A0A096LSZ0_POEFO Loading...

Copine family member 9

AlphaFold DB , UniProt , Accession A0A096LSZ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 587 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.5	Very low	26	Very low	246 Å²	246	146.2 Å²	146.2	100%	1.212	83%	0.828	S	S	*	*				0	90.6	0	-79.5	174.5	174.2	0	0	106.8
2	A	23.4	Very low	26.2	Very low	101 Å²	101	142.6 Å²	142.6	84%	0.835	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-90.1	122.7	174.5	0	0	0	0	0	107
3	T	21.8	Very low	27.5	Very low	140 Å²	140	136.4 Å²	136.4	86%	0.859	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-64.6	128	178.4	31.9	0	0	0	0	110.3	G5	T3-G5 PolarHBondContact O-N 3.23Å
4	I	27	Very low	29.2	Very low	164 Å²	164	135.7 Å²	135.7	84%	0.841	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-56.6	117.7	169.5	-67	164.8	0	0	0	106.9
5	G	25.1	Very low	30.8	Very low	66 Å²	66	129.5 Å²	129.5	68%	0.68	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-65.6	136.6	174.3	0	0	0	0	0	110.1	T3 F7	T3-G5 PolarHBondContact O-N 3.23Å; G5-F7 PolarHBondContact O-N 3.33Å
6	D	23.9	Very low	33	Very low	167 Å²	167	125.9 Å²	125.9	89%	0.893	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-53.4	132.3	-178.9	-67.9	-54.9	0	0	0	112.1
7	F	25.4	Very low	35.7	Very low	200 Å²	200	119.6 Å²	119.6	88%	0.877	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-75.6	116.7	174	-147	-96.7	0	0	0	107.7	G5 P9	G5-F7 PolarHBondContact O-N 3.33Å; F7-P9 WeakPolarHBondContact O-CD 3.45Å
8	D	25.3	Very low	38.5	Very low	118 Å²	118	118.2 Å²	118.2	63%	0.631	69%	0.687	S	S	*	*			trans	-88.5	110.2	176	-165.2	-6.7	0	0	0	109.2	L10	D8-L10 PolarHBondContact O-N 3.01Å
9	P	26.6	Very low	41.2	Very low	108 Å²	108	112 Å²	112	70%	0.701	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	11	-168.6	32.2	-33.3	0	0	0	114.6	F7	F7-P9 WeakPolarHBondContact O-CD 3.45Å
10	L	26.4	Very low	43.6	Very low	153 Å²	153	108.1 Å²	108.1	80%	0.801	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	8.2	-176.4	-83	158.7	0	0	0	114.8	D8	D8-L10 PolarHBondContact O-N 3.01Å
11	N	31.8	Very low	45.8	Very low	145 Å²	145	102.9 Å²	102.9	78%	0.775	60%	0.597	S	S	*	*			trans	-139	32.4	-166.7	-132.4	17.6	0	0	0	115.8
12	S	27.7	Very low	48.6	Very low	103 Å²	103	92.8 Å²	92.8	72%	0.72	55%	0.549	S	S	*	.			trans	-113.9	67.5	173.3	70.5	0	0	0	0	112	V14	S12-V14 PolarHBondContact O-N 3.32Å
13	T	43.7	Very low	51.7	Low	62 Å²	62	88 Å²	88	38%	0.38	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-71.5	117.2	149.1	44.8	0	0	0	0	107.1	K539	T13-K539 PolarHBondContact OG1-NZ 3.28Å
14	V	51.5	Low	54.7	Low	127 Å²	127	82.1 Å²	82.1	77%	0.77	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-63.6	125.9	174.4	179.3	0	0	0	0	106.6	S12 A16	S12-V14 PolarHBondContact O-N 3.32Å; V14-A16 PolarHBondContact O-N 2.86Å
15	P	52.7	Low	57.6	Low	42 Å²	42	74.3 Å²	74.3	27%	0.273	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-57	138.8	177.8	24.2	-33.5	0	0	0	110.2	T17 D77 F79	P15-T17 PolarHBondContact O-N 3.26Å; P15-D77 HydrophobicContact CB-CB 3.9Å; P15-D77 HydrophobicContact CG-CB 4.39Å; P15-F79 HydrophobicContact CB-CE1 3.91Å; P15-F79 HydrophobicContact CB-CE2 4.17Å; P15-F79 HydrophobicContact CB-CZ 3.66Å; P15-F79 HydrophobicContact CG-CZ 4.49Å
16	A	66.6	Low	60.7	Low	72 Å²	72	74.6 Å²	74.6	60%	0.595	41%	0.414	S	S	*	.	S	Bend	trans	-56.2	-41.7	178.3	0	0	0	0	0	110	V14 Y78	V14-A16 PolarHBondContact O-N 2.86Å; A16-Y78 HydrophobicContact CB-CD1 4.31Å; A16-Y78 PolarHBondContact N-O 3.44Å
17	T	79.2	Confident	63.7	Low	19 Å²	19	72.2 Å²	72.2	12%	0.117	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	178.4	171.3	-164.4	0	0	0	0	111.8	P15 I19 Y78 E166 V313	P15-T17 PolarHBondContact O-N 3.26Å; T17-I19 HydrophobicContact CG2-CD1 3.76Å; T17-I19 HydrophobicContact CG2-CG1 4.21Å; T17-Y78 HydrophobicContact CG2-CD1 3.92Å; T17-Y78 HydrophobicContact CG2-CG 4.43Å; T17-Y78 PolarHBondContact O-N 2.89Å; T17-E166 WeakPolarHBondContact CB-OE1 3.09Å; T17-E166 HydrophobicContact CG2-CG 3.72Å; T17-E166 WeakPolarHBondContact CG2-OE1 3.33Å; T17-E166 WeakPolarHBondContact OG1-CG 3.16Å; T17-E166 PolarHBondContact OG1-OE1 3.38Å; T17-V313 HydrophobicContact CG2-CG2 4.15Å
18	K	86.1	Confident	66.5	Low	94 Å²	94	63 Å²	63	41%	0.409	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.7	168.2	-72.9	-175.8	-177.8	-65.6	0	109.7	V75 L76 D77 L167	K18-V75 HydrophobicContact CB-CG1 4.35Å; K18-V75 HydrophobicContact CD-CG1 4.2Å; K18-L76 CarbonylContact C-O 3.52Å; K18-L76 WeakPolarHBondContact CA-O 3.38Å; K18-D77 IonicContact NZ-OD1 3.41Å; K18-D77 PolarHBondContact NZ-OD1 2.79Å; K18-D77 IonicContact NZ-OD2 2.71Å; K18-L167 HydrophobicContact CB-CB 4.02Å; K18-L167 HydrophobicContact CB-CD1 4.32Å; K18-L167 PolarHBondContact O-N 3.14Å
19	I	89	Confident	69.1	Low	1 Å²	1	59.2 Å²	59.2	1%	0.005	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.2	178.9	-58.5	-66.6	0	0	0	109	T17 V21 V75 L76 Y78 L113 I117 A164 E165 E166 V313	T17-I19 HydrophobicContact CG2-CD1 3.76Å; T17-I19 HydrophobicContact CG2-CG1 4.21Å; I19-V21 HydrophobicContact CG2-CG2 4.15Å; I19-V75 CarbonylContact O-C 3.52Å; I19-V75 WeakPolarHBondContact O-CA 3.23Å; I19-L76 PolarHBondContact N-O 3.17Å; I19-L76 PolarHBondContact O-N 3.06Å; I19-Y78 HydrophobicContact CG1-CG 4.07Å; I19-L113 HydrophobicContact CB-CD1 4.46Å; I19-L113 HydrophobicContact CG2-CD1 4.13Å; I19-I117 HydrophobicContact CD1-CD1 4.09Å; I19-I117 HydrophobicContact CG1-CD1 3.86Å; I19-I117 HydrophobicContact CG2-CD1 4.4Å; I19-I117 HydrophobicContact CG2-CG1 4.5Å; I19-A164 HydrophobicContact CG2-CB 3.8Å; I19-E165 CarbonylContact C-O 3.46Å; I19-E165 WeakPolarHBondContact CA-O 2.66Å; I19-E166 HydrophobicContact CD1-CB 3.96Å; I19-E166 HydrophobicContact CD1-CG 4.16Å; I19-V313 HydrophobicContact CD1-CG1 4.22Å; I19-V313 HydrophobicContact CD1-CG2 4.42Å
20	E	89.8	Confident	71.3	Confident	33 Å²	33	57.7 Å²	57.7	15%	0.154	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.1	170.3	-168.9	173.2	75.6	0	0	109.9	K73 F74 V75 A164 E165 L167	E20-K73 VanDerWaalsContact CD-CD 3.41Å; E20-K73 HydrophobicContact CG-CB 3.49Å; E20-K73 VanDerWaalsContact CG-CB 3.49Å; E20-K73 HydrophobicContact CG-CD 3.97Å; E20-K73 HydrophobicContact CG-CG 3.87Å; E20-K73 WeakPolarHBondContact OE1-CD 3.15Å; E20-K73 WeakPolarHBondContact OE1-CE 3.25Å; E20-K73 IonicContact OE1-NZ 3.69Å; E20-K73 PolarHBondContact OE1-NZ 3.38Å; E20-K73 IonicContact OE2-NZ 3.69Å; E20-F74 CarbonylContact C-O 3.55Å; E20-F74 WeakPolarHBondContact CA-O 3.49Å; E20-V75 HydrophobicContact CG-CG2 4.47Å; E20-A164 WeakPolarHBondContact O-CA 3.41Å; E20-E165 PolarHBondContact N-O 2.96Å; E20-E165 PolarHBondContact O-N 2.88Å; E20-L167 HydrophobicContact CB-CD1 3.91Å; E20-L167 HydrophobicContact CB-CD2 3.89Å; E20-L167 HydrophobicContact CB-CG 3.73Å
21	V	89.6	Confident	73.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.7	176	-177.1	0	0	0	0	109	I19 V23 F74 L76 L113 I116 F162	I19-V21 HydrophobicContact CG2-CG2 4.15Å; V21-V23 HydrophobicContact CG1-CG2 4.24Å; V21-F74 HydrophobicContact CB-CB 4.39Å; V21-F74 PolarHBondContact N-O 2.62Å; V21-F74 PolarHBondContact O-N 3.02Å; V21-L76 HydrophobicContact CG2-CD1 4.08Å; V21-L113 HydrophobicContact CG2-CD1 4Å; V21-I116 HydrophobicContact CG1-CD1 4.43Å; V21-F162 HydrophobicContact CG1-CB 4.46Å; V21-F162 HydrophobicContact CG1-CD1 4.18Å
22	T	87.8	Confident	74.6	Confident	34 Å²	34	48.6 Å²	48.6	21%	0.209	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.9	169	-54.2	0	0	0	0	109.1	K73 F162 T163	T22-K73 WeakPolarHBondContact OG1-CE 3.37Å; T22-F162 WeakPolarHBondContact O-CA 3.33Å; T22-T163 PolarHBondContact N-O 2.61Å; T22-T163 PolarHBondContact O-N 3.12Å
23	V	88.9	Confident	75.9	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140.2	-177.5	-172.2	0	0	0	0	110	V21 V41 F70 F74 F88 I160 V161 F162	V21-V23 HydrophobicContact CG1-CG2 4.24Å; V23-V41 HydrophobicContact CG1-CG1 4.31Å; V23-V41 HydrophobicContact CG1-CG2 4.16Å; V23-F70 HydrophobicContact CB-CD2 4.44Å; V23-F70 HydrophobicContact CG1-CD2 4.45Å; V23-F70 WeakPolarHBondContact O-CD2 3.14Å; V23-F70 PolarHBondContact O-N 2.63Å; V23-F74 HydrophobicContact CG2-CD2 3.9Å; V23-F74 HydrophobicContact CG2-CE2 3.82Å; V23-F88 HydrophobicContact CG2-CE1 4.16Å; V23-I160 HydrophobicContact CG1-CD1 3.7Å; V23-I160 HydrophobicContact CG1-CG1 3.8Å; V23-V161 WeakPolarHBondContact CA-O 3.29Å; V23-F162 HydrophobicContact CG1-CD1 4.29Å; V23-F162 HydrophobicContact CG1-CE1 4.08Å; V23-F162 HydrophobicContact CG2-CD1 3.98Å; V23-F162 HydrophobicContact CG2-CE1 4.18Å
24	S	85.1	Confident	76.5	Confident	15 Å²	15	56.3 Å²	56.3	11%	0.105	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	159.1	165.8	64.6	0	0	0	0	110.7	P68 D69 I160 V161	S24-P68 CarbonylContact C-O 3.59Å; S24-P68 VanDerWaalsContact CA-O 3.31Å; S24-P68 WeakPolarHBondContact CA-O 3.48Å; S24-P68 VanDerWaalsContact CB-O 3.27Å; S24-P68 WeakPolarHBondContact CB-O 3.33Å; S24-D69 WeakPolarHBondContact CB-OD1 3.3Å; S24-I160 WeakPolarHBondContact O-CA 3.47Å; S24-V161 PolarHBondContact N-O 2.79Å; S24-V161 PolarHBondContact O-N 3.45Å
25	C	88.1	Confident	77.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	155.8	175.5	-54.1	0	0	0	0	110.7	L28 N67 P68 S159	C25-L28 HydrophobicContact CB-CD1 3.82Å; C25-L28 HydrophobicContact CB-CD2 3.71Å; C25-L28 HydrophobicContact CB-CG 3.78Å; C25-N67 CarbonylContact O-C 3.49Å; C25-N67 WeakPolarHBondContact O-CA 3.46Å; C25-P68 HydrophobicContact CB-CG 3.66Å; C25-P68 PolarHBondContact N-O 2.85Å; C25-S159 CarbonylContact C-O 3.57Å; C25-S159 VanDerWaalsContact CA-O 3.27Å; C25-S159 WeakPolarHBondContact CA-O 3.47Å
26	R	89.7	Confident	78.3	Confident	73 Å²	73	56 Å²	56	28%	0.275	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	141.3	177.6	-58	-66.2	178.7	-101	5.2	110.5	L28 L66 N67 P68 D69 G158 S159 V161	R26-L28 VanDerWaalsContact C-N 3.26Å; R26-L28 PolarHBondContact O-N 3.04Å; R26-L66 CarbonylContact C-O 3.46Å; R26-N67 VanDerWaalsContact CA-OD1 3.27Å; R26-N67 WeakPolarHBondContact CA-OD1 3.26Å; R26-P68 PolarHBondContact NH1-O 3.39Å; R26-D69 IonicContact CZ-OD1 3.52Å; R26-D69 VanDerWaalsContact CZ-OD1 3.25Å; R26-D69 IonicContact NH1-OD1 3.58Å; R26-D69 PolarHBondContact NH1-OD1 3.39Å; R26-D69 IonicContact NH1-OD2 2.73Å; R26-D69 IonicContact NH2-OD1 3.53Å; R26-D69 PolarHBondContact NH2-OD1 3.03Å; R26-D69 IonicContact NH2-OD2 3.99Å; R26-G158 CarbonylContact O-C 3.56Å; R26-G158 VanDerWaalsContact O-CA 3.22Å; R26-G158 WeakPolarHBondContact O-CA 3.25Å; R26-S159 PolarHBondContact N-O 3.06Å; R26-S159 PolarHBondContact O-N 3.38Å; R26-V161 HydrophobicContact CG-CG2 4.35Å
27	N	86.4	Confident	79	Confident	117 Å²	117	52.6 Å²	52.6	63%	0.626	27%	0.267	S	S	*	.	S	Bend	trans	52.2	40.5	174.5	-52.9	-52.4	0	0	0	113.8	L66 N67 G158	N27-L66 PolarHBondContact N-O 2.79Å; N27-L66 VanDerWaalsContact N-O 3.09Å; N27-N67 PolarHBondContact N-OD1 3.36Å; N27-G158 WeakPolarHBondContact O-CA 3.27Å; N27-G158 PolarHBondContact O-N 2.94Å
28	L	84.7	Confident	79.3	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	27%	0.271	C	S	.	.			trans	-56.5	153.4	176.3	-67.2	179.6	0	0	0	111.5	C25 R26 D30 P39 L66 P68 V90 L106 L128	C25-L28 HydrophobicContact CB-CD1 3.82Å; C25-L28 HydrophobicContact CB-CD2 3.71Å; C25-L28 HydrophobicContact CB-CG 3.78Å; R26-L28 VanDerWaalsContact C-N 3.26Å; R26-L28 PolarHBondContact O-N 3.04Å; L28-D30 PolarHBondContact O-N 2.67Å; L28-P39 HydrophobicContact CD1-CB 3.58Å; L28-P39 HydrophobicContact CD1-CG 3.98Å; L28-L66 HydrophobicContact CB-CB 4.34Å; L28-L66 HydrophobicContact CB-CD2 4.38Å; L28-L66 PolarHBondContact N-O 2.87Å; L28-P68 HydrophobicContact CD1-CG 3.93Å; L28-V90 HydrophobicContact CD1-CG1 4.35Å; L28-V90 HydrophobicContact CD2-CG1 4.33Å; L28-L106 HydrophobicContact CD1-CD1 4.22Å; L28-L128 HydrophobicContact CD2-CD1 3.44Å; L28-L128 VanDerWaalsContact CD2-CD1 3.44Å
29	L	79.3	Confident	79.3	Confident	40 Å²	40	49 Å²	49	21%	0.209	25%	0.252	C	S	.	.			trans	-69.1	124.9	178.1	-176.7	56	0	0	0	110	M31 S37	L29-M31 HydrophobicContact CB-CE 4.23Å; L29-M31 HydrophobicContact CD2-CE 3.16Å; L29-M31 HydrophobicContact CD2-SD 4Å; L29-M31 HydrophobicContact CG-CE 3.64Å; L29-M31 HydrophobicContact CG-SD 4.03Å; L29-M31 PolarHBondContact O-N 3.01Å; L29-S37 PolarHBondContact O-OG 3.22Å
30	D	72.6	Confident	79.4	Confident	76 Å²	76	49.4 Å²	49.4	41%	0.406	25%	0.254	S	S	.	.			trans	-76.6	110.7	175	-159.2	-0.3	0	0	0	109.4	L28 L66	L28-D30 PolarHBondContact O-N 2.67Å; D30-L66 HydrophobicContact CB-CD1 4.15Å; D30-L66 HydrophobicContact CB-CD2 4.14Å
31	M	66.3	Low	79.6	Confident	71 Å²	71	47.8 Å²	47.8	35%	0.35	25%	0.247	S	C	.	.			trans	-96.3	-13.1	179.3	-67.5	-60.4	-172	0	0	112.9	L29 L106	L29-M31 HydrophobicContact CB-CE 4.23Å; L29-M31 HydrophobicContact CD2-CE 3.16Å; L29-M31 HydrophobicContact CD2-SD 4Å; L29-M31 HydrophobicContact CG-CE 3.64Å; L29-M31 HydrophobicContact CG-SD 4.03Å; L29-M31 PolarHBondContact O-N 3.01Å; M31-L106 HydrophobicContact CE-CD2 4.06Å; M31-L106 HydrophobicContact CG-CD2 3.54Å
32	D	61.5	Low	79.8	Confident	35 Å²	35	47.8 Å²	47.8	19%	0.187	25%	0.247	C	C	.	.			trans	-94.6	140.8	-172.5	-79.5	-12.3	0	0	0	112.3	S35	D32-S35 WeakPolarHBondContact CB-O 3.37Å; D32-S35 WeakPolarHBondContact CB-OG 3.43Å; D32-S35 PolarHBondContact OD2-OG 3.21Å
33	T	55.8	Low	80.2	Confident	125 Å²	125	46.2 Å²	46.2	77%	0.767	24%	0.237	S	C	*	.	S	Bend	trans	-82.9	-19.7	-177.6	-37.1	0	0	0	0	112.8
34	F	57	Low	80.5	Confident	203 Å²	203	47.4 Å²	47.4	89%	0.89	24%	0.241	S	C	*	.	S	Bend	trans	-138.5	-1	-172.9	-60.9	-75	0	0	0	114.6
35	S	68.1	Low	80.9	Confident	60 Å²	60	48.4 Å²	48.4	42%	0.42	25%	0.247	S	C	.	.	S	Bend	trans	-139	173.8	176.4	40.4	0	0	0	0	109.2	D32	D32-S35 WeakPolarHBondContact CB-O 3.37Å; D32-S35 WeakPolarHBondContact CB-OG 3.43Å; D32-S35 PolarHBondContact OD2-OG 3.21Å
36	K	73.9	Confident	80.9	Confident	102 Å²	102	50.7 Å²	50.7	44%	0.443	26%	0.257	S	S	.	.			trans	-92.6	162.5	161.7	-57.1	171	179.2	175.1	0	108.8	N64 L66	K36-N64 WeakPolarHBondContact CB-OD1 3.36Å; K36-N64 WeakPolarHBondContact CG-OD1 3.41Å; K36-N64 PolarHBondContact N-OD1 2.89Å; K36-L66 HydrophobicContact CB-CD2 4.22Å; K36-L66 HydrophobicContact CB-CG 4.33Å; K36-L66 HydrophobicContact CD-CG 4.41Å; K36-L66 HydrophobicContact CG-CG 4.48Å
37	S	80.1	Confident	80.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.			trans	-55.5	152.3	176.2	-58.4	0	0	0	0	115	L29 P39 N64 T65 N92	L29-S37 PolarHBondContact O-OG 3.22Å; S37-P39 WeakPolarHBondContact O-CD 3.46Å; S37-N64 PolarHBondContact O-N 3.35Å; S37-T65 PolarHBondContact O-N 3.11Å; S37-T65 VanDerWaalsContact O-O 3.09Å; S37-N92 WeakPolarHBondContact CA-OD1 3.18Å; S37-N92 WeakPolarHBondContact CB-OD1 3.15Å
38	D	84.8	Confident	79.5	Confident	39 Å²	39	46.3 Å²	46.3	21%	0.209	24%	0.243	C	C	.	.			trans	-107.4	75.1	173.2	-67	-16.5	0	0	0	109.8	V61 I62 E63 N64 N92 V93	D38-V61 HydrophobicContact CB-CG1 3.94Å; D38-I62 WeakPolarHBondContact CA-O 3.47Å; D38-E63 WeakPolarHBondContact OD1-CA 3.48Å; D38-N64 PolarHBondContact OD1-N 3.34Å; D38-N92 PolarHBondContact N-OD1 3.29Å; D38-V93 HydrophobicContact CB-CB 4.47Å; D38-V93 PolarHBondContact O-N 2.84Å
39	P	87.8	Confident	78.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.6	-170.3	26.5	-38.7	0	0	0	114.7	L28 S37 I62 T65 P68 F70 Y91	L28-P39 HydrophobicContact CD1-CB 3.58Å; L28-P39 HydrophobicContact CD1-CG 3.98Å; S37-P39 WeakPolarHBondContact O-CD 3.46Å; P39-I62 WeakPolarHBondContact CD-O 3.31Å; P39-I62 PolarHBondContact O-N 3.07Å; P39-T65 WeakPolarHBondContact CD-O 3.32Å; P39-T65 HydrophobicContact CG-CG2 3.94Å; P39-P68 HydrophobicContact CB-CB 4.49Å; P39-P68 HydrophobicContact CB-CG 3.97Å; P39-P68 HydrophobicContact CG-CB 3.68Å; P39-P68 HydrophobicContact CG-CG 3.51Å; P39-F70 HydrophobicContact CB-CZ 4.28Å; P39-Y91 CarbonylContact C-O 3.35Å; P39-Y91 VanDerWaalsContact CA-O 3.28Å; P39-Y91 WeakPolarHBondContact CA-O 3.47Å
40	V	91.3	Very high	78.4	Confident	8 Å²	8	48 Å²	48	5%	0.048	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.4	165.6	67.6	0	0	0	0	110.1	R58 V61 V90 Y91 V93	V40-R58 HydrophobicContact CG2-CB 4.44Å; V40-V61 HydrophobicContact CB-CG2 4.22Å; V40-V61 HydrophobicContact CG2-CG2 4.38Å; V40-V90 WeakPolarHBondContact O-CA 3.15Å; V40-Y91 PolarHBondContact N-O 3.33Å; V40-Y91 PolarHBondContact O-N 3.11Å; V40-V93 HydrophobicContact CB-CG2 3.92Å; V40-V93 HydrophobicContact CG1-CG2 3.41Å; V40-V93 VanDerWaalsContact CG1-CG2 3.41Å
41	V	92.6	Very high	78.6	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.7	174.2	-178.8	0	0	0	0	110.1	V23 R58 T59 F70 F88 D89 V90 I160	V23-V41 HydrophobicContact CG1-CG1 4.31Å; V23-V41 HydrophobicContact CG1-CG2 4.16Å; V41-R58 CarbonylContact O-C 3.52Å; V41-R58 VanDerWaalsContact O-CA 3.31Å; V41-R58 WeakPolarHBondContact O-CA 3.35Å; V41-T59 HydrophobicContact CB-CG2 3.92Å; V41-T59 PolarHBondContact N-OG1 3.41Å; V41-T59 PolarHBondContact O-N 2.73Å; V41-F70 HydrophobicContact CB-CE2 4.48Å; V41-F70 HydrophobicContact CG2-CD2 4.18Å; V41-F70 HydrophobicContact CG2-CE2 3.46Å; V41-F70 VanDerWaalsContact CG2-CE2 3.46Å; V41-F70 HydrophobicContact CG2-CZ 3.79Å; V41-F88 HydrophobicContact CG1-CB 4.21Å; V41-F88 HydrophobicContact CG1-CD1 3.9Å; V41-D89 WeakPolarHBondContact CA-O 3.46Å; V41-V90 HydrophobicContact CG2-CG1 4.47Å; V41-V90 HydrophobicContact CG2-CG2 4.23Å; V41-I160 HydrophobicContact CG1-CD1 4.35Å; V41-I160 HydrophobicContact CG2-CD1 4.48Å
42	V	94.9	Very high	79.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.3	175.4	-173.3	0	0	0	0	108.9	Y44 E55 R58 F88 D89 Y91 L100	V42-Y44 HydrophobicContact CB-CE2 3.85Å; V42-Y44 HydrophobicContact CG1-CD2 4.03Å; V42-Y44 HydrophobicContact CG1-CE1 4.39Å; V42-Y44 HydrophobicContact CG1-CE2 3.33Å; V42-E55 HydrophobicContact CG1-CG 3.8Å; V42-R58 HydrophobicContact CB-CG 4.43Å; V42-R58 HydrophobicContact CG1-CG 4.09Å; V42-R58 HydrophobicContact CG2-CG 3.98Å; V42-F88 WeakPolarHBondContact O-CA 3.45Å; V42-D89 PolarHBondContact N-O 3.41Å; V42-D89 PolarHBondContact O-N 3.37Å; V42-Y91 HydrophobicContact CB-CE2 4.39Å; V42-Y91 HydrophobicContact CG2-CD2 3.92Å; V42-Y91 HydrophobicContact CG2-CE2 3.9Å; V42-L100 HydrophobicContact CG1-CD1 4.36Å; V42-L100 HydrophobicContact CG2-CD1 4.15Å; V42-L100 HydrophobicContact CG2-CD2 3.76Å
43	L	95.6	Very high	80.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.7	173.9	172.4	58.7	0	0	0	109.8	V45 F56 G57 F74 L76 L86 F88	L43-V45 HydrophobicContact CG-CG1 4.49Å; L43-F56 HydrophobicContact CB-CB 4.41Å; L43-F56 HydrophobicContact CD2-CB 4.16Å; L43-F56 HydrophobicContact CD2-CD1 3.79Å; L43-F56 HydrophobicContact CD2-CG 4.14Å; L43-F56 HydrophobicContact CG-CB 3.94Å; L43-F56 HydrophobicContact CG-CD1 4.45Å; L43-F56 HydrophobicContact CG-CG 4.45Å; L43-F56 WeakPolarHBondContact O-CB 3.46Å; L43-F56 PolarHBondContact O-N 2.91Å; L43-G57 PolarHBondContact N-O 3.27Å; L43-G57 PolarHBondContact O-N 3.14Å; L43-F74 HydrophobicContact CB-CD1 4.09Å; L43-F74 HydrophobicContact CB-CD2 4.38Å; L43-F74 HydrophobicContact CB-CE1 3.81Å; L43-F74 HydrophobicContact CB-CE2 4.12Å; L43-F74 HydrophobicContact CB-CG 4.37Å; L43-F74 HydrophobicContact CB-CZ 3.82Å; L43-F74 HydrophobicContact CD2-CB 3.83Å; L43-F74 HydrophobicContact CD2-CD1 3.85Å; L43-F74 HydrophobicContact CD2-CD2 4.09Å; L43-F74 HydrophobicContact CD2-CE1 4.43Å; L43-F74 HydrophobicContact CD2-CG 3.65Å; L43-L76 HydrophobicContact CD2-CD1 4.33Å; L43-L76 HydrophobicContact CD2-CD2 4.19Å; L43-L86 HydrophobicContact CD1-CB 4.06Å; L43-L86 HydrophobicContact CD1-CD2 4.23Å; L43-F88 HydrophobicContact CB-CD1 4.25Å; L43-F88 HydrophobicContact CB-CE1 4.18Å; L43-F88 HydrophobicContact CD1-CD1 4Å; L43-F88 HydrophobicContact CD1-CD2 4.33Å; L43-F88 HydrophobicContact CD1-CE1 3.65Å; L43-F88 HydrophobicContact CD1-CE2 3.99Å; L43-F88 HydrophobicContact CD1-CG 4.34Å; L43-F88 HydrophobicContact CD1-CZ 3.66Å; L43-F88 HydrophobicContact CD2-CE1 4.32Å; L43-F88 HydrophobicContact CG-CE1 4.25Å
44	Y	94.9	Very high	82.6	Confident	26 Å²	26	58.4 Å²	58.4	10%	0.102	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.8	167.2	-58.2	-99.1	0	0	0	110.4	V42 W53 R54 E55 R87 D89 L100	V42-Y44 HydrophobicContact CB-CE2 3.85Å; V42-Y44 HydrophobicContact CG1-CD2 4.03Å; V42-Y44 HydrophobicContact CG1-CE1 4.39Å; V42-Y44 HydrophobicContact CG1-CE2 3.33Å; Y44-W53 HydrophobicContact CD1-CB 4.45Å; Y44-R54 CarbonylContact C-O 3.53Å; Y44-R54 VanDerWaalsContact CA-O 3.23Å; Y44-R54 WeakPolarHBondContact CA-O 3.12Å; Y44-E55 HydrophobicContact CD1-CB 4.01Å; Y44-E55 HydrophobicContact CE1-CB 3.85Å; Y44-E55 HydrophobicContact CE1-CG 4.33Å; Y44-R87 VanDerWaalsContact CE2-NH2 3.34Å; Y44-R87 PolarHBondContact N-O 2.97Å; Y44-R87 PolarHBondContact O-N 3.24Å; Y44-D89 WeakPolarHBondContact CD2-OD2 3.34Å; Y44-D89 HydrophobicContact CE2-CB 4.07Å; Y44-D89 WeakPolarHBondContact CE2-OD2 3.5Å; Y44-L100 WeakPolarHBondContact OH-CD1 3.37Å
45	V	93.1	Very high	84.3	Confident	36 Å²	36	53 Å²	53	22%	0.218	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.5	174.8	-64.9	0	0	0	0	109.8	L43 R54 F56 L76 L86	L43-V45 HydrophobicContact CG-CG1 4.49Å; V45-R54 PolarHBondContact N-O 2.97Å; V45-R54 PolarHBondContact O-N 3.15Å; V45-F56 HydrophobicContact CG1-CB 3.93Å; V45-F56 HydrophobicContact CG1-CD2 3.94Å; V45-F56 HydrophobicContact CG1-CG 4.12Å; V45-F56 HydrophobicContact CG2-CB 4.21Å; V45-F56 HydrophobicContact CG2-CD2 4.11Å; V45-L76 HydrophobicContact CG1-CD2 4.28Å; V45-L86 HydrophobicContact CG1-CD2 3.91Å
46	Q	88.1	Confident	85.5	Confident	49 Å²	49	54.6 Å²	54.6	23%	0.229	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.4	174.6	-170	171.3	58.9	0	0	109.8	T50 K51 W53 N85	Q46-T50 VanDerWaalsContact CD-O 3.26Å; Q46-T50 WeakPolarHBondContact CG-O 3.48Å; Q46-T50 PolarHBondContact NE2-O 2.8Å; Q46-K51 PolarHBondContact NE2-O 3.47Å; Q46-W53 HydrophobicContact CB-CD2 4.41Å; Q46-W53 HydrophobicContact CB-CE3 4.02Å; Q46-W53 HydrophobicContact CB-CH2 4.25Å; Q46-W53 HydrophobicContact CB-CZ3 3.94Å; Q46-N85 HydrophobicContact CB-CB 4.13Å; Q46-N85 PolarHBondContact N-O 2.64Å; Q46-N85 PolarHBondContact OE1-ND2 2.77Å
47	G	76.7	Confident	86.3	Confident	18 Å²	18	50.2 Å²	50.2	19%	0.186	25%	0.245	C	C	.	.			trans	-74.6	149.9	176.4	0	0	0	0	0	112	G49 T50	G47-G49 PolarHBondContact O-N 3.3Å; G47-T50 WeakPolarHBondContact CA-OG1 3.15Å; G47-T50 PolarHBondContact N-OG1 3.36Å; G47-T50 PolarHBondContact O-N 3.14Å; G47-T50 PolarHBondContact O-OG1 2.89Å
48	L	71.6	Confident	87	Confident	80 Å²	80	53.3 Å²	53.3	42%	0.419	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	125.9	179	-156.4	96.9	0	0	0	111.5	T50 E82 L532 A535	L48-T50 PolarHBondContact O-N 2.78Å; L48-T50 VanDerWaalsContact O-N 3.13Å; L48-E82 HydrophobicContact CD1-CB 4.49Å; L48-E82 HydrophobicContact CD1-CG 4.3Å; L48-L532 HydrophobicContact CD2-CD2 4.36Å; L48-A535 HydrophobicContact CD1-CB 4.11Å; L48-A535 HydrophobicContact CD2-CB 3.86Å; L48-A535 HydrophobicContact CG-CB 3.95Å
49	G	65.8	Low	87.2	Confident	27 Å²	27	51.9 Å²	51.9	28%	0.278	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	2.5	179.6	0	0	0	0	0	115.9	G47	G47-G49 PolarHBondContact O-N 3.3Å
50	T	73.3	Confident	87.2	Confident	53 Å²	53	54.7 Å²	54.7	33%	0.325	26%	0.262	S	S	.	.			trans	-103.4	148.4	176.7	72.1	0	0	0	0	110.7	Q46 G47 L48 E52	Q46-T50 VanDerWaalsContact CD-O 3.26Å; Q46-T50 WeakPolarHBondContact CG-O 3.48Å; Q46-T50 PolarHBondContact NE2-O 2.8Å; G47-T50 WeakPolarHBondContact CA-OG1 3.15Å; G47-T50 PolarHBondContact N-OG1 3.36Å; G47-T50 PolarHBondContact O-N 3.14Å; G47-T50 PolarHBondContact O-OG1 2.89Å; L48-T50 PolarHBondContact O-N 2.78Å; L48-T50 VanDerWaalsContact O-N 3.13Å; T50-E52 VanDerWaalsContact C-N 3.34Å
51	K	76.8	Confident	87.1	Confident	159 Å²	159	57.5 Å²	57.5	69%	0.691	28%	0.279	S	S	*	.			trans	-91.4	-2.9	169.8	-67.5	-173.6	177.8	-178.2	0	112.5	Q46 L142	Q46-K51 PolarHBondContact NE2-O 3.47Å; K51-L142 HydrophobicContact CD-CD1 4.4Å
52	E	86.1	Confident	86.4	Confident	144 Å²	144	59.5 Å²	59.5	67%	0.673	29%	0.289	S	S	*	.			trans	-84	131.9	-173.7	-64	-173.5	168	0	0	111.4	T50	T50-E52 VanDerWaalsContact C-N 3.34Å
53	W	90.4	Very high	85.9	Confident	73 Å²	73	66.9 Å²	66.9	28%	0.277	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	129.3	174	-68.8	97.9	0	0	0	109.6	Y44 Q46 N85 R87 F110	Y44-W53 HydrophobicContact CD1-CB 4.45Å; Q46-W53 HydrophobicContact CB-CD2 4.41Å; Q46-W53 HydrophobicContact CB-CE3 4.02Å; Q46-W53 HydrophobicContact CB-CH2 4.25Å; Q46-W53 HydrophobicContact CB-CZ3 3.94Å; W53-N85 HydrophobicContact CH2-CB 3.98Å; W53-N85 HydrophobicContact CZ3-CB 4.47Å; W53-R87 HydrophobicContact CD2-CB 4.23Å; W53-R87 HydrophobicContact CE3-CB 3.75Å; W53-R87 HydrophobicContact CH2-CB 3.75Å; W53-R87 HydrophobicContact CZ2-CB 4.24Å; W53-R87 HydrophobicContact CZ3-CB 3.5Å; W53-F110 AromaticContact CH2-CD1 3.95Å; W53-F110 HydrophobicContact CH2-CD1 3.95Å; W53-F110 HydrophobicContact CH2-CE1 4.31Å; W53-F110 AromaticContact CZ2-CD1 3.69Å; W53-F110 HydrophobicContact CZ2-CD1 3.69Å; W53-F110 AromaticContact CZ2-CE1 3.69Å; W53-F110 HydrophobicContact CZ2-CE1 3.69Å
54	R	91.3	Very high	85.2	Confident	149 Å²	149	71.3 Å²	71.3	56%	0.562	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.7	176.3	-73.3	-175.3	-88.8	178.7	-7.1	109.6	Y44 V45 F56	Y44-R54 CarbonylContact C-O 3.53Å; Y44-R54 VanDerWaalsContact CA-O 3.23Å; Y44-R54 WeakPolarHBondContact CA-O 3.12Å; V45-R54 PolarHBondContact N-O 2.97Å; V45-R54 PolarHBondContact O-N 3.15Å; R54-F56 PolarHBondContact O-N 2.83Å
55	E	93.4	Very high	84.5	Confident	89 Å²	89	71.5 Å²	71.5	42%	0.416	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	121	175.1	-171.8	-176.2	140.9	0	0	108.9	V42 Y44 R58	V42-E55 HydrophobicContact CG1-CG 3.8Å; Y44-E55 HydrophobicContact CD1-CB 4.01Å; Y44-E55 HydrophobicContact CE1-CB 3.85Å; Y44-E55 HydrophobicContact CE1-CG 4.33Å; E55-R58 VanDerWaalsContact CD-NE 3.35Å; E55-R58 WeakPolarHBondContact OE1-CG 3.41Å; E55-R58 IonicContact OE1-CZ 2.62Å; E55-R58 IonicContact OE1-NE 3.92Å; E55-R58 PolarHBondContact OE1-NE 3.35Å; E55-R58 IonicContact OE1-NH2 2.77Å; E55-R58 PolarHBondContact OE1-NH2 2.88Å; E55-R58 IonicContact OE2-CZ 3.32Å; E55-R58 IonicContact OE2-NE 3.62Å; E55-R58 PolarHBondContact OE2-NE 3.01Å; E55-R58 IonicContact OE2-NH2 3.7Å; E55-R58 PolarHBondContact OE2-NH2 2.96Å
56	F	92.6	Very high	84.1	Confident	95 Å²	95	71.4 Å²	71.4	42%	0.417	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-42.9	176	-174.4	-92.1	0	0	0	110.8	L43 V45 R54 F74 V75 L76	L43-F56 HydrophobicContact CB-CB 4.41Å; L43-F56 HydrophobicContact CD2-CB 4.16Å; L43-F56 HydrophobicContact CD2-CD1 3.79Å; L43-F56 HydrophobicContact CD2-CG 4.14Å; L43-F56 HydrophobicContact CG-CB 3.94Å; L43-F56 HydrophobicContact CG-CD1 4.45Å; L43-F56 HydrophobicContact CG-CG 4.45Å; L43-F56 WeakPolarHBondContact O-CB 3.46Å; L43-F56 PolarHBondContact O-N 2.91Å; V45-F56 HydrophobicContact CG1-CB 3.93Å; V45-F56 HydrophobicContact CG1-CD2 3.94Å; V45-F56 HydrophobicContact CG1-CG 4.12Å; V45-F56 HydrophobicContact CG2-CB 4.21Å; V45-F56 HydrophobicContact CG2-CD2 4.11Å; R54-F56 PolarHBondContact O-N 2.83Å; F56-F74 HydrophobicContact CD1-CD1 4.13Å; F56-F74 HydrophobicContact CE1-CD1 4.49Å; F56-V75 VanDerWaalsContact CZ-O 3.25Å; F56-V75 WeakPolarHBondContact CZ-O 3.47Å; F56-L76 HydrophobicContact CD1-CD2 4.14Å; F56-L76 HydrophobicContact CD2-CD2 4.02Å; F56-L76 HydrophobicContact CE1-CD2 3.8Å; F56-L76 HydrophobicContact CE2-CD2 3.68Å; F56-L76 HydrophobicContact CG-CD2 4.24Å; F56-L76 HydrophobicContact CZ-CD2 3.58Å
57	G	92.1	Very high	83.8	Confident	9 Å²	9	72.4 Å²	72.4	9%	0.093	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.2	179.5	177.8	0	0	0	0	0	112.9	L43	L43-G57 PolarHBondContact N-O 3.27Å; L43-G57 PolarHBondContact O-N 3.14Å
58	R	93.7	Very high	84.2	Confident	66 Å²	66	71.6 Å²	71.6	25%	0.249	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.6	-180	-48.9	-172.4	-173.8	173.4	1.9	110.6	V40 V41 V42 E55 R72 C98	V40-R58 HydrophobicContact CG2-CB 4.44Å; V41-R58 CarbonylContact O-C 3.52Å; V41-R58 VanDerWaalsContact O-CA 3.31Å; V41-R58 WeakPolarHBondContact O-CA 3.35Å; V42-R58 HydrophobicContact CB-CG 4.43Å; V42-R58 HydrophobicContact CG1-CG 4.09Å; V42-R58 HydrophobicContact CG2-CG 3.98Å; E55-R58 VanDerWaalsContact CD-NE 3.35Å; E55-R58 WeakPolarHBondContact OE1-CG 3.41Å; E55-R58 IonicContact OE1-CZ 2.62Å; E55-R58 IonicContact OE1-NE 3.92Å; E55-R58 PolarHBondContact OE1-NE 3.35Å; E55-R58 IonicContact OE1-NH2 2.77Å; E55-R58 PolarHBondContact OE1-NH2 2.88Å; E55-R58 IonicContact OE2-CZ 3.32Å; E55-R58 IonicContact OE2-NE 3.62Å; E55-R58 PolarHBondContact OE2-NE 3.01Å; E55-R58 IonicContact OE2-NH2 3.7Å; E55-R58 PolarHBondContact OE2-NH2 2.96Å; R58-R72 WeakPolarHBondContact O-CD 3.23Å; R58-R72 PolarHBondContact O-NE 3.43Å; R58-R72 PolarHBondContact O-NH1 2.84Å; R58-C98 PolarHBondContact NH1-O 2.88Å
59	T	90	Very high	84.6	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.049	35%	0.352	C	S	.	.			trans	-70.2	174	167.3	63.2	0	0	0	0	111	V41 F70 F74	V41-T59 HydrophobicContact CB-CG2 3.92Å; V41-T59 PolarHBondContact N-OG1 3.41Å; V41-T59 PolarHBondContact O-N 2.73Å; T59-F70 HydrophobicContact CG2-CB 3.94Å; T59-F70 HydrophobicContact CG2-CD1 4.09Å; T59-F70 HydrophobicContact CG2-CD2 4.27Å; T59-F70 HydrophobicContact CG2-CG 3.84Å; T59-F70 WeakPolarHBondContact OG1-CD1 3.5Å; T59-F70 WeakPolarHBondContact OG1-CE1 3.22Å; T59-F74 HydrophobicContact CG2-CE2 3.96Å; T59-F74 HydrophobicContact CG2-CZ 3.81Å
60	E	87	Confident	85.3	Confident	60 Å²	60	71.4 Å²	71.4	28%	0.28	34%	0.341	S	S	.	.			trans	-67.1	163.3	159.3	74.4	-75.6	-176.5	0	0	111.7	I62 F70 V71 R72	E60-I62 HydrophobicContact CG-CG1 4.36Å; E60-F70 WeakPolarHBondContact O-CD1 3.04Å; E60-F70 VanDerWaalsContact O-CE1 3.31Å; E60-F70 WeakPolarHBondContact O-CE1 3.2Å; E60-F70 VanDerWaalsContact OE1-CA 3.31Å; E60-F70 WeakPolarHBondContact OE1-CA 3.15Å; E60-V71 PolarHBondContact OE1-N 2.98Å; E60-R72 WeakPolarHBondContact OE2-CB 3.39Å; E60-R72 PolarHBondContact OE2-N 3.18Å
61	V	88.4	Confident	85.5	Confident	66 Å²	66	74.7 Å²	74.7	40%	0.4	36%	0.36	S	S	.	.			trans	-89.6	132.8	172.3	-173.8	0	0	0	0	108.1	D38 V40 V93	D38-V61 HydrophobicContact CB-CG1 3.94Å; V40-V61 HydrophobicContact CB-CG2 4.22Å; V40-V61 HydrophobicContact CG2-CG2 4.38Å; V61-V93 HydrophobicContact CG1-CB 4.02Å; V61-V93 HydrophobicContact CG1-CG2 4.08Å; V61-V93 HydrophobicContact CG2-CB 4.39Å; V61-V93 HydrophobicContact CG2-CG1 4.38Å; V61-V93 HydrophobicContact CG2-CG2 3.9Å
62	I	78.9	Confident	85.5	Confident	42 Å²	42	73.6 Å²	73.6	22%	0.215	35%	0.352	C	S	.	.			trans	-110.8	118.4	174.7	-58.2	-180	0	0	0	108.4	D38 P39 E60 T65 P68 D69 F70	D38-I62 WeakPolarHBondContact CA-O 3.47Å; P39-I62 WeakPolarHBondContact CD-O 3.31Å; P39-I62 PolarHBondContact O-N 3.07Å; E60-I62 HydrophobicContact CG-CG1 4.36Å; I62-T65 HydrophobicContact CB-CG2 3.99Å; I62-T65 HydrophobicContact CG2-CG2 3.49Å; I62-T65 VanDerWaalsContact CG2-CG2 3.49Å; I62-P68 HydrophobicContact CB-CB 4.31Å; I62-P68 HydrophobicContact CD1-CB 3.82Å; I62-P68 HydrophobicContact CG1-CB 4.49Å; I62-D69 WeakPolarHBondContact CD1-O 3.29Å; I62-F70 HydrophobicContact CD1-CD1 3.7Å; I62-F70 HydrophobicContact CD1-CE1 3.99Å; I62-F70 HydrophobicContact CD1-CG 4.3Å; I62-F70 HydrophobicContact CG1-CD1 4.02Å; I62-F70 HydrophobicContact CG1-CE1 4.05Å
63	E	83.3	Confident	85.5	Confident	156 Å²	156	70.6 Å²	70.6	73%	0.729	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	140.6	-174	-62.1	179.7	176.2	0	0	112.2	D38 T65	D38-E63 WeakPolarHBondContact OD1-CA 3.48Å; E63-T65 PolarHBondContact O-N 2.85Å
64	N	81.3	Confident	85.5	Confident	93 Å²	93	67.3 Å²	67.3	50%	0.497	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	49.8	166.8	-166.1	20.1	0	0	0	114.4	K36 S37 D38	K36-N64 WeakPolarHBondContact CB-OD1 3.36Å; K36-N64 WeakPolarHBondContact CG-OD1 3.41Å; K36-N64 PolarHBondContact N-OD1 2.89Å; S37-N64 PolarHBondContact O-N 3.35Å; D38-N64 PolarHBondContact OD1-N 3.34Å
65	T	81.2	Confident	85.4	Confident	30 Å²	30	63 Å²	63	18%	0.184	32%	0.315	C	S	.	.			trans	-143.4	141.7	178.9	-169.9	0	0	0	0	113.7	S37 P39 I62 E63 N67 P68	S37-T65 PolarHBondContact O-N 3.11Å; S37-T65 VanDerWaalsContact O-O 3.09Å; P39-T65 WeakPolarHBondContact CD-O 3.32Å; P39-T65 HydrophobicContact CG-CG2 3.94Å; I62-T65 HydrophobicContact CB-CG2 3.99Å; I62-T65 HydrophobicContact CG2-CG2 3.49Å; I62-T65 VanDerWaalsContact CG2-CG2 3.49Å; E63-T65 PolarHBondContact O-N 2.85Å; T65-N67 PolarHBondContact OG1-N 2.67Å; T65-N67 VanDerWaalsContact OG1-N 3.09Å; T65-P68 HydrophobicContact CG2-CB 3.88Å
66	L	84.3	Confident	85.3	Confident	34 Å²	34	59.3 Å²	59.3	18%	0.178	30%	0.297	C	S	.	.	S	Bend	trans	-98.9	-1.6	169.5	-54.5	179.5	0	0	0	112.2	R26 N27 L28 D30 K36 P68	R26-L66 CarbonylContact C-O 3.46Å; N27-L66 PolarHBondContact N-O 2.79Å; N27-L66 VanDerWaalsContact N-O 3.09Å; L28-L66 HydrophobicContact CB-CB 4.34Å; L28-L66 HydrophobicContact CB-CD2 4.38Å; L28-L66 PolarHBondContact N-O 2.87Å; D30-L66 HydrophobicContact CB-CD1 4.15Å; D30-L66 HydrophobicContact CB-CD2 4.14Å; K36-L66 HydrophobicContact CB-CD2 4.22Å; K36-L66 HydrophobicContact CB-CG 4.33Å; K36-L66 HydrophobicContact CD-CG 4.41Å; K36-L66 HydrophobicContact CG-CG 4.48Å; L66-P68 VanDerWaalsContact C-CD 3.47Å
67	N	82.6	Confident	85.1	Confident	69 Å²	69	57.9 Å²	57.9	37%	0.369	29%	0.294	S	S	.	.	S	Bend	trans	-132.8	60.6	-177.8	-58	-74.8	0	0	0	110.6	C25 R26 N27 T65	C25-N67 CarbonylContact O-C 3.49Å; C25-N67 WeakPolarHBondContact O-CA 3.46Å; R26-N67 VanDerWaalsContact CA-OD1 3.27Å; R26-N67 WeakPolarHBondContact CA-OD1 3.26Å; N27-N67 PolarHBondContact N-OD1 3.36Å; T65-N67 PolarHBondContact OG1-N 2.67Å; T65-N67 VanDerWaalsContact OG1-N 3.09Å
68	P	83.9	Confident	85	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	29%	0.29	C	S	.	.			trans	-67.8	138.4	-178.9	30.2	-37.4	0	0	0	111.7	S24 C25 R26 L28 P39 I62 T65 L66 F70	S24-P68 CarbonylContact C-O 3.59Å; S24-P68 VanDerWaalsContact CA-O 3.31Å; S24-P68 WeakPolarHBondContact CA-O 3.48Å; S24-P68 VanDerWaalsContact CB-O 3.27Å; S24-P68 WeakPolarHBondContact CB-O 3.33Å; C25-P68 HydrophobicContact CB-CG 3.66Å; C25-P68 PolarHBondContact N-O 2.85Å; R26-P68 PolarHBondContact NH1-O 3.39Å; L28-P68 HydrophobicContact CD1-CG 3.93Å; P39-P68 HydrophobicContact CB-CB 4.49Å; P39-P68 HydrophobicContact CB-CG 3.97Å; P39-P68 HydrophobicContact CG-CB 3.68Å; P39-P68 HydrophobicContact CG-CG 3.51Å; I62-P68 HydrophobicContact CB-CB 4.31Å; I62-P68 HydrophobicContact CD1-CB 3.82Å; I62-P68 HydrophobicContact CG1-CB 4.49Å; T65-P68 HydrophobicContact CG2-CB 3.88Å; L66-P68 VanDerWaalsContact C-CD 3.47Å; P68-F70 HydrophobicContact CB-CD2 4.43Å; P68-F70 HydrophobicContact CB-CE1 4.01Å; P68-F70 HydrophobicContact CB-CE2 3.77Å; P68-F70 HydrophobicContact CB-CZ 3.54Å; P68-F70 HydrophobicContact CG-CE2 3.69Å; P68-F70 HydrophobicContact CG-CZ 3.64Å
69	D	79.6	Confident	84.8	Confident	95 Å²	95	55.7 Å²	55.7	51%	0.508	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-114.4	109.1	164.7	-69.8	-50.8	0	0	0	107.7	S24 R26 I62	S24-D69 WeakPolarHBondContact CB-OD1 3.3Å; R26-D69 IonicContact CZ-OD1 3.52Å; R26-D69 VanDerWaalsContact CZ-OD1 3.25Å; R26-D69 IonicContact NH1-OD1 3.58Å; R26-D69 PolarHBondContact NH1-OD1 3.39Å; R26-D69 IonicContact NH1-OD2 2.73Å; R26-D69 IonicContact NH2-OD1 3.53Å; R26-D69 PolarHBondContact NH2-OD1 3.03Å; R26-D69 IonicContact NH2-OD2 3.99Å; I62-D69 WeakPolarHBondContact CD1-O 3.29Å
70	F	80.9	Confident	84.7	Confident	9 Å²	9	55.3 Å²	55.3	4%	0.039	28%	0.282	C	S	.	.			trans	-84.8	135.8	-174.1	-58.2	-79.7	0	0	0	111.3	V23 P39 V41 T59 E60 I62 P68	V23-F70 HydrophobicContact CB-CD2 4.44Å; V23-F70 HydrophobicContact CG1-CD2 4.45Å; V23-F70 WeakPolarHBondContact O-CD2 3.14Å; V23-F70 PolarHBondContact O-N 2.63Å; P39-F70 HydrophobicContact CB-CZ 4.28Å; V41-F70 HydrophobicContact CB-CE2 4.48Å; V41-F70 HydrophobicContact CG2-CD2 4.18Å; V41-F70 HydrophobicContact CG2-CE2 3.46Å; V41-F70 VanDerWaalsContact CG2-CE2 3.46Å; V41-F70 HydrophobicContact CG2-CZ 3.79Å; T59-F70 HydrophobicContact CG2-CB 3.94Å; T59-F70 HydrophobicContact CG2-CD1 4.09Å; T59-F70 HydrophobicContact CG2-CD2 4.27Å; T59-F70 HydrophobicContact CG2-CG 3.84Å; T59-F70 WeakPolarHBondContact OG1-CD1 3.5Å; T59-F70 WeakPolarHBondContact OG1-CE1 3.22Å; E60-F70 WeakPolarHBondContact O-CD1 3.04Å; E60-F70 VanDerWaalsContact O-CE1 3.31Å; E60-F70 WeakPolarHBondContact O-CE1 3.2Å; E60-F70 VanDerWaalsContact OE1-CA 3.31Å; E60-F70 WeakPolarHBondContact OE1-CA 3.15Å; I62-F70 HydrophobicContact CD1-CD1 3.7Å; I62-F70 HydrophobicContact CD1-CE1 3.99Å; I62-F70 HydrophobicContact CD1-CG 4.3Å; I62-F70 HydrophobicContact CG1-CD1 4.02Å; I62-F70 HydrophobicContact CG1-CE1 4.05Å; P68-F70 HydrophobicContact CB-CD2 4.43Å; P68-F70 HydrophobicContact CB-CE1 4.01Å; P68-F70 HydrophobicContact CB-CE2 3.77Å; P68-F70 HydrophobicContact CB-CZ 3.54Å; P68-F70 HydrophobicContact CG-CE2 3.69Å; P68-F70 HydrophobicContact CG-CZ 3.64Å
71	V	77.1	Confident	84.8	Confident	121 Å²	121	53.7 Å²	53.7	73%	0.733	27%	0.274	S	S	*	.	S	Bend	trans	-79.3	-39.7	175.3	-179.7	0	0	0	0	110.5	E60 K73	E60-V71 PolarHBondContact OE1-N 2.98Å; V71-K73 PolarHBondContact O-N 2.98Å
72	R	78.4	Confident	84.7	Confident	136 Å²	136	52.3 Å²	52.3	51%	0.513	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-69.9	121.7	179.7	-176.4	167.6	178.1	-178.2	7.3	110.6	R58 E60	R58-R72 WeakPolarHBondContact O-CD 3.23Å; R58-R72 PolarHBondContact O-NE 3.43Å; R58-R72 PolarHBondContact O-NH1 2.84Å; E60-R72 WeakPolarHBondContact OE2-CB 3.39Å; E60-R72 PolarHBondContact OE2-N 3.18Å
73	K	84.8	Confident	85.1	Confident	81 Å²	81	53.4 Å²	53.4	35%	0.352	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-97.5	152.2	177.3	-69.9	142.7	153.8	-139.8	0	111.5	E20 T22 V71	E20-K73 VanDerWaalsContact CD-CD 3.41Å; E20-K73 HydrophobicContact CG-CB 3.49Å; E20-K73 VanDerWaalsContact CG-CB 3.49Å; E20-K73 HydrophobicContact CG-CD 3.97Å; E20-K73 HydrophobicContact CG-CG 3.87Å; E20-K73 WeakPolarHBondContact OE1-CD 3.15Å; E20-K73 WeakPolarHBondContact OE1-CE 3.25Å; E20-K73 IonicContact OE1-NZ 3.69Å; E20-K73 PolarHBondContact OE1-NZ 3.38Å; E20-K73 IonicContact OE2-NZ 3.69Å; T22-K73 WeakPolarHBondContact OG1-CE 3.37Å; V71-K73 PolarHBondContact O-N 2.98Å
74	F	90.6	Very high	85.5	Confident	5 Å²	5	47.7 Å²	47.7	2%	0.022	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.4	172.7	-60.6	-69.7	0	0	0	109.7	E20 V21 V23 L43 F56 T59 F88	E20-F74 CarbonylContact C-O 3.55Å; E20-F74 WeakPolarHBondContact CA-O 3.49Å; V21-F74 HydrophobicContact CB-CB 4.39Å; V21-F74 PolarHBondContact N-O 2.62Å; V21-F74 PolarHBondContact O-N 3.02Å; V23-F74 HydrophobicContact CG2-CD2 3.9Å; V23-F74 HydrophobicContact CG2-CE2 3.82Å; L43-F74 HydrophobicContact CB-CD1 4.09Å; L43-F74 HydrophobicContact CB-CD2 4.38Å; L43-F74 HydrophobicContact CB-CE1 3.81Å; L43-F74 HydrophobicContact CB-CE2 4.12Å; L43-F74 HydrophobicContact CB-CG 4.37Å; L43-F74 HydrophobicContact CB-CZ 3.82Å; L43-F74 HydrophobicContact CD2-CB 3.83Å; L43-F74 HydrophobicContact CD2-CD1 3.85Å; L43-F74 HydrophobicContact CD2-CD2 4.09Å; L43-F74 HydrophobicContact CD2-CE1 4.43Å; L43-F74 HydrophobicContact CD2-CG 3.65Å; F56-F74 HydrophobicContact CD1-CD1 4.13Å; F56-F74 HydrophobicContact CE1-CD1 4.49Å; T59-F74 HydrophobicContact CG2-CE2 3.96Å; T59-F74 HydrophobicContact CG2-CZ 3.81Å; F74-F88 HydrophobicContact CD2-CE1 4.22Å; F74-F88 HydrophobicContact CE2-CE1 4.23Å
75	V	90.3	Very high	86	Confident	59 Å²	59	45.3 Å²	45.3	36%	0.358	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	110.4	178.8	177.7	0	0	0	0	109.4	K18 I19 E20 F56 L167	K18-V75 HydrophobicContact CB-CG1 4.35Å; K18-V75 HydrophobicContact CD-CG1 4.2Å; I19-V75 CarbonylContact O-C 3.52Å; I19-V75 WeakPolarHBondContact O-CA 3.23Å; E20-V75 HydrophobicContact CG-CG2 4.47Å; F56-V75 VanDerWaalsContact CZ-O 3.25Å; F56-V75 WeakPolarHBondContact CZ-O 3.47Å; V75-L167 HydrophobicContact CB-CD1 4.21Å; V75-L167 HydrophobicContact CG1-CD1 3.5Å; V75-L167 HydrophobicContact CG2-CD1 3.74Å
76	L	90.6	Very high	86.7	Confident	10 Å²	10	44 Å²	44	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.7	-175.6	-62.2	168.6	0	0	0	110.5	K18 I19 V21 L43 V45 F56 L86 L113	K18-L76 CarbonylContact C-O 3.52Å; K18-L76 WeakPolarHBondContact CA-O 3.38Å; I19-L76 PolarHBondContact N-O 3.17Å; I19-L76 PolarHBondContact O-N 3.06Å; V21-L76 HydrophobicContact CG2-CD1 4.08Å; L43-L76 HydrophobicContact CD2-CD1 4.33Å; L43-L76 HydrophobicContact CD2-CD2 4.19Å; V45-L76 HydrophobicContact CG1-CD2 4.28Å; F56-L76 HydrophobicContact CD1-CD2 4.14Å; F56-L76 HydrophobicContact CD2-CD2 4.02Å; F56-L76 HydrophobicContact CE1-CD2 3.8Å; F56-L76 HydrophobicContact CE2-CD2 3.68Å; F56-L76 HydrophobicContact CG-CD2 4.24Å; F56-L76 HydrophobicContact CZ-CD2 3.58Å; L76-L86 HydrophobicContact CD1-CD1 4.09Å; L76-L86 HydrophobicContact CD1-CD2 4.07Å; L76-L113 HydrophobicContact CB-CD2 4Å; L76-L113 HydrophobicContact CD1-CD1 4.03Å; L76-L113 HydrophobicContact CD1-CD2 4.27Å
77	D	88.9	Confident	87.2	Confident	65 Å²	65	44.7 Å²	44.7	35%	0.348	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	135	165.4	-72	-44.8	0	0	0	109.1	P15 K18 F79 Q84	P15-D77 HydrophobicContact CB-CB 3.9Å; P15-D77 HydrophobicContact CG-CB 4.39Å; K18-D77 IonicContact NZ-OD1 3.41Å; K18-D77 PolarHBondContact NZ-OD1 2.79Å; K18-D77 IonicContact NZ-OD2 2.71Å; D77-F79 HydrophobicContact CB-CE2 3.82Å; D77-F79 HydrophobicContact CB-CZ 4.42Å; D77-Q84 PolarHBondContact O-NE2 2.89Å
78	Y	88.8	Confident	87.7	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.7	-179.4	172.5	-104.7	0	0	0	111.5	A16 T17 I19 F80 L113 I117 V313 Y368	A16-Y78 HydrophobicContact CB-CD1 4.31Å; A16-Y78 PolarHBondContact N-O 3.44Å; T17-Y78 HydrophobicContact CG2-CD1 3.92Å; T17-Y78 HydrophobicContact CG2-CG 4.43Å; T17-Y78 PolarHBondContact O-N 2.89Å; I19-Y78 HydrophobicContact CG1-CG 4.07Å; Y78-F80 HydrophobicContact CE1-CB 4.24Å; Y78-L113 HydrophobicContact CD2-CD2 3.99Å; Y78-L113 HydrophobicContact CD2-CG 4.19Å; Y78-I117 HydrophobicContact CD2-CD1 3.44Å; Y78-I117 VanDerWaalsContact CD2-CD1 3.44Å; Y78-I117 HydrophobicContact CE2-CD1 3.43Å; Y78-I117 VanDerWaalsContact CE2-CD1 3.43Å; Y78-I117 HydrophobicContact CG-CD1 4.12Å; Y78-V313 HydrophobicContact CD1-CG2 4.22Å; Y78-V313 HydrophobicContact CE1-CG2 3.89Å; Y78-Y368 WeakPolarHBondContact CE2-OH 3.36Å; Y78-Y368 VanDerWaalsContact OH-CE1 3.3Å; Y78-Y368 WeakPolarHBondContact OH-CE1 3.29Å; Y78-Y368 VanDerWaalsContact OH-CZ 3.31Å; Y78-Y368 PolarHBondContact OH-OH 3.25Å
79	F	89.1	Confident	88.2	Confident	27 Å²	27	41.5 Å²	41.5	12%	0.118	20%	0.202	C	C	.	.			trans	-128.8	115.4	176.1	-60	-87.4	0	0	0	107.1	P15 D77 E81 E82 Q84	P15-F79 HydrophobicContact CB-CE1 3.91Å; P15-F79 HydrophobicContact CB-CE2 4.17Å; P15-F79 HydrophobicContact CB-CZ 3.66Å; P15-F79 HydrophobicContact CG-CZ 4.49Å; D77-F79 HydrophobicContact CB-CE2 3.82Å; D77-F79 HydrophobicContact CB-CZ 4.42Å; F79-E81 PolarHBondContact O-N 2.92Å; F79-E82 HydrophobicContact CB-CB 3.93Å; F79-E82 HydrophobicContact CB-CG 3.84Å; F79-E82 HydrophobicContact CG-CG 4.48Å; F79-E82 PolarHBondContact O-N 2.98Å; F79-Q84 PolarHBondContact O-OE1 2.67Å
80	F	88.8	Confident	88.7	Confident	1 Å²	1	37 Å²	37	0%	0.004	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-36.2	-177.9	165.1	-103.4	0	0	0	111.3	Y78 E82 F312 L322 I364 Y368 L542 I545 P546	Y78-F80 HydrophobicContact CE1-CB 4.24Å; F80-E82 VanDerWaalsContact C-N 3.26Å; F80-E82 PolarHBondContact O-N 2.86Å; F80-F312 AromaticContact CD2-CE1 3.57Å; F80-F312 HydrophobicContact CD2-CE1 3.57Å; F80-F312 AromaticContact CD2-CZ 3.61Å; F80-F312 HydrophobicContact CD2-CZ 3.61Å; F80-F312 HydrophobicContact CE2-CE1 4.05Å; F80-F312 AromaticContact CE2-CZ 3.61Å; F80-F312 HydrophobicContact CE2-CZ 3.61Å; F80-F312 HydrophobicContact CG-CE1 4.21Å; F80-F312 HydrophobicContact CG-CZ 4.35Å; F80-F312 HydrophobicContact CZ-CZ 4.35Å; F80-L322 HydrophobicContact CE2-CD1 3.88Å; F80-L322 HydrophobicContact CZ-CD1 3.98Å; F80-I364 WeakPolarHBondContact O-CG2 3.48Å; F80-Y368 HydrophobicContact CD2-CD2 4.43Å; F80-Y368 HydrophobicContact CD2-CE1 4.18Å; F80-Y368 AromaticContact CD2-CE2 3.89Å; F80-Y368 HydrophobicContact CD2-CE2 3.89Å; F80-Y368 AromaticContact CD2-CZ 3.75Å; F80-Y368 HydrophobicContact CE2-CD1 4.47Å; F80-Y368 AromaticContact CE2-CD2 3.85Å; F80-Y368 HydrophobicContact CE2-CD2 3.85Å; F80-Y368 HydrophobicContact CE2-CE1 4.36Å; F80-Y368 AromaticContact CE2-CE2 3.74Å; F80-Y368 HydrophobicContact CE2-CE2 3.74Å; F80-Y368 HydrophobicContact CE2-CG 4.23Å; F80-L542 HydrophobicContact CD1-CB 4.19Å; F80-L542 WeakPolarHBondContact CD1-O 3.19Å; F80-L542 HydrophobicContact CE1-CB 3.82Å; F80-L542 HydrophobicContact CE1-CD2 4.18Å; F80-L542 HydrophobicContact CE1-CG 4.45Å; F80-L542 WeakPolarHBondContact CE1-O 3.33Å; F80-I545 HydrophobicContact CE1-CB 3.76Å; F80-I545 HydrophobicContact CE1-CG1 4.39Å; F80-I545 HydrophobicContact CE1-CG2 4.06Å; F80-I545 HydrophobicContact CZ-CB 4.23Å; F80-I545 HydrophobicContact CZ-CG2 4.01Å; F80-P546 HydrophobicContact CB-CG 3.97Å; F80-P546 HydrophobicContact CD1-CG 3.54Å; F80-P546 HydrophobicContact CE1-CG 4.21Å; F80-P546 HydrophobicContact CG-CG 3.78Å
81	E	88.3	Confident	89.1	Confident	25 Å²	25	37.9 Å²	37.9	12%	0.117	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	3.2	-174.5	73.9	-78.7	-173.1	0	0	113.7	F79 I364 K539 L542	F79-E81 PolarHBondContact O-N 2.92Å; E81-I364 WeakPolarHBondContact O-CD1 3.45Å; E81-K539 HydrophobicContact CG-CB 4.18Å; E81-K539 HydrophobicContact CG-CG 3.64Å; E81-L542 HydrophobicContact CB-CB 3.78Å
82	E	87.6	Confident	89.6	Confident	37 Å²	37	32.1 Å²	32.1	17%	0.173	15%	0.146	C	C	.	.	S	Bend	trans	-121.1	138.6	179.7	-60	-170	179.8	0	0	112.9	L48 F79 F80 Q84 K539	L48-E82 HydrophobicContact CD1-CB 4.49Å; L48-E82 HydrophobicContact CD1-CG 4.3Å; F79-E82 HydrophobicContact CB-CB 3.93Å; F79-E82 HydrophobicContact CB-CG 3.84Å; F79-E82 HydrophobicContact CG-CG 4.48Å; F79-E82 PolarHBondContact O-N 2.98Å; F80-E82 VanDerWaalsContact C-N 3.26Å; F80-E82 PolarHBondContact O-N 2.86Å; E82-Q84 HydrophobicContact CB-CG 4.19Å; E82-Q84 PolarHBondContact O-N 2.95Å; E82-Q84 VanDerWaalsContact O-N 3.08Å; E82-K539 IonicContact OE1-NZ 2.97Å; E82-K539 PolarHBondContact OE1-NZ 2.94Å
83	K	87.6	Confident	89.7	Confident	65 Å²	65	26.6 Å²	26.6	28%	0.283	13%	0.128	S	C	.	.			trans	-78.7	92.7	170.5	-170.1	167.1	178.7	164.8	0	110.8	N85 T112 E363 I364	K83-N85 PolarHBondContact O-N 3.29Å; K83-T112 HydrophobicContact CG-CG2 4.11Å; K83-E363 HydrophobicContact CD-CB 4.39Å; K83-E363 IonicContact NZ-OE2 2.72Å; K83-E363 PolarHBondContact NZ-OE2 2.89Å; K83-I364 HydrophobicContact CB-CD1 4.49Å; K83-I364 HydrophobicContact CB-CG1 4.14Å
84	Q	90.9	Very high	88.9	Confident	36 Å²	36	24.9 Å²	24.9	17%	0.168	12%	0.122	C	C	.	.			trans	-88.5	88.6	-176.7	-57.5	-176.8	-91.1	0	0	111.5	D77 F79 E82 T112 L113	D77-Q84 PolarHBondContact O-NE2 2.89Å; F79-Q84 PolarHBondContact O-OE1 2.67Å; E82-Q84 HydrophobicContact CB-CG 4.19Å; E82-Q84 PolarHBondContact O-N 2.95Å; E82-Q84 VanDerWaalsContact O-N 3.08Å; Q84-T112 CarbonylContact O-C 3.49Å; Q84-T112 VanDerWaalsContact O-CA 3.29Å; Q84-T112 WeakPolarHBondContact O-CA 3.21Å; Q84-L113 HydrophobicContact CB-CB 3.98Å; Q84-L113 PolarHBondContact O-N 2.89Å
85	N	92.8	Very high	87.5	Confident	43 Å²	43	32.8 Å²	32.8	23%	0.23	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	130.9	-178.3	-62.8	-38.8	0	0	0	112.4	Q46 W53 K83	Q46-N85 HydrophobicContact CB-CB 4.13Å; Q46-N85 PolarHBondContact N-O 2.64Å; Q46-N85 PolarHBondContact OE1-ND2 2.77Å; W53-N85 HydrophobicContact CH2-CB 3.98Å; W53-N85 HydrophobicContact CZ3-CB 4.47Å; K83-N85 PolarHBondContact O-N 3.29Å
86	L	94.8	Very high	86.1	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.3	178.7	-51.7	-179.9	0	0	0	110.1	L43 V45 L76 F88 F110 C111 L113 I116	L43-L86 HydrophobicContact CD1-CB 4.06Å; L43-L86 HydrophobicContact CD1-CD2 4.23Å; V45-L86 HydrophobicContact CG1-CD2 3.91Å; L76-L86 HydrophobicContact CD1-CD1 4.09Å; L76-L86 HydrophobicContact CD1-CD2 4.07Å; L86-F88 HydrophobicContact CB-CD2 4.37Å; L86-F88 HydrophobicContact CB-CE2 3.71Å; L86-F88 HydrophobicContact CB-CZ 4.4Å; L86-F88 HydrophobicContact CD1-CE2 4.01Å; L86-F88 HydrophobicContact CD1-CZ 4.11Å; L86-F110 WeakPolarHBondContact O-CA 3.49Å; L86-C111 WeakPolarHBondContact CA-O 3.45Å; L86-C111 PolarHBondContact N-O 2.84Å; L86-C111 PolarHBondContact O-N 2.69Å; L86-C111 VanDerWaalsContact O-N 3.09Å; L86-L113 HydrophobicContact CD1-CB 4.07Å; L86-L113 HydrophobicContact CD1-CD1 4.32Å; L86-I116 HydrophobicContact CD1-CD1 3.95Å
87	R	94.8	Very high	84.9	Confident	47 Å²	47	43.6 Å²	43.6	18%	0.177	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.2	168.8	-177.1	-173.6	85.2	-169.3	2.4	109.2	Y44 W53 D89 I109 F110	Y44-R87 VanDerWaalsContact CE2-NH2 3.34Å; Y44-R87 PolarHBondContact N-O 2.97Å; Y44-R87 PolarHBondContact O-N 3.24Å; W53-R87 HydrophobicContact CD2-CB 4.23Å; W53-R87 HydrophobicContact CE3-CB 3.75Å; W53-R87 HydrophobicContact CH2-CB 3.75Å; W53-R87 HydrophobicContact CZ2-CB 4.24Å; W53-R87 HydrophobicContact CZ3-CB 3.5Å; R87-D89 WeakPolarHBondContact CD-OD1 3.34Å; R87-D89 WeakPolarHBondContact CG-OD1 3.38Å; R87-D89 IonicContact CZ-OD2 3.99Å; R87-D89 VanDerWaalsContact CZ-OD2 3.26Å; R87-D89 IonicContact NE-OD1 3.85Å; R87-D89 PolarHBondContact NE-OD1 3.45Å; R87-D89 VanDerWaalsContact NE-OD1 3.16Å; R87-D89 IonicContact NE-OD2 3.33Å; R87-D89 PolarHBondContact NE-OD2 3.41Å; R87-D89 IonicContact NH2-OD2 2.91Å; R87-D89 PolarHBondContact NH2-OD2 3.09Å; R87-I109 WeakPolarHBondContact CA-O 3.26Å; R87-F110 HydrophobicContact CB-CD1 3.89Å; R87-F110 HydrophobicContact CB-CE1 3.94Å; R87-F110 HydrophobicContact CG-CD1 3.84Å; R87-F110 HydrophobicContact CG-CE1 3.55Å; R87-F110 HydrophobicContact CG-CZ 4.01Å
88	F	94.4	Very high	83.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.2	176	-61.8	-97.6	0	0	0	109.2	V23 V41 V42 L43 F74 L86 Q108 I109 I116 I160 F162	V23-F88 HydrophobicContact CG2-CE1 4.16Å; V41-F88 HydrophobicContact CG1-CB 4.21Å; V41-F88 HydrophobicContact CG1-CD1 3.9Å; V42-F88 WeakPolarHBondContact O-CA 3.45Å; L43-F88 HydrophobicContact CB-CD1 4.25Å; L43-F88 HydrophobicContact CB-CE1 4.18Å; L43-F88 HydrophobicContact CD1-CD1 4Å; L43-F88 HydrophobicContact CD1-CD2 4.33Å; L43-F88 HydrophobicContact CD1-CE1 3.65Å; L43-F88 HydrophobicContact CD1-CE2 3.99Å; L43-F88 HydrophobicContact CD1-CG 4.34Å; L43-F88 HydrophobicContact CD1-CZ 3.66Å; L43-F88 HydrophobicContact CD2-CE1 4.32Å; L43-F88 HydrophobicContact CG-CE1 4.25Å; F74-F88 HydrophobicContact CD2-CE1 4.22Å; F74-F88 HydrophobicContact CE2-CE1 4.23Å; L86-F88 HydrophobicContact CB-CD2 4.37Å; L86-F88 HydrophobicContact CB-CE2 3.71Å; L86-F88 HydrophobicContact CB-CZ 4.4Å; L86-F88 HydrophobicContact CD1-CE2 4.01Å; L86-F88 HydrophobicContact CD1-CZ 4.11Å; F88-Q108 CarbonylContact O-C 3.51Å; F88-Q108 WeakPolarHBondContact O-CA 3.43Å; F88-I109 HydrophobicContact CB-CG2 3.77Å; F88-I109 HydrophobicContact CD2-CG2 4.23Å; F88-I109 HydrophobicContact CG-CG2 4.43Å; F88-I109 PolarHBondContact N-O 3.36Å; F88-I109 PolarHBondContact O-N 2.98Å; F88-I116 HydrophobicContact CE2-CD1 4.48Å; F88-I160 HydrophobicContact CB-CD1 4.14Å; F88-F162 HydrophobicContact CB-CE1 4.48Å; F88-F162 HydrophobicContact CB-CZ 4.29Å; F88-F162 AromaticContact CD1-CE1 3.68Å; F88-F162 HydrophobicContact CD1-CE1 3.68Å; F88-F162 HydrophobicContact CD1-CZ 4.27Å; F88-F162 AromaticContact CD2-CE1 3.68Å; F88-F162 HydrophobicContact CD2-CE1 3.68Å; F88-F162 AromaticContact CD2-CZ 3.57Å; F88-F162 HydrophobicContact CD2-CZ 3.57Å; F88-F162 HydrophobicContact CE1-CD1 4.24Å; F88-F162 AromaticContact CE1-CE1 3.61Å; F88-F162 HydrophobicContact CE1-CE1 3.61Å; F88-F162 HydrophobicContact CE1-CZ 4.47Å; F88-F162 HydrophobicContact CE2-CD1 4.33Å; F88-F162 AromaticContact CE2-CE1 3.63Å; F88-F162 HydrophobicContact CE2-CE1 3.63Å; F88-F162 AromaticContact CE2-CZ 3.83Å; F88-F162 HydrophobicContact CE2-CZ 3.83Å; F88-F162 AromaticContact CG-CE1 3.69Å; F88-F162 HydrophobicContact CG-CE1 3.69Å; F88-F162 AromaticContact CG-CZ 3.8Å; F88-F162 HydrophobicContact CG-CZ 3.8Å; F88-F162 HydrophobicContact CZ-CD1 4.04Å; F88-F162 AromaticContact CZ-CE1 3.59Å; F88-F162 HydrophobicContact CZ-CE1 3.59Å; F88-F162 HydrophobicContact CZ-CZ 4.27Å
89	D	93.5	Very high	82.8	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.7	177	-61	-16.2	0	0	0	108.6	V41 V42 Y44 R87 Y91 F105 Q108	V41-D89 WeakPolarHBondContact CA-O 3.46Å; V42-D89 PolarHBondContact N-O 3.41Å; V42-D89 PolarHBondContact O-N 3.37Å; Y44-D89 WeakPolarHBondContact CD2-OD2 3.34Å; Y44-D89 HydrophobicContact CE2-CB 4.07Å; Y44-D89 WeakPolarHBondContact CE2-OD2 3.5Å; R87-D89 WeakPolarHBondContact CD-OD1 3.34Å; R87-D89 WeakPolarHBondContact CG-OD1 3.38Å; R87-D89 IonicContact CZ-OD2 3.99Å; R87-D89 VanDerWaalsContact CZ-OD2 3.26Å; R87-D89 IonicContact NE-OD1 3.85Å; R87-D89 PolarHBondContact NE-OD1 3.45Å; R87-D89 VanDerWaalsContact NE-OD1 3.16Å; R87-D89 IonicContact NE-OD2 3.33Å; R87-D89 PolarHBondContact NE-OD2 3.41Å; R87-D89 IonicContact NH2-OD2 2.91Å; R87-D89 PolarHBondContact NH2-OD2 3.09Å; D89-Y91 HydrophobicContact CB-CD2 4.34Å; D89-Y91 HydrophobicContact CB-CE2 3.5Å; D89-F105 HydrophobicContact CB-CE2 4.16Å; D89-Q108 WeakPolarHBondContact OD1-CB 3.36Å
90	V	90.9	Very high	81.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.3	-179.6	-167.8	0	0	0	0	109	L28 V40 V41 L106 G107 L128 I160	L28-V90 HydrophobicContact CD1-CG1 4.35Å; L28-V90 HydrophobicContact CD2-CG1 4.33Å; V40-V90 WeakPolarHBondContact O-CA 3.15Å; V41-V90 HydrophobicContact CG2-CG1 4.47Å; V41-V90 HydrophobicContact CG2-CG2 4.23Å; V90-L106 HydrophobicContact CB-CB 4.27Å; V90-L106 HydrophobicContact CG1-CB 4.19Å; V90-L106 HydrophobicContact CG1-CD1 4.12Å; V90-L106 PolarHBondContact O-N 3.32Å; V90-G107 PolarHBondContact N-O 3.19Å; V90-G107 PolarHBondContact O-N 2.87Å; V90-L128 HydrophobicContact CB-CD1 4.35Å; V90-L128 HydrophobicContact CG2-CD1 3.92Å; V90-L128 HydrophobicContact CG2-CD2 3.75Å; V90-I160 HydrophobicContact CG2-CD1 4.22Å
91	Y	89.3	Confident	81	Confident	29 Å²	29	53.7 Å²	53.7	11%	0.114	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.5	180	-61.8	-93.7	0	0	0	111.3	P39 V40 V42 D89 L100 H103 D104 F105	P39-Y91 CarbonylContact C-O 3.35Å; P39-Y91 VanDerWaalsContact CA-O 3.28Å; P39-Y91 WeakPolarHBondContact CA-O 3.47Å; V40-Y91 PolarHBondContact N-O 3.33Å; V40-Y91 PolarHBondContact O-N 3.11Å; V42-Y91 HydrophobicContact CB-CE2 4.39Å; V42-Y91 HydrophobicContact CG2-CD2 3.92Å; V42-Y91 HydrophobicContact CG2-CE2 3.9Å; D89-Y91 HydrophobicContact CB-CD2 4.34Å; D89-Y91 HydrophobicContact CB-CE2 3.5Å; Y91-L100 HydrophobicContact CD2-CD2 4.04Å; Y91-L100 HydrophobicContact CE2-CD1 4.5Å; Y91-L100 HydrophobicContact CE2-CD2 4.09Å; Y91-L100 HydrophobicContact CG-CD2 4.43Å; Y91-H103 HydrophobicContact CD1-CB 4.29Å; Y91-D104 CarbonylContact C-O 3.54Å; Y91-D104 VanDerWaalsContact CA-O 3.3Å; Y91-D104 WeakPolarHBondContact CA-O 3.37Å; Y91-F105 HydrophobicContact CD1-CB 4.22Å; Y91-F105 HydrophobicContact CD1-CD2 4.14Å; Y91-F105 HydrophobicContact CE1-CB 4.16Å; Y91-F105 AromaticContact CE1-CD2 3.7Å; Y91-F105 HydrophobicContact CE1-CD2 3.7Å; Y91-F105 HydrophobicContact CE1-CG 4.42Å; Y91-F105 AromaticContact CZ-CD2 3.95Å
92	N	85.9	Confident	80	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119.3	164.6	-179.3	45	0	0	0	109.4	S37 D38 D94 H103 D104 L106	S37-N92 WeakPolarHBondContact CA-OD1 3.18Å; S37-N92 WeakPolarHBondContact CB-OD1 3.15Å; D38-N92 PolarHBondContact N-OD1 3.29Å; N92-D94 VanDerWaalsContact ND2-CG 3.35Å; N92-D94 PolarHBondContact ND2-OD1 2.84Å; N92-D94 PolarHBondContact ND2-OD2 3.38Å; N92-D94 PolarHBondContact O-N 3.25Å; N92-H103 WeakPolarHBondContact O-CA 3.33Å; N92-H103 VanDerWaalsContact O-CB 3.26Å; N92-H103 WeakPolarHBondContact O-CB 3.48Å; N92-D104 HydrophobicContact CB-CB 4.07Å; N92-D104 PolarHBondContact N-O 2.85Å; N92-D104 PolarHBondContact O-N 3.31Å; N92-L106 HydrophobicContact CB-CD1 4Å; N92-L106 HydrophobicContact CB-CD2 4.03Å; N92-L106 HydrophobicContact CB-CG 4Å
93	V	82	Confident	79.6	Confident	20 Å²	20	57.5 Å²	57.5	12%	0.121	29%	0.287	C	S	.	.			trans	-87.8	88.7	-172.2	-178.3	0	0	0	0	111.4	D38 V40 V61 M95 H103	D38-V93 HydrophobicContact CB-CB 4.47Å; D38-V93 PolarHBondContact O-N 2.84Å; V40-V93 HydrophobicContact CB-CG2 3.92Å; V40-V93 HydrophobicContact CG1-CG2 3.41Å; V40-V93 VanDerWaalsContact CG1-CG2 3.41Å; V61-V93 HydrophobicContact CG1-CB 4.02Å; V61-V93 HydrophobicContact CG1-CG2 4.08Å; V61-V93 HydrophobicContact CG2-CB 4.39Å; V61-V93 HydrophobicContact CG2-CG1 4.38Å; V61-V93 HydrophobicContact CG2-CG2 3.9Å; V93-M95 PolarHBondContact O-N 3.05Å; V93-H103 VanDerWaalsContact CG1-CE1 3.49Å; V93-H103 WeakPolarHBondContact CG1-CE1 3.17Å
94	D	68	Low	79.3	Confident	45 Å²	45	58.2 Å²	58.2	24%	0.241	29%	0.294	C	S	.	.			trans	-85.8	111.3	173.7	-56.8	-52.3	0	0	0	110.5	N92	N92-D94 VanDerWaalsContact ND2-CG 3.35Å; N92-D94 PolarHBondContact ND2-OD1 2.84Å; N92-D94 PolarHBondContact ND2-OD2 3.38Å; N92-D94 PolarHBondContact O-N 3.25Å
95	M	61.4	Low	79	Confident	170 Å²	170	59.5 Å²	59.5	84%	0.837	30%	0.299	S	S	*	.	S	Bend	trans	75.9	146.1	-173.1	-49	-176.8	-177.5	0	0	115.7	V93 S97	V93-M95 PolarHBondContact O-N 3.05Å; M95-S97 PolarHBondContact O-N 2.92Å
96	R	60.7	Low	78.6	Confident	259 Å²	259	57.5 Å²	57.5	98%	0.977	29%	0.288	S	S	*	.	S	Bend	trans	-65.6	56.4	178.5	-61.1	-179.6	-179.4	179	-0.8	113.9
97	S	64.6	Low	78.3	Confident	37 Å²	37	57.3 Å²	57.3	26%	0.259	29%	0.287	S	S	.	.			trans	-108.5	148.7	172.9	-157.3	0	0	0	0	110	M95 N99 H103	M95-S97 PolarHBondContact O-N 2.92Å; S97-N99 VanDerWaalsContact C-N 3.33Å; S97-H103 PolarHBondContact O-CE1 3.48Å; S97-H103 PolarHBondContact O-NE2 2.78Å
98	C	62.9	Low	78.2	Confident	109 Å²	109	56.8 Å²	56.8	74%	0.736	29%	0.287	S	S	*	.	S	Bend	trans	-89.3	-0.8	172.9	54.9	0	0	0	0	113.2	R58	R58-C98 PolarHBondContact NH1-O 2.88Å
99	N	70.4	Confident	78.1	Confident	74 Å²	74	57.4 Å²	57.4	40%	0.396	29%	0.29	S	S	.	.			trans	-92.5	112	-175.2	-175	-2.2	0	0	0	111.2	S97 S101 K102 H103	S97-N99 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact ND2-OG 2.9Å; N99-S101 PolarHBondContact O-N 2.96Å; N99-S101 VanDerWaalsContact O-N 3.15Å; N99-S101 PolarHBondContact OD1-N 2.8Å; N99-S101 VanDerWaalsContact OD1-N 3.12Å; N99-S101 PolarHBondContact OD1-OG 3.44Å; N99-S101 VanDerWaalsContact OD1-OG 3.12Å; N99-K102 HydrophobicContact CB-CD 4.29Å; N99-K102 HydrophobicContact CB-CG 4.37Å; N99-K102 WeakPolarHBondContact O-CB 3.42Å; N99-K102 PolarHBondContact O-N 3.08Å; N99-K102 VanDerWaalsContact O-N 3.09Å; N99-H103 PolarHBondContact O-NE2 2.78Å
100	L	70.3	Confident	78.1	Confident	23 Å²	23	61.8 Å²	61.8	12%	0.12	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-57.5	-27.6	-179.4	-65	173.6	0	0	0	113.8	V42 Y44 Y91 K102 H103	V42-L100 HydrophobicContact CG1-CD1 4.36Å; V42-L100 HydrophobicContact CG2-CD1 4.15Å; V42-L100 HydrophobicContact CG2-CD2 3.76Å; Y44-L100 WeakPolarHBondContact OH-CD1 3.37Å; Y91-L100 HydrophobicContact CD2-CD2 4.04Å; Y91-L100 HydrophobicContact CE2-CD1 4.5Å; Y91-L100 HydrophobicContact CE2-CD2 4.09Å; Y91-L100 HydrophobicContact CG-CD2 4.43Å; L100-K102 PolarHBondContact O-N 2.77Å; L100-H103 PolarHBondContact O-N 2.88Å
101	S	70.6	Confident	78.2	Confident	101 Å²	101	62.2 Å²	62.2	71%	0.706	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-68.8	-5.6	179.3	79.7	0	0	0	0	113.9	N99	N99-S101 PolarHBondContact ND2-OG 2.9Å; N99-S101 PolarHBondContact O-N 2.96Å; N99-S101 VanDerWaalsContact O-N 3.15Å; N99-S101 PolarHBondContact OD1-N 2.8Å; N99-S101 VanDerWaalsContact OD1-N 3.12Å; N99-S101 PolarHBondContact OD1-OG 3.44Å; N99-S101 VanDerWaalsContact OD1-OG 3.12Å
102	K	67.4	Low	78.4	Confident	125 Å²	125	61.3 Å²	61.3	54%	0.543	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-107	-0.4	-179.7	-60.6	-176.6	-180	177.6	0	112.8	N99 L100	N99-K102 HydrophobicContact CB-CD 4.29Å; N99-K102 HydrophobicContact CB-CG 4.37Å; N99-K102 WeakPolarHBondContact O-CB 3.42Å; N99-K102 PolarHBondContact O-N 3.08Å; N99-K102 VanDerWaalsContact O-N 3.09Å; L100-K102 PolarHBondContact O-N 2.77Å
103	H	78.1	Confident	78.7	Confident	17 Å²	17	61.3 Å²	61.3	8%	0.079	31%	0.31	C	S	.	.	S	Bend	trans	-108.7	146.3	-176.6	-60.8	-37.3	0	0	0	109.8	Y91 N92 V93 S97 N99 L100	Y91-H103 HydrophobicContact CD1-CB 4.29Å; N92-H103 WeakPolarHBondContact O-CA 3.33Å; N92-H103 VanDerWaalsContact O-CB 3.26Å; N92-H103 WeakPolarHBondContact O-CB 3.48Å; V93-H103 VanDerWaalsContact CG1-CE1 3.49Å; V93-H103 WeakPolarHBondContact CG1-CE1 3.17Å; S97-H103 PolarHBondContact O-CE1 3.48Å; S97-H103 PolarHBondContact O-NE2 2.78Å; N99-H103 PolarHBondContact O-NE2 2.78Å; L100-H103 PolarHBondContact O-N 2.88Å
104	D	80.9	Confident	79.1	Confident	80 Å²	80	60.7 Å²	60.7	43%	0.428	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.1	-178.2	-79.2	-11.8	0	0	0	110.2	Y91 N92 L106	Y91-D104 CarbonylContact C-O 3.54Å; Y91-D104 VanDerWaalsContact CA-O 3.3Å; Y91-D104 WeakPolarHBondContact CA-O 3.37Å; N92-D104 HydrophobicContact CB-CB 4.07Å; N92-D104 PolarHBondContact N-O 2.85Å; N92-D104 PolarHBondContact O-N 3.31Å; D104-L106 PolarHBondContact O-N 2.8Å
105	F	86.3	Confident	80.3	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.281	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	120.9	-178.3	177.7	-103.7	0	0	0	110.8	D89 Y91 G107 Q108 L130	D89-F105 HydrophobicContact CB-CE2 4.16Å; Y91-F105 HydrophobicContact CD1-CB 4.22Å; Y91-F105 HydrophobicContact CD1-CD2 4.14Å; Y91-F105 HydrophobicContact CE1-CB 4.16Å; Y91-F105 AromaticContact CE1-CD2 3.7Å; Y91-F105 HydrophobicContact CE1-CD2 3.7Å; Y91-F105 HydrophobicContact CE1-CG 4.42Å; Y91-F105 AromaticContact CZ-CD2 3.95Å; F105-G107 WeakPolarHBondContact CE2-O 3.45Å; F105-Q108 HydrophobicContact CE2-CB 4.16Å; F105-Q108 HydrophobicContact CZ-CB 3.68Å; F105-Q108 HydrophobicContact CZ-CG 3.89Å; F105-L130 HydrophobicContact CD1-CD2 4.39Å
106	L	84.1	Confident	81.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-31.6	-177.6	-64.1	179.4	0	0	0	112.3	L28 M31 V90 N92 D104	L28-L106 HydrophobicContact CD1-CD1 4.22Å; M31-L106 HydrophobicContact CE-CD2 4.06Å; M31-L106 HydrophobicContact CG-CD2 3.54Å; V90-L106 HydrophobicContact CB-CB 4.27Å; V90-L106 HydrophobicContact CG1-CB 4.19Å; V90-L106 HydrophobicContact CG1-CD1 4.12Å; V90-L106 PolarHBondContact O-N 3.32Å; N92-L106 HydrophobicContact CB-CD1 4Å; N92-L106 HydrophobicContact CB-CD2 4.03Å; N92-L106 HydrophobicContact CB-CG 4Å; D104-L106 PolarHBondContact O-N 2.8Å
107	G	88.3	Confident	83.1	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.9	172.7	176	0	0	0	0	0	113.2	V90 F105 S129	V90-G107 PolarHBondContact N-O 3.19Å; V90-G107 PolarHBondContact O-N 2.87Å; F105-G107 WeakPolarHBondContact CE2-O 3.45Å; G107-S129 CarbonylContact C-O 3.51Å; G107-S129 VanDerWaalsContact CA-O 3.29Å; G107-S129 WeakPolarHBondContact CA-O 3.45Å
108	Q	91.7	Very high	84.2	Confident	36 Å²	36	39.2 Å²	39.2	17%	0.168	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	162.1	176.7	62.8	-177.1	25.2	0	0	111.7	F88 D89 F105 F110 S129	F88-Q108 CarbonylContact O-C 3.51Å; F88-Q108 WeakPolarHBondContact O-CA 3.43Å; D89-Q108 WeakPolarHBondContact OD1-CB 3.36Å; F105-Q108 HydrophobicContact CE2-CB 4.16Å; F105-Q108 HydrophobicContact CZ-CB 3.68Å; F105-Q108 HydrophobicContact CZ-CG 3.89Å; Q108-F110 HydrophobicContact CG-CE2 4.36Å; Q108-S129 PolarHBondContact N-O 2.96Å; Q108-S129 PolarHBondContact O-N 3.33Å; Q108-S129 PolarHBondContact O-OG 3.45Å
109	I	93.1	Very high	85.3	Confident	14 Å²	14	34.8 Å²	34.8	7%	0.072	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.3	166.9	-177.6	161.4	0	0	0	111.3	R87 F88 R126 I160 F162	R87-I109 WeakPolarHBondContact CA-O 3.26Å; F88-I109 HydrophobicContact CB-CG2 3.77Å; F88-I109 HydrophobicContact CD2-CG2 4.23Å; F88-I109 HydrophobicContact CG-CG2 4.43Å; F88-I109 PolarHBondContact N-O 3.36Å; F88-I109 PolarHBondContact O-N 2.98Å; I109-R126 HydrophobicContact CD1-CB 3.04Å; I109-R126 HydrophobicContact CD1-CG 3.46Å; I109-R126 VanDerWaalsContact CD1-CG 3.46Å; I109-I160 HydrophobicContact CB-CG2 4.45Å; I109-I160 HydrophobicContact CD1-CG2 4.29Å; I109-I160 HydrophobicContact CG2-CG2 3.79Å; I109-F162 HydrophobicContact CD1-CE2 4.46Å; I109-F162 HydrophobicContact CG2-CE2 4.3Å; I109-F162 HydrophobicContact CG2-CZ 3.9Å
110	F	92.8	Very high	85.8	Confident	95 Å²	95	35.1 Å²	35.1	42%	0.417	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.5	167	-58	-92.6	0	0	0	109.1	W53 L86 R87 Q108	W53-F110 AromaticContact CH2-CD1 3.95Å; W53-F110 HydrophobicContact CH2-CD1 3.95Å; W53-F110 HydrophobicContact CH2-CE1 4.31Å; W53-F110 AromaticContact CZ2-CD1 3.69Å; W53-F110 HydrophobicContact CZ2-CD1 3.69Å; W53-F110 AromaticContact CZ2-CE1 3.69Å; W53-F110 HydrophobicContact CZ2-CE1 3.69Å; L86-F110 WeakPolarHBondContact O-CA 3.49Å; R87-F110 HydrophobicContact CB-CD1 3.89Å; R87-F110 HydrophobicContact CB-CE1 3.94Å; R87-F110 HydrophobicContact CG-CD1 3.84Å; R87-F110 HydrophobicContact CG-CE1 3.55Å; R87-F110 HydrophobicContact CG-CZ 4.01Å; Q108-F110 HydrophobicContact CG-CE2 4.36Å
111	C	93	Very high	86.2	Confident	8 Å²	8	34.5 Å²	34.5	5%	0.054	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	174.4	171.5	58.3	0	0	0	0	109.1	L86 E115 L124	L86-C111 WeakPolarHBondContact CA-O 3.45Å; L86-C111 PolarHBondContact N-O 2.84Å; L86-C111 PolarHBondContact O-N 2.69Å; L86-C111 VanDerWaalsContact O-N 3.09Å; C111-E115 VanDerWaalsContact CB-OE2 3.28Å; C111-E115 WeakPolarHBondContact CB-OE2 3.26Å; C111-L124 HydrophobicContact CB-CD2 4.21Å
112	T	93.3	Very high	86.8	Confident	10 Å²	10	29.7 Å²	29.7	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	158	169.3	67.3	0	0	0	0	110.4	K83 Q84 G114 E115 I116 D367	K83-T112 HydrophobicContact CG-CG2 4.11Å; Q84-T112 CarbonylContact O-C 3.49Å; Q84-T112 VanDerWaalsContact O-CA 3.29Å; Q84-T112 WeakPolarHBondContact O-CA 3.21Å; T112-G114 PolarHBondContact O-N 3.5Å; T112-E115 PolarHBondContact O-N 3.49Å; T112-E115 VanDerWaalsContact OG1-CB 3.31Å; T112-E115 WeakPolarHBondContact OG1-CB 3.5Å; T112-E115 PolarHBondContact OG1-N 3.45Å; T112-I116 PolarHBondContact O-N 2.85Å; T112-D367 WeakPolarHBondContact CB-OD2 3.5Å; T112-D367 PolarHBondContact OG1-OD2 3.05Å
113	L	92.8	Very high	87.7	Confident	1 Å²	1	28 Å²	28	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-61.2	-37.3	170.4	-175.7	55.5	0	0	0	111.2	I19 V21 L76 Y78 Q84 L86 I116 I117	I19-L113 HydrophobicContact CB-CD1 4.46Å; I19-L113 HydrophobicContact CG2-CD1 4.13Å; V21-L113 HydrophobicContact CG2-CD1 4Å; L76-L113 HydrophobicContact CB-CD2 4Å; L76-L113 HydrophobicContact CD1-CD1 4.03Å; L76-L113 HydrophobicContact CD1-CD2 4.27Å; Y78-L113 HydrophobicContact CD2-CD2 3.99Å; Y78-L113 HydrophobicContact CD2-CG 4.19Å; Q84-L113 HydrophobicContact CB-CB 3.98Å; Q84-L113 PolarHBondContact O-N 2.89Å; L86-L113 HydrophobicContact CD1-CB 4.07Å; L86-L113 HydrophobicContact CD1-CD1 4.32Å; L113-I116 PolarHBondContact O-N 3.43Å; L113-I117 HydrophobicContact CD1-CD1 4.17Å; L113-I117 HydrophobicContact CG-CD1 3.89Å; L113-I117 WeakPolarHBondContact O-CG1 3.25Å; L113-I117 PolarHBondContact O-N 3.48Å
114	G	91	Very high	88.3	Confident	6 Å²	6	27.3 Å²	27.3	6%	0.062	15%	0.145	C	C	.	.	H	α-helix	trans	-57.9	-44.7	174	0	0	0	0	0	112.8	T112 I116 I117 G118	T112-G114 PolarHBondContact O-N 3.5Å; G114-I116 VanDerWaalsContact C-N 3.33Å; G114-I116 PolarHBondContact O-N 3.27Å; G114-I117 PolarHBondContact O-N 2.75Å; G114-I117 VanDerWaalsContact O-N 3.16Å; G114-G118 PolarHBondContact O-N 3Å
115	E	91.9	Very high	88.7	Confident	39 Å²	39	27.3 Å²	27.3	18%	0.182	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-38.5	178.7	-173.5	-175.2	-179.8	0	0	112.3	C111 T112 S119 L124 R126	C111-E115 VanDerWaalsContact CB-OE2 3.28Å; C111-E115 WeakPolarHBondContact CB-OE2 3.26Å; T112-E115 PolarHBondContact O-N 3.49Å; T112-E115 VanDerWaalsContact OG1-CB 3.31Å; T112-E115 WeakPolarHBondContact OG1-CB 3.5Å; T112-E115 PolarHBondContact OG1-N 3.45Å; E115-S119 WeakPolarHBondContact O-CB 3.37Å; E115-S119 PolarHBondContact O-N 3.04Å; E115-S119 VanDerWaalsContact O-N 3.14Å; E115-S119 PolarHBondContact O-OG 2.98Å; E115-L124 HydrophobicContact CG-CD2 4.21Å; E115-R126 IonicContact OE1-CZ 2.81Å; E115-R126 IonicContact OE1-NE 3.41Å; E115-R126 IonicContact OE1-NH2 3.95Å; E115-R126 PolarHBondContact OE1-NH2 3.12Å
116	I	90.9	Very high	88.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-43.3	176.4	-58	172	0	0	0	110.5	V21 L86 F88 T112 L113 G114 G122 L124 F162 A164	V21-I116 HydrophobicContact CG1-CD1 4.43Å; L86-I116 HydrophobicContact CD1-CD1 3.95Å; F88-I116 HydrophobicContact CE2-CD1 4.48Å; T112-I116 PolarHBondContact O-N 2.85Å; L113-I116 PolarHBondContact O-N 3.43Å; G114-I116 VanDerWaalsContact C-N 3.33Å; G114-I116 PolarHBondContact O-N 3.27Å; I116-G122 CarbonylContact O-C 3.49Å; I116-G122 WeakPolarHBondContact O-CA 3.16Å; I116-L124 HydrophobicContact CG1-CB 4.45Å; I116-L124 HydrophobicContact CG1-CD2 3.77Å; I116-L124 HydrophobicContact CG2-CB 4.48Å; I116-F162 HydrophobicContact CD1-CB 4.26Å; I116-F162 HydrophobicContact CD1-CG 4.21Å; I116-F162 HydrophobicContact CG1-CB 4.4Å; I116-F162 HydrophobicContact CG2-CB 3.9Å; I116-A164 HydrophobicContact CG2-CB 3.69Å
117	I	90.3	Very high	89.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-72.8	-41.3	-177.3	-65.8	164.4	0	0	0	111.7	I19 Y78 L113 G114 S119 A164 V313 I316 R317	I19-I117 HydrophobicContact CD1-CD1 4.09Å; I19-I117 HydrophobicContact CG1-CD1 3.86Å; I19-I117 HydrophobicContact CG2-CD1 4.4Å; I19-I117 HydrophobicContact CG2-CG1 4.5Å; Y78-I117 HydrophobicContact CD2-CD1 3.44Å; Y78-I117 VanDerWaalsContact CD2-CD1 3.44Å; Y78-I117 HydrophobicContact CE2-CD1 3.43Å; Y78-I117 VanDerWaalsContact CE2-CD1 3.43Å; Y78-I117 HydrophobicContact CG-CD1 4.12Å; L113-I117 HydrophobicContact CD1-CD1 4.17Å; L113-I117 HydrophobicContact CG-CD1 3.89Å; L113-I117 WeakPolarHBondContact O-CG1 3.25Å; L113-I117 PolarHBondContact O-N 3.48Å; G114-I117 PolarHBondContact O-N 2.75Å; G114-I117 VanDerWaalsContact O-N 3.16Å; I117-S119 VanDerWaalsContact C-N 3.26Å; I117-S119 PolarHBondContact O-N 3.38Å; I117-A164 HydrophobicContact CG1-CB 4.09Å; I117-V313 HydrophobicContact CG2-CG1 3.99Å; I117-I316 HydrophobicContact CG2-CG2 4.23Å; I117-R317 HydrophobicContact CG2-CG 4.48Å
118	G	87.6	Confident	89.1	Confident	22 Å²	22	33.5 Å²	33.5	23%	0.227	17%	0.174	C	C	.	.	H	α-helix	trans	-72.6	-15.7	178.5	0	0	0	0	0	113.9	G114	G114-G118 PolarHBondContact O-N 3Å
119	S	86.9	Confident	88.8	Confident	16 Å²	16	32.7 Å²	32.7	11%	0.112	17%	0.172	C	C	.	.	S	Bend	trans	-65.5	145.5	173.4	-68	0	0	0	0	111.4	E115 I117 G121 G122 R123	E115-S119 WeakPolarHBondContact O-CB 3.37Å; E115-S119 PolarHBondContact O-N 3.04Å; E115-S119 VanDerWaalsContact O-N 3.14Å; E115-S119 PolarHBondContact O-OG 2.98Å; I117-S119 VanDerWaalsContact C-N 3.26Å; I117-S119 PolarHBondContact O-N 3.38Å; S119-G121 PolarHBondContact O-N 3.05Å; S119-G122 WeakPolarHBondContact O-CA 3.31Å; S119-G122 PolarHBondContact O-N 3.01Å; S119-R123 WeakPolarHBondContact CB-O 3.24Å
120	P	81.2	Confident	87.9	Confident	80 Å²	80	34.8 Å²	34.8	52%	0.519	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-50.7	123.4	179.2	-29	35.5	0	0	0	113	G122 R123	P120-G122 PolarHBondContact O-N 2.99Å; P120-R123 PolarHBondContact O-N 3.23Å
121	G	77.9	Confident	86.3	Confident	10 Å²	10	31 Å²	31	10%	0.103	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	72.6	6.5	-177.2	0	0	0	0	0	115.3	S119 R123 Q564	S119-G121 PolarHBondContact O-N 3.05Å; G121-R123 VanDerWaalsContact C-N 3.27Å; G121-Q564 WeakPolarHBondContact CA-O 3.26Å
122	G	82.6	Confident	84.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	68.3	26.2	-170.1	0	0	0	0	0	112.7	I116 S119 P120 T163 A164	I116-G122 CarbonylContact O-C 3.49Å; I116-G122 WeakPolarHBondContact O-CA 3.16Å; S119-G122 WeakPolarHBondContact O-CA 3.31Å; S119-G122 PolarHBondContact O-N 3.01Å; P120-G122 PolarHBondContact O-N 2.99Å; G122-T163 CarbonylContact O-C 3.55Å; G122-T163 WeakPolarHBondContact O-CA 3.16Å; G122-A164 PolarHBondContact O-N 2.95Å
123	R	87.2	Confident	81.4	Confident	90 Å²	90	39.5 Å²	39.5	34%	0.34	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.6	-179.2	-175.3	-175.7	174.5	-81.1	-2.1	110.8	S119 P120 G121 E125 V161 F162	S119-R123 WeakPolarHBondContact CB-O 3.24Å; P120-R123 PolarHBondContact O-N 3.23Å; G121-R123 VanDerWaalsContact C-N 3.27Å; R123-E125 IonicContact CZ-OE2 3.73Å; R123-E125 IonicContact NH1-OE2 2.9Å; R123-E125 PolarHBondContact NH1-OE2 2.76Å; R123-E125 IonicContact NH2-OE2 2.7Å; R123-E125 PolarHBondContact NH2-OE2 3.01Å; R123-V161 HydrophobicContact CG-CG1 4.2Å; R123-F162 CarbonylContact C-O 3.54Å; R123-F162 VanDerWaalsContact CA-O 3.24Å; R123-F162 WeakPolarHBondContact CA-O 3.21Å
124	L	89.6	Confident	78.8	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.2	178.6	178	65.3	0	0	0	110	C111 E115 I116 R126 V161 F162	C111-L124 HydrophobicContact CB-CD2 4.21Å; E115-L124 HydrophobicContact CG-CD2 4.21Å; I116-L124 HydrophobicContact CG1-CB 4.45Å; I116-L124 HydrophobicContact CG1-CD2 3.77Å; I116-L124 HydrophobicContact CG2-CB 4.48Å; L124-R126 HydrophobicContact CD1-CG 4Å; L124-R126 HydrophobicContact CD2-CG 4.38Å; L124-R126 HydrophobicContact CG-CG 4.02Å; L124-V161 CarbonylContact O-C 3.39Å; L124-V161 WeakPolarHBondContact O-CA 3.33Å; L124-F162 HydrophobicContact CB-CB 4.33Å; L124-F162 HydrophobicContact CB-CD2 4.2Å; L124-F162 HydrophobicContact CD2-CD2 4.08Å; L124-F162 HydrophobicContact CG-CD2 4.19Å; L124-F162 PolarHBondContact N-O 3.2Å; L124-F162 PolarHBondContact O-N 3.15Å
125	E	90.3	Very high	75.8	Confident	80 Å²	80	53 Å²	53	37%	0.374	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.8	172.1	177.9	164.4	-172	0	0	110.4	R123 S159 I160 V161	R123-E125 IonicContact CZ-OE2 3.73Å; R123-E125 IonicContact NH1-OE2 2.9Å; R123-E125 PolarHBondContact NH1-OE2 2.76Å; R123-E125 IonicContact NH2-OE2 2.7Å; R123-E125 PolarHBondContact NH2-OE2 3.01Å; E125-S159 PolarHBondContact OE1-OG 2.79Å; E125-I160 WeakPolarHBondContact CA-O 3.36Å; E125-V161 HydrophobicContact CB-CG2 4.21Å; E125-V161 HydrophobicContact CG-CG2 3.89Å
126	R	90.3	Very high	73	Confident	102 Å²	102	62.3 Å²	62.3	39%	0.385	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.4	-175.6	-70	-77.4	-175	-96.7	3.7	111.6	I109 E115 L124 S159 I160	I109-R126 HydrophobicContact CD1-CB 3.04Å; I109-R126 HydrophobicContact CD1-CG 3.46Å; I109-R126 VanDerWaalsContact CD1-CG 3.46Å; E115-R126 IonicContact OE1-CZ 2.81Å; E115-R126 IonicContact OE1-NE 3.41Å; E115-R126 IonicContact OE1-NH2 3.95Å; E115-R126 PolarHBondContact OE1-NH2 3.12Å; L124-R126 HydrophobicContact CD1-CG 4Å; L124-R126 HydrophobicContact CD2-CG 4.38Å; L124-R126 HydrophobicContact CG-CG 4.02Å; R126-S159 CarbonylContact O-C 3.56Å; R126-S159 WeakPolarHBondContact O-CA 3.49Å; R126-S159 VanDerWaalsContact O-CB 3.28Å; R126-S159 WeakPolarHBondContact O-CB 3.41Å; R126-I160 PolarHBondContact N-O 2.97Å; R126-I160 PolarHBondContact O-N 3.48Å
127	T	89.9	Confident	70.1	Confident	84 Å²	84	69.5 Å²	69.5	52%	0.515	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.8	176.5	-55.8	0	0	0	0	110.2
128	L	86.8	Confident	67.3	Low	7 Å²	7	74.2 Å²	74.2	4%	0.037	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-71.4	136.1	175.1	-70.4	171.7	0	0	0	110.8	L28 V90 C157 G158 I160	L28-L128 HydrophobicContact CD2-CD1 3.44Å; L28-L128 VanDerWaalsContact CD2-CD1 3.44Å; V90-L128 HydrophobicContact CB-CD1 4.35Å; V90-L128 HydrophobicContact CG2-CD1 3.92Å; V90-L128 HydrophobicContact CG2-CD2 3.75Å; L128-C157 HydrophobicContact CB-CB 4.09Å; L128-C157 WeakPolarHBondContact CD1-O 3.42Å; L128-G158 PolarHBondContact N-O 3.11Å; L128-I160 HydrophobicContact CD2-CB 4.01Å; L128-I160 HydrophobicContact CD2-CG2 3.76Å; L128-I160 HydrophobicContact CG-CB 4.37Å; L128-I160 HydrophobicContact CG-CG2 4.34Å
129	S	84.8	Confident	64.8	Low	20 Å²	20	85.5 Å²	85.5	14%	0.14	46%	0.456	C	S	.	.	B	Isolated β-bridge	trans	-100.9	134.4	174	67.5	0	0	0	0	110.2	G107 Q108 G131	G107-S129 CarbonylContact C-O 3.51Å; G107-S129 VanDerWaalsContact CA-O 3.29Å; G107-S129 WeakPolarHBondContact CA-O 3.45Å; Q108-S129 PolarHBondContact N-O 2.96Å; Q108-S129 PolarHBondContact O-N 3.33Å; Q108-S129 PolarHBondContact O-OG 3.45Å; S129-G131 PolarHBondContact O-N 3.36Å; S129-G131 VanDerWaalsContact O-N 3.11Å
130	L	75.1	Confident	62.2	Low	57 Å²	57	90.7 Å²	90.7	30%	0.298	49%	0.487	S	S	.	.			trans	-73	104.4	163.2	-73.5	161.5	0	0	0	106.1	F105 C157	F105-L130 HydrophobicContact CD1-CD2 4.39Å; L130-C157 WeakPolarHBondContact CD1-SG 3.4Å; L130-C157 WeakPolarHBondContact CG-SG 3.44Å
131	G	60.1	Low	59.7	Low	17 Å²	17	93 Å²	93	18%	0.175	50%	0.5	C	S	.	.			trans	-49.1	146.7	170.1	0	0	0	0	0	109.9	S129 A133	S129-G131 PolarHBondContact O-N 3.36Å; S129-G131 VanDerWaalsContact O-N 3.11Å; G131-A133 VanDerWaalsContact C-N 3.27Å; G131-A133 PolarHBondContact O-N 3.01Å
132	A	45	Very low	57.6	Low	105 Å²	105	98.7 Å²	98.7	87%	0.868	53%	0.527	S	S	*	.			trans	-58.3	101	165.3	0	0	0	0	0	106.6	E134	A132-E134 PolarHBondContact O-N 3.16Å
133	A	38.2	Very low	55.2	Low	90 Å²	90	104.1 Å²	104.1	74%	0.744	56%	0.563	S	S	*	*			trans	-45.7	127.7	175.9	0	0	0	0	0	107.8	G131 S135	G131-A133 VanDerWaalsContact C-N 3.27Å; G131-A133 PolarHBondContact O-N 3.01Å; A133-S135 PolarHBondContact O-N 3.33Å
134	E	36.8	Very low	52.8	Low	189 Å²	189	107.8 Å²	107.8	88%	0.883	58%	0.584	S	S	*	*			trans	-46.1	97.2	-178.3	-68.9	-178.4	155.1	0	0	110.6	A132 R136	A132-E134 PolarHBondContact O-N 3.16Å; E134-R136 PolarHBondContact O-N 3.29Å
135	S	29.2	Very low	50.4	Low	103 Å²	103	111.3 Å²	111.3	72%	0.72	61%	0.609	S	S	*	*			trans	-70.3	100.9	167.2	-170.3	0	0	0	0	105.8	A133 N137	A133-S135 PolarHBondContact O-N 3.33Å; S135-N137 PolarHBondContact O-N 3.06Å
136	R	32.6	Very low	47.6	Very low	233 Å²	233	110.3 Å²	110.3	88%	0.879	62%	0.62	S	S	*	*	S	Bend	trans	-50.2	111.5	168.9	-75.6	-179.7	174	173.7	-1.2	107.9	E134	E134-R136 PolarHBondContact O-N 3.29Å
137	N	30.5	Very low	45.2	Very low	151 Å²	151	113 Å²	113	81%	0.807	64%	0.64	S	S	*	*	S	Bend	trans	92.1	77.5	-175.9	-55.4	-21.9	0	0	0	115.5	S135	S135-N137 PolarHBondContact O-N 3.06Å
138	S	31.3	Very low	42.7	Very low	99 Å²	99	114.8 Å²	114.8	69%	0.692	65%	0.646	S	S	*	*			trans	-165.2	131.7	132.3	-83.5	0	0	0	0	111.6	V140	S138-V140 PolarHBondContact O-N 3.33Å
139	R	35.4	Very low	40.4	Very low	259 Å²	259	120.4 Å²	120.4	98%	0.977	68%	0.676	S	S	*	*			trans	-63	100.9	161.5	-76.8	173.7	165.9	162.8	-5.1	107.4
140	V	31.6	Very low	38.2	Very low	125 Å²	125	124 Å²	124	76%	0.758	70%	0.701	S	S	*	*			trans	-131.9	126.9	172.3	-177.6	0	0	0	0	110.3	S138	S138-V140 PolarHBondContact O-N 3.33Å
141	T	29.1	Very low	36.6	Very low	129 Å²	129	123.3 Å²	123.3	79%	0.791	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-56.6	141.4	175.1	-36.6	0	0	0	0	111.7
142	L	32.6	Very low	35.9	Very low	129 Å²	129	128.4 Å²	128.4	68%	0.675	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-47.3	138.2	166.8	-68.3	154.4	0	0	0	110.9	K51	K51-L142 HydrophobicContact CD-CD1 4.4Å
143	P	32.1	Very low	35.7	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-76	139.7	157.6	10.9	4.8	0	0	0	109.5
144	Q	36.8	Very low	36.1	Very low	167 Å²	167	129.4 Å²	129.4	78%	0.78	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-60.2	146.2	175.6	-98.4	161.2	-48.4	0	0	112.2	G146	Q144-G146 PolarHBondContact O-N 2.83Å
145	S	39.3	Very low	37.2	Very low	78 Å²	78	127.1 Å²	127.1	55%	0.545	72%	0.722	S	S	.	*	S	Bend	trans	-41.9	121.8	168.3	179.9	0	0	0	0	111.9
146	G	32.8	Very low	38.8	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	73%	0.728	S	S	*	*	S	Bend	trans	163.6	94.9	179.5	0	0	0	0	0	109.6	Q144 L148	Q144-G146 PolarHBondContact O-N 2.83Å; G146-L148 PolarHBondContact O-N 3.14Å
147	I	39.2	Very low	41	Very low	158 Å²	158	120.5 Å²	120.5	81%	0.81	69%	0.687	S	S	*	*			trans	38.7	79.8	164.3	-47.5	176.9	0	0	0	113.9	D149	I147-D149 HydrophobicContact CG2-CB 4.19Å; I147-D149 PolarHBondContact O-N 3.01Å; I147-D149 VanDerWaalsContact O-N 3.12Å
148	L	38.4	Very low	43.6	Very low	121 Å²	121	113.7 Å²	113.7	63%	0.634	65%	0.652	S	S	*	*			trans	-86.6	62	171.7	-157.9	88.5	0	0	0	110.9	G146 S150	G146-L148 PolarHBondContact O-N 3.14Å; L148-S150 VanDerWaalsContact C-N 3.35Å
149	D	38.3	Very low	46.3	Very low	125 Å²	125	109.6 Å²	109.6	67%	0.668	62%	0.624	S	S	*	*			trans	-94.9	7.9	172	-123.8	9.8	0	0	0	112.6	I147 G151	I147-D149 HydrophobicContact CG2-CB 4.19Å; I147-D149 PolarHBondContact O-N 3.01Å; I147-D149 VanDerWaalsContact O-N 3.12Å; D149-G151 PolarHBondContact O-N 3.17Å
150	S	37.6	Very low	49	Very low	96 Å²	96	97.2 Å²	97.2	67%	0.671	58%	0.577	S	S	*	*			trans	-97.8	77.6	178.1	62.7	0	0	0	0	111.5	L148	L148-S150 VanDerWaalsContact C-N 3.35Å
151	G	41	Very low	51.7	Low	42 Å²	42	91.6 Å²	91.6	43%	0.433	54%	0.543	S	S	.	.			trans	-59.6	165.2	153.7	0	0	0	0	0	110.9	D149 P153	D149-G151 PolarHBondContact O-N 3.17Å; G151-P153 WeakPolarHBondContact O-CD 3.37Å
152	I	46.1	Very low	54.7	Low	125 Å²	125	85.4 Å²	85.4	64%	0.641	51%	0.505	S	S	*	.	S	Bend	trans	-53.7	123.7	172.1	-60.5	170.1	0	0	0	108.2	G154	I152-G154 PolarHBondContact O-N 3.26Å
153	P	40.2	Very low	57.2	Low	132 Å²	132	81.4 Å²	81.4	86%	0.857	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	115.9	-177.9	-23.7	31.5	0	0	0	110.8	G151	G151-P153 WeakPolarHBondContact O-CD 3.37Å
154	G	48.3	Very low	59.9	Low	83 Å²	83	76 Å²	76	86%	0.856	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.2	-7	169.7	0	0	0	0	0	117.8	I152	I152-G154 PolarHBondContact O-N 3.26Å
155	K	58.8	Low	62.1	Low	142 Å²	142	72.2 Å²	72.2	62%	0.617	43%	0.433	S	S	*	.			trans	-116.1	105.9	171.7	-82.5	-168.7	174.5	-171.3	0	111.5	C157	K155-C157 PolarHBondContact O-SG 2.98Å
156	K	63.3	Low	64.2	Low	192 Å²	192	69.6 Å²	69.6	84%	0.835	41%	0.413	S	S	*	.			trans	-77.5	119.6	169.7	-66	-172.5	177.5	-171.7	0	108.5	G158	K156-G158 VanDerWaalsContact C-N 3.35Å
157	C	77.4	Confident	66.2	Low	4 Å²	4	69.6 Å²	69.6	3%	0.027	40%	0.398	C	S	.	.			trans	-97.3	12.8	-174.8	-55.3	0	0	0	0	113	L128 L130 K155	L128-C157 HydrophobicContact CB-CB 4.09Å; L128-C157 WeakPolarHBondContact CD1-O 3.42Å; L130-C157 WeakPolarHBondContact CD1-SG 3.4Å; L130-C157 WeakPolarHBondContact CG-SG 3.44Å; K155-C157 PolarHBondContact O-SG 2.98Å
158	G	86.1	Confident	67.3	Low	8 Å²	8	64.2 Å²	64.2	8%	0.082	37%	0.374	C	S	.	.			trans	87.1	176.5	-170.7	0	0	0	0	0	113.4	R26 N27 L128 K156	R26-G158 CarbonylContact O-C 3.56Å; R26-G158 VanDerWaalsContact O-CA 3.22Å; R26-G158 WeakPolarHBondContact O-CA 3.25Å; N27-G158 WeakPolarHBondContact O-CA 3.27Å; N27-G158 PolarHBondContact O-N 2.94Å; L128-G158 PolarHBondContact N-O 3.11Å; K156-G158 VanDerWaalsContact C-N 3.35Å
159	S	88.9	Confident	68.2	Low	13 Å²	13	63.4 Å²	63.4	9%	0.091	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	154.2	170.8	60.7	0	0	0	0	110.8	C25 R26 E125 R126	C25-S159 CarbonylContact C-O 3.57Å; C25-S159 VanDerWaalsContact CA-O 3.27Å; C25-S159 WeakPolarHBondContact CA-O 3.47Å; R26-S159 PolarHBondContact N-O 3.06Å; R26-S159 PolarHBondContact O-N 3.38Å; E125-S159 PolarHBondContact OE1-OG 2.79Å; R126-S159 CarbonylContact O-C 3.56Å; R126-S159 WeakPolarHBondContact O-CA 3.49Å; R126-S159 VanDerWaalsContact O-CB 3.28Å; R126-S159 WeakPolarHBondContact O-CB 3.41Å
160	I	91.3	Very high	69.2	Low	0 Å²	0	60 Å²	60	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.6	170.8	-173	165.6	0	0	0	108	V23 S24 V41 F88 V90 I109 E125 R126 L128 F162	V23-I160 HydrophobicContact CG1-CD1 3.7Å; V23-I160 HydrophobicContact CG1-CG1 3.8Å; S24-I160 WeakPolarHBondContact O-CA 3.47Å; V41-I160 HydrophobicContact CG1-CD1 4.35Å; V41-I160 HydrophobicContact CG2-CD1 4.48Å; F88-I160 HydrophobicContact CB-CD1 4.14Å; V90-I160 HydrophobicContact CG2-CD1 4.22Å; I109-I160 HydrophobicContact CB-CG2 4.45Å; I109-I160 HydrophobicContact CD1-CG2 4.29Å; I109-I160 HydrophobicContact CG2-CG2 3.79Å; E125-I160 WeakPolarHBondContact CA-O 3.36Å; R126-I160 PolarHBondContact N-O 2.97Å; R126-I160 PolarHBondContact O-N 3.48Å; L128-I160 HydrophobicContact CD2-CB 4.01Å; L128-I160 HydrophobicContact CD2-CG2 3.76Å; L128-I160 HydrophobicContact CG-CB 4.37Å; L128-I160 HydrophobicContact CG-CG2 4.34Å; I160-F162 HydrophobicContact CB-CZ 4.35Å; I160-F162 HydrophobicContact CD1-CE1 3.71Å; I160-F162 HydrophobicContact CD1-CZ 3.57Å; I160-F162 HydrophobicContact CG1-CE1 3.86Å; I160-F162 HydrophobicContact CG1-CE2 4.21Å; I160-F162 HydrophobicContact CG1-CZ 3.65Å; I160-F162 HydrophobicContact CG2-CE2 3.82Å; I160-F162 HydrophobicContact CG2-CZ 3.81Å
161	V	88.9	Confident	70.9	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.036	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.7	-176.4	-176	0	0	0	0	108	V23 S24 R26 R123 L124 E125	V23-V161 WeakPolarHBondContact CA-O 3.29Å; S24-V161 PolarHBondContact N-O 2.79Å; S24-V161 PolarHBondContact O-N 3.45Å; R26-V161 HydrophobicContact CG-CG2 4.35Å; R123-V161 HydrophobicContact CG-CG1 4.2Å; L124-V161 CarbonylContact O-C 3.39Å; L124-V161 WeakPolarHBondContact O-CA 3.33Å; E125-V161 HydrophobicContact CB-CG2 4.21Å; E125-V161 HydrophobicContact CG-CG2 3.89Å
162	F	90.6	Very high	72.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.5	176.5	-53.2	-74.6	0	0	0	109.6	V21 T22 V23 F88 I109 I116 R123 L124 I160	V21-F162 HydrophobicContact CG1-CB 4.46Å; V21-F162 HydrophobicContact CG1-CD1 4.18Å; T22-F162 WeakPolarHBondContact O-CA 3.33Å; V23-F162 HydrophobicContact CG1-CD1 4.29Å; V23-F162 HydrophobicContact CG1-CE1 4.08Å; V23-F162 HydrophobicContact CG2-CD1 3.98Å; V23-F162 HydrophobicContact CG2-CE1 4.18Å; F88-F162 HydrophobicContact CB-CE1 4.48Å; F88-F162 HydrophobicContact CB-CZ 4.29Å; F88-F162 AromaticContact CD1-CE1 3.68Å; F88-F162 HydrophobicContact CD1-CE1 3.68Å; F88-F162 HydrophobicContact CD1-CZ 4.27Å; F88-F162 AromaticContact CD2-CE1 3.68Å; F88-F162 HydrophobicContact CD2-CE1 3.68Å; F88-F162 AromaticContact CD2-CZ 3.57Å; F88-F162 HydrophobicContact CD2-CZ 3.57Å; F88-F162 HydrophobicContact CE1-CD1 4.24Å; F88-F162 AromaticContact CE1-CE1 3.61Å; F88-F162 HydrophobicContact CE1-CE1 3.61Å; F88-F162 HydrophobicContact CE1-CZ 4.47Å; F88-F162 HydrophobicContact CE2-CD1 4.33Å; F88-F162 AromaticContact CE2-CE1 3.63Å; F88-F162 HydrophobicContact CE2-CE1 3.63Å; F88-F162 AromaticContact CE2-CZ 3.83Å; F88-F162 HydrophobicContact CE2-CZ 3.83Å; F88-F162 AromaticContact CG-CE1 3.69Å; F88-F162 HydrophobicContact CG-CE1 3.69Å; F88-F162 AromaticContact CG-CZ 3.8Å; F88-F162 HydrophobicContact CG-CZ 3.8Å; F88-F162 HydrophobicContact CZ-CD1 4.04Å; F88-F162 AromaticContact CZ-CE1 3.59Å; F88-F162 HydrophobicContact CZ-CE1 3.59Å; F88-F162 HydrophobicContact CZ-CZ 4.27Å; I109-F162 HydrophobicContact CD1-CE2 4.46Å; I109-F162 HydrophobicContact CG2-CE2 4.3Å; I109-F162 HydrophobicContact CG2-CZ 3.9Å; I116-F162 HydrophobicContact CD1-CB 4.26Å; I116-F162 HydrophobicContact CD1-CG 4.21Å; I116-F162 HydrophobicContact CG1-CB 4.4Å; I116-F162 HydrophobicContact CG2-CB 3.9Å; R123-F162 CarbonylContact C-O 3.54Å; R123-F162 VanDerWaalsContact CA-O 3.24Å; R123-F162 WeakPolarHBondContact CA-O 3.21Å; L124-F162 HydrophobicContact CB-CB 4.33Å; L124-F162 HydrophobicContact CB-CD2 4.2Å; L124-F162 HydrophobicContact CD2-CD2 4.08Å; L124-F162 HydrophobicContact CG-CD2 4.19Å; L124-F162 PolarHBondContact N-O 3.2Å; L124-F162 PolarHBondContact O-N 3.15Å; I160-F162 HydrophobicContact CB-CZ 4.35Å; I160-F162 HydrophobicContact CD1-CE1 3.71Å; I160-F162 HydrophobicContact CD1-CZ 3.57Å; I160-F162 HydrophobicContact CG1-CE1 3.86Å; I160-F162 HydrophobicContact CG1-CE2 4.21Å; I160-F162 HydrophobicContact CG1-CZ 3.65Å; I160-F162 HydrophobicContact CG2-CE2 3.82Å; I160-F162 HydrophobicContact CG2-CZ 3.81Å
163	T	86.3	Confident	74.9	Confident	44 Å²	44	53.2 Å²	53.2	27%	0.27	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.9	166.1	-55.9	0	0	0	0	108.5	T22 G122	T22-T163 PolarHBondContact N-O 2.61Å; T22-T163 PolarHBondContact O-N 3.12Å; G122-T163 CarbonylContact O-C 3.55Å; G122-T163 WeakPolarHBondContact O-CA 3.16Å
164	A	87.8	Confident	77.3	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.5	175.6	0	0	0	0	0	110.9	I19 E20 I116 I117 G122 R317	I19-A164 HydrophobicContact CG2-CB 3.8Å; E20-A164 WeakPolarHBondContact O-CA 3.41Å; I116-A164 HydrophobicContact CG2-CB 3.69Å; I117-A164 HydrophobicContact CG1-CB 4.09Å; G122-A164 PolarHBondContact O-N 2.95Å; A164-R317 PolarHBondContact O-NE 3.09Å; A164-R317 PolarHBondContact O-NH2 3.5Å
165	E	83.6	Confident	79.4	Confident	87 Å²	87	44.4 Å²	44.4	41%	0.407	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.1	172.4	-67.5	-176.7	168.7	0	0	109.9	I19 E20	I19-E165 CarbonylContact C-O 3.46Å; I19-E165 WeakPolarHBondContact CA-O 2.66Å; E20-E165 PolarHBondContact N-O 2.96Å; E20-E165 PolarHBondContact O-N 2.88Å
166	E	84	Confident	81.1	Confident	24 Å²	24	37.6 Å²	37.6	11%	0.112	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.7	176.4	-176.1	-175.3	-171.5	0	0	110.6	T17 I19 S168 R171 T311 V313	T17-E166 WeakPolarHBondContact CB-OE1 3.09Å; T17-E166 HydrophobicContact CG2-CG 3.72Å; T17-E166 WeakPolarHBondContact CG2-OE1 3.33Å; T17-E166 WeakPolarHBondContact OG1-CG 3.16Å; T17-E166 PolarHBondContact OG1-OE1 3.38Å; I19-E166 HydrophobicContact CD1-CB 3.96Å; I19-E166 HydrophobicContact CD1-CG 4.16Å; E166-S168 PolarHBondContact O-N 3.42Å; E166-S168 VanDerWaalsContact O-N 3.15Å; E166-R171 IonicContact OE2-CZ 3.05Å; E166-R171 IonicContact OE2-NE 3.86Å; E166-R171 IonicContact OE2-NH2 3.94Å; E166-R171 PolarHBondContact OE2-NH2 2.75Å; E166-T311 WeakPolarHBondContact OE2-CB 3.32Å; E166-T311 WeakPolarHBondContact OE2-CG2 3.47Å; E166-T311 PolarHBondContact OE2-OG1 3.21Å; E166-V313 HydrophobicContact CB-CG1 4.22Å
167	L	73.8	Confident	82.7	Confident	58 Å²	58	31 Å²	31	30%	0.304	17%	0.169	S	C	.	.			trans	-86	78.6	173.6	-66.5	175.3	0	0	0	109.7	K18 E20 V75	K18-L167 HydrophobicContact CB-CB 4.02Å; K18-L167 HydrophobicContact CB-CD1 4.32Å; K18-L167 PolarHBondContact O-N 3.14Å; E20-L167 HydrophobicContact CB-CD1 3.91Å; E20-L167 HydrophobicContact CB-CD2 3.89Å; E20-L167 HydrophobicContact CB-CG 3.73Å; V75-L167 HydrophobicContact CB-CD1 4.21Å; V75-L167 HydrophobicContact CG1-CD1 3.5Å; V75-L167 HydrophobicContact CG2-CD1 3.74Å
168	S	63.3	Low	83.6	Confident	45 Å²	45	30.9 Å²	30.9	32%	0.315	17%	0.168	S	C	.	.			trans	-86.2	119.3	171.3	60.5	0	0	0	0	111	E166 C170 R171	E166-S168 PolarHBondContact O-N 3.42Å; E166-S168 VanDerWaalsContact O-N 3.15Å; S168-C170 VanDerWaalsContact C-N 3.32Å; S168-C170 PolarHBondContact O-N 3.12Å; S168-R171 VanDerWaalsContact CB-NE 3.26Å; S168-R171 WeakPolarHBondContact OG-CD 3.07Å; S168-R171 WeakPolarHBondContact OG-CG 3.28Å; S168-R171 PolarHBondContact OG-NE 3.28Å
169	N	56.8	Low	84.1	Confident	105 Å²	105	31.6 Å²	31.6	56%	0.561	17%	0.171	S	C	*	.	S	Bend	trans	-74.7	83.9	168	-73.2	-3.1	0	0	0	109.7	R232	N169-R232 VanDerWaalsContact CB-NH1 3.26Å; N169-R232 PolarHBondContact ND2-NH1 3.11Å; N169-R232 PolarHBondContact ND2-NH2 3.33Å
170	C	60.2	Low	84.5	Confident	53 Å²	53	31.2 Å²	31.2	36%	0.358	17%	0.169	S	C	.	.			trans	59.6	104	179.9	-174.2	0	0	0	0	113.9	S168 D172	S168-C170 VanDerWaalsContact C-N 3.32Å; S168-C170 PolarHBondContact O-N 3.12Å; C170-D172 VanDerWaalsContact C-N 3.27Å; C170-D172 PolarHBondContact O-N 3.37Å
171	R	72.3	Confident	84.6	Confident	67 Å²	67	34.8 Å²	34.8	25%	0.253	19%	0.187	S	C	.	.			trans	-83.9	0.5	178.5	-60.6	-177.6	-179.6	170.7	-12.6	113.9	E166 S168 I173 E309 D314	E166-R171 IonicContact OE2-CZ 3.05Å; E166-R171 IonicContact OE2-NE 3.86Å; E166-R171 IonicContact OE2-NH2 3.94Å; E166-R171 PolarHBondContact OE2-NH2 2.75Å; S168-R171 VanDerWaalsContact CB-NE 3.26Å; S168-R171 WeakPolarHBondContact OG-CD 3.07Å; S168-R171 WeakPolarHBondContact OG-CG 3.28Å; S168-R171 PolarHBondContact OG-NE 3.28Å; R171-I173 PolarHBondContact O-N 2.88Å; R171-E309 PolarHBondContact O-N 2.97Å; R171-D314 IonicContact CZ-OD1 2.76Å; R171-D314 IonicContact CZ-OD2 3.9Å; R171-D314 IonicContact NE-OD2 2.86Å; R171-D314 IonicContact NH1-OD1 3.63Å; R171-D314 PolarHBondContact NH1-OD1 2.77Å; R171-D314 IonicContact NH1-OD2 3.26Å; R171-D314 PolarHBondContact NH1-OD2 3.35Å; R171-D314 IonicContact NH2-OD1 2.79Å; R171-D314 PolarHBondContact NH2-OD1 3.05Å; R171-D314 IonicContact NH2-OD2 3.16Å
172	D	83.5	Confident	84.8	Confident	37 Å²	37	41.9 Å²	41.9	20%	0.198	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	129.7	-171.9	-62.1	-26	0	0	0	109.9	C170 V231 V306 E307 S308	C170-D172 VanDerWaalsContact C-N 3.27Å; C170-D172 PolarHBondContact O-N 3.37Å; D172-V231 HydrophobicContact CB-CB 4.05Å; D172-V231 HydrophobicContact CB-CG2 3.64Å; D172-V231 VanDerWaalsContact O-CB 3.31Å; D172-V231 WeakPolarHBondContact O-CB 3.1Å; D172-V231 VanDerWaalsContact O-CG2 3.26Å; D172-V231 WeakPolarHBondContact O-CG2 3.41Å; D172-V231 PolarHBondContact O-N 3.18Å; D172-V306 HydrophobicContact CB-CG1 3.73Å; D172-E307 WeakPolarHBondContact CA-O 3.23Å; D172-S308 PolarHBondContact OD1-OG 3.42Å
173	I	87.1	Confident	84.8	Confident	16 Å²	16	42.1 Å²	42.1	8%	0.082	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.1	167.8	56.8	168.7	0	0	0	108.7	R171 T228 V306 E307 E309	R171-I173 PolarHBondContact O-N 2.88Å; I173-T228 HydrophobicContact CD1-CG2 4.41Å; I173-V306 WeakPolarHBondContact O-CA 3.2Å; I173-E307 HydrophobicContact CG1-CB 4.39Å; I173-E307 VanDerWaalsContact CG1-O 3.31Å; I173-E307 WeakPolarHBondContact CG1-O 3.39Å; I173-E307 PolarHBondContact N-O 3.01Å; I173-E307 PolarHBondContact O-N 2.99Å; I173-E309 HydrophobicContact CD1-CB 4.19Å; I173-E309 HydrophobicContact CD1-CG 4.42Å; I173-E309 HydrophobicContact CG1-CB 4.23Å; I173-E309 HydrophobicContact CG2-CB 4.12Å; I173-E309 WeakPolarHBondContact CG2-OE2 3.39Å
174	A	90.8	Very high	84.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	110.3	174.2	0	0	0	0	0	109	M176 T228 I229 V231 L234 F304 K305	A174-M176 HydrophobicContact CB-CE 3.55Å; A174-T228 WeakPolarHBondContact O-CA 3.23Å; A174-I229 PolarHBondContact N-O 3.19Å; A174-I229 PolarHBondContact O-N 3.22Å; A174-V231 HydrophobicContact CB-CG2 4.21Å; A174-L234 HydrophobicContact CB-CD1 4.05Å; A174-F304 HydrophobicContact CB-CE2 3.77Å; A174-F304 HydrophobicContact CB-CZ 3.69Å; A174-K305 CarbonylContact C-O 3.59Å; A174-K305 WeakPolarHBondContact CA-O 3.44Å
175	T	93.2	Very high	84.7	Confident	30 Å²	30	47.7 Å²	47.7	18%	0.184	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.8	171	-55	0	0	0	0	108.8	F227 T228 F304 K305	T175-F227 WeakPolarHBondContact CA-O 3.46Å; T175-T228 HydrophobicContact CG2-CG2 4.24Å; T175-T228 WeakPolarHBondContact OG1-CG2 3.42Å; T175-F304 WeakPolarHBondContact O-CA 3.32Å; T175-K305 PolarHBondContact N-O 3.43Å; T175-K305 PolarHBondContact O-N 3.05Å
176	M	94.5	Very high	84.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152	-175.7	61.1	-169.6	79.7	0	0	113	A174 F178 F198 S226 F227 I229 L234 L301 S303 F304	A174-M176 HydrophobicContact CB-CE 3.55Å; M176-F178 HydrophobicContact CB-CE2 4.13Å; M176-F178 HydrophobicContact CG-CD2 4.39Å; M176-F178 HydrophobicContact CG-CE2 3.84Å; M176-F178 HydrophobicContact SD-CE2 3.63Å; M176-F178 HydrophobicContact SD-CZ 4.31Å; M176-F198 HydrophobicContact SD-CE1 4.4Å; M176-S226 WeakPolarHBondContact O-CA 3.42Å; M176-F227 HydrophobicContact CG-CD2 3.91Å; M176-F227 HydrophobicContact CG-CE1 4.25Å; M176-F227 HydrophobicContact CG-CE2 3.28Å; M176-F227 HydrophobicContact CG-CZ 3.49Å; M176-F227 VanDerWaalsContact CG-CZ 3.49Å; M176-F227 PolarHBondContact N-O 3.32Å; M176-F227 PolarHBondContact O-N 2.57Å; M176-F227 HydrophobicContact SD-CE2 3.61Å; M176-F227 HydrophobicContact SD-CZ 3.92Å; M176-I229 HydrophobicContact CE-CD1 4.35Å; M176-I229 HydrophobicContact SD-CD1 4.34Å; M176-L234 HydrophobicContact CE-CD1 3.79Å; M176-L301 HydrophobicContact CB-CD1 4.02Å; M176-S303 WeakPolarHBondContact CA-O 3.28Å; M176-S303 WeakPolarHBondContact CB-O 3.02Å; M176-F304 HydrophobicContact CB-CD2 4.09Å; M176-F304 HydrophobicContact CE-CD2 4.22Å; M176-F304 HydrophobicContact CE-CE2 3.71Å
177	Q	96.6	Very high	84.6	Confident	54 Å²	54	46.6 Å²	46.6	25%	0.252	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.8	175	-167.6	-179.4	28.1	0	0	108.9	W224 L302 S303	Q177-W224 VanDerWaalsContact CG-O 3.32Å; Q177-W224 WeakPolarHBondContact CG-O 3.39Å; Q177-W224 PolarHBondContact NE2-O 2.81Å; Q177-W224 VanDerWaalsContact NE2-O 3.12Å; Q177-L302 HydrophobicContact CB-CB 4.2Å; Q177-L302 HydrophobicContact CG-CB 4.37Å; Q177-L302 HydrophobicContact CG-CD1 4.37Å; Q177-L302 WeakPolarHBondContact O-CA 3.43Å; Q177-L302 WeakPolarHBondContact O-CB 3.44Å; Q177-L302 PolarHBondContact O-N 2.86Å; Q177-S303 VanDerWaalsContact CB-OG 3.28Å; Q177-S303 WeakPolarHBondContact CB-OG 3.48Å; Q177-S303 PolarHBondContact N-O 2.74Å; Q177-S303 VanDerWaalsContact N-O 3.12Å; Q177-S303 PolarHBondContact N-OG 2.75Å; Q177-S303 PolarHBondContact O-N 3.24Å
178	F	96.9	Very high	84.6	Confident	1 Å²	1	52.9 Å²	52.9	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	154.4	178.5	-73.8	-93.6	0	0	0	111.4	M176 L196 F198 W224 F227 L269 Y279 V299 T300 L301	M176-F178 HydrophobicContact CB-CE2 4.13Å; M176-F178 HydrophobicContact CG-CD2 4.39Å; M176-F178 HydrophobicContact CG-CE2 3.84Å; M176-F178 HydrophobicContact SD-CE2 3.63Å; M176-F178 HydrophobicContact SD-CZ 4.31Å; F178-L196 HydrophobicContact CB-CD1 4.04Å; F178-L196 HydrophobicContact CG-CD1 4.28Å; F178-F198 AromaticContact CD2-CZ 3.99Å; F178-F198 HydrophobicContact CD2-CZ 3.99Å; F178-F198 AromaticContact CE2-CE1 3.91Å; F178-F198 HydrophobicContact CE2-CE1 3.91Å; F178-F198 AromaticContact CE2-CZ 3.61Å; F178-F198 HydrophobicContact CE2-CZ 3.61Å; F178-F198 HydrophobicContact CZ-CE1 4.05Å; F178-F198 HydrophobicContact CZ-CZ 4.08Å; F178-W224 HydrophobicContact CB-CE3 3.93Å; F178-W224 HydrophobicContact CB-CZ3 4.33Å; F178-W224 PolarHBondContact O-N 3.26Å; F178-F227 AromaticContact CD2-CE1 3.98Å; F178-F227 HydrophobicContact CD2-CE1 3.98Å; F178-F227 AromaticContact CD2-CZ 3.78Å; F178-F227 HydrophobicContact CD2-CZ 3.78Å; F178-F227 AromaticContact CE2-CZ 3.93Å; F178-F227 HydrophobicContact CE2-CZ 3.93Å; F178-L269 HydrophobicContact CZ-CD2 3.95Å; F178-Y279 HydrophobicContact CE1-CE2 4.25Å; F178-V299 HydrophobicContact CB-CG1 4.41Å; F178-V299 HydrophobicContact CD1-CG1 3.6Å; F178-V299 HydrophobicContact CE1-CG1 4.28Å; F178-V299 HydrophobicContact CG-CG1 4.37Å; F178-T300 WeakPolarHBondContact CA-O 3.36Å; F178-L301 HydrophobicContact CD1-CB 4.27Å; F178-L301 HydrophobicContact CD1-CD1 4.26Å; F178-L301 HydrophobicContact CD2-CD1 4.2Å; F178-L301 HydrophobicContact CE1-CB 3.89Å; F178-L301 HydrophobicContact CE1-CD1 3.74Å; F178-L301 HydrophobicContact CE1-CG 4.42Å; F178-L301 HydrophobicContact CE2-CD1 3.66Å; F178-L301 HydrophobicContact CG-CD1 4.49Å; F178-L301 HydrophobicContact CZ-CB 4.42Å; F178-L301 HydrophobicContact CZ-CD1 3.43Å; F178-L301 VanDerWaalsContact CZ-CD1 3.43Å; F178-L301 HydrophobicContact CZ-CG 4.47Å
179	C	96.5	Very high	85.1	Confident	23 Å²	23	61 Å²	61	16%	0.155	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	161.3	159.7	68.3	0	0	0	0	110.4	P222 V223 V299 T300 L302	C179-P222 CarbonylContact C-O 3.58Å; C179-P222 WeakPolarHBondContact CA-O 3.21Å; C179-P222 WeakPolarHBondContact CB-O 3.26Å; C179-V223 HydrophobicContact CB-CB 4.32Å; C179-V223 HydrophobicContact CB-CG1 4.41Å; C179-V223 HydrophobicContact CB-CG2 3.84Å; C179-V299 CarbonylContact O-C 3.5Å; C179-V299 WeakPolarHBondContact O-CA 3.15Å; C179-T300 PolarHBondContact N-O 2.9Å; C179-T300 PolarHBondContact O-N 3.38Å; C179-L302 HydrophobicContact CB-CD1 3.8Å; C179-L302 HydrophobicContact CB-CG 4.18Å
180	A	95.9	Very high	86.2	Confident	5 Å²	5	57.1 Å²	57.1	4%	0.041	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	163.8	167.1	0	0	0	0	0	111.4	L183 N221 P222 W224 T298 V299	A180-L183 HydrophobicContact CB-CD1 3.69Å; A180-L183 HydrophobicContact CB-CD2 3.87Å; A180-L183 HydrophobicContact CB-CG 3.73Å; A180-N221 CarbonylContact O-C 3.57Å; A180-N221 WeakPolarHBondContact O-CA 3.1Å; A180-P222 HydrophobicContact CB-CG 3.78Å; A180-P222 PolarHBondContact N-O 2.85Å; A180-W224 HydrophobicContact CB-CH2 3.68Å; A180-W224 HydrophobicContact CB-CZ3 3.82Å; A180-T298 CarbonylContact C-O 3.57Å; A180-T298 WeakPolarHBondContact CA-O 3.47Å; A180-T298 WeakPolarHBondContact CB-O 3.41Å; A180-V299 HydrophobicContact CB-CG2 3.91Å
181	N	94.6	Very high	87.4	Confident	74 Å²	74	59 Å²	59	40%	0.396	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	131.8	-179.1	179.8	49.8	0	0	0	109.8	L183 N221 G297 T298	N181-L183 PolarHBondContact O-N 2.82Å; N181-N221 WeakPolarHBondContact CA-OD1 3.5Å; N181-N221 PolarHBondContact OD1-OD1 3.35Å; N181-N221 VanDerWaalsContact OD1-OD1 3.05Å; N181-G297 WeakPolarHBondContact O-CA 3.42Å; N181-T298 PolarHBondContact N-O 2.82Å; N181-T298 PolarHBondContact O-N 3.2Å
182	K	92.3	Very high	88.2	Confident	156 Å²	156	55.8 Å²	55.8	68%	0.678	27%	0.268	S	S	*	.	S	Bend	trans	53.5	45.8	178.6	-60.4	175.2	175.3	176.1	0	113.5	L220 N221 G297	K182-L220 PolarHBondContact N-O 2.75Å; K182-N221 PolarHBondContact N-OD1 3.4Å; K182-G297 VanDerWaalsContact O-CA 3.23Å; K182-G297 WeakPolarHBondContact O-CA 3.49Å
183	L	91.3	Very high	88.5	Confident	5 Å²	5	55 Å²	55	3%	0.026	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-61.1	151.6	172.1	-66.3	-179.7	0	0	0	111.4	A180 N181 P194 L220 P222 V247 I259 V281 S296	A180-L183 HydrophobicContact CB-CD1 3.69Å; A180-L183 HydrophobicContact CB-CD2 3.87Å; A180-L183 HydrophobicContact CB-CG 3.73Å; N181-L183 PolarHBondContact O-N 2.82Å; L183-P194 HydrophobicContact CD1-CB 3.62Å; L183-P194 HydrophobicContact CD1-CG 3.88Å; L183-L220 HydrophobicContact CB-CB 4.48Å; L183-L220 PolarHBondContact N-O 2.71Å; L183-L220 WeakPolarHBondContact O-CD2 3.29Å; L183-P222 HydrophobicContact CD1-CG 3.92Å; L183-V247 HydrophobicContact CD1-CG1 4.1Å; L183-V247 HydrophobicContact CD2-CG1 4.24Å; L183-I259 HydrophobicContact CD2-CG2 4.36Å; L183-V281 HydrophobicContact CD2-CG2 4.26Å; L183-S296 WeakPolarHBondContact CA-O 3.18Å
184	D	86.2	Confident	88.9	Confident	45 Å²	45	54.3 Å²	54.3	24%	0.241	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-65.5	136.2	175.1	-77.6	-16.8	0	0	0	111.1	S192 I259 S296	D184-S192 PolarHBondContact O-OG 3.42Å; D184-I259 HydrophobicContact CB-CG2 4.31Å; D184-S296 PolarHBondContact N-O 3.07Å; D184-S296 WeakPolarHBondContact OD2-CB 3.32Å; D184-S296 PolarHBondContact OD2-OG 3.2Å
185	K	86.2	Confident	89.1	Confident	116 Å²	116	54.9 Å²	54.9	50%	0.504	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-75.1	118.8	170.5	-172.3	-167.2	-175.2	-140.6	0	109.5	D187 F188 G190 S192 L220	K185-D187 WeakPolarHBondContact CE-O 3.41Å; K185-D187 PolarHBondContact NZ-O 3.36Å; K185-D187 VanDerWaalsContact NZ-O 3.14Å; K185-F188 PolarHBondContact NZ-O 3.23Å; K185-G190 WeakPolarHBondContact CE-O 3.31Å; K185-S192 VanDerWaalsContact CA-OG 3.3Å; K185-S192 WeakPolarHBondContact CA-OG 3.4Å; K185-L220 HydrophobicContact CB-CD1 4.47Å; K185-L220 HydrophobicContact CB-CD2 4.45Å
186	K	84.9	Confident	89.2	Confident	46 Å²	46	53.4 Å²	53.4	20%	0.2	25%	0.253	C	S	.	.			trans	-102.9	-33.9	173	-51.3	-68.6	-171.2	171.4	0	112.4	S192 D249 D257 F258 I259	K186-S192 PolarHBondContact N-OG 3.22Å; K186-S192 VanDerWaalsContact N-OG 3.11Å; K186-D249 HydrophobicContact CB-CB 4.18Å; K186-D249 VanDerWaalsContact CB-OD2 3.29Å; K186-D249 WeakPolarHBondContact CB-OD2 3.31Å; K186-D249 HydrophobicContact CG-CB 4.14Å; K186-D257 HydrophobicContact CB-CB 3.92Å; K186-D257 HydrophobicContact CG-CB 4.03Å; K186-F258 WeakPolarHBondContact CE-O 3.31Å; K186-F258 PolarHBondContact NZ-O 3.4Å; K186-I259 HydrophobicContact CG-CG1 4.03Å
187	D	80.1	Confident	89.2	Confident	43 Å²	43	53.6 Å²	53.6	23%	0.23	25%	0.254	C	S	.	.			trans	-63.3	137.8	175.7	-83.4	-38.8	0	0	0	116.6	K185	K185-D187 WeakPolarHBondContact CE-O 3.41Å; K185-D187 PolarHBondContact NZ-O 3.36Å; K185-D187 VanDerWaalsContact NZ-O 3.14Å
188	F	74	Confident	89.2	Confident	190 Å²	190	51 Å²	51	83%	0.833	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-43.8	172.6	-80	-87.5	0	0	0	112.3	K185	K185-F188 PolarHBondContact NZ-O 3.23Å
189	F	72.2	Confident	88.9	Confident	214 Å²	214	52.8 Å²	52.8	94%	0.939	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.4	53.8	-175.4	-73.6	-79	0	0	0	113.3
190	G	80.3	Confident	88.7	Confident	25 Å²	25	53.8 Å²	53.8	26%	0.258	25%	0.25	S	C	.	.	S	Bend	trans	166.4	175	179.7	0	0	0	0	0	109.7	K185	K185-G190 WeakPolarHBondContact CE-O 3.31Å
191	K	86.5	Confident	88.4	Confident	92 Å²	92	54.6 Å²	54.6	40%	0.4	26%	0.255	S	S	.	.			trans	-82.4	163.9	158.2	-61.3	163.5	177.8	174.2	0	108	N218 L220	K191-N218 WeakPolarHBondContact CA-OD1 3.39Å; K191-N218 WeakPolarHBondContact CB-OD1 3.43Å; K191-N218 WeakPolarHBondContact CD-O 3.28Å; K191-N218 WeakPolarHBondContact CG-OD1 3.31Å; K191-N218 PolarHBondContact N-OD1 3.35Å; K191-N218 WeakPolarHBondContact O-CA 3.46Å; K191-L220 HydrophobicContact CB-CD2 3.88Å; K191-L220 HydrophobicContact CB-CG 3.89Å; K191-L220 HydrophobicContact CD-CG 4.11Å; K191-L220 HydrophobicContact CG-CD1 4.25Å; K191-L220 HydrophobicContact CG-CD2 4.44Å; K191-L220 HydrophobicContact CG-CG 3.97Å
192	S	88.3	Confident	87.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.245	C	C	.	.			trans	-54.5	152.4	172.6	-40.4	0	0	0	0	112.5	D184 K185 K186 P194 N218 N219 D249	D184-S192 PolarHBondContact O-OG 3.42Å; K185-S192 VanDerWaalsContact CA-OG 3.3Å; K185-S192 WeakPolarHBondContact CA-OG 3.4Å; K186-S192 PolarHBondContact N-OG 3.22Å; K186-S192 VanDerWaalsContact N-OG 3.11Å; S192-P194 WeakPolarHBondContact O-CD 3.28Å; S192-N218 CarbonylContact O-C 3.6Å; S192-N218 WeakPolarHBondContact O-CA 3.35Å; S192-N218 PolarHBondContact O-N 3.22Å; S192-N219 PolarHBondContact O-N 3.13Å; S192-D249 WeakPolarHBondContact CA-OD1 3.31Å; S192-D249 VanDerWaalsContact CA-OD2 3.25Å; S192-D249 WeakPolarHBondContact CA-OD2 3.48Å; S192-D249 VanDerWaalsContact CB-CG 3.43Å; S192-D249 WeakPolarHBondContact CB-OD1 3.41Å; S192-D249 WeakPolarHBondContact CB-OD2 3.17Å; S192-D249 PolarHBondContact OG-OD2 2.72Å
193	D	90.4	Very high	87	Confident	21 Å²	21	53.6 Å²	53.6	11%	0.112	25%	0.251	C	S	.	.			trans	-102.9	68.2	172.2	-69	-7.8	0	0	0	110.4	V215 I216 K217 N218 D249 W250	D193-V215 HydrophobicContact CB-CG1 3.89Å; D193-I216 CarbonylContact C-O 3.48Å; D193-I216 VanDerWaalsContact CA-O 3.29Å; D193-I216 WeakPolarHBondContact CA-O 3.4Å; D193-K217 WeakPolarHBondContact OD1-CA 3.44Å; D193-N218 PolarHBondContact OD1-N 3.07Å; D193-D249 WeakPolarHBondContact CA-OD1 3.46Å; D193-D249 PolarHBondContact N-OD1 2.91Å; D193-W250 HydrophobicContact CB-CB 4.05Å; D193-W250 WeakPolarHBondContact O-CB 3.41Å; D193-W250 PolarHBondContact O-N 3.12Å
194	P	94.3	Very high	86.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	146.8	-165.7	30.6	-41.1	0	0	0	115.6	L183 S192 I216 N219 P222 W224 Y248 I259	L183-P194 HydrophobicContact CD1-CB 3.62Å; L183-P194 HydrophobicContact CD1-CG 3.88Å; S192-P194 WeakPolarHBondContact O-CD 3.28Å; P194-I216 VanDerWaalsContact CD-O 3.22Å; P194-I216 WeakPolarHBondContact CD-O 3.48Å; P194-I216 PolarHBondContact O-N 3.14Å; P194-N219 WeakPolarHBondContact CD-O 3.18Å; P194-N219 WeakPolarHBondContact CG-O 3.41Å; P194-P222 HydrophobicContact CB-CG 4.29Å; P194-P222 HydrophobicContact CG-CB 3.93Å; P194-P222 HydrophobicContact CG-CG 3.56Å; P194-W224 HydrophobicContact CB-CZ2 4.15Å; P194-W224 HydrophobicContact CG-CZ2 4.47Å; P194-W224 PolarHBondContact O-NE1 3.49Å; P194-Y248 WeakPolarHBondContact CA-O 3.31Å; P194-I259 HydrophobicContact CB-CD1 4.33Å
195	F	94.9	Very high	86.2	Confident	12 Å²	12	59.2 Å²	59.2	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	159.2	167	69.4	-80.3	0	0	0	111.7	V197 V215 Y248 W250 H256	F195-V197 HydrophobicContact CD2-CG2 3.9Å; F195-V197 HydrophobicContact CE2-CG2 3.52Å; F195-V215 HydrophobicContact CB-CG2 4.1Å; F195-V215 HydrophobicContact CD1-CG2 4.04Å; F195-V215 HydrophobicContact CG-CG2 4.19Å; F195-Y248 HydrophobicContact CE1-CG 4.38Å; F195-Y248 HydrophobicContact CE2-CD2 4.14Å; F195-Y248 HydrophobicContact CE2-CG 4.42Å; F195-Y248 VanDerWaalsContact CZ-CB 3.41Å; F195-Y248 HydrophobicContact CZ-CD2 4.12Å; F195-Y248 AromaticContact CZ-CG 3.95Å; F195-Y248 HydrophobicContact CZ-CG 3.95Å; F195-Y248 PolarHBondContact N-O 2.89Å; F195-Y248 PolarHBondContact O-N 3.47Å; F195-W250 HydrophobicContact CD1-CB 4.03Å; F195-W250 HydrophobicContact CE1-CB 4.01Å; F195-H256 HydrophobicContact CE1-CB 4.31Å; F195-H256 HydrophobicContact CZ-CB 4.29Å; F195-H256 AromaticContact CZ-CD2 3.68Å
196	L	96.5	Very high	86.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	144.9	178.8	-57	179.7	0	0	0	111.3	F178 F198 K212 T213 W224 V245 D246 V247 V299	F178-L196 HydrophobicContact CB-CD1 4.04Å; F178-L196 HydrophobicContact CG-CD1 4.28Å; L196-F198 HydrophobicContact CB-CD2 4.43Å; L196-F198 HydrophobicContact CB-CE2 3.81Å; L196-F198 HydrophobicContact CD1-CE2 4.09Å; L196-F198 HydrophobicContact CD1-CZ 4.09Å; L196-K212 WeakPolarHBondContact O-CA 3.39Å; L196-T213 HydrophobicContact CB-CG2 3.87Å; L196-T213 HydrophobicContact CD1-CG2 4.37Å; L196-T213 HydrophobicContact CG-CG2 4.37Å; L196-T213 PolarHBondContact N-OG1 3.38Å; L196-T213 PolarHBondContact O-N 2.87Å; L196-T213 VanDerWaalsContact O-N 3.08Å; L196-W224 HydrophobicContact CD1-CD2 4.22Å; L196-W224 HydrophobicContact CD1-CE3 3.77Å; L196-W224 HydrophobicContact CD1-CH2 4.01Å; L196-W224 HydrophobicContact CD1-CZ2 4.44Å; L196-W224 HydrophobicContact CD1-CZ3 3.67Å; L196-W224 HydrophobicContact CD2-CH2 3.6Å; L196-W224 HydrophobicContact CD2-CZ2 3.98Å; L196-W224 HydrophobicContact CD2-CZ3 4.08Å; L196-W224 HydrophobicContact CG-CD2 4.24Å; L196-W224 HydrophobicContact CG-CE3 4.15Å; L196-W224 HydrophobicContact CG-CH2 3.68Å; L196-W224 HydrophobicContact CG-CZ2 3.78Å; L196-W224 HydrophobicContact CG-CZ3 3.89Å; L196-V245 HydrophobicContact CB-CG1 4.22Å; L196-V245 HydrophobicContact CD2-CG1 4.24Å; L196-D246 CarbonylContact C-O 3.49Å; L196-D246 WeakPolarHBondContact CA-O 3.43Å; L196-V247 HydrophobicContact CD2-CB 4.27Å; L196-V247 HydrophobicContact CD2-CG1 4.13Å; L196-V247 HydrophobicContact CD2-CG2 3.7Å; L196-V299 HydrophobicContact CD1-CG1 4.49Å; L196-V299 HydrophobicContact CD2-CG2 4.39Å
197	V	95.1	Very high	86.1	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.1	169.9	-171.8	0	0	0	0	109.4	F195 Y199 I209 K212 V245 D246 Y248	F195-V197 HydrophobicContact CD2-CG2 3.9Å; F195-V197 HydrophobicContact CE2-CG2 3.52Å; V197-Y199 HydrophobicContact CB-CE2 3.75Å; V197-Y199 HydrophobicContact CG1-CD2 4.16Å; V197-Y199 HydrophobicContact CG1-CE1 4.18Å; V197-Y199 HydrophobicContact CG1-CE2 3.43Å; V197-Y199 VanDerWaalsContact CG1-CE2 3.43Å; V197-Y199 VanDerWaalsContact CG1-CZ 3.43Å; V197-Y199 WeakPolarHBondContact CG1-OH 3.43Å; V197-Y199 WeakPolarHBondContact O-CD2 3.26Å; V197-I209 HydrophobicContact CG1-CD1 4.41Å; V197-I209 HydrophobicContact CG1-CG1 4.18Å; V197-I209 HydrophobicContact CG1-CG2 4.17Å; V197-K212 HydrophobicContact CB-CG 4.46Å; V197-K212 HydrophobicContact CG1-CG 3.99Å; V197-K212 HydrophobicContact CG2-CD 4.38Å; V197-K212 HydrophobicContact CG2-CG 4.09Å; V197-V245 WeakPolarHBondContact O-CA 3.42Å; V197-D246 HydrophobicContact CB-CB 4.47Å; V197-D246 PolarHBondContact N-O 3.43Å; V197-D246 PolarHBondContact O-N 2.86Å; V197-Y248 HydrophobicContact CB-CE2 4.39Å; V197-Y248 HydrophobicContact CG2-CD2 3.81Å; V197-Y248 HydrophobicContact CG2-CE2 3.94Å
198	F	94.9	Very high	86.2	Confident	1 Å²	1	59.7 Å²	59.7	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135.1	179.6	-68.9	-101.6	0	0	0	110.2	M176 F178 L196 I209 C210 H211 T213 F227 I229 V243 V245	M176-F198 HydrophobicContact SD-CE1 4.4Å; F178-F198 AromaticContact CD2-CZ 3.99Å; F178-F198 HydrophobicContact CD2-CZ 3.99Å; F178-F198 AromaticContact CE2-CE1 3.91Å; F178-F198 HydrophobicContact CE2-CE1 3.91Å; F178-F198 AromaticContact CE2-CZ 3.61Å; F178-F198 HydrophobicContact CE2-CZ 3.61Å; F178-F198 HydrophobicContact CZ-CE1 4.05Å; F178-F198 HydrophobicContact CZ-CZ 4.08Å; L196-F198 HydrophobicContact CB-CD2 4.43Å; L196-F198 HydrophobicContact CB-CE2 3.81Å; L196-F198 HydrophobicContact CD1-CE2 4.09Å; L196-F198 HydrophobicContact CD1-CZ 4.09Å; F198-I209 CarbonylContact O-C 3.57Å; F198-I209 WeakPolarHBondContact O-CA 3.2Å; F198-C210 HydrophobicContact CB-CB 4.36Å; F198-C210 PolarHBondContact O-N 3.05Å; F198-H211 HydrophobicContact CB-CB 4.29Å; F198-H211 HydrophobicContact CD2-CB 4.33Å; F198-H211 PolarHBondContact N-O 2.94Å; F198-T213 HydrophobicContact CE2-CG2 4.26Å; F198-F227 HydrophobicContact CD2-CZ 4.37Å; F198-F227 HydrophobicContact CE1-CZ 4.42Å; F198-F227 HydrophobicContact CE2-CE1 4.35Å; F198-F227 HydrophobicContact CE2-CE2 4.04Å; F198-F227 AromaticContact CE2-CZ 3.51Å; F198-F227 HydrophobicContact CE2-CZ 3.51Å; F198-F227 HydrophobicContact CZ-CE2 4.21Å; F198-F227 AromaticContact CZ-CZ 3.55Å; F198-F227 HydrophobicContact CZ-CZ 3.55Å; F198-I229 HydrophobicContact CB-CD1 4.36Å; F198-I229 HydrophobicContact CD1-CD1 4.4Å; F198-I229 HydrophobicContact CG-CD1 4.18Å; F198-V243 HydrophobicContact CD1-CG1 4.24Å; F198-V245 HydrophobicContact CD1-CG1 4.39Å; F198-V245 HydrophobicContact CD1-CG2 3.55Å; F198-V245 HydrophobicContact CE1-CG1 4.16Å; F198-V245 HydrophobicContact CE1-CG2 3.6Å; F198-V245 HydrophobicContact CE2-CG1 4.34Å; F198-V245 HydrophobicContact CG-CG2 4.3Å; F198-V245 HydrophobicContact CZ-CG1 4.11Å; F198-V245 HydrophobicContact CZ-CG2 4.37Å
199	Y	91.6	Very high	86.6	Confident	37 Å²	37	54.7 Å²	54.7	15%	0.145	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.8	177.3	-56.9	-99	0	0	0	111.5	V197 F207 T208 I209 V243 K244 D246	V197-Y199 HydrophobicContact CB-CE2 3.75Å; V197-Y199 HydrophobicContact CG1-CD2 4.16Å; V197-Y199 HydrophobicContact CG1-CE1 4.18Å; V197-Y199 HydrophobicContact CG1-CE2 3.43Å; V197-Y199 VanDerWaalsContact CG1-CE2 3.43Å; V197-Y199 VanDerWaalsContact CG1-CZ 3.43Å; V197-Y199 WeakPolarHBondContact CG1-OH 3.43Å; V197-Y199 WeakPolarHBondContact O-CD2 3.26Å; Y199-F207 HydrophobicContact CD1-CB 4.08Å; Y199-F207 HydrophobicContact CG-CB 4.34Å; Y199-T208 CarbonylContact C-O 3.58Å; Y199-T208 WeakPolarHBondContact CA-O 3.33Å; Y199-I209 HydrophobicContact CD1-CB 4.42Å; Y199-I209 HydrophobicContact CD1-CG1 3.58Å; Y199-I209 HydrophobicContact CE1-CB 4.46Å; Y199-I209 HydrophobicContact CE1-CD1 3.99Å; Y199-I209 HydrophobicContact CE1-CG1 3.23Å; Y199-V243 CarbonylContact O-C 3.59Å; Y199-V243 VanDerWaalsContact O-CA 3.25Å; Y199-V243 WeakPolarHBondContact O-CA 3.27Å; Y199-K244 PolarHBondContact N-O 2.79Å; Y199-K244 PolarHBondContact O-N 2.84Å; Y199-D246 HydrophobicContact CE2-CB 4.04Å; Y199-D246 VanDerWaalsContact CE2-OD2 3.29Å; Y199-D246 WeakPolarHBondContact CE2-OD2 3.38Å
200	R	91.7	Very high	87.3	Confident	45 Å²	45	46 Å²	46	17%	0.17	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	135.6	167	176.1	-166.1	72.6	-150.7	-0.5	109.9	N202 F207 T208 C210 A233 L234 R241	R200-N202 PolarHBondContact NE-OD1 3.44Å; R200-N202 PolarHBondContact NH2-OD1 3.04Å; R200-F207 WeakPolarHBondContact O-CA 3.5Å; R200-T208 PolarHBondContact N-O 3.44Å; R200-T208 PolarHBondContact O-N 3.03Å; R200-C210 WeakPolarHBondContact CB-SG 3.5Å; R200-C210 PolarHBondContact N-SG 3.07Å; R200-A233 WeakPolarHBondContact CB-O 3.48Å; R200-A233 WeakPolarHBondContact CD-O 3.2Å; R200-L234 VanDerWaalsContact CG-O 3.27Å; R200-L234 WeakPolarHBondContact CG-O 3.5Å; R200-R241 HydrophobicContact CG-CG 4.24Å
201	S	89.3	Confident	87.8	Confident	21 Å²	21	47.1 Å²	47.1	15%	0.147	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.7	169	64.7	0	0	0	0	112.2	T206 R241 T242	S201-T206 CarbonylContact C-O 3.56Å; S201-T206 WeakPolarHBondContact CA-O 3.48Å; S201-R241 VanDerWaalsContact O-CD 3.24Å; S201-R241 WeakPolarHBondContact O-CD 3.4Å; S201-R241 PolarHBondContact O-NH1 3.49Å; S201-R241 VanDerWaalsContact OG-CG 3.31Å; S201-R241 WeakPolarHBondContact OG-CG 3.44Å; S201-T242 PolarHBondContact N-O 2.73Å; S201-T242 PolarHBondContact OG-N 2.84Å; S201-T242 PolarHBondContact OG-O 2.81Å
202	N	81	Confident	88.1	Confident	33 Å²	33	48.5 Å²	48.5	18%	0.176	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-91.6	168.6	174.4	-63.2	-39.5	0	0	0	111.2	R200 D204 G205 T206 T208	R200-N202 PolarHBondContact NE-OD1 3.44Å; R200-N202 PolarHBondContact NH2-OD1 3.04Å; N202-D204 WeakPolarHBondContact CB-OD1 3.22Å; N202-D204 PolarHBondContact O-N 2.91Å; N202-G205 PolarHBondContact O-N 3.28Å; N202-G205 VanDerWaalsContact O-N 3.09Å; N202-T206 PolarHBondContact N-O 2.77Å; N202-T206 PolarHBondContact ND2-OG1 2.57Å; N202-T208 PolarHBondContact ND2-OG1 3.47Å
203	E	77.8	Confident	88.4	Confident	176 Å²	176	49.1 Å²	49.1	82%	0.822	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.7	-178.6	-66.8	178.9	-178.4	0	0	113.1	G205 R241	E203-G205 PolarHBondContact O-N 3.43Å; E203-R241 IonicContact OE1-NH2 3.56Å
204	D	80.4	Confident	88.5	Confident	115 Å²	115	51.3 Å²	51.3	62%	0.615	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	3.4	174.9	65.1	-3.9	0	0	0	113.2	N202 T206	N202-D204 WeakPolarHBondContact CB-OD1 3.22Å; N202-D204 PolarHBondContact O-N 2.91Å; D204-T206 VanDerWaalsContact C-N 3.27Å; D204-T206 PolarHBondContact O-N 2.98Å; D204-T206 WeakPolarHBondContact OD1-CB 3.41Å; D204-T206 WeakPolarHBondContact OD1-CG2 3.43Å; D204-T206 PolarHBondContact OD1-N 2.62Å; D204-T206 PolarHBondContact OD1-OG1 3.4Å; D204-T206 WeakPolarHBondContact OD2-CG2 3.43Å; D204-T206 PolarHBondContact OD2-OG1 2.88Å
205	G	79.3	Confident	88.5	Confident	54 Å²	54	53.8 Å²	53.8	56%	0.557	29%	0.285	S	S	*	.	S	Bend	trans	79.6	1.5	-177.9	0	0	0	0	0	114.8	N202 E203	N202-G205 PolarHBondContact O-N 3.28Å; N202-G205 VanDerWaalsContact O-N 3.09Å; E203-G205 PolarHBondContact O-N 3.43Å
206	T	84.2	Confident	88.3	Confident	67 Å²	67	54.8 Å²	54.8	41%	0.411	29%	0.29	S	S	.	.			trans	-77.1	170.6	172.3	68.5	0	0	0	0	111.4	S201 N202 D204	S201-T206 CarbonylContact C-O 3.56Å; S201-T206 WeakPolarHBondContact CA-O 3.48Å; N202-T206 PolarHBondContact N-O 2.77Å; N202-T206 PolarHBondContact ND2-OG1 2.57Å; D204-T206 VanDerWaalsContact C-N 3.27Å; D204-T206 PolarHBondContact O-N 2.98Å; D204-T206 WeakPolarHBondContact OD1-CB 3.41Å; D204-T206 WeakPolarHBondContact OD1-CG2 3.43Å; D204-T206 PolarHBondContact OD1-N 2.62Å; D204-T206 PolarHBondContact OD1-OG1 3.4Å; D204-T206 WeakPolarHBondContact OD2-CG2 3.43Å; D204-T206 PolarHBondContact OD2-OG1 2.88Å
207	F	86.3	Confident	88.1	Confident	86 Å²	86	61.8 Å²	61.8	38%	0.377	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.9	178.3	-76.1	-83.5	0	0	0	110.8	Y199 R200 K244	Y199-F207 HydrophobicContact CD1-CB 4.08Å; Y199-F207 HydrophobicContact CG-CB 4.34Å; R200-F207 WeakPolarHBondContact O-CA 3.5Å; F207-K244 HydrophobicContact CD1-CB 4Å; F207-K244 HydrophobicContact CE1-CB 3.63Å; F207-K244 HydrophobicContact CE1-CD 4.18Å; F207-K244 HydrophobicContact CE2-CD 4.29Å; F207-K244 HydrophobicContact CZ-CB 4.26Å; F207-K244 HydrophobicContact CZ-CD 4.06Å
208	T	81.3	Confident	87.8	Confident	62 Å²	62	66 Å²	66	38%	0.38	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.3	174.4	-61.9	0	0	0	0	109.7	Y199 R200 N202 C210	Y199-T208 CarbonylContact C-O 3.58Å; Y199-T208 WeakPolarHBondContact CA-O 3.33Å; R200-T208 PolarHBondContact N-O 3.44Å; R200-T208 PolarHBondContact O-N 3.03Å; N202-T208 PolarHBondContact ND2-OG1 3.47Å; T208-C210 PolarHBondContact O-N 3.31Å
209	I	83.2	Confident	87.6	Confident	85 Å²	85	68.2 Å²	68.2	44%	0.436	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	130	176.9	-64.6	170	0	0	0	109.5	V197 F198 Y199 K212	V197-I209 HydrophobicContact CG1-CD1 4.41Å; V197-I209 HydrophobicContact CG1-CG1 4.18Å; V197-I209 HydrophobicContact CG1-CG2 4.17Å; F198-I209 CarbonylContact O-C 3.57Å; F198-I209 WeakPolarHBondContact O-CA 3.2Å; Y199-I209 HydrophobicContact CD1-CB 4.42Å; Y199-I209 HydrophobicContact CD1-CG1 3.58Å; Y199-I209 HydrophobicContact CE1-CB 4.46Å; Y199-I209 HydrophobicContact CE1-CD1 3.99Å; Y199-I209 HydrophobicContact CE1-CG1 3.23Å; I209-K212 HydrophobicContact CG2-CG 4.42Å
210	C	86	Confident	87.6	Confident	30 Å²	30	68 Å²	68	20%	0.203	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-36.8	175.2	-52.7	0	0	0	0	111.8	F198 R200 T208 I229 A233	F198-C210 HydrophobicContact CB-CB 4.36Å; F198-C210 PolarHBondContact O-N 3.05Å; R200-C210 WeakPolarHBondContact CB-SG 3.5Å; R200-C210 PolarHBondContact N-SG 3.07Å; T208-C210 PolarHBondContact O-N 3.31Å; C210-I229 HydrophobicContact CB-CG2 4.2Å; C210-A233 PolarHBondContact SG-O 3.31Å
211	H	90.9	Very high	87.8	Confident	49 Å²	49	69.1 Å²	69.1	23%	0.227	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	156.2	-174.2	-169.7	75.5	0	0	0	112.3	F198 F227 I229	F198-H211 HydrophobicContact CB-CB 4.29Å; F198-H211 HydrophobicContact CD2-CB 4.33Å; F198-H211 PolarHBondContact N-O 2.94Å; H211-F227 AromaticContact CD2-CD2 3.42Å; H211-F227 VanDerWaalsContact CD2-CD2 3.42Å; H211-F227 WeakPolarHBondContact CD2-CD2 3.22Å; H211-F227 AromaticContact CD2-CE2 3.7Å; H211-F227 AromaticContact CD2-CG 3.82Å; H211-F227 AromaticContact CE1-CD2 3.99Å; H211-F227 WeakPolarHBondContact NE2-CB 3.04Å; H211-F227 AromaticContact NE2-CD2 3.41Å; H211-F227 WeakPolarHBondContact NE2-CD2 3.46Å; H211-F227 AromaticContact NE2-CG 3.36Å; H211-F227 WeakPolarHBondContact NE2-CG 3.42Å; H211-I229 HydrophobicContact CB-CD1 3.44Å; H211-I229 VanDerWaalsContact CB-CD1 3.44Å; H211-I229 HydrophobicContact CB-CG1 3.78Å
212	K	92.7	Very high	88.1	Confident	122 Å²	122	68.1 Å²	68.1	53%	0.53	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.1	169.8	-65	-172.7	178.7	-179.3	0	109.5	L196 V197 I209	L196-K212 WeakPolarHBondContact O-CA 3.39Å; V197-K212 HydrophobicContact CB-CG 4.46Å; V197-K212 HydrophobicContact CG1-CG 3.99Å; V197-K212 HydrophobicContact CG2-CD 4.38Å; V197-K212 HydrophobicContact CG2-CG 4.09Å; I209-K212 HydrophobicContact CG2-CG 4.42Å
213	T	94.1	Very high	88.8	Confident	13 Å²	13	70.4 Å²	70.4	8%	0.08	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-78.2	171.9	176.2	65.1	0	0	0	0	111.4	L196 F198 W224 F227	L196-T213 HydrophobicContact CB-CG2 3.87Å; L196-T213 HydrophobicContact CD1-CG2 4.37Å; L196-T213 HydrophobicContact CG-CG2 4.37Å; L196-T213 PolarHBondContact N-OG1 3.38Å; L196-T213 PolarHBondContact O-N 2.87Å; L196-T213 VanDerWaalsContact O-N 3.08Å; F198-T213 HydrophobicContact CE2-CG2 4.26Å; T213-W224 HydrophobicContact CG2-CB 4.47Å; T213-W224 HydrophobicContact CG2-CG 4.34Å; T213-W224 PolarHBondContact OG1-NE1 3.22Å; T213-F227 HydrophobicContact CG2-CD1 4.01Å; T213-F227 HydrophobicContact CG2-CE1 3.67Å; T213-F227 HydrophobicContact CG2-CZ 4.26Å
214	E	93.3	Very high	89.8	Confident	66 Å²	66	62.1 Å²	62.1	31%	0.308	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-65.6	158.7	166.4	79.9	-75.1	-172.4	0	0	112.3	I216 W224 Q225	E214-I216 HydrophobicContact CG-CG1 4.32Å; E214-W224 VanDerWaalsContact O-CD1 3.31Å; E214-W224 PolarHBondContact O-NE1 3.39Å; E214-W224 VanDerWaalsContact OE1-CA 3.26Å; E214-W224 WeakPolarHBondContact OE1-CA 3.04Å; E214-Q225 PolarHBondContact OE1-N 2.76Å
215	V	93.4	Very high	90.4	Very high	52 Å²	52	63.4 Å²	63.4	32%	0.315	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-89.2	123	175.1	176.7	0	0	0	0	109.4	D193 F195 W250	D193-V215 HydrophobicContact CB-CG1 3.89Å; F195-V215 HydrophobicContact CB-CG2 4.1Å; F195-V215 HydrophobicContact CD1-CG2 4.04Å; F195-V215 HydrophobicContact CG-CG2 4.19Å; V215-W250 HydrophobicContact CB-CB 4.42Å; V215-W250 HydrophobicContact CG1-CB 3.53Å; V215-W250 HydrophobicContact CG1-CD2 4.44Å; V215-W250 HydrophobicContact CG1-CG 3.92Å; V215-W250 HydrophobicContact CG2-CB 3.94Å; V215-W250 HydrophobicContact CG2-CG 3.91Å
216	I	92.1	Very high	91.1	Very high	33 Å²	33	64.2 Å²	64.2	17%	0.169	33%	0.334	C	S	.	.			trans	-103.9	110.2	176.6	-60.5	-172.6	0	0	0	109.6	D193 P194 E214 N219 P222 V223 W224	D193-I216 CarbonylContact C-O 3.48Å; D193-I216 VanDerWaalsContact CA-O 3.29Å; D193-I216 WeakPolarHBondContact CA-O 3.4Å; P194-I216 VanDerWaalsContact CD-O 3.22Å; P194-I216 WeakPolarHBondContact CD-O 3.48Å; P194-I216 PolarHBondContact O-N 3.14Å; E214-I216 HydrophobicContact CG-CG1 4.32Å; I216-N219 HydrophobicContact CG2-CB 3.79Å; I216-P222 HydrophobicContact CB-CB 4.15Å; I216-P222 HydrophobicContact CD1-CB 3.8Å; I216-P222 HydrophobicContact CG1-CB 4.41Å; I216-P222 HydrophobicContact CG2-CB 4.35Å; I216-V223 WeakPolarHBondContact CD1-O 3.34Å; I216-W224 HydrophobicContact CD1-CG 4.2Å
217	K	90.6	Very high	91.5	Very high	148 Å²	148	61.9 Å²	61.9	64%	0.643	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	140.6	-173.5	-60.9	-172.3	175.9	-177.2	0	114.1	D193 N219	D193-K217 WeakPolarHBondContact OD1-CA 3.44Å; K217-N219 PolarHBondContact O-N 3.39Å
218	N	89.6	Confident	91.6	Very high	91 Å²	91	61 Å²	61	49%	0.487	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	48.8	169.7	-169	13.9	0	0	0	112.7	K191 S192 D193	K191-N218 WeakPolarHBondContact CA-OD1 3.39Å; K191-N218 WeakPolarHBondContact CB-OD1 3.43Å; K191-N218 WeakPolarHBondContact CD-O 3.28Å; K191-N218 WeakPolarHBondContact CG-OD1 3.31Å; K191-N218 PolarHBondContact N-OD1 3.35Å; K191-N218 WeakPolarHBondContact O-CA 3.46Å; S192-N218 CarbonylContact O-C 3.6Å; S192-N218 WeakPolarHBondContact O-CA 3.35Å; S192-N218 PolarHBondContact O-N 3.22Å; D193-N218 PolarHBondContact OD1-N 3.07Å
219	N	91	Very high	91.9	Very high	47 Å²	47	58.1 Å²	58.1	25%	0.251	30%	0.302	S	S	.	.			trans	-144	117.1	-173.3	-164.7	-7.1	0	0	0	113.2	S192 P194 I216 K217 N221	S192-N219 PolarHBondContact O-N 3.13Å; P194-N219 WeakPolarHBondContact CD-O 3.18Å; P194-N219 WeakPolarHBondContact CG-O 3.41Å; I216-N219 HydrophobicContact CG2-CB 3.79Å; K217-N219 PolarHBondContact O-N 3.39Å; N219-N221 VanDerWaalsContact C-N 3.35Å; N219-N221 VanDerWaalsContact OD1-C 3.25Å; N219-N221 WeakPolarHBondContact OD1-CA 3.36Å; N219-N221 PolarHBondContact OD1-N 2.97Å; N219-N221 PolarHBondContact OD1-O 3.14Å
220	L	92.2	Very high	92.1	Very high	33 Å²	33	57.4 Å²	57.4	17%	0.173	30%	0.303	C	S	.	.	S	Bend	trans	-88.8	-2.8	174.7	-54.9	-179.5	0	0	0	113.5	K182 L183 K185 K191	K182-L220 PolarHBondContact N-O 2.75Å; L183-L220 HydrophobicContact CB-CB 4.48Å; L183-L220 PolarHBondContact N-O 2.71Å; L183-L220 WeakPolarHBondContact O-CD2 3.29Å; K185-L220 HydrophobicContact CB-CD1 4.47Å; K185-L220 HydrophobicContact CB-CD2 4.45Å; K191-L220 HydrophobicContact CB-CD2 3.88Å; K191-L220 HydrophobicContact CB-CG 3.89Å; K191-L220 HydrophobicContact CD-CG 4.11Å; K191-L220 HydrophobicContact CG-CD1 4.25Å; K191-L220 HydrophobicContact CG-CD2 4.44Å; K191-L220 HydrophobicContact CG-CG 3.97Å
221	N	95.3	Very high	92.1	Very high	69 Å²	69	56 Å²	56	37%	0.369	29%	0.294	S	S	.	.	S	Bend	trans	-131.6	57.1	177.2	-42.7	-80.1	0	0	0	110.1	A180 N181 K182 N219	A180-N221 CarbonylContact O-C 3.57Å; A180-N221 WeakPolarHBondContact O-CA 3.1Å; N181-N221 WeakPolarHBondContact CA-OD1 3.5Å; N181-N221 PolarHBondContact OD1-OD1 3.35Å; N181-N221 VanDerWaalsContact OD1-OD1 3.05Å; K182-N221 PolarHBondContact N-OD1 3.4Å; N219-N221 VanDerWaalsContact C-N 3.35Å; N219-N221 VanDerWaalsContact OD1-C 3.25Å; N219-N221 WeakPolarHBondContact OD1-CA 3.36Å; N219-N221 PolarHBondContact OD1-N 2.97Å; N219-N221 PolarHBondContact OD1-O 3.14Å
222	P	95.8	Very high	91.8	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.			trans	-62.1	144.7	-178.9	29.5	-38.9	0	0	0	111.4	C179 A180 L183 P194 I216 W224	C179-P222 CarbonylContact C-O 3.58Å; C179-P222 WeakPolarHBondContact CA-O 3.21Å; C179-P222 WeakPolarHBondContact CB-O 3.26Å; A180-P222 HydrophobicContact CB-CG 3.78Å; A180-P222 PolarHBondContact N-O 2.85Å; L183-P222 HydrophobicContact CD1-CG 3.92Å; P194-P222 HydrophobicContact CB-CG 4.29Å; P194-P222 HydrophobicContact CG-CB 3.93Å; P194-P222 HydrophobicContact CG-CG 3.56Å; I216-P222 HydrophobicContact CB-CB 4.15Å; I216-P222 HydrophobicContact CD1-CB 3.8Å; I216-P222 HydrophobicContact CG1-CB 4.41Å; I216-P222 HydrophobicContact CG2-CB 4.35Å; P222-W224 HydrophobicContact CB-CD2 4.27Å; P222-W224 HydrophobicContact CB-CH2 4.23Å; P222-W224 HydrophobicContact CB-CZ2 3.87Å; P222-W224 HydrophobicContact CG-CD2 4.47Å; P222-W224 HydrophobicContact CG-CE3 4.45Å; P222-W224 HydrophobicContact CG-CH2 3.42Å; P222-W224 VanDerWaalsContact CG-CH2 3.42Å; P222-W224 HydrophobicContact CG-CZ2 3.4Å; P222-W224 VanDerWaalsContact CG-CZ2 3.4Å; P222-W224 HydrophobicContact CG-CZ3 3.96Å
223	V	96.3	Very high	91.4	Very high	81 Å²	81	54.2 Å²	54.2	49%	0.491	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-117.8	108.3	162.1	-178.2	0	0	0	0	105.4	C179 I216 L302	C179-V223 HydrophobicContact CB-CB 4.32Å; C179-V223 HydrophobicContact CB-CG1 4.41Å; C179-V223 HydrophobicContact CB-CG2 3.84Å; I216-V223 WeakPolarHBondContact CD1-O 3.34Å; V223-L302 HydrophobicContact CG1-CD1 3.91Å
224	W	97	Very high	91	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-76.7	154.3	179.8	-63.4	-81.6	0	0	0	110.6	Q177 F178 A180 P194 L196 T213 E214 I216 P222	Q177-W224 VanDerWaalsContact CG-O 3.32Å; Q177-W224 WeakPolarHBondContact CG-O 3.39Å; Q177-W224 PolarHBondContact NE2-O 2.81Å; Q177-W224 VanDerWaalsContact NE2-O 3.12Å; F178-W224 HydrophobicContact CB-CE3 3.93Å; F178-W224 HydrophobicContact CB-CZ3 4.33Å; F178-W224 PolarHBondContact O-N 3.26Å; A180-W224 HydrophobicContact CB-CH2 3.68Å; A180-W224 HydrophobicContact CB-CZ3 3.82Å; P194-W224 HydrophobicContact CB-CZ2 4.15Å; P194-W224 HydrophobicContact CG-CZ2 4.47Å; P194-W224 PolarHBondContact O-NE1 3.49Å; L196-W224 HydrophobicContact CD1-CD2 4.22Å; L196-W224 HydrophobicContact CD1-CE3 3.77Å; L196-W224 HydrophobicContact CD1-CH2 4.01Å; L196-W224 HydrophobicContact CD1-CZ2 4.44Å; L196-W224 HydrophobicContact CD1-CZ3 3.67Å; L196-W224 HydrophobicContact CD2-CH2 3.6Å; L196-W224 HydrophobicContact CD2-CZ2 3.98Å; L196-W224 HydrophobicContact CD2-CZ3 4.08Å; L196-W224 HydrophobicContact CG-CD2 4.24Å; L196-W224 HydrophobicContact CG-CE3 4.15Å; L196-W224 HydrophobicContact CG-CH2 3.68Å; L196-W224 HydrophobicContact CG-CZ2 3.78Å; L196-W224 HydrophobicContact CG-CZ3 3.89Å; T213-W224 HydrophobicContact CG2-CB 4.47Å; T213-W224 HydrophobicContact CG2-CG 4.34Å; T213-W224 PolarHBondContact OG1-NE1 3.22Å; E214-W224 VanDerWaalsContact O-CD1 3.31Å; E214-W224 PolarHBondContact O-NE1 3.39Å; E214-W224 VanDerWaalsContact OE1-CA 3.26Å; E214-W224 WeakPolarHBondContact OE1-CA 3.04Å; I216-W224 HydrophobicContact CD1-CG 4.2Å; P222-W224 HydrophobicContact CB-CD2 4.27Å; P222-W224 HydrophobicContact CB-CH2 4.23Å; P222-W224 HydrophobicContact CB-CZ2 3.87Å; P222-W224 HydrophobicContact CG-CD2 4.47Å; P222-W224 HydrophobicContact CG-CE3 4.45Å; P222-W224 HydrophobicContact CG-CH2 3.42Å; P222-W224 VanDerWaalsContact CG-CH2 3.42Å; P222-W224 HydrophobicContact CG-CZ2 3.4Å; P222-W224 VanDerWaalsContact CG-CZ2 3.4Å; P222-W224 HydrophobicContact CG-CZ3 3.96Å
225	Q	94.8	Very high	90.7	Very high	143 Å²	143	50.5 Å²	50.5	67%	0.668	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-60.9	152.2	171.8	-67.8	-171.2	-0.2	0	0	110.1	E214 F227	E214-Q225 PolarHBondContact OE1-N 2.76Å; Q225-F227 WeakPolarHBondContact O-CD1 3.25Å
226	S	92.9	Very high	90	Very high	70 Å²	70	51.1 Å²	51.1	49%	0.49	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-65	136	172.4	-56.8	0	0	0	0	109.8	M176	M176-S226 WeakPolarHBondContact O-CA 3.42Å
227	F	92.6	Very high	89.4	Confident	19 Å²	19	52.4 Å²	52.4	8%	0.083	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	163	179.8	60.3	-94.2	0	0	0	111.2	T175 M176 F178 F198 H211 T213 Q225 I229	T175-F227 WeakPolarHBondContact CA-O 3.46Å; M176-F227 HydrophobicContact CG-CD2 3.91Å; M176-F227 HydrophobicContact CG-CE1 4.25Å; M176-F227 HydrophobicContact CG-CE2 3.28Å; M176-F227 HydrophobicContact CG-CZ 3.49Å; M176-F227 VanDerWaalsContact CG-CZ 3.49Å; M176-F227 PolarHBondContact N-O 3.32Å; M176-F227 PolarHBondContact O-N 2.57Å; M176-F227 HydrophobicContact SD-CE2 3.61Å; M176-F227 HydrophobicContact SD-CZ 3.92Å; F178-F227 AromaticContact CD2-CE1 3.98Å; F178-F227 HydrophobicContact CD2-CE1 3.98Å; F178-F227 AromaticContact CD2-CZ 3.78Å; F178-F227 HydrophobicContact CD2-CZ 3.78Å; F178-F227 AromaticContact CE2-CZ 3.93Å; F178-F227 HydrophobicContact CE2-CZ 3.93Å; F198-F227 HydrophobicContact CD2-CZ 4.37Å; F198-F227 HydrophobicContact CE1-CZ 4.42Å; F198-F227 HydrophobicContact CE2-CE1 4.35Å; F198-F227 HydrophobicContact CE2-CE2 4.04Å; F198-F227 AromaticContact CE2-CZ 3.51Å; F198-F227 HydrophobicContact CE2-CZ 3.51Å; F198-F227 HydrophobicContact CZ-CE2 4.21Å; F198-F227 AromaticContact CZ-CZ 3.55Å; F198-F227 HydrophobicContact CZ-CZ 3.55Å; H211-F227 AromaticContact CD2-CD2 3.42Å; H211-F227 VanDerWaalsContact CD2-CD2 3.42Å; H211-F227 WeakPolarHBondContact CD2-CD2 3.22Å; H211-F227 AromaticContact CD2-CE2 3.7Å; H211-F227 AromaticContact CD2-CG 3.82Å; H211-F227 AromaticContact CE1-CD2 3.99Å; H211-F227 WeakPolarHBondContact NE2-CB 3.04Å; H211-F227 AromaticContact NE2-CD2 3.41Å; H211-F227 WeakPolarHBondContact NE2-CD2 3.46Å; H211-F227 AromaticContact NE2-CG 3.36Å; H211-F227 WeakPolarHBondContact NE2-CG 3.42Å; T213-F227 HydrophobicContact CG2-CD1 4.01Å; T213-F227 HydrophobicContact CG2-CE1 3.67Å; T213-F227 HydrophobicContact CG2-CZ 4.26Å; Q225-F227 WeakPolarHBondContact O-CD1 3.25Å; F227-I229 HydrophobicContact CD2-CD1 4.16Å; F227-I229 HydrophobicContact CD2-CG1 3.94Å; F227-I229 HydrophobicContact CE2-CD1 3.68Å; F227-I229 HydrophobicContact CE2-CG1 3.97Å
228	T	89	Confident	89.2	Confident	68 Å²	68	48.8 Å²	48.8	42%	0.417	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.2	-179.7	54.8	0	0	0	0	111.4	I173 A174 T175	I173-T228 HydrophobicContact CD1-CG2 4.41Å; A174-T228 WeakPolarHBondContact O-CA 3.23Å; T175-T228 HydrophobicContact CG2-CG2 4.24Å; T175-T228 WeakPolarHBondContact OG1-CG2 3.42Å
229	I	88.1	Confident	89.2	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	131.4	170.1	-50.6	178.3	0	0	0	108.5	A174 M176 F198 C210 H211 F227 V231 A233 L234	A174-I229 PolarHBondContact N-O 3.19Å; A174-I229 PolarHBondContact O-N 3.22Å; M176-I229 HydrophobicContact CE-CD1 4.35Å; M176-I229 HydrophobicContact SD-CD1 4.34Å; F198-I229 HydrophobicContact CB-CD1 4.36Å; F198-I229 HydrophobicContact CD1-CD1 4.4Å; F198-I229 HydrophobicContact CG-CD1 4.18Å; C210-I229 HydrophobicContact CB-CG2 4.2Å; H211-I229 HydrophobicContact CB-CD1 3.44Å; H211-I229 VanDerWaalsContact CB-CD1 3.44Å; H211-I229 HydrophobicContact CB-CG1 3.78Å; F227-I229 HydrophobicContact CD2-CD1 4.16Å; F227-I229 HydrophobicContact CD2-CG1 3.94Å; F227-I229 HydrophobicContact CE2-CD1 3.68Å; F227-I229 HydrophobicContact CE2-CG1 3.97Å; I229-V231 PolarHBondContact O-N 3.11Å; I229-A233 HydrophobicContact CG2-CB 4.06Å; I229-L234 HydrophobicContact CB-CD1 4.1Å; I229-L234 HydrophobicContact CB-CD2 4.36Å; I229-L234 HydrophobicContact CB-CG 4.06Å; I229-L234 HydrophobicContact CD1-CD2 3.88Å; I229-L234 HydrophobicContact CG2-CD1 4.22Å; I229-L234 HydrophobicContact CG2-CD2 3.96Å; I229-L234 HydrophobicContact CG2-CG 3.64Å
230	P	85.7	Confident	89.4	Confident	70 Å²	70	50.5 Å²	50.5	46%	0.455	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	132.5	170.9	-24	33.7	0	0	0	110.9	R232 A233 L234	P230-R232 PolarHBondContact O-N 2.77Å; P230-A233 HydrophobicContact CB-CB 4.06Å; P230-A233 HydrophobicContact CG-CB 4.38Å; P230-A233 WeakPolarHBondContact O-CA 3.42Å; P230-A233 VanDerWaalsContact O-CB 3.31Å; P230-A233 WeakPolarHBondContact O-CB 3.46Å; P230-A233 PolarHBondContact O-N 3.49Å; P230-L234 PolarHBondContact O-N 2.86Å; P230-L234 VanDerWaalsContact O-N 3.15Å
231	V	87.2	Confident	89.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.9	-37.7	-178.7	170	0	0	0	0	110.7	D172 A174 I229 A233 L234 C235 Y239 Y266 V306	D172-V231 HydrophobicContact CB-CB 4.05Å; D172-V231 HydrophobicContact CB-CG2 3.64Å; D172-V231 VanDerWaalsContact O-CB 3.31Å; D172-V231 WeakPolarHBondContact O-CB 3.1Å; D172-V231 VanDerWaalsContact O-CG2 3.26Å; D172-V231 WeakPolarHBondContact O-CG2 3.41Å; D172-V231 PolarHBondContact O-N 3.18Å; A174-V231 HydrophobicContact CB-CG2 4.21Å; I229-V231 PolarHBondContact O-N 3.11Å; V231-A233 VanDerWaalsContact C-N 3.32Å; V231-A233 PolarHBondContact O-N 3.23Å; V231-L234 WeakPolarHBondContact O-CB 3.31Å; V231-L234 PolarHBondContact O-N 3.39Å; V231-L234 VanDerWaalsContact O-N 3.12Å; V231-C235 PolarHBondContact O-N 3.5Å; V231-C235 PolarHBondContact O-SG 3.05Å; V231-Y239 HydrophobicContact CG1-CE1 4.12Å; V231-Y266 HydrophobicContact CB-CE2 4.34Å; V231-Y266 HydrophobicContact CG1-CD2 4.01Å; V231-Y266 HydrophobicContact CG1-CE1 4.49Å; V231-Y266 HydrophobicContact CG1-CE2 3.79Å; V231-Y266 HydrophobicContact CG1-CG 4.46Å; V231-Y266 HydrophobicContact CG2-CD2 4.24Å; V231-Y266 HydrophobicContact CG2-CE2 3.58Å; V231-V306 HydrophobicContact CG2-CG1 4.47Å
232	R	84.1	Confident	89.4	Confident	107 Å²	107	49.9 Å²	49.9	40%	0.404	28%	0.28	S	S	.	.	H	α-helix	trans	-61.2	-37.2	172.9	-170.1	178.8	-178.7	-170.2	-1.2	113.2	N169 P230 L234 N236	N169-R232 VanDerWaalsContact CB-NH1 3.26Å; N169-R232 PolarHBondContact ND2-NH1 3.11Å; N169-R232 PolarHBondContact ND2-NH2 3.33Å; P230-R232 PolarHBondContact O-N 2.77Å; R232-L234 VanDerWaalsContact C-N 3.29Å; R232-L234 PolarHBondContact O-N 2.67Å; R232-N236 PolarHBondContact NE-OD1 3.1Å; R232-N236 WeakPolarHBondContact O-CA 3.03Å; R232-N236 PolarHBondContact O-N 3.49Å
233	A	83.8	Confident	89.4	Confident	27 Å²	27	49.9 Å²	49.9	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-34.5	176.1	0	0	0	0	0	111.3	R200 C210 I229 P230 V231	R200-A233 WeakPolarHBondContact CB-O 3.48Å; R200-A233 WeakPolarHBondContact CD-O 3.2Å; C210-A233 PolarHBondContact SG-O 3.31Å; I229-A233 HydrophobicContact CG2-CB 4.06Å; P230-A233 HydrophobicContact CB-CB 4.06Å; P230-A233 HydrophobicContact CG-CB 4.38Å; P230-A233 WeakPolarHBondContact O-CA 3.42Å; P230-A233 VanDerWaalsContact O-CB 3.31Å; P230-A233 WeakPolarHBondContact O-CB 3.46Å; P230-A233 PolarHBondContact O-N 3.49Å; V231-A233 VanDerWaalsContact C-N 3.32Å; V231-A233 PolarHBondContact O-N 3.23Å
234	L	86.1	Confident	89.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-73.2	-41.6	176.4	-73.1	169.6	0	0	0	113.5	A174 M176 R200 I229 P230 V231 R232 V243	A174-L234 HydrophobicContact CB-CD1 4.05Å; M176-L234 HydrophobicContact CE-CD1 3.79Å; R200-L234 VanDerWaalsContact CG-O 3.27Å; R200-L234 WeakPolarHBondContact CG-O 3.5Å; I229-L234 HydrophobicContact CB-CD1 4.1Å; I229-L234 HydrophobicContact CB-CD2 4.36Å; I229-L234 HydrophobicContact CB-CG 4.06Å; I229-L234 HydrophobicContact CD1-CD2 3.88Å; I229-L234 HydrophobicContact CG2-CD1 4.22Å; I229-L234 HydrophobicContact CG2-CD2 3.96Å; I229-L234 HydrophobicContact CG2-CG 3.64Å; P230-L234 PolarHBondContact O-N 2.86Å; P230-L234 VanDerWaalsContact O-N 3.15Å; V231-L234 WeakPolarHBondContact O-CB 3.31Å; V231-L234 PolarHBondContact O-N 3.39Å; V231-L234 VanDerWaalsContact O-N 3.12Å; R232-L234 VanDerWaalsContact C-N 3.29Å; R232-L234 PolarHBondContact O-N 2.67Å; L234-V243 HydrophobicContact CD2-CG1 4.26Å; L234-V243 HydrophobicContact CD2-CG2 4.32Å
235	C	86.6	Confident	89.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-135.6	-13.5	-162	85.1	0	0	0	0	114.5	V231 G237 D238 Y239 R241	V231-C235 PolarHBondContact O-N 3.5Å; V231-C235 PolarHBondContact O-SG 3.05Å; C235-G237 PolarHBondContact O-N 3.33Å; C235-D238 VanDerWaalsContact CB-O 3.23Å; C235-D238 WeakPolarHBondContact CB-O 3.42Å; C235-D238 PolarHBondContact O-N 3.23Å; C235-Y239 VanDerWaalsContact SG-CD1 3.55Å; C235-R241 VanDerWaalsContact O-CD 3.28Å; C235-R241 WeakPolarHBondContact O-CD 3.38Å; C235-R241 PolarHBondContact O-NE 2.55Å
236	N	80.3	Confident	89.4	Confident	65 Å²	65	40.9 Å²	40.9	35%	0.348	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	41.4	-178.1	-163.9	44	0	0	0	114.1	R232 D238	R232-N236 PolarHBondContact NE-OD1 3.1Å; R232-N236 WeakPolarHBondContact O-CA 3.03Å; R232-N236 PolarHBondContact O-N 3.49Å; N236-D238 VanDerWaalsContact C-N 3.32Å; N236-D238 PolarHBondContact O-N 3.36Å
237	G	78.9	Confident	89.5	Confident	60 Å²	60	37.6 Å²	37.6	62%	0.619	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.1	-13	-179.7	0	0	0	0	0	115.3	C235	C235-G237 PolarHBondContact O-N 3.33Å
238	D	85.7	Confident	89.6	Confident	73 Å²	73	39 Å²	39	39%	0.39	21%	0.214	S	C	.	.			trans	-99.6	98.9	173	175.7	4.8	0	0	0	109.9	C235 N236 D240 R241	C235-D238 VanDerWaalsContact CB-O 3.23Å; C235-D238 WeakPolarHBondContact CB-O 3.42Å; C235-D238 PolarHBondContact O-N 3.23Å; N236-D238 VanDerWaalsContact C-N 3.32Å; N236-D238 PolarHBondContact O-N 3.36Å; D238-D240 PolarHBondContact O-N 2.81Å; D238-D240 VanDerWaalsContact O-N 3.14Å; D238-D240 PolarHBondContact OD1-N 2.63Å; D238-R241 HydrophobicContact CB-CB 4.04Å; D238-R241 WeakPolarHBondContact O-CB 3.24Å; D238-R241 PolarHBondContact O-N 3.02Å; D238-R241 PolarHBondContact OD1-N 3.13Å
239	Y	90.9	Very high	89.6	Confident	86 Å²	86	35.7 Å²	35.7	34%	0.337	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14	-176.2	-63.7	-22.7	0	0	0	114.8	V231 C235 Y266 R267	V231-Y239 HydrophobicContact CG1-CE1 4.12Å; C235-Y239 VanDerWaalsContact SG-CD1 3.55Å; Y239-Y266 AromaticContact CD1-CD1 3.47Å; Y239-Y266 HydrophobicContact CD1-CD1 3.47Å; Y239-Y266 VanDerWaalsContact CD1-CD1 3.47Å; Y239-Y266 AromaticContact CD1-CE1 3.79Å; Y239-Y266 HydrophobicContact CD1-CE1 3.79Å; Y239-Y266 HydrophobicContact CD1-CG 4.27Å; Y239-Y266 HydrophobicContact CD2-CD1 4.4Å; Y239-Y266 HydrophobicContact CD2-CE1 4.34Å; Y239-Y266 HydrophobicContact CE1-CD1 4.13Å; Y239-Y266 HydrophobicContact CE1-CE1 4.02Å; Y239-Y266 AromaticContact CG-CD1 3.65Å; Y239-Y266 HydrophobicContact CG-CD1 3.65Å; Y239-Y266 AromaticContact CG-CE1 4Å; Y239-Y266 HydrophobicContact CG-CE1 4Å; Y239-Y266 PolarHBondContact O-N 3.38Å; Y239-R267 WeakPolarHBondContact O-CB 3.2Å; Y239-R267 PolarHBondContact O-N 2.96Å
240	D	93.7	Very high	89.8	Confident	87 Å²	87	39.5 Å²	39.5	47%	0.465	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.5	176.6	-65.4	-70.6	0	0	0	112.1	D238 T242 R267	D238-D240 PolarHBondContact O-N 2.81Å; D238-D240 VanDerWaalsContact O-N 3.14Å; D238-D240 PolarHBondContact OD1-N 2.63Å; D240-T242 PolarHBondContact O-N 2.87Å; D240-R267 VanDerWaalsContact CG-NE 3.26Å; D240-R267 WeakPolarHBondContact OD1-CD 3.46Å; D240-R267 IonicContact OD1-CZ 2.77Å; D240-R267 IonicContact OD1-NE 2.89Å; D240-R267 PolarHBondContact OD1-NE 2.98Å; D240-R267 IonicContact OD2-CZ 2.85Å; D240-R267 IonicContact OD2-NE 3.68Å; D240-R267 PolarHBondContact OD2-NE 3.45Å; D240-R267 IonicContact OD2-NH2 3.35Å; D240-R267 PolarHBondContact OD2-NH2 2.86Å
241	R	92.3	Very high	89.7	Confident	30 Å²	30	37.6 Å²	37.6	11%	0.113	19%	0.194	C	C	.	.	S	Bend	trans	-56.8	136.2	176.2	-173.2	169.7	-70.6	-112.1	1.8	111.4	R200 S201 E203 C235 D238 V243 S265	R200-R241 HydrophobicContact CG-CG 4.24Å; S201-R241 VanDerWaalsContact O-CD 3.24Å; S201-R241 WeakPolarHBondContact O-CD 3.4Å; S201-R241 PolarHBondContact O-NH1 3.49Å; S201-R241 VanDerWaalsContact OG-CG 3.31Å; S201-R241 WeakPolarHBondContact OG-CG 3.44Å; E203-R241 IonicContact OE1-NH2 3.56Å; C235-R241 VanDerWaalsContact O-CD 3.28Å; C235-R241 WeakPolarHBondContact O-CD 3.38Å; C235-R241 PolarHBondContact O-NE 2.55Å; D238-R241 HydrophobicContact CB-CB 4.04Å; D238-R241 WeakPolarHBondContact O-CB 3.24Å; D238-R241 PolarHBondContact O-N 3.02Å; D238-R241 PolarHBondContact OD1-N 3.13Å; R241-V243 PolarHBondContact O-N 2.79Å; R241-S265 WeakPolarHBondContact O-CB 3.41Å
242	T	95.6	Very high	89.2	Confident	60 Å²	60	48.7 Å²	48.7	37%	0.368	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.5	-177.3	-54.1	0	0	0	0	111.1	S201 D240 T263	S201-T242 PolarHBondContact N-O 2.73Å; S201-T242 PolarHBondContact OG-N 2.84Å; S201-T242 PolarHBondContact OG-O 2.81Å; D240-T242 PolarHBondContact O-N 2.87Å; T242-T263 HydrophobicContact CG2-CG2 4.01Å
243	V	96.2	Very high	88.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.6	166.6	179.9	0	0	0	0	107.4	F198 Y199 L234 R241 V245 T263 T264	F198-V243 HydrophobicContact CD1-CG1 4.24Å; Y199-V243 CarbonylContact O-C 3.59Å; Y199-V243 VanDerWaalsContact O-CA 3.25Å; Y199-V243 WeakPolarHBondContact O-CA 3.27Å; L234-V243 HydrophobicContact CD2-CG1 4.26Å; L234-V243 HydrophobicContact CD2-CG2 4.32Å; R241-V243 PolarHBondContact O-N 2.79Å; V243-V245 HydrophobicContact CG1-CG2 4.3Å; V243-T263 CarbonylContact O-C 3.55Å; V243-T263 WeakPolarHBondContact O-CA 3.47Å; V243-T264 HydrophobicContact CB-CG2 4.19Å; V243-T264 PolarHBondContact N-O 3.15Å; V243-T264 PolarHBondContact O-N 2.97Å
244	K	95.9	Very high	88.5	Confident	31 Å²	31	50.7 Å²	50.7	14%	0.135	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	136	174.9	-173.4	173.5	91.6	85.7	0	108.9	Y199 F207 D246 E261 T263	Y199-K244 PolarHBondContact N-O 2.79Å; Y199-K244 PolarHBondContact O-N 2.84Å; F207-K244 HydrophobicContact CD1-CB 4Å; F207-K244 HydrophobicContact CE1-CB 3.63Å; F207-K244 HydrophobicContact CE1-CD 4.18Å; F207-K244 HydrophobicContact CE2-CD 4.29Å; F207-K244 HydrophobicContact CZ-CB 4.26Å; F207-K244 HydrophobicContact CZ-CD 4.06Å; K244-D246 VanDerWaalsContact NZ-CG 3.34Å; K244-D246 IonicContact NZ-OD1 3.43Å; K244-D246 PolarHBondContact NZ-OD1 2.99Å; K244-D246 IonicContact NZ-OD2 3.52Å; K244-D246 PolarHBondContact NZ-OD2 3.15Å; K244-E261 IonicContact NZ-OE2 2.64Å; K244-E261 PolarHBondContact NZ-OE2 3.37Å; K244-T263 HydrophobicContact CB-CG2 4.4Å; K244-T263 HydrophobicContact CG-CG2 4.31Å
245	V	96.9	Very high	88.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.5	178.3	-172.5	0	0	0	0	108.6	L196 V197 F198 V243 E261 F262	L196-V245 HydrophobicContact CB-CG1 4.22Å; L196-V245 HydrophobicContact CD2-CG1 4.24Å; V197-V245 WeakPolarHBondContact O-CA 3.42Å; F198-V245 HydrophobicContact CD1-CG1 4.39Å; F198-V245 HydrophobicContact CD1-CG2 3.55Å; F198-V245 HydrophobicContact CE1-CG1 4.16Å; F198-V245 HydrophobicContact CE1-CG2 3.6Å; F198-V245 HydrophobicContact CE2-CG1 4.34Å; F198-V245 HydrophobicContact CG-CG2 4.3Å; F198-V245 HydrophobicContact CZ-CG1 4.11Å; F198-V245 HydrophobicContact CZ-CG2 4.37Å; V243-V245 HydrophobicContact CG1-CG2 4.3Å; V245-E261 VanDerWaalsContact O-CA 3.26Å; V245-E261 WeakPolarHBondContact O-CA 3.26Å; V245-F262 HydrophobicContact CB-CD1 4.07Å; V245-F262 HydrophobicContact CB-CD2 4.27Å; V245-F262 HydrophobicContact CB-CE1 3.57Å; V245-F262 HydrophobicContact CB-CE2 3.8Å; V245-F262 HydrophobicContact CB-CG 4.41Å; V245-F262 HydrophobicContact CB-CZ 3.43Å; V245-F262 VanDerWaalsContact CB-CZ 3.43Å; V245-F262 HydrophobicContact CG1-CD1 4.47Å; V245-F262 HydrophobicContact CG1-CE1 3.61Å; V245-F262 HydrophobicContact CG1-CE2 4.45Å; V245-F262 HydrophobicContact CG1-CZ 3.61Å; V245-F262 HydrophobicContact CG2-CD2 4.42Å; V245-F262 HydrophobicContact CG2-CE1 4.35Å; V245-F262 HydrophobicContact CG2-CE2 3.73Å; V245-F262 HydrophobicContact CG2-CZ 3.7Å; V245-F262 PolarHBondContact N-O 3.15Å; V245-F262 PolarHBondContact O-N 3.21Å
246	D	95.4	Very high	88.1	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.027	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	141.8	175.3	-67.3	-2.6	0	0	0	109.8	L196 V197 Y199 K244 Y248 F258 E261	L196-D246 CarbonylContact C-O 3.49Å; L196-D246 WeakPolarHBondContact CA-O 3.43Å; V197-D246 HydrophobicContact CB-CB 4.47Å; V197-D246 PolarHBondContact N-O 3.43Å; V197-D246 PolarHBondContact O-N 2.86Å; Y199-D246 HydrophobicContact CE2-CB 4.04Å; Y199-D246 VanDerWaalsContact CE2-OD2 3.29Å; Y199-D246 WeakPolarHBondContact CE2-OD2 3.38Å; K244-D246 VanDerWaalsContact NZ-CG 3.34Å; K244-D246 IonicContact NZ-OD1 3.43Å; K244-D246 PolarHBondContact NZ-OD1 2.99Å; K244-D246 IonicContact NZ-OD2 3.52Å; K244-D246 PolarHBondContact NZ-OD2 3.15Å; D246-Y248 HydrophobicContact CB-CD2 3.94Å; D246-Y248 HydrophobicContact CB-CE2 3.27Å; D246-Y248 PolarHBondContact OD2-OH 2.78Å; D246-F258 HydrophobicContact CB-CE2 4.03Å; D246-E261 WeakPolarHBondContact OD1-CB 3.43Å
247	V	95.8	Very high	88.4	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.5	173.4	-166	0	0	0	0	107.7	L183 L196 I259 G260 V281 V299	L183-V247 HydrophobicContact CD1-CG1 4.1Å; L183-V247 HydrophobicContact CD2-CG1 4.24Å; L196-V247 HydrophobicContact CD2-CB 4.27Å; L196-V247 HydrophobicContact CD2-CG1 4.13Å; L196-V247 HydrophobicContact CD2-CG2 3.7Å; V247-I259 HydrophobicContact CB-CB 4.17Å; V247-I259 HydrophobicContact CG1-CB 4.13Å; V247-I259 HydrophobicContact CG1-CD1 4.17Å; V247-I259 HydrophobicContact CG1-CG2 4.33Å; V247-I259 WeakPolarHBondContact O-CA 3.37Å; V247-I259 WeakPolarHBondContact O-CB 2.93Å; V247-I259 PolarHBondContact O-N 3.49Å; V247-G260 PolarHBondContact N-O 3Å; V247-G260 PolarHBondContact O-N 2.94Å; V247-V281 HydrophobicContact CB-CG1 4.25Å; V247-V281 HydrophobicContact CG2-CG1 3.84Å; V247-V281 HydrophobicContact CG2-CG2 4.03Å; V247-V299 HydrophobicContact CG2-CG2 4.16Å
248	Y	92.8	Very high	89	Confident	48 Å²	48	56.5 Å²	56.5	19%	0.188	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	154	178.8	-70.4	-84.5	0	0	0	110.7	P194 F195 V197 D246 H256 D257 F258	P194-Y248 WeakPolarHBondContact CA-O 3.31Å; F195-Y248 HydrophobicContact CE1-CG 4.38Å; F195-Y248 HydrophobicContact CE2-CD2 4.14Å; F195-Y248 HydrophobicContact CE2-CG 4.42Å; F195-Y248 VanDerWaalsContact CZ-CB 3.41Å; F195-Y248 HydrophobicContact CZ-CD2 4.12Å; F195-Y248 AromaticContact CZ-CG 3.95Å; F195-Y248 HydrophobicContact CZ-CG 3.95Å; F195-Y248 PolarHBondContact N-O 2.89Å; F195-Y248 PolarHBondContact O-N 3.47Å; V197-Y248 HydrophobicContact CB-CE2 4.39Å; V197-Y248 HydrophobicContact CG2-CD2 3.81Å; V197-Y248 HydrophobicContact CG2-CE2 3.94Å; D246-Y248 HydrophobicContact CB-CD2 3.94Å; D246-Y248 HydrophobicContact CB-CE2 3.27Å; D246-Y248 PolarHBondContact OD2-OH 2.78Å; Y248-H256 HydrophobicContact CD1-CB 4.25Å; Y248-D257 CarbonylContact C-O 3.57Å; Y248-D257 WeakPolarHBondContact CA-O 3.38Å; Y248-F258 HydrophobicContact CD1-CB 4.25Å; Y248-F258 HydrophobicContact CD1-CD2 4.13Å; Y248-F258 HydrophobicContact CE1-CB 4.04Å; Y248-F258 AromaticContact CE1-CD2 3.63Å; Y248-F258 HydrophobicContact CE1-CD2 3.63Å; Y248-F258 HydrophobicContact CE1-CG 4.31Å; Y248-F258 AromaticContact CZ-CD2 3.81Å
249	D	91	Very high	89.2	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.9	161.1	-165	2.5	0	0	0	108.8	K186 S192 D193 H256 D257 I259	K186-D249 HydrophobicContact CB-CB 4.18Å; K186-D249 VanDerWaalsContact CB-OD2 3.29Å; K186-D249 WeakPolarHBondContact CB-OD2 3.31Å; K186-D249 HydrophobicContact CG-CB 4.14Å; S192-D249 WeakPolarHBondContact CA-OD1 3.31Å; S192-D249 VanDerWaalsContact CA-OD2 3.25Å; S192-D249 WeakPolarHBondContact CA-OD2 3.48Å; S192-D249 VanDerWaalsContact CB-CG 3.43Å; S192-D249 WeakPolarHBondContact CB-OD1 3.41Å; S192-D249 WeakPolarHBondContact CB-OD2 3.17Å; S192-D249 PolarHBondContact OG-OD2 2.72Å; D193-D249 WeakPolarHBondContact CA-OD1 3.46Å; D193-D249 PolarHBondContact N-OD1 2.91Å; D249-H256 CarbonylContact O-C 3.59Å; D249-H256 VanDerWaalsContact O-CA 3.25Å; D249-H256 WeakPolarHBondContact O-CA 3.2Å; D249-H256 VanDerWaalsContact O-CB 3.26Å; D249-H256 WeakPolarHBondContact O-CB 3.27Å; D249-D257 HydrophobicContact CB-CB 3.96Å; D249-D257 PolarHBondContact N-O 3.46Å; D249-D257 PolarHBondContact O-N 2.58Å; D249-D257 VanDerWaalsContact O-N 3.14Å; D249-I259 HydrophobicContact CB-CD1 4.1Å; D249-I259 HydrophobicContact CB-CG1 4.24Å
250	W	91.7	Very high	89.3	Confident	81 Å²	81	48.9 Å²	48.9	31%	0.307	25%	0.247	S	C	.	.			trans	-84.8	129.5	-178.8	-179.1	88.8	0	0	0	111.3	D193 F195 V215 R252 H256	D193-W250 HydrophobicContact CB-CB 4.05Å; D193-W250 WeakPolarHBondContact O-CB 3.41Å; D193-W250 PolarHBondContact O-N 3.12Å; F195-W250 HydrophobicContact CD1-CB 4.03Å; F195-W250 HydrophobicContact CE1-CB 4.01Å; V215-W250 HydrophobicContact CB-CB 4.42Å; V215-W250 HydrophobicContact CG1-CB 3.53Å; V215-W250 HydrophobicContact CG1-CD2 4.44Å; V215-W250 HydrophobicContact CG1-CG 3.92Å; V215-W250 HydrophobicContact CG2-CB 3.94Å; V215-W250 HydrophobicContact CG2-CG 3.91Å; W250-R252 HydrophobicContact CH2-CB 3.91Å; W250-R252 HydrophobicContact CH2-CG 4.07Å; W250-R252 HydrophobicContact CZ3-CB 4.18Å; W250-H256 AromaticContact CD1-CE1 3.18Å; W250-H256 AromaticContact CD1-ND1 3.81Å; W250-H256 AromaticContact CD1-NE2 3.64Å; W250-H256 AromaticContact CG-CE1 3.92Å; W250-H256 AromaticContact NE1-CE1 3.39Å; W250-H256 PolarHBondContact NE1-CE1 3.33Å; W250-H256 AromaticContact NE1-NE2 3.92Å
251	D	83.3	Confident	89.3	Confident	30 Å²	30	46.8 Å²	46.8	16%	0.16	24%	0.235	C	C	.	.			trans	-120.3	139.8	179.3	-71	-64.5	0	0	0	111	D253 G254 H256 D257	D251-D253 PolarHBondContact O-N 2.75Å; D251-G254 PolarHBondContact O-N 3.25Å; D251-G254 VanDerWaalsContact O-N 3.11Å; D251-H256 PolarHBondContact N-ND1 3.1Å; D251-H256 PolarHBondContact O-CE1 3.31Å; D251-H256 PolarHBondContact O-ND1 2.77Å; D251-H256 WeakPolarHBondContact OD2-CA 3.37Å; D251-D257 PolarHBondContact OD2-N 2.8Å
252	R	76.6	Confident	89.5	Confident	232 Å²	232	46 Å²	46	88%	0.875	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.1	-174.2	-167.5	176.5	-171.5	-168.4	2.8	113.9	W250 G254	W250-R252 HydrophobicContact CH2-CB 3.91Å; W250-R252 HydrophobicContact CH2-CG 4.07Å; W250-R252 HydrophobicContact CZ3-CB 4.18Å; R252-G254 VanDerWaalsContact C-N 3.32Å
253	D	78	Confident	89.4	Confident	127 Å²	127	47 Å²	47	68%	0.679	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-2.4	179.6	63.8	10.7	0	0	0	113.6	D251 S255	D251-D253 PolarHBondContact O-N 2.75Å; D253-S255 VanDerWaalsContact C-N 3.33Å; D253-S255 WeakPolarHBondContact OD1-CB 3.23Å; D253-S255 PolarHBondContact OD1-N 3Å; D253-S255 PolarHBondContact OD1-OG 3.37Å; D253-S255 PolarHBondContact OD2-OG 2.92Å
254	G	74.6	Confident	89.4	Confident	50 Å²	50	47.4 Å²	47.4	52%	0.515	24%	0.241	S	C	.	.	S	Bend	trans	85	-2.3	-178.9	0	0	0	0	0	114.7	D251 R252 H256	D251-G254 PolarHBondContact O-N 3.25Å; D251-G254 VanDerWaalsContact O-N 3.11Å; R252-G254 VanDerWaalsContact C-N 3.32Å; G254-H256 PolarHBondContact O-N 2.79Å; G254-H256 VanDerWaalsContact O-N 3.14Å
255	S	81	Confident	89.4	Confident	74 Å²	74	46.4 Å²	46.4	52%	0.517	24%	0.238	S	C	.	.			trans	-88	55.1	175.4	61.4	0	0	0	0	112.9	D253 D257	D253-S255 VanDerWaalsContact C-N 3.33Å; D253-S255 WeakPolarHBondContact OD1-CB 3.23Å; D253-S255 PolarHBondContact OD1-N 3Å; D253-S255 PolarHBondContact OD1-OG 3.37Å; D253-S255 PolarHBondContact OD2-OG 2.92Å; S255-D257 PolarHBondContact O-N 2.85Å
256	H	84.8	Confident	89.2	Confident	64 Å²	64	47.5 Å²	47.5	30%	0.296	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-49	121.4	-176.6	-57.2	-27	0	0	0	113.3	F195 Y248 D249 W250 D251 G254 F258	F195-H256 HydrophobicContact CE1-CB 4.31Å; F195-H256 HydrophobicContact CZ-CB 4.29Å; F195-H256 AromaticContact CZ-CD2 3.68Å; Y248-H256 HydrophobicContact CD1-CB 4.25Å; D249-H256 CarbonylContact O-C 3.59Å; D249-H256 VanDerWaalsContact O-CA 3.25Å; D249-H256 WeakPolarHBondContact O-CA 3.2Å; D249-H256 VanDerWaalsContact O-CB 3.26Å; D249-H256 WeakPolarHBondContact O-CB 3.27Å; W250-H256 AromaticContact CD1-CE1 3.18Å; W250-H256 AromaticContact CD1-ND1 3.81Å; W250-H256 AromaticContact CD1-NE2 3.64Å; W250-H256 AromaticContact CG-CE1 3.92Å; W250-H256 AromaticContact NE1-CE1 3.39Å; W250-H256 PolarHBondContact NE1-CE1 3.33Å; W250-H256 AromaticContact NE1-NE2 3.92Å; D251-H256 PolarHBondContact N-ND1 3.1Å; D251-H256 PolarHBondContact O-CE1 3.31Å; D251-H256 PolarHBondContact O-ND1 2.77Å; D251-H256 WeakPolarHBondContact OD2-CA 3.37Å; G254-H256 PolarHBondContact O-N 2.79Å; G254-H256 VanDerWaalsContact O-N 3.14Å; H256-F258 PolarHBondContact O-N 3.14Å
257	D	86.1	Confident	89.1	Confident	73 Å²	73	52.3 Å²	52.3	39%	0.39	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.1	-178.6	-94.1	-26.4	0	0	0	112.6	K186 Y248 D249 D251 S255 I259	K186-D257 HydrophobicContact CB-CB 3.92Å; K186-D257 HydrophobicContact CG-CB 4.03Å; Y248-D257 CarbonylContact C-O 3.57Å; Y248-D257 WeakPolarHBondContact CA-O 3.38Å; D249-D257 HydrophobicContact CB-CB 3.96Å; D249-D257 PolarHBondContact N-O 3.46Å; D249-D257 PolarHBondContact O-N 2.58Å; D249-D257 VanDerWaalsContact O-N 3.14Å; D251-D257 PolarHBondContact OD2-N 2.8Å; S255-D257 PolarHBondContact O-N 2.85Å; D257-I259 PolarHBondContact O-N 2.87Å
258	F	89.9	Confident	89	Confident	35 Å²	35	56 Å²	56	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.6	178.7	-177.2	-112.6	0	0	0	111.9	K186 D246 Y248 H256 G260 E261 N283	K186-F258 WeakPolarHBondContact CE-O 3.31Å; K186-F258 PolarHBondContact NZ-O 3.4Å; D246-F258 HydrophobicContact CB-CE2 4.03Å; Y248-F258 HydrophobicContact CD1-CB 4.25Å; Y248-F258 HydrophobicContact CD1-CD2 4.13Å; Y248-F258 HydrophobicContact CE1-CB 4.04Å; Y248-F258 AromaticContact CE1-CD2 3.63Å; Y248-F258 HydrophobicContact CE1-CD2 3.63Å; Y248-F258 HydrophobicContact CE1-CG 4.31Å; Y248-F258 AromaticContact CZ-CD2 3.81Å; H256-F258 PolarHBondContact O-N 3.14Å; F258-G260 VanDerWaalsContact CE2-O 3.32Å; F258-G260 WeakPolarHBondContact CE2-O 3.18Å; F258-G260 VanDerWaalsContact CZ-CA 3.46Å; F258-E261 HydrophobicContact CE2-CB 4.28Å; F258-E261 HydrophobicContact CZ-CB 3.81Å; F258-E261 HydrophobicContact CZ-CG 3.98Å; F258-N283 PolarHBondContact O-ND2 3.04Å; F258-N283 VanDerWaalsContact O-ND2 3.15Å
259	I	90.7	Very high	89	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-51	175.9	-62.8	176.4	0	0	0	109.7	L183 D184 K186 P194 V247 D249 D257 V281 N283 S296	L183-I259 HydrophobicContact CD2-CG2 4.36Å; D184-I259 HydrophobicContact CB-CG2 4.31Å; K186-I259 HydrophobicContact CG-CG1 4.03Å; P194-I259 HydrophobicContact CB-CD1 4.33Å; V247-I259 HydrophobicContact CB-CB 4.17Å; V247-I259 HydrophobicContact CG1-CB 4.13Å; V247-I259 HydrophobicContact CG1-CD1 4.17Å; V247-I259 HydrophobicContact CG1-CG2 4.33Å; V247-I259 WeakPolarHBondContact O-CA 3.37Å; V247-I259 WeakPolarHBondContact O-CB 2.93Å; V247-I259 PolarHBondContact O-N 3.49Å; D249-I259 HydrophobicContact CB-CD1 4.1Å; D249-I259 HydrophobicContact CB-CG1 4.24Å; D257-I259 PolarHBondContact O-N 2.87Å; I259-V281 HydrophobicContact CG2-CG1 4.38Å; I259-N283 WeakPolarHBondContact O-CB 3.47Å; I259-N283 PolarHBondContact O-ND2 3.38Å; I259-S296 PolarHBondContact O-OG 2.81Å
260	G	92.9	Very high	89	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.3	-176.3	175.3	0	0	0	0	0	112.4	V247 F258 R282	V247-G260 PolarHBondContact N-O 3Å; V247-G260 PolarHBondContact O-N 2.94Å; F258-G260 VanDerWaalsContact CE2-O 3.32Å; F258-G260 WeakPolarHBondContact CE2-O 3.18Å; F258-G260 VanDerWaalsContact CZ-CA 3.46Å; G260-R282 CarbonylContact C-O 3.54Å; G260-R282 VanDerWaalsContact CA-O 3.31Å; G260-R282 WeakPolarHBondContact CA-O 3.46Å
261	E	94.9	Very high	88.9	Confident	43 Å²	43	59.4 Å²	59.4	20%	0.201	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	162.5	179.8	61.2	175.7	-155.4	0	0	112.2	K244 V245 D246 F258 R282 L284	K244-E261 IonicContact NZ-OE2 2.64Å; K244-E261 PolarHBondContact NZ-OE2 3.37Å; V245-E261 VanDerWaalsContact O-CA 3.26Å; V245-E261 WeakPolarHBondContact O-CA 3.26Å; D246-E261 WeakPolarHBondContact OD1-CB 3.43Å; F258-E261 HydrophobicContact CE2-CB 4.28Å; F258-E261 HydrophobicContact CZ-CB 3.81Å; F258-E261 HydrophobicContact CZ-CG 3.98Å; E261-R282 PolarHBondContact N-O 2.95Å; E261-R282 PolarHBondContact O-N 3.49Å; E261-L284 WeakPolarHBondContact OE1-CD1 3.25Å
262	F	94.9	Very high	89	Confident	14 Å²	14	58.7 Å²	58.7	6%	0.061	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	166.9	164	66.4	-87.8	0	0	0	110.3	V245 Y279 V299	V245-F262 HydrophobicContact CB-CD1 4.07Å; V245-F262 HydrophobicContact CB-CD2 4.27Å; V245-F262 HydrophobicContact CB-CE1 3.57Å; V245-F262 HydrophobicContact CB-CE2 3.8Å; V245-F262 HydrophobicContact CB-CG 4.41Å; V245-F262 HydrophobicContact CB-CZ 3.43Å; V245-F262 VanDerWaalsContact CB-CZ 3.43Å; V245-F262 HydrophobicContact CG1-CD1 4.47Å; V245-F262 HydrophobicContact CG1-CE1 3.61Å; V245-F262 HydrophobicContact CG1-CE2 4.45Å; V245-F262 HydrophobicContact CG1-CZ 3.61Å; V245-F262 HydrophobicContact CG2-CD2 4.42Å; V245-F262 HydrophobicContact CG2-CE1 4.35Å; V245-F262 HydrophobicContact CG2-CE2 3.73Å; V245-F262 HydrophobicContact CG2-CZ 3.7Å; V245-F262 PolarHBondContact N-O 3.15Å; V245-F262 PolarHBondContact O-N 3.21Å; F262-Y279 VanDerWaalsContact CD2-CB 3.44Å; F262-Y279 AromaticContact CD2-CD1 3.56Å; F262-Y279 HydrophobicContact CD2-CD1 3.56Å; F262-Y279 AromaticContact CD2-CD2 3.82Å; F262-Y279 HydrophobicContact CD2-CD2 3.82Å; F262-Y279 HydrophobicContact CD2-CE1 4.23Å; F262-Y279 HydrophobicContact CD2-CE2 4.46Å; F262-Y279 AromaticContact CD2-CG 3.31Å; F262-Y279 HydrophobicContact CD2-CG 3.31Å; F262-Y279 AromaticContact CE2-CD1 3.93Å; F262-Y279 HydrophobicContact CE2-CD1 3.93Å; F262-Y279 AromaticContact CE2-CD2 3.39Å; F262-Y279 HydrophobicContact CE2-CD2 3.39Å; F262-Y279 HydrophobicContact CE2-CE1 4.31Å; F262-Y279 AromaticContact CE2-CE2 3.84Å; F262-Y279 HydrophobicContact CE2-CE2 3.84Å; F262-Y279 AromaticContact CE2-CG 3.44Å; F262-Y279 HydrophobicContact CE2-CG 3.44Å; F262-Y279 VanDerWaalsContact CE2-CG 3.44Å; F262-Y279 HydrophobicContact CG-CD1 4.41Å; F262-Y279 AromaticContact CG-CG 3.97Å; F262-Y279 HydrophobicContact CG-CG 3.97Å; F262-Y279 AromaticContact CZ-CD2 3.89Å; F262-Y279 HydrophobicContact CZ-CD2 3.89Å; F262-Y279 HydrophobicContact CZ-CE2 4.49Å; F262-Y279 HydrophobicContact CZ-CG 4.18Å; F262-V299 HydrophobicContact CD1-CB 4.44Å; F262-V299 HydrophobicContact CE1-CB 3.73Å; F262-V299 HydrophobicContact CE1-CG1 3.79Å; F262-V299 HydrophobicContact CE1-CG2 3.97Å; F262-V299 HydrophobicContact CZ-CB 4.15Å; F262-V299 HydrophobicContact CZ-CG1 3.79Å
263	T	95.2	Very high	89.2	Confident	81 Å²	81	54.5 Å²	54.5	50%	0.497	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.2	177.4	57	0	0	0	0	110.6	T242 V243 K244	T242-T263 HydrophobicContact CG2-CG2 4.01Å; V243-T263 CarbonylContact O-C 3.55Å; V243-T263 WeakPolarHBondContact O-CA 3.47Å; K244-T263 HydrophobicContact CB-CG2 4.4Å; K244-T263 HydrophobicContact CG-CG2 4.31Å
264	T	95.4	Very high	89.1	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.049	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	-167.1	173.3	-167.7	0	0	0	0	110	V243 E268 L269 Y279	V243-T264 HydrophobicContact CB-CG2 4.19Å; V243-T264 PolarHBondContact N-O 3.15Å; V243-T264 PolarHBondContact O-N 2.97Å; T264-E268 VanDerWaalsContact CA-OE2 3.26Å; T264-E268 WeakPolarHBondContact CA-OE2 3.42Å; T264-E268 WeakPolarHBondContact CB-OE2 3.38Å; T264-E268 WeakPolarHBondContact OG1-CB 3.42Å; T264-E268 PolarHBondContact OG1-OE2 3.31Å; T264-L269 HydrophobicContact CG2-CD1 4Å; T264-L269 HydrophobicContact CG2-CD2 4.04Å; T264-L269 HydrophobicContact CG2-CG 3.9Å; T264-Y279 HydrophobicContact CG2-CE1 4.47Å; T264-Y279 PolarHBondContact OG1-OH 3.38Å
265	S	95.2	Very high	89.1	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.07	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	166	171.9	70.9	0	0	0	0	110.9	R241 R267 E268 L269	R241-S265 WeakPolarHBondContact O-CB 3.41Å; S265-R267 PolarHBondContact O-N 3.16Å; S265-E268 PolarHBondContact N-OE2 2.92Å; S265-E268 PolarHBondContact O-N 2.93Å; S265-E268 VanDerWaalsContact O-N 3.16Å; S265-E268 PolarHBondContact OG-N 3.04Å; S265-L269 WeakPolarHBondContact O-CG 3.3Å; S265-L269 PolarHBondContact O-N 2.91Å
266	Y	93	Very high	88.7	Confident	23 Å²	23	60.6 Å²	60.6	9%	0.09	29%	0.293	C	S	.	.	H	α-helix	trans	-56.2	-41.7	173.8	172	-96.4	0	0	0	111.6	V231 Y239 E268 L269 S270 F304 V306	V231-Y266 HydrophobicContact CB-CE2 4.34Å; V231-Y266 HydrophobicContact CG1-CD2 4.01Å; V231-Y266 HydrophobicContact CG1-CE1 4.49Å; V231-Y266 HydrophobicContact CG1-CE2 3.79Å; V231-Y266 HydrophobicContact CG1-CG 4.46Å; V231-Y266 HydrophobicContact CG2-CD2 4.24Å; V231-Y266 HydrophobicContact CG2-CE2 3.58Å; Y239-Y266 AromaticContact CD1-CD1 3.47Å; Y239-Y266 HydrophobicContact CD1-CD1 3.47Å; Y239-Y266 VanDerWaalsContact CD1-CD1 3.47Å; Y239-Y266 AromaticContact CD1-CE1 3.79Å; Y239-Y266 HydrophobicContact CD1-CE1 3.79Å; Y239-Y266 HydrophobicContact CD1-CG 4.27Å; Y239-Y266 HydrophobicContact CD2-CD1 4.4Å; Y239-Y266 HydrophobicContact CD2-CE1 4.34Å; Y239-Y266 HydrophobicContact CE1-CD1 4.13Å; Y239-Y266 HydrophobicContact CE1-CE1 4.02Å; Y239-Y266 AromaticContact CG-CD1 3.65Å; Y239-Y266 HydrophobicContact CG-CD1 3.65Å; Y239-Y266 AromaticContact CG-CE1 4Å; Y239-Y266 HydrophobicContact CG-CE1 4Å; Y239-Y266 PolarHBondContact O-N 3.38Å; Y266-E268 VanDerWaalsContact C-N 3.28Å; Y266-E268 PolarHBondContact O-N 3.09Å; Y266-L269 PolarHBondContact O-N 3.42Å; Y266-S270 VanDerWaalsContact O-CB 3.28Å; Y266-S270 WeakPolarHBondContact O-CB 3.43Å; Y266-S270 PolarHBondContact O-N 3.16Å; Y266-S270 PolarHBondContact O-OG 3.19Å; Y266-F304 AromaticContact CD2-CZ 3.94Å; Y266-F304 HydrophobicContact CD2-CZ 3.94Å; Y266-F304 HydrophobicContact CE2-CE1 4.17Å; Y266-F304 AromaticContact CE2-CZ 3.75Å; Y266-F304 HydrophobicContact CE2-CZ 3.75Å; Y266-V306 HydrophobicContact CE2-CG2 4.18Å; Y266-V306 WeakPolarHBondContact OH-CG2 3.08Å
267	R	93.2	Very high	88.9	Confident	106 Å²	106	57.5 Å²	57.5	40%	0.4	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-33.6	178.5	-174.5	-178.8	-57	-73.5	0.3	113.4	Y239 D240 S265 S270	Y239-R267 WeakPolarHBondContact O-CB 3.2Å; Y239-R267 PolarHBondContact O-N 2.96Å; D240-R267 VanDerWaalsContact CG-NE 3.26Å; D240-R267 WeakPolarHBondContact OD1-CD 3.46Å; D240-R267 IonicContact OD1-CZ 2.77Å; D240-R267 IonicContact OD1-NE 2.89Å; D240-R267 PolarHBondContact OD1-NE 2.98Å; D240-R267 IonicContact OD2-CZ 2.85Å; D240-R267 IonicContact OD2-NE 3.68Å; D240-R267 PolarHBondContact OD2-NE 3.45Å; D240-R267 IonicContact OD2-NH2 3.35Å; D240-R267 PolarHBondContact OD2-NH2 2.86Å; S265-R267 PolarHBondContact O-N 3.16Å; R267-S270 PolarHBondContact O-OG 2.63Å; R267-S270 VanDerWaalsContact O-OG 3.07Å
268	E	93.2	Very high	89.2	Confident	77 Å²	77	57.3 Å²	57.3	36%	0.36	28%	0.28	S	S	.	.	H	α-helix	trans	-75	-49	175.9	-72	-179.7	165.9	0	0	111.1	T264 S265 Y266 S270 R271 N277	T264-E268 VanDerWaalsContact CA-OE2 3.26Å; T264-E268 WeakPolarHBondContact CA-OE2 3.42Å; T264-E268 WeakPolarHBondContact CB-OE2 3.38Å; T264-E268 WeakPolarHBondContact OG1-CB 3.42Å; T264-E268 PolarHBondContact OG1-OE2 3.31Å; S265-E268 PolarHBondContact N-OE2 2.92Å; S265-E268 PolarHBondContact O-N 2.93Å; S265-E268 VanDerWaalsContact O-N 3.16Å; S265-E268 PolarHBondContact OG-N 3.04Å; Y266-E268 VanDerWaalsContact C-N 3.28Å; Y266-E268 PolarHBondContact O-N 3.09Å; E268-S270 PolarHBondContact O-N 2.96Å; E268-R271 WeakPolarHBondContact O-CB 3.46Å; E268-R271 PolarHBondContact O-N 3.28Å; E268-N277 PolarHBondContact O-ND2 2.96Å; E268-N277 PolarHBondContact O-OD1 3.26Å
269	L	93.7	Very high	89.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.8	-39.9	176.6	-68.2	171.5	0	0	0	111.6	F178 T264 S265 Y266 R271 G272 Y279 L301 F304	F178-L269 HydrophobicContact CZ-CD2 3.95Å; T264-L269 HydrophobicContact CG2-CD1 4Å; T264-L269 HydrophobicContact CG2-CD2 4.04Å; T264-L269 HydrophobicContact CG2-CG 3.9Å; S265-L269 WeakPolarHBondContact O-CG 3.3Å; S265-L269 PolarHBondContact O-N 2.91Å; Y266-L269 PolarHBondContact O-N 3.42Å; L269-R271 PolarHBondContact O-N 3.46Å; L269-G272 PolarHBondContact O-N 3.38Å; L269-Y279 WeakPolarHBondContact CD2-OH 3.5Å; L269-L301 HydrophobicContact CD2-CD1 4.33Å; L269-L301 HydrophobicContact CD2-CD2 3.88Å; L269-F304 HydrophobicContact CB-CD2 3.82Å; L269-F304 HydrophobicContact CB-CE2 3.5Å; L269-F304 VanDerWaalsContact CB-CE2 3.5Å; L269-F304 HydrophobicContact CB-CZ 3.98Å; L269-F304 HydrophobicContact CD1-CE2 4.33Å; L269-F304 HydrophobicContact CG-CE2 4.46Å; L269-F304 WeakPolarHBondContact O-CG 3.38Å
270	S	91.5	Very high	89.4	Confident	55 Å²	55	60.9 Å²	60.9	39%	0.385	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-8.9	179.9	78	0	0	0	0	114.7	Y266 R267 E268 G272 F304	Y266-S270 VanDerWaalsContact O-CB 3.28Å; Y266-S270 WeakPolarHBondContact O-CB 3.43Å; Y266-S270 PolarHBondContact O-N 3.16Å; Y266-S270 PolarHBondContact O-OG 3.19Å; R267-S270 PolarHBondContact O-OG 2.63Å; R267-S270 VanDerWaalsContact O-OG 3.07Å; E268-S270 PolarHBondContact O-N 2.96Å; S270-G272 PolarHBondContact O-N 3.1Å; S270-F304 VanDerWaalsContact CA-CE1 3.41Å
271	R	89.6	Confident	89.3	Confident	146 Å²	146	60.9 Å²	60.9	55%	0.551	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-6	170.6	-62	176.8	-179.7	173.1	1	112.9	E268 L269	E268-R271 WeakPolarHBondContact O-CB 3.46Å; E268-R271 PolarHBondContact O-N 3.28Å; L269-R271 PolarHBondContact O-N 3.46Å
272	G	84.8	Confident	89	Confident	15 Å²	15	64.6 Å²	64.6	16%	0.155	31%	0.309	C	S	.	.			trans	73.1	-157.5	174.9	0	0	0	0	0	113.7	L269 S270 S274 N277	L269-G272 PolarHBondContact O-N 3.38Å; S270-G272 PolarHBondContact O-N 3.1Å; G272-S274 PolarHBondContact O-N 3.41Å; G272-N277 PolarHBondContact O-ND2 3.38Å
273	Q	79.8	Confident	88.4	Confident	144 Å²	144	64.1 Å²	64.1	67%	0.673	31%	0.307	S	S	*	.	S	Bend	trans	-62.7	110.3	174.8	-77.8	-173.3	-13.6	0	0	109.9	L302	Q273-L302 WeakPolarHBondContact CG-O 3.23Å; Q273-L302 PolarHBondContact NE2-O 3.28Å
274	S	76.6	Confident	87.2	Confident	40 Å²	40	63.5 Å²	63.5	28%	0.28	30%	0.3	S	S	.	.	S	Bend	trans	-153.8	165	174.4	75.9	0	0	0	0	110.6	G272 F276 N277	G272-S274 PolarHBondContact O-N 3.41Å; S274-F276 PolarHBondContact O-N 3.46Å; S274-F276 WeakPolarHBondContact OG-CB 3.47Å; S274-F276 PolarHBondContact OG-N 3.04Å; S274-N277 PolarHBondContact O-N 3.34Å
275	Q	74.7	Confident	85.7	Confident	184 Å²	184	68.4 Å²	68.4	86%	0.86	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-59	-17.6	172.6	-64	-176	6.3	0	0	112.7
276	F	72.9	Confident	83.6	Confident	154 Å²	154	72.7 Å²	72.7	68%	0.675	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-80	-15	177.4	-57.7	-74.5	0	0	0	113.6	S274	S274-F276 PolarHBondContact O-N 3.46Å; S274-F276 WeakPolarHBondContact OG-CB 3.47Å; S274-F276 PolarHBondContact OG-N 3.04Å
277	N	88.8	Confident	81.4	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-108.9	39.7	178.7	-67	-28	0	0	0	111.7	E268 G272 S274 Y279 L301	E268-N277 PolarHBondContact O-ND2 2.96Å; E268-N277 PolarHBondContact O-OD1 3.26Å; G272-N277 PolarHBondContact O-ND2 3.38Å; S274-N277 PolarHBondContact O-N 3.34Å; N277-Y279 HydrophobicContact CB-CE2 4.27Å; N277-Y279 PolarHBondContact OD1-OH 3.08Å; N277-L301 HydrophobicContact CB-CB 3.74Å; N277-L301 HydrophobicContact CB-CD2 3.92Å; N277-L301 HydrophobicContact CB-CG 4.5Å; N277-L301 PolarHBondContact O-N 3.3Å
278	V	91.9	Very high	79.2	Confident	69 Å²	69	79.8 Å²	79.8	42%	0.418	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	112.6	167.5	-178.2	0	0	0	0	107.2	T300	V278-T300 HydrophobicContact CG2-CG2 4Å
279	Y	93.2	Very high	76.8	Confident	17 Å²	17	86 Å²	86	7%	0.067	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.7	-171.6	-51.3	-80.4	0	0	0	110.5	F178 F262 T264 L269 N277 V281 T298 V299	F178-Y279 HydrophobicContact CE1-CE2 4.25Å; F262-Y279 VanDerWaalsContact CD2-CB 3.44Å; F262-Y279 AromaticContact CD2-CD1 3.56Å; F262-Y279 HydrophobicContact CD2-CD1 3.56Å; F262-Y279 AromaticContact CD2-CD2 3.82Å; F262-Y279 HydrophobicContact CD2-CD2 3.82Å; F262-Y279 HydrophobicContact CD2-CE1 4.23Å; F262-Y279 HydrophobicContact CD2-CE2 4.46Å; F262-Y279 AromaticContact CD2-CG 3.31Å; F262-Y279 HydrophobicContact CD2-CG 3.31Å; F262-Y279 AromaticContact CE2-CD1 3.93Å; F262-Y279 HydrophobicContact CE2-CD1 3.93Å; F262-Y279 AromaticContact CE2-CD2 3.39Å; F262-Y279 HydrophobicContact CE2-CD2 3.39Å; F262-Y279 HydrophobicContact CE2-CE1 4.31Å; F262-Y279 AromaticContact CE2-CE2 3.84Å; F262-Y279 HydrophobicContact CE2-CE2 3.84Å; F262-Y279 AromaticContact CE2-CG 3.44Å; F262-Y279 HydrophobicContact CE2-CG 3.44Å; F262-Y279 VanDerWaalsContact CE2-CG 3.44Å; F262-Y279 HydrophobicContact CG-CD1 4.41Å; F262-Y279 AromaticContact CG-CG 3.97Å; F262-Y279 HydrophobicContact CG-CG 3.97Å; F262-Y279 AromaticContact CZ-CD2 3.89Å; F262-Y279 HydrophobicContact CZ-CD2 3.89Å; F262-Y279 HydrophobicContact CZ-CE2 4.49Å; F262-Y279 HydrophobicContact CZ-CG 4.18Å; T264-Y279 HydrophobicContact CG2-CE1 4.47Å; T264-Y279 PolarHBondContact OG1-OH 3.38Å; L269-Y279 WeakPolarHBondContact CD2-OH 3.5Å; N277-Y279 HydrophobicContact CB-CE2 4.27Å; N277-Y279 PolarHBondContact OD1-OH 3.08Å; Y279-V281 PolarHBondContact O-N 2.85Å; Y279-T298 CarbonylContact O-C 3.53Å; Y279-T298 VanDerWaalsContact O-CA 3.23Å; Y279-T298 WeakPolarHBondContact O-CA 3.46Å; Y279-V299 WeakPolarHBondContact CD2-O 3.4Å; Y279-V299 PolarHBondContact N-O 2.7Å; Y279-V299 PolarHBondContact O-N 2.6Å
280	E	92.3	Very high	74.4	Confident	92 Å²	92	94.5 Å²	94.5	43%	0.43	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	122.9	168.2	-63.2	-172.4	143.2	0	0	109.5	R282 N295	E280-R282 PolarHBondContact O-N 3.03Å; E280-R282 IonicContact OE2-CZ 3.18Å; E280-R282 IonicContact OE2-NE 2.74Å; E280-R282 IonicContact OE2-NH2 3.62Å; E280-R282 PolarHBondContact OE2-NH2 3.06Å; E280-N295 PolarHBondContact OE1-ND2 3.38Å
281	V	90.9	Very high	72	Confident	0 Å²	0	99.8 Å²	99.8	0%	0	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119	175.5	-177.8	0	0	0	0	107.8	L183 V247 I259 Y279 S296 G297 V299	L183-V281 HydrophobicContact CD2-CG2 4.26Å; V247-V281 HydrophobicContact CB-CG1 4.25Å; V247-V281 HydrophobicContact CG2-CG1 3.84Å; V247-V281 HydrophobicContact CG2-CG2 4.03Å; I259-V281 HydrophobicContact CG2-CG1 4.38Å; Y279-V281 PolarHBondContact O-N 2.85Å; V281-S296 PolarHBondContact O-N 3.38Å; V281-G297 WeakPolarHBondContact CB-O 3.38Å; V281-G297 PolarHBondContact N-O 3.18Å; V281-V299 HydrophobicContact CG2-CB 4.34Å; V281-V299 HydrophobicContact CG2-CG2 3.59Å
282	R	87.6	Confident	70.1	Confident	122 Å²	122	99.2 Å²	99.2	46%	0.46	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.5	-176.5	-66.7	-176.8	179.4	172.5	1.1	110.8	G260 E261 E280	G260-R282 CarbonylContact C-O 3.54Å; G260-R282 VanDerWaalsContact CA-O 3.31Å; G260-R282 WeakPolarHBondContact CA-O 3.46Å; E261-R282 PolarHBondContact N-O 2.95Å; E261-R282 PolarHBondContact O-N 3.49Å; E280-R282 PolarHBondContact O-N 3.03Å; E280-R282 IonicContact OE2-CZ 3.18Å; E280-R282 IonicContact OE2-NE 2.74Å; E280-R282 IonicContact OE2-NH2 3.62Å; E280-R282 PolarHBondContact OE2-NH2 3.06Å
283	N	82.3	Confident	68.7	Low	4 Å²	4	100.9 Å²	100.9	2%	0.021	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	106	172.5	-163.5	-49.3	0	0	0	110.5	F258 I259 N285 F286	F258-N283 PolarHBondContact O-ND2 3.04Å; F258-N283 VanDerWaalsContact O-ND2 3.15Å; I259-N283 WeakPolarHBondContact O-CB 3.47Å; I259-N283 PolarHBondContact O-ND2 3.38Å; N283-N285 VanDerWaalsContact C-N 3.34Å; N283-N285 WeakPolarHBondContact OD1-CB 3.18Å; N283-N285 PolarHBondContact OD1-N 3.49Å; N283-F286 HydrophobicContact CB-CD2 3.88Å; N283-F286 HydrophobicContact CB-CE2 4.42Å
284	L	70.1	Confident	68	Low	67 Å²	67	97.6 Å²	97.6	35%	0.351	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-78.1	-16.9	179.5	-66.4	178.3	0	0	0	113.5	E261 F286 K287	E261-L284 WeakPolarHBondContact OE1-CD1 3.25Å; L284-F286 PolarHBondContact O-N 3.38Å; L284-K287 WeakPolarHBondContact O-CB 3.17Å; L284-K287 PolarHBondContact O-N 3.32Å
285	N	63.5	Low	68.1	Low	112 Å²	112	99.2 Å²	99.2	60%	0.599	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-71.1	-18.8	-179.2	-66.4	-16.9	0	0	0	112.7	N283 K287	N283-N285 VanDerWaalsContact C-N 3.34Å; N283-N285 WeakPolarHBondContact OD1-CB 3.18Å; N283-N285 PolarHBondContact OD1-N 3.49Å; N285-K287 PolarHBondContact O-N 3.03Å
286	F	52.8	Low	68.7	Low	99 Å²	99	90.4 Å²	90.4	43%	0.434	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-74.7	-5.5	174.5	-82.3	-79.4	0	0	0	114.9	N283 L284 I288 Y289	N283-F286 HydrophobicContact CB-CD2 3.88Å; N283-F286 HydrophobicContact CB-CE2 4.42Å; L284-F286 PolarHBondContact O-N 3.38Å; F286-I288 PolarHBondContact O-N 3.24Å; F286-Y289 PolarHBondContact O-N 3.18Å
287	K	45.8	Very low	69.5	Low	146 Å²	146	83.3 Å²	83.3	64%	0.635	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-60.2	-12.3	175.8	-81.2	-174.9	175.9	177.1	0	114.2	L284 N285	L284-K287 WeakPolarHBondContact O-CB 3.17Å; L284-K287 PolarHBondContact O-N 3.32Å; N285-K287 PolarHBondContact O-N 3.03Å
288	I	46.4	Very low	69.8	Low	133 Å²	133	85 Å²	85	68%	0.682	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-75.9	-21.4	179.8	-58.7	178.5	0	0	0	112.4	F286	F286-I288 PolarHBondContact O-N 3.24Å
289	Y	43.9	Very low	70	Confident	208 Å²	208	81.7 Å²	81.7	82%	0.816	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-23	-172.7	-71.1	-77.5	0	0	0	117.4	F286	F286-Y289 PolarHBondContact O-N 3.18Å
290	K	41.9	Very low	70.1	Confident	177 Å²	177	82.5 Å²	82.5	77%	0.77	40%	0.404	S	S	*	.	S	Bend	trans	-150.1	141.3	172.7	-81.4	-176	178.6	168.1	0	111.2	N292	K290-N292 PolarHBondContact O-N 3.04Å
291	N	43.2	Very low	70.3	Confident	166 Å²	166	78.3 Å²	78.3	89%	0.888	38%	0.384	S	S	*	.	S	Bend	trans	-71.8	22.9	-164.6	-139.4	17.7	0	0	0	116.5
292	N	48.6	Very low	70.4	Confident	135 Å²	135	80.5 Å²	80.5	72%	0.722	40%	0.396	S	S	*	.	S	Bend	trans	-135.9	131.1	179.4	-82.1	-9.6	0	0	0	110.1	K290 V294	K290-N292 PolarHBondContact O-N 3.04Å; N292-V294 PolarHBondContact O-N 3.08Å
293	S	54.6	Low	70.7	Confident	50 Å²	50	76.6 Å²	76.6	35%	0.35	39%	0.387	S	S	.	.			trans	-64.1	123.1	167.8	68.9	0	0	0	0	108.8
294	V	66.2	Low	71.2	Confident	75 Å²	75	77.9 Å²	77.9	46%	0.455	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130	175.9	-177.5	0	0	0	0	107.8	N292 S296	N292-V294 PolarHBondContact O-N 3.08Å; V294-S296 PolarHBondContact O-N 3.38Å
295	N	78.1	Confident	72.2	Confident	73 Å²	73	80.3 Å²	80.3	39%	0.39	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	114.4	170.4	177.7	-41.4	0	0	0	107.4	E280 G297	E280-N295 PolarHBondContact OE1-ND2 3.38Å; N295-G297 VanDerWaalsContact C-N 3.3Å; N295-G297 WeakPolarHBondContact OD1-CA 3.3Å; N295-G297 PolarHBondContact OD1-N 2.7Å; N295-G297 PolarHBondContact OD1-O 3.36Å
296	S	86.7	Confident	73.5	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	30.8	-176.3	-66.2	0	0	0	0	111.8	L183 D184 I259 V281 V294	L183-S296 WeakPolarHBondContact CA-O 3.18Å; D184-S296 PolarHBondContact N-O 3.07Å; D184-S296 WeakPolarHBondContact OD2-CB 3.32Å; D184-S296 PolarHBondContact OD2-OG 3.2Å; I259-S296 PolarHBondContact O-OG 2.81Å; V281-S296 PolarHBondContact O-N 3.38Å; V294-S296 PolarHBondContact O-N 3.38Å
297	G	91.4	Very high	75	Confident	5 Å²	5	76.5 Å²	76.5	5%	0.052	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	103.7	-173.1	-175.9	0	0	0	0	0	113.3	N181 K182 V281 N295	N181-G297 WeakPolarHBondContact O-CA 3.42Å; K182-G297 VanDerWaalsContact O-CA 3.23Å; K182-G297 WeakPolarHBondContact O-CA 3.49Å; V281-G297 WeakPolarHBondContact CB-O 3.38Å; V281-G297 PolarHBondContact N-O 3.18Å; N295-G297 VanDerWaalsContact C-N 3.3Å; N295-G297 WeakPolarHBondContact OD1-CA 3.3Å; N295-G297 PolarHBondContact OD1-N 2.7Å; N295-G297 PolarHBondContact OD1-O 3.36Å
298	T	93.8	Very high	76.7	Confident	34 Å²	34	73.2 Å²	73.2	21%	0.209	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.8	179.2	57	0	0	0	0	111.2	A180 N181 Y279	A180-T298 CarbonylContact C-O 3.57Å; A180-T298 WeakPolarHBondContact CA-O 3.47Å; A180-T298 WeakPolarHBondContact CB-O 3.41Å; N181-T298 PolarHBondContact N-O 2.82Å; N181-T298 PolarHBondContact O-N 3.2Å; Y279-T298 CarbonylContact O-C 3.53Å; Y279-T298 VanDerWaalsContact O-CA 3.23Å; Y279-T298 WeakPolarHBondContact O-CA 3.46Å
299	V	95.9	Very high	78.2	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133	169.8	171.4	0	0	0	0	108.7	F178 C179 A180 L196 V247 F262 Y279 V281	F178-V299 HydrophobicContact CB-CG1 4.41Å; F178-V299 HydrophobicContact CD1-CG1 3.6Å; F178-V299 HydrophobicContact CE1-CG1 4.28Å; F178-V299 HydrophobicContact CG-CG1 4.37Å; C179-V299 CarbonylContact O-C 3.5Å; C179-V299 WeakPolarHBondContact O-CA 3.15Å; A180-V299 HydrophobicContact CB-CG2 3.91Å; L196-V299 HydrophobicContact CD1-CG1 4.49Å; L196-V299 HydrophobicContact CD2-CG2 4.39Å; V247-V299 HydrophobicContact CG2-CG2 4.16Å; F262-V299 HydrophobicContact CD1-CB 4.44Å; F262-V299 HydrophobicContact CE1-CB 3.73Å; F262-V299 HydrophobicContact CE1-CG1 3.79Å; F262-V299 HydrophobicContact CE1-CG2 3.97Å; F262-V299 HydrophobicContact CZ-CB 4.15Å; F262-V299 HydrophobicContact CZ-CG1 3.79Å; Y279-V299 WeakPolarHBondContact CD2-O 3.4Å; Y279-V299 PolarHBondContact N-O 2.7Å; Y279-V299 PolarHBondContact O-N 2.6Å; V281-V299 HydrophobicContact CG2-CB 4.34Å; V281-V299 HydrophobicContact CG2-CG2 3.59Å
300	T	95.8	Very high	80.1	Confident	35 Å²	35	63.1 Å²	63.1	22%	0.215	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.3	-176.7	-58.3	0	0	0	0	110.3	F178 C179 V278 L302	F178-T300 WeakPolarHBondContact CA-O 3.36Å; C179-T300 PolarHBondContact N-O 2.9Å; C179-T300 PolarHBondContact O-N 3.38Å; V278-T300 HydrophobicContact CG2-CG2 4Å; T300-L302 PolarHBondContact O-N 2.74Å
301	L	95.9	Very high	82.2	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	112.7	170.1	-176.6	67.3	0	0	0	109.8	M176 F178 L269 N277 S303 F304	M176-L301 HydrophobicContact CB-CD1 4.02Å; F178-L301 HydrophobicContact CD1-CB 4.27Å; F178-L301 HydrophobicContact CD1-CD1 4.26Å; F178-L301 HydrophobicContact CD2-CD1 4.2Å; F178-L301 HydrophobicContact CE1-CB 3.89Å; F178-L301 HydrophobicContact CE1-CD1 3.74Å; F178-L301 HydrophobicContact CE1-CG 4.42Å; F178-L301 HydrophobicContact CE2-CD1 3.66Å; F178-L301 HydrophobicContact CG-CD1 4.49Å; F178-L301 HydrophobicContact CZ-CB 4.42Å; F178-L301 HydrophobicContact CZ-CD1 3.43Å; F178-L301 VanDerWaalsContact CZ-CD1 3.43Å; F178-L301 HydrophobicContact CZ-CG 4.47Å; L269-L301 HydrophobicContact CD2-CD1 4.33Å; L269-L301 HydrophobicContact CD2-CD2 3.88Å; N277-L301 HydrophobicContact CB-CB 3.74Å; N277-L301 HydrophobicContact CB-CD2 3.92Å; N277-L301 HydrophobicContact CB-CG 4.5Å; N277-L301 PolarHBondContact O-N 3.3Å; L301-S303 VanDerWaalsContact CD1-O 3.29Å; L301-S303 WeakPolarHBondContact CD1-O 3.5Å; L301-F304 HydrophobicContact CD1-CB 4.48Å; L301-F304 HydrophobicContact CD2-CB 3.97Å; L301-F304 HydrophobicContact CD2-CD2 4.42Å; L301-F304 HydrophobicContact CG-CB 4.47Å
302	L	94.1	Very high	84.4	Confident	47 Å²	47	49 Å²	49	25%	0.246	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-29.3	177.2	-66.8	-177	0	0	0	112.8	Q177 C179 V223 Q273 T300	Q177-L302 HydrophobicContact CB-CB 4.2Å; Q177-L302 HydrophobicContact CG-CB 4.37Å; Q177-L302 HydrophobicContact CG-CD1 4.37Å; Q177-L302 WeakPolarHBondContact O-CA 3.43Å; Q177-L302 WeakPolarHBondContact O-CB 3.44Å; Q177-L302 PolarHBondContact O-N 2.86Å; C179-L302 HydrophobicContact CB-CD1 3.8Å; C179-L302 HydrophobicContact CB-CG 4.18Å; V223-L302 HydrophobicContact CG1-CD1 3.91Å; Q273-L302 WeakPolarHBondContact CG-O 3.23Å; Q273-L302 PolarHBondContact NE2-O 3.28Å; T300-L302 PolarHBondContact O-N 2.74Å
303	S	93.1	Very high	86.3	Confident	40 Å²	40	42.8 Å²	42.8	28%	0.28	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	148.1	174.3	63	0	0	0	0	110	M176 Q177 L301	M176-S303 WeakPolarHBondContact CA-O 3.28Å; M176-S303 WeakPolarHBondContact CB-O 3.02Å; Q177-S303 VanDerWaalsContact CB-OG 3.28Å; Q177-S303 WeakPolarHBondContact CB-OG 3.48Å; Q177-S303 PolarHBondContact N-O 2.74Å; Q177-S303 VanDerWaalsContact N-O 3.12Å; Q177-S303 PolarHBondContact N-OG 2.75Å; Q177-S303 PolarHBondContact O-N 3.24Å; L301-S303 VanDerWaalsContact CD1-O 3.29Å; L301-S303 WeakPolarHBondContact CD1-O 3.5Å
304	F	93	Very high	87.8	Confident	30 Å²	30	41.4 Å²	41.4	13%	0.132	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	118.2	170.8	-168.1	-91.3	0	0	0	108.4	A174 T175 M176 Y266 L269 S270 L301 V306	A174-F304 HydrophobicContact CB-CE2 3.77Å; A174-F304 HydrophobicContact CB-CZ 3.69Å; T175-F304 WeakPolarHBondContact O-CA 3.32Å; M176-F304 HydrophobicContact CB-CD2 4.09Å; M176-F304 HydrophobicContact CE-CD2 4.22Å; M176-F304 HydrophobicContact CE-CE2 3.71Å; Y266-F304 AromaticContact CD2-CZ 3.94Å; Y266-F304 HydrophobicContact CD2-CZ 3.94Å; Y266-F304 HydrophobicContact CE2-CE1 4.17Å; Y266-F304 AromaticContact CE2-CZ 3.75Å; Y266-F304 HydrophobicContact CE2-CZ 3.75Å; L269-F304 HydrophobicContact CB-CD2 3.82Å; L269-F304 HydrophobicContact CB-CE2 3.5Å; L269-F304 VanDerWaalsContact CB-CE2 3.5Å; L269-F304 HydrophobicContact CB-CZ 3.98Å; L269-F304 HydrophobicContact CD1-CE2 4.33Å; L269-F304 HydrophobicContact CG-CE2 4.46Å; L269-F304 WeakPolarHBondContact O-CG 3.38Å; S270-F304 VanDerWaalsContact CA-CE1 3.41Å; L301-F304 HydrophobicContact CD1-CB 4.48Å; L301-F304 HydrophobicContact CD2-CB 3.97Å; L301-F304 HydrophobicContact CD2-CD2 4.42Å; L301-F304 HydrophobicContact CG-CB 4.47Å; F304-V306 HydrophobicContact CD1-CG2 4Å; F304-V306 HydrophobicContact CE1-CG2 3.28Å; F304-V306 HydrophobicContact CZ-CG2 4.01Å
305	K	92.1	Very high	89	Confident	119 Å²	119	38.2 Å²	38.2	52%	0.517	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.8	177	-168.2	-173.2	-176	-170.2	0	107.5	A174 T175 E307	A174-K305 CarbonylContact C-O 3.59Å; A174-K305 WeakPolarHBondContact CA-O 3.44Å; T175-K305 PolarHBondContact N-O 3.43Å; T175-K305 PolarHBondContact O-N 3.05Å; K305-E307 HydrophobicContact CD-CG 3.91Å; K305-E307 VanDerWaalsContact CE-CD 3.42Å; K305-E307 WeakPolarHBondContact CE-OE1 3.17Å; K305-E307 HydrophobicContact CG-CG 4Å; K305-E307 IonicContact NZ-OE1 2.79Å; K305-E307 PolarHBondContact NZ-OE1 3.26Å; K305-E307 IonicContact NZ-OE2 2.67Å
306	V	89.4	Confident	89.6	Confident	55 Å²	55	35 Å²	35	33%	0.333	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.7	172.8	-175.5	0	0	0	0	107	D172 I173 V231 Y266 F304	D172-V306 HydrophobicContact CB-CG1 3.73Å; I173-V306 WeakPolarHBondContact O-CA 3.2Å; V231-V306 HydrophobicContact CG2-CG1 4.47Å; Y266-V306 HydrophobicContact CE2-CG2 4.18Å; Y266-V306 WeakPolarHBondContact OH-CG2 3.08Å; F304-V306 HydrophobicContact CD1-CG2 4Å; F304-V306 HydrophobicContact CE1-CG2 3.28Å; F304-V306 HydrophobicContact CZ-CG2 4.01Å
307	E	85.3	Confident	89.5	Confident	75 Å²	75	36.3 Å²	36.3	35%	0.35	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.6	177.1	-63.1	175.4	118.3	0	0	107.1	D172 I173 K305 E309	D172-E307 WeakPolarHBondContact CA-O 3.23Å; I173-E307 HydrophobicContact CG1-CB 4.39Å; I173-E307 VanDerWaalsContact CG1-O 3.31Å; I173-E307 WeakPolarHBondContact CG1-O 3.39Å; I173-E307 PolarHBondContact N-O 3.01Å; I173-E307 PolarHBondContact O-N 2.99Å; K305-E307 HydrophobicContact CD-CG 3.91Å; K305-E307 VanDerWaalsContact CE-CD 3.42Å; K305-E307 WeakPolarHBondContact CE-OE1 3.17Å; K305-E307 HydrophobicContact CG-CG 4Å; K305-E307 IonicContact NZ-OE1 2.79Å; K305-E307 PolarHBondContact NZ-OE1 3.26Å; K305-E307 IonicContact NZ-OE2 2.67Å; E307-E309 PolarHBondContact O-N 3.35Å
308	S	81.1	Confident	89.3	Confident	77 Å²	77	36.1 Å²	36.1	54%	0.538	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	119.5	167.8	-57.9	0	0	0	0	107.3	D172	D172-S308 PolarHBondContact OD1-OG 3.42Å
309	E	78.3	Confident	89.1	Confident	73 Å²	73	35.5 Å²	35.5	34%	0.341	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-75.4	126.5	175.1	-166.6	160.3	-138.1	0	0	108.6	R171 I173 E307 K554	R171-E309 PolarHBondContact O-N 2.97Å; I173-E309 HydrophobicContact CD1-CB 4.19Å; I173-E309 HydrophobicContact CD1-CG 4.42Å; I173-E309 HydrophobicContact CG1-CB 4.23Å; I173-E309 HydrophobicContact CG2-CB 4.12Å; I173-E309 WeakPolarHBondContact CG2-OE2 3.39Å; E307-E309 PolarHBondContact O-N 3.35Å; E309-K554 IonicContact OE1-NZ 3.25Å; E309-K554 PolarHBondContact OE1-NZ 3.36Å
310	H	84.3	Confident	88.9	Confident	57 Å²	57	35.9 Å²	35.9	26%	0.264	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-68.3	144.8	173.2	-66.4	-58.8	0	0	0	109.8	D314 Y315 M550 A560	H310-D314 HydrophobicContact CB-CB 4.46Å; H310-Y315 HydrophobicContact CB-CD2 4.37Å; H310-Y315 HydrophobicContact CB-CE2 3.57Å; H310-M550 WeakPolarHBondContact O-CE 3.38Å; H310-A560 HydrophobicContact CB-CB 4.09Å; H310-A560 PolarHBondContact CD2-N 2.8Å; H310-A560 WeakPolarHBondContact ND1-CB 3.37Å; H310-A560 PolarHBondContact NE2-N 2.79Å
311	T	85.9	Confident	88.7	Confident	30 Å²	30	37.1 Å²	37.1	18%	0.184	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-98.5	165.2	173	70.8	0	0	0	0	110.4	E166 V313 D314 Y315 M550	E166-T311 WeakPolarHBondContact OE2-CB 3.32Å; E166-T311 WeakPolarHBondContact OE2-CG2 3.47Å; E166-T311 PolarHBondContact OE2-OG1 3.21Å; T311-V313 PolarHBondContact O-N 3.43Å; T311-V313 PolarHBondContact OG1-N 2.91Å; T311-D314 PolarHBondContact N-OD2 2.64Å; T311-D314 WeakPolarHBondContact O-CB 3.4Å; T311-D314 PolarHBondContact O-N 2.89Å; T311-D314 VanDerWaalsContact O-N 3.08Å; T311-D314 PolarHBondContact OG1-N 3.27Å; T311-D314 PolarHBondContact OG1-OD2 3.41Å; T311-Y315 VanDerWaalsContact O-CD2 3.29Å; T311-Y315 WeakPolarHBondContact O-CD2 3.31Å; T311-Y315 PolarHBondContact O-N 2.87Å; T311-M550 VanDerWaalsContact C-SD 3.59Å
312	F	88.4	Confident	88.6	Confident	17 Å²	17	37 Å²	37	8%	0.075	20%	0.196	C	C	.	.	H	α-helix	trans	-52	-42.7	170.2	172.4	-99.4	0	0	0	111.9	F80 D314 Y315 I316 L322 Y368 P546 L549 M550	F80-F312 AromaticContact CD2-CE1 3.57Å; F80-F312 HydrophobicContact CD2-CE1 3.57Å; F80-F312 AromaticContact CD2-CZ 3.61Å; F80-F312 HydrophobicContact CD2-CZ 3.61Å; F80-F312 HydrophobicContact CE2-CE1 4.05Å; F80-F312 AromaticContact CE2-CZ 3.61Å; F80-F312 HydrophobicContact CE2-CZ 3.61Å; F80-F312 HydrophobicContact CG-CE1 4.21Å; F80-F312 HydrophobicContact CG-CZ 4.35Å; F80-F312 HydrophobicContact CZ-CZ 4.35Å; F312-D314 VanDerWaalsContact C-N 3.31Å; F312-D314 PolarHBondContact O-N 2.93Å; F312-Y315 PolarHBondContact O-N 2.97Å; F312-I316 HydrophobicContact CD1-CG1 4.24Å; F312-I316 HydrophobicContact CE1-CD1 4.4Å; F312-I316 HydrophobicContact CE1-CG1 3.74Å; F312-I316 HydrophobicContact CE2-CD1 4.16Å; F312-I316 HydrophobicContact CE2-CG1 4.18Å; F312-I316 HydrophobicContact CZ-CD1 3.87Å; F312-I316 HydrophobicContact CZ-CG1 3.72Å; F312-I316 WeakPolarHBondContact O-CG1 3.3Å; F312-I316 PolarHBondContact O-N 2.8Å; F312-L322 HydrophobicContact CZ-CD1 4.17Å; F312-Y368 HydrophobicContact CE1-CE1 4.45Å; F312-P546 HydrophobicContact CB-CB 4.08Å; F312-P546 HydrophobicContact CD1-CB 4.44Å; F312-P546 HydrophobicContact CD2-CB 3.81Å; F312-P546 HydrophobicContact CD2-CG 4.34Å; F312-P546 HydrophobicContact CE2-CB 4.34Å; F312-P546 HydrophobicContact CE2-CG 4.43Å; F312-P546 HydrophobicContact CG-CB 3.85Å; F312-P546 HydrophobicContact CG-CG 4.39Å; F312-L549 HydrophobicContact CD2-CD1 4.34Å; F312-L549 HydrophobicContact CD2-CD2 4.39Å; F312-L549 HydrophobicContact CE2-CD1 4.03Å; F312-M550 HydrophobicContact CB-CG 4.43Å; F312-M550 HydrophobicContact CB-SD 4.49Å; F312-M550 PolarHBondContact N-SD 2.93Å
313	V	88.1	Confident	88.6	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.024	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-34.7	179.7	175.9	0	0	0	0	111.9	T17 I19 Y78 I117 E166 T311 Y315 I316 R317	T17-V313 HydrophobicContact CG2-CG2 4.15Å; I19-V313 HydrophobicContact CD1-CG1 4.22Å; I19-V313 HydrophobicContact CD1-CG2 4.42Å; Y78-V313 HydrophobicContact CD1-CG2 4.22Å; Y78-V313 HydrophobicContact CE1-CG2 3.89Å; I117-V313 HydrophobicContact CG2-CG1 3.99Å; E166-V313 HydrophobicContact CB-CG1 4.22Å; T311-V313 PolarHBondContact O-N 3.43Å; T311-V313 PolarHBondContact OG1-N 2.91Å; V313-Y315 PolarHBondContact O-N 2.71Å; V313-I316 PolarHBondContact O-N 2.86Å; V313-R317 HydrophobicContact CG1-CG 4.11Å; V313-R317 WeakPolarHBondContact O-CB 3.48Å; V313-R317 WeakPolarHBondContact O-CG 3.45Å; V313-R317 PolarHBondContact O-N 3.22Å
314	D	87.5	Confident	88.7	Confident	21 Å²	21	34 Å²	34	11%	0.112	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-42.4	175.5	-68.4	-31	0	0	0	111.8	R171 H310 T311 F312 G318 A560	R171-D314 IonicContact CZ-OD1 2.76Å; R171-D314 IonicContact CZ-OD2 3.9Å; R171-D314 IonicContact NE-OD2 2.86Å; R171-D314 IonicContact NH1-OD1 3.63Å; R171-D314 PolarHBondContact NH1-OD1 2.77Å; R171-D314 IonicContact NH1-OD2 3.26Å; R171-D314 PolarHBondContact NH1-OD2 3.35Å; R171-D314 IonicContact NH2-OD1 2.79Å; R171-D314 PolarHBondContact NH2-OD1 3.05Å; R171-D314 IonicContact NH2-OD2 3.16Å; H310-D314 HydrophobicContact CB-CB 4.46Å; T311-D314 PolarHBondContact N-OD2 2.64Å; T311-D314 WeakPolarHBondContact O-CB 3.4Å; T311-D314 PolarHBondContact O-N 2.89Å; T311-D314 VanDerWaalsContact O-N 3.08Å; T311-D314 PolarHBondContact OG1-N 3.27Å; T311-D314 PolarHBondContact OG1-OD2 3.41Å; F312-D314 VanDerWaalsContact C-N 3.31Å; F312-D314 PolarHBondContact O-N 2.93Å; D314-G318 PolarHBondContact O-N 3.03Å; D314-A560 HydrophobicContact CB-CB 3.85Å
315	Y	90.8	Very high	88.9	Confident	8 Å²	8	32.8 Å²	32.8	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-45.8	177.4	-74.6	-79.3	0	0	0	111.9	H310 T311 F312 V313 G318 G319 T320 L549 M550 M553 I558 A560	H310-Y315 HydrophobicContact CB-CD2 4.37Å; H310-Y315 HydrophobicContact CB-CE2 3.57Å; T311-Y315 VanDerWaalsContact O-CD2 3.29Å; T311-Y315 WeakPolarHBondContact O-CD2 3.31Å; T311-Y315 PolarHBondContact O-N 2.87Å; F312-Y315 PolarHBondContact O-N 2.97Å; V313-Y315 PolarHBondContact O-N 2.71Å; Y315-G318 CarbonylContact O-C 3.58Å; Y315-G318 PolarHBondContact O-N 3.12Å; Y315-G319 PolarHBondContact O-N 2.7Å; Y315-T320 WeakPolarHBondContact O-CB 3.31Å; Y315-T320 PolarHBondContact O-N 3.3Å; Y315-T320 PolarHBondContact O-OG1 2.78Å; Y315-L549 HydrophobicContact CD2-CD2 4.23Å; Y315-L549 HydrophobicContact CG-CD2 4.24Å; Y315-M550 HydrophobicContact CD2-CE 4.4Å; Y315-M550 HydrophobicContact CD2-SD 3.56Å; Y315-M550 VanDerWaalsContact CD2-SD 3.56Å; Y315-M550 HydrophobicContact CE2-CE 3.74Å; Y315-M550 HydrophobicContact CE2-SD 3.47Å; Y315-M550 WeakPolarHBondContact CE2-SD 3.37Å; Y315-M553 HydrophobicContact CD1-CE 4.03Å; Y315-M553 HydrophobicContact CD1-CG 3.96Å; Y315-M553 HydrophobicContact CD1-SD 4.19Å; Y315-M553 HydrophobicContact CD2-CG 4.5Å; Y315-M553 HydrophobicContact CE1-CB 3.83Å; Y315-M553 HydrophobicContact CE1-CE 4.43Å; Y315-M553 HydrophobicContact CE1-CG 3.61Å; Y315-M553 HydrophobicContact CE1-SD 3.97Å; Y315-M553 HydrophobicContact CE2-CB 4.16Å; Y315-M553 HydrophobicContact CE2-CG 4.2Å; Y315-M553 HydrophobicContact CG-CG 4.4Å; Y315-M553 WeakPolarHBondContact OH-CB 3.31Å; Y315-I558 HydrophobicContact CE1-CG2 4.32Å; Y315-I558 PolarHBondContact OH-O 3.12Å; Y315-A560 HydrophobicContact CD1-CB 4.01Å; Y315-A560 HydrophobicContact CD2-CB 4.44Å; Y315-A560 HydrophobicContact CE1-CB 4Å; Y315-A560 HydrophobicContact CE2-CB 4.42Å; Y315-A560 HydrophobicContact CG-CB 4.22Å
316	I	90.7	Very high	89.1	Confident	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-49.5	178.1	-62.3	-56	0	0	0	110.7	I117 F312 V313 G318 G319 L322 Y368	I117-I316 HydrophobicContact CG2-CG2 4.23Å; F312-I316 HydrophobicContact CD1-CG1 4.24Å; F312-I316 HydrophobicContact CE1-CD1 4.4Å; F312-I316 HydrophobicContact CE1-CG1 3.74Å; F312-I316 HydrophobicContact CE2-CD1 4.16Å; F312-I316 HydrophobicContact CE2-CG1 4.18Å; F312-I316 HydrophobicContact CZ-CD1 3.87Å; F312-I316 HydrophobicContact CZ-CG1 3.72Å; F312-I316 WeakPolarHBondContact O-CG1 3.3Å; F312-I316 PolarHBondContact O-N 2.8Å; V313-I316 PolarHBondContact O-N 2.86Å; I316-G318 VanDerWaalsContact C-N 3.27Å; I316-G318 PolarHBondContact O-N 3.01Å; I316-G319 WeakPolarHBondContact O-CA 2.98Å; I316-G319 PolarHBondContact O-N 3.2Å; I316-L322 HydrophobicContact CD1-CD1 4.49Å; I316-L322 HydrophobicContact CD1-CD2 4.29Å; I316-L322 HydrophobicContact CD1-CG 4.07Å; I316-Y368 HydrophobicContact CD1-CD1 4.36Å; I316-Y368 HydrophobicContact CG1-CD1 4.31Å; I316-Y368 HydrophobicContact CG2-CD1 3.99Å
317	R	85.7	Confident	89.5	Confident	27 Å²	27	24.5 Å²	24.5	10%	0.102	13%	0.132	C	C	.	.	H	α-helix	trans	-65.7	-29.9	178	-69.8	179.4	67.8	-158.8	4.6	113.1	I117 A164 V313 G319	I117-R317 HydrophobicContact CG2-CG 4.48Å; A164-R317 PolarHBondContact O-NE 3.09Å; A164-R317 PolarHBondContact O-NH2 3.5Å; V313-R317 HydrophobicContact CG1-CG 4.11Å; V313-R317 WeakPolarHBondContact O-CB 3.48Å; V313-R317 WeakPolarHBondContact O-CG 3.45Å; V313-R317 PolarHBondContact O-N 3.22Å; R317-G319 PolarHBondContact O-N 2.72Å
318	G	87.1	Confident	90.1	Very high	1 Å²	1	21 Å²	21	1%	0.01	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	2.5	169.8	0	0	0	0	0	114.1	D314 Y315 I316 R561	D314-G318 PolarHBondContact O-N 3.03Å; Y315-G318 CarbonylContact O-C 3.58Å; Y315-G318 PolarHBondContact O-N 3.12Å; I316-G318 VanDerWaalsContact C-N 3.27Å; I316-G318 PolarHBondContact O-N 3.01Å; G318-R561 VanDerWaalsContact CA-O 3.27Å; G318-R561 WeakPolarHBondContact CA-O 3.43Å; G318-R561 WeakPolarHBondContact O-CB 3.21Å; G318-R561 PolarHBondContact O-NE 3.39Å
319	G	88.9	Confident	90.9	Very high	21 Å²	21	17.3 Å²	17.3	22%	0.216	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	21.1	175.3	0	0	0	0	0	114.3	Y315 I316 R317 Q321 R561	Y315-G319 PolarHBondContact O-N 2.7Å; I316-G319 WeakPolarHBondContact O-CA 2.98Å; I316-G319 PolarHBondContact O-N 3.2Å; R317-G319 PolarHBondContact O-N 2.72Å; G319-Q321 PolarHBondContact O-N 3.02Å; G319-R561 VanDerWaalsContact C-NH2 3.3Å; G319-R561 PolarHBondContact O-NH2 3.28Å
320	T	92.2	Very high	91.8	Very high	7 Å²	7	13.8 Å²	13.8	4%	0.043	7%	0.073	C	C	.	.			trans	-70.1	124.5	168.1	-54.1	0	0	0	0	108.6	Y315 G446 S447 L549 M553	Y315-T320 WeakPolarHBondContact O-CB 3.31Å; Y315-T320 PolarHBondContact O-N 3.3Å; Y315-T320 PolarHBondContact O-OG1 2.78Å; T320-G446 WeakPolarHBondContact CG2-O 3.48Å; T320-G446 PolarHBondContact OG1-O 2.9Å; T320-S447 WeakPolarHBondContact CA-O 3.28Å; T320-L549 HydrophobicContact CG2-CD1 4.41Å; T320-M553 HydrophobicContact CG2-CE 3.81Å
321	Q	91.3	Very high	92.3	Very high	61 Å²	61	11.2 Å²	11.2	29%	0.285	6%	0.061	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.5	-178.9	-58.2	-171.3	4.7	0	0	110.9	G319 S370 S447 Q448 Y449	G319-Q321 PolarHBondContact O-N 3.02Å; Q321-S370 PolarHBondContact NE2-OG 3.43Å; Q321-S370 PolarHBondContact OE1-OG 3.5Å; Q321-S370 VanDerWaalsContact OE1-OG 3.11Å; Q321-S447 PolarHBondContact N-O 3.25Å; Q321-Q448 WeakPolarHBondContact O-CA 3.49Å; Q321-Y449 PolarHBondContact O-N 3.03Å
322	L	93.4	Very high	92.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	99.4	170.6	-61.5	-169.3	0	0	0	109.3	F80 F312 I316 F324 I365 Y368 D369 Y449 L549	F80-L322 HydrophobicContact CE2-CD1 3.88Å; F80-L322 HydrophobicContact CZ-CD1 3.98Å; F312-L322 HydrophobicContact CZ-CD1 4.17Å; I316-L322 HydrophobicContact CD1-CD1 4.49Å; I316-L322 HydrophobicContact CD1-CD2 4.29Å; I316-L322 HydrophobicContact CD1-CG 4.07Å; L322-F324 PolarHBondContact O-N 3.48Å; L322-I365 HydrophobicContact CD1-CG1 4.39Å; L322-Y368 HydrophobicContact CD1-CG 4.19Å; L322-Y368 PolarHBondContact N-O 3.18Å; L322-D369 WeakPolarHBondContact O-CB 3.38Å; L322-Y449 CarbonylContact C-O 3.52Å; L322-Y449 WeakPolarHBondContact CA-O 3.39Å; L322-Y449 HydrophobicContact CD2-CD1 4.2Å; L322-Y449 HydrophobicContact CD2-CG 4.47Å; L322-L549 HydrophobicContact CD2-CD1 3.64Å
323	N	93.9	Very high	93	Very high	24 Å²	24	15.2 Å²	15.2	13%	0.128	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	105.5	178.7	-70.2	-4.1	0	0	0	109.8	Q448 Y449 F450 V451	N323-Q448 PolarHBondContact ND2-OE1 3.28Å; N323-Y449 PolarHBondContact N-O 3.28Å; N323-F450 HydrophobicContact CB-CD1 3.76Å; N323-F450 HydrophobicContact CB-CE1 3.99Å; N323-F450 HydrophobicContact CB-CG 4.2Å; N323-F450 WeakPolarHBondContact ND2-CE1 3.43Å; N323-F450 VanDerWaalsContact ND2-CZ 3.25Å; N323-F450 WeakPolarHBondContact ND2-CZ 3.39Å; N323-F450 WeakPolarHBondContact O-CA 3.36Å; N323-V451 PolarHBondContact O-N 3.22Å
324	F	95.6	Very high	93.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.2	-176.1	-176.7	-122.3	0	0	0	112.1	L322 V326 V361 I365 F374 P375 I407 V451 L453	L322-F324 PolarHBondContact O-N 3.48Å; F324-V326 HydrophobicContact CD1-CG2 4.04Å; F324-V326 HydrophobicContact CE1-CG2 3.43Å; F324-V326 VanDerWaalsContact CE1-CG2 3.43Å; F324-V326 HydrophobicContact CZ-CG2 3.81Å; F324-V361 HydrophobicContact CE2-CG1 4.19Å; F324-V361 HydrophobicContact CZ-CG1 4.09Å; F324-I365 HydrophobicContact CB-CD1 4.49Å; F324-I365 HydrophobicContact CB-CG2 4.03Å; F324-I365 HydrophobicContact CD1-CG2 3.6Å; F324-I365 HydrophobicContact CD2-CD1 3.72Å; F324-I365 HydrophobicContact CD2-CG1 4.38Å; F324-I365 HydrophobicContact CD2-CG2 3.67Å; F324-I365 HydrophobicContact CE1-CG2 3.82Å; F324-I365 HydrophobicContact CE2-CD1 4.23Å; F324-I365 HydrophobicContact CE2-CG2 3.87Å; F324-I365 HydrophobicContact CG-CD1 4.34Å; F324-I365 HydrophobicContact CG-CG2 3.49Å; F324-I365 VanDerWaalsContact CG-CG2 3.49Å; F324-I365 HydrophobicContact CZ-CG2 3.94Å; F324-F374 HydrophobicContact CB-CD1 3.72Å; F324-F374 HydrophobicContact CB-CE1 3.86Å; F324-F374 AromaticContact CD1-CD1 4Å; F324-F374 HydrophobicContact CD1-CD1 4Å; F324-F374 HydrophobicContact CD1-CE1 4.31Å; F324-F374 HydrophobicContact CD1-CG 4.32Å; F324-F374 HydrophobicContact CG-CD1 4.36Å; F324-F374 WeakPolarHBondContact O-CD1 3.21Å; F324-P375 WeakPolarHBondContact O-CD 3.49Å; F324-I407 HydrophobicContact CD1-CD1 4.18Å; F324-I407 HydrophobicContact CE1-CD1 3.97Å; F324-V451 HydrophobicContact CD2-CB 4.26Å; F324-V451 HydrophobicContact CD2-CG1 4.21Å; F324-V451 HydrophobicContact CE2-CG1 4.48Å; F324-L453 HydrophobicContact CE2-CB 3.59Å; F324-L453 HydrophobicContact CE2-CD2 4.34Å; F324-L453 HydrophobicContact CZ-CB 3.73Å; F324-L453 HydrophobicContact CZ-CD2 3.69Å; F324-L453 HydrophobicContact CZ-CG 4.36Å
325	T	96.8	Very high	93.5	Very high	6 Å²	6	15.5 Å²	15.5	4%	0.037	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.3	176.2	-62.7	0	0	0	0	110.3	P375 Y377 V436 V451 L452 L453	T325-P375 WeakPolarHBondContact CA-O 3.36Å; T325-P375 HydrophobicContact CG2-CB 4.12Å; T325-Y377 HydrophobicContact CG2-CD2 3.79Å; T325-Y377 HydrophobicContact CG2-CE2 3.78Å; T325-V436 HydrophobicContact CG2-CG2 3.8Å; T325-V451 PolarHBondContact N-O 2.76Å; T325-L452 HydrophobicContact CG2-CD1 3.87Å; T325-L452 CarbonylContact O-C 3.57Å; T325-L452 WeakPolarHBondContact O-CA 3.48Å; T325-L453 PolarHBondContact O-N 2.98Å
326	V	97.6	Very high	93.6	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.8	179.9	179.4	0	0	0	0	110.1	F324 I328 L358 P375 A376 Y377 V410 L453	F324-V326 HydrophobicContact CD1-CG2 4.04Å; F324-V326 HydrophobicContact CE1-CG2 3.43Å; F324-V326 VanDerWaalsContact CE1-CG2 3.43Å; F324-V326 HydrophobicContact CZ-CG2 3.81Å; V326-I328 HydrophobicContact CG1-CD1 4.2Å; V326-I328 HydrophobicContact CG1-CG1 3.9Å; V326-L358 HydrophobicContact CB-CD1 4.35Å; V326-L358 HydrophobicContact CG1-CD1 3.76Å; V326-L358 HydrophobicContact CG2-CD1 3.66Å; V326-P375 PolarHBondContact N-O 2.83Å; V326-A376 CarbonylContact O-C 3.57Å; V326-A376 WeakPolarHBondContact O-CA 3.45Å; V326-Y377 PolarHBondContact O-N 3.37Å; V326-V410 HydrophobicContact CB-CG1 4.21Å; V326-V410 HydrophobicContact CG1-CG1 4.18Å; V326-V410 HydrophobicContact CG2-CG1 4.29Å; V326-L453 CarbonylContact C-O 3.59Å
327	A	97.8	Very high	93.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.6	174.7	0	0	0	0	0	110.5	Y377 F379 V432 L452 L453 M454 I455	A327-Y377 CarbonylContact C-O 3.59Å; A327-Y377 VanDerWaalsContact CA-O 3.29Å; A327-Y377 WeakPolarHBondContact CA-O 3.02Å; A327-F379 HydrophobicContact CB-CD1 4.26Å; A327-F379 HydrophobicContact CB-CE1 4.15Å; A327-V432 HydrophobicContact CB-CG1 3.7Å; A327-L452 HydrophobicContact CB-CD1 3.89Å; A327-L453 PolarHBondContact N-O 3.27Å; A327-M454 HydrophobicContact CB-CG 4.11Å; A327-M454 CarbonylContact O-C 3.51Å; A327-M454 WeakPolarHBondContact O-CA 3.48Å; A327-I455 PolarHBondContact O-N 2.78Å
328	I	97.8	Very high	93.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.8	-175.3	-60.8	176	0	0	0	109.4	V326 F330 Y354 L358 Y377 G378 F379 L395 Y414	V326-I328 HydrophobicContact CG1-CD1 4.2Å; V326-I328 HydrophobicContact CG1-CG1 3.9Å; I328-F330 HydrophobicContact CB-CD2 4.27Å; I328-F330 HydrophobicContact CB-CE2 3.79Å; I328-F330 HydrophobicContact CG2-CD2 4Å; I328-F330 HydrophobicContact CG2-CE2 3.63Å; I328-F330 HydrophobicContact CG2-CZ 4.38Å; I328-F330 VanDerWaalsContact O-CD2 3.31Å; I328-F330 WeakPolarHBondContact O-CD2 3.29Å; I328-Y354 HydrophobicContact CG2-CD1 3.71Å; I328-Y354 HydrophobicContact CG2-CE1 4.02Å; I328-L358 HydrophobicContact CD1-CD2 4.4Å; I328-Y377 PolarHBondContact N-O 2.95Å; I328-G378 CarbonylContact O-C 3.36Å; I328-G378 VanDerWaalsContact O-CA 3.28Å; I328-G378 WeakPolarHBondContact O-CA 3.19Å; I328-F379 VanDerWaalsContact C-CE1 3.42Å; I328-F379 VanDerWaalsContact O-CD1 3.3Å; I328-F379 WeakPolarHBondContact O-CD1 3.14Å; I328-F379 PolarHBondContact O-N 3.45Å; I328-L395 HydrophobicContact CD1-CD1 3.93Å; I328-Y414 HydrophobicContact CD1-CD2 3.5Å; I328-Y414 VanDerWaalsContact CD1-CD2 3.5Å; I328-Y414 HydrophobicContact CD1-CE2 4.18Å; I328-Y414 HydrophobicContact CD1-CG 3.83Å; I328-Y414 HydrophobicContact CG2-CD2 3.95Å; I328-Y414 HydrophobicContact CG2-CE2 3.77Å
329	D	96.9	Very high	94.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.4	172	-167	-22	0	0	0	110.5	T331 H344 Y354 F379 T427 I455 T456	D329-T331 WeakPolarHBondContact OD1-CB 3.49Å; D329-T331 WeakPolarHBondContact OD1-CG2 3.44Å; D329-T331 PolarHBondContact OD1-N 2.89Å; D329-T331 PolarHBondContact OD1-OG1 3.3Å; D329-H344 PolarHBondContact O-CE1 3.1Å; D329-H344 PolarHBondContact O-NE2 3.35Å; D329-Y354 HydrophobicContact CB-CE1 4.15Å; D329-F379 HydrophobicContact CB-CE1 4.24Å; D329-F379 HydrophobicContact CB-CE2 3.66Å; D329-F379 HydrophobicContact CB-CZ 3.5Å; D329-T427 WeakPolarHBondContact OD2-CG2 3.19Å; D329-I455 WeakPolarHBondContact CB-O 3.4Å; D329-I455 PolarHBondContact N-O 2.94Å; D329-T456 WeakPolarHBondContact OD2-CB 3.41Å; D329-T456 PolarHBondContact OD2-OG1 2.79Å
330	F	96.9	Very high	94.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.199	C	C	.	.			trans	-117.2	30.4	174.5	-78.3	-104.2	0	0	0	111	I328 F379 A381 F393 L395 Y414 T417 L418 V421 L423 Y424	I328-F330 HydrophobicContact CB-CD2 4.27Å; I328-F330 HydrophobicContact CB-CE2 3.79Å; I328-F330 HydrophobicContact CG2-CD2 4Å; I328-F330 HydrophobicContact CG2-CE2 3.63Å; I328-F330 HydrophobicContact CG2-CZ 4.38Å; I328-F330 VanDerWaalsContact O-CD2 3.31Å; I328-F330 WeakPolarHBondContact O-CD2 3.29Å; F330-F379 PolarHBondContact N-O 3.32Å; F330-A381 HydrophobicContact CB-CB 3.81Å; F330-F393 HydrophobicContact CB-CZ 4.46Å; F330-F393 HydrophobicContact CD2-CZ 4.12Å; F330-F393 HydrophobicContact CG-CZ 4.22Å; F330-L395 HydrophobicContact CE2-CD2 3.62Å; F330-L395 HydrophobicContact CZ-CD2 3.87Å; F330-Y414 HydrophobicContact CE2-CD2 4.32Å; F330-Y414 AromaticContact CZ-CD2 3.77Å; F330-Y414 HydrophobicContact CZ-CD2 3.77Å; F330-Y414 HydrophobicContact CZ-CE2 4.16Å; F330-T417 HydrophobicContact CD1-CG2 4.35Å; F330-T417 HydrophobicContact CE1-CG2 3.55Å; F330-T417 HydrophobicContact CE2-CG2 4.33Å; F330-T417 HydrophobicContact CZ-CG2 3.56Å; F330-L418 HydrophobicContact CD1-CD2 3.6Å; F330-L418 HydrophobicContact CD1-CG 4.26Å; F330-L418 HydrophobicContact CE1-CB 4.19Å; F330-L418 HydrophobicContact CE1-CD2 3.36Å; F330-L418 HydrophobicContact CE1-CG 3.5Å; F330-L418 VanDerWaalsContact CE1-CG 3.5Å; F330-L418 HydrophobicContact CZ-CD2 4.31Å; F330-L418 HydrophobicContact CZ-CG 4.17Å; F330-V421 HydrophobicContact CD1-CG2 3.62Å; F330-V421 HydrophobicContact CE1-CG2 4.06Å; F330-V421 HydrophobicContact CG-CG2 4.43Å; F330-L423 HydrophobicContact CB-CD2 3.79Å; F330-L423 HydrophobicContact CD1-CD2 3.73Å; F330-L423 HydrophobicContact CG-CD2 4.21Å; F330-L423 WeakPolarHBondContact O-CA 3.48Å; F330-L423 WeakPolarHBondContact O-CB 3.38Å; F330-L423 WeakPolarHBondContact O-CD2 3.37Å; F330-Y424 PolarHBondContact O-N 2.95Å
331	T	95.8	Very high	94.1	Very high	2 Å²	2	37 Å²	37	1%	0.012	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-77.3	156.3	179.4	58.4	0	0	0	0	113.2	D329 S333 N334 Y424 T427	D329-T331 WeakPolarHBondContact OD1-CB 3.49Å; D329-T331 WeakPolarHBondContact OD1-CG2 3.44Å; D329-T331 PolarHBondContact OD1-N 2.89Å; D329-T331 PolarHBondContact OD1-OG1 3.3Å; T331-S333 PolarHBondContact O-N 3.46Å; T331-S333 PolarHBondContact OG1-OG 3.11Å; T331-N334 WeakPolarHBondContact O-CB 3.3Å; T331-N334 PolarHBondContact O-N 3.17Å; T331-N334 PolarHBondContact O-ND2 3.2Å; T331-Y424 CarbonylContact C-O 3.59Å; T331-Y424 WeakPolarHBondContact CA-O 3.35Å; T331-Y424 WeakPolarHBondContact CB-O 3.38Å; T331-Y424 WeakPolarHBondContact CG2-O 3.42Å; T331-T427 HydrophobicContact CG2-CG2 4.38Å; T331-T427 WeakPolarHBondContact CG2-OG1 3.36Å
332	A	94.4	Very high	94.3	Very high	56 Å²	56	34.5 Å²	34.5	46%	0.463	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-68.4	-16.7	-174.3	0	0	0	0	0	113.8	N334 G335 L423 Y424	A332-N334 PolarHBondContact O-N 2.83Å; A332-G335 PolarHBondContact O-N 3.09Å; A332-G335 VanDerWaalsContact O-N 3.08Å; A332-L423 HydrophobicContact CB-CB 4.48Å; A332-Y424 PolarHBondContact N-O 2.76Å
333	S	93.4	Very high	94.3	Very high	75 Å²	75	36.5 Å²	36.5	52%	0.524	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-58.9	-27.5	172.8	44.3	0	0	0	0	112.3	T331 G335 D457	T331-S333 PolarHBondContact O-N 3.46Å; T331-S333 PolarHBondContact OG1-OG 3.11Å; S333-G335 PolarHBondContact O-N 3.05Å; S333-G335 VanDerWaalsContact O-N 3.15Å; S333-D457 WeakPolarHBondContact CB-OD2 3.21Å; S333-D457 VanDerWaalsContact OG-CG 3.28Å; S333-D457 PolarHBondContact OG-OD1 3.34Å; S333-D457 PolarHBondContact OG-OD2 3.18Å
334	N	94.3	Very high	94.4	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-67.1	-11.3	175	-72.7	-75.3	0	0	0	115.1	T331 A332 S342 L343 H344 Y354 D457	T331-N334 WeakPolarHBondContact O-CB 3.3Å; T331-N334 PolarHBondContact O-N 3.17Å; T331-N334 PolarHBondContact O-ND2 3.2Å; A332-N334 PolarHBondContact O-N 2.83Å; N334-S342 CarbonylContact O-C 3.01Å; N334-S342 WeakPolarHBondContact O-CA 3.12Å; N334-S342 WeakPolarHBondContact O-CB 3.38Å; N334-S342 PolarHBondContact O-OG 3.35Å; N334-L343 HydrophobicContact CB-CB 4.42Å; N334-L343 PolarHBondContact O-N 3.34Å; N334-L343 WeakPolarHBondContact OD1-CB 3.45Å; N334-L343 WeakPolarHBondContact OD1-CD1 3.27Å; N334-H344 VanDerWaalsContact CB-CD2 3.4Å; N334-H344 WeakPolarHBondContact CB-CD2 3.47Å; N334-Y354 PolarHBondContact ND2-OH 2.86Å; N334-Y354 VanDerWaalsContact OD1-CE2 3.27Å; N334-Y354 WeakPolarHBondContact OD1-CE2 3.44Å; N334-Y354 PolarHBondContact OD1-OH 3.13Å; N334-D457 PolarHBondContact N-OD2 2.7Å; N334-D457 VanDerWaalsContact ND2-CG 3.34Å; N334-D457 PolarHBondContact ND2-OD1 3.17Å; N334-D457 VanDerWaalsContact ND2-OD1 3.15Å; N334-D457 WeakPolarHBondContact OD1-CB 3.36Å
335	G	92.9	Very high	94.4	Very high	29 Å²	29	38.9 Å²	38.9	30%	0.299	24%	0.24	S	C	.	.			trans	73.4	174.1	-177.1	0	0	0	0	0	113.8	A332 S333 P337 S342 L423	A332-G335 PolarHBondContact O-N 3.09Å; A332-G335 VanDerWaalsContact O-N 3.08Å; S333-G335 PolarHBondContact O-N 3.05Å; S333-G335 VanDerWaalsContact O-N 3.15Å; G335-P337 WeakPolarHBondContact O-CD 3.37Å; G335-S342 PolarHBondContact O-OG 2.87Å; G335-S342 VanDerWaalsContact O-OG 3.12Å; G335-L423 WeakPolarHBondContact O-CD1 3.28Å
336	N	91.8	Very high	93.9	Very high	82 Å²	82	40.9 Å²	40.9	44%	0.439	25%	0.249	S	C	.	.			trans	-71.7	123.4	-175.6	-176.1	-38.7	0	0	0	111.4	S338 Q339 S342	N336-S338 PolarHBondContact O-N 3.05Å; N336-S338 WeakPolarHBondContact OD1-CB 3.44Å; N336-S338 PolarHBondContact OD1-N 3.37Å; N336-S338 PolarHBondContact OD1-OG 3.46Å; N336-Q339 HydrophobicContact CB-CG 4.14Å; N336-Q339 WeakPolarHBondContact O-CB 3.39Å; N336-Q339 PolarHBondContact O-N 3.33Å; N336-S342 WeakPolarHBondContact O-CB 3.47Å
337	P	92.9	Very high	93.4	Very high	19 Å²	19	42.6 Å²	42.6	12%	0.123	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-18	-177.2	-25.8	34.7	0	0	0	115.5	G335 Q339 H344 Y345 M346 L418 L423	G335-P337 WeakPolarHBondContact O-CD 3.37Å; P337-Q339 VanDerWaalsContact C-N 3.32Å; P337-H344 HydrophobicContact CB-CB 4.17Å; P337-H344 HydrophobicContact CG-CB 4.1Å; P337-Y345 WeakPolarHBondContact O-CA 3.34Å; P337-M346 PolarHBondContact O-N 2.78Å; P337-L418 HydrophobicContact CG-CD2 4.06Å; P337-L423 HydrophobicContact CG-CD1 3.92Å; P337-L423 HydrophobicContact CG-CG 4.47Å
338	S	89.6	Confident	92.7	Very high	100 Å²	100	47.6 Å²	47.6	70%	0.699	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.1	175.2	-54.3	0	0	0	0	113.4	N336	N336-S338 PolarHBondContact O-N 3.05Å; N336-S338 WeakPolarHBondContact OD1-CB 3.44Å; N336-S338 PolarHBondContact OD1-N 3.37Å; N336-S338 PolarHBondContact OD1-OG 3.46Å
339	Q	92.4	Very high	91.9	Very high	101 Å²	101	57.6 Å²	57.6	47%	0.472	33%	0.333	S	S	.	.	S	Bend	trans	-97.6	135.7	-177.5	-66.6	-174.3	-9	0	0	111.1	N336 P337 T341 S342 Y345	N336-Q339 HydrophobicContact CB-CG 4.14Å; N336-Q339 WeakPolarHBondContact O-CB 3.39Å; N336-Q339 PolarHBondContact O-N 3.33Å; P337-Q339 VanDerWaalsContact C-N 3.32Å; Q339-T341 PolarHBondContact O-N 2.94Å; Q339-S342 WeakPolarHBondContact O-CB 3.29Å; Q339-S342 PolarHBondContact O-N 3.39Å; Q339-Y345 WeakPolarHBondContact O-CD2 3.3Å
340	P	90.4	Very high	91.3	Very high	98 Å²	98	63.7 Å²	63.7	64%	0.636	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.5	177.9	-26.3	34.8	0	0	0	115.3	S342 Y345	P340-S342 VanDerWaalsContact C-N 3.32Å; P340-Y345 HydrophobicContact CB-CD1 4.42Å; P340-Y345 HydrophobicContact CB-CE1 4.21Å; P340-Y345 HydrophobicContact CB-CE2 4.42Å; P340-Y345 HydrophobicContact CG-CE1 4.43Å; P340-Y345 HydrophobicContact CG-CE2 4.05Å
341	T	91.3	Very high	90.8	Very high	121 Å²	121	66.8 Å²	66.8	74%	0.742	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-9.5	177.5	50.8	0	0	0	0	113.4	Q339	Q339-T341 PolarHBondContact O-N 2.94Å
342	S	94.4	Very high	90.7	Very high	9 Å²	9	67.3 Å²	67.3	6%	0.063	38%	0.379	C	S	.	.	S	Bend	trans	-76.3	141.9	178.9	175	0	0	0	0	111.6	N334 G335 N336 Q339 P340 H344 Y345	N334-S342 CarbonylContact O-C 3.01Å; N334-S342 WeakPolarHBondContact O-CA 3.12Å; N334-S342 WeakPolarHBondContact O-CB 3.38Å; N334-S342 PolarHBondContact O-OG 3.35Å; G335-S342 PolarHBondContact O-OG 2.87Å; G335-S342 VanDerWaalsContact O-OG 3.12Å; N336-S342 WeakPolarHBondContact O-CB 3.47Å; Q339-S342 WeakPolarHBondContact O-CB 3.29Å; Q339-S342 PolarHBondContact O-N 3.39Å; P340-S342 VanDerWaalsContact C-N 3.32Å; S342-H344 PolarHBondContact O-N 2.91Å; S342-H344 PolarHBondContact OG-N 2.84Å; S342-Y345 VanDerWaalsContact O-CB 3.24Å; S342-Y345 WeakPolarHBondContact O-CB 3.39Å; S342-Y345 PolarHBondContact O-N 3.05Å; S342-Y345 VanDerWaalsContact O-N 3.08Å
343	L	94.1	Very high	90.5	Very high	42 Å²	42	65.4 Å²	65.4	22%	0.22	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.2	171.6	-61	176.7	0	0	0	112.1	N334 N352 Y354 D457 V485	N334-L343 HydrophobicContact CB-CB 4.42Å; N334-L343 PolarHBondContact O-N 3.34Å; N334-L343 WeakPolarHBondContact OD1-CB 3.45Å; N334-L343 WeakPolarHBondContact OD1-CD1 3.27Å; L343-N352 WeakPolarHBondContact O-CB 3.49Å; L343-Y354 HydrophobicContact CB-CD2 4.46Å; L343-Y354 HydrophobicContact CB-CE2 3.9Å; L343-D457 HydrophobicContact CD1-CB 3.46Å; L343-D457 VanDerWaalsContact CD1-CB 3.46Å; L343-V485 HydrophobicContact CD1-CG2 4.46Å
344	H	95.8	Very high	90.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	12	171.7	-70	-53.6	0	0	0	113.9	D329 N334 P337 S342 M346 N352 Y354 Y414 L418	D329-H344 PolarHBondContact O-CE1 3.1Å; D329-H344 PolarHBondContact O-NE2 3.35Å; N334-H344 VanDerWaalsContact CB-CD2 3.4Å; N334-H344 WeakPolarHBondContact CB-CD2 3.47Å; P337-H344 HydrophobicContact CB-CB 4.17Å; P337-H344 HydrophobicContact CG-CB 4.1Å; S342-H344 PolarHBondContact O-N 2.91Å; S342-H344 PolarHBondContact OG-N 2.84Å; H344-M346 PolarHBondContact O-N 3.31Å; H344-M346 VanDerWaalsContact O-N 3.16Å; H344-N352 PolarHBondContact O-ND2 3.36Å; H344-Y354 AromaticContact CE1-CD1 3.93Å; H344-Y354 AromaticContact CE1-CD2 3.55Å; H344-Y354 AromaticContact CE1-CE1 3.79Å; H344-Y354 AromaticContact CE1-CE2 3.41Å; H344-Y354 VanDerWaalsContact CE1-CE2 3.41Å; H344-Y354 WeakPolarHBondContact CE1-CE2 3.45Å; H344-Y354 AromaticContact CE1-CG 3.82Å; H344-Y354 AromaticContact CE1-CZ 3.56Å; H344-Y354 AromaticContact ND1-CD2 3.46Å; H344-Y354 WeakPolarHBondContact ND1-CD2 3.5Å; H344-Y354 AromaticContact ND1-CE2 3.69Å; H344-Y354 AromaticContact ND1-CG 3.89Å; H344-Y414 AromaticContact ND1-CE2 3.76Å; H344-Y414 AromaticContact ND1-CZ 3.73Å; H344-Y414 PolarHBondContact ND1-OH 3.12Å; H344-L418 HydrophobicContact CB-CD1 3.99Å; H344-L418 HydrophobicContact CB-CD2 3.84Å
345	Y	94.4	Very high	90.6	Very high	74 Å²	74	61.7 Å²	61.7	29%	0.29	34%	0.338	S	S	.	.			trans	-52.7	125.2	-174.8	179.2	-124.5	0	0	0	112.3	P337 Q339 P340 S342 S347 N352	P337-Y345 WeakPolarHBondContact O-CA 3.34Å; Q339-Y345 WeakPolarHBondContact O-CD2 3.3Å; P340-Y345 HydrophobicContact CB-CD1 4.42Å; P340-Y345 HydrophobicContact CB-CE1 4.21Å; P340-Y345 HydrophobicContact CB-CE2 4.42Å; P340-Y345 HydrophobicContact CG-CE1 4.43Å; P340-Y345 HydrophobicContact CG-CE2 4.05Å; S342-Y345 VanDerWaalsContact O-CB 3.24Å; S342-Y345 WeakPolarHBondContact O-CB 3.39Å; S342-Y345 PolarHBondContact O-N 3.05Å; S342-Y345 VanDerWaalsContact O-N 3.08Å; Y345-S347 VanDerWaalsContact C-N 3.35Å; Y345-S347 PolarHBondContact O-N 2.79Å; Y345-S347 VanDerWaalsContact O-N 3.14Å; Y345-N352 PolarHBondContact O-ND2 3.15Å
346	M	88.1	Confident	90.5	Very high	48 Å²	48	61.6 Å²	61.6	24%	0.236	33%	0.33	C	S	.	.			trans	-86.9	73.9	178	-65.3	-172.5	-169.6	0	0	110.8	P337 H344 F415 L418 R419	P337-M346 PolarHBondContact O-N 2.78Å; H344-M346 PolarHBondContact O-N 3.31Å; H344-M346 VanDerWaalsContact O-N 3.16Å; M346-F415 HydrophobicContact CE-CD1 4.39Å; M346-F415 WeakPolarHBondContact CE-O 3.43Å; M346-F415 HydrophobicContact CG-CD1 4.2Å; M346-F415 HydrophobicContact SD-CD1 4.47Å; M346-L418 HydrophobicContact CE-CB 3.1Å; M346-L418 HydrophobicContact CE-CD1 3.63Å; M346-L418 HydrophobicContact CE-CG 4.01Å; M346-R419 HydrophobicContact CE-CG 3.89Å; M346-R419 HydrophobicContact SD-CG 4.2Å
347	S	85.9	Confident	90.6	Very high	36 Å²	36	57.7 Å²	57.7	25%	0.252	31%	0.309	S	S	.	.			trans	-68	136.9	173.5	174.6	0	0	0	0	110.7	Y345 Y349 Q350	Y345-S347 VanDerWaalsContact C-N 3.35Å; Y345-S347 PolarHBondContact O-N 2.79Å; Y345-S347 VanDerWaalsContact O-N 3.14Å; S347-Y349 PolarHBondContact O-N 3Å; S347-Y349 PolarHBondContact OG-N 3.15Å; S347-Q350 WeakPolarHBondContact CB-O 3.31Å; S347-Q350 PolarHBondContact OG-N 3.02Å
348	P	83.1	Confident	90.7	Very high	105 Å²	105	56.8 Å²	56.8	68%	0.682	30%	0.303	S	S	*	.	S	Bend	trans	-72.8	-10	173.9	28.9	-33.1	0	0	0	113.2
349	Y	81.9	Confident	90.8	Very high	210 Å²	210	53.8 Å²	53.8	82%	0.824	28%	0.277	S	S	*	.	S	Bend	trans	-117.3	-22.1	-173.2	-57.6	-66	0	0	0	114.3	S347	S347-Y349 PolarHBondContact O-N 3Å; S347-Y349 PolarHBondContact OG-N 3.15Å
350	Q	83.5	Confident	90.7	Very high	128 Å²	128	49.3 Å²	49.3	60%	0.598	26%	0.258	S	S	*	.	S	Bend	trans	-139.9	144.7	-173.8	-67.8	-176.8	6.3	0	0	111.1	S347	S347-Q350 WeakPolarHBondContact CB-O 3.31Å; S347-Q350 PolarHBondContact OG-N 3.02Å
351	M	87.3	Confident	90.8	Very high	64 Å²	64	44.7 Å²	44.7	32%	0.315	23%	0.228	S	C	.	.			trans	-72.7	142.8	171	-70.7	-179.5	178.2	0	0	110.1	A355 M356 K359	M351-A355 HydrophobicContact CB-CB 3.96Å; M351-A355 HydrophobicContact CG-CB 4.26Å; M351-M356 HydrophobicContact CB-CG 3.74Å; M351-K359 HydrophobicContact CE-CD 4.01Å; M351-K359 HydrophobicContact SD-CD 3.87Å
352	N	92.3	Very high	90.8	Very high	13 Å²	13	38.9 Å²	38.9	7%	0.07	19%	0.192	C	C	.	.			trans	-76.2	170.5	170.6	61.6	40.7	0	0	0	111.5	L343 H344 Y345 Y354 A355 M356 Y414	L343-N352 WeakPolarHBondContact O-CB 3.49Å; H344-N352 PolarHBondContact O-ND2 3.36Å; Y345-N352 PolarHBondContact O-ND2 3.15Å; N352-Y354 VanDerWaalsContact C-N 3.29Å; N352-Y354 PolarHBondContact O-N 2.86Å; N352-Y354 WeakPolarHBondContact OD1-CB 3.29Å; N352-Y354 PolarHBondContact OD1-N 2.82Å; N352-A355 PolarHBondContact O-N 2.82Å; N352-A355 VanDerWaalsContact O-N 3.14Å; N352-A355 WeakPolarHBondContact OD1-CB 3.38Å; N352-A355 PolarHBondContact OD1-N 2.68Å; N352-M356 WeakPolarHBondContact O-CG 2.95Å; N352-M356 PolarHBondContact O-N 3.49Å; N352-Y414 PolarHBondContact ND2-OH 3.34Å; N352-Y414 PolarHBondContact OD1-OH 3.25Å; N352-Y414 VanDerWaalsContact OD1-OH 3.11Å
353	A	91.5	Very high	90.6	Very high	16 Å²	16	40.4 Å²	40.4	13%	0.132	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-41.5	-175.1	0	0	0	0	0	112.6	M356 A357 V485 F520	A353-M356 PolarHBondContact O-N 2.85Å; A353-A357 WeakPolarHBondContact O-CB 3.48Å; A353-A357 PolarHBondContact O-N 2.88Å; A353-V485 HydrophobicContact CB-CB 4.02Å; A353-V485 HydrophobicContact CB-CG1 3.88Å; A353-F520 HydrophobicContact CB-CD1 3.97Å; A353-F520 HydrophobicContact CB-CE1 3.89Å
354	Y	95.2	Very high	90.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-50.3	174.7	-74.4	-91.1	0	0	0	112.6	I328 D329 N334 L343 H344 N352 M356 A357 L358 Y414 I455 D457 V485	I328-Y354 HydrophobicContact CG2-CD1 3.71Å; I328-Y354 HydrophobicContact CG2-CE1 4.02Å; D329-Y354 HydrophobicContact CB-CE1 4.15Å; N334-Y354 PolarHBondContact ND2-OH 2.86Å; N334-Y354 VanDerWaalsContact OD1-CE2 3.27Å; N334-Y354 WeakPolarHBondContact OD1-CE2 3.44Å; N334-Y354 PolarHBondContact OD1-OH 3.13Å; L343-Y354 HydrophobicContact CB-CD2 4.46Å; L343-Y354 HydrophobicContact CB-CE2 3.9Å; H344-Y354 AromaticContact CE1-CD1 3.93Å; H344-Y354 AromaticContact CE1-CD2 3.55Å; H344-Y354 AromaticContact CE1-CE1 3.79Å; H344-Y354 AromaticContact CE1-CE2 3.41Å; H344-Y354 VanDerWaalsContact CE1-CE2 3.41Å; H344-Y354 WeakPolarHBondContact CE1-CE2 3.45Å; H344-Y354 AromaticContact CE1-CG 3.82Å; H344-Y354 AromaticContact CE1-CZ 3.56Å; H344-Y354 AromaticContact ND1-CD2 3.46Å; H344-Y354 WeakPolarHBondContact ND1-CD2 3.5Å; H344-Y354 AromaticContact ND1-CE2 3.69Å; H344-Y354 AromaticContact ND1-CG 3.89Å; N352-Y354 VanDerWaalsContact C-N 3.29Å; N352-Y354 PolarHBondContact O-N 2.86Å; N352-Y354 WeakPolarHBondContact OD1-CB 3.29Å; N352-Y354 PolarHBondContact OD1-N 2.82Å; Y354-M356 VanDerWaalsContact C-N 3.34Å; Y354-M356 PolarHBondContact O-N 3.5Å; Y354-A357 PolarHBondContact O-N 3.48Å; Y354-L358 VanDerWaalsContact O-CB 3.28Å; Y354-L358 WeakPolarHBondContact O-CB 3.39Å; Y354-L358 PolarHBondContact O-N 3.09Å; Y354-Y414 VanDerWaalsContact CB-OH 3.3Å; Y354-Y414 WeakPolarHBondContact CB-OH 3.29Å; Y354-I455 HydrophobicContact CD1-CB 3.77Å; Y354-I455 HydrophobicContact CD1-CG2 3.34Å; Y354-I455 HydrophobicContact CE1-CB 4Å; Y354-I455 HydrophobicContact CE1-CG2 3.62Å; Y354-I455 WeakPolarHBondContact CE1-O 3.35Å; Y354-I455 HydrophobicContact CG-CG2 4.12Å; Y354-D457 PolarHBondContact OH-N 3.44Å; Y354-V485 HydrophobicContact CD2-CG2 4.04Å; Y354-V485 HydrophobicContact CE1-CG2 4.09Å; Y354-V485 HydrophobicContact CE2-CG2 3.44Å; Y354-V485 VanDerWaalsContact CE2-CG2 3.44Å; Y354-V485 VanDerWaalsContact CZ-CG2 3.45Å
355	A	94.1	Very high	90.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-36.7	179.5	0	0	0	0	0	112.2	M351 N352 K359 L411 Y414 F415	M351-A355 HydrophobicContact CB-CB 3.96Å; M351-A355 HydrophobicContact CG-CB 4.26Å; N352-A355 PolarHBondContact O-N 2.82Å; N352-A355 VanDerWaalsContact O-N 3.14Å; N352-A355 WeakPolarHBondContact OD1-CB 3.38Å; N352-A355 PolarHBondContact OD1-N 2.68Å; A355-K359 WeakPolarHBondContact O-CB 3.46Å; A355-K359 PolarHBondContact O-N 2.75Å; A355-L411 HydrophobicContact CB-CD2 3.8Å; A355-Y414 HydrophobicContact CB-CE1 4.3Å; A355-F415 HydrophobicContact CB-CE2 4.49Å; A355-F415 HydrophobicContact CB-CZ 3.92Å
356	M	91.6	Very high	90.1	Very high	27 Å²	27	36.2 Å²	36.2	13%	0.133	18%	0.181	C	C	.	.	H	α-helix	trans	-65.9	-46.8	175.2	-71.9	-171.4	-70.8	0	0	112	M351 N352 A353 Y354 K359 A360 F520	M351-M356 HydrophobicContact CB-CG 3.74Å; N352-M356 WeakPolarHBondContact O-CG 2.95Å; N352-M356 PolarHBondContact O-N 3.49Å; A353-M356 PolarHBondContact O-N 2.85Å; Y354-M356 VanDerWaalsContact C-N 3.34Å; Y354-M356 PolarHBondContact O-N 3.5Å; M356-K359 PolarHBondContact O-N 2.79Å; M356-A360 VanDerWaalsContact O-CB 3.27Å; M356-A360 WeakPolarHBondContact O-CB 3.31Å; M356-A360 PolarHBondContact O-N 3.46Å; M356-F520 HydrophobicContact CB-CE2 4.14Å; M356-F520 HydrophobicContact CB-CZ 3.7Å; M356-F520 HydrophobicContact CE-CE1 3.9Å; M356-F520 HydrophobicContact CE-CZ 3.85Å; M356-F520 HydrophobicContact SD-CZ 4.37Å
357	A	92.7	Very high	90.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-47.9	177.4	0	0	0	0	0	111.7	A353 Y354 K359 A360 V361 I455 V483 F520 L537	A353-A357 WeakPolarHBondContact O-CB 3.48Å; A353-A357 PolarHBondContact O-N 2.88Å; Y354-A357 PolarHBondContact O-N 3.48Å; A357-K359 VanDerWaalsContact C-N 3.32Å; A357-K359 PolarHBondContact O-N 2.92Å; A357-A360 PolarHBondContact O-N 3.3Å; A357-V361 WeakPolarHBondContact O-CG2 3.48Å; A357-V361 PolarHBondContact O-N 2.73Å; A357-V361 VanDerWaalsContact O-N 3.12Å; A357-I455 HydrophobicContact CB-CD1 4.09Å; A357-I455 HydrophobicContact CB-CG2 4.49Å; A357-V483 HydrophobicContact CB-CG1 3.88Å; A357-F520 HydrophobicContact CB-CD2 3.96Å; A357-F520 HydrophobicContact CB-CE2 4.08Å; A357-L537 HydrophobicContact CB-CD2 4.16Å
358	L	94.4	Very high	90.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56	-47.4	175.6	172.6	57.3	0	0	0	111.4	V326 I328 Y354 G362 I407 V410 L411 L453 I455	V326-L358 HydrophobicContact CB-CD1 4.35Å; V326-L358 HydrophobicContact CG1-CD1 3.76Å; V326-L358 HydrophobicContact CG2-CD1 3.66Å; I328-L358 HydrophobicContact CD1-CD2 4.4Å; Y354-L358 VanDerWaalsContact O-CB 3.28Å; Y354-L358 WeakPolarHBondContact O-CB 3.39Å; Y354-L358 PolarHBondContact O-N 3.09Å; L358-G362 WeakPolarHBondContact O-CA 3.42Å; L358-G362 PolarHBondContact O-N 2.85Å; L358-I407 HydrophobicContact CG-CG2 4.45Å; L358-V410 HydrophobicContact CD1-CG1 4.14Å; L358-V410 HydrophobicContact CD2-CB 4.29Å; L358-V410 HydrophobicContact CD2-CG1 3.65Å; L358-L411 HydrophobicContact CD2-CD2 3.66Å; L358-L411 HydrophobicContact CD2-CG 3.92Å; L358-L411 HydrophobicContact CG-CD2 4.25Å; L358-L411 HydrophobicContact CG-CG 4.49Å; L358-L453 HydrophobicContact CD1-CD2 4.35Å; L358-I455 HydrophobicContact CB-CD1 3.96Å
359	K	92.1	Very high	90.5	Very high	37 Å²	37	29.1 Å²	29.1	16%	0.161	13%	0.134	C	C	.	.	H	α-helix	trans	-66.3	-42.8	-179.5	-172.6	170.5	-178.4	171.7	0	112.2	M351 A355 M356 A357 E363	M351-K359 HydrophobicContact CE-CD 4.01Å; M351-K359 HydrophobicContact SD-CD 3.87Å; A355-K359 WeakPolarHBondContact O-CB 3.46Å; A355-K359 PolarHBondContact O-N 2.75Å; M356-K359 PolarHBondContact O-N 2.79Å; A357-K359 VanDerWaalsContact C-N 3.32Å; A357-K359 PolarHBondContact O-N 2.92Å; K359-E363 WeakPolarHBondContact CE-OE1 3.44Å; K359-E363 HydrophobicContact CG-CG 4.04Å; K359-E363 IonicContact NZ-OE1 3.25Å; K359-E363 WeakPolarHBondContact O-CB 3.31Å; K359-E363 VanDerWaalsContact O-CG 3.3Å; K359-E363 WeakPolarHBondContact O-CG 3.39Å; K359-E363 PolarHBondContact O-N 3.4Å
360	A	90.5	Very high	90.5	Very high	8 Å²	8	22.7 Å²	22.7	7%	0.066	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-48.1	-179.1	0	0	0	0	0	112.3	M356 A357 M534 L537 A538	M356-A360 VanDerWaalsContact O-CB 3.27Å; M356-A360 WeakPolarHBondContact O-CB 3.31Å; M356-A360 PolarHBondContact O-N 3.46Å; A357-A360 PolarHBondContact O-N 3.3Å; A360-M534 HydrophobicContact CB-CB 3.79Å; A360-M534 HydrophobicContact CB-CG 4.05Å; A360-L537 HydrophobicContact CB-CD2 3.97Å; A360-A538 HydrophobicContact CB-CB 4.44Å; A360-A538 WeakPolarHBondContact O-CB 3.42Å
361	V	92.1	Very high	90.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-76.9	-47.9	-179.2	-179.6	0	0	0	0	110.7	F324 A357 E363 I364 I365 L453 V541 L542	F324-V361 HydrophobicContact CE2-CG1 4.19Å; F324-V361 HydrophobicContact CZ-CG1 4.09Å; A357-V361 WeakPolarHBondContact O-CG2 3.48Å; A357-V361 PolarHBondContact O-N 2.73Å; A357-V361 VanDerWaalsContact O-N 3.12Å; V361-E363 VanDerWaalsContact C-N 3.31Å; V361-E363 PolarHBondContact O-N 3.35Å; V361-I364 PolarHBondContact O-N 2.9Å; V361-I365 PolarHBondContact O-N 3.26Å; V361-L453 HydrophobicContact CB-CD2 4.06Å; V361-L453 HydrophobicContact CG1-CD2 4.17Å; V361-L453 HydrophobicContact CG2-CD2 4.44Å; V361-V541 HydrophobicContact CG1-CG1 4.14Å; V361-V541 HydrophobicContact CG2-CB 4.25Å; V361-V541 HydrophobicContact CG2-CG1 3.62Å; V361-V541 HydrophobicContact CG2-CG2 4.48Å; V361-L542 HydrophobicContact CG1-CD2 4Å; V361-L542 HydrophobicContact CG1-CG 4.42Å
362	G	92.5	Very high	90.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60	-38.9	-176.6	0	0	0	0	0	113	L358 I364 Q366 I407	L358-G362 WeakPolarHBondContact O-CA 3.42Å; L358-G362 PolarHBondContact O-N 2.85Å; G362-I364 PolarHBondContact O-N 3.47Å; G362-Q366 WeakPolarHBondContact O-CB 3.17Å; G362-Q366 VanDerWaalsContact O-CG 3.3Å; G362-Q366 WeakPolarHBondContact O-CG 3.48Å; G362-Q366 PolarHBondContact O-N 3.3Å; G362-Q366 VanDerWaalsContact O-N 3.16Å; G362-I407 VanDerWaalsContact C-CG1 3.48Å; G362-I407 VanDerWaalsContact CA-CD1 3.41Å; G362-I407 WeakPolarHBondContact O-CG1 3.27Å
363	E	90.2	Very high	90.9	Very high	40 Å²	40	23.2 Å²	23.2	19%	0.187	13%	0.125	C	C	.	.	H	α-helix	trans	-64.4	-23.2	-176.5	-86.6	-164.5	-173.1	0	0	114.1	K83 K359 V361 Q366	K83-E363 HydrophobicContact CD-CB 4.39Å; K83-E363 IonicContact NZ-OE2 2.72Å; K83-E363 PolarHBondContact NZ-OE2 2.89Å; K359-E363 WeakPolarHBondContact CE-OE1 3.44Å; K359-E363 HydrophobicContact CG-CG 4.04Å; K359-E363 IonicContact NZ-OE1 3.25Å; K359-E363 WeakPolarHBondContact O-CB 3.31Å; K359-E363 VanDerWaalsContact O-CG 3.3Å; K359-E363 WeakPolarHBondContact O-CG 3.39Å; K359-E363 PolarHBondContact O-N 3.4Å; V361-E363 VanDerWaalsContact C-N 3.31Å; V361-E363 PolarHBondContact O-N 3.35Å; E363-Q366 PolarHBondContact O-NE2 3.39Å
364	I	90.8	Very high	91.1	Very high	10 Å²	10	22.5 Å²	22.5	5%	0.051	12%	0.119	C	C	.	.	H	α-helix	trans	-92.4	-52.9	-179.8	-57	-172.6	0	0	0	109.8	F80 E81 K83 V361 G362 Q366 D367 A538 L542	F80-I364 WeakPolarHBondContact O-CG2 3.48Å; E81-I364 WeakPolarHBondContact O-CD1 3.45Å; K83-I364 HydrophobicContact CB-CD1 4.49Å; K83-I364 HydrophobicContact CB-CG1 4.14Å; V361-I364 PolarHBondContact O-N 2.9Å; G362-I364 PolarHBondContact O-N 3.47Å; I364-Q366 VanDerWaalsContact C-N 3.26Å; I364-Q366 PolarHBondContact O-N 3.33Å; I364-D367 PolarHBondContact O-N 3.39Å; I364-A538 HydrophobicContact CD1-CB 3.53Å; I364-L542 HydrophobicContact CB-CD1 3.72Å; I364-L542 HydrophobicContact CD1-CD1 4.03Å; I364-L542 HydrophobicContact CG1-CD1 4.37Å; I364-L542 HydrophobicContact CG2-CD1 3.68Å
365	I	90.3	Very high	91.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.1	-27.4	-172.9	-159.8	161	0	0	0	113.1	L322 F324 V361 D367 Y368 V451 L542	L322-I365 HydrophobicContact CD1-CG1 4.39Å; F324-I365 HydrophobicContact CB-CD1 4.49Å; F324-I365 HydrophobicContact CB-CG2 4.03Å; F324-I365 HydrophobicContact CD1-CG2 3.6Å; F324-I365 HydrophobicContact CD2-CD1 3.72Å; F324-I365 HydrophobicContact CD2-CG1 4.38Å; F324-I365 HydrophobicContact CD2-CG2 3.67Å; F324-I365 HydrophobicContact CE1-CG2 3.82Å; F324-I365 HydrophobicContact CE2-CD1 4.23Å; F324-I365 HydrophobicContact CE2-CG2 3.87Å; F324-I365 HydrophobicContact CG-CD1 4.34Å; F324-I365 HydrophobicContact CG-CG2 3.49Å; F324-I365 VanDerWaalsContact CG-CG2 3.49Å; F324-I365 HydrophobicContact CZ-CG2 3.94Å; V361-I365 PolarHBondContact O-N 3.26Å; I365-D367 PolarHBondContact O-N 3.12Å; I365-D367 VanDerWaalsContact O-N 3.08Å; I365-Y368 PolarHBondContact O-N 3.38Å; I365-V451 HydrophobicContact CD1-CB 3.79Å; I365-V451 HydrophobicContact CD1-CG1 3.68Å; I365-V451 HydrophobicContact CD1-CG2 3.95Å; I365-L542 HydrophobicContact CD1-CD2 4.27Å
366	Q	91.2	Very high	91.3	Very high	19 Å²	19	23.7 Å²	23.7	9%	0.089	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-60.9	-18.3	178.6	68.9	174.9	-37.7	0	0	114.3	G362 E363 I364 Y368 K372 F374 I407	G362-Q366 WeakPolarHBondContact O-CB 3.17Å; G362-Q366 VanDerWaalsContact O-CG 3.3Å; G362-Q366 WeakPolarHBondContact O-CG 3.48Å; G362-Q366 PolarHBondContact O-N 3.3Å; G362-Q366 VanDerWaalsContact O-N 3.16Å; E363-Q366 PolarHBondContact O-NE2 3.39Å; I364-Q366 VanDerWaalsContact C-N 3.26Å; I364-Q366 PolarHBondContact O-N 3.33Å; Q366-Y368 PolarHBondContact O-N 3.27Å; Q366-K372 PolarHBondContact O-NZ 3.21Å; Q366-F374 HydrophobicContact CB-CE2 3.97Å; Q366-F374 HydrophobicContact CB-CZ 3.5Å; Q366-I407 HydrophobicContact CB-CG1 4.35Å
367	D	89.8	Confident	91.6	Very high	22 Å²	22	23.5 Å²	23.5	12%	0.118	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-75.1	-14	178.4	-72.4	-13.7	0	0	0	112.3	T112 I364 I365 K372	T112-D367 WeakPolarHBondContact CB-OD2 3.5Å; T112-D367 PolarHBondContact OG1-OD2 3.05Å; I364-D367 PolarHBondContact O-N 3.39Å; I365-D367 PolarHBondContact O-N 3.12Å; I365-D367 VanDerWaalsContact O-N 3.08Å; D367-K372 IonicContact OD1-NZ 2.84Å
368	Y	89.3	Confident	91.8	Very high	11 Å²	11	23.5 Å²	23.5	4%	0.043	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-107.8	4.4	-179.4	-53.8	-87.9	0	0	0	113	Y78 F80 F312 I316 L322 I365 Q366	Y78-Y368 WeakPolarHBondContact CE2-OH 3.36Å; Y78-Y368 VanDerWaalsContact OH-CE1 3.3Å; Y78-Y368 WeakPolarHBondContact OH-CE1 3.29Å; Y78-Y368 VanDerWaalsContact OH-CZ 3.31Å; Y78-Y368 PolarHBondContact OH-OH 3.25Å; F80-Y368 HydrophobicContact CD2-CD2 4.43Å; F80-Y368 HydrophobicContact CD2-CE1 4.18Å; F80-Y368 AromaticContact CD2-CE2 3.89Å; F80-Y368 HydrophobicContact CD2-CE2 3.89Å; F80-Y368 AromaticContact CD2-CZ 3.75Å; F80-Y368 HydrophobicContact CE2-CD1 4.47Å; F80-Y368 AromaticContact CE2-CD2 3.85Å; F80-Y368 HydrophobicContact CE2-CD2 3.85Å; F80-Y368 HydrophobicContact CE2-CE1 4.36Å; F80-Y368 AromaticContact CE2-CE2 3.74Å; F80-Y368 HydrophobicContact CE2-CE2 3.74Å; F80-Y368 HydrophobicContact CE2-CG 4.23Å; F312-Y368 HydrophobicContact CE1-CE1 4.45Å; I316-Y368 HydrophobicContact CD1-CD1 4.36Å; I316-Y368 HydrophobicContact CG1-CD1 4.31Å; I316-Y368 HydrophobicContact CG2-CD1 3.99Å; L322-Y368 HydrophobicContact CD1-CG 4.19Å; L322-Y368 PolarHBondContact N-O 3.18Å; I365-Y368 PolarHBondContact O-N 3.38Å; Q366-Y368 PolarHBondContact O-N 3.27Å
369	D	87.4	Confident	91.9	Very high	6 Å²	6	23.5 Å²	23.5	3%	0.032	12%	0.124	C	C	.	.			trans	-108.2	123.6	172	-169.5	-49.1	0	0	0	108.5	L322 D371 K372 F374	L322-D369 WeakPolarHBondContact O-CB 3.38Å; D369-D371 PolarHBondContact OD1-N 3.22Å; D369-K372 PolarHBondContact OD1-N 2.87Å; D369-F374 HydrophobicContact CB-CE1 3.69Å; D369-F374 HydrophobicContact CB-CZ 4.17Å; D369-F374 WeakPolarHBondContact OD2-CE1 3.4Å
370	S	82.5	Confident	92.1	Very high	76 Å²	76	21.7 Å²	21.7	53%	0.531	12%	0.117	S	C	.	.	S	Bend	trans	-78.5	-33.5	-170	73.5	0	0	0	0	113.9	Q321	Q321-S370 PolarHBondContact NE2-OG 3.43Å; Q321-S370 PolarHBondContact OE1-OG 3.5Å; Q321-S370 VanDerWaalsContact OE1-OG 3.11Å
371	D	86.3	Confident	92.3	Very high	86 Å²	86	21.3 Å²	21.3	46%	0.46	11%	0.114	S	C	.	.	S	Bend	trans	-95.8	-17.5	-178.3	70.3	15	0	0	0	111.9	D369 L373	D369-D371 PolarHBondContact OD1-N 3.22Å; D371-L373 HydrophobicContact CB-CD1 4.29Å; D371-L373 HydrophobicContact CB-CG 4.16Å; D371-L373 PolarHBondContact O-N 3.27Å; D371-L373 VanDerWaalsContact OD1-CB 3.31Å; D371-L373 WeakPolarHBondContact OD1-CB 3.31Å; D371-L373 PolarHBondContact OD1-N 2.93Å
372	K	91.6	Very high	92.5	Very high	69 Å²	69	23.8 Å²	23.8	30%	0.3	12%	0.124	S	C	.	.			trans	54.9	32.8	-178.3	-57.2	179.1	-179.7	-76.3	0	111.3	Q366 D367 D369 F374 G406	Q366-K372 PolarHBondContact O-NZ 3.21Å; D367-K372 IonicContact OD1-NZ 2.84Å; D369-K372 PolarHBondContact OD1-N 2.87Å; K372-F374 HydrophobicContact CB-CE2 4.24Å; K372-F374 HydrophobicContact CB-CZ 4.14Å; K372-G406 PolarHBondContact O-N 3.44Å
373	L	93.7	Very high	92.6	Very high	61 Å²	61	25.9 Å²	25.9	32%	0.319	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	95.4	177.4	-67.3	-177.5	0	0	0	109.4	D371 P375 N403 C404 V405	D371-L373 HydrophobicContact CB-CD1 4.29Å; D371-L373 HydrophobicContact CB-CG 4.16Å; D371-L373 PolarHBondContact O-N 3.27Å; D371-L373 VanDerWaalsContact OD1-CB 3.31Å; D371-L373 WeakPolarHBondContact OD1-CB 3.31Å; D371-L373 PolarHBondContact OD1-N 2.93Å; L373-P375 WeakPolarHBondContact O-CD 3.33Å; L373-N403 HydrophobicContact CB-CB 3.98Å; L373-C404 WeakPolarHBondContact CA-O 3.41Å; L373-V405 HydrophobicContact CD2-CG2 3.9Å
374	F	95.6	Very high	92.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.9	-171.5	-55.7	-57.1	0	0	0	111.7	F324 Q366 D369 K372 A376 N403 C404 I407 V410	F324-F374 HydrophobicContact CB-CD1 3.72Å; F324-F374 HydrophobicContact CB-CE1 3.86Å; F324-F374 AromaticContact CD1-CD1 4Å; F324-F374 HydrophobicContact CD1-CD1 4Å; F324-F374 HydrophobicContact CD1-CE1 4.31Å; F324-F374 HydrophobicContact CD1-CG 4.32Å; F324-F374 HydrophobicContact CG-CD1 4.36Å; F324-F374 WeakPolarHBondContact O-CD1 3.21Å; Q366-F374 HydrophobicContact CB-CE2 3.97Å; Q366-F374 HydrophobicContact CB-CZ 3.5Å; D369-F374 HydrophobicContact CB-CE1 3.69Å; D369-F374 HydrophobicContact CB-CZ 4.17Å; D369-F374 WeakPolarHBondContact OD2-CE1 3.4Å; K372-F374 HydrophobicContact CB-CE2 4.24Å; K372-F374 HydrophobicContact CB-CZ 4.14Å; F374-A376 PolarHBondContact O-N 2.58Å; F374-N403 CarbonylContact O-C 3.59Å; F374-N403 WeakPolarHBondContact O-CA 3.38Å; F374-C404 PolarHBondContact N-O 3.06Å; F374-C404 PolarHBondContact O-N 3.2Å; F374-I407 HydrophobicContact CD2-CD1 3.84Å; F374-I407 HydrophobicContact CE2-CD1 3.79Å; F374-I407 HydrophobicContact CE2-CG1 4.22Å; F374-I407 HydrophobicContact CZ-CD1 4.48Å; F374-V410 HydrophobicContact CB-CG2 3.87Å; F374-V410 HydrophobicContact CD2-CG2 4.4Å
375	P	96.4	Very high	92.4	Very high	26 Å²	26	33.8 Å²	33.8	17%	0.169	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	128.1	168.3	-17.1	28.4	0	0	0	109.9	F324 T325 V326 L373 Y377 P402 N403	F324-P375 WeakPolarHBondContact O-CD 3.49Å; T325-P375 WeakPolarHBondContact CA-O 3.36Å; T325-P375 HydrophobicContact CG2-CB 4.12Å; V326-P375 PolarHBondContact N-O 2.83Å; L373-P375 WeakPolarHBondContact O-CD 3.33Å; P375-Y377 HydrophobicContact CB-CE2 3.78Å; P375-P402 HydrophobicContact CB-CB 4.46Å; P375-P402 HydrophobicContact CB-CG 4.12Å; P375-N403 WeakPolarHBondContact CG-OD1 3.26Å
376	A	97.3	Very high	92.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.7	-179.2	0	0	0	0	0	111.4	V326 F374 P394 L395 P402 V410	V326-A376 CarbonylContact O-C 3.57Å; V326-A376 WeakPolarHBondContact O-CA 3.45Å; F374-A376 PolarHBondContact O-N 2.58Å; A376-P394 WeakPolarHBondContact O-CA 3.42Å; A376-L395 HydrophobicContact CB-CB 4.23Å; A376-L395 HydrophobicContact CB-CD1 3.89Å; A376-L395 HydrophobicContact CB-CG 4.13Å; A376-L395 PolarHBondContact O-N 3.16Å; A376-P402 PolarHBondContact N-O 2.92Å; A376-V410 HydrophobicContact CB-CG1 3.86Å; A376-V410 HydrophobicContact CB-CG2 4.33Å
377	Y	97.8	Very high	92.2	Very high	22 Å²	22	39.9 Å²	39.9	9%	0.086	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	150.5	-176.8	-58.3	-78.9	0	0	0	112.4	T325 V326 A327 I328 P375 F393 P402 Q435	T325-Y377 HydrophobicContact CG2-CD2 3.79Å; T325-Y377 HydrophobicContact CG2-CE2 3.78Å; V326-Y377 PolarHBondContact O-N 3.37Å; A327-Y377 CarbonylContact C-O 3.59Å; A327-Y377 VanDerWaalsContact CA-O 3.29Å; A327-Y377 WeakPolarHBondContact CA-O 3.02Å; I328-Y377 PolarHBondContact N-O 2.95Å; P375-Y377 HydrophobicContact CB-CE2 3.78Å; Y377-F393 CarbonylContact C-O 3.57Å; Y377-F393 WeakPolarHBondContact CA-O 3.34Å; Y377-P402 HydrophobicContact CE1-CB 3.79Å; Y377-P402 HydrophobicContact CE1-CG 4.29Å; Y377-P402 VanDerWaalsContact OH-CG 3.25Å; Y377-P402 WeakPolarHBondContact OH-CG 3.22Å; Y377-Q435 PolarHBondContact OH-NE2 2.85Å
378	G	96.9	Very high	92.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	155.1	163.2	0	0	0	0	0	110.7	I328 G392 F393	I328-G378 CarbonylContact O-C 3.36Å; I328-G378 VanDerWaalsContact O-CA 3.28Å; I328-G378 WeakPolarHBondContact O-CA 3.19Å; G378-G392 CarbonylContact O-C 3.55Å; G378-G392 VanDerWaalsContact O-CA 3.32Å; G378-G392 WeakPolarHBondContact O-CA 3.36Å; G378-G392 PolarHBondContact O-N 2.8Å; G378-F393 PolarHBondContact N-O 2.95Å; G378-F393 WeakPolarHBondContact O-CD1 3.42Å; G378-F393 VanDerWaalsContact O-CE1 3.3Å; G378-F393 WeakPolarHBondContact O-CE1 3.44Å; G378-F393 PolarHBondContact O-N 3.16Å
379	F	96.5	Very high	92.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.2	172.2	61.3	-91.1	0	0	0	111.8	A327 I328 D329 F330 H391 T427 F429 V432 M454	A327-F379 HydrophobicContact CB-CD1 4.26Å; A327-F379 HydrophobicContact CB-CE1 4.15Å; I328-F379 VanDerWaalsContact C-CE1 3.42Å; I328-F379 VanDerWaalsContact O-CD1 3.3Å; I328-F379 WeakPolarHBondContact O-CD1 3.14Å; I328-F379 PolarHBondContact O-N 3.45Å; D329-F379 HydrophobicContact CB-CE1 4.24Å; D329-F379 HydrophobicContact CB-CE2 3.66Å; D329-F379 HydrophobicContact CB-CZ 3.5Å; F330-F379 PolarHBondContact N-O 3.32Å; F379-H391 WeakPolarHBondContact CB-O 3.3Å; F379-T427 HydrophobicContact CE2-CG2 3.98Å; F379-F429 HydrophobicContact CD2-CD1 4.5Å; F379-F429 AromaticContact CE2-CD1 3.79Å; F379-F429 HydrophobicContact CE2-CD1 3.79Å; F379-F429 AromaticContact CE2-CE1 3.58Å; F379-F429 HydrophobicContact CE2-CE1 3.58Å; F379-F429 AromaticContact CZ-CD1 3.98Å; F379-F429 HydrophobicContact CZ-CD1 3.98Å; F379-F429 AromaticContact CZ-CE1 3.68Å; F379-F429 HydrophobicContact CZ-CE1 3.68Å; F379-V432 HydrophobicContact CB-CG2 4.15Å; F379-V432 HydrophobicContact CD1-CG2 4.25Å; F379-V432 HydrophobicContact CG-CG2 4.49Å; F379-M454 HydrophobicContact CD1-CE 4.33Å; F379-M454 HydrophobicContact CE1-CE 3.7Å; F379-M454 HydrophobicContact CZ-CE 3.87Å
380	G	95.3	Very high	92.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	87.1	22.6	175	0	0	0	0	0	115.3	S390 Y424 G425	G380-S390 PolarHBondContact N-O 3.32Å; G380-Y424 CarbonylContact O-C 3.55Å; G380-Y424 VanDerWaalsContact O-CA 3.31Å; G380-Y424 WeakPolarHBondContact O-CA 3.43Å; G380-Y424 PolarHBondContact O-N 2.96Å; G380-G425 PolarHBondContact O-N 2.83Å
381	A	95.8	Very high	93.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	159	-180	0	0	0	0	0	112.8	F330 I389 S390 F393 V421 Q422	F330-A381 HydrophobicContact CB-CB 3.81Å; A381-I389 WeakPolarHBondContact O-CA 3.16Å; A381-S390 PolarHBondContact N-O 2.89Å; A381-S390 PolarHBondContact O-N 3.23Å; A381-F393 HydrophobicContact CB-CE1 3.69Å; A381-F393 HydrophobicContact CB-CZ 3.77Å; A381-V421 HydrophobicContact CB-CB 4.05Å; A381-V421 HydrophobicContact CB-CG2 3.92Å; A381-Q422 WeakPolarHBondContact CA-O 3.49Å
382	K	96	Very high	93.8	Very high	51 Å²	51	44.7 Å²	44.7	22%	0.222	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.6	163.9	-72.4	178.9	177.3	173.8	0	109.6	G387 K388 I389 Q422 Y424	K382-G387 WeakPolarHBondContact CG-O 3.25Å; K382-K388 WeakPolarHBondContact CA-O 3.28Å; K382-I389 HydrophobicContact CG-CG1 3.88Å; K382-Q422 HydrophobicContact CB-CB 4.18Å; K382-Q422 PolarHBondContact N-O 3.19Å; K382-Q422 PolarHBondContact O-N 2.78Å; K382-Y424 HydrophobicContact CD-CD1 4.38Å; K382-Y424 HydrophobicContact CD-CD2 4.06Å; K382-Y424 HydrophobicContact CD-CE2 4.5Å; K382-Y424 HydrophobicContact CD-CG 4.01Å; K382-Y424 HydrophobicContact CG-CD1 4.1Å; K382-Y424 HydrophobicContact CG-CD2 4.42Å; K382-Y424 HydrophobicContact CG-CG 3.87Å
383	L	93.3	Very high	94	Very high	44 Å²	44	42 Å²	42	23%	0.23	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	143.3	-178.4	-56.9	-178.6	0	0	0	111.5	G387 K388 F393 V421	L383-G387 WeakPolarHBondContact O-CA 3.23Å; L383-G387 PolarHBondContact O-N 3.4Å; L383-K388 PolarHBondContact N-O 3.02Å; L383-F393 HydrophobicContact CD1-CB 3.67Å; L383-F393 HydrophobicContact CD1-CD1 4.38Å; L383-F393 HydrophobicContact CD1-CG 3.97Å; L383-F393 HydrophobicContact CD2-CB 4.28Å; L383-F393 HydrophobicContact CD2-CD1 3.85Å; L383-F393 HydrophobicContact CD2-CD2 3.64Å; L383-F393 HydrophobicContact CD2-CE1 4.03Å; L383-F393 HydrophobicContact CD2-CE2 3.82Å; L383-F393 HydrophobicContact CD2-CG 3.65Å; L383-F393 HydrophobicContact CD2-CZ 4.02Å; L383-F393 HydrophobicContact CG-CD1 4.46Å; L383-F393 HydrophobicContact CG-CG 4.35Å; L383-V421 HydrophobicContact CD2-CB 4.44Å; L383-V421 HydrophobicContact CD2-CG1 3.66Å
384	P	89.8	Confident	94.1	Very high	79 Å²	79	39.9 Å²	39.9	51%	0.513	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	157.8	168	31.4	-34.3	0	0	0	111.1
385	P	87.9	Confident	94.1	Very high	137 Å²	137	39.9 Å²	39.9	89%	0.89	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.3	-13.8	-3.7	35.3	-34.8	0	0	0	113.9
386	D	88	Confident	93.9	Very high	116 Å²	116	41.1 Å²	41.1	62%	0.62	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.4	-170.4	63.7	-9.3	0	0	0	113.9	K388	D386-K388 PolarHBondContact O-N 2.95Å; D386-K388 WeakPolarHBondContact OD1-CB 3.37Å; D386-K388 PolarHBondContact OD1-N 3.32Å; D386-K388 VanDerWaalsContact OD1-N 3.15Å; D386-K388 WeakPolarHBondContact OD2-CB 3.19Å
387	G	88.8	Confident	93.5	Very high	32 Å²	32	45.1 Å²	45.1	33%	0.33	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	22.1	-178.3	0	0	0	0	0	112.7	K382 L383	K382-G387 WeakPolarHBondContact CG-O 3.25Å; L383-G387 WeakPolarHBondContact O-CA 3.23Å; L383-G387 PolarHBondContact O-N 3.4Å
388	K	92.6	Very high	93.1	Very high	143 Å²	143	47.3 Å²	47.3	62%	0.622	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	133.5	179.3	-175.1	179	177.5	-174.5	0	110.3	K382 L383 D386 S390	K382-K388 WeakPolarHBondContact CA-O 3.28Å; L383-K388 PolarHBondContact N-O 3.02Å; D386-K388 PolarHBondContact O-N 2.95Å; D386-K388 WeakPolarHBondContact OD1-CB 3.37Å; D386-K388 PolarHBondContact OD1-N 3.32Å; D386-K388 VanDerWaalsContact OD1-N 3.15Å; D386-K388 WeakPolarHBondContact OD2-CB 3.19Å; K388-S390 PolarHBondContact O-N 2.87Å
389	I	94.2	Very high	92.6	Very high	69 Å²	69	53.3 Å²	53.3	35%	0.354	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	129.5	176.3	-54.5	163.5	0	0	0	108.5	A381 K382 Y424	A381-I389 WeakPolarHBondContact O-CA 3.16Å; K382-I389 HydrophobicContact CG-CG1 3.88Å; I389-Y424 HydrophobicContact CD1-CD1 3.69Å; I389-Y424 HydrophobicContact CD1-CE1 3.36Å; I389-Y424 HydrophobicContact CG1-CD1 3.67Å; I389-Y424 HydrophobicContact CG1-CE1 3.88Å; I389-Y424 HydrophobicContact CG2-CD1 4.26Å
390	S	94.3	Very high	92.2	Very high	27 Å²	27	62 Å²	62	19%	0.189	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.6	174.7	-174.9	0	0	0	0	111.2	G380 A381 K388 G392	G380-S390 PolarHBondContact N-O 3.32Å; A381-S390 PolarHBondContact N-O 2.89Å; A381-S390 PolarHBondContact O-N 3.23Å; K388-S390 PolarHBondContact O-N 2.87Å; S390-G392 PolarHBondContact OG-N 2.83Å
391	H	94.1	Very high	92	Very high	39 Å²	39	65.5 Å²	65.5	18%	0.181	37%	0.372	C	S	.	.	S	Bend	trans	-113.8	23.6	176	-59.4	-72.8	0	0	0	111.8	F379 P426 N428 P431 V432	F379-H391 WeakPolarHBondContact CB-O 3.3Å; H391-P426 PolarHBondContact CE1-O 2.81Å; H391-P426 PolarHBondContact ND1-O 2.87Å; H391-N428 HydrophobicContact CB-CB 4.23Å; H391-N428 PolarHBondContact CE1-ND2 3.14Å; H391-N428 PolarHBondContact NE2-ND2 3.3Å; H391-P431 HydrophobicContact CB-CB 4.14Å; H391-P431 HydrophobicContact CB-CG 3.8Å; H391-V432 VanDerWaalsContact O-CG2 3.22Å; H391-V432 WeakPolarHBondContact O-CG2 3.48Å
392	G	93.8	Very high	91.9	Very high	24 Å²	24	66.5 Å²	66.5	25%	0.247	38%	0.378	C	S	.	.	S	Bend	trans	175.8	85.8	179.1	0	0	0	0	0	109.5	G378 S390	G378-G392 CarbonylContact O-C 3.55Å; G378-G392 VanDerWaalsContact O-CA 3.32Å; G378-G392 WeakPolarHBondContact O-CA 3.36Å; G378-G392 PolarHBondContact O-N 2.8Å; S390-G392 PolarHBondContact OG-N 2.83Å
393	F	95.3	Very high	91.9	Very high	11 Å²	11	66.4 Å²	66.4	5%	0.048	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142.3	-179.6	61	-90.2	0	0	0	111	F330 Y377 G378 A381 L383 L395 T417 V421	F330-F393 HydrophobicContact CB-CZ 4.46Å; F330-F393 HydrophobicContact CD2-CZ 4.12Å; F330-F393 HydrophobicContact CG-CZ 4.22Å; Y377-F393 CarbonylContact C-O 3.57Å; Y377-F393 WeakPolarHBondContact CA-O 3.34Å; G378-F393 PolarHBondContact N-O 2.95Å; G378-F393 WeakPolarHBondContact O-CD1 3.42Å; G378-F393 VanDerWaalsContact O-CE1 3.3Å; G378-F393 WeakPolarHBondContact O-CE1 3.44Å; G378-F393 PolarHBondContact O-N 3.16Å; A381-F393 HydrophobicContact CB-CE1 3.69Å; A381-F393 HydrophobicContact CB-CZ 3.77Å; L383-F393 HydrophobicContact CD1-CB 3.67Å; L383-F393 HydrophobicContact CD1-CD1 4.38Å; L383-F393 HydrophobicContact CD1-CG 3.97Å; L383-F393 HydrophobicContact CD2-CB 4.28Å; L383-F393 HydrophobicContact CD2-CD1 3.85Å; L383-F393 HydrophobicContact CD2-CD2 3.64Å; L383-F393 HydrophobicContact CD2-CE1 4.03Å; L383-F393 HydrophobicContact CD2-CE2 3.82Å; L383-F393 HydrophobicContact CD2-CG 3.65Å; L383-F393 HydrophobicContact CD2-CZ 4.02Å; L383-F393 HydrophobicContact CG-CD1 4.46Å; L383-F393 HydrophobicContact CG-CG 4.35Å; F393-L395 HydrophobicContact CE2-CD2 4.2Å; F393-T417 HydrophobicContact CE2-CG2 3.61Å; F393-T417 HydrophobicContact CZ-CG2 4.28Å; F393-V421 HydrophobicContact CE2-CG1 4.09Å; F393-V421 HydrophobicContact CZ-CG1 4.34Å
394	P	96	Very high	92	Very high	18 Å²	18	64.7 Å²	64.7	12%	0.117	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	132.3	-177.9	29.6	-36.3	0	0	0	111.2	A376 N396 S397 N398 T399 P402	A376-P394 WeakPolarHBondContact O-CA 3.42Å; P394-N396 VanDerWaalsContact C-N 3.28Å; P394-N396 PolarHBondContact O-N 2.8Å; P394-S397 PolarHBondContact O-N 2.86Å; P394-S397 VanDerWaalsContact O-N 3.13Å; P394-N398 WeakPolarHBondContact CB-O 3.34Å; P394-N398 WeakPolarHBondContact CG-O 3.05Å; P394-T399 HydrophobicContact CG-CG2 4.09Å; P394-P402 HydrophobicContact CB-CB 3.98Å
395	L	96.1	Very high	92.2	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.5	179.7	-61.2	-173.5	0	0	0	112.5	I328 F330 A376 F393 S397 A413 T417	I328-L395 HydrophobicContact CD1-CD1 3.93Å; F330-L395 HydrophobicContact CE2-CD2 3.62Å; F330-L395 HydrophobicContact CZ-CD2 3.87Å; A376-L395 HydrophobicContact CB-CB 4.23Å; A376-L395 HydrophobicContact CB-CD1 3.89Å; A376-L395 HydrophobicContact CB-CG 4.13Å; A376-L395 PolarHBondContact O-N 3.16Å; F393-L395 HydrophobicContact CE2-CD2 4.2Å; L395-S397 PolarHBondContact O-N 3.05Å; L395-A413 HydrophobicContact CB-CB 3.83Å; L395-T417 WeakPolarHBondContact CA-OG1 3.47Å; L395-T417 HydrophobicContact CD2-CG2 3.91Å; L395-T417 PolarHBondContact O-OG1 2.75Å
396	N	92.3	Very high	92.5	Very high	51 Å²	51	60.3 Å²	60.3	27%	0.273	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5.6	175.6	72	0.4	0	0	0	113.2	P394 N398 N401 P402 N403	P394-N396 VanDerWaalsContact C-N 3.28Å; P394-N396 PolarHBondContact O-N 2.8Å; N396-N398 PolarHBondContact O-N 2.92Å; N396-N398 VanDerWaalsContact O-N 3.13Å; N396-N398 WeakPolarHBondContact OD1-CB 3.45Å; N396-N398 PolarHBondContact OD1-N 2.83Å; N396-N398 PolarHBondContact OD1-O 2.92Å; N396-N401 PolarHBondContact ND2-O 2.96Å; N396-P402 VanDerWaalsContact ND2-C 3.29Å; N396-N403 PolarHBondContact ND2-O 3.25Å; N396-N403 VanDerWaalsContact ND2-O 3.09Å
397	S	88.6	Confident	92.8	Very high	85 Å²	85	54.8 Å²	54.8	59%	0.594	31%	0.313	S	S	*	.	S	Bend	trans	60.7	12.9	-177	-54.3	0	0	0	0	115.4	P394 L395	P394-S397 PolarHBondContact O-N 2.86Å; P394-S397 VanDerWaalsContact O-N 3.13Å; L395-S397 PolarHBondContact O-N 3.05Å
398	N	89.4	Confident	93.1	Very high	68 Å²	68	56.7 Å²	56.7	36%	0.364	31%	0.314	S	S	.	.			trans	-108.5	108.9	177.9	-175.6	-11.9	0	0	0	110.7	P394 N396 E400 N401	P394-N398 WeakPolarHBondContact CB-O 3.34Å; P394-N398 WeakPolarHBondContact CG-O 3.05Å; N396-N398 PolarHBondContact O-N 2.92Å; N396-N398 VanDerWaalsContact O-N 3.13Å; N396-N398 WeakPolarHBondContact OD1-CB 3.45Å; N396-N398 PolarHBondContact OD1-N 2.83Å; N396-N398 PolarHBondContact OD1-O 2.92Å; N398-E400 VanDerWaalsContact C-N 3.34Å; N398-E400 PolarHBondContact OD1-N 2.68Å; N398-N401 WeakPolarHBondContact CB-O 3.34Å; N398-N401 CarbonylContact O-C 3.37Å; N398-N401 PolarHBondContact OD1-N 3.28Å
399	T	85.8	Confident	93.2	Very high	126 Å²	126	50.7 Å²	50.7	77%	0.773	29%	0.292	S	S	*	.	S	Bend	trans	-74.3	-21.9	-179.6	50.1	0	0	0	0	114.1	P394	P394-T399 HydrophobicContact CG-CG2 4.09Å
400	E	89.3	Confident	93.4	Very high	182 Å²	182	47.4 Å²	47.4	85%	0.85	28%	0.276	S	S	*	.	S	Bend	trans	-84.7	-33	177.8	-63.5	-174.5	169	0	0	111.6	N398	N398-E400 VanDerWaalsContact C-N 3.34Å; N398-E400 PolarHBondContact OD1-N 2.68Å
401	N	91.5	Very high	93.4	Very high	74 Å²	74	46.7 Å²	46.7	40%	0.396	27%	0.27	S	S	.	.			trans	-137.1	96.2	178.2	-176.5	3.3	0	0	0	110.8	N396 N398 N403	N396-N401 PolarHBondContact ND2-O 2.96Å; N398-N401 WeakPolarHBondContact CB-O 3.34Å; N398-N401 CarbonylContact O-C 3.37Å; N398-N401 PolarHBondContact OD1-N 3.28Å; N401-N403 PolarHBondContact O-N 2.96Å; N401-N403 WeakPolarHBondContact OD1-CB 3.47Å; N401-N403 VanDerWaalsContact OD1-CG 3.23Å; N401-N403 PolarHBondContact OD1-N 2.89Å; N401-N403 VanDerWaalsContact OD1-N 3.09Å; N401-N403 PolarHBondContact OD1-ND2 3.15Å
402	P	93.6	Very high	93.5	Very high	20 Å²	20	51.9 Å²	51.9	13%	0.13	29%	0.294	C	S	.	.			trans	-78.3	2.3	-179.4	33.6	-36.4	0	0	0	113.6	P375 A376 Y377 P394 N396	P375-P402 HydrophobicContact CB-CB 4.46Å; P375-P402 HydrophobicContact CB-CG 4.12Å; A376-P402 PolarHBondContact N-O 2.92Å; Y377-P402 HydrophobicContact CE1-CB 3.79Å; Y377-P402 HydrophobicContact CE1-CG 4.29Å; Y377-P402 VanDerWaalsContact OH-CG 3.25Å; Y377-P402 WeakPolarHBondContact OH-CG 3.22Å; P394-P402 HydrophobicContact CB-CB 3.98Å; N396-P402 VanDerWaalsContact ND2-C 3.29Å
403	N	95.1	Very high	93.6	Very high	50 Å²	50	51.3 Å²	51.3	27%	0.267	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.4	-170.6	-60.1	-9.7	0	0	0	112.2	L373 F374 P375 N396 N401	L373-N403 HydrophobicContact CB-CB 3.98Å; F374-N403 CarbonylContact O-C 3.59Å; F374-N403 WeakPolarHBondContact O-CA 3.38Å; P375-N403 WeakPolarHBondContact CG-OD1 3.26Å; N396-N403 PolarHBondContact ND2-O 3.25Å; N396-N403 VanDerWaalsContact ND2-O 3.09Å; N401-N403 PolarHBondContact O-N 2.96Å; N401-N403 WeakPolarHBondContact OD1-CB 3.47Å; N401-N403 VanDerWaalsContact OD1-CG 3.23Å; N401-N403 PolarHBondContact OD1-N 2.89Å; N401-N403 VanDerWaalsContact OD1-N 3.09Å; N401-N403 PolarHBondContact OD1-ND2 3.15Å
404	C	95.2	Very high	93.7	Very high	8 Å²	8	50.8 Å²	50.8	5%	0.054	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141.4	173	-60.1	0	0	0	0	109.5	L373 F374 G406 V410	L373-C404 WeakPolarHBondContact CA-O 3.41Å; F374-C404 PolarHBondContact N-O 3.06Å; F374-C404 PolarHBondContact O-N 3.2Å; C404-G406 PolarHBondContact O-N 3.24Å; C404-V410 HydrophobicContact CB-CB 4.43Å; C404-V410 HydrophobicContact CB-CG2 3.69Å
405	V	94.4	Very high	93.7	Very high	112 Å²	112	52.3 Å²	52.3	68%	0.679	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	110.7	179.4	-177.4	0	0	0	0	109.6	L373 G409	L373-V405 HydrophobicContact CD2-CG2 3.9Å; V405-G409 WeakPolarHBondContact O-CA 3.46Å; V405-G409 PolarHBondContact O-N 3.28Å
406	G	94.6	Very high	93.6	Very high	11 Å²	11	57 Å²	57	11%	0.113	31%	0.311	C	S	.	.	H	α-helix	trans	67.1	173.1	179.7	0	0	0	0	0	114	K372 C404 E408 G409 V410	K372-G406 PolarHBondContact O-N 3.44Å; C404-G406 PolarHBondContact O-N 3.24Å; G406-E408 VanDerWaalsContact C-N 3.3Å; G406-E408 PolarHBondContact O-N 3.05Å; G406-G409 PolarHBondContact O-N 3.38Å; G406-V410 PolarHBondContact O-N 3.47Å
407	I	94.7	Very high	93.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-35	177.1	-59.2	-56.7	0	0	0	111.5	F324 L358 G362 Q366 F374 G409 V410 L411	F324-I407 HydrophobicContact CD1-CD1 4.18Å; F324-I407 HydrophobicContact CE1-CD1 3.97Å; L358-I407 HydrophobicContact CG-CG2 4.45Å; G362-I407 VanDerWaalsContact C-CG1 3.48Å; G362-I407 VanDerWaalsContact CA-CD1 3.41Å; G362-I407 WeakPolarHBondContact O-CG1 3.27Å; Q366-I407 HydrophobicContact CB-CG1 4.35Å; F374-I407 HydrophobicContact CD2-CD1 3.84Å; F374-I407 HydrophobicContact CE2-CD1 3.79Å; F374-I407 HydrophobicContact CE2-CG1 4.22Å; F374-I407 HydrophobicContact CZ-CD1 4.48Å; I407-G409 VanDerWaalsContact C-N 3.29Å; I407-G409 PolarHBondContact O-N 2.77Å; I407-V410 PolarHBondContact O-N 3.03Å; I407-L411 HydrophobicContact CG2-CD1 4.23Å; I407-L411 WeakPolarHBondContact O-CG 3.4Å; I407-L411 PolarHBondContact O-N 2.95Å
408	E	93.9	Very high	94	Very high	72 Å²	72	51.1 Å²	51.1	34%	0.336	27%	0.273	S	S	.	.	H	α-helix	trans	-57.1	-41.6	172	-82.6	62.6	-154.1	0	0	112	G406 L411 E412	G406-E408 VanDerWaalsContact C-N 3.3Å; G406-E408 PolarHBondContact O-N 3.05Å; E408-L411 PolarHBondContact O-N 3.14Å; E408-E412 PolarHBondContact O-N 3.17Å
409	G	95.8	Very high	94.2	Very high	17 Å²	17	56.3 Å²	56.3	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-39.5	175.2	0	0	0	0	0	112.6	V405 G406 I407 E412 A413	V405-G409 WeakPolarHBondContact O-CA 3.46Å; V405-G409 PolarHBondContact O-N 3.28Å; G406-G409 PolarHBondContact O-N 3.38Å; I407-G409 VanDerWaalsContact C-N 3.29Å; I407-G409 PolarHBondContact O-N 2.77Å; G409-E412 PolarHBondContact O-N 3.4Å; G409-A413 WeakPolarHBondContact O-CB 3.45Å; G409-A413 PolarHBondContact O-N 3.08Å
410	V	96.9	Very high	94.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-43.5	174.5	-177.3	0	0	0	0	110.8	V326 L358 F374 A376 C404 G406 I407 A413 Y414	V326-V410 HydrophobicContact CB-CG1 4.21Å; V326-V410 HydrophobicContact CG1-CG1 4.18Å; V326-V410 HydrophobicContact CG2-CG1 4.29Å; L358-V410 HydrophobicContact CD1-CG1 4.14Å; L358-V410 HydrophobicContact CD2-CB 4.29Å; L358-V410 HydrophobicContact CD2-CG1 3.65Å; F374-V410 HydrophobicContact CB-CG2 3.87Å; F374-V410 HydrophobicContact CD2-CG2 4.4Å; A376-V410 HydrophobicContact CB-CG1 3.86Å; A376-V410 HydrophobicContact CB-CG2 4.33Å; C404-V410 HydrophobicContact CB-CB 4.43Å; C404-V410 HydrophobicContact CB-CG2 3.69Å; G406-V410 PolarHBondContact O-N 3.47Å; I407-V410 PolarHBondContact O-N 3.03Å; V410-A413 PolarHBondContact O-N 3.44Å; V410-Y414 WeakPolarHBondContact O-CB 3.32Å; V410-Y414 PolarHBondContact O-N 3.47Å
411	L	96	Very high	94.8	Very high	13 Å²	13	45.3 Å²	45.3	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-43.7	177.1	-76.3	166.9	0	0	0	111.8	A355 L358 I407 E408 Y414 F415	A355-L411 HydrophobicContact CB-CD2 3.8Å; L358-L411 HydrophobicContact CD2-CD2 3.66Å; L358-L411 HydrophobicContact CD2-CG 3.92Å; L358-L411 HydrophobicContact CG-CD2 4.25Å; L358-L411 HydrophobicContact CG-CG 4.49Å; I407-L411 HydrophobicContact CG2-CD1 4.23Å; I407-L411 WeakPolarHBondContact O-CG 3.4Å; I407-L411 PolarHBondContact O-N 2.95Å; E408-L411 PolarHBondContact O-N 3.14Å; L411-Y414 PolarHBondContact O-N 3.26Å; L411-F415 HydrophobicContact CD2-CE2 4.47Å; L411-F415 WeakPolarHBondContact O-CD2 3.48Å; L411-F415 PolarHBondContact O-N 3.26Å
412	E	95.2	Very high	95	Very high	148 Å²	148	47.5 Å²	47.5	69%	0.692	24%	0.24	S	C	*	.	H	α-helix	trans	-60.7	-48	175.5	-174.5	176.6	-174.9	0	0	111.3	E408 G409 Y414 F415 H416	E408-E412 PolarHBondContact O-N 3.17Å; G409-E412 PolarHBondContact O-N 3.4Å; E412-Y414 VanDerWaalsContact C-N 3.33Å; E412-Y414 PolarHBondContact O-N 3.18Å; E412-F415 PolarHBondContact O-N 2.63Å; E412-H416 WeakPolarHBondContact O-CB 3.2Å; E412-H416 PolarHBondContact O-N 2.81Å
413	A	96.8	Very high	95	Very high	11 Å²	11	47.7 Å²	47.7	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-40.4	177.7	0	0	0	0	0	112.3	L395 G409 V410 H416 T417	L395-A413 HydrophobicContact CB-CB 3.83Å; G409-A413 WeakPolarHBondContact O-CB 3.45Å; G409-A413 PolarHBondContact O-N 3.08Å; V410-A413 PolarHBondContact O-N 3.44Å; A413-H416 PolarHBondContact O-N 3.35Å; A413-T417 VanDerWaalsContact O-CB 3.29Å; A413-T417 WeakPolarHBondContact O-CB 3.24Å; A413-T417 PolarHBondContact O-N 3.16Å; A413-T417 PolarHBondContact O-OG1 3.06Å
414	Y	97.3	Very high	95	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-52.6	174.3	162.6	-114.3	0	0	0	112.2	I328 F330 H344 N352 Y354 A355 V410 L411 E412 H416 T417 L418	I328-Y414 HydrophobicContact CD1-CD2 3.5Å; I328-Y414 VanDerWaalsContact CD1-CD2 3.5Å; I328-Y414 HydrophobicContact CD1-CE2 4.18Å; I328-Y414 HydrophobicContact CD1-CG 3.83Å; I328-Y414 HydrophobicContact CG2-CD2 3.95Å; I328-Y414 HydrophobicContact CG2-CE2 3.77Å; F330-Y414 HydrophobicContact CE2-CD2 4.32Å; F330-Y414 AromaticContact CZ-CD2 3.77Å; F330-Y414 HydrophobicContact CZ-CD2 3.77Å; F330-Y414 HydrophobicContact CZ-CE2 4.16Å; H344-Y414 AromaticContact ND1-CE2 3.76Å; H344-Y414 AromaticContact ND1-CZ 3.73Å; H344-Y414 PolarHBondContact ND1-OH 3.12Å; N352-Y414 PolarHBondContact ND2-OH 3.34Å; N352-Y414 PolarHBondContact OD1-OH 3.25Å; N352-Y414 VanDerWaalsContact OD1-OH 3.11Å; Y354-Y414 VanDerWaalsContact CB-OH 3.3Å; Y354-Y414 WeakPolarHBondContact CB-OH 3.29Å; A355-Y414 HydrophobicContact CB-CE1 4.3Å; V410-Y414 WeakPolarHBondContact O-CB 3.32Å; V410-Y414 PolarHBondContact O-N 3.47Å; L411-Y414 PolarHBondContact O-N 3.26Å; E412-Y414 VanDerWaalsContact C-N 3.33Å; E412-Y414 PolarHBondContact O-N 3.18Å; Y414-H416 VanDerWaalsContact C-N 3.31Å; Y414-H416 PolarHBondContact O-N 2.87Å; Y414-T417 PolarHBondContact O-N 3.28Å; Y414-L418 HydrophobicContact CD2-CD1 4.15Å; Y414-L418 HydrophobicContact CD2-CG 4.25Å; Y414-L418 HydrophobicContact CE1-CD1 3.96Å; Y414-L418 HydrophobicContact CE2-CD1 3.48Å; Y414-L418 VanDerWaalsContact CE2-CD1 3.48Å; Y414-L418 HydrophobicContact CE2-CD2 4.38Å; Y414-L418 HydrophobicContact CE2-CG 3.84Å; Y414-L418 PolarHBondContact O-N 2.98Å
415	F	95.1	Very high	94.8	Very high	51 Å²	51	50.6 Å²	50.6	22%	0.224	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-32.7	179.6	-72.6	-60.4	0	0	0	112.8	M346 A355 L411 E412	M346-F415 HydrophobicContact CE-CD1 4.39Å; M346-F415 WeakPolarHBondContact CE-O 3.43Å; M346-F415 HydrophobicContact CG-CD1 4.2Å; M346-F415 HydrophobicContact SD-CD1 4.47Å; A355-F415 HydrophobicContact CB-CE2 4.49Å; A355-F415 HydrophobicContact CB-CZ 3.92Å; L411-F415 HydrophobicContact CD2-CE2 4.47Å; L411-F415 WeakPolarHBondContact O-CD2 3.48Å; L411-F415 PolarHBondContact O-N 3.26Å; E412-F415 PolarHBondContact O-N 2.63Å
416	H	94.5	Very high	94.8	Very high	98 Å²	98	48.1 Å²	48.1	45%	0.454	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-51.3	173	-176.6	82.4	0	0	0	111	E412 A413 Y414 L418 R419	E412-H416 WeakPolarHBondContact O-CB 3.2Å; E412-H416 PolarHBondContact O-N 2.81Å; A413-H416 PolarHBondContact O-N 3.35Å; Y414-H416 VanDerWaalsContact C-N 3.31Å; Y414-H416 PolarHBondContact O-N 2.87Å; H416-L418 VanDerWaalsContact C-N 3.33Å; H416-L418 PolarHBondContact O-N 2.94Å; H416-R419 WeakPolarHBondContact O-CB 3.3Å; H416-R419 PolarHBondContact O-N 3.1Å
417	T	95.2	Very high	94.7	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-57.3	-43.6	-179.4	-62.9	0	0	0	0	112.3	F330 F393 L395 A413 Y414 R419 T420 V421	F330-T417 HydrophobicContact CD1-CG2 4.35Å; F330-T417 HydrophobicContact CE1-CG2 3.55Å; F330-T417 HydrophobicContact CE2-CG2 4.33Å; F330-T417 HydrophobicContact CZ-CG2 3.56Å; F393-T417 HydrophobicContact CE2-CG2 3.61Å; F393-T417 HydrophobicContact CZ-CG2 4.28Å; L395-T417 WeakPolarHBondContact CA-OG1 3.47Å; L395-T417 HydrophobicContact CD2-CG2 3.91Å; L395-T417 PolarHBondContact O-OG1 2.75Å; A413-T417 VanDerWaalsContact O-CB 3.29Å; A413-T417 WeakPolarHBondContact O-CB 3.24Å; A413-T417 PolarHBondContact O-N 3.16Å; A413-T417 PolarHBondContact O-OG1 3.06Å; Y414-T417 PolarHBondContact O-N 3.28Å; T417-R419 PolarHBondContact O-N 2.85Å; T417-T420 PolarHBondContact O-N 3.02Å; T417-T420 PolarHBondContact O-OG1 3.12Å; T417-V421 HydrophobicContact CG2-CG1 3.71Å; T417-V421 HydrophobicContact CG2-CG2 4.09Å; T417-V421 WeakPolarHBondContact O-CG2 3.48Å; T417-V421 PolarHBondContact O-N 3.32Å
418	L	94.3	Very high	94.8	Very high	9 Å²	9	49.5 Å²	49.5	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-20.6	179	-84.2	176.1	0	0	0	113.9	F330 P337 H344 M346 Y414 H416 L423	F330-L418 HydrophobicContact CD1-CD2 3.6Å; F330-L418 HydrophobicContact CD1-CG 4.26Å; F330-L418 HydrophobicContact CE1-CB 4.19Å; F330-L418 HydrophobicContact CE1-CD2 3.36Å; F330-L418 HydrophobicContact CE1-CG 3.5Å; F330-L418 VanDerWaalsContact CE1-CG 3.5Å; F330-L418 HydrophobicContact CZ-CD2 4.31Å; F330-L418 HydrophobicContact CZ-CG 4.17Å; P337-L418 HydrophobicContact CG-CD2 4.06Å; H344-L418 HydrophobicContact CB-CD1 3.99Å; H344-L418 HydrophobicContact CB-CD2 3.84Å; M346-L418 HydrophobicContact CE-CB 3.1Å; M346-L418 HydrophobicContact CE-CD1 3.63Å; M346-L418 HydrophobicContact CE-CG 4.01Å; Y414-L418 HydrophobicContact CD2-CD1 4.15Å; Y414-L418 HydrophobicContact CD2-CG 4.25Å; Y414-L418 HydrophobicContact CE1-CD1 3.96Å; Y414-L418 HydrophobicContact CE2-CD1 3.48Å; Y414-L418 VanDerWaalsContact CE2-CD1 3.48Å; Y414-L418 HydrophobicContact CE2-CD2 4.38Å; Y414-L418 HydrophobicContact CE2-CG 3.84Å; Y414-L418 PolarHBondContact O-N 2.98Å; H416-L418 VanDerWaalsContact C-N 3.33Å; H416-L418 PolarHBondContact O-N 2.94Å; L418-L423 HydrophobicContact CD2-CD2 4.17Å
419	R	93	Very high	94.8	Very high	177 Å²	177	46 Å²	46	67%	0.668	23%	0.228	S	C	*	.	H	α-helix	trans	-89.3	-18.2	176.7	-60	178.5	-172.2	137.6	3.6	113.2	M346 H416 T417	M346-R419 HydrophobicContact CE-CG 3.89Å; M346-R419 HydrophobicContact SD-CG 4.2Å; H416-R419 WeakPolarHBondContact O-CB 3.3Å; H416-R419 PolarHBondContact O-N 3.1Å; T417-R419 PolarHBondContact O-N 2.85Å
420	T	92.6	Very high	94.9	Very high	59 Å²	59	45.5 Å²	45.5	36%	0.362	22%	0.222	S	C	.	.	H	α-helix	trans	-106.5	-31.2	-171	59.7	0	0	0	0	112.7	T417	T417-T420 PolarHBondContact O-N 3.02Å; T417-T420 PolarHBondContact O-OG1 3.12Å
421	V	94.5	Very high	94.9	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.115	24%	0.239	C	C	.	.	S	Bend	trans	-92.6	156.9	-179	-51.8	0	0	0	0	112.1	F330 A381 L383 F393 T417	F330-V421 HydrophobicContact CD1-CG2 3.62Å; F330-V421 HydrophobicContact CE1-CG2 4.06Å; F330-V421 HydrophobicContact CG-CG2 4.43Å; A381-V421 HydrophobicContact CB-CB 4.05Å; A381-V421 HydrophobicContact CB-CG2 3.92Å; L383-V421 HydrophobicContact CD2-CB 4.44Å; L383-V421 HydrophobicContact CD2-CG1 3.66Å; F393-V421 HydrophobicContact CE2-CG1 4.09Å; F393-V421 HydrophobicContact CZ-CG1 4.34Å; T417-V421 HydrophobicContact CG2-CG1 3.71Å; T417-V421 HydrophobicContact CG2-CG2 4.09Å; T417-V421 WeakPolarHBondContact O-CG2 3.48Å; T417-V421 PolarHBondContact O-N 3.32Å
422	Q	95.6	Very high	94.9	Very high	119 Å²	119	47.5 Å²	47.5	56%	0.556	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.6	170.1	176.9	-179.5	24.4	0	0	109.5	A381 K382 Y424	A381-Q422 WeakPolarHBondContact CA-O 3.49Å; K382-Q422 HydrophobicContact CB-CB 4.18Å; K382-Q422 PolarHBondContact N-O 3.19Å; K382-Q422 PolarHBondContact O-N 2.78Å; Q422-Y424 PolarHBondContact O-N 2.86Å
423	L	95.4	Very high	95	Very high	24 Å²	24	40.5 Å²	40.5	13%	0.126	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	134	176.5	-52.5	-175.5	0	0	0	110.9	F330 A332 G335 P337 L418	F330-L423 HydrophobicContact CB-CD2 3.79Å; F330-L423 HydrophobicContact CD1-CD2 3.73Å; F330-L423 HydrophobicContact CG-CD2 4.21Å; F330-L423 WeakPolarHBondContact O-CA 3.48Å; F330-L423 WeakPolarHBondContact O-CB 3.38Å; F330-L423 WeakPolarHBondContact O-CD2 3.37Å; A332-L423 HydrophobicContact CB-CB 4.48Å; G335-L423 WeakPolarHBondContact O-CD1 3.28Å; P337-L423 HydrophobicContact CG-CD1 3.92Å; P337-L423 HydrophobicContact CG-CG 4.47Å; L418-L423 HydrophobicContact CD2-CD2 4.17Å
424	Y	94.8	Very high	95	Very high	101 Å²	101	42.5 Å²	42.5	40%	0.396	21%	0.212	S	C	.	.	B	Isolated β-bridge	trans	-149.1	-147.1	-173.2	-160.4	-110.6	0	0	0	112.6	F330 T331 A332 G380 K382 I389 Q422	F330-Y424 PolarHBondContact O-N 2.95Å; T331-Y424 CarbonylContact C-O 3.59Å; T331-Y424 WeakPolarHBondContact CA-O 3.35Å; T331-Y424 WeakPolarHBondContact CB-O 3.38Å; T331-Y424 WeakPolarHBondContact CG2-O 3.42Å; A332-Y424 PolarHBondContact N-O 2.76Å; G380-Y424 CarbonylContact O-C 3.55Å; G380-Y424 VanDerWaalsContact O-CA 3.31Å; G380-Y424 WeakPolarHBondContact O-CA 3.43Å; G380-Y424 PolarHBondContact O-N 2.96Å; K382-Y424 HydrophobicContact CD-CD1 4.38Å; K382-Y424 HydrophobicContact CD-CD2 4.06Å; K382-Y424 HydrophobicContact CD-CE2 4.5Å; K382-Y424 HydrophobicContact CD-CG 4.01Å; K382-Y424 HydrophobicContact CG-CD1 4.1Å; K382-Y424 HydrophobicContact CG-CD2 4.42Å; K382-Y424 HydrophobicContact CG-CG 3.87Å; I389-Y424 HydrophobicContact CD1-CD1 3.69Å; I389-Y424 HydrophobicContact CD1-CE1 3.36Å; I389-Y424 HydrophobicContact CG1-CD1 3.67Å; I389-Y424 HydrophobicContact CG1-CE1 3.88Å; I389-Y424 HydrophobicContact CG2-CD1 4.26Å; Q422-Y424 PolarHBondContact O-N 2.86Å
425	G	91.4	Very high	94.9	Very high	19 Å²	19	45.3 Å²	45.3	20%	0.196	23%	0.226	C	C	.	.			trans	-169	179.5	177	0	0	0	0	0	110.9	G380	G380-G425 PolarHBondContact O-N 2.83Å
426	P	93.9	Very high	95	Very high	60 Å²	60	43.1 Å²	43.1	39%	0.39	22%	0.216	S	C	.	.			cis	-75.3	176	1.7	30.8	-36.8	0	0	0	114.4	H391 N428 S461	H391-P426 PolarHBondContact CE1-O 2.81Å; H391-P426 PolarHBondContact ND1-O 2.87Å; P426-N428 PolarHBondContact O-N 3.05Å; P426-S461 WeakPolarHBondContact CB-OG 3.47Å
427	T	92.8	Very high	95.1	Very high	10 Å²	10	39 Å²	39	6%	0.061	20%	0.199	C	C	.	.			trans	-88.6	98	175.3	-46.1	0	0	0	0	109.2	D329 T331 F379 F429 V459 S461	D329-T427 WeakPolarHBondContact OD2-CG2 3.19Å; T331-T427 HydrophobicContact CG2-CG2 4.38Å; T331-T427 WeakPolarHBondContact CG2-OG1 3.36Å; F379-T427 HydrophobicContact CE2-CG2 3.98Å; T427-F429 HydrophobicContact CG2-CD1 4.32Å; T427-F429 HydrophobicContact CG2-CE1 3.66Å; T427-V459 WeakPolarHBondContact CB-O 3.35Å; T427-V459 WeakPolarHBondContact CG2-O 3.27Å; T427-V459 PolarHBondContact OG1-O 2.8Å; T427-S461 PolarHBondContact N-OG 2.86Å; T427-S461 VanDerWaalsContact O-CB 3.31Å; T427-S461 WeakPolarHBondContact O-CB 3.3Å; T427-S461 PolarHBondContact O-N 3.33Å; T427-S461 PolarHBondContact O-OG 3.31Å
428	N	95	Very high	95.1	Very high	29 Å²	29	47.4 Å²	47.4	16%	0.155	23%	0.23	C	C	.	.			trans	-115.8	120.7	-175.4	-69.7	-12.9	0	0	0	110.8	H391 P426 P431 D462	H391-N428 HydrophobicContact CB-CB 4.23Å; H391-N428 PolarHBondContact CE1-ND2 3.14Å; H391-N428 PolarHBondContact NE2-ND2 3.3Å; P426-N428 PolarHBondContact O-N 3.05Å; N428-P431 HydrophobicContact CB-CG 4.37Å; N428-D462 VanDerWaalsContact CA-CG 3.46Å; N428-D462 VanDerWaalsContact CA-OD1 3.31Å; N428-D462 WeakPolarHBondContact CA-OD1 3.21Å; N428-D462 WeakPolarHBondContact CA-OD2 3.07Å; N428-D462 HydrophobicContact CB-CB 4.31Å; N428-D462 WeakPolarHBondContact CB-OD2 3.34Å
429	F	95.8	Very high	95.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.			trans	-93.9	-33.1	-178.1	-69.9	4.3	0	0	0	112.6	F379 T427 P431 V432 I433 M454 T456 I460 D462 T466 I482 M493	F379-F429 HydrophobicContact CD2-CD1 4.5Å; F379-F429 AromaticContact CE2-CD1 3.79Å; F379-F429 HydrophobicContact CE2-CD1 3.79Å; F379-F429 AromaticContact CE2-CE1 3.58Å; F379-F429 HydrophobicContact CE2-CE1 3.58Å; F379-F429 AromaticContact CZ-CD1 3.98Å; F379-F429 HydrophobicContact CZ-CD1 3.98Å; F379-F429 AromaticContact CZ-CE1 3.68Å; F379-F429 HydrophobicContact CZ-CE1 3.68Å; T427-F429 HydrophobicContact CG2-CD1 4.32Å; T427-F429 HydrophobicContact CG2-CE1 3.66Å; F429-P431 VanDerWaalsContact C-N 3.29Å; F429-P431 VanDerWaalsContact O-N 3.12Å; F429-V432 PolarHBondContact O-N 3.08Å; F429-V432 VanDerWaalsContact O-N 3.14Å; F429-I433 HydrophobicContact CB-CD1 3.96Å; F429-I433 PolarHBondContact O-N 3.11Å; F429-M454 HydrophobicContact CB-CE 3.72Å; F429-M454 HydrophobicContact CB-SD 4.24Å; F429-M454 HydrophobicContact CD1-CE 3.5Å; F429-M454 HydrophobicContact CD2-CE 3.91Å; F429-M454 HydrophobicContact CD2-SD 4.16Å; F429-M454 HydrophobicContact CE1-CE 4.09Å; F429-M454 HydrophobicContact CE2-CE 4.44Å; F429-M454 HydrophobicContact CG-CE 3.43Å; F429-M454 VanDerWaalsContact CG-CE 3.43Å; F429-M454 HydrophobicContact CG-SD 4.15Å; F429-T456 HydrophobicContact CE2-CG2 4.39Å; F429-T456 HydrophobicContact CZ-CG2 3.63Å; F429-I460 HydrophobicContact CD2-CD1 3.59Å; F429-I460 HydrophobicContact CD2-CG1 3.95Å; F429-I460 HydrophobicContact CE2-CD1 3.52Å; F429-I460 HydrophobicContact CE2-CG1 3.62Å; F429-I460 HydrophobicContact CG-CD1 4.43Å; F429-I460 HydrophobicContact CZ-CD1 4.32Å; F429-I460 HydrophobicContact CZ-CG1 3.91Å; F429-D462 PolarHBondContact N-OD1 2.79Å; F429-D462 PolarHBondContact N-OD2 2.94Å; F429-T466 HydrophobicContact CB-CG2 4.08Å; F429-T466 HydrophobicContact CD2-CG2 4.46Å; F429-I482 HydrophobicContact CE2-CD1 4.32Å; F429-I482 HydrophobicContact CE2-CG2 4.37Å; F429-M493 HydrophobicContact CE2-CE 3.87Å; F429-M493 HydrophobicContact CE2-SD 4.14Å; F429-M493 HydrophobicContact CZ-CE 3.77Å
430	A	96.7	Very high	95.3	Very high	6 Å²	6	41.4 Å²	41.4	5%	0.05	22%	0.216	C	C	.	.	H	α-helix	trans	-52.9	-38.1	-174	0	0	0	0	0	113.9	V432 N434 D462 Q465 T466 A469	A430-V432 PolarHBondContact O-N 3.22Å; A430-N434 VanDerWaalsContact O-CB 3.28Å; A430-N434 WeakPolarHBondContact O-CB 3.41Å; A430-N434 VanDerWaalsContact O-CG 3.3Å; A430-N434 PolarHBondContact O-N 2.99Å; A430-N434 PolarHBondContact O-ND2 2.85Å; A430-D462 WeakPolarHBondContact CB-OD2 3.2Å; A430-D462 PolarHBondContact N-OD2 2.91Å; A430-Q465 HydrophobicContact CB-CB 3.72Å; A430-T466 PolarHBondContact N-OG1 2.84Å; A430-A469 HydrophobicContact CB-CB 4.37Å
431	P	96.4	Very high	95.5	Very high	54 Å²	54	41 Å²	41	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-61.2	-44.1	179.9	-26	37.5	0	0	0	113.6	H391 N428 F429 Q435	H391-P431 HydrophobicContact CB-CB 4.14Å; H391-P431 HydrophobicContact CB-CG 3.8Å; N428-P431 HydrophobicContact CB-CG 4.37Å; F429-P431 VanDerWaalsContact C-N 3.29Å; F429-P431 VanDerWaalsContact O-N 3.12Å; P431-Q435 WeakPolarHBondContact O-CB 3.3Å; P431-Q435 PolarHBondContact O-N 3.33Å; P431-Q435 VanDerWaalsContact O-N 3.08Å
432	V	95.8	Very high	95.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.5	-43	-179.5	-175.5	0	0	0	0	111.1	A327 F379 H391 F429 A430 N434 Q435 V436 L452	A327-V432 HydrophobicContact CB-CG1 3.7Å; F379-V432 HydrophobicContact CB-CG2 4.15Å; F379-V432 HydrophobicContact CD1-CG2 4.25Å; F379-V432 HydrophobicContact CG-CG2 4.49Å; H391-V432 VanDerWaalsContact O-CG2 3.22Å; H391-V432 WeakPolarHBondContact O-CG2 3.48Å; F429-V432 PolarHBondContact O-N 3.08Å; F429-V432 VanDerWaalsContact O-N 3.14Å; A430-V432 PolarHBondContact O-N 3.22Å; V432-N434 VanDerWaalsContact C-N 3.32Å; V432-N434 PolarHBondContact O-N 3.42Å; V432-Q435 WeakPolarHBondContact O-CB 3.48Å; V432-Q435 PolarHBondContact O-N 3.2Å; V432-Q435 VanDerWaalsContact O-N 3.09Å; V432-V436 PolarHBondContact O-N 3.48Å; V432-V436 VanDerWaalsContact O-N 3.08Å; V432-L452 HydrophobicContact CG1-CD1 4.18Å; V432-L452 HydrophobicContact CG1-CD2 4.28Å
433	I	97.7	Very high	95.4	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-48	176.3	-63.4	169.4	0	0	0	109.9	F429 Q435 V436 A437 L452 M454 T466 A469 V470 L480	F429-I433 HydrophobicContact CB-CD1 3.96Å; F429-I433 PolarHBondContact O-N 3.11Å; I433-Q435 VanDerWaalsContact C-N 3.27Å; I433-Q435 PolarHBondContact O-N 2.83Å; I433-V436 PolarHBondContact O-N 3.14Å; I433-A437 VanDerWaalsContact O-CB 3.23Å; I433-A437 WeakPolarHBondContact O-CB 3.12Å; I433-A437 PolarHBondContact O-N 3.48Å; I433-L452 HydrophobicContact CG1-CD2 4.12Å; I433-M454 HydrophobicContact CD1-SD 4.25Å; I433-M454 HydrophobicContact CG1-SD 3.92Å; I433-T466 HydrophobicContact CD1-CG2 3.96Å; I433-A469 HydrophobicContact CB-CB 4.13Å; I433-A469 HydrophobicContact CG2-CB 3.75Å; I433-V470 HydrophobicContact CD1-CG2 4.4Å; I433-L480 HydrophobicContact CD1-CD2 3.75Å; I433-L480 HydrophobicContact CG1-CD2 4.2Å
434	N	97.8	Very high	95.2	Very high	54 Å²	54	47.2 Å²	47.2	29%	0.289	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-31.4	178.2	-77.7	-57.4	0	0	0	112.9	A430 V432 R438	A430-N434 VanDerWaalsContact O-CB 3.28Å; A430-N434 WeakPolarHBondContact O-CB 3.41Å; A430-N434 VanDerWaalsContact O-CG 3.3Å; A430-N434 PolarHBondContact O-N 2.99Å; A430-N434 PolarHBondContact O-ND2 2.85Å; V432-N434 VanDerWaalsContact C-N 3.32Å; V432-N434 PolarHBondContact O-N 3.42Å; N434-R438 VanDerWaalsContact O-CG 3.28Å; N434-R438 WeakPolarHBondContact O-CG 3.32Å; N434-R438 PolarHBondContact O-N 2.92Å; N434-R438 VanDerWaalsContact O-N 3.11Å
435	Q	94.8	Very high	95.1	Very high	59 Å²	59	46.8 Å²	46.8	28%	0.276	26%	0.258	S	S	.	.	H	α-helix	trans	-66.5	-48.9	177	179.6	168.3	-12.4	0	0	111.2	Y377 P431 V432 I433 R438	Y377-Q435 PolarHBondContact OH-NE2 2.85Å; P431-Q435 WeakPolarHBondContact O-CB 3.3Å; P431-Q435 PolarHBondContact O-N 3.33Å; P431-Q435 VanDerWaalsContact O-N 3.08Å; V432-Q435 WeakPolarHBondContact O-CB 3.48Å; V432-Q435 PolarHBondContact O-N 3.2Å; V432-Q435 VanDerWaalsContact O-N 3.09Å; I433-Q435 VanDerWaalsContact C-N 3.27Å; I433-Q435 PolarHBondContact O-N 2.83Å; Q435-R438 PolarHBondContact O-N 2.91Å
436	V	96.3	Very high	95	Very high	5 Å²	5	46 Å²	46	3%	0.03	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-40.1	177	-178.7	0	0	0	0	111.2	T325 V432 I433 R438 C439 A440 F450 L452 M478	T325-V436 HydrophobicContact CG2-CG2 3.8Å; V432-V436 PolarHBondContact O-N 3.48Å; V432-V436 VanDerWaalsContact O-N 3.08Å; I433-V436 PolarHBondContact O-N 3.14Å; V436-R438 VanDerWaalsContact C-N 3.26Å; V436-R438 PolarHBondContact O-N 2.97Å; V436-C439 WeakPolarHBondContact O-CB 3.42Å; V436-C439 PolarHBondContact O-N 3.19Å; V436-C439 VanDerWaalsContact O-N 3.1Å; V436-A440 PolarHBondContact O-N 3.16Å; V436-F450 HydrophobicContact CG1-CB 4.08Å; V436-F450 HydrophobicContact CG1-CD1 4.28Å; V436-L452 HydrophobicContact CB-CD2 4.33Å; V436-L452 HydrophobicContact CG1-CB 4.45Å; V436-L452 HydrophobicContact CG2-CD1 4.14Å; V436-L452 HydrophobicContact CG2-CD2 4.02Å; V436-L452 HydrophobicContact CG2-CG 4.45Å; V436-M478 HydrophobicContact CB-CE 3.94Å; V436-M478 HydrophobicContact CG1-CE 3.7Å
437	A	97.4	Very high	95	Very high	10 Å²	10	44.2 Å²	44.2	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-36.3	176.4	0	0	0	0	0	112.5	I433 A440 A441 A473 L476 M478	I433-A437 VanDerWaalsContact O-CB 3.23Å; I433-A437 WeakPolarHBondContact O-CB 3.12Å; I433-A437 PolarHBondContact O-N 3.48Å; A437-A440 PolarHBondContact O-N 3.26Å; A437-A441 WeakPolarHBondContact O-CB 3.27Å; A437-A441 PolarHBondContact O-N 3.27Å; A437-A473 HydrophobicContact CB-CB 4.39Å; A437-L476 HydrophobicContact CB-CD1 3.83Å; A437-L476 VanDerWaalsContact O-CD1 3.25Å; A437-L476 WeakPolarHBondContact O-CD1 3.36Å; A437-M478 HydrophobicContact CB-SD 3.87Å
438	R	96.1	Very high	95	Very high	181 Å²	181	46.9 Å²	46.9	68%	0.683	25%	0.251	S	S	*	.	H	α-helix	trans	-63.1	-44.1	175	-75.3	170.5	-165.5	165.1	6.1	112	N434 Q435 V436 A441	N434-R438 VanDerWaalsContact O-CG 3.28Å; N434-R438 WeakPolarHBondContact O-CG 3.32Å; N434-R438 PolarHBondContact O-N 2.92Å; N434-R438 VanDerWaalsContact O-N 3.11Å; Q435-R438 PolarHBondContact O-N 2.91Å; V436-R438 VanDerWaalsContact C-N 3.26Å; V436-R438 PolarHBondContact O-N 2.97Å; R438-A441 PolarHBondContact O-N 2.85Å
439	C	93.9	Very high	95.1	Very high	60 Å²	60	45.5 Å²	45.5	41%	0.405	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-44.1	175.5	-60.3	0	0	0	0	111	V436 A441 E442 F450	V436-C439 WeakPolarHBondContact O-CB 3.42Å; V436-C439 PolarHBondContact O-N 3.19Å; V436-C439 VanDerWaalsContact O-N 3.1Å; C439-A441 VanDerWaalsContact C-N 3.28Å; C439-A441 PolarHBondContact O-N 3.07Å; C439-E442 PolarHBondContact O-N 3.5Å; C439-F450 HydrophobicContact CB-CE1 3.9Å; C439-F450 HydrophobicContact CB-CZ 4.24Å
440	A	96.4	Very high	95.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-34.8	177.4	0	0	0	0	0	112.8	V436 A437 E442 V443 F450 L476 P477 M478	V436-A440 PolarHBondContact O-N 3.16Å; A437-A440 PolarHBondContact O-N 3.26Å; A440-E442 PolarHBondContact O-N 3.08Å; A440-V443 PolarHBondContact O-N 3.05Å; A440-V443 VanDerWaalsContact O-N 3.16Å; A440-F450 HydrophobicContact CB-CB 4.35Å; A440-F450 HydrophobicContact CB-CD2 3.62Å; A440-F450 HydrophobicContact CB-CE2 4.1Å; A440-F450 HydrophobicContact CB-CG 4Å; A440-L476 HydrophobicContact CB-CB 4.22Å; A440-P477 HydrophobicContact CB-CG 4.2Å; A440-P477 WeakPolarHBondContact O-CD 3.21Å; A440-P477 WeakPolarHBondContact O-CG 3.46Å; A440-M478 HydrophobicContact CB-CB 4.18Å
441	A	96.4	Very high	95.2	Very high	51 Å²	51	46 Å²	46	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-66.9	-19.6	178.7	0	0	0	0	0	114.3	A437 R438 C439 V443 L476	A437-A441 WeakPolarHBondContact O-CB 3.27Å; A437-A441 PolarHBondContact O-N 3.27Å; R438-A441 PolarHBondContact O-N 2.85Å; C439-A441 VanDerWaalsContact C-N 3.28Å; C439-A441 PolarHBondContact O-N 3.07Å; A441-V443 VanDerWaalsContact C-N 3.28Å; A441-L476 HydrophobicContact CB-CD1 4.13Å; A441-L476 HydrophobicContact CB-CD2 3.94Å
442	E	94.9	Very high	95.2	Very high	169 Å²	169	43.5 Å²	43.5	79%	0.79	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-15.5	175.9	-64.2	-178	172.5	0	0	112.4	C439 A440	C439-E442 PolarHBondContact O-N 3.5Å; A440-E442 PolarHBondContact O-N 3.08Å
443	V	93.4	Very high	95.3	Very high	15 Å²	15	43.5 Å²	43.5	9%	0.091	23%	0.228	C	C	.	.			trans	-107.5	113.3	-177.8	-176.1	0	0	0	0	110.3	A440 A441 Q448 F450 P477	A440-V443 PolarHBondContact O-N 3.05Å; A440-V443 VanDerWaalsContact O-N 3.16Å; A441-V443 VanDerWaalsContact C-N 3.28Å; V443-Q448 HydrophobicContact CG1-CB 4.04Å; V443-Q448 HydrophobicContact CG2-CB 4.29Å; V443-F450 HydrophobicContact CB-CE2 4.32Å; V443-F450 HydrophobicContact CG2-CE2 3.94Å; V443-F450 HydrophobicContact CG2-CZ 4.22Å; V443-P477 HydrophobicContact CB-CG 4.46Å; V443-P477 WeakPolarHBondContact O-CG 2.72Å
444	T	91.3	Very high	95.3	Very high	107 Å²	107	43.4 Å²	43.4	66%	0.656	23%	0.228	S	C	*	.			trans	-121.8	-7.1	-178.5	61.7	0	0	0	0	113.9
445	D	91.9	Very high	95.2	Very high	92 Å²	92	40.9 Å²	40.9	49%	0.492	21%	0.214	S	C	.	.	S	Bend	trans	-93.6	-0.2	-173.5	71.7	-21.3	0	0	0	113.6	S447 R561	D445-S447 VanDerWaalsContact C-N 3.28Å; D445-S447 PolarHBondContact O-N 3.32Å; D445-S447 WeakPolarHBondContact OD1-CB 3.3Å; D445-S447 PolarHBondContact OD1-N 2.94Å; D445-S447 PolarHBondContact OD1-OG 2.81Å; D445-S447 WeakPolarHBondContact OD2-CB 3.2Å; D445-S447 PolarHBondContact OD2-OG 2.9Å; D445-R561 IonicContact OD2-NH1 2.85Å
446	G	90.9	Very high	95.2	Very high	2 Å²	2	38 Å²	38	2%	0.021	20%	0.201	C	C	.	.	S	Bend	trans	74.4	14.5	-176.2	0	0	0	0	0	114.2	T320 Q448 M553	T320-G446 WeakPolarHBondContact CG2-O 3.48Å; T320-G446 PolarHBondContact OG1-O 2.9Å; G446-Q448 VanDerWaalsContact C-N 3.32Å; G446-M553 WeakPolarHBondContact O-CE 3.46Å
447	S	92.3	Very high	95	Very high	23 Å²	23	38.4 Å²	38.4	16%	0.161	20%	0.203	C	C	.	.	S	Bend	trans	-69.8	-29.5	176.8	59.3	0	0	0	0	113.8	T320 Q321 D445	T320-S447 WeakPolarHBondContact CA-O 3.28Å; Q321-S447 PolarHBondContact N-O 3.25Å; D445-S447 VanDerWaalsContact C-N 3.28Å; D445-S447 PolarHBondContact O-N 3.32Å; D445-S447 WeakPolarHBondContact OD1-CB 3.3Å; D445-S447 PolarHBondContact OD1-N 2.94Å; D445-S447 PolarHBondContact OD1-OG 2.81Å; D445-S447 WeakPolarHBondContact OD2-CB 3.2Å; D445-S447 PolarHBondContact OD2-OG 2.9Å
448	Q	94.3	Very high	93.8	Very high	67 Å²	67	38.1 Å²	38.1	31%	0.313	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	141.7	-177.9	-54	172.1	30.9	0	0	109.3	Q321 N323 V443 G446 F450	Q321-Q448 WeakPolarHBondContact O-CA 3.49Å; N323-Q448 PolarHBondContact ND2-OE1 3.28Å; V443-Q448 HydrophobicContact CG1-CB 4.04Å; V443-Q448 HydrophobicContact CG2-CB 4.29Å; G446-Q448 VanDerWaalsContact C-N 3.32Å; Q448-F450 HydrophobicContact CB-CE2 4.08Å
449	Y	96.1	Very high	92.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.5	173.6	-169.4	-88.6	0	0	0	108.6	Q321 L322 N323 V451 P477 M478 S479 L549 Y552	Q321-Y449 PolarHBondContact O-N 3.03Å; L322-Y449 CarbonylContact C-O 3.52Å; L322-Y449 WeakPolarHBondContact CA-O 3.39Å; L322-Y449 HydrophobicContact CD2-CD1 4.2Å; L322-Y449 HydrophobicContact CD2-CG 4.47Å; N323-Y449 PolarHBondContact N-O 3.28Å; Y449-V451 HydrophobicContact CD1-CG2 4.17Å; Y449-V451 HydrophobicContact CE1-CG2 4.37Å; Y449-P477 HydrophobicContact CD2-CB 3.89Å; Y449-P477 HydrophobicContact CE2-CB 4.39Å; Y449-M478 PolarHBondContact OH-O 3.43Å; Y449-S479 VanDerWaalsContact CE1-OG 3.3Å; Y449-S479 WeakPolarHBondContact CE1-OG 3.16Å; Y449-S479 PolarHBondContact OH-OG 3.32Å; Y449-L549 HydrophobicContact CD1-CB 4.39Å; Y449-L549 HydrophobicContact CD1-CD1 4.11Å; Y449-L549 HydrophobicContact CD1-CG 4.46Å; Y449-L549 HydrophobicContact CD2-CB 4.22Å; Y449-L549 HydrophobicContact CD2-CD1 4.16Å; Y449-L549 HydrophobicContact CD2-CG 3.89Å; Y449-L549 HydrophobicContact CE1-CB 4.26Å; Y449-L549 HydrophobicContact CE2-CB 4.08Å; Y449-L549 HydrophobicContact CE2-CG 4.24Å; Y449-L549 HydrophobicContact CG-CB 4.37Å; Y449-L549 HydrophobicContact CG-CD1 3.77Å; Y449-L549 HydrophobicContact CG-CG 4.01Å; Y449-Y552 HydrophobicContact CD2-CD1 4.33Å; Y449-Y552 HydrophobicContact CE2-CD1 4.33Å; Y449-Y552 HydrophobicContact CE2-CG 4.21Å
450	F	97.2	Very high	92.6	Very high	17 Å²	17	31.7 Å²	31.7	8%	0.075	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.2	-169.8	-67.4	-102.1	0	0	0	110.7	N323 V436 C439 A440 V443 Q448 P477 M478 S479	N323-F450 HydrophobicContact CB-CD1 3.76Å; N323-F450 HydrophobicContact CB-CE1 3.99Å; N323-F450 HydrophobicContact CB-CG 4.2Å; N323-F450 WeakPolarHBondContact ND2-CE1 3.43Å; N323-F450 VanDerWaalsContact ND2-CZ 3.25Å; N323-F450 WeakPolarHBondContact ND2-CZ 3.39Å; N323-F450 WeakPolarHBondContact O-CA 3.36Å; V436-F450 HydrophobicContact CG1-CB 4.08Å; V436-F450 HydrophobicContact CG1-CD1 4.28Å; C439-F450 HydrophobicContact CB-CE1 3.9Å; C439-F450 HydrophobicContact CB-CZ 4.24Å; A440-F450 HydrophobicContact CB-CB 4.35Å; A440-F450 HydrophobicContact CB-CD2 3.62Å; A440-F450 HydrophobicContact CB-CE2 4.1Å; A440-F450 HydrophobicContact CB-CG 4Å; V443-F450 HydrophobicContact CB-CE2 4.32Å; V443-F450 HydrophobicContact CG2-CE2 3.94Å; V443-F450 HydrophobicContact CG2-CZ 4.22Å; Q448-F450 HydrophobicContact CB-CE2 4.08Å; F450-P477 PolarHBondContact N-O 3.3Å; F450-M478 HydrophobicContact CB-CB 3.88Å; F450-M478 CarbonylContact O-C 3.57Å; F450-M478 WeakPolarHBondContact O-CA 3.15Å; F450-M478 WeakPolarHBondContact O-CB 3.32Å; F450-S479 PolarHBondContact O-N 3.36Å
451	V	96.9	Very high	92.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	112.6	175.1	-177.5	0	0	0	0	108.5	N323 F324 T325 I365 Y449 I481 I545	N323-V451 PolarHBondContact O-N 3.22Å; F324-V451 HydrophobicContact CD2-CB 4.26Å; F324-V451 HydrophobicContact CD2-CG1 4.21Å; F324-V451 HydrophobicContact CE2-CG1 4.48Å; T325-V451 PolarHBondContact N-O 2.76Å; I365-V451 HydrophobicContact CD1-CB 3.79Å; I365-V451 HydrophobicContact CD1-CG1 3.68Å; I365-V451 HydrophobicContact CD1-CG2 3.95Å; Y449-V451 HydrophobicContact CD1-CG2 4.17Å; Y449-V451 HydrophobicContact CE1-CG2 4.37Å; V451-I481 HydrophobicContact CG1-CD1 3.63Å; V451-I481 HydrophobicContact CG1-CG1 4.32Å; V451-I545 HydrophobicContact CG1-CD1 4.08Å; V451-I545 HydrophobicContact CG2-CD1 4.37Å; V451-I545 HydrophobicContact CG2-CG2 4.21Å
452	L	97.6	Very high	92.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.6	177.1	171.9	55.9	0	0	0	109.7	T325 A327 V432 I433 V436 M454 M478 S479 L480 I481	T325-L452 HydrophobicContact CG2-CD1 3.87Å; T325-L452 CarbonylContact O-C 3.57Å; T325-L452 WeakPolarHBondContact O-CA 3.48Å; A327-L452 HydrophobicContact CB-CD1 3.89Å; V432-L452 HydrophobicContact CG1-CD1 4.18Å; V432-L452 HydrophobicContact CG1-CD2 4.28Å; I433-L452 HydrophobicContact CG1-CD2 4.12Å; V436-L452 HydrophobicContact CB-CD2 4.33Å; V436-L452 HydrophobicContact CG1-CB 4.45Å; V436-L452 HydrophobicContact CG2-CD1 4.14Å; V436-L452 HydrophobicContact CG2-CD2 4.02Å; V436-L452 HydrophobicContact CG2-CG 4.45Å; L452-M454 HydrophobicContact CD1-CG 4.21Å; L452-M454 HydrophobicContact CD2-CG 4.21Å; L452-M454 HydrophobicContact CD2-SD 4.24Å; L452-M454 HydrophobicContact CG-CG 3.92Å; L452-M478 HydrophobicContact CB-CE 4.25Å; L452-M478 HydrophobicContact CD2-CE 4.33Å; L452-S479 PolarHBondContact N-O 3.04Å; L452-L480 HydrophobicContact CB-CD1 4.25Å; L452-L480 HydrophobicContact CD2-CD1 3.89Å; L452-L480 HydrophobicContact CG-CD1 3.85Å; L452-I481 PolarHBondContact O-N 2.89Å
453	L	97.4	Very high	92.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	116.1	168.3	171.9	64.4	0	0	0	110.2	F324 T325 V326 A327 L358 V361 I455 I481 V483	F324-L453 HydrophobicContact CE2-CB 3.59Å; F324-L453 HydrophobicContact CE2-CD2 4.34Å; F324-L453 HydrophobicContact CZ-CB 3.73Å; F324-L453 HydrophobicContact CZ-CD2 3.69Å; F324-L453 HydrophobicContact CZ-CG 4.36Å; T325-L453 PolarHBondContact O-N 2.98Å; V326-L453 CarbonylContact C-O 3.59Å; A327-L453 PolarHBondContact N-O 3.27Å; L358-L453 HydrophobicContact CD1-CD2 4.35Å; V361-L453 HydrophobicContact CB-CD2 4.06Å; V361-L453 HydrophobicContact CG1-CD2 4.17Å; V361-L453 HydrophobicContact CG2-CD2 4.44Å; L453-I455 HydrophobicContact CD1-CG1 4.18Å; L453-I455 HydrophobicContact CD2-CD1 4.15Å; L453-I455 HydrophobicContact CD2-CG1 4.27Å; L453-I455 HydrophobicContact CG-CD1 4.44Å; L453-I455 HydrophobicContact CG-CG1 4.02Å; L453-I481 HydrophobicContact CD1-CB 4.13Å; L453-I481 HydrophobicContact CD1-CG2 3.52Å; L453-V483 HydrophobicContact CD1-CG2 3.73Å
454	M	97	Very high	92.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.6	169.7	-58.7	-164.4	65.2	0	0	110.1	A327 F379 F429 I433 L452 L480 I481 I482 V483	A327-M454 HydrophobicContact CB-CG 4.11Å; A327-M454 CarbonylContact O-C 3.51Å; A327-M454 WeakPolarHBondContact O-CA 3.48Å; F379-M454 HydrophobicContact CD1-CE 4.33Å; F379-M454 HydrophobicContact CE1-CE 3.7Å; F379-M454 HydrophobicContact CZ-CE 3.87Å; F429-M454 HydrophobicContact CB-CE 3.72Å; F429-M454 HydrophobicContact CB-SD 4.24Å; F429-M454 HydrophobicContact CD1-CE 3.5Å; F429-M454 HydrophobicContact CD2-CE 3.91Å; F429-M454 HydrophobicContact CD2-SD 4.16Å; F429-M454 HydrophobicContact CE1-CE 4.09Å; F429-M454 HydrophobicContact CE2-CE 4.44Å; F429-M454 HydrophobicContact CG-CE 3.43Å; F429-M454 VanDerWaalsContact CG-CE 3.43Å; F429-M454 HydrophobicContact CG-SD 4.15Å; I433-M454 HydrophobicContact CD1-SD 4.25Å; I433-M454 HydrophobicContact CG1-SD 3.92Å; L452-M454 HydrophobicContact CD1-CG 4.21Å; L452-M454 HydrophobicContact CD2-CG 4.21Å; L452-M454 HydrophobicContact CD2-SD 4.24Å; L452-M454 HydrophobicContact CG-CG 3.92Å; M454-L480 HydrophobicContact CB-CD1 4.46Å; M454-L480 HydrophobicContact CG-CD1 3.61Å; M454-L480 HydrophobicContact SD-CD1 3.66Å; M454-I481 PolarHBondContact N-O 3.36Å; M454-I482 HydrophobicContact CB-CG1 4.46Å; M454-I482 CarbonylContact O-C 3.57Å; M454-I482 WeakPolarHBondContact O-CA 3.37Å; M454-V483 PolarHBondContact O-N 3.43Å
455	I	96.7	Very high	92.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.8	174.4	-46.3	174.2	0	0	0	108.3	A327 D329 Y354 A357 L358 L453 V483 V485	A327-I455 PolarHBondContact O-N 2.78Å; D329-I455 WeakPolarHBondContact CB-O 3.4Å; D329-I455 PolarHBondContact N-O 2.94Å; Y354-I455 HydrophobicContact CD1-CB 3.77Å; Y354-I455 HydrophobicContact CD1-CG2 3.34Å; Y354-I455 HydrophobicContact CE1-CB 4Å; Y354-I455 HydrophobicContact CE1-CG2 3.62Å; Y354-I455 WeakPolarHBondContact CE1-O 3.35Å; Y354-I455 HydrophobicContact CG-CG2 4.12Å; A357-I455 HydrophobicContact CB-CD1 4.09Å; A357-I455 HydrophobicContact CB-CG2 4.49Å; L358-I455 HydrophobicContact CB-CD1 3.96Å; L453-I455 HydrophobicContact CD1-CG1 4.18Å; L453-I455 HydrophobicContact CD2-CD1 4.15Å; L453-I455 HydrophobicContact CD2-CG1 4.27Å; L453-I455 HydrophobicContact CG-CD1 4.44Å; L453-I455 HydrophobicContact CG-CG1 4.02Å; I455-V483 WeakPolarHBondContact CA-O 3.32Å; I455-V483 HydrophobicContact CG2-CB 4.45Å; I455-V485 HydrophobicContact CG2-CG1 3.81Å; I455-V485 HydrophobicContact CG2-CG2 4.43Å
456	T	95.3	Very high	92.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	155.2	-169.5	-175.2	0	0	0	0	112.3	D329 F429 G458 I482 V483 G484 V485 M493	D329-T456 WeakPolarHBondContact OD2-CB 3.41Å; D329-T456 PolarHBondContact OD2-OG1 2.79Å; F429-T456 HydrophobicContact CE2-CG2 4.39Å; F429-T456 HydrophobicContact CZ-CG2 3.63Å; T456-G458 PolarHBondContact OG1-N 3.14Å; T456-I482 HydrophobicContact CG2-CG2 4.07Å; T456-V483 PolarHBondContact N-O 3.45Å; T456-V483 VanDerWaalsContact N-O 3.09Å; T456-G484 CarbonylContact O-C 3.59Å; T456-G484 WeakPolarHBondContact O-CA 3.05Å; T456-V485 WeakPolarHBondContact O-CG2 3.28Å; T456-V485 PolarHBondContact O-N 3.09Å; T456-M493 HydrophobicContact CG2-CE 3.9Å
457	D	90.7	Very high	92.9	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.07	15%	0.152	C	C	.	.	S	Bend	trans	-95.4	8.1	177.3	73	-40.1	0	0	0	115	S333 N334 L343 Y354 V485 A488	S333-D457 WeakPolarHBondContact CB-OD2 3.21Å; S333-D457 VanDerWaalsContact OG-CG 3.28Å; S333-D457 PolarHBondContact OG-OD1 3.34Å; S333-D457 PolarHBondContact OG-OD2 3.18Å; N334-D457 PolarHBondContact N-OD2 2.7Å; N334-D457 VanDerWaalsContact ND2-CG 3.34Å; N334-D457 PolarHBondContact ND2-OD1 3.17Å; N334-D457 VanDerWaalsContact ND2-OD1 3.15Å; N334-D457 WeakPolarHBondContact OD1-CB 3.36Å; L343-D457 HydrophobicContact CD1-CB 3.46Å; L343-D457 VanDerWaalsContact CD1-CB 3.46Å; Y354-D457 PolarHBondContact OH-N 3.44Å; D457-V485 VanDerWaalsContact CA-O 3.29Å; D457-V485 WeakPolarHBondContact CA-O 3.24Å; D457-V485 HydrophobicContact CB-CG2 4.29Å; D457-A488 WeakPolarHBondContact O-CB 3.41Å
458	G	72.4	Confident	93.1	Very high	3 Å²	3	27.3 Å²	27.3	3%	0.031	15%	0.154	C	C	.	.	S	Bend	trans	109.9	31.8	151.9	0	0	0	0	0	118.8	T456 F490	T456-G458 PolarHBondContact OG1-N 3.14Å; G458-F490 VanDerWaalsContact CA-CE1 3.43Å
459	V	77.9	Confident	93.3	Very high	89 Å²	89	24.1 Å²	24.1	54%	0.539	14%	0.139	S	C	.	.			trans	-138.8	110.5	168.6	-177.6	0	0	0	0	110.6	T427	T427-V459 WeakPolarHBondContact CB-O 3.35Å; T427-V459 WeakPolarHBondContact CG2-O 3.27Å; T427-V459 PolarHBondContact OG1-O 2.8Å
460	I	88.4	Confident	93.3	Very high	17 Å²	17	24.2 Å²	24.2	9%	0.087	14%	0.14	C	C	.	.			trans	-81.9	121.6	171.7	-53.3	-174.9	0	0	0	109.5	F429 D462 M463 T466 M493 L496	F429-I460 HydrophobicContact CD2-CD1 3.59Å; F429-I460 HydrophobicContact CD2-CG1 3.95Å; F429-I460 HydrophobicContact CE2-CD1 3.52Å; F429-I460 HydrophobicContact CE2-CG1 3.62Å; F429-I460 HydrophobicContact CG-CD1 4.43Å; F429-I460 HydrophobicContact CZ-CD1 4.32Å; F429-I460 HydrophobicContact CZ-CG1 3.91Å; I460-D462 VanDerWaalsContact CG2-OD1 3.3Å; I460-D462 WeakPolarHBondContact CG2-OD1 3.13Å; I460-M463 HydrophobicContact CB-CE 4.43Å; I460-M463 HydrophobicContact CD1-CE 4.05Å; I460-M463 HydrophobicContact CD1-SD 4.42Å; I460-M463 HydrophobicContact CG2-CB 4.34Å; I460-T466 HydrophobicContact CD1-CG2 4.31Å; I460-M493 HydrophobicContact CD1-CE 3.91Å; I460-M493 HydrophobicContact CD1-SD 3.31Å; I460-M493 WeakPolarHBondContact CD1-SD 3.06Å; I460-M493 HydrophobicContact CG1-CE 3.37Å; I460-M493 HydrophobicContact CG1-SD 3.48Å; I460-M493 WeakPolarHBondContact CG1-SD 3.31Å; I460-L496 HydrophobicContact CD1-CD1 3.38Å
461	S	92.1	Very high	93.3	Very high	67 Å²	67	23.9 Å²	23.9	47%	0.469	14%	0.139	S	C	.	.	S	Bend	trans	-86.6	-28.3	176.6	-58.4	0	0	0	0	113	P426 T427	P426-S461 WeakPolarHBondContact CB-OG 3.47Å; T427-S461 PolarHBondContact N-OG 2.86Å; T427-S461 VanDerWaalsContact O-CB 3.31Å; T427-S461 WeakPolarHBondContact O-CB 3.3Å; T427-S461 PolarHBondContact O-N 3.33Å; T427-S461 PolarHBondContact O-OG 3.31Å
462	D	94.3	Very high	93.2	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.064	16%	0.155	C	C	.	.			trans	-107.9	42.4	-177.8	69.6	-18.1	0	0	0	113.1	N428 F429 A430 I460 A464 Q465 T466	N428-D462 VanDerWaalsContact CA-CG 3.46Å; N428-D462 VanDerWaalsContact CA-OD1 3.31Å; N428-D462 WeakPolarHBondContact CA-OD1 3.21Å; N428-D462 WeakPolarHBondContact CA-OD2 3.07Å; N428-D462 HydrophobicContact CB-CB 4.31Å; N428-D462 WeakPolarHBondContact CB-OD2 3.34Å; F429-D462 PolarHBondContact N-OD1 2.79Å; F429-D462 PolarHBondContact N-OD2 2.94Å; A430-D462 WeakPolarHBondContact CB-OD2 3.2Å; A430-D462 PolarHBondContact N-OD2 2.91Å; I460-D462 VanDerWaalsContact CG2-OD1 3.3Å; I460-D462 WeakPolarHBondContact CG2-OD1 3.13Å; D462-A464 VanDerWaalsContact C-N 3.3Å; D462-A464 PolarHBondContact O-N 2.76Å; D462-Q465 HydrophobicContact CB-CB 4.22Å; D462-Q465 PolarHBondContact O-N 2.96Å; D462-Q465 PolarHBondContact O-OE1 2.91Å; D462-T466 WeakPolarHBondContact O-CB 3.28Å; D462-T466 PolarHBondContact O-N 3.39Å; D462-T466 PolarHBondContact O-OG1 3.09Å; D462-T466 PolarHBondContact OD1-OG1 2.95Å
463	M	92.5	Very high	93.2	Very high	37 Å²	37	27 Å²	27	18%	0.182	16%	0.156	C	C	.	.	H	α-helix	trans	-52.3	-43.3	-173.1	179.5	56.1	91.9	0	0	113.6	I460 Q465 T466 K467 A492 L496	I460-M463 HydrophobicContact CB-CE 4.43Å; I460-M463 HydrophobicContact CD1-CE 4.05Å; I460-M463 HydrophobicContact CD1-SD 4.42Å; I460-M463 HydrophobicContact CG2-CB 4.34Å; M463-Q465 PolarHBondContact O-N 2.8Å; M463-T466 PolarHBondContact O-N 2.72Å; M463-K467 HydrophobicContact CG-CD 4.48Å; M463-K467 WeakPolarHBondContact O-CG 3.18Å; M463-K467 PolarHBondContact O-N 2.96Å; M463-K467 HydrophobicContact SD-CD 4.37Å; M463-K467 HydrophobicContact SD-CG 4.1Å; M463-A492 HydrophobicContact CE-CB 3.44Å; M463-A492 VanDerWaalsContact CE-CB 3.44Å; M463-A492 WeakPolarHBondContact CE-O 3.43Å; M463-L496 HydrophobicContact CE-CG 4.44Å; M463-L496 HydrophobicContact SD-CD1 4.39Å; M463-L496 HydrophobicContact SD-CD2 4.09Å; M463-L496 HydrophobicContact SD-CG 4.26Å
464	A	94.5	Very high	93.1	Very high	67 Å²	67	27 Å²	27	55%	0.554	16%	0.156	S	C	*	.	H	α-helix	trans	-63.9	-41.5	180	0	0	0	0	0	112.5	D462 E468	D462-A464 VanDerWaalsContact C-N 3.3Å; D462-A464 PolarHBondContact O-N 2.76Å; A464-E468 PolarHBondContact O-N 3.07Å; A464-E468 VanDerWaalsContact O-N 3.11Å
465	Q	96.4	Very high	93.1	Very high	105 Å²	105	28.6 Å²	28.6	49%	0.491	17%	0.167	S	C	.	.	H	α-helix	trans	-70.7	-36	176.6	-62.7	83.4	-13.8	0	0	111.3	A430 D462 M463 E468 A469	A430-Q465 HydrophobicContact CB-CB 3.72Å; D462-Q465 HydrophobicContact CB-CB 4.22Å; D462-Q465 PolarHBondContact O-N 2.96Å; D462-Q465 PolarHBondContact O-OE1 2.91Å; M463-Q465 PolarHBondContact O-N 2.8Å; Q465-E468 PolarHBondContact O-N 3.46Å; Q465-A469 WeakPolarHBondContact O-CB 3.39Å; Q465-A469 PolarHBondContact O-N 3.03Å
466	T	96	Very high	93.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-46.3	176.3	-67.8	0	0	0	0	110.9	F429 A430 I433 I460 D462 M463 E468 A469 V470 L496	F429-T466 HydrophobicContact CB-CG2 4.08Å; F429-T466 HydrophobicContact CD2-CG2 4.46Å; A430-T466 PolarHBondContact N-OG1 2.84Å; I433-T466 HydrophobicContact CD1-CG2 3.96Å; I460-T466 HydrophobicContact CD1-CG2 4.31Å; D462-T466 WeakPolarHBondContact O-CB 3.28Å; D462-T466 PolarHBondContact O-N 3.39Å; D462-T466 PolarHBondContact O-OG1 3.09Å; D462-T466 PolarHBondContact OD1-OG1 2.95Å; M463-T466 PolarHBondContact O-N 2.72Å; T466-E468 VanDerWaalsContact C-N 3.31Å; T466-E468 PolarHBondContact O-N 2.85Å; T466-A469 WeakPolarHBondContact O-CB 3.2Å; T466-A469 PolarHBondContact O-N 2.75Å; T466-A469 VanDerWaalsContact O-N 3.13Å; T466-V470 WeakPolarHBondContact O-CG2 3.43Å; T466-V470 PolarHBondContact O-N 2.72Å; T466-L496 HydrophobicContact CG2-CD1 3.87Å; T466-L496 HydrophobicContact CG2-CD2 4.36Å
467	K	95.5	Very high	93.2	Very high	36 Å²	36	30.2 Å²	30.2	16%	0.157	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-41.4	171.5	-72.5	-179	-177.9	168	0	112.6	M463 A469 V470 V471 E495 L496 V503	M463-K467 HydrophobicContact CG-CD 4.48Å; M463-K467 WeakPolarHBondContact O-CG 3.18Å; M463-K467 PolarHBondContact O-N 2.96Å; M463-K467 HydrophobicContact SD-CD 4.37Å; M463-K467 HydrophobicContact SD-CG 4.1Å; K467-A469 VanDerWaalsContact C-N 3.35Å; K467-V470 PolarHBondContact O-N 2.73Å; K467-V471 WeakPolarHBondContact O-CB 3.22Å; K467-V471 VanDerWaalsContact O-CG2 3.23Å; K467-V471 WeakPolarHBondContact O-CG2 3.48Å; K467-V471 PolarHBondContact O-N 3.18Å; K467-E495 WeakPolarHBondContact CE-OE2 3.25Å; K467-E495 IonicContact NZ-OE1 3.13Å; K467-E495 PolarHBondContact NZ-OE1 3.1Å; K467-E495 IonicContact NZ-OE2 3.22Å; K467-E495 PolarHBondContact NZ-OE2 3.37Å; K467-L496 HydrophobicContact CG-CD2 3.83Å; K467-V503 HydrophobicContact CB-CG1 4.18Å; K467-V503 HydrophobicContact CG-CG1 4.01Å
468	E	96.6	Very high	93.5	Very high	43 Å²	43	29.6 Å²	29.6	20%	0.201	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-40.9	175.4	-174.1	169.7	-165.6	0	0	112	A464 Q465 T466 N472 R506	A464-E468 PolarHBondContact O-N 3.07Å; A464-E468 VanDerWaalsContact O-N 3.11Å; Q465-E468 PolarHBondContact O-N 3.46Å; T466-E468 VanDerWaalsContact C-N 3.31Å; T466-E468 PolarHBondContact O-N 2.85Å; E468-N472 WeakPolarHBondContact O-CB 3.03Å; E468-N472 PolarHBondContact O-N 3.38Å; E468-N472 PolarHBondContact O-ND2 2.99Å; E468-N472 VanDerWaalsContact O-ND2 3.09Å; E468-R506 VanDerWaalsContact CD-CZ 3.5Å; E468-R506 IonicContact OE1-CZ 3.92Å; E468-R506 IonicContact OE1-NE 3.97Å; E468-R506 IonicContact OE1-NH1 2.57Å; E468-R506 PolarHBondContact OE1-NH1 3.37Å; E468-R506 IonicContact OE1-NH2 2.81Å; E468-R506 PolarHBondContact OE1-NH2 2.87Å; E468-R506 IonicContact OE2-CZ 2.57Å; E468-R506 VanDerWaalsContact OE2-CZ 3.22Å; E468-R506 IonicContact OE2-NE 2.81Å; E468-R506 IonicContact OE2-NH1 3.92Å; E468-R506 IonicContact OE2-NH2 2.75Å; E468-R506 PolarHBondContact OE2-NH2 2.72Å
469	A	97.3	Very high	94.7	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-45.2	176.3	0	0	0	0	0	111.8	A430 I433 Q465 T466 K467 N472 A473	A430-A469 HydrophobicContact CB-CB 4.37Å; I433-A469 HydrophobicContact CB-CB 4.13Å; I433-A469 HydrophobicContact CG2-CB 3.75Å; Q465-A469 WeakPolarHBondContact O-CB 3.39Å; Q465-A469 PolarHBondContact O-N 3.03Å; T466-A469 WeakPolarHBondContact O-CB 3.2Å; T466-A469 PolarHBondContact O-N 2.75Å; T466-A469 VanDerWaalsContact O-N 3.13Å; K467-A469 VanDerWaalsContact C-N 3.35Å; A469-N472 PolarHBondContact O-N 2.94Å; A469-A473 WeakPolarHBondContact O-CB 3.31Å; A469-A473 PolarHBondContact O-N 3.19Å
470	V	96.6	Very high	95.5	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-47.7	176.5	171	0	0	0	0	111.1	I433 T466 K467 N472 A473 A474 L480 V503 I514 V515	I433-V470 HydrophobicContact CD1-CG2 4.4Å; T466-V470 WeakPolarHBondContact O-CG2 3.43Å; T466-V470 PolarHBondContact O-N 2.72Å; K467-V470 PolarHBondContact O-N 2.73Å; V470-N472 VanDerWaalsContact C-N 3.31Å; V470-N472 PolarHBondContact O-N 2.9Å; V470-A473 PolarHBondContact O-N 3.45Å; V470-A473 VanDerWaalsContact O-N 3.12Å; V470-A474 PolarHBondContact O-N 3.01Å; V470-L480 HydrophobicContact CG2-CD2 4.11Å; V470-V503 HydrophobicContact CB-CG1 4.47Å; V470-V503 HydrophobicContact CG1-CB 4.28Å; V470-V503 HydrophobicContact CG1-CG1 4.14Å; V470-V503 HydrophobicContact CG1-CG2 4.36Å; V470-I514 HydrophobicContact CG1-CD1 4.21Å; V470-I514 HydrophobicContact CG1-CG1 4.13Å; V470-V515 HydrophobicContact CG1-CG2 3.72Å; V470-V515 HydrophobicContact CG2-CG2 4.15Å
471	V	96.5	Very high	95.9	Very high	11 Å²	11	24.5 Å²	24.5	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-61	-39.7	178.5	170	0	0	0	0	111.7	K467 V503 R508 A510	K467-V471 WeakPolarHBondContact O-CB 3.22Å; K467-V471 VanDerWaalsContact O-CG2 3.23Å; K467-V471 WeakPolarHBondContact O-CG2 3.48Å; K467-V471 PolarHBondContact O-N 3.18Å; V471-V503 HydrophobicContact CG2-CG1 4.18Å; V471-R508 HydrophobicContact CG1-CB 4.29Å; V471-A510 HydrophobicContact CG2-CB 4.31Å
472	N	96.1	Very high	96	Very high	63 Å²	63	21.3 Å²	21.3	34%	0.337	12%	0.119	S	C	.	.	H	α-helix	trans	-72.3	-33.7	176.2	-66.3	-28.6	0	0	0	112.1	E468 A469 V470 S475 R508	E468-N472 WeakPolarHBondContact O-CB 3.03Å; E468-N472 PolarHBondContact O-N 3.38Å; E468-N472 PolarHBondContact O-ND2 2.99Å; E468-N472 VanDerWaalsContact O-ND2 3.09Å; A469-N472 PolarHBondContact O-N 2.94Å; V470-N472 VanDerWaalsContact C-N 3.31Å; V470-N472 PolarHBondContact O-N 2.9Å; N472-S475 PolarHBondContact O-OG 3.37Å; N472-S475 VanDerWaalsContact O-OG 3.1Å; N472-R508 PolarHBondContact OD1-NH2 2.9Å
473	A	97	Very high	96	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.008	12%	0.116	C	C	.	.	H	α-helix	trans	-73.3	-26.2	178.3	0	0	0	0	0	113	A437 A469 V470 S475 L476 M478 I514	A437-A473 HydrophobicContact CB-CB 4.39Å; A469-A473 WeakPolarHBondContact O-CB 3.31Å; A469-A473 PolarHBondContact O-N 3.19Å; V470-A473 PolarHBondContact O-N 3.45Å; V470-A473 VanDerWaalsContact O-N 3.12Å; A473-S475 PolarHBondContact O-N 3.01Å; A473-L476 VanDerWaalsContact O-CB 3.3Å; A473-L476 WeakPolarHBondContact O-CB 3.28Å; A473-L476 PolarHBondContact O-N 2.75Å; A473-M478 HydrophobicContact CB-CG 4.14Å; A473-M478 HydrophobicContact CB-SD 3.62Å; A473-I514 HydrophobicContact CB-CD1 3.69Å
474	A	96.1	Very high	96.1	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.9	-177.4	0	0	0	0	0	114.1	V470 L476 A510 R512 I514	V470-A474 PolarHBondContact O-N 3.01Å; A474-L476 VanDerWaalsContact C-N 3.35Å; A474-A510 HydrophobicContact CB-CB 3.7Å; A474-R512 PolarHBondContact O-NE 3.41Å; A474-R512 VanDerWaalsContact O-NE 3.12Å; A474-R512 PolarHBondContact O-NH2 3.23Å; A474-I514 HydrophobicContact CB-CD1 4.49Å; A474-I514 HydrophobicContact CB-CG2 4.48Å
475	S	95.3	Very high	96	Very high	34 Å²	34	15.8 Å²	15.8	24%	0.238	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-11.3	175	59.1	0	0	0	0	114.6	N472 A473 E511 R556	N472-S475 PolarHBondContact O-OG 3.37Å; N472-S475 VanDerWaalsContact O-OG 3.1Å; A473-S475 PolarHBondContact O-N 3.01Å; S475-E511 WeakPolarHBondContact CA-OE2 3.07Å; S475-E511 VanDerWaalsContact CB-OE2 3.31Å; S475-E511 WeakPolarHBondContact CB-OE2 3.45Å; S475-R556 VanDerWaalsContact CB-NH2 3.29Å; S475-R556 PolarHBondContact O-NE 3.48Å; S475-R556 PolarHBondContact O-NH2 2.94Å
476	L	97.6	Very high	95.6	Very high	33 Å²	33	11.6 Å²	11.6	17%	0.173	7%	0.066	C	C	.	.	S	Bend	trans	-100.9	162.7	-170.7	-54.6	-178.1	0	0	0	111.7	A437 A440 A441 A473 A474 M478 R512 Y552	A437-L476 HydrophobicContact CB-CD1 3.83Å; A437-L476 VanDerWaalsContact O-CD1 3.25Å; A437-L476 WeakPolarHBondContact O-CD1 3.36Å; A440-L476 HydrophobicContact CB-CB 4.22Å; A441-L476 HydrophobicContact CB-CD1 4.13Å; A441-L476 HydrophobicContact CB-CD2 3.94Å; A473-L476 VanDerWaalsContact O-CB 3.3Å; A473-L476 WeakPolarHBondContact O-CB 3.28Å; A473-L476 PolarHBondContact O-N 2.75Å; A474-L476 VanDerWaalsContact C-N 3.35Å; L476-M478 PolarHBondContact O-N 2.74Å; L476-R512 PolarHBondContact O-NH2 3.22Å; L476-Y552 VanDerWaalsContact C-CE2 3.45Å
477	P	97.3	Very high	95.1	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	10%	0.1	C	C	.	.	S	Bend	trans	-74.5	62.6	175.2	32.2	-36.4	0	0	0	110.8	A440 V443 Y449 F450 Y552	A440-P477 HydrophobicContact CB-CG 4.2Å; A440-P477 WeakPolarHBondContact O-CD 3.21Å; A440-P477 WeakPolarHBondContact O-CG 3.46Å; V443-P477 HydrophobicContact CB-CG 4.46Å; V443-P477 WeakPolarHBondContact O-CG 2.72Å; Y449-P477 HydrophobicContact CD2-CB 3.89Å; Y449-P477 HydrophobicContact CE2-CB 4.39Å; F450-P477 PolarHBondContact N-O 3.3Å; P477-Y552 HydrophobicContact CB-CD1 3.99Å; P477-Y552 HydrophobicContact CB-CD2 4.46Å; P477-Y552 HydrophobicContact CB-CE1 3.53Å; P477-Y552 HydrophobicContact CB-CE2 4.03Å; P477-Y552 HydrophobicContact CB-CG 4.44Å; P477-Y552 HydrophobicContact CG-CE1 4.42Å
478	M	97	Very high	94.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	152.1	175.8	85.1	-179	-74.1	0	0	114.2	V436 A437 A440 Y449 F450 L452 A473 L476 I514	V436-M478 HydrophobicContact CB-CE 3.94Å; V436-M478 HydrophobicContact CG1-CE 3.7Å; A437-M478 HydrophobicContact CB-SD 3.87Å; A440-M478 HydrophobicContact CB-CB 4.18Å; Y449-M478 PolarHBondContact OH-O 3.43Å; F450-M478 HydrophobicContact CB-CB 3.88Å; F450-M478 CarbonylContact O-C 3.57Å; F450-M478 WeakPolarHBondContact O-CA 3.15Å; F450-M478 WeakPolarHBondContact O-CB 3.32Å; L452-M478 HydrophobicContact CB-CE 4.25Å; L452-M478 HydrophobicContact CD2-CE 4.33Å; A473-M478 HydrophobicContact CB-CG 4.14Å; A473-M478 HydrophobicContact CB-SD 3.62Å; L476-M478 PolarHBondContact O-N 2.74Å; M478-I514 WeakPolarHBondContact O-CG2 3.48Å
479	S	97.1	Very high	94	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	151.1	167.9	-68.5	0	0	0	0	110.3	Y449 F450 L452 I514 I545 Q548	Y449-S479 VanDerWaalsContact CE1-OG 3.3Å; Y449-S479 WeakPolarHBondContact CE1-OG 3.16Å; Y449-S479 PolarHBondContact OH-OG 3.32Å; F450-S479 PolarHBondContact O-N 3.36Å; L452-S479 PolarHBondContact N-O 3.04Å; S479-I514 CarbonylContact C-O 3.48Å; S479-I545 VanDerWaalsContact CB-CD1 3.46Å; S479-Q548 PolarHBondContact OG-OE1 2.82Å
480	L	96.3	Very high	93.5	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.8	-179.8	172.4	59.5	0	0	0	108.8	I433 L452 M454 V470 I482 I514 V515 Q516	I433-L480 HydrophobicContact CD1-CD2 3.75Å; I433-L480 HydrophobicContact CG1-CD2 4.2Å; L452-L480 HydrophobicContact CB-CD1 4.25Å; L452-L480 HydrophobicContact CD2-CD1 3.89Å; L452-L480 HydrophobicContact CG-CD1 3.85Å; M454-L480 HydrophobicContact CB-CD1 4.46Å; M454-L480 HydrophobicContact CG-CD1 3.61Å; M454-L480 HydrophobicContact SD-CD1 3.66Å; V470-L480 HydrophobicContact CG2-CD2 4.11Å; L480-I482 HydrophobicContact CD1-CG1 4.15Å; L480-I482 HydrophobicContact CD2-CD1 4.08Å; L480-I482 HydrophobicContact CD2-CG1 4.3Å; L480-I482 HydrophobicContact CG-CD1 4.28Å; L480-I482 HydrophobicContact CG-CG1 3.96Å; L480-I514 PolarHBondContact N-O 3.18Å; L480-V515 HydrophobicContact CB-CG2 4.4Å; L480-V515 HydrophobicContact CD2-CG1 4.46Å; L480-V515 HydrophobicContact CD2-CG2 4.1Å; L480-V515 HydrophobicContact CG-CG1 4.48Å; L480-V515 CarbonylContact O-C 3.56Å; L480-V515 VanDerWaalsContact O-CA 3.24Å; L480-V515 WeakPolarHBondContact O-CA 3.28Å; L480-Q516 PolarHBondContact O-N 3.11Å
481	I	95.6	Very high	93.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	130.7	172.3	-66.1	168.3	0	0	0	107.9	V451 L452 L453 M454 V483 Q516 V541 L542 I545	V451-I481 HydrophobicContact CG1-CD1 3.63Å; V451-I481 HydrophobicContact CG1-CG1 4.32Å; L452-I481 PolarHBondContact O-N 2.89Å; L453-I481 HydrophobicContact CD1-CB 4.13Å; L453-I481 HydrophobicContact CD1-CG2 3.52Å; M454-I481 PolarHBondContact N-O 3.36Å; I481-V483 HydrophobicContact CG2-CG2 4.15Å; I481-Q516 CarbonylContact C-O 3.39Å; I481-Q516 WeakPolarHBondContact CA-O 3.29Å; I481-V541 HydrophobicContact CB-CG1 4.39Å; I481-V541 HydrophobicContact CD1-CG1 3.84Å; I481-V541 HydrophobicContact CG1-CG1 4.27Å; I481-V541 HydrophobicContact CG2-CG1 3.32Å; I481-L542 HydrophobicContact CD1-CD2 4.07Å; I481-I545 HydrophobicContact CD1-CD1 4Å; I481-I545 HydrophobicContact CD1-CG1 4.25Å; I481-I545 HydrophobicContact CG1-CD1 4.15Å
482	I	94.4	Very high	92.5	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.9	175.3	-53.9	177.8	0	0	0	108.9	F429 M454 T456 L480 L496 V515 Q516 F517 V518	F429-I482 HydrophobicContact CE2-CD1 4.32Å; F429-I482 HydrophobicContact CE2-CG2 4.37Å; M454-I482 HydrophobicContact CB-CG1 4.46Å; M454-I482 CarbonylContact O-C 3.57Å; M454-I482 WeakPolarHBondContact O-CA 3.37Å; T456-I482 HydrophobicContact CG2-CG2 4.07Å; L480-I482 HydrophobicContact CD1-CG1 4.15Å; L480-I482 HydrophobicContact CD2-CD1 4.08Å; L480-I482 HydrophobicContact CD2-CG1 4.3Å; L480-I482 HydrophobicContact CG-CD1 4.28Å; L480-I482 HydrophobicContact CG-CG1 3.96Å; I482-L496 HydrophobicContact CD1-CD1 4.19Å; I482-V515 HydrophobicContact CD1-CG1 3.95Å; I482-V515 HydrophobicContact CG1-CG1 4.37Å; I482-Q516 PolarHBondContact N-O 2.88Å; I482-F517 HydrophobicContact CB-CD2 4.02Å; I482-F517 HydrophobicContact CG2-CD2 3.87Å; I482-F517 HydrophobicContact CG2-CE2 4.34Å; I482-F517 WeakPolarHBondContact O-CA 3.49Å; I482-F517 VanDerWaalsContact O-CD2 3.31Å; I482-F517 WeakPolarHBondContact O-CD2 3.47Å; I482-V518 PolarHBondContact O-N 3.34Å
483	V	94.6	Very high	92.1	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	113.4	173.6	-179.2	0	0	0	0	109.8	A357 L453 M454 I455 T456 I481 V485 V518 F520 L537 V541	A357-V483 HydrophobicContact CB-CG1 3.88Å; L453-V483 HydrophobicContact CD1-CG2 3.73Å; M454-V483 PolarHBondContact O-N 3.43Å; I455-V483 WeakPolarHBondContact CA-O 3.32Å; I455-V483 HydrophobicContact CG2-CB 4.45Å; T456-V483 PolarHBondContact N-O 3.45Å; T456-V483 VanDerWaalsContact N-O 3.09Å; I481-V483 HydrophobicContact CG2-CG2 4.15Å; V483-V485 HydrophobicContact CG1-CG1 4.42Å; V483-V518 WeakPolarHBondContact CA-O 3.27Å; V483-F520 HydrophobicContact CG1-CB 3.91Å; V483-F520 HydrophobicContact CG1-CD2 4.34Å; V483-L537 HydrophobicContact CG1-CD1 4.45Å; V483-V541 HydrophobicContact CG2-CG2 4.02Å
484	G	93.9	Very high	91.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	120.5	176.6	0	0	0	0	0	111.6	T456 V518 F520	T456-G484 CarbonylContact O-C 3.59Å; T456-G484 WeakPolarHBondContact O-CA 3.05Å; G484-V518 PolarHBondContact N-O 2.73Å; G484-F520 VanDerWaalsContact O-CB 3.26Å; G484-F520 WeakPolarHBondContact O-CB 3.3Å; G484-F520 PolarHBondContact O-N 3.08Å
485	V	92.5	Very high	91.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.195	C	C	.	.			trans	-109.8	154.2	177.1	-61.9	0	0	0	0	111.9	L343 A353 Y354 I455 T456 D457 V483 F520	L343-V485 HydrophobicContact CD1-CG2 4.46Å; A353-V485 HydrophobicContact CB-CB 4.02Å; A353-V485 HydrophobicContact CB-CG1 3.88Å; Y354-V485 HydrophobicContact CD2-CG2 4.04Å; Y354-V485 HydrophobicContact CE1-CG2 4.09Å; Y354-V485 HydrophobicContact CE2-CG2 3.44Å; Y354-V485 VanDerWaalsContact CE2-CG2 3.44Å; Y354-V485 VanDerWaalsContact CZ-CG2 3.45Å; I455-V485 HydrophobicContact CG2-CG1 3.81Å; I455-V485 HydrophobicContact CG2-CG2 4.43Å; T456-V485 WeakPolarHBondContact O-CG2 3.28Å; T456-V485 PolarHBondContact O-N 3.09Å; D457-V485 VanDerWaalsContact CA-O 3.29Å; D457-V485 WeakPolarHBondContact CA-O 3.24Å; D457-V485 HydrophobicContact CB-CG2 4.29Å; V483-V485 HydrophobicContact CG1-CG1 4.42Å; V485-F520 HydrophobicContact CG1-CB 3.93Å; V485-F520 HydrophobicContact CG1-CD1 4.46Å; V485-F520 HydrophobicContact CG1-CG 4.22Å
486	G	88.8	Confident	90.7	Very high	17 Å²	17	33.2 Å²	33.2	18%	0.175	18%	0.184	C	C	.	.	S	Bend	trans	81.2	-168.9	177.8	0	0	0	0	0	114.4
487	P	86.1	Confident	90.1	Very high	110 Å²	110	32.7 Å²	32.7	71%	0.714	18%	0.181	S	C	*	.	S	Bend	trans	-94.9	4.1	-167.3	37	-36.2	0	0	0	114.8	R521	P487-R521 PolarHBondContact O-NH1 3.34Å
488	A	85	Confident	89.1	Confident	26 Å²	26	33 Å²	33	22%	0.215	18%	0.184	C	C	.	.			trans	-63	164.1	-176.6	0	0	0	0	0	113.2	D457 F490 R521	D457-A488 WeakPolarHBondContact O-CB 3.41Å; A488-F490 HydrophobicContact CB-CE1 4.46Å; A488-F490 WeakPolarHBondContact O-CE2 3.47Å; A488-R521 VanDerWaalsContact O-CZ 3.29Å; A488-R521 PolarHBondContact O-NH1 3.11Å; A488-R521 PolarHBondContact O-NH2 3.28Å; A488-R521 VanDerWaalsContact O-NH2 3.14Å
489	E	84	Confident	88.2	Confident	137 Å²	137	37.7 Å²	37.7	64%	0.64	21%	0.209	S	C	*	.			trans	-84.2	135.6	170.5	-61.4	-60.1	166	0	0	109.6
490	F	86.6	Confident	87.2	Confident	2 Å²	2	47 Å²	47	1%	0.009	25%	0.252	C	S	.	.			trans	-112.7	17.4	-170.4	-61.4	-68.8	0	0	0	114	G458 A488 A492 M493 E494 F517 P519	G458-F490 VanDerWaalsContact CA-CE1 3.43Å; A488-F490 HydrophobicContact CB-CE1 4.46Å; A488-F490 WeakPolarHBondContact O-CE2 3.47Å; F490-A492 PolarHBondContact O-N 2.91Å; F490-M493 HydrophobicContact CB-CB 4.43Å; F490-M493 HydrophobicContact CB-CG 4.25Å; F490-M493 HydrophobicContact CD1-CG 4.17Å; F490-M493 WeakPolarHBondContact O-CA 3.33Å; F490-M493 WeakPolarHBondContact O-CB 3.31Å; F490-M493 PolarHBondContact O-N 3.08Å; F490-E494 PolarHBondContact O-N 3.37Å; F490-E494 VanDerWaalsContact O-N 3.07Å; F490-F517 HydrophobicContact CB-CE1 3.64Å; F490-F517 HydrophobicContact CB-CE2 4.32Å; F490-F517 HydrophobicContact CB-CZ 3.36Å; F490-F517 HydrophobicContact CD1-CE2 4.19Å; F490-F517 AromaticContact CD1-CZ 3.81Å; F490-F517 HydrophobicContact CD1-CZ 3.81Å; F490-F517 AromaticContact CD2-CZ 3.88Å; F490-F517 HydrophobicContact CD2-CZ 3.88Å; F490-F517 HydrophobicContact CG-CE1 4.18Å; F490-F517 HydrophobicContact CG-CE2 4.26Å; F490-F517 AromaticContact CG-CZ 3.43Å; F490-F517 HydrophobicContact CG-CZ 3.43Å; F490-F517 VanDerWaalsContact CG-CZ 3.43Å; F490-P519 HydrophobicContact CD2-CB 4.09Å; F490-P519 HydrophobicContact CE2-CB 4.18Å
491	D	86.6	Confident	86.6	Confident	111 Å²	111	51.8 Å²	51.8	59%	0.594	28%	0.282	S	S	*	.	H	α-helix	trans	-48.6	-38.1	179	-52.3	-11.7	0	0	0	113	M493 E494 E495	D491-M493 VanDerWaalsContact C-N 3.31Å; D491-M493 PolarHBondContact O-N 3.35Å; D491-E494 PolarHBondContact O-N 2.84Å; D491-E495 PolarHBondContact O-N 3Å
492	A	85.1	Confident	86.3	Confident	31 Å²	31	56.9 Å²	56.9	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-35	177	0	0	0	0	0	113	M463 F490	M463-A492 HydrophobicContact CE-CB 3.44Å; M463-A492 VanDerWaalsContact CE-CB 3.44Å; M463-A492 WeakPolarHBondContact CE-O 3.43Å; F490-A492 PolarHBondContact O-N 2.91Å
493	M	86.7	Confident	86.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-81	-36.9	179.7	-46.6	-46.3	-170.2	0	0	111.2	F429 T456 I460 F490 D491 E495 L496 D497 F517	F429-M493 HydrophobicContact CE2-CE 3.87Å; F429-M493 HydrophobicContact CE2-SD 4.14Å; F429-M493 HydrophobicContact CZ-CE 3.77Å; T456-M493 HydrophobicContact CG2-CE 3.9Å; I460-M493 HydrophobicContact CD1-CE 3.91Å; I460-M493 HydrophobicContact CD1-SD 3.31Å; I460-M493 WeakPolarHBondContact CD1-SD 3.06Å; I460-M493 HydrophobicContact CG1-CE 3.37Å; I460-M493 HydrophobicContact CG1-SD 3.48Å; I460-M493 WeakPolarHBondContact CG1-SD 3.31Å; F490-M493 HydrophobicContact CB-CB 4.43Å; F490-M493 HydrophobicContact CB-CG 4.25Å; F490-M493 HydrophobicContact CD1-CG 4.17Å; F490-M493 WeakPolarHBondContact O-CA 3.33Å; F490-M493 WeakPolarHBondContact O-CB 3.31Å; F490-M493 PolarHBondContact O-N 3.08Å; D491-M493 VanDerWaalsContact C-N 3.31Å; D491-M493 PolarHBondContact O-N 3.35Å; M493-E495 PolarHBondContact O-N 2.9Å; M493-L496 WeakPolarHBondContact O-CA 3.25Å; M493-L496 WeakPolarHBondContact O-CB 3.18Å; M493-L496 PolarHBondContact O-N 2.89Å; M493-D497 PolarHBondContact O-N 3.35Å; M493-D497 VanDerWaalsContact O-N 3.13Å; M493-F517 HydrophobicContact CB-CB 4.3Å; M493-F517 HydrophobicContact CB-CD1 3.84Å; M493-F517 HydrophobicContact CB-CD2 3.34Å; M493-F517 HydrophobicContact CB-CE1 4Å; M493-F517 HydrophobicContact CB-CE2 3.54Å; M493-F517 HydrophobicContact CB-CG 3.52Å; M493-F517 HydrophobicContact CB-CZ 3.89Å; M493-F517 HydrophobicContact CG-CD2 3.97Å; M493-F517 HydrophobicContact CG-CE2 3.75Å; M493-F517 HydrophobicContact CG-CZ 4.21Å
494	E	85.9	Confident	86	Confident	121 Å²	121	59.7 Å²	59.7	57%	0.565	32%	0.32	S	S	*	.	H	α-helix	trans	-59.9	-35.9	171.5	-65.7	176.5	-176.8	0	0	111	F490 D491 L496 D497 F517	F490-E494 PolarHBondContact O-N 3.37Å; F490-E494 VanDerWaalsContact O-N 3.07Å; D491-E494 PolarHBondContact O-N 2.84Å; E494-L496 PolarHBondContact O-N 3.2Å; E494-D497 WeakPolarHBondContact O-CB 3.35Å; E494-D497 PolarHBondContact O-N 3.35Å; E494-F517 HydrophobicContact CG-CD1 4.15Å; E494-F517 HydrophobicContact CG-CE1 4.25Å
495	E	86.7	Confident	85.9	Confident	107 Å²	107	60.5 Å²	60.5	50%	0.5	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.5	172.5	-164.6	-174.6	-177.9	0	0	113.2	K467 D491 M493	K467-E495 WeakPolarHBondContact CE-OE2 3.25Å; K467-E495 IonicContact NZ-OE1 3.13Å; K467-E495 PolarHBondContact NZ-OE1 3.1Å; K467-E495 IonicContact NZ-OE2 3.22Å; K467-E495 PolarHBondContact NZ-OE2 3.37Å; D491-E495 PolarHBondContact O-N 3Å; M493-E495 PolarHBondContact O-N 2.9Å
496	L	87	Confident	85.8	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-24.3	178.4	-70.3	176.5	0	0	0	113.4	I460 M463 T466 K467 I482 M493 E494 G498 V503 V515	I460-L496 HydrophobicContact CD1-CD1 3.38Å; M463-L496 HydrophobicContact CE-CG 4.44Å; M463-L496 HydrophobicContact SD-CD1 4.39Å; M463-L496 HydrophobicContact SD-CD2 4.09Å; M463-L496 HydrophobicContact SD-CG 4.26Å; T466-L496 HydrophobicContact CG2-CD1 3.87Å; T466-L496 HydrophobicContact CG2-CD2 4.36Å; K467-L496 HydrophobicContact CG-CD2 3.83Å; I482-L496 HydrophobicContact CD1-CD1 4.19Å; M493-L496 WeakPolarHBondContact O-CA 3.25Å; M493-L496 WeakPolarHBondContact O-CB 3.18Å; M493-L496 PolarHBondContact O-N 2.89Å; E494-L496 PolarHBondContact O-N 3.2Å; L496-G498 PolarHBondContact O-N 2.95Å; L496-G498 VanDerWaalsContact O-N 3.14Å; L496-V503 HydrophobicContact CD2-CG1 4.46Å; L496-V503 WeakPolarHBondContact O-CG2 3.36Å; L496-V515 HydrophobicContact CB-CG1 4.15Å; L496-V515 WeakPolarHBondContact O-CB 3.2Å; L496-V515 WeakPolarHBondContact O-CG2 3.49Å
497	D	85.1	Confident	85.8	Confident	22 Å²	22	72.4 Å²	72.4	12%	0.118	39%	0.387	C	S	.	.	S	Bend	trans	-59.8	-23	-174.7	-150.8	22.8	0	0	0	113.3	M493 E494 D499 Q516 F517	M493-D497 PolarHBondContact O-N 3.35Å; M493-D497 VanDerWaalsContact O-N 3.13Å; E494-D497 WeakPolarHBondContact O-CB 3.35Å; E494-D497 PolarHBondContact O-N 3.35Å; D497-D499 PolarHBondContact O-N 2.84Å; D497-Q516 WeakPolarHBondContact OD1-CA 3.43Å; D497-F517 HydrophobicContact CB-CB 4.28Å; D497-F517 PolarHBondContact OD1-N 2.93Å
498	G	76.3	Confident	86.1	Confident	6 Å²	6	73.7 Å²	73.7	6%	0.062	38%	0.378	C	S	.	.			trans	76	-14.1	168.7	0	0	0	0	0	115.9	L496 E500 V501 D513	L496-G498 PolarHBondContact O-N 2.95Å; L496-G498 VanDerWaalsContact O-N 3.14Å; G498-E500 PolarHBondContact O-N 2.78Å; G498-V501 CarbonylContact O-C 3.57Å; G498-V501 PolarHBondContact O-N 2.95Å; G498-D513 WeakPolarHBondContact CA-OD2 3.4Å
499	D	77.9	Confident	86.5	Confident	99 Å²	99	78.8 Å²	78.8	53%	0.529	40%	0.396	S	S	.	.	S	Bend	trans	-52.9	-51.5	179.7	-87.3	-5.9	0	0	0	114.3	D497	D497-D499 PolarHBondContact O-N 2.84Å
500	E	75.9	Confident	87	Confident	195 Å²	195	72.7 Å²	72.7	91%	0.911	37%	0.368	S	S	*	.	S	Bend	trans	-82.4	-44.2	178.7	-64.3	-164.9	164.6	0	0	111.8	G498	G498-E500 PolarHBondContact O-N 2.78Å
501	V	83.1	Confident	87.3	Confident	104 Å²	104	78.4 Å²	78.4	63%	0.63	40%	0.395	S	S	*	.	S	Bend	trans	-139.5	117.3	-173.8	-177.3	0	0	0	0	109.5	G498 V503	G498-V501 CarbonylContact O-C 3.57Å; G498-V501 PolarHBondContact O-N 2.95Å; V501-V503 PolarHBondContact O-N 2.63Å
502	R	89.4	Confident	87.6	Confident	107 Å²	107	73.6 Å²	73.6	40%	0.404	37%	0.369	S	S	.	.			trans	-53.4	126.2	176.6	-164.4	73.1	67.3	-157.8	-0.3	110.9	S504 F509 A510 D513	R502-S504 PolarHBondContact O-N 3.36Å; R502-F509 HydrophobicContact CB-CD1 4.32Å; R502-A510 HydrophobicContact CG-CB 4.14Å; R502-A510 WeakPolarHBondContact CG-O 3.48Å; R502-D513 IonicContact CZ-OD2 2.72Å; R502-D513 VanDerWaalsContact NH1-N 3.14Å; R502-D513 IonicContact NH1-OD2 3.3Å; R502-D513 PolarHBondContact NH1-OD2 2.99Å
503	V	90.9	Very high	88	Confident	8 Å²	8	73.2 Å²	73.2	5%	0.048	36%	0.363	C	S	.	.			trans	-54.4	135	179.1	-177.2	0	0	0	0	110.5	K467 V470 V471 L496 V501 A510	K467-V503 HydrophobicContact CB-CG1 4.18Å; K467-V503 HydrophobicContact CG-CG1 4.01Å; V470-V503 HydrophobicContact CB-CG1 4.47Å; V470-V503 HydrophobicContact CG1-CB 4.28Å; V470-V503 HydrophobicContact CG1-CG1 4.14Å; V470-V503 HydrophobicContact CG1-CG2 4.36Å; V471-V503 HydrophobicContact CG2-CG1 4.18Å; L496-V503 HydrophobicContact CD2-CG1 4.46Å; L496-V503 WeakPolarHBondContact O-CG2 3.36Å; V501-V503 PolarHBondContact O-N 2.63Å; V503-A510 PolarHBondContact O-N 2.93Å
504	S	92.2	Very high	88.3	Confident	51 Å²	51	73.3 Å²	73.3	36%	0.357	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	149.4	178.6	70.8	0	0	0	0	112.4	R502 R508	R502-S504 PolarHBondContact O-N 3.36Å; S504-R508 CarbonylContact C-O 3.43Å; S504-R508 VanDerWaalsContact CA-O 3.22Å; S504-R508 WeakPolarHBondContact CA-O 3.41Å; S504-R508 WeakPolarHBondContact CB-O 3.42Å
505	S	92.9	Very high	88.8	Confident	16 Å²	16	67.6 Å²	67.6	11%	0.112	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	130.5	175.9	-175.3	0	0	0	0	110	G507 R508	S505-G507 PolarHBondContact O-N 2.97Å; S505-G507 VanDerWaalsContact O-N 3.15Å; S505-R508 PolarHBondContact N-O 3.16Å; S505-R508 PolarHBondContact O-N 3.43Å
506	R	90.5	Very high	89.1	Confident	196 Å²	196	63.4 Å²	63.4	74%	0.74	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	38.5	-179.8	-55.7	-178.1	-176.3	159.3	6.5	113.6	E468 R508	E468-R506 VanDerWaalsContact CD-CZ 3.5Å; E468-R506 IonicContact OE1-CZ 3.92Å; E468-R506 IonicContact OE1-NE 3.97Å; E468-R506 IonicContact OE1-NH1 2.57Å; E468-R506 PolarHBondContact OE1-NH1 3.37Å; E468-R506 IonicContact OE1-NH2 2.81Å; E468-R506 PolarHBondContact OE1-NH2 2.87Å; E468-R506 IonicContact OE2-CZ 2.57Å; E468-R506 VanDerWaalsContact OE2-CZ 3.22Å; E468-R506 IonicContact OE2-NE 2.81Å; E468-R506 IonicContact OE2-NH1 3.92Å; E468-R506 IonicContact OE2-NH2 2.75Å; E468-R506 PolarHBondContact OE2-NH2 2.72Å; R506-R508 VanDerWaalsContact C-N 3.31Å; R506-R508 PolarHBondContact O-N 3.32Å
507	G	87.8	Confident	89.3	Confident	71 Å²	71	63.9 Å²	63.9	73%	0.732	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	5.4	179	0	0	0	0	0	115.5	S505	S505-G507 PolarHBondContact O-N 2.97Å; S505-G507 VanDerWaalsContact O-N 3.15Å
508	R	92.9	Very high	89.6	Confident	137 Å²	137	63 Å²	63	52%	0.517	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.6	170.4	-61.6	-172.8	-61	162.6	9	109.6	V471 N472 S504 S505 R506	V471-R508 HydrophobicContact CG1-CB 4.29Å; N472-R508 PolarHBondContact OD1-NH2 2.9Å; S504-R508 CarbonylContact C-O 3.43Å; S504-R508 VanDerWaalsContact CA-O 3.22Å; S504-R508 WeakPolarHBondContact CA-O 3.41Å; S504-R508 WeakPolarHBondContact CB-O 3.42Å; S505-R508 PolarHBondContact N-O 3.16Å; S505-R508 PolarHBondContact O-N 3.43Å; R506-R508 VanDerWaalsContact C-N 3.31Å; R506-R508 PolarHBondContact O-N 3.32Å
509	F	93.5	Very high	90.3	Very high	134 Å²	134	63.8 Å²	63.8	59%	0.588	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	149.2	174.2	-68.5	-89.8	0	0	0	110.3	R502	R502-F509 HydrophobicContact CB-CD1 4.32Å
510	A	93.7	Very high	90.8	Very high	8 Å²	8	59.4 Å²	59.4	7%	0.066	29%	0.294	C	S	.	.			trans	-59.8	136.6	169.9	0	0	0	0	0	110.5	V471 A474 R502 V503 R512	V471-A510 HydrophobicContact CG2-CB 4.31Å; A474-A510 HydrophobicContact CB-CB 3.7Å; R502-A510 HydrophobicContact CG-CB 4.14Å; R502-A510 WeakPolarHBondContact CG-O 3.48Å; V503-A510 PolarHBondContact O-N 2.93Å; A510-R512 VanDerWaalsContact C-N 3.26Å; A510-R512 PolarHBondContact O-N 3.35Å
511	E	92.8	Very high	91.2	Very high	122 Å²	122	54.6 Å²	54.6	57%	0.57	27%	0.268	S	S	*	.	S	Bend	trans	-64.8	-31.1	-178.5	-68.1	-174.4	175.7	0	0	112.6	S475 R556	S475-E511 WeakPolarHBondContact CA-OE2 3.07Å; S475-E511 VanDerWaalsContact CB-OE2 3.31Å; S475-E511 WeakPolarHBondContact CB-OE2 3.45Å; E511-R556 IonicContact OE2-CZ 3.81Å; E511-R556 IonicContact OE2-NH2 2.78Å; E511-R556 PolarHBondContact OE2-NH2 3.17Å
512	R	93.2	Very high	91.3	Very high	11 Å²	11	55 Å²	55	4%	0.042	27%	0.266	C	S	.	.	S	Bend	trans	-145.1	164.8	-177.8	-62.3	-179.2	-60.2	109.3	5.1	109.2	A474 L476 A510 Q548 S551	A474-R512 PolarHBondContact O-NE 3.41Å; A474-R512 VanDerWaalsContact O-NE 3.12Å; A474-R512 PolarHBondContact O-NH2 3.23Å; L476-R512 PolarHBondContact O-NH2 3.22Å; A510-R512 VanDerWaalsContact C-N 3.26Å; A510-R512 PolarHBondContact O-N 3.35Å; R512-Q548 PolarHBondContact NH1-O 3.39Å; R512-S551 WeakPolarHBondContact CD-OG 3.38Å
513	D	92.8	Very high	90.8	Very high	23 Å²	23	51.7 Å²	51.7	12%	0.123	25%	0.254	C	S	.	.			trans	-74.3	138.6	160.8	-129	-45.4	0	0	0	111	G498 R502 V515	G498-D513 WeakPolarHBondContact CA-OD2 3.4Å; R502-D513 IonicContact CZ-OD2 2.72Å; R502-D513 VanDerWaalsContact NH1-N 3.14Å; R502-D513 IonicContact NH1-OD2 3.3Å; R502-D513 PolarHBondContact NH1-OD2 2.99Å; D513-V515 PolarHBondContact OD1-N 3.48Å
514	I	94.8	Very high	89.8	Confident	2 Å²	2	56 Å²	56	1%	0.01	28%	0.276	C	S	.	.			trans	-141.2	-2.3	176.9	64	159.7	0	0	0	112.3	V470 A473 A474 M478 S479 L480	V470-I514 HydrophobicContact CG1-CD1 4.21Å; V470-I514 HydrophobicContact CG1-CG1 4.13Å; A473-I514 HydrophobicContact CB-CD1 3.69Å; A474-I514 HydrophobicContact CB-CD1 4.49Å; A474-I514 HydrophobicContact CB-CG2 4.48Å; M478-I514 WeakPolarHBondContact O-CG2 3.48Å; S479-I514 CarbonylContact C-O 3.48Å; L480-I514 PolarHBondContact N-O 3.18Å
515	V	94.8	Very high	88.5	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.8	-176.6	-174	0	0	0	0	108.2	V470 L480 I482 L496 D513	V470-V515 HydrophobicContact CG1-CG2 3.72Å; V470-V515 HydrophobicContact CG2-CG2 4.15Å; L480-V515 HydrophobicContact CB-CG2 4.4Å; L480-V515 HydrophobicContact CD2-CG1 4.46Å; L480-V515 HydrophobicContact CD2-CG2 4.1Å; L480-V515 HydrophobicContact CG-CG1 4.48Å; L480-V515 CarbonylContact O-C 3.56Å; L480-V515 VanDerWaalsContact O-CA 3.24Å; L480-V515 WeakPolarHBondContact O-CA 3.28Å; I482-V515 HydrophobicContact CD1-CG1 3.95Å; I482-V515 HydrophobicContact CG1-CG1 4.37Å; L496-V515 HydrophobicContact CB-CG1 4.15Å; L496-V515 WeakPolarHBondContact O-CB 3.2Å; L496-V515 WeakPolarHBondContact O-CG2 3.49Å; D513-V515 PolarHBondContact OD1-N 3.48Å
516	Q	93.2	Very high	86.7	Confident	20 Å²	20	68.4 Å²	68.4	9%	0.093	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.8	165.3	178	62.8	46.4	0	0	108.2	L480 I481 I482 D497 V518 E544	L480-Q516 PolarHBondContact O-N 3.11Å; I481-Q516 CarbonylContact C-O 3.39Å; I481-Q516 WeakPolarHBondContact CA-O 3.29Å; I482-Q516 PolarHBondContact N-O 2.88Å; D497-Q516 WeakPolarHBondContact OD1-CA 3.43Å; Q516-V518 HydrophobicContact CG-CG2 4.09Å; Q516-E544 PolarHBondContact OE1-OE1 3.17Å; Q516-E544 PolarHBondContact OE1-OE2 3.32Å
517	F	92.1	Very high	85.2	Confident	10 Å²	10	63 Å²	63	4%	0.044	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.2	173.6	174.7	-111.3	0	0	0	111.2	I482 F490 M493 E494 D497 P519	I482-F517 HydrophobicContact CB-CD2 4.02Å; I482-F517 HydrophobicContact CG2-CD2 3.87Å; I482-F517 HydrophobicContact CG2-CE2 4.34Å; I482-F517 WeakPolarHBondContact O-CA 3.49Å; I482-F517 VanDerWaalsContact O-CD2 3.31Å; I482-F517 WeakPolarHBondContact O-CD2 3.47Å; F490-F517 HydrophobicContact CB-CE1 3.64Å; F490-F517 HydrophobicContact CB-CE2 4.32Å; F490-F517 HydrophobicContact CB-CZ 3.36Å; F490-F517 HydrophobicContact CD1-CE2 4.19Å; F490-F517 AromaticContact CD1-CZ 3.81Å; F490-F517 HydrophobicContact CD1-CZ 3.81Å; F490-F517 AromaticContact CD2-CZ 3.88Å; F490-F517 HydrophobicContact CD2-CZ 3.88Å; F490-F517 HydrophobicContact CG-CE1 4.18Å; F490-F517 HydrophobicContact CG-CE2 4.26Å; F490-F517 AromaticContact CG-CZ 3.43Å; F490-F517 HydrophobicContact CG-CZ 3.43Å; F490-F517 VanDerWaalsContact CG-CZ 3.43Å; M493-F517 HydrophobicContact CB-CB 4.3Å; M493-F517 HydrophobicContact CB-CD1 3.84Å; M493-F517 HydrophobicContact CB-CD2 3.34Å; M493-F517 HydrophobicContact CB-CE1 4Å; M493-F517 HydrophobicContact CB-CE2 3.54Å; M493-F517 HydrophobicContact CB-CG 3.52Å; M493-F517 HydrophobicContact CB-CZ 3.89Å; M493-F517 HydrophobicContact CG-CD2 3.97Å; M493-F517 HydrophobicContact CG-CE2 3.75Å; M493-F517 HydrophobicContact CG-CZ 4.21Å; E494-F517 HydrophobicContact CG-CD1 4.15Å; E494-F517 HydrophobicContact CG-CE1 4.25Å; D497-F517 HydrophobicContact CB-CB 4.28Å; D497-F517 PolarHBondContact OD1-N 2.93Å; F517-P519 HydrophobicContact CE1-CB 4.35Å; F517-P519 HydrophobicContact CE1-CG 4.37Å; F517-P519 HydrophobicContact CZ-CB 4.11Å
518	V	90.8	Very high	83.8	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	120.6	174.9	-176.6	0	0	0	0	111.1	I482 V483 G484 Q516 F520 Y523 L537 V541	I482-V518 PolarHBondContact O-N 3.34Å; V483-V518 WeakPolarHBondContact CA-O 3.27Å; G484-V518 PolarHBondContact N-O 2.73Å; Q516-V518 HydrophobicContact CG-CG2 4.09Å; V518-F520 PolarHBondContact O-N 3.38Å; V518-Y523 HydrophobicContact CG1-CD2 4.21Å; V518-Y523 HydrophobicContact CG1-CE2 3.29Å; V518-L537 HydrophobicContact CG1-CD1 3.77Å; V518-V541 HydrophobicContact CB-CG2 3.69Å; V518-V541 HydrophobicContact CG1-CG2 4.05Å; V518-V541 HydrophobicContact CG2-CB 4.39Å; V518-V541 HydrophobicContact CG2-CG2 3.58Å
519	P	91.1	Very high	82.7	Confident	22 Å²	22	58.6 Å²	58.6	14%	0.143	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114.5	172.3	30.5	-34.4	0	0	0	111	F490 F517 R521 D522 Y523	F490-P519 HydrophobicContact CD2-CB 4.09Å; F490-P519 HydrophobicContact CE2-CB 4.18Å; F517-P519 HydrophobicContact CE1-CB 4.35Å; F517-P519 HydrophobicContact CE1-CG 4.37Å; F517-P519 HydrophobicContact CZ-CB 4.11Å; P519-R521 HydrophobicContact CB-CG 4.24Å; P519-R521 PolarHBondContact O-N 2.92Å; P519-R521 VanDerWaalsContact O-N 3.11Å; P519-D522 WeakPolarHBondContact CG-OD2 3.21Å; P519-D522 PolarHBondContact O-N 2.88Å; P519-Y523 WeakPolarHBondContact O-CD2 3.22Å; P519-Y523 WeakPolarHBondContact O-CE2 3.27Å
520	F	88.4	Confident	81.7	Confident	8 Å²	8	56 Å²	56	4%	0.035	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-58.1	-30.1	-178.4	-174.9	-99.9	0	0	0	113.4	A353 M356 A357 V483 G484 V485 V518 D522 Y523 I524 L537	A353-F520 HydrophobicContact CB-CD1 3.97Å; A353-F520 HydrophobicContact CB-CE1 3.89Å; M356-F520 HydrophobicContact CB-CE2 4.14Å; M356-F520 HydrophobicContact CB-CZ 3.7Å; M356-F520 HydrophobicContact CE-CE1 3.9Å; M356-F520 HydrophobicContact CE-CZ 3.85Å; M356-F520 HydrophobicContact SD-CZ 4.37Å; A357-F520 HydrophobicContact CB-CD2 3.96Å; A357-F520 HydrophobicContact CB-CE2 4.08Å; V483-F520 HydrophobicContact CG1-CB 3.91Å; V483-F520 HydrophobicContact CG1-CD2 4.34Å; G484-F520 VanDerWaalsContact O-CB 3.26Å; G484-F520 WeakPolarHBondContact O-CB 3.3Å; G484-F520 PolarHBondContact O-N 3.08Å; V485-F520 HydrophobicContact CG1-CB 3.93Å; V485-F520 HydrophobicContact CG1-CD1 4.46Å; V485-F520 HydrophobicContact CG1-CG 4.22Å; V518-F520 PolarHBondContact O-N 3.38Å; F520-D522 PolarHBondContact O-N 3Å; F520-Y523 PolarHBondContact O-N 2.81Å; F520-I524 HydrophobicContact CD1-CD1 3.66Å; F520-I524 HydrophobicContact CD1-CG1 3.85Å; F520-I524 HydrophobicContact CE1-CD1 3.48Å; F520-I524 VanDerWaalsContact CE1-CD1 3.48Å; F520-I524 HydrophobicContact CE1-CG1 3.55Å; F520-I524 HydrophobicContact CZ-CG1 4.34Å; F520-L537 HydrophobicContact CD2-CD1 3.92Å; F520-L537 HydrophobicContact CD2-CD2 3.45Å; F520-L537 VanDerWaalsContact CD2-CD2 3.45Å; F520-L537 HydrophobicContact CD2-CG 4.27Å; F520-L537 HydrophobicContact CE2-CD2 3.57Å
521	R	85.1	Confident	80.7	Confident	93 Å²	93	59.2 Å²	59.2	35%	0.351	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-60.2	-25.2	-178.3	61.6	179.1	170	-158.6	-1.1	113.8	P487 A488 P519 Y523	P487-R521 PolarHBondContact O-NH1 3.34Å; A488-R521 VanDerWaalsContact O-CZ 3.29Å; A488-R521 PolarHBondContact O-NH1 3.11Å; A488-R521 PolarHBondContact O-NH2 3.28Å; A488-R521 VanDerWaalsContact O-NH2 3.14Å; P519-R521 HydrophobicContact CB-CG 4.24Å; P519-R521 PolarHBondContact O-N 2.92Å; P519-R521 VanDerWaalsContact O-N 3.11Å; R521-Y523 PolarHBondContact O-N 3.41Å
522	D	83.6	Confident	80	Confident	112 Å²	112	55.9 Å²	55.9	60%	0.599	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-74.7	-15.1	-177.2	-66.6	-4.6	0	0	0	112.4	P519 F520	P519-D522 WeakPolarHBondContact CG-OD2 3.21Å; P519-D522 PolarHBondContact O-N 2.88Å; F520-D522 PolarHBondContact O-N 3Å
523	Y	79.4	Confident	79.3	Confident	38 Å²	38	56.1 Å²	56.1	15%	0.149	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-107.1	-9.3	-175.4	-55.3	-82.1	0	0	0	113.6	V518 P519 F520 R521 D525 S533 R536 L537 D540	V518-Y523 HydrophobicContact CG1-CD2 4.21Å; V518-Y523 HydrophobicContact CG1-CE2 3.29Å; P519-Y523 WeakPolarHBondContact O-CD2 3.22Å; P519-Y523 WeakPolarHBondContact O-CE2 3.27Å; F520-Y523 PolarHBondContact O-N 2.81Å; R521-Y523 PolarHBondContact O-N 3.41Å; Y523-D525 PolarHBondContact O-N 2.79Å; Y523-D525 VanDerWaalsContact O-N 3.1Å; Y523-S533 WeakPolarHBondContact O-CA 3.19Å; Y523-S533 WeakPolarHBondContact O-CB 3.07Å; Y523-S533 PolarHBondContact O-OG 3.11Å; Y523-S533 VanDerWaalsContact O-OG 3.11Å; Y523-R536 HydrophobicContact CD1-CB 3.63Å; Y523-R536 HydrophobicContact CE1-CB 4.2Å; Y523-L537 HydrophobicContact CD2-CB 4.34Å; Y523-L537 HydrophobicContact CD2-CD1 3.71Å; Y523-L537 HydrophobicContact CE2-CD1 4.08Å; Y523-L537 HydrophobicContact CG-CB 4.13Å; Y523-L537 HydrophobicContact CG-CD1 4.34Å; Y523-D540 VanDerWaalsContact CE1-OD2 3.28Å; Y523-D540 WeakPolarHBondContact CE1-OD2 3.4Å; Y523-D540 PolarHBondContact OH-OD2 2.83Å
524	I	71.1	Confident	78.7	Confident	100 Å²	100	56.9 Å²	56.9	51%	0.513	29%	0.294	S	S	.	.			trans	-76.8	99.9	177.2	-53.9	178.9	0	0	0	109.1	F520	F520-I524 HydrophobicContact CD1-CD1 3.66Å; F520-I524 HydrophobicContact CD1-CG1 3.85Å; F520-I524 HydrophobicContact CE1-CD1 3.48Å; F520-I524 VanDerWaalsContact CE1-CD1 3.48Å; F520-I524 HydrophobicContact CE1-CG1 3.55Å; F520-I524 HydrophobicContact CZ-CG1 4.34Å
525	D	63.3	Low	78	Confident	72 Å²	72	57.9 Å²	57.9	39%	0.385	30%	0.303	S	S	.	.			trans	-73.1	138.3	174.9	-168.4	-4	0	0	0	111.7	Y523 S527 G528	Y523-D525 PolarHBondContact O-N 2.79Å; Y523-D525 VanDerWaalsContact O-N 3.1Å; D525-S527 PolarHBondContact O-N 2.83Å; D525-S527 PolarHBondContact OD1-N 2.96Å; D525-S527 VanDerWaalsContact OD2-CB 3.31Å; D525-S527 WeakPolarHBondContact OD2-CB 3.37Å; D525-S527 PolarHBondContact OD2-OG 2.9Å; D525-G528 PolarHBondContact O-N 3.23Å
526	R	55.5	Low	77.5	Confident	255 Å²	255	64.1 Å²	64.1	96%	0.962	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.5	171.5	-65	-177.5	-178.6	179.7	1.6	112.6	G528	R526-G528 VanDerWaalsContact C-N 3.3Å; R526-G528 PolarHBondContact O-N 2.81Å
527	S	58.4	Low	77.1	Confident	83 Å²	83	63.1 Å²	63.1	58%	0.58	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.1	177.7	78	0	0	0	0	114.6	D525	D525-S527 PolarHBondContact O-N 2.83Å; D525-S527 PolarHBondContact OD1-N 2.96Å; D525-S527 VanDerWaalsContact OD2-CB 3.31Å; D525-S527 WeakPolarHBondContact OD2-CB 3.37Å; D525-S527 PolarHBondContact OD2-OG 2.9Å
528	G	59.1	Low	76.9	Confident	56 Å²	56	62.7 Å²	62.7	58%	0.577	32%	0.32	S	S	*	.			trans	80.9	7.7	176	0	0	0	0	0	115.9	D525 R526 Q530	D525-G528 PolarHBondContact O-N 3.23Å; R526-G528 VanDerWaalsContact C-N 3.3Å; R526-G528 PolarHBondContact O-N 2.81Å; G528-Q530 PolarHBondContact O-N 2.87Å
529	N	70.3	Confident	76.6	Confident	59 Å²	59	64.3 Å²	64.3	32%	0.316	33%	0.327	S	S	.	.			trans	-80.3	83.7	172.4	-165.6	-16.4	0	0	0	111.3	V531 L532 S533	N529-V531 PolarHBondContact O-N 2.78Å; N529-V531 PolarHBondContact OD1-N 3.09Å; N529-L532 HydrophobicContact CB-CD1 4.29Å; N529-L532 VanDerWaalsContact ND2-CD1 3.26Å; N529-L532 WeakPolarHBondContact ND2-CD1 3.43Å; N529-L532 PolarHBondContact O-N 2.97Å; N529-S533 PolarHBondContact O-N 3.32Å; N529-S533 PolarHBondContact O-OG 3.01Å
530	Q	71.9	Confident	76.3	Confident	80 Å²	80	66.6 Å²	66.6	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-56.3	-31.4	179.8	-68.3	-179.3	-19.8	0	0	113	G528 S533 M534	G528-Q530 PolarHBondContact O-N 2.87Å; Q530-S533 PolarHBondContact O-N 3.29Å; Q530-M534 WeakPolarHBondContact O-CB 3.34Å; Q530-M534 WeakPolarHBondContact O-CE 3.43Å; Q530-M534 VanDerWaalsContact O-CG 3.3Å; Q530-M534 WeakPolarHBondContact O-CG 3.41Å; Q530-M534 PolarHBondContact O-N 2.84Å
531	V	74.2	Confident	76.3	Confident	74 Å²	74	66.2 Å²	66.2	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-68	-45.3	-177	-175.1	0	0	0	0	111.4	N529 S533 M534 A535	N529-V531 PolarHBondContact O-N 2.78Å; N529-V531 PolarHBondContact OD1-N 3.09Å; V531-S533 VanDerWaalsContact C-N 3.33Å; V531-M534 PolarHBondContact O-N 3.5Å; V531-A535 WeakPolarHBondContact O-CB 3.2Å; V531-A535 PolarHBondContact O-N 2.87Å
532	L	77.1	Confident	76.5	Confident	53 Å²	53	61.8 Å²	61.8	28%	0.277	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-37.6	176	-77.5	168.3	0	0	0	111.7	L48 N529 A535 R536	L48-L532 HydrophobicContact CD2-CD2 4.36Å; N529-L532 HydrophobicContact CB-CD1 4.29Å; N529-L532 VanDerWaalsContact ND2-CD1 3.26Å; N529-L532 WeakPolarHBondContact ND2-CD1 3.43Å; N529-L532 PolarHBondContact O-N 2.97Å; L532-A535 PolarHBondContact O-N 3.09Å; L532-R536 WeakPolarHBondContact O-CG 3.29Å; L532-R536 PolarHBondContact O-N 2.93Å
533	S	77.9	Confident	76.6	Confident	15 Å²	15	58.8 Å²	58.8	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-47.5	177.6	-55.9	0	0	0	0	111	Y523 N529 Q530 V531 R536 L537	Y523-S533 WeakPolarHBondContact O-CA 3.19Å; Y523-S533 WeakPolarHBondContact O-CB 3.07Å; Y523-S533 PolarHBondContact O-OG 3.11Å; Y523-S533 VanDerWaalsContact O-OG 3.11Å; N529-S533 PolarHBondContact O-N 3.32Å; N529-S533 PolarHBondContact O-OG 3.01Å; Q530-S533 PolarHBondContact O-N 3.29Å; V531-S533 VanDerWaalsContact C-N 3.33Å; S533-R536 PolarHBondContact O-N 2.79Å; S533-L537 PolarHBondContact O-N 3.02Å; S533-L537 VanDerWaalsContact O-N 3.1Å
534	M	80.8	Confident	77	Confident	39 Å²	39	59.1 Å²	59.1	19%	0.192	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-41.3	176.2	-72.1	-176.9	-62	0	0	112.4	A360 Q530 V531 R536 L537 A538	A360-M534 HydrophobicContact CB-CB 3.79Å; A360-M534 HydrophobicContact CB-CG 4.05Å; Q530-M534 WeakPolarHBondContact O-CB 3.34Å; Q530-M534 WeakPolarHBondContact O-CE 3.43Å; Q530-M534 VanDerWaalsContact O-CG 3.3Å; Q530-M534 WeakPolarHBondContact O-CG 3.41Å; Q530-M534 PolarHBondContact O-N 2.84Å; V531-M534 PolarHBondContact O-N 3.5Å; M534-R536 PolarHBondContact O-N 3.03Å; M534-L537 PolarHBondContact O-N 3.06Å; M534-A538 WeakPolarHBondContact O-CB 3.25Å; M534-A538 PolarHBondContact O-N 3.35Å
535	A	80.6	Confident	78	Confident	24 Å²	24	54.4 Å²	54.4	20%	0.198	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-40.5	179.7	0	0	0	0	0	112.4	L48 V531 L532 K539	L48-A535 HydrophobicContact CD1-CB 4.11Å; L48-A535 HydrophobicContact CD2-CB 3.86Å; L48-A535 HydrophobicContact CG-CB 3.95Å; V531-A535 WeakPolarHBondContact O-CB 3.2Å; V531-A535 PolarHBondContact O-N 2.87Å; L532-A535 PolarHBondContact O-N 3.09Å; A535-K539 WeakPolarHBondContact O-CB 3.46Å; A535-K539 PolarHBondContact O-N 3.04Å
536	R	83.4	Confident	79.4	Confident	130 Å²	130	51.9 Å²	51.9	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-41.8	176.3	-68.9	176.2	-179.1	171.3	-0.2	112.5	Y523 L532 S533 M534 A538 K539 D540	Y523-R536 HydrophobicContact CD1-CB 3.63Å; Y523-R536 HydrophobicContact CE1-CB 4.2Å; L532-R536 WeakPolarHBondContact O-CG 3.29Å; L532-R536 PolarHBondContact O-N 2.93Å; S533-R536 PolarHBondContact O-N 2.79Å; M534-R536 PolarHBondContact O-N 3.03Å; R536-A538 VanDerWaalsContact C-N 3.35Å; R536-A538 PolarHBondContact O-N 2.78Å; R536-K539 WeakPolarHBondContact O-CB 3.49Å; R536-K539 PolarHBondContact O-N 2.94Å; R536-D540 PolarHBondContact O-N 3.03Å
537	L	85.7	Confident	81	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-50.7	173.9	176.9	78.8	0	0	0	110.8	A357 A360 V483 V518 F520 Y523 S533 M534 K539 D540 V541	A357-L537 HydrophobicContact CB-CD2 4.16Å; A360-L537 HydrophobicContact CB-CD2 3.97Å; V483-L537 HydrophobicContact CG1-CD1 4.45Å; V518-L537 HydrophobicContact CG1-CD1 3.77Å; F520-L537 HydrophobicContact CD2-CD1 3.92Å; F520-L537 HydrophobicContact CD2-CD2 3.45Å; F520-L537 VanDerWaalsContact CD2-CD2 3.45Å; F520-L537 HydrophobicContact CD2-CG 4.27Å; F520-L537 HydrophobicContact CE2-CD2 3.57Å; Y523-L537 HydrophobicContact CD2-CB 4.34Å; Y523-L537 HydrophobicContact CD2-CD1 3.71Å; Y523-L537 HydrophobicContact CE2-CD1 4.08Å; Y523-L537 HydrophobicContact CG-CB 4.13Å; Y523-L537 HydrophobicContact CG-CD1 4.34Å; S533-L537 PolarHBondContact O-N 3.02Å; S533-L537 VanDerWaalsContact O-N 3.1Å; M534-L537 PolarHBondContact O-N 3.06Å; L537-K539 PolarHBondContact O-N 3.01Å; L537-D540 PolarHBondContact O-N 2.76Å; L537-V541 HydrophobicContact CD1-CG2 4.01Å; L537-V541 HydrophobicContact CG-CG2 4.06Å; L537-V541 VanDerWaalsContact O-CB 3.27Å; L537-V541 WeakPolarHBondContact O-CB 3.38Å; L537-V541 WeakPolarHBondContact O-CG2 3.46Å; L537-V541 PolarHBondContact O-N 2.88Å
538	A	86.5	Confident	82.6	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-36.2	-176.8	0	0	0	0	0	111.5	A360 I364 M534 R536 L542	A360-A538 HydrophobicContact CB-CB 4.44Å; A360-A538 WeakPolarHBondContact O-CB 3.42Å; I364-A538 HydrophobicContact CD1-CB 3.53Å; M534-A538 WeakPolarHBondContact O-CB 3.25Å; M534-A538 PolarHBondContact O-N 3.35Å; R536-A538 VanDerWaalsContact C-N 3.35Å; R536-A538 PolarHBondContact O-N 2.78Å; A538-L542 VanDerWaalsContact O-CB 3.25Å; A538-L542 WeakPolarHBondContact O-CB 3.36Å; A538-L542 WeakPolarHBondContact O-CG 3.49Å; A538-L542 PolarHBondContact O-N 2.87Å
539	K	85.4	Confident	84.3	Confident	37 Å²	37	39.2 Å²	39.2	16%	0.161	21%	0.208	C	C	.	.	H	α-helix	trans	-54.6	-55.1	174.7	-170.7	172.2	-171.6	131.9	0	111.9	T13 E81 E82 A535 R536 L537 A543	T13-K539 PolarHBondContact OG1-NZ 3.28Å; E81-K539 HydrophobicContact CG-CB 4.18Å; E81-K539 HydrophobicContact CG-CG 3.64Å; E82-K539 IonicContact OE1-NZ 2.97Å; E82-K539 PolarHBondContact OE1-NZ 2.94Å; A535-K539 WeakPolarHBondContact O-CB 3.46Å; A535-K539 PolarHBondContact O-N 3.04Å; R536-K539 WeakPolarHBondContact O-CB 3.49Å; R536-K539 PolarHBondContact O-N 2.94Å; L537-K539 PolarHBondContact O-N 3.01Å; K539-A543 WeakPolarHBondContact O-CB 3.47Å; K539-A543 PolarHBondContact O-N 3.13Å; K539-A543 VanDerWaalsContact O-N 3.16Å
540	D	85.6	Confident	85.3	Confident	69 Å²	69	38 Å²	38	37%	0.369	20%	0.201	S	C	.	.	H	α-helix	trans	-76	-32.3	-174.5	-64.8	-4.8	0	0	0	111.4	Y523 R536 L537	Y523-D540 VanDerWaalsContact CE1-OD2 3.28Å; Y523-D540 WeakPolarHBondContact CE1-OD2 3.4Å; Y523-D540 PolarHBondContact OH-OD2 2.83Å; R536-D540 PolarHBondContact O-N 3.03Å; L537-D540 PolarHBondContact O-N 2.76Å
541	V	87.1	Confident	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-38.2	177	164.7	0	0	0	0	113.2	V361 I481 V483 V518 L537	V361-V541 HydrophobicContact CG1-CG1 4.14Å; V361-V541 HydrophobicContact CG2-CB 4.25Å; V361-V541 HydrophobicContact CG2-CG1 3.62Å; V361-V541 HydrophobicContact CG2-CG2 4.48Å; I481-V541 HydrophobicContact CB-CG1 4.39Å; I481-V541 HydrophobicContact CD1-CG1 3.84Å; I481-V541 HydrophobicContact CG1-CG1 4.27Å; I481-V541 HydrophobicContact CG2-CG1 3.32Å; V483-V541 HydrophobicContact CG2-CG2 4.02Å; V518-V541 HydrophobicContact CB-CG2 3.69Å; V518-V541 HydrophobicContact CG1-CG2 4.05Å; V518-V541 HydrophobicContact CG2-CB 4.39Å; V518-V541 HydrophobicContact CG2-CG2 3.58Å; L537-V541 HydrophobicContact CD1-CG2 4.01Å; L537-V541 HydrophobicContact CG-CG2 4.06Å; L537-V541 VanDerWaalsContact O-CB 3.27Å; L537-V541 WeakPolarHBondContact O-CB 3.38Å; L537-V541 WeakPolarHBondContact O-CG2 3.46Å; L537-V541 PolarHBondContact O-N 2.88Å
542	L	89.9	Confident	87.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-97.2	-8.6	-173.2	-68.6	173.6	0	0	0	113.4	F80 E81 V361 I364 I365 I481 A538 E544 I545	F80-L542 HydrophobicContact CD1-CB 4.19Å; F80-L542 WeakPolarHBondContact CD1-O 3.19Å; F80-L542 HydrophobicContact CE1-CB 3.82Å; F80-L542 HydrophobicContact CE1-CD2 4.18Å; F80-L542 HydrophobicContact CE1-CG 4.45Å; F80-L542 WeakPolarHBondContact CE1-O 3.33Å; E81-L542 HydrophobicContact CB-CB 3.78Å; V361-L542 HydrophobicContact CG1-CD2 4Å; V361-L542 HydrophobicContact CG1-CG 4.42Å; I364-L542 HydrophobicContact CB-CD1 3.72Å; I364-L542 HydrophobicContact CD1-CD1 4.03Å; I364-L542 HydrophobicContact CG1-CD1 4.37Å; I364-L542 HydrophobicContact CG2-CD1 3.68Å; I365-L542 HydrophobicContact CD1-CD2 4.27Å; I481-L542 HydrophobicContact CD1-CD2 4.07Å; A538-L542 VanDerWaalsContact O-CB 3.25Å; A538-L542 WeakPolarHBondContact O-CB 3.36Å; A538-L542 WeakPolarHBondContact O-CG 3.49Å; A538-L542 PolarHBondContact O-N 2.87Å; L542-E544 PolarHBondContact O-N 3.41Å; L542-I545 HydrophobicContact CD2-CG1 4.34Å; L542-I545 PolarHBondContact O-N 2.88Å
543	A	84.4	Confident	88	Confident	49 Å²	49	31 Å²	31	41%	0.405	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-38.3	-174	0	0	0	0	0	113.5	K539	K539-A543 WeakPolarHBondContact O-CB 3.47Å; K539-A543 PolarHBondContact O-N 3.13Å; K539-A543 VanDerWaalsContact O-N 3.16Å
544	E	88.4	Confident	88.5	Confident	45 Å²	45	36.3 Å²	36.3	21%	0.21	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-17.5	-173.6	-60.3	-151.2	155.5	0	0	115.2	Q516 L542 D547 Q548	Q516-E544 PolarHBondContact OE1-OE1 3.17Å; Q516-E544 PolarHBondContact OE1-OE2 3.32Å; L542-E544 PolarHBondContact O-N 3.41Å; E544-D547 PolarHBondContact O-N 3.44Å; E544-D547 VanDerWaalsContact O-N 3.09Å; E544-Q548 HydrophobicContact CB-CG 4.21Å; E544-Q548 WeakPolarHBondContact O-CB 3.02Å; E544-Q548 VanDerWaalsContact O-CG 3.31Å; E544-Q548 WeakPolarHBondContact O-CG 3.41Å; E544-Q548 PolarHBondContact O-N 3.03Å; E544-Q548 PolarHBondContact OE2-NE2 3.31Å
545	I	92.8	Very high	89	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-57.7	-43	-172.9	-61.6	-63.4	0	0	0	112.3	F80 V451 S479 I481 L542 D547 Q548 L549	F80-I545 HydrophobicContact CE1-CB 3.76Å; F80-I545 HydrophobicContact CE1-CG1 4.39Å; F80-I545 HydrophobicContact CE1-CG2 4.06Å; F80-I545 HydrophobicContact CZ-CB 4.23Å; F80-I545 HydrophobicContact CZ-CG2 4.01Å; V451-I545 HydrophobicContact CG1-CD1 4.08Å; V451-I545 HydrophobicContact CG2-CD1 4.37Å; V451-I545 HydrophobicContact CG2-CG2 4.21Å; S479-I545 VanDerWaalsContact CB-CD1 3.46Å; I481-I545 HydrophobicContact CD1-CD1 4Å; I481-I545 HydrophobicContact CD1-CG1 4.25Å; I481-I545 HydrophobicContact CG1-CD1 4.15Å; L542-I545 HydrophobicContact CD2-CG1 4.34Å; L542-I545 PolarHBondContact O-N 2.88Å; I545-D547 PolarHBondContact O-N 2.9Å; I545-Q548 PolarHBondContact O-N 3.43Å; I545-L549 WeakPolarHBondContact O-CB 3.31Å; I545-L549 PolarHBondContact O-N 3.41Å
546	P	91.4	Very high	89.6	Confident	19 Å²	19	41.7 Å²	41.7	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-47.2	174.9	-26.7	37.2	0	0	0	112.9	F80 F312 L549 M550	F80-P546 HydrophobicContact CB-CG 3.97Å; F80-P546 HydrophobicContact CD1-CG 3.54Å; F80-P546 HydrophobicContact CE1-CG 4.21Å; F80-P546 HydrophobicContact CG-CG 3.78Å; F312-P546 HydrophobicContact CB-CB 4.08Å; F312-P546 HydrophobicContact CD1-CB 4.44Å; F312-P546 HydrophobicContact CD2-CB 3.81Å; F312-P546 HydrophobicContact CD2-CG 4.34Å; F312-P546 HydrophobicContact CE2-CB 4.34Å; F312-P546 HydrophobicContact CE2-CG 4.43Å; F312-P546 HydrophobicContact CG-CB 3.85Å; F312-P546 HydrophobicContact CG-CG 4.39Å; P546-L549 PolarHBondContact O-N 3.09Å; P546-M550 WeakPolarHBondContact O-CB 3.43Å; P546-M550 WeakPolarHBondContact O-CG 3.13Å; P546-M550 PolarHBondContact O-N 3.42Å
547	D	89.5	Confident	89.9	Confident	121 Å²	121	38.5 Å²	38.5	65%	0.647	22%	0.219	S	C	*	.	H	α-helix	trans	-70.2	-38.8	-177.7	-75	-19.5	0	0	0	112.1	E544 I545 M550 S551	E544-D547 PolarHBondContact O-N 3.44Å; E544-D547 VanDerWaalsContact O-N 3.09Å; I545-D547 PolarHBondContact O-N 2.9Å; D547-M550 PolarHBondContact O-N 3.33Å; D547-S551 WeakPolarHBondContact O-CB 3.38Å; D547-S551 PolarHBondContact O-N 2.96Å
548	Q	93.4	Very high	90.2	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-42.2	175.4	-68.2	178.5	4.1	0	0	111.4	S479 R512 E544 I545 Y552	S479-Q548 PolarHBondContact OG-OE1 2.82Å; R512-Q548 PolarHBondContact NH1-O 3.39Å; E544-Q548 HydrophobicContact CB-CG 4.21Å; E544-Q548 WeakPolarHBondContact O-CB 3.02Å; E544-Q548 VanDerWaalsContact O-CG 3.31Å; E544-Q548 WeakPolarHBondContact O-CG 3.41Å; E544-Q548 PolarHBondContact O-N 3.03Å; E544-Q548 PolarHBondContact OE2-NE2 3.31Å; I545-Q548 PolarHBondContact O-N 3.43Å; Q548-Y552 PolarHBondContact O-N 3.33Å
549	L	94.6	Very high	90.4	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-49.6	173.9	-176.9	155.4	0	0	0	111.1	F312 Y315 T320 L322 Y449 I545 P546 S551 Y552 M553	F312-L549 HydrophobicContact CD2-CD1 4.34Å; F312-L549 HydrophobicContact CD2-CD2 4.39Å; F312-L549 HydrophobicContact CE2-CD1 4.03Å; Y315-L549 HydrophobicContact CD2-CD2 4.23Å; Y315-L549 HydrophobicContact CG-CD2 4.24Å; T320-L549 HydrophobicContact CG2-CD1 4.41Å; L322-L549 HydrophobicContact CD2-CD1 3.64Å; Y449-L549 HydrophobicContact CD1-CB 4.39Å; Y449-L549 HydrophobicContact CD1-CD1 4.11Å; Y449-L549 HydrophobicContact CD1-CG 4.46Å; Y449-L549 HydrophobicContact CD2-CB 4.22Å; Y449-L549 HydrophobicContact CD2-CD1 4.16Å; Y449-L549 HydrophobicContact CD2-CG 3.89Å; Y449-L549 HydrophobicContact CE1-CB 4.26Å; Y449-L549 HydrophobicContact CE2-CB 4.08Å; Y449-L549 HydrophobicContact CE2-CG 4.24Å; Y449-L549 HydrophobicContact CG-CB 4.37Å; Y449-L549 HydrophobicContact CG-CD1 3.77Å; Y449-L549 HydrophobicContact CG-CG 4.01Å; I545-L549 WeakPolarHBondContact O-CB 3.31Å; I545-L549 PolarHBondContact O-N 3.41Å; P546-L549 PolarHBondContact O-N 3.09Å; L549-S551 VanDerWaalsContact C-N 3.3Å; L549-S551 PolarHBondContact O-N 3.18Å; L549-Y552 WeakPolarHBondContact O-CB 3.44Å; L549-Y552 PolarHBondContact O-N 2.86Å; L549-Y552 VanDerWaalsContact O-N 3.14Å; L549-M553 HydrophobicContact CD2-CE 4.02Å; L549-M553 HydrophobicContact CD2-CG 3.76Å; L549-M553 HydrophobicContact CG-CE 4.27Å; L549-M553 HydrophobicContact CG-CG 4.49Å; L549-M553 WeakPolarHBondContact O-CG 3.49Å; L549-M553 PolarHBondContact O-N 3.43Å
550	M	90.9	Very high	90.4	Very high	33 Å²	33	46.1 Å²	46.1	16%	0.163	26%	0.259	C	S	.	.	H	α-helix	trans	-59.4	-42.2	179.3	-74.9	-55.8	-52.9	0	0	111.7	H310 T311 F312 Y315 P546 D547 Y552 M553 K554	H310-M550 WeakPolarHBondContact O-CE 3.38Å; T311-M550 VanDerWaalsContact C-SD 3.59Å; F312-M550 HydrophobicContact CB-CG 4.43Å; F312-M550 HydrophobicContact CB-SD 4.49Å; F312-M550 PolarHBondContact N-SD 2.93Å; Y315-M550 HydrophobicContact CD2-CE 4.4Å; Y315-M550 HydrophobicContact CD2-SD 3.56Å; Y315-M550 VanDerWaalsContact CD2-SD 3.56Å; Y315-M550 HydrophobicContact CE2-CE 3.74Å; Y315-M550 HydrophobicContact CE2-SD 3.47Å; Y315-M550 WeakPolarHBondContact CE2-SD 3.37Å; P546-M550 WeakPolarHBondContact O-CB 3.43Å; P546-M550 WeakPolarHBondContact O-CG 3.13Å; P546-M550 PolarHBondContact O-N 3.42Å; D547-M550 PolarHBondContact O-N 3.33Å; M550-Y552 PolarHBondContact O-N 2.88Å; M550-M553 PolarHBondContact O-N 3.24Å; M550-K554 VanDerWaalsContact O-CB 3.23Å; M550-K554 WeakPolarHBondContact O-CB 3.36Å; M550-K554 PolarHBondContact O-N 3.19Å
551	S	91.1	Very high	90.5	Very high	53 Å²	53	46.9 Å²	46.9	37%	0.371	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-43.8	175.1	-177.1	0	0	0	0	111.7	R512 D547 L549 S555	R512-S551 WeakPolarHBondContact CD-OG 3.38Å; D547-S551 WeakPolarHBondContact O-CB 3.38Å; D547-S551 PolarHBondContact O-N 2.96Å; L549-S551 VanDerWaalsContact C-N 3.3Å; L549-S551 PolarHBondContact O-N 3.18Å; S551-S555 VanDerWaalsContact O-CB 3.27Å; S551-S555 WeakPolarHBondContact O-CB 3.46Å; S551-S555 PolarHBondContact O-N 2.98Å; S551-S555 PolarHBondContact O-OG 3.46Å
552	Y	94.9	Very high	90.3	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.027	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-55.4	173.5	173.7	-99.6	0	0	0	111.8	Y449 L476 P477 Q548 L549 M550 K554 S555 R556 I558	Y449-Y552 HydrophobicContact CD2-CD1 4.33Å; Y449-Y552 HydrophobicContact CE2-CD1 4.33Å; Y449-Y552 HydrophobicContact CE2-CG 4.21Å; L476-Y552 VanDerWaalsContact C-CE2 3.45Å; P477-Y552 HydrophobicContact CB-CD1 3.99Å; P477-Y552 HydrophobicContact CB-CD2 4.46Å; P477-Y552 HydrophobicContact CB-CE1 3.53Å; P477-Y552 HydrophobicContact CB-CE2 4.03Å; P477-Y552 HydrophobicContact CB-CG 4.44Å; P477-Y552 HydrophobicContact CG-CE1 4.42Å; Q548-Y552 PolarHBondContact O-N 3.33Å; L549-Y552 WeakPolarHBondContact O-CB 3.44Å; L549-Y552 PolarHBondContact O-N 2.86Å; L549-Y552 VanDerWaalsContact O-N 3.14Å; M550-Y552 PolarHBondContact O-N 2.88Å; Y552-K554 VanDerWaalsContact C-N 3.29Å; Y552-K554 PolarHBondContact O-N 3.47Å; Y552-S555 PolarHBondContact O-N 3.37Å; Y552-S555 VanDerWaalsContact O-N 3.15Å; Y552-S555 PolarHBondContact O-OG 3.38Å; Y552-R556 HydrophobicContact CD2-CG 4.18Å; Y552-R556 HydrophobicContact CE1-CG 4.42Å; Y552-R556 HydrophobicContact CE2-CG 3.73Å; Y552-R556 PolarHBondContact O-N 3.45Å; Y552-R556 VanDerWaalsContact O-N 3.1Å; Y552-I558 HydrophobicContact CE1-CD1 3.73Å
553	M	93.9	Very high	89.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.2	-44.2	-176	-64	-60	-173	0	0	111.2	Y315 T320 G446 L549 M550 R556 G557 I558	Y315-M553 HydrophobicContact CD1-CE 4.03Å; Y315-M553 HydrophobicContact CD1-CG 3.96Å; Y315-M553 HydrophobicContact CD1-SD 4.19Å; Y315-M553 HydrophobicContact CD2-CG 4.5Å; Y315-M553 HydrophobicContact CE1-CB 3.83Å; Y315-M553 HydrophobicContact CE1-CE 4.43Å; Y315-M553 HydrophobicContact CE1-CG 3.61Å; Y315-M553 HydrophobicContact CE1-SD 3.97Å; Y315-M553 HydrophobicContact CE2-CB 4.16Å; Y315-M553 HydrophobicContact CE2-CG 4.2Å; Y315-M553 HydrophobicContact CG-CG 4.4Å; Y315-M553 WeakPolarHBondContact OH-CB 3.31Å; T320-M553 HydrophobicContact CG2-CE 3.81Å; G446-M553 WeakPolarHBondContact O-CE 3.46Å; L549-M553 HydrophobicContact CD2-CE 4.02Å; L549-M553 HydrophobicContact CD2-CG 3.76Å; L549-M553 HydrophobicContact CG-CE 4.27Å; L549-M553 HydrophobicContact CG-CG 4.49Å; L549-M553 WeakPolarHBondContact O-CG 3.49Å; L549-M553 PolarHBondContact O-N 3.43Å; M550-M553 PolarHBondContact O-N 3.24Å; M553-R556 PolarHBondContact O-N 2.85Å; M553-G557 PolarHBondContact O-N 2.83Å; M553-I558 HydrophobicContact CB-CB 4.35Å; M553-I558 PolarHBondContact O-N 3.37Å; M553-I558 HydrophobicContact SD-CB 3.92Å; M553-I558 HydrophobicContact SD-CD1 3.84Å; M553-I558 HydrophobicContact SD-CG1 4.49Å; M553-I558 HydrophobicContact SD-CG2 3.74Å
554	K	88.8	Confident	88.4	Confident	127 Å²	127	57.9 Å²	57.9	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-63.9	-45	177.3	-170.2	170.4	-171.5	163	0	112.3	E309 M550 Y552 R556 G557	E309-K554 IonicContact OE1-NZ 3.25Å; E309-K554 PolarHBondContact OE1-NZ 3.36Å; M550-K554 VanDerWaalsContact O-CB 3.23Å; M550-K554 WeakPolarHBondContact O-CB 3.36Å; M550-K554 PolarHBondContact O-N 3.19Å; Y552-K554 VanDerWaalsContact C-N 3.29Å; Y552-K554 PolarHBondContact O-N 3.47Å; K554-R556 PolarHBondContact O-N 3.15Å; K554-G557 PolarHBondContact O-N 3.12Å; K554-G557 VanDerWaalsContact O-N 3.16Å
555	S	89.9	Confident	86.8	Confident	64 Å²	64	61.3 Å²	61.3	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-26	179.3	75.3	0	0	0	0	113.5	S551 Y552	S551-S555 VanDerWaalsContact O-CB 3.27Å; S551-S555 WeakPolarHBondContact O-CB 3.46Å; S551-S555 PolarHBondContact O-N 2.98Å; S551-S555 PolarHBondContact O-OG 3.46Å; Y552-S555 PolarHBondContact O-N 3.37Å; Y552-S555 VanDerWaalsContact O-N 3.15Å; Y552-S555 PolarHBondContact O-OG 3.38Å
556	R	93.3	Very high	84.7	Confident	112 Å²	112	63.8 Å²	63.8	42%	0.423	36%	0.362	S	S	.	.	H	α-helix	trans	-98.5	-2.9	178.5	-61.3	-57.8	179.9	-148.2	-10.2	113.6	S475 E511 Y552 M553 K554 I558	S475-R556 VanDerWaalsContact CB-NH2 3.29Å; S475-R556 PolarHBondContact O-NE 3.48Å; S475-R556 PolarHBondContact O-NH2 2.94Å; E511-R556 IonicContact OE2-CZ 3.81Å; E511-R556 IonicContact OE2-NH2 2.78Å; E511-R556 PolarHBondContact OE2-NH2 3.17Å; Y552-R556 HydrophobicContact CD2-CG 4.18Å; Y552-R556 HydrophobicContact CE1-CG 4.42Å; Y552-R556 HydrophobicContact CE2-CG 3.73Å; Y552-R556 PolarHBondContact O-N 3.45Å; Y552-R556 VanDerWaalsContact O-N 3.1Å; M553-R556 PolarHBondContact O-N 2.85Å; K554-R556 PolarHBondContact O-N 3.15Å; R556-I558 VanDerWaalsContact C-N 3.28Å; R556-I558 HydrophobicContact CB-CD1 3.72Å; R556-I558 HydrophobicContact CB-CG1 3.82Å; R556-I558 HydrophobicContact CG-CD1 4.46Å; R556-I558 PolarHBondContact O-N 3.13Å
557	G	90.4	Very high	82.3	Confident	63 Å²	63	69 Å²	69	65%	0.649	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	31.8	-177.2	0	0	0	0	0	113.2	M553 K554	M553-G557 PolarHBondContact O-N 2.83Å; K554-G557 PolarHBondContact O-N 3.12Å; K554-G557 VanDerWaalsContact O-N 3.16Å
558	I	92	Very high	79.7	Confident	25 Å²	25	68.6 Å²	68.6	13%	0.128	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-86.2	119.4	179.8	-61.3	168.4	0	0	0	108.5	Y315 Y552 M553 R556	Y315-I558 HydrophobicContact CE1-CG2 4.32Å; Y315-I558 PolarHBondContact OH-O 3.12Å; Y552-I558 HydrophobicContact CE1-CD1 3.73Å; M553-I558 HydrophobicContact CB-CB 4.35Å; M553-I558 PolarHBondContact O-N 3.37Å; M553-I558 HydrophobicContact SD-CB 3.92Å; M553-I558 HydrophobicContact SD-CD1 3.84Å; M553-I558 HydrophobicContact SD-CG1 4.49Å; M553-I558 HydrophobicContact SD-CG2 3.74Å; R556-I558 VanDerWaalsContact C-N 3.28Å; R556-I558 HydrophobicContact CB-CD1 3.72Å; R556-I558 HydrophobicContact CB-CG1 3.82Å; R556-I558 HydrophobicContact CG-CD1 4.46Å; R556-I558 PolarHBondContact O-N 3.13Å
559	E	89.9	Confident	76.8	Confident	154 Å²	154	74.5 Å²	74.5	72%	0.72	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-86.5	149.8	175.7	-65.5	-176.2	175.8	0	0	111.4	R561	E559-R561 PolarHBondContact O-N 3.3Å
560	A	86.4	Confident	73.9	Confident	19 Å²	19	80.5 Å²	80.5	16%	0.157	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-69.8	132.6	176.6	0	0	0	0	0	110.1	H310 D314 Y315	H310-A560 HydrophobicContact CB-CB 4.09Å; H310-A560 PolarHBondContact CD2-N 2.8Å; H310-A560 WeakPolarHBondContact ND1-CB 3.37Å; H310-A560 PolarHBondContact NE2-N 2.79Å; D314-A560 HydrophobicContact CB-CB 3.85Å; Y315-A560 HydrophobicContact CD1-CB 4.01Å; Y315-A560 HydrophobicContact CD2-CB 4.44Å; Y315-A560 HydrophobicContact CE1-CB 4Å; Y315-A560 HydrophobicContact CE2-CB 4.42Å; Y315-A560 HydrophobicContact CG-CB 4.22Å
561	R	87.8	Confident	71.4	Confident	84 Å²	84	84.9 Å²	84.9	32%	0.317	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-69.7	150	177.5	-66.1	-177	-66.6	-143.2	0.1	110.5	G318 G319 D445 E559	G318-R561 VanDerWaalsContact CA-O 3.27Å; G318-R561 WeakPolarHBondContact CA-O 3.43Å; G318-R561 WeakPolarHBondContact O-CB 3.21Å; G318-R561 PolarHBondContact O-NE 3.39Å; G319-R561 VanDerWaalsContact C-NH2 3.3Å; G319-R561 PolarHBondContact O-NH2 3.28Å; D445-R561 IonicContact OD2-NH1 2.85Å; E559-R561 PolarHBondContact O-N 3.3Å
562	P	81.5	Confident	68.5	Low	104 Å²	104	87.4 Å²	87.4	68%	0.675	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-59.4	149.2	172	25.7	-33.6	0	0	0	110.4	Q564	P562-Q564 PolarHBondContact O-N 2.96Å
563	P	71	Confident	65.3	Low	71 Å²	71	94.1 Å²	94.1	46%	0.461	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-53.2	124.7	176.8	-23.3	31.9	0	0	0	110.3
564	Q	63.8	Low	62.5	Low	106 Å²	106	100 Å²	100	50%	0.495	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-67	130.4	179	-69.6	-165.8	-9.9	0	0	109.6	G121 P562 A566	G121-Q564 WeakPolarHBondContact CA-O 3.26Å; P562-Q564 PolarHBondContact O-N 2.96Å; Q564-A566 PolarHBondContact O-N 3.06Å
565	P	54.9	Low	59.8	Low	116 Å²	116	99.8 Å²	99.8	75%	0.753	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-63.8	131.8	170.3	25.1	-29.8	0	0	0	108.4	T567	P565-T567 PolarHBondContact O-N 3.44Å
566	A	48.7	Very low	57	Low	54 Å²	54	102.4 Å²	102.4	45%	0.446	62%	0.619	S	S	.	*			trans	-54.8	109.6	174.1	0	0	0	0	0	108.6	Q564 S568	Q564-A566 PolarHBondContact O-N 3.06Å; A566-S568 PolarHBondContact O-N 2.88Å
567	T	41.3	Very low	54.1	Low	128 Å²	128	103.8 Å²	103.8	79%	0.785	64%	0.64	S	S	*	*			trans	-63.8	118.6	172.9	46.1	0	0	0	0	107.6	P565 D569	P565-T567 PolarHBondContact O-N 3.44Å; T567-D569 PolarHBondContact O-N 3.09Å
568	S	35.3	Very low	51.2	Low	112 Å²	112	104.1 Å²	104.1	78%	0.783	64%	0.644	S	S	*	*			trans	-54.7	129.6	159.6	52.4	0	0	0	0	108.1	A566	A566-S568 PolarHBondContact O-N 2.88Å
569	D	31.8	Very low	48.3	Very low	132 Å²	132	109.6 Å²	109.6	71%	0.706	68%	0.679	S	S	*	*			trans	-34.3	140.7	-176.2	-76.7	-45.3	0	0	0	114.8	T567 T571	T567-D569 PolarHBondContact O-N 3.09Å; D569-T571 HydrophobicContact CB-CG2 4.47Å; D569-T571 PolarHBondContact O-N 3.03Å
570	P	34.4	Very low	45.5	Very low	127 Å²	127	106.9 Å²	106.9	83%	0.825	68%	0.683	S	S	*	*			trans	-77.4	66.5	166.8	34.7	-31.8	0	0	0	109.4
571	T	38	Very low	43	Very low	125 Å²	125	115.5 Å²	115.5	77%	0.767	72%	0.716	S	S	*	*			trans	-101.9	81.6	162	54.3	0	0	0	0	109.3	D569	D569-T571 HydrophobicContact CB-CG2 4.47Å; D569-T571 PolarHBondContact O-N 3.03Å
572	S	30.4	Very low	40.3	Very low	105 Å²	105	120.4 Å²	120.4	73%	0.734	74%	0.743	S	S	*	*			trans	-145.3	92	149.7	56.1	0	0	0	0	108.5	P574	S572-P574 WeakPolarHBondContact O-CD 3.4Å
573	D	28.5	Very low	37.9	Very low	149 Å²	149	122.9 Å²	122.9	80%	0.797	75%	0.751	S	S	*	*			trans	-57.2	123.9	159.1	-92.3	-34.5	0	0	0	108.8	T575	D573-T575 VanDerWaalsContact C-N 3.3Å; D573-T575 PolarHBondContact O-N 3.18Å
574	P	34.3	Very low	36.3	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	77%	0.77	S	S	*	*			trans	-88.7	73.2	168.7	35.1	-28.5	0	0	0	108.6	S572	S572-P574 WeakPolarHBondContact O-CD 3.4Å
575	T	32.4	Very low	34.8	Very low	122 Å²	122	128.6 Å²	128.6	75%	0.748	79%	0.786	S	S	*	*			trans	-134.4	83.6	165.9	32.1	0	0	0	0	111.3	D573	D573-T575 VanDerWaalsContact C-N 3.3Å; D573-T575 PolarHBondContact O-N 3.18Å
576	S	31.4	Very low	33.9	Very low	118 Å²	118	134.8 Å²	134.8	83%	0.825	79%	0.794	S	S	*	*			trans	-139.7	89.3	143.9	78.5	0	0	0	0	109.3	G578	S576-G578 PolarHBondContact O-N 3.32Å
577	T	31.4	Very low	33.8	Very low	142 Å²	142	141.9 Å²	141.9	87%	0.871	84%	0.836	S	S	*	*			trans	-62.5	98.6	160.1	42.2	0	0	0	0	108.3	T579	T577-T579 PolarHBondContact O-N 3Å
578	G	30	Very low	33.4	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	84%	0.838	S	S	*	*			trans	-67.3	115	167.8	0	0	0	0	0	109.8	S576 A580	S576-G578 PolarHBondContact O-N 3.32Å; G578-A580 PolarHBondContact O-N 3.49Å; G578-A580 VanDerWaalsContact O-N 3.11Å
579	T	31.9	Very low	33.3	Very low	140 Å²	140	144.2 Å²	144.2	86%	0.859	84%	0.841	S	S	*	*			trans	-61.7	105.3	167.5	41.8	0	0	0	0	110.2	T577 K581	T577-T579 PolarHBondContact O-N 3Å; T579-K581 PolarHBondContact O-N 3.11Å
580	A	31	Very low	33.4	Very low	97 Å²	97	144.9 Å²	144.9	80%	0.802	85%	0.848	S	S	*	*			trans	-79.7	113.5	166.8	0	0	0	0	0	109.5	G578 Q582	G578-A580 PolarHBondContact O-N 3.49Å; G578-A580 VanDerWaalsContact O-N 3.11Å; A580-Q582 PolarHBondContact O-N 3.39Å
581	K	32.3	Very low	33.3	Very low	199 Å²	199	145.9 Å²	145.9	87%	0.865	85%	0.85	S	S	*	*			trans	-63.8	119.6	168.7	-75.9	178.8	175.4	177.6	0	109.4	T579 N583	T579-K581 PolarHBondContact O-N 3.11Å; K581-N583 PolarHBondContact O-N 3.35Å
582	Q	31	Very low	33	Very low	188 Å²	188	147.3 Å²	147.3	88%	0.879	86%	0.855	S	S	*	*			trans	-70.6	114.8	164.1	-82.5	176.2	-19	0	0	109.3	A580	A580-Q582 PolarHBondContact O-N 3.39Å
583	N	32.5	Very low	33.2	Very low	156 Å²	156	150.1 Å²	150.1	83%	0.834	86%	0.863	S	S	*	*			trans	-80.7	116.4	161.7	-89.7	-12.1	0	0	0	108.7	K581	K581-N583 PolarHBondContact O-N 3.35Å
584	N	36.1	Very low	33.6	Very low	161 Å²	161	150.1 Å²	150.1	86%	0.861	87%	0.868	S	S	*	*			trans	-69.5	124	164.6	-98.5	-19.1	0	0	0	110
585	T	33.7	Very low	33.5	Very low	135 Å²	135	152.2 Å²	152.2	83%	0.828	87%	0.873	S	S	*	*			trans	-150	116.4	150.3	23.6	0	0	0	0	110.4
586	R	36.2	Very low	33.6	Very low	247 Å²	247	154.7 Å²	154.7	93%	0.932	88%	0.883	S	S	*	*			trans	-161.6	150.3	148.8	-102.6	-169.3	-170.7	-165.3	3.1	108
587	P	45.8	Very low	33.8	Very low	203 Å²	203	158 Å²	158	100%	1.318	89%	0.888	S	S	*	*			cis	-88.2	0	-32.6	5.5	15.6	0	0	0	112.3

Retrieved 587 of 587 residues in 143.5 ms (Link to these results)

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