573 Y574 F585	D509-W561 PolarHBondContact OD2-N 2.74Å; E511-W561 HydrophobicContact CB-CB 3.91Å; E511-W561 WeakPolarHBondContact CB-O 3.44Å; E511-W561 HydrophobicContact CG-CB 4.49Å; V522-W561 HydrophobicContact CG1-CB 3.78Å; V522-W561 HydrophobicContact CG1-CD2 4.21Å; V522-W561 HydrophobicContact CG1-CG 3.82Å; V522-W561 HydrophobicContact CG2-CD2 3.95Å; V522-W561 HydrophobicContact CG2-CG 4.05Å; V522-W561 HydrophobicContact CG2-CZ2 4.38Å; S536-W561 PolarHBondContact OG-NE1 3.25Å; L553-W561 HydrophobicContact CB-CH2 4.41Å; L553-W561 HydrophobicContact CB-CZ2 4.34Å; L553-W561 HydrophobicContact CD1-CH2 3.58Å; L553-W561 HydrophobicContact CD1-CZ2 3.92Å; L553-W561 HydrophobicContact CD1-CZ3 4.32Å; T555-W561 HydrophobicContact CG2-CZ2 3.76Å; C558-W561 PolarHBondContact SG-NE1 3.43Å; W561-L572 HydrophobicContact CE3-CB 3.87Å; W561-L572 HydrophobicContact CE3-CD1 4.45Å; W561-L572 HydrophobicContact CZ3-CB 3.69Å; W561-L572 HydrophobicContact CZ3-CD1 4.31Å; W561-I573 CarbonylContact C-O 3.56Å; W561-I573 WeakPolarHBondContact CA-O 3.48Å; W561-Y574 AromaticContact CH2-CD1 3.9Å; W561-Y574 HydrophobicContact CH2-CD1 3.9Å; W561-Y574 HydrophobicContact CH2-CG 4.12Å; W561-Y574 HydrophobicContact CZ2-CD1 4.22Å; W561-Y574 HydrophobicContact CZ2-CG 4.07Å; W561-Y574 HydrophobicContact CZ3-CD1 4.33Å; W561-Y574 HydrophobicContact CZ3-CG 4.46Å; W561-F585 AromaticContact CH2-CD2 3.78Å; W561-F585 HydrophobicContact CH2-CD2 3.78Å; W561-F585 AromaticContact CH2-CE2 3.54Å; W561-F585 HydrophobicContact CH2-CE2 3.54Å; W561-F585 AromaticContact CZ3-CD2 3.75Å; W561-F585 HydrophobicContact CZ3-CD2 3.75Å; W561-F585 AromaticContact CZ3-CE2 3.95Å; W561-F585 HydrophobicContact CZ3-CE2 3.95Å
562	E	98.5	Very high	95.6	Very high	34 Å²	34	40.2 Å²	40.2	16%	0.159	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.4	175.9	-80	-77.8	-173.7	0	0	111	V244 V246 L572 I573	V244-E562 HydrophobicContact CG1-CB 4.44Å; V244-E562 HydrophobicContact CG1-CG 3.93Å; V244-E562 WeakPolarHBondContact O-CG 3.33Å; V244-E562 VanDerWaalsContact O-OE1 3.06Å; V246-E562 HydrophobicContact CB-CB 4.45Å; V246-E562 HydrophobicContact CG2-CB 3.75Å; V246-E562 HydrophobicContact CG2-CG 4.01Å; E562-L572 CarbonylContact O-C 3.5Å; E562-L572 VanDerWaalsContact O-CA 3.3Å; E562-L572 WeakPolarHBondContact O-CA 3.24Å; E562-I573 HydrophobicContact CB-CG2 3.64Å; E562-I573 PolarHBondContact N-O 2.85Å; E562-I573 PolarHBondContact O-N 2.9Å
563	F	98.3	Very high	95.8	Very high	46 Å²	46	33.5 Å²	33.5	20%	0.202	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135.3	169.8	175.7	-96.2	0	0	0	112.1	E511 F513 L515 F571 L572 L587	E511-F563 HydrophobicContact CG-CB 4.26Å; E511-F563 VanDerWaalsContact OE1-CB 3.27Å; E511-F563 WeakPolarHBondContact OE1-CB 3.35Å; E511-F563 PolarHBondContact OE1-N 2.93Å; F513-F563 HydrophobicContact CB-CB 3.73Å; F513-F563 HydrophobicContact CB-CD1 3.7Å; F513-F563 HydrophobicContact CB-CD2 3.6Å; F513-F563 HydrophobicContact CB-CE1 4.17Å; F513-F563 HydrophobicContact CB-CE2 4.04Å; F513-F563 HydrophobicContact CB-CG 3.38Å; F513-F563 HydrophobicContact CB-CZ 4.31Å; F513-F563 HydrophobicContact CD1-CB 4.27Å; F513-F563 HydrophobicContact CD1-CD2 4.15Å; F513-F563 HydrophobicContact CD1-CG 4.41Å; F513-F563 AromaticContact CD2-CD2 3.47Å; F513-F563 HydrophobicContact CD2-CD2 3.47Å; F513-F563 VanDerWaalsContact CD2-CD2 3.47Å; F513-F563 AromaticContact CD2-CE2 3.48Å; F513-F563 HydrophobicContact CD2-CE2 3.48Å; F513-F563 VanDerWaalsContact CD2-CE2 3.48Å; F513-F563 HydrophobicContact CD2-CG 4.2Å; F513-F563 HydrophobicContact CD2-CZ 4.25Å; F513-F563 HydrophobicContact CE2-CD2 4.13Å; F513-F563 HydrophobicContact CE2-CE2 4.14Å; F513-F563 HydrophobicContact CG-CB 4.08Å; F513-F563 HydrophobicContact CG-CD1 4.49Å; F513-F563 AromaticContact CG-CD2 3.47Å; F513-F563 HydrophobicContact CG-CD2 3.47Å; F513-F563 VanDerWaalsContact CG-CD2 3.47Å; F513-F563 AromaticContact CG-CE2 3.93Å; F513-F563 HydrophobicContact CG-CE2 3.93Å; F513-F563 AromaticContact CG-CG 3.77Å; F513-F563 HydrophobicContact CG-CG 3.77Å; L515-F563 HydrophobicContact CD2-CE2 4.07Å; L515-F563 HydrophobicContact CD2-CZ 4.28Å; F563-F571 WeakPolarHBondContact CD2-O 3.41Å; F563-L572 HydrophobicContact CB-CD2 3.92Å; F563-L572 HydrophobicContact CD2-CD2 4.04Å; F563-L572 HydrophobicContact CG-CD2 4.5Å; F563-L587 HydrophobicContact CD2-CD1 4.08Å; F563-L587 HydrophobicContact CE2-CD1 3.81Å
564	F	97.8	Very high	95.9	Very high	9 Å²	9	33.1 Å²	33.1	4%	0.039	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	160.8	171.7	67.4	-86.3	0	0	0	113	V246 L254 W272 F277 F571 I573 V584	V246-F564 HydrophobicContact CG1-CB 3.76Å; V246-F564 HydrophobicContact CG1-CD1 4.24Å; V246-F564 HydrophobicContact CG1-CG 4.05Å; V246-F564 HydrophobicContact CG2-CD1 4.38Å; L254-F564 HydrophobicContact CD2-CB 4.27Å; L254-F564 HydrophobicContact CD2-CD2 3.24Å; L254-F564 HydrophobicContact CD2-CE2 3.69Å; L254-F564 HydrophobicContact CD2-CG 3.94Å; W272-F564 HydrophobicContact CD2-CE2 4.22Å; W272-F564 HydrophobicContact CE3-CE2 4.14Å; W272-F564 HydrophobicContact CE3-CZ 4.17Å; W272-F564 HydrophobicContact CH2-CE2 4.15Å; W272-F564 HydrophobicContact CH2-CZ 4.09Å; W272-F564 HydrophobicContact CZ2-CE2 4.23Å; W272-F564 HydrophobicContact CZ3-CE2 4.11Å; W272-F564 AromaticContact CZ3-CZ 3.85Å; W272-F564 HydrophobicContact CZ3-CZ 3.85Å; F277-F564 AromaticContact CE2-CE1 3.89Å; F277-F564 HydrophobicContact CE2-CE1 3.89Å; F277-F564 HydrophobicContact CE2-CE2 4.35Å; F277-F564 AromaticContact CE2-CZ 3.63Å; F277-F564 HydrophobicContact CE2-CZ 3.63Å; F277-F564 HydrophobicContact CZ-CE1 4.33Å; F277-F564 HydrophobicContact CZ-CE2 4.42Å; F277-F564 HydrophobicContact CZ-CZ 4.08Å; F564-F571 HydrophobicContact CD1-CB 4.11Å; F564-F571 HydrophobicContact CD2-CB 4.03Å; F564-F571 HydrophobicContact CD2-CD2 4.07Å; F564-F571 HydrophobicContact CD2-CG 4.39Å; F564-F571 HydrophobicContact CE1-CB 3.64Å; F564-F571 HydrophobicContact CE2-CB 3.59Å; F564-F571 AromaticContact CE2-CD2 3.69Å; F564-F571 HydrophobicContact CE2-CD2 3.69Å; F564-F571 AromaticContact CE2-CG 3.76Å; F564-F571 HydrophobicContact CE2-CG 3.76Å; F564-F571 HydrophobicContact CG-CB 4.3Å; F564-F571 HydrophobicContact CZ-CB 3.38Å; F564-F571 HydrophobicContact CZ-CD2 4.3Å; F564-F571 AromaticContact CZ-CG 3.88Å; F564-F571 HydrophobicContact CZ-CG 3.88Å; F564-F571 PolarHBondContact N-O 3.41Å; F564-F571 PolarHBondContact O-N 2.8Å; F564-I573 HydrophobicContact CD1-CG2 4.22Å; F564-I573 HydrophobicContact CE1-CB 4.09Å; F564-I573 HydrophobicContact CE1-CG2 3.94Å; F564-V584 HydrophobicContact CE1-CG1 4.26Å; F564-V584 HydrophobicContact CZ-CG1 3.84Å
565	S	94.4	Very high	96	Very high	66 Å²	66	28.7 Å²	28.7	46%	0.462	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.2	174.8	-67	0	0	0	0	111.4	E569 S570	S565-E569 CarbonylContact C-O 3.19Å; S565-E569 WeakPolarHBondContact CA-O 3.3Å; S565-E569 WeakPolarHBondContact CB-O 3.45Å; S565-S570 PolarHBondContact OG-OG 3.1Å
566	S	91.5	Very high	96	Very high	18 Å²	18	28.6 Å²	28.6	13%	0.126	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	128.6	178.7	-170.5	0	0	0	0	110	W272 G568 E569	W272-S566 PolarHBondContact NE1-OG 2.97Å; S566-G568 PolarHBondContact O-N 3.17Å; S566-E569 PolarHBondContact N-O 3.4Å; S566-E569 PolarHBondContact O-N 3.09Å
567	N	87.7	Confident	96	Very high	159 Å²	159	26.3 Å²	26.3	85%	0.85	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	36.6	-179.4	-58.3	-36	0	0	0	114.3	E569	N567-E569 VanDerWaalsContact C-N 3.25Å; N567-E569 PolarHBondContact O-N 3Å
568	G	85.2	Confident	96	Very high	69 Å²	69	31 Å²	31	71%	0.711	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.4	3.3	179.8	0	0	0	0	0	115	S566	S566-G568 PolarHBondContact O-N 3.17Å
569	E	91.2	Very high	96	Very high	77 Å²	77	31.6 Å²	31.6	36%	0.36	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	152	172.5	-55.3	-168.8	119.8	0	0	110.4	S565 S566 N567 F571 K586 K588	S565-E569 CarbonylContact C-O 3.19Å; S565-E569 WeakPolarHBondContact CA-O 3.3Å; S565-E569 WeakPolarHBondContact CB-O 3.45Å; S566-E569 PolarHBondContact N-O 3.4Å; S566-E569 PolarHBondContact O-N 3.09Å; N567-E569 VanDerWaalsContact C-N 3.25Å; N567-E569 PolarHBondContact O-N 3Å; E569-F571 HydrophobicContact CB-CE2 3.68Å; E569-F571 HydrophobicContact CB-CZ 3.86Å; E569-K586 WeakPolarHBondContact OE1-CE 3.29Å; E569-K586 IonicContact OE1-NZ 2.63Å; E569-K586 PolarHBondContact OE1-NZ 3.35Å; E569-K586 VanDerWaalsContact OE2-CE 3.23Å; E569-K586 WeakPolarHBondContact OE2-CE 3.35Å; E569-K586 IonicContact OE2-NZ 3.72Å; E569-K586 PolarHBondContact OE2-NZ 2.85Å; E569-K588 IonicContact OE1-NZ 3.55Å
570	S	95.3	Very high	95.9	Very high	22 Å²	22	34.2 Å²	34.2	15%	0.154	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.8	-176.7	-59.1	0	0	0	0	111.3	S565 L587	S565-S570 PolarHBondContact OG-OG 3.1Å; S570-L587 PolarHBondContact O-N 3.11Å
571	F	97.9	Very high	95.9	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.022	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	156	-172.6	-57.4	-93	0	0	0	110.7	Q232 W272 F563 F564 E569 V584 F585 K586	Q232-F571 HydrophobicContact CG-CE1 4.21Å; W272-F571 HydrophobicContact CH2-CD1 4.25Å; W272-F571 HydrophobicContact CH2-CE1 4.2Å; W272-F571 HydrophobicContact CZ2-CD1 4.45Å; W272-F571 HydrophobicContact CZ2-CE1 4.08Å; W272-F571 HydrophobicContact CZ2-CE2 4.22Å; W272-F571 AromaticContact CZ2-CZ 3.97Å; W272-F571 HydrophobicContact CZ2-CZ 3.97Å; F563-F571 WeakPolarHBondContact CD2-O 3.41Å; F564-F571 HydrophobicContact CD1-CB 4.11Å; F564-F571 HydrophobicContact CD2-CB 4.03Å; F564-F571 HydrophobicContact CD2-CD2 4.07Å; F564-F571 HydrophobicContact CD2-CG 4.39Å; F564-F571 HydrophobicContact CE1-CB 3.64Å; F564-F571 HydrophobicContact CE2-CB 3.59Å; F564-F571 AromaticContact CE2-CD2 3.69Å; F564-F571 HydrophobicContact CE2-CD2 3.69Å; F564-F571 AromaticContact CE2-CG 3.76Å; F564-F571 HydrophobicContact CE2-CG 3.76Å; F564-F571 HydrophobicContact CG-CB 4.3Å; F564-F571 HydrophobicContact CZ-CB 3.38Å; F564-F571 HydrophobicContact CZ-CD2 4.3Å; F564-F571 AromaticContact CZ-CG 3.88Å; F564-F571 HydrophobicContact CZ-CG 3.88Å; F564-F571 PolarHBondContact N-O 3.41Å; F564-F571 PolarHBondContact O-N 2.8Å; E569-F571 HydrophobicContact CB-CE2 3.68Å; E569-F571 HydrophobicContact CB-CZ 3.86Å; F571-V584 HydrophobicContact CB-CG1 4.21Å; F571-V584 HydrophobicContact CD1-CG1 4.07Å; F571-V584 HydrophobicContact CG-CG1 4.5Å; F571-F585 CarbonylContact C-O 3.58Å; F571-F585 WeakPolarHBondContact CA-O 3.44Å; F571-F585 WeakPolarHBondContact CB-O 3.35Å; F571-K586 HydrophobicContact CD1-CB 3.84Å; F571-K586 HydrophobicContact CD1-CG 4.1Å; F571-K586 HydrophobicContact CE1-CB 3.79Å; F571-K586 HydrophobicContact CE1-CD 3.85Å; F571-K586 HydrophobicContact CE1-CG 3.71Å; F571-K586 HydrophobicContact CZ-CD 4.33Å; F571-K586 HydrophobicContact CZ-CG 4.34Å
572	L	98.4	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.7	163.6	-69.4	170.7	0	0	0	108.5	F513 V522 W561 E562 F563 V584 F585 L587	F513-L572 HydrophobicContact CD1-CD2 4.06Å; F513-L572 HydrophobicContact CE1-CD1 4.13Å; F513-L572 HydrophobicContact CE1-CD2 3.77Å; F513-L572 HydrophobicContact CE1-CG 4.44Å; F513-L572 HydrophobicContact CZ-CD1 4.07Å; F513-L572 HydrophobicContact CZ-CD2 4.21Å; F513-L572 HydrophobicContact CZ-CG 4.46Å; V522-L572 HydrophobicContact CG1-CD2 4.47Å; W561-L572 HydrophobicContact CE3-CB 3.87Å; W561-L572 HydrophobicContact CE3-CD1 4.45Å; W561-L572 HydrophobicContact CZ3-CB 3.69Å; W561-L572 HydrophobicContact CZ3-CD1 4.31Å; E562-L572 CarbonylContact O-C 3.5Å; E562-L572 VanDerWaalsContact O-CA 3.3Å; E562-L572 WeakPolarHBondContact O-CA 3.24Å; F563-L572 HydrophobicContact CB-CD2 3.92Å; F563-L572 HydrophobicContact CD2-CD2 4.04Å; F563-L572 HydrophobicContact CG-CD2 4.5Å; L572-V584 CarbonylContact O-C 3.47Å; L572-V584 WeakPolarHBondContact O-CA 3.1Å; L572-F585 HydrophobicContact CB-CB 4.48Å; L572-F585 PolarHBondContact N-O 3.26Å; L572-F585 PolarHBondContact O-N 3.21Å; L572-L587 HydrophobicContact CD1-CD1 4.46Å; L572-L587 HydrophobicContact CD1-CD2 3.92Å; L572-L587 HydrophobicContact CG-CD1 4.1Å; L572-L587 HydrophobicContact CG-CD2 4.14Å; L572-L587 HydrophobicContact CG-CG 4.42Å
573	I	98.6	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.7	165.4	-177.8	171	0	0	0	108.9	V244 V246 M258 F277 W561 E562 F564 K583 V584	V244-I573 HydrophobicContact CG1-CG2 4.33Å; V244-I573 HydrophobicContact CG2-CD1 4.26Å; V244-I573 HydrophobicContact CG2-CG2 4.34Å; V246-I573 HydrophobicContact CG2-CG2 3.9Å; M258-I573 HydrophobicContact CE-CD1 3.55Å; F277-I573 HydrophobicContact CD2-CD1 3.97Å; F277-I573 HydrophobicContact CE2-CD1 3.96Å; W561-I573 CarbonylContact C-O 3.56Å; W561-I573 WeakPolarHBondContact CA-O 3.48Å; E562-I573 HydrophobicContact CB-CG2 3.64Å; E562-I573 PolarHBondContact N-O 2.85Å; E562-I573 PolarHBondContact O-N 2.9Å; F564-I573 HydrophobicContact CD1-CG2 4.22Å; F564-I573 HydrophobicContact CE1-CB 4.09Å; F564-I573 HydrophobicContact CE1-CG2 3.94Å; I573-K583 VanDerWaalsContact CA-O 3.3Å; I573-K583 WeakPolarHBondContact CA-O 3.47Å; I573-V584 HydrophobicContact CB-CG2 4.27Å; I573-V584 HydrophobicContact CD1-CG2 3.91Å; I573-V584 HydrophobicContact CG1-CG2 4.07Å
574	Y	98	Very high	95.8	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	152.6	167.6	88.2	-81.4	0	0	0	111.8	T555 C558 D560 W561 F581 S582 K583 F585	T555-Y574 HydrophobicContact CG2-CD1 4.2Å; T555-Y574 HydrophobicContact CG2-CD2 3.92Å; T555-Y574 HydrophobicContact CG2-CE1 3.94Å; T555-Y574 HydrophobicContact CG2-CE2 3.78Å; T555-Y574 HydrophobicContact CG2-CG 4.12Å; C558-Y574 HydrophobicContact CB-CD2 4.39Å; C558-Y574 VanDerWaalsContact SG-CD2 3.59Å; D560-Y574 WeakPolarHBondContact O-CA 3.39Å; D560-Y574 WeakPolarHBondContact O-CB 3.25Å; W561-Y574 AromaticContact CH2-CD1 3.9Å; W561-Y574 HydrophobicContact CH2-CD1 3.9Å; W561-Y574 HydrophobicContact CH2-CG 4.12Å; W561-Y574 HydrophobicContact CZ2-CD1 4.22Å; W561-Y574 HydrophobicContact CZ2-CG 4.07Å; W561-Y574 HydrophobicContact CZ3-CD1 4.33Å; W561-Y574 HydrophobicContact CZ3-CG 4.46Å; Y574-F581 WeakPolarHBondContact OH-CE2 3.32Å; Y574-S582 VanDerWaalsContact O-CA 3.29Å; Y574-S582 WeakPolarHBondContact O-CA 3.4Å; Y574-S582 WeakPolarHBondContact O-CB 3.2Å; Y574-K583 HydrophobicContact CD1-CB 3.88Å; Y574-K583 HydrophobicContact CD1-CG 4.42Å; Y574-K583 HydrophobicContact CE1-CB 3.51Å; Y574-K583 HydrophobicContact CE1-CD 3.78Å; Y574-K583 HydrophobicContact CE1-CG 3.6Å; Y574-K583 PolarHBondContact N-O 2.74Å; Y574-K583 PolarHBondContact O-N 2.78Å; Y574-K583 VanDerWaalsContact O-N 3.17Å; Y574-F585 AromaticContact CD1-CE2 3.66Å; Y574-F585 HydrophobicContact CD1-CE2 3.66Å; Y574-F585 HydrophobicContact CD1-CZ 4.42Å; Y574-F585 AromaticContact CE1-CE2 3.84Å; Y574-F585 HydrophobicContact CE1-CE2 3.84Å; Y574-F585 HydrophobicContact CE1-CZ 4.15Å
575	S	98.2	Very high	95.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	150.4	174.5	75.4	0	0	0	0	112.1	S559 D560	S559-S575 PolarHBondContact N-O 3.38Å; S559-S575 VanDerWaalsContact OG-C 3.31Å; S559-S575 PolarHBondContact OG-O 2.77Å; S559-S575 VanDerWaalsContact OG-O 3.08Å; S559-S575 PolarHBondContact OG-OG 3.16Å; D560-S575 VanDerWaalsContact CB-OG 3.23Å; D560-S575 WeakPolarHBondContact CB-OG 3.31Å; D560-S575 PolarHBondContact N-OG 3.26Å; D560-S575 PolarHBondContact O-N 2.91Å; D560-S575 VanDerWaalsContact O-N 3.09Å
576	S	98.2	Very high	95.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.6	178	179.9	0	0	0	0	111.9	E240 T241 I556 K578 A579 F581	E240-S576 CarbonylContact C-O 3.54Å; E240-S576 WeakPolarHBondContact CA-O 3.32Å; T241-S576 PolarHBondContact N-O 2.87Å; T241-S576 CarbonylContact O-C 3.54Å; T241-S576 VanDerWaalsContact O-O 3.12Å; I556-S576 WeakPolarHBondContact O-CB 3.41Å; I556-S576 PolarHBondContact O-OG 2.91Å; S576-K578 PolarHBondContact O-N 2.83Å; S576-K578 PolarHBondContact OG-N 3.16Å; S576-A579 WeakPolarHBondContact CB-O 3.4Å; S576-A579 VanDerWaalsContact O-O 3.14Å; S576-A579 PolarHBondContact OG-N 2.78Å; S576-F581 WeakPolarHBondContact CB-O 3.48Å
577	A	96.8	Very high	96.1	Very high	15 Å²	15	31.4 Å²	31.4	12%	0.124	18%	0.18	C	C	.	.	S	Bend	trans	-78.8	1.2	171.9	0	0	0	0	0	113.6	T241 G557 S559	T241-A577 PolarHBondContact O-N 3.43Å; G557-A577 PolarHBondContact O-N 2.79Å; S559-A577 PolarHBondContact OG-N 2.89Å
578	K	97.5	Very high	96.2	Very high	98 Å²	98	26.9 Å²	26.9	43%	0.426	15%	0.153	S	C	.	.	S	Bend	trans	-125.6	-12	-176.1	-63	-59.6	-177.6	-174.8	0	114.7	Y532 I556 S576	Y532-K578 HydrophobicContact CD1-CD 4.2Å; Y532-K578 HydrophobicContact CD1-CG 3.82Å; Y532-K578 HydrophobicContact CD2-CD 4.39Å; Y532-K578 HydrophobicContact CD2-CG 4.39Å; Y532-K578 HydrophobicContact CE1-CD 4.3Å; Y532-K578 HydrophobicContact CE1-CG 4.39Å; Y532-K578 HydrophobicContact CE2-CD 4.48Å; Y532-K578 HydrophobicContact CG-CD 4.26Å; Y532-K578 HydrophobicContact CG-CG 3.83Å; Y532-K578 PolarHBondContact OH-NZ 2.84Å; I556-K578 HydrophobicContact CG2-CB 4.22Å; S576-K578 PolarHBondContact O-N 2.83Å; S576-K578 PolarHBondContact OG-N 3.16Å
579	A	96.9	Very high	96.2	Very high	13 Å²	13	26 Å²	26	11%	0.107	13%	0.134	C	C	.	.	S	Bend	trans	-138.9	146.8	177.7	0	0	0	0	0	110.7	S576 F581	S576-A579 WeakPolarHBondContact CB-O 3.4Å; S576-A579 VanDerWaalsContact O-O 3.14Å; S576-A579 PolarHBondContact OG-N 2.78Å; A579-F581 HydrophobicContact CB-CD1 3.56Å; A579-F581 HydrophobicContact CB-CE1 3.31Å; A579-F581 HydrophobicContact CB-CZ 4.18Å; A579-F581 PolarHBondContact O-N 2.81Å
580	P	97.1	Very high	95	Very high	72 Å²	72	29.5 Å²	29.5	47%	0.468	15%	0.145	S	C	.	.	S	Bend	trans	-80.9	55.3	-179.1	35.3	-37	0	0	0	111.6	T237	T237-P580 PolarHBondContact N-O 3.27Å; T237-P580 WeakPolarHBondContact OG1-CA 3.48Å; T237-P580 PolarHBondContact OG1-O 2.84Å
581	F	97.3	Very high	95	Very high	40 Å²	40	29.9 Å²	29.9	18%	0.175	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	159.4	169.9	71.1	-97.9	0	0	0	111.7	V234 L235 T237 I556 Y574 S576 A579 K583	V234-F581 HydrophobicContact CG1-CB 4.35Å; V234-F581 HydrophobicContact CG1-CD2 4.34Å; V234-F581 HydrophobicContact CG1-CG 4.45Å; L235-F581 CarbonylContact O-C 3.56Å; L235-F581 WeakPolarHBondContact O-CA 3.46Å; L235-F581 WeakPolarHBondContact O-CB 3.12Å; T237-F581 PolarHBondContact OG1-N 3.03Å; I556-F581 HydrophobicContact CD1-CE1 4.35Å; I556-F581 HydrophobicContact CD1-CZ 4.1Å; Y574-F581 WeakPolarHBondContact OH-CE2 3.32Å; S576-F581 WeakPolarHBondContact CB-O 3.48Å; A579-F581 HydrophobicContact CB-CD1 3.56Å; A579-F581 HydrophobicContact CB-CE1 3.31Å; A579-F581 HydrophobicContact CB-CZ 4.18Å; A579-F581 PolarHBondContact O-N 2.81Å; F581-K583 HydrophobicContact CD2-CG 3.83Å; F581-K583 HydrophobicContact CE2-CD 4.15Å; F581-K583 HydrophobicContact CE2-CG 3.8Å
582	S	98	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	159	164.1	-65.3	0	0	0	0	108.8	L235 Y574	L235-S582 PolarHBondContact N-O 3.37Å; L235-S582 PolarHBondContact O-N 3.2Å; Y574-S582 VanDerWaalsContact O-CA 3.29Å; Y574-S582 WeakPolarHBondContact O-CA 3.4Å; Y574-S582 WeakPolarHBondContact O-CB 3.2Å
583	K	98.2	Very high	94.6	Very high	42 Å²	42	32.9 Å²	32.9	18%	0.183	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.3	173.7	-53.3	-172.1	171.6	-171	0	111.8	E231 Q233 V234 I573 Y574 F581 F585	E231-K583 VanDerWaalsContact OE2-CD 3.28Å; E231-K583 WeakPolarHBondContact OE2-CD 3.14Å; E231-K583 WeakPolarHBondContact OE2-CE 3.3Å; E231-K583 IonicContact OE2-NZ 3.65Å; E231-K583 PolarHBondContact OE2-NZ 2.99Å; Q233-K583 CarbonylContact O-C 3.59Å; Q233-K583 VanDerWaalsContact O-CA 3.3Å; Q233-K583 WeakPolarHBondContact O-CA 3.37Å; V234-K583 HydrophobicContact CG1-CG 4.44Å; V234-K583 HydrophobicContact CG2-CD 4.24Å; V234-K583 HydrophobicContact CG2-CG 4.26Å; I573-K583 VanDerWaalsContact CA-O 3.3Å; I573-K583 WeakPolarHBondContact CA-O 3.47Å; Y574-K583 HydrophobicContact CD1-CB 3.88Å; Y574-K583 HydrophobicContact CD1-CG 4.42Å; Y574-K583 HydrophobicContact CE1-CB 3.51Å; Y574-K583 HydrophobicContact CE1-CD 3.78Å; Y574-K583 HydrophobicContact CE1-CG 3.6Å; Y574-K583 PolarHBondContact N-O 2.74Å; Y574-K583 PolarHBondContact O-N 2.78Å; Y574-K583 VanDerWaalsContact O-N 3.17Å; F581-K583 HydrophobicContact CD2-CG 3.83Å; F581-K583 HydrophobicContact CE2-CD 4.15Å; F581-K583 HydrophobicContact CE2-CG 3.8Å; K583-F585 HydrophobicContact CB-CE2 3.93Å; K583-F585 HydrophobicContact CB-CZ 4.1Å; K583-F585 HydrophobicContact CD-CZ 4.22Å
584	V	98.6	Very high	94.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.3	173.2	-173.6	0	0	0	0	108.7	Q232 Q233 W272 F277 F564 F571 L572 I573	Q232-V584 HydrophobicContact CB-CG1 4.47Å; Q232-V584 PolarHBondContact N-O 2.88Å; Q233-V584 HydrophobicContact CB-CB 4Å; Q233-V584 HydrophobicContact CB-CG2 4.14Å; Q233-V584 PolarHBondContact N-O 2.85Å; Q233-V584 VanDerWaalsContact N-O 3.15Å; Q233-V584 PolarHBondContact O-N 3.3Å; W272-V584 HydrophobicContact CH2-CG1 4.06Å; W272-V584 HydrophobicContact CZ3-CG1 4.1Å; W272-V584 HydrophobicContact CZ3-CG2 4.35Å; F277-V584 HydrophobicContact CD2-CG2 3.87Å; F277-V584 HydrophobicContact CE2-CG2 4.3Å; F564-V584 HydrophobicContact CE1-CG1 4.26Å; F564-V584 HydrophobicContact CZ-CG1 3.84Å; F571-V584 HydrophobicContact CB-CG1 4.21Å; F571-V584 HydrophobicContact CD1-CG1 4.07Å; F571-V584 HydrophobicContact CG-CG1 4.5Å; L572-V584 CarbonylContact O-C 3.47Å; L572-V584 WeakPolarHBondContact O-CA 3.1Å; I573-V584 HydrophobicContact CB-CG2 4.27Å; I573-V584 HydrophobicContact CD1-CG2 3.91Å; I573-V584 HydrophobicContact CG1-CG2 4.07Å
585	F	97.9	Very high	94.2	Very high	13 Å²	13	36.9 Å²	36.9	6%	0.057	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.7	174.2	-60	-87.2	0	0	0	110.4	V229 L230 E231 W561 F571 L572 Y574 K583	V229-F585 HydrophobicContact CG1-CB 3.56Å; V229-F585 HydrophobicContact CG1-CD1 3.87Å; V229-F585 HydrophobicContact CG1-CG 3.95Å; L230-F585 CarbonylContact O-C 3.47Å; L230-F585 WeakPolarHBondContact O-CA 3.14Å; E231-F585 HydrophobicContact CB-CD1 4.15Å; E231-F585 HydrophobicContact CB-CE1 4.04Å; E231-F585 HydrophobicContact CG-CE1 4.24Å; W561-F585 AromaticContact CH2-CD2 3.78Å; W561-F585 HydrophobicContact CH2-CD2 3.78Å; W561-F585 AromaticContact CH2-CE2 3.54Å; W561-F585 HydrophobicContact CH2-CE2 3.54Å; W561-F585 AromaticContact CZ3-CD2 3.75Å; W561-F585 HydrophobicContact CZ3-CD2 3.75Å; W561-F585 AromaticContact CZ3-CE2 3.95Å; W561-F585 HydrophobicContact CZ3-CE2 3.95Å; F571-F585 CarbonylContact C-O 3.58Å; F571-F585 WeakPolarHBondContact CA-O 3.44Å; F571-F585 WeakPolarHBondContact CB-O 3.35Å; L572-F585 HydrophobicContact CB-CB 4.48Å; L572-F585 PolarHBondContact N-O 3.26Å; L572-F585 PolarHBondContact O-N 3.21Å; Y574-F585 AromaticContact CD1-CE2 3.66Å; Y574-F585 HydrophobicContact CD1-CE2 3.66Å; Y574-F585 HydrophobicContact CD1-CZ 4.42Å; Y574-F585 AromaticContact CE1-CE2 3.84Å; Y574-F585 HydrophobicContact CE1-CE2 3.84Å; Y574-F585 HydrophobicContact CE1-CZ 4.15Å; K583-F585 HydrophobicContact CB-CE2 3.93Å; K583-F585 HydrophobicContact CB-CZ 4.1Å; K583-F585 HydrophobicContact CD-CZ 4.22Å
586	K	96.4	Very high	93.9	Very high	25 Å²	25	39.4 Å²	39.4	11%	0.109	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129.3	173.4	-177.1	170.2	-174.8	165.3	0	109.7	L230 Q232 E569 F571	L230-K586 HydrophobicContact CB-CB 4.42Å; L230-K586 PolarHBondContact N-O 2.92Å; L230-K586 PolarHBondContact O-N 2.98Å; Q232-K586 HydrophobicContact CB-CB 4.13Å; E569-K586 WeakPolarHBondContact OE1-CE 3.29Å; E569-K586 IonicContact OE1-NZ 2.63Å; E569-K586 PolarHBondContact OE1-NZ 3.35Å; E569-K586 VanDerWaalsContact OE2-CE 3.23Å; E569-K586 WeakPolarHBondContact OE2-CE 3.35Å; E569-K586 IonicContact OE2-NZ 3.72Å; E569-K586 PolarHBondContact OE2-NZ 2.85Å; F571-K586 HydrophobicContact CD1-CB 3.84Å; F571-K586 HydrophobicContact CD1-CG 4.1Å; F571-K586 HydrophobicContact CE1-CB 3.79Å; F571-K586 HydrophobicContact CE1-CD 3.85Å; F571-K586 HydrophobicContact CE1-CG 3.71Å; F571-K586 HydrophobicContact CZ-CD 4.33Å; F571-K586 HydrophobicContact CZ-CG 4.34Å
587	L	95.3	Very high	93.6	Very high	7 Å²	7	42.2 Å²	42.2	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	106.4	179.3	-54.4	-178.1	0	0	0	108.7	L226 V229 F513 L515 F563 S570 L572	L226-L587 HydrophobicContact CD1-CB 3.91Å; L226-L587 HydrophobicContact CD1-CD2 4.26Å; V229-L587 HydrophobicContact CG1-CD2 4.16Å; V229-L587 HydrophobicContact CG2-CD2 3.94Å; F513-L587 HydrophobicContact CD2-CD1 4.28Å; F513-L587 HydrophobicContact CE2-CD1 3.56Å; F513-L587 HydrophobicContact CZ-CD1 4Å; L515-L587 HydrophobicContact CD1-CB 4.19Å; L515-L587 HydrophobicContact CD1-CD1 4.05Å; L515-L587 HydrophobicContact CD2-CD1 4.07Å; L515-L587 HydrophobicContact CG-CD1 4.46Å; F563-L587 HydrophobicContact CD2-CD1 4.08Å; F563-L587 HydrophobicContact CE2-CD1 3.81Å; S570-L587 PolarHBondContact O-N 3.11Å; L572-L587 HydrophobicContact CD1-CD1 4.46Å; L572-L587 HydrophobicContact CD1-CD2 3.92Å; L572-L587 HydrophobicContact CG-CD1 4.1Å; L572-L587 HydrophobicContact CG-CD2 4.14Å; L572-L587 HydrophobicContact CG-CG 4.42Å
588	K	89.3	Confident	93.3	Very high	64 Å²	64	44.3 Å²	44.3	28%	0.278	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	119.4	179.1	-73.7	-64.2	-167.1	173.3	0	109.9	D227 Y228 L230 E569	D227-K588 PolarHBondContact N-O 3.01Å; Y228-K588 HydrophobicContact CD2-CB 4.24Å; Y228-K588 HydrophobicContact CD2-CG 4.36Å; Y228-K588 HydrophobicContact CE1-CB 4.29Å; Y228-K588 HydrophobicContact CE2-CB 3.96Å; Y228-K588 HydrophobicContact CE2-CG 3.78Å; Y228-K588 PolarHBondContact O-N 2.82Å; L230-K588 HydrophobicContact CD1-CG 4.02Å; L230-K588 HydrophobicContact CG-CG 4.41Å; E569-K588 IonicContact OE1-NZ 3.55Å
589	T	84.9	Confident	93	Very high	50 Å²	50	39.8 Å²	39.8	31%	0.307	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141.5	175.4	60.7	0	0	0	0	109.9	K224 R225 L515	K224-T589 HydrophobicContact CB-CG2 4.08Å; R225-T589 VanDerWaalsContact O-CA 3.27Å; R225-T589 WeakPolarHBondContact O-CA 3.08Å; L515-T589 HydrophobicContact CB-CG2 4.27Å; L515-T589 HydrophobicContact CD1-CG2 4.05Å; L515-T589 HydrophobicContact CD2-CG2 4.46Å
590	Y	66.3	Low	92.6	Very high	152 Å²	152	42.3 Å²	42.3	60%	0.596	20%	0.201	S	C	*	.			trans	-90.1	0	172.7	67.1	-112.1	0	0	0	113.1	K224 R225 D227	K224-Y590 WeakPolarHBondContact CA-O 3.41Å; R225-Y590 HydrophobicContact CB-CD1 4.15Å; R225-Y590 HydrophobicContact CB-CE1 3.51Å; R225-Y590 HydrophobicContact CB-CE2 4.04Å; R225-Y590 VanDerWaalsContact CB-CZ 3.45Å; R225-Y590 WeakPolarHBondContact CD-OH 3.49Å; R225-Y590 HydrophobicContact CG-CE1 3.73Å; R225-Y590 PolarHBondContact NH1-OH 3.01Å; R225-Y590 PolarHBondContact O-N 2.93Å; R225-Y590 VanDerWaalsContact O-N 3.16Å; D227-Y590 HydrophobicContact CB-CD1 4.13Å

Retrieved 590 of 590 residues in 171.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).