A0A077Z3D9_TRITR Loading...

UDP-glucuronosyltransferase

AlphaFold DB , UniProt , Accession A0A077Z3D9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 361 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	40.7	Very low	53.1	Low	242 Å²	242	127.8 Å²	127.8	100%	1.192	70%	0.704	S	S	*	*				0	125.3	0	-80.9	177	160.2	0	0	109	K3	M1-K3 PolarHBondContact O-N 3.37Å
2	T	47.4	Very low	53.6	Low	145 Å²	145	124.4 Å²	124.4	89%	0.89	68%	0.684	S	S	*	*			trans	-54.9	124.2	178.9	40.2	0	0	0	0	112.2
3	K	49.1	Very low	53.8	Low	206 Å²	206	122.9 Å²	122.9	90%	0.896	67%	0.673	S	S	*	*			trans	-113.6	108.8	159.1	-96.2	-174	176.2	-179.6	0	108.5	M1	M1-K3 PolarHBondContact O-N 3.37Å
4	K	55.6	Low	53.7	Low	176 Å²	176	122.5 Å²	122.5	77%	0.765	67%	0.668	S	S	*	*			trans	-60.2	127	-178.5	-73.1	175.1	169.5	178.9	0	111.7	T6	K4-T6 PolarHBondContact O-N 3.43Å
5	P	51.6	Low	53.7	Low	115 Å²	115	120 Å²	120	75%	0.747	65%	0.653	S	S	*	*			trans	-88.3	88.5	156.5	32.9	-24	0	0	0	107.9
6	T	53.4	Low	53.8	Low	91 Å²	91	119.1 Å²	119.1	56%	0.558	65%	0.646	S	S	*	*			trans	-127.9	-23.5	174.3	35.3	0	0	0	0	113.4	K4 A10	K4-T6 PolarHBondContact O-N 3.43Å; T6-A10 WeakPolarHBondContact O-CB 3.17Å; T6-A10 PolarHBondContact O-N 2.94Å
7	A	55.7	Low	53.6	Low	62 Å²	62	115.6 Å²	115.6	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-71.3	-44.2	-176.5	0	0	0	0	0	113.5	I9 A10 I11	A7-I9 PolarHBondContact O-N 2.51Å; A7-A10 PolarHBondContact O-N 2.7Å; A7-I11 HydrophobicContact CB-CD1 4.49Å; A7-I11 WeakPolarHBondContact O-CB 3.44Å; A7-I11 VanDerWaalsContact O-CG1 3.23Å; A7-I11 WeakPolarHBondContact O-CG1 2.96Å; A7-I11 PolarHBondContact O-N 3.11Å
8	T	56.2	Low	53.3	Low	101 Å²	101	113.7 Å²	113.7	62%	0.62	63%	0.625	S	S	*	*	H	α-helix	trans	-67.6	-39.1	-173.9	-42.3	0	0	0	0	112.9	N12	T8-N12 WeakPolarHBondContact O-CB 3.3Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 3.34Å
9	I	57.2	Low	53	Low	113 Å²	113	115.8 Å²	115.8	58%	0.579	62%	0.624	S	S	*	*	H	α-helix	trans	-67.9	-44.4	177.2	-62.6	174.1	0	0	0	109.7	A7 N12 I13	A7-I9 PolarHBondContact O-N 2.51Å; I9-N12 PolarHBondContact O-N 3.46Å; I9-I13 HydrophobicContact CG2-CD1 3.66Å; I9-I13 HydrophobicContact CG2-CG1 4.36Å; I9-I13 WeakPolarHBondContact O-CB 3.37Å; I9-I13 VanDerWaalsContact O-CG1 3.23Å; I9-I13 WeakPolarHBondContact O-CG1 3.37Å; I9-I13 PolarHBondContact O-N 3.38Å
10	A	58.2	Low	52.8	Low	59 Å²	59	116 Å²	116	49%	0.488	63%	0.629	S	S	.	*	H	α-helix	trans	-63.8	-42.7	178.4	0	0	0	0	0	112.6	T6 A7 I13 L14	T6-A10 WeakPolarHBondContact O-CB 3.17Å; T6-A10 PolarHBondContact O-N 2.94Å; A7-A10 PolarHBondContact O-N 2.7Å; A10-I13 PolarHBondContact O-N 3.15Å; A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.33Å
11	I	58.9	Low	52.8	Low	96 Å²	96	117.1 Å²	117.1	49%	0.492	63%	0.63	S	S	.	*	H	α-helix	trans	-64.1	-45.7	177.4	-69.5	165.7	0	0	0	110.5	A7 I13 L14 I15	A7-I11 HydrophobicContact CB-CD1 4.49Å; A7-I11 WeakPolarHBondContact O-CB 3.44Å; A7-I11 VanDerWaalsContact O-CG1 3.23Å; A7-I11 WeakPolarHBondContact O-CG1 2.96Å; A7-I11 PolarHBondContact O-N 3.11Å; I11-I13 PolarHBondContact O-N 3.16Å; I11-L14 PolarHBondContact O-N 2.86Å; I11-I15 HydrophobicContact CG2-CD1 3.54Å; I11-I15 HydrophobicContact CG2-CG1 4.21Å; I11-I15 WeakPolarHBondContact O-CB 3.46Å; I11-I15 VanDerWaalsContact O-CG1 3.23Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.16Å
12	N	59.8	Low	53.3	Low	87 Å²	87	111.5 Å²	111.5	47%	0.465	60%	0.601	S	S	.	*	H	α-helix	trans	-64.2	-40.9	177.4	-78.3	-27.8	0	0	0	112	T8 I9 L14 I15 I16	T8-N12 WeakPolarHBondContact O-CB 3.3Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 3.34Å; I9-N12 PolarHBondContact O-N 3.46Å; N12-L14 VanDerWaalsContact C-N 3.34Å; N12-I15 PolarHBondContact O-N 3.4Å; N12-I16 VanDerWaalsContact O-CB 3.31Å; N12-I16 WeakPolarHBondContact O-CB 3.26Å; N12-I16 WeakPolarHBondContact O-CD1 3.27Å; N12-I16 WeakPolarHBondContact O-CG1 3.31Å; N12-I16 PolarHBondContact O-N 2.87Å
13	I	55.8	Low	53.6	Low	105 Å²	105	111.8 Å²	111.8	54%	0.538	60%	0.595	S	S	.	*	H	α-helix	trans	-63.1	-42.4	175.3	-68.7	169	0	0	0	110.7	I9 A10 I11 S17	I9-I13 HydrophobicContact CG2-CD1 3.66Å; I9-I13 HydrophobicContact CG2-CG1 4.36Å; I9-I13 WeakPolarHBondContact O-CB 3.37Å; I9-I13 VanDerWaalsContact O-CG1 3.23Å; I9-I13 WeakPolarHBondContact O-CG1 3.37Å; I9-I13 PolarHBondContact O-N 3.38Å; A10-I13 PolarHBondContact O-N 3.15Å; I11-I13 PolarHBondContact O-N 3.16Å; I13-S17 VanDerWaalsContact O-CB 3.27Å; I13-S17 WeakPolarHBondContact O-CB 3.4Å; I13-S17 PolarHBondContact O-N 3.4Å
14	L	52.8	Low	54	Low	117 Å²	117	103.3 Å²	103.3	61%	0.613	56%	0.561	S	S	*	*	H	α-helix	trans	-65.8	-43.8	177.8	-164.2	77.5	0	0	0	111.2	A10 I11 N12 S17 T18	A10-L14 WeakPolarHBondContact O-CB 3.46Å; A10-L14 PolarHBondContact O-N 3.33Å; I11-L14 PolarHBondContact O-N 2.86Å; N12-L14 VanDerWaalsContact C-N 3.34Å; L14-S17 WeakPolarHBondContact O-CB 3.4Å; L14-S17 PolarHBondContact O-N 3.34Å; L14-T18 WeakPolarHBondContact O-CG2 3.32Å; L14-T18 PolarHBondContact O-N 3.22Å; L14-T18 PolarHBondContact O-OG1 2.86Å
15	I	53.5	Low	54.5	Low	85 Å²	85	103.1 Å²	103.1	44%	0.436	56%	0.56	S	S	.	*	H	α-helix	trans	-63.8	-46.2	177.6	-69.1	170.8	0	0	0	110.3	I11 N12 S17 T18 Y19	I11-I15 HydrophobicContact CG2-CD1 3.54Å; I11-I15 HydrophobicContact CG2-CG1 4.21Å; I11-I15 WeakPolarHBondContact O-CB 3.46Å; I11-I15 VanDerWaalsContact O-CG1 3.23Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.16Å; N12-I15 PolarHBondContact O-N 3.4Å; I15-S17 VanDerWaalsContact C-N 3.32Å; I15-S17 PolarHBondContact O-N 2.84Å; I15-T18 VanDerWaalsContact CA-OG1 3.29Å; I15-T18 WeakPolarHBondContact CA-OG1 3.42Å; I15-T18 PolarHBondContact O-N 3.27Å; I15-T18 PolarHBondContact O-OG1 2.84Å; I15-Y19 WeakPolarHBondContact O-CB 3.47Å; I15-Y19 PolarHBondContact O-N 3.45Å
16	I	55	Low	55.7	Low	106 Å²	106	100.8 Å²	100.8	54%	0.544	55%	0.551	S	S	.	*	H	α-helix	trans	-61.1	-42.5	175.6	-67.5	163.8	0	0	0	110.1	N12 T18 Y19 V20	N12-I16 VanDerWaalsContact O-CB 3.31Å; N12-I16 WeakPolarHBondContact O-CB 3.26Å; N12-I16 WeakPolarHBondContact O-CD1 3.27Å; N12-I16 WeakPolarHBondContact O-CG1 3.31Å; N12-I16 PolarHBondContact O-N 2.87Å; I16-T18 PolarHBondContact O-N 2.92Å; I16-Y19 PolarHBondContact O-N 3.41Å; I16-V20 HydrophobicContact CG2-CG2 4.14Å; I16-V20 WeakPolarHBondContact O-CB 3.32Å; I16-V20 WeakPolarHBondContact O-CG2 3.07Å; I16-V20 PolarHBondContact O-N 3.37Å
17	S	50.5	Low	57.2	Low	60 Å²	60	99.2 Å²	99.2	42%	0.42	54%	0.538	S	S	.	.	H	α-helix	trans	-59.1	-47	174.2	-175.2	0	0	0	0	111.5	I13 L14 I15 Y19 V20 E21	I13-S17 VanDerWaalsContact O-CB 3.27Å; I13-S17 WeakPolarHBondContact O-CB 3.4Å; I13-S17 PolarHBondContact O-N 3.4Å; L14-S17 WeakPolarHBondContact O-CB 3.4Å; L14-S17 PolarHBondContact O-N 3.34Å; I15-S17 VanDerWaalsContact C-N 3.32Å; I15-S17 PolarHBondContact O-N 2.84Å; S17-Y19 VanDerWaalsContact C-N 3.33Å; S17-Y19 PolarHBondContact O-N 3.09Å; S17-V20 PolarHBondContact O-N 2.95Å; S17-E21 PolarHBondContact O-N 3.18Å
18	T	47.6	Very low	58.9	Low	80 Å²	80	102.9 Å²	102.9	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-67.7	-31.4	179.1	53.1	0	0	0	0	112.8	L14 I15 I16	L14-T18 WeakPolarHBondContact O-CG2 3.32Å; L14-T18 PolarHBondContact O-N 3.22Å; L14-T18 PolarHBondContact O-OG1 2.86Å; I15-T18 VanDerWaalsContact CA-OG1 3.29Å; I15-T18 WeakPolarHBondContact CA-OG1 3.42Å; I15-T18 PolarHBondContact O-N 3.27Å; I15-T18 PolarHBondContact O-OG1 2.84Å; I16-T18 PolarHBondContact O-N 2.92Å
19	Y	47.4	Very low	60.5	Low	154 Å²	154	99.5 Å²	99.5	60%	0.604	53%	0.528	S	S	*	.	H	α-helix	trans	-78.8	-32.4	176.4	-122.9	-85	0	0	0	112.2	I15 I16 S17 E21 E22	I15-Y19 WeakPolarHBondContact O-CB 3.47Å; I15-Y19 PolarHBondContact O-N 3.45Å; I16-Y19 PolarHBondContact O-N 3.41Å; S17-Y19 VanDerWaalsContact C-N 3.33Å; S17-Y19 PolarHBondContact O-N 3.09Å; Y19-E21 VanDerWaalsContact C-N 3.3Å; Y19-E22 HydrophobicContact CD1-CG 4.1Å; Y19-E22 HydrophobicContact CE1-CG 4.38Å; Y19-E22 WeakPolarHBondContact O-CB 3.32Å; Y19-E22 WeakPolarHBondContact O-CG 3.3Å; Y19-E22 PolarHBondContact O-N 3.34Å
20	V	50.5	Low	62.1	Low	119 Å²	119	98.5 Å²	98.5	72%	0.721	52%	0.523	S	S	*	.	H	α-helix	trans	-72.7	-29.2	173.9	172.7	0	0	0	0	110.8	I16 S17 E22	I16-V20 HydrophobicContact CG2-CG2 4.14Å; I16-V20 WeakPolarHBondContact O-CB 3.32Å; I16-V20 WeakPolarHBondContact O-CG2 3.07Å; I16-V20 PolarHBondContact O-N 3.37Å; S17-V20 PolarHBondContact O-N 2.95Å; V20-E22 PolarHBondContact O-N 3.46Å
21	E	52	Low	63.7	Low	141 Å²	141	96.9 Å²	96.9	66%	0.659	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	9.9	164.3	-77	-171	168.6	0	0	113.4	S17 Y19 I23	S17-E21 PolarHBondContact O-N 3.18Å; Y19-E21 VanDerWaalsContact C-N 3.3Å; E21-I23 WeakPolarHBondContact O-CA 3.3Å; E21-I23 PolarHBondContact O-N 3.46Å
22	E	52.1	Low	65.1	Low	124 Å²	124	97.8 Å²	97.8	58%	0.579	51%	0.508	S	S	*	.			trans	-47.4	114	171.2	-99.2	-160.2	151.3	0	0	108.9	Y19 V20 V24	Y19-E22 HydrophobicContact CD1-CG 4.1Å; Y19-E22 HydrophobicContact CE1-CG 4.38Å; Y19-E22 WeakPolarHBondContact O-CB 3.32Å; Y19-E22 WeakPolarHBondContact O-CG 3.3Å; Y19-E22 PolarHBondContact O-N 3.34Å; V20-E22 PolarHBondContact O-N 3.46Å; E22-V24 PolarHBondContact O-N 3.2Å
23	I	53.5	Low	66.3	Low	151 Å²	151	94 Å²	94	77%	0.774	49%	0.488	S	S	*	.			trans	-63.1	119.6	-148.6	-67.2	155.8	0	0	0	107.6	E21 K25	E21-I23 WeakPolarHBondContact O-CA 3.3Å; E21-I23 PolarHBondContact O-N 3.46Å; I23-K25 VanDerWaalsContact C-N 3.31Å; I23-K25 PolarHBondContact O-N 3.44Å
24	V	56.4	Low	67.2	Low	28 Å²	28	93.8 Å²	93.8	17%	0.17	50%	0.502	C	S	.	.			trans	-60.4	106.1	164.3	-166.7	0	0	0	0	105.1	E22 A26 H56 N315 L318	E22-V24 PolarHBondContact O-N 3.2Å; V24-A26 PolarHBondContact O-N 3.02Å; V24-A26 VanDerWaalsContact O-N 3.1Å; V24-H56 WeakPolarHBondContact CG1-CE1 3.46Å; V24-N315 HydrophobicContact CG1-CB 4.28Å; V24-N315 HydrophobicContact CG2-CB 4.11Å; V24-L318 HydrophobicContact CG1-CB 4.28Å; V24-L318 HydrophobicContact CG1-CD1 4.48Å
25	K	66.8	Low	68.3	Low	171 Å²	171	90.6 Å²	90.6	74%	0.743	49%	0.485	S	S	*	.			trans	-51.2	125.5	-179.8	-169.3	176.3	-179.1	179.7	0	107.4	I23 N27	I23-K25 VanDerWaalsContact C-N 3.31Å; I23-K25 PolarHBondContact O-N 3.44Å; K25-N27 PolarHBondContact O-N 3.15Å; K25-N27 VanDerWaalsContact O-N 3.13Å; K25-N27 PolarHBondContact O-ND2 3.25Å
26	A	76.9	Confident	69.4	Low	67 Å²	67	88.3 Å²	88.3	55%	0.554	48%	0.475	S	S	*	.			trans	-54.4	122.6	-178.8	0	0	0	0	0	109.3	V24 G55	V24-A26 PolarHBondContact O-N 3.02Å; V24-A26 VanDerWaalsContact O-N 3.1Å; A26-G55 WeakPolarHBondContact CB-O 3.42Å
27	N	85	Confident	70.5	Confident	57 Å²	57	83.5 Å²	83.5	31%	0.305	45%	0.451	S	S	.	.			trans	-115.5	158.1	177.9	-79.1	-74.3	0	0	0	109.7	K25 H56 S57 L318	K25-N27 PolarHBondContact O-N 3.15Å; K25-N27 VanDerWaalsContact O-N 3.13Å; K25-N27 PolarHBondContact O-ND2 3.25Å; N27-H56 PolarHBondContact N-ND1 2.63Å; N27-S57 PolarHBondContact O-N 3.26Å; N27-L318 HydrophobicContact CB-CD1 4.13Å; N27-L318 HydrophobicContact CB-CD2 4.38Å
28	N	89.8	Confident	72.1	Confident	140 Å²	140	81.6 Å²	81.6	75%	0.749	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.1	169	-61.2	-31.4	0	0	0	108.1	S57	N28-S57 WeakPolarHBondContact CA-O 3.39Å; N28-S57 VanDerWaalsContact OD1-CB 3.25Å; N28-S57 WeakPolarHBondContact OD1-CB 3.4Å
29	I	90.6	Very high	73.7	Confident	30 Å²	30	78.4 Å²	78.4	15%	0.154	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122	-179.1	-54.2	176.5	0	0	0	108.4	F31 L51 H56 S57 I58 S59 I314 L318	I29-F31 HydrophobicContact CG2-CD2 4.21Å; I29-F31 HydrophobicContact CG2-CE2 3.85Å; I29-L51 HydrophobicContact CD1-CD1 4.15Å; I29-L51 HydrophobicContact CD1-CD2 4.47Å; I29-H56 HydrophobicContact CD1-CB 3.94Å; I29-H56 HydrophobicContact CG1-CB 4.44Å; I29-S57 PolarHBondContact N-O 2.95Å; I29-I58 HydrophobicContact CB-CD1 3.74Å; I29-I58 HydrophobicContact CD1-CD1 4.02Å; I29-I58 HydrophobicContact CG1-CD1 4.21Å; I29-I58 HydrophobicContact CG2-CD1 4.45Å; I29-S59 PolarHBondContact O-N 3.46Å; I29-I314 HydrophobicContact CD1-CG2 4Å; I29-L318 HydrophobicContact CD1-CD1 4.19Å
30	L	91.6	Very high	75.5	Confident	92 Å²	92	73.6 Å²	73.6	48%	0.482	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.5	175.1	178.2	62.7	0	0	0	110.1	M32 S59 A61 I79	L30-M32 HydrophobicContact CD2-CG 3.9Å; L30-M32 HydrophobicContact CD2-SD 3.97Å; L30-M32 HydrophobicContact CG-CG 3.89Å; L30-S59 WeakPolarHBondContact CA-O 3.41Å; L30-A61 HydrophobicContact CD1-CB 4.35Å; L30-I79 HydrophobicContact CD1-CD1 3.9Å
31	F	91.1	Very high	77.3	Confident	24 Å²	24	67.9 Å²	67.9	11%	0.105	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	123.4	167.9	-80.6	-98.4	0	0	0	109.8	I29 M44 L47 A48 L51 I58 S59 L60 A61	I29-F31 HydrophobicContact CG2-CD2 4.21Å; I29-F31 HydrophobicContact CG2-CE2 3.85Å; F31-M44 HydrophobicContact CB-CE 4.27Å; F31-M44 HydrophobicContact CB-SD 4.13Å; F31-M44 HydrophobicContact CD1-CB 3.86Å; F31-M44 HydrophobicContact CD1-CG 4.17Å; F31-M44 HydrophobicContact CD1-SD 3.89Å; F31-M44 HydrophobicContact CE1-CB 4.43Å; F31-L47 HydrophobicContact CE1-CB 4.43Å; F31-L47 HydrophobicContact CE1-CD2 4.01Å; F31-L47 HydrophobicContact CE1-CG 4.2Å; F31-L47 HydrophobicContact CZ-CB 4.47Å; F31-L47 HydrophobicContact CZ-CD2 4.16Å; F31-L47 HydrophobicContact CZ-CG 3.99Å; F31-A48 HydrophobicContact CD2-CB 4.15Å; F31-A48 HydrophobicContact CE2-CB 4.03Å; F31-A48 HydrophobicContact CZ-CB 4.29Å; F31-L51 HydrophobicContact CE2-CD1 3.86Å; F31-L51 HydrophobicContact CZ-CD1 3.62Å; F31-I58 HydrophobicContact CD2-CG2 3.76Å; F31-I58 HydrophobicContact CE2-CD1 4.46Å; F31-I58 HydrophobicContact CE2-CG2 3.96Å; F31-S59 PolarHBondContact N-O 2.62Å; F31-L60 HydrophobicContact CB-CB 4.33Å; F31-L60 HydrophobicContact CB-CD1 4.2Å; F31-L60 HydrophobicContact CB-CG 3.84Å; F31-A61 PolarHBondContact O-N 2.8Å
32	M	87.9	Confident	79	Confident	115 Å²	115	65.8 Å²	65.8	57%	0.567	36%	0.355	S	S	*	.			trans	-115.5	121.3	174.5	-64.1	-176.5	68.8	0	0	109.6	L30 A61	L30-M32 HydrophobicContact CD2-CG 3.9Å; L30-M32 HydrophobicContact CD2-SD 3.97Å; L30-M32 HydrophobicContact CG-CG 3.89Å; M32-A61 HydrophobicContact CG-CB 4.33Å
33	P	85.1	Confident	80.6	Confident	8 Å²	8	61.8 Å²	61.8	5%	0.052	34%	0.341	C	S	.	.			trans	-73.2	140.5	178.1	30.5	-33.9	0	0	0	109.4	M35 H40 V41 M44 A61 Y63	P33-M35 WeakPolarHBondContact CB-O 3.49Å; P33-M35 PolarHBondContact O-N 3.02Å; P33-H40 HydrophobicContact CB-CB 3.98Å; P33-V41 HydrophobicContact CB-CG2 4.21Å; P33-V41 HydrophobicContact CG-CG2 4.09Å; P33-M44 HydrophobicContact CB-CE 3.64Å; P33-M44 HydrophobicContact CG-CE 4.26Å; P33-A61 WeakPolarHBondContact CD-O 3.18Å; P33-A61 WeakPolarHBondContact CG-O 3.34Å; P33-Y63 HydrophobicContact CG-CD2 4.01Å; P33-Y63 HydrophobicContact CG-CE2 4.14Å
34	A	76	Confident	82.3	Confident	100 Å²	100	56 Å²	56	83%	0.826	31%	0.311	S	S	*	.	S	Bend	trans	-64.9	-19.5	175.9	0	0	0	0	0	113.4
35	M	75.1	Confident	84	Confident	51 Å²	51	55.5 Å²	55.5	25%	0.251	31%	0.307	S	S	.	.	S	Bend	trans	-143.7	161	-180	-56.2	-175.3	77.9	0	0	110.6	P33 A37 H40 F158	P33-M35 WeakPolarHBondContact CB-O 3.49Å; P33-M35 PolarHBondContact O-N 3.02Å; M35-A37 VanDerWaalsContact C-N 3.25Å; M35-A37 PolarHBondContact O-N 3.42Å; M35-H40 PolarHBondContact SD-CE1 3.42Å; M35-F158 HydrophobicContact CB-CE2 4.39Å; M35-F158 HydrophobicContact CB-CZ 4.07Å; M35-F158 HydrophobicContact CE-CD2 4.06Å; M35-F158 HydrophobicContact CE-CE1 4.4Å; M35-F158 HydrophobicContact CE-CE2 3.33Å; M35-F158 HydrophobicContact CE-CZ 3.51Å; M35-F158 HydrophobicContact SD-CE2 3.66Å; M35-F158 HydrophobicContact SD-CZ 4.15Å
36	T	76.9	Confident	85.1	Confident	37 Å²	37	50.3 Å²	50.3	23%	0.227	29%	0.291	C	S	.	.	S	Bend	trans	-73.3	-11.4	-176	59.5	0	0	0	0	114.6	Y63 T83 L88	T36-Y63 HydrophobicContact CG2-CD2 4.17Å; T36-Y63 HydrophobicContact CG2-CG 3.9Å; T36-T83 HydrophobicContact CG2-CG2 4.26Å; T36-L88 HydrophobicContact CG2-CD1 3.78Å; T36-L88 HydrophobicContact CG2-CG 4.35Å
37	A	78.9	Confident	85.8	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.033	27%	0.27	C	S	.	.	S	Bend	trans	-69.7	137.3	-174.2	0	0	0	0	0	113.2	M35 S39 H40 H157 F158	M35-A37 VanDerWaalsContact C-N 3.25Å; M35-A37 PolarHBondContact O-N 3.42Å; A37-S39 PolarHBondContact O-N 3.12Å; A37-H40 WeakPolarHBondContact O-CB 3.5Å; A37-H40 PolarHBondContact O-N 3.44Å; A37-H157 HydrophobicContact CB-CB 3.87Å; A37-F158 HydrophobicContact CB-CE1 3.9Å; A37-F158 HydrophobicContact CB-CE2 3.78Å; A37-F158 HydrophobicContact CB-CZ 3.34Å
38	P	82.7	Confident	86.2	Confident	20 Å²	20	45.4 Å²	45.4	13%	0.13	26%	0.255	C	S	.	.	H	α-helix	trans	-53.6	-28.4	176.6	-29.5	35.5	0	0	0	114.8	H40 V41 K42 E69 L71	P38-H40 VanDerWaalsContact C-N 3.28Å; P38-H40 PolarHBondContact O-N 3.06Å; P38-V41 PolarHBondContact O-N 3.25Å; P38-K42 WeakPolarHBondContact O-CG 3.34Å; P38-K42 PolarHBondContact O-N 2.87Å; P38-E69 HydrophobicContact CG-CB 4.47Å; P38-L71 HydrophobicContact CB-CD1 4.14Å
39	S	82.3	Confident	86.3	Confident	14 Å²	14	42.4 Å²	42.4	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-32.8	174.2	46.6	0	0	0	0	113.8	A37 K42 S43 H157	A37-S39 PolarHBondContact O-N 3.12Å; S39-K42 PolarHBondContact O-N 2.91Å; S39-S43 PolarHBondContact O-N 3.07Å; S39-S43 PolarHBondContact O-OG 3.25Å; S39-H157 WeakPolarHBondContact CB-CE1 3.37Å; S39-H157 VanDerWaalsContact CB-ND1 3.3Å; S39-H157 WeakPolarHBondContact CB-ND1 3.45Å; S39-H157 PolarHBondContact N-CE1 2.99Å; S39-H157 PolarHBondContact OG-CE1 2.89Å; S39-H157 PolarHBondContact OG-ND1 3.32Å
40	H	83.7	Confident	86.3	Confident	52 Å²	52	41.8 Å²	41.8	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-70.2	-39.3	-179.4	-72.6	-114.1	0	0	0	110.3	P33 M35 A37 P38 S43	P33-H40 HydrophobicContact CB-CB 3.98Å; M35-H40 PolarHBondContact SD-CE1 3.42Å; A37-H40 WeakPolarHBondContact O-CB 3.5Å; A37-H40 PolarHBondContact O-N 3.44Å; P38-H40 VanDerWaalsContact C-N 3.28Å; P38-H40 PolarHBondContact O-N 3.06Å; H40-S43 WeakPolarHBondContact CA-OG 3.42Å; H40-S43 PolarHBondContact O-N 3.16Å; H40-S43 PolarHBondContact O-OG 3.32Å
41	V	88.5	Confident	86.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-50.7	171.1	171.8	0	0	0	0	111	P33 P38 S43 M44 L45 L60 Q62 L71 F78	P33-V41 HydrophobicContact CB-CG2 4.21Å; P33-V41 HydrophobicContact CG-CG2 4.09Å; P38-V41 PolarHBondContact O-N 3.25Å; V41-S43 PolarHBondContact O-N 3.37Å; V41-M44 PolarHBondContact O-N 3.16Å; V41-L45 PolarHBondContact O-N 3.48Å; V41-L60 HydrophobicContact CB-CD2 4.16Å; V41-L60 HydrophobicContact CG1-CD1 4.32Å; V41-L60 HydrophobicContact CG1-CD2 3.36Å; V41-L60 HydrophobicContact CG1-CG 4.5Å; V41-L60 HydrophobicContact CG2-CD2 4Å; V41-Q62 HydrophobicContact CG2-CB 4.1Å; V41-Q62 HydrophobicContact CG2-CG 4.03Å; V41-L71 HydrophobicContact CB-CD1 3.83Å; V41-L71 HydrophobicContact CG1-CD1 3.54Å; V41-F78 HydrophobicContact CG1-CE1 3.81Å
42	K	87.6	Confident	86.3	Confident	96 Å²	96	40.8 Å²	40.8	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-57.9	-35.5	179.3	-72.6	178.7	-178.2	178.4	0	113.1	P38 S39 M44 L45 L71	P38-K42 WeakPolarHBondContact O-CG 3.34Å; P38-K42 PolarHBondContact O-N 2.87Å; S39-K42 PolarHBondContact O-N 2.91Å; K42-M44 VanDerWaalsContact C-N 3.28Å; K42-M44 PolarHBondContact O-N 3.18Å; K42-L45 HydrophobicContact CG-CD1 4.47Å; K42-L45 PolarHBondContact O-N 2.78Å; K42-L71 HydrophobicContact CD-CD1 4.44Å; K42-L71 VanDerWaalsContact CE-CD2 3.44Å; K42-L71 HydrophobicContact CG-CD1 3.72Å
43	S	87.1	Confident	86.5	Confident	40 Å²	40	43.9 Å²	43.9	28%	0.28	23%	0.234	S	C	.	.	H	α-helix	trans	-68.4	-22.4	177.8	51.5	0	0	0	0	114.5	S39 H40 V41	S39-S43 PolarHBondContact O-N 3.07Å; S39-S43 PolarHBondContact O-OG 3.25Å; H40-S43 WeakPolarHBondContact CA-OG 3.42Å; H40-S43 PolarHBondContact O-N 3.16Å; H40-S43 PolarHBondContact O-OG 3.32Å; V41-S43 PolarHBondContact O-N 3.37Å
44	M	89.4	Confident	86.7	Confident	31 Å²	31	45.7 Å²	45.7	15%	0.153	24%	0.244	C	C	.	.	H	α-helix	trans	-87.3	-21.5	178.5	-64	-176.4	-59.9	0	0	112.9	F31 P33 V41 K42 P46 L47 A48 L60	F31-M44 HydrophobicContact CB-CE 4.27Å; F31-M44 HydrophobicContact CB-SD 4.13Å; F31-M44 HydrophobicContact CD1-CB 3.86Å; F31-M44 HydrophobicContact CD1-CG 4.17Å; F31-M44 HydrophobicContact CD1-SD 3.89Å; F31-M44 HydrophobicContact CE1-CB 4.43Å; P33-M44 HydrophobicContact CB-CE 3.64Å; P33-M44 HydrophobicContact CG-CE 4.26Å; V41-M44 PolarHBondContact O-N 3.16Å; K42-M44 VanDerWaalsContact C-N 3.28Å; K42-M44 PolarHBondContact O-N 3.18Å; M44-P46 VanDerWaalsContact C-CD 3.46Å; M44-L47 PolarHBondContact O-N 3.05Å; M44-A48 WeakPolarHBondContact O-CB 3.49Å; M44-A48 PolarHBondContact O-N 2.82Å; M44-L60 HydrophobicContact CB-CD1 4.29Å; M44-L60 HydrophobicContact CE-CD1 4.22Å; M44-L60 HydrophobicContact CE-CD2 4.05Å; M44-L60 HydrophobicContact CE-CG 4.11Å
45	L	90.6	Very high	87.4	Confident	17 Å²	17	43.2 Å²	43.2	9%	0.089	23%	0.228	C	C	.	.	H	α-helix	trans	-54	-41.6	-175.8	-71.2	174.1	0	0	0	114.4	V41 K42 L47 A48 K49 L60 E73 F78	V41-L45 PolarHBondContact O-N 3.48Å; K42-L45 HydrophobicContact CG-CD1 4.47Å; K42-L45 PolarHBondContact O-N 2.78Å; L45-L47 PolarHBondContact O-N 3.23Å; L45-A48 PolarHBondContact O-N 3.42Å; L45-K49 VanDerWaalsContact O-CB 3.31Å; L45-K49 WeakPolarHBondContact O-CB 3.37Å; L45-K49 VanDerWaalsContact O-CG 3.25Å; L45-K49 WeakPolarHBondContact O-CG 3.42Å; L45-K49 PolarHBondContact O-N 3.26Å; L45-L60 HydrophobicContact CD2-CD1 4.02Å; L45-E73 HydrophobicContact CD2-CB 4.3Å; L45-E73 HydrophobicContact CD2-CG 4.34Å; L45-F78 HydrophobicContact CD2-CZ 4.08Å
46	P	90.7	Very high	88.2	Confident	61 Å²	61	41 Å²	41	40%	0.396	22%	0.217	S	C	.	.	H	α-helix	trans	-58.3	-46.1	178.2	-26.2	36.1	0	0	0	112.9	M44 A50 T307	M44-P46 VanDerWaalsContact C-CD 3.46Å; P46-A50 WeakPolarHBondContact O-CB 3.34Å; P46-A50 PolarHBondContact O-N 2.91Å; P46-T307 HydrophobicContact CB-CG2 4.42Å
47	L	92.1	Very high	88.8	Confident	22 Å²	22	41.7 Å²	41.7	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-71.1	-42.8	179.6	-178.2	60.4	0	0	0	111.9	F31 M44 L45 K49 A50 L51 V124 T307 K311 I314	F31-L47 HydrophobicContact CE1-CB 4.43Å; F31-L47 HydrophobicContact CE1-CD2 4.01Å; F31-L47 HydrophobicContact CE1-CG 4.2Å; F31-L47 HydrophobicContact CZ-CB 4.47Å; F31-L47 HydrophobicContact CZ-CD2 4.16Å; F31-L47 HydrophobicContact CZ-CG 3.99Å; M44-L47 PolarHBondContact O-N 3.05Å; L45-L47 PolarHBondContact O-N 3.23Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.4Å; L47-A50 WeakPolarHBondContact O-CB 3.23Å; L47-A50 PolarHBondContact O-N 3.05Å; L47-A50 VanDerWaalsContact O-N 3.11Å; L47-L51 HydrophobicContact CD1-CD1 4.31Å; L47-L51 HydrophobicContact CD1-CG 4.3Å; L47-L51 HydrophobicContact CG-CD1 4.13Å; L47-L51 PolarHBondContact O-N 3.04Å; L47-V124 HydrophobicContact CD2-CG1 4.1Å; L47-T307 WeakPolarHBondContact CD1-O 3.34Å; L47-K311 HydrophobicContact CD1-CB 4.22Å; L47-I314 HydrophobicContact CD2-CD1 3.97Å; L47-I314 HydrophobicContact CG-CD1 4.46Å
48	A	92.4	Very high	89.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-49.5	174.3	0	0	0	0	0	111.4	F31 M44 L45 A50 L51 R52 I58	F31-A48 HydrophobicContact CD2-CB 4.15Å; F31-A48 HydrophobicContact CE2-CB 4.03Å; F31-A48 HydrophobicContact CZ-CB 4.29Å; M44-A48 WeakPolarHBondContact O-CB 3.49Å; M44-A48 PolarHBondContact O-N 2.82Å; L45-A48 PolarHBondContact O-N 3.42Å; A48-A50 VanDerWaalsContact C-N 3.31Å; A48-A50 PolarHBondContact O-N 2.78Å; A48-L51 PolarHBondContact O-N 3.01Å; A48-R52 PolarHBondContact O-N 2.9Å; A48-I58 HydrophobicContact CB-CG2 3.81Å
49	K	91.8	Very high	89.9	Confident	76 Å²	76	41.5 Å²	41.5	33%	0.33	22%	0.222	S	C	.	.	H	α-helix	trans	-62.2	-37.5	175.9	-73.3	173.6	175.6	-179.1	0	112.2	L45 L47 K53 E73 V76	L45-K49 VanDerWaalsContact O-CB 3.31Å; L45-K49 WeakPolarHBondContact O-CB 3.37Å; L45-K49 VanDerWaalsContact O-CG 3.25Å; L45-K49 WeakPolarHBondContact O-CG 3.42Å; L45-K49 PolarHBondContact O-N 3.26Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.4Å; K49-K53 WeakPolarHBondContact O-CG 3.36Å; K49-K53 PolarHBondContact O-N 3.41Å; K49-E73 VanDerWaalsContact CE-CD 3.45Å; K49-E73 WeakPolarHBondContact CE-OE1 3.46Å; K49-E73 IonicContact NZ-OE1 3.19Å; K49-E73 PolarHBondContact NZ-OE1 3.41Å; K49-E73 IonicContact NZ-OE2 2.68Å; K49-E73 PolarHBondContact NZ-OE2 3.14Å; K49-V76 HydrophobicContact CG-CG2 4.4Å
50	A	91.8	Very high	90.5	Very high	17 Å²	17	40.9 Å²	40.9	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-44.3	179.6	0	0	0	0	0	112.3	P46 L47 A48 R52 K53 D54 T307 K311	P46-A50 WeakPolarHBondContact O-CB 3.34Å; P46-A50 PolarHBondContact O-N 2.91Å; L47-A50 WeakPolarHBondContact O-CB 3.23Å; L47-A50 PolarHBondContact O-N 3.05Å; L47-A50 VanDerWaalsContact O-N 3.11Å; A48-A50 VanDerWaalsContact C-N 3.31Å; A48-A50 PolarHBondContact O-N 2.78Å; A50-R52 VanDerWaalsContact C-N 3.35Å; A50-K53 WeakPolarHBondContact O-CB 3.37Å; A50-K53 PolarHBondContact O-N 3.36Å; A50-D54 PolarHBondContact O-N 2.85Å; A50-T307 HydrophobicContact CB-CG2 3.62Å; A50-K311 HydrophobicContact CB-CD 4Å
51	L	91.8	Very high	90.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-35.2	176.2	-71.9	165.6	0	0	0	112.5	I29 F31 L47 A48 K53 D54 H56 I58 K311 I314 N315	I29-L51 HydrophobicContact CD1-CD1 4.15Å; I29-L51 HydrophobicContact CD1-CD2 4.47Å; F31-L51 HydrophobicContact CE2-CD1 3.86Å; F31-L51 HydrophobicContact CZ-CD1 3.62Å; L47-L51 HydrophobicContact CD1-CD1 4.31Å; L47-L51 HydrophobicContact CD1-CG 4.3Å; L47-L51 HydrophobicContact CG-CD1 4.13Å; L47-L51 PolarHBondContact O-N 3.04Å; A48-L51 PolarHBondContact O-N 3.01Å; L51-K53 VanDerWaalsContact C-N 3.28Å; L51-K53 PolarHBondContact O-N 3.41Å; L51-D54 WeakPolarHBondContact O-CA 3.35Å; L51-D54 WeakPolarHBondContact O-CB 3.4Å; L51-D54 PolarHBondContact O-N 3.21Å; L51-H56 WeakPolarHBondContact O-CB 3.25Å; L51-H56 PolarHBondContact O-N 3.04Å; L51-I58 HydrophobicContact CB-CD1 3.79Å; L51-I58 HydrophobicContact CB-CG1 4.45Å; L51-K311 HydrophobicContact CD2-CB 4.45Å; L51-K311 HydrophobicContact CD2-CG 3.89Å; L51-K311 HydrophobicContact CG-CG 4.39Å; L51-I314 HydrophobicContact CD1-CD1 3.68Å; L51-I314 HydrophobicContact CD1-CG2 4.16Å; L51-I314 HydrophobicContact CD2-CB 3.98Å; L51-I314 HydrophobicContact CD2-CD1 4.44Å; L51-I314 HydrophobicContact CD2-CG2 3.68Å; L51-N315 WeakPolarHBondContact CD2-OD1 3.34Å
52	R	90.4	Very high	91	Very high	95 Å²	95	38.5 Å²	38.5	36%	0.358	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-38.6	173.7	-171.9	173.7	-179.6	118.7	-3.4	112.1	A48 A50 D54 G55 I58 N75	A48-R52 PolarHBondContact O-N 2.9Å; A50-R52 VanDerWaalsContact C-N 3.35Å; R52-D54 PolarHBondContact O-N 2.81Å; R52-G55 WeakPolarHBondContact O-CA 3.34Å; R52-G55 PolarHBondContact O-N 2.76Å; R52-I58 HydrophobicContact CB-CG1 3.76Å; R52-I58 HydrophobicContact CG-CG1 4.48Å; R52-N75 WeakPolarHBondContact CD-O 3.23Å; R52-N75 PolarHBondContact NE-O 2.91Å; R52-N75 PolarHBondContact NH1-O 3.48Å
53	K	91	Very high	91	Very high	180 Å²	180	37.1 Å²	37.1	78%	0.783	20%	0.2	S	C	*	.	H	α-helix	trans	-62.8	-24	174.9	-72.7	177.5	178.8	-172.4	0	112.8	K49 A50 L51 G55	K49-K53 WeakPolarHBondContact O-CG 3.36Å; K49-K53 PolarHBondContact O-N 3.41Å; A50-K53 WeakPolarHBondContact O-CB 3.37Å; A50-K53 PolarHBondContact O-N 3.36Å; L51-K53 VanDerWaalsContact C-N 3.28Å; L51-K53 PolarHBondContact O-N 3.41Å; K53-G55 PolarHBondContact O-N 2.8Å
54	D	90.3	Very high	90.9	Very high	47 Å²	47	36.6 Å²	36.6	25%	0.251	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	9.1	172.6	-65	-2	0	0	0	112.4	A50 L51 R52 K311 N315	A50-D54 PolarHBondContact O-N 2.85Å; L51-D54 WeakPolarHBondContact O-CA 3.35Å; L51-D54 WeakPolarHBondContact O-CB 3.4Å; L51-D54 PolarHBondContact O-N 3.21Å; R52-D54 PolarHBondContact O-N 2.81Å; D54-K311 VanDerWaalsContact CG-NZ 3.34Å; D54-K311 IonicContact OD1-NZ 2.91Å; D54-K311 PolarHBondContact OD1-NZ 3.3Å; D54-K311 WeakPolarHBondContact OD2-CD 3.46Å; D54-K311 WeakPolarHBondContact OD2-CE 3.49Å; D54-K311 WeakPolarHBondContact OD2-CG 3.42Å; D54-K311 IonicContact OD2-NZ 3.1Å; D54-K311 PolarHBondContact OD2-NZ 2.9Å; D54-K311 VanDerWaalsContact OD2-NZ 3.08Å; D54-N315 PolarHBondContact OD2-ND2 3.28Å
55	G	90.5	Very high	90.4	Very high	48 Å²	48	38 Å²	38	50%	0.495	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	4.5	174.2	0	0	0	0	0	115.1	A26 R52 K53	A26-G55 WeakPolarHBondContact CB-O 3.42Å; R52-G55 WeakPolarHBondContact O-CA 3.34Å; R52-G55 PolarHBondContact O-N 2.76Å; K53-G55 PolarHBondContact O-N 2.8Å
56	H	91.2	Very high	89.8	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.019	22%	0.222	C	C	.	.			trans	-76.1	145.5	177.5	-61.5	-29.4	0	0	0	112.6	V24 N27 I29 L51 I58 N315	V24-H56 WeakPolarHBondContact CG1-CE1 3.46Å; N27-H56 PolarHBondContact N-ND1 2.63Å; I29-H56 HydrophobicContact CD1-CB 3.94Å; I29-H56 HydrophobicContact CG1-CB 4.44Å; L51-H56 WeakPolarHBondContact O-CB 3.25Å; L51-H56 PolarHBondContact O-N 3.04Å; H56-I58 HydrophobicContact CB-CD1 3.7Å; H56-I58 HydrophobicContact CB-CG1 4.44Å; H56-N315 PolarHBondContact NE2-OD1 3.44Å
57	S	91	Very high	89.4	Confident	52 Å²	52	44.8 Å²	44.8	36%	0.364	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.9	167.4	-169.1	0	0	0	0	108.3	N27 N28 I29	N27-S57 PolarHBondContact O-N 3.26Å; N28-S57 WeakPolarHBondContact CA-O 3.39Å; N28-S57 VanDerWaalsContact OD1-CB 3.25Å; N28-S57 WeakPolarHBondContact OD1-CB 3.4Å; I29-S57 PolarHBondContact N-O 2.95Å
58	I	91.8	Very high	89	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.1	-174	-52.1	-59.7	0	0	0	109.8	I29 F31 A48 L51 R52 H56 E77	I29-I58 HydrophobicContact CB-CD1 3.74Å; I29-I58 HydrophobicContact CD1-CD1 4.02Å; I29-I58 HydrophobicContact CG1-CD1 4.21Å; I29-I58 HydrophobicContact CG2-CD1 4.45Å; F31-I58 HydrophobicContact CD2-CG2 3.76Å; F31-I58 HydrophobicContact CE2-CD1 4.46Å; F31-I58 HydrophobicContact CE2-CG2 3.96Å; A48-I58 HydrophobicContact CB-CG2 3.81Å; L51-I58 HydrophobicContact CB-CD1 3.79Å; L51-I58 HydrophobicContact CB-CG1 4.45Å; R52-I58 HydrophobicContact CB-CG1 3.76Å; R52-I58 HydrophobicContact CG-CG1 4.48Å; H56-I58 HydrophobicContact CB-CD1 3.7Å; H56-I58 HydrophobicContact CB-CG1 4.44Å; I58-E77 PolarHBondContact O-N 3.36Å
59	S	92.8	Very high	88.5	Confident	19 Å²	19	54.5 Å²	54.5	13%	0.133	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.6	169.5	-43.3	0	0	0	0	109.2	I29 L30 F31 E77	I29-S59 PolarHBondContact O-N 3.46Å; L30-S59 WeakPolarHBondContact CA-O 3.41Å; F31-S59 PolarHBondContact N-O 2.62Å; S59-E77 CarbonylContact C-O 3.58Å; S59-E77 VanDerWaalsContact CA-O 3.27Å; S59-E77 WeakPolarHBondContact CA-O 3.4Å; S59-E77 PolarHBondContact OG-OE2 2.83Å
60	L	93.8	Very high	88.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.7	-177.5	-163.2	154.2	0	0	0	109.4	F31 V41 M44 L45 V76 E77 F78 I79	F31-L60 HydrophobicContact CB-CB 4.33Å; F31-L60 HydrophobicContact CB-CD1 4.2Å; F31-L60 HydrophobicContact CB-CG 3.84Å; V41-L60 HydrophobicContact CB-CD2 4.16Å; V41-L60 HydrophobicContact CG1-CD1 4.32Å; V41-L60 HydrophobicContact CG1-CD2 3.36Å; V41-L60 HydrophobicContact CG1-CG 4.5Å; V41-L60 HydrophobicContact CG2-CD2 4Å; M44-L60 HydrophobicContact CB-CD1 4.29Å; M44-L60 HydrophobicContact CE-CD1 4.22Å; M44-L60 HydrophobicContact CE-CD2 4.05Å; M44-L60 HydrophobicContact CE-CG 4.11Å; L45-L60 HydrophobicContact CD2-CD1 4.02Å; L60-V76 HydrophobicContact CB-CG1 4Å; L60-E77 PolarHBondContact N-O 2.75Å; L60-F78 HydrophobicContact CB-CD1 4.5Å; L60-F78 HydrophobicContact CD2-CD1 4.13Å; L60-F78 HydrophobicContact CD2-CE1 3.91Å; L60-F78 CarbonylContact O-C 3.45Å; L60-F78 WeakPolarHBondContact O-CA 3.3Å; L60-I79 PolarHBondContact O-N 2.66Å
61	A	92.5	Very high	88	Confident	3 Å²	3	54.5 Å²	54.5	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	130.7	174.7	0	0	0	0	0	110.2	L30 F31 M32 P33 I79 L81	L30-A61 HydrophobicContact CD1-CB 4.35Å; F31-A61 PolarHBondContact O-N 2.8Å; M32-A61 HydrophobicContact CG-CB 4.33Å; P33-A61 WeakPolarHBondContact CD-O 3.18Å; P33-A61 WeakPolarHBondContact CG-O 3.34Å; A61-I79 CarbonylContact C-O 3.49Å; A61-I79 WeakPolarHBondContact CA-O 3.48Å; A61-L81 HydrophobicContact CB-CD1 4.24Å
62	Q	91.1	Very high	87.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.3	171.8	175.1	173.6	-5.4	0	0	109.7	V41 E69 F78 I79 Y80 L81	V41-Q62 HydrophobicContact CG2-CB 4.1Å; V41-Q62 HydrophobicContact CG2-CG 4.03Å; Q62-E69 PolarHBondContact NE2-O 3.42Å; Q62-F78 HydrophobicContact CB-CD1 4.3Å; Q62-I79 PolarHBondContact N-O 2.98Å; Q62-Y80 HydrophobicContact CB-CD1 4.22Å; Q62-Y80 WeakPolarHBondContact O-CA 2.91Å; Q62-L81 PolarHBondContact O-N 3.47Å
63	Y	86.8	Confident	87.5	Confident	66 Å²	66	58.1 Å²	58.1	26%	0.259	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	139.8	165.4	-56.2	-80.5	0	0	0	110.1	P33 T36 L81 T83	P33-Y63 HydrophobicContact CG-CD2 4.01Å; P33-Y63 HydrophobicContact CG-CE2 4.14Å; T36-Y63 HydrophobicContact CG2-CD2 4.17Å; T36-Y63 HydrophobicContact CG2-CG 3.9Å; Y63-L81 CarbonylContact C-O 3.52Å; Y63-L81 VanDerWaalsContact CA-O 3.24Å; Y63-L81 WeakPolarHBondContact CA-O 3.32Å; Y63-L81 HydrophobicContact CD1-CB 3.69Å; Y63-L81 HydrophobicContact CD1-CD1 4.07Å; Y63-L81 HydrophobicContact CE1-CB 3.96Å; Y63-L81 HydrophobicContact CE1-CD1 3.53Å; Y63-L81 HydrophobicContact CE1-CG 4.4Å; Y63-T83 HydrophobicContact CD1-CG2 4.27Å
64	Y	84.4	Confident	87.1	Confident	30 Å²	30	56 Å²	56	12%	0.118	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	148.9	177.5	74.6	-74.5	0	0	0	111.6	K70 L81 S82 T83	Y64-K70 HydrophobicContact CD2-CG 4.14Å; Y64-K70 HydrophobicContact CE2-CD 4.44Å; Y64-K70 HydrophobicContact CG-CG 4.13Å; Y64-K70 WeakPolarHBondContact OH-CE 3.39Å; Y64-K70 PolarHBondContact OH-NZ 3.31Å; Y64-L81 WeakPolarHBondContact CD1-O 3.26Å; Y64-L81 PolarHBondContact N-O 2.84Å; Y64-S82 WeakPolarHBondContact O-CA 3.32Å; Y64-T83 PolarHBondContact O-N 3.21Å; Y64-T83 VanDerWaalsContact O-N 3.13Å
65	S	78.8	Confident	86.5	Confident	61 Å²	61	59.3 Å²	59.3	43%	0.427	32%	0.318	S	S	.	.	S	Bend	trans	-104.6	-37.5	174	68.3	0	0	0	0	111.4	E69	S65-E69 PolarHBondContact N-OE2 3.25Å; S65-E69 PolarHBondContact OG-OE1 3.45Å; S65-E69 PolarHBondContact OG-OE2 3.36Å
66	E	78.8	Confident	86.2	Confident	94 Å²	94	57.8 Å²	57.8	44%	0.439	30%	0.299	S	S	.	.	S	Bend	trans	-123.2	147.1	-179.9	-63.9	-175.7	-167.2	0	0	111.5	K68 E69	E66-K68 HydrophobicContact CB-CG 4.28Å; E66-K68 PolarHBondContact O-N 3.01Å; E66-K68 VanDerWaalsContact O-N 3.16Å; E66-K68 IonicContact OE1-NZ 3.39Å; E66-K68 WeakPolarHBondContact OE2-CD 3.26Å; E66-K68 WeakPolarHBondContact OE2-CE 3.45Å; E66-K68 IonicContact OE2-NZ 3.93Å; E66-K68 PolarHBondContact OE2-NZ 2.91Å; E66-E69 HydrophobicContact CB-CG 4.2Å; E66-E69 PolarHBondContact N-OE2 2.7Å; E66-E69 VanDerWaalsContact N-OE2 3.14Å; E66-E69 WeakPolarHBondContact O-CB 2.9Å; E66-E69 PolarHBondContact O-N 3.3Å
67	Q	83.2	Confident	86.2	Confident	125 Å²	125	62.8 Å²	62.8	58%	0.584	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-58.9	-33.3	-176.8	-63.9	-62.5	-28	0	0	113.2	E69 K70	Q67-E69 PolarHBondContact O-N 3.4Å; Q67-K70 WeakPolarHBondContact O-CB 3.37Å; Q67-K70 PolarHBondContact O-N 3.26Å
68	K	82.8	Confident	86.3	Confident	169 Å²	169	61.5 Å²	61.5	74%	0.735	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-66.9	-14.9	179.5	75.5	-168.5	-167.4	-149	0	114	E66	E66-K68 HydrophobicContact CB-CG 4.28Å; E66-K68 PolarHBondContact O-N 3.01Å; E66-K68 VanDerWaalsContact O-N 3.16Å; E66-K68 IonicContact OE1-NZ 3.39Å; E66-K68 WeakPolarHBondContact OE2-CD 3.26Å; E66-K68 WeakPolarHBondContact OE2-CE 3.45Å; E66-K68 IonicContact OE2-NZ 3.93Å; E66-K68 PolarHBondContact OE2-NZ 2.91Å
69	E	81.1	Confident	86.4	Confident	58 Å²	58	64.7 Å²	64.7	27%	0.271	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-80.8	-22.2	178.6	-60.3	179.5	145.9	0	0	112.3	P38 Q62 S65 E66 Q67 L71	P38-E69 HydrophobicContact CG-CB 4.47Å; Q62-E69 PolarHBondContact NE2-O 3.42Å; S65-E69 PolarHBondContact N-OE2 3.25Å; S65-E69 PolarHBondContact OG-OE1 3.45Å; S65-E69 PolarHBondContact OG-OE2 3.36Å; E66-E69 HydrophobicContact CB-CG 4.2Å; E66-E69 PolarHBondContact N-OE2 2.7Å; E66-E69 VanDerWaalsContact N-OE2 3.14Å; E66-E69 WeakPolarHBondContact O-CB 2.9Å; E66-E69 PolarHBondContact O-N 3.3Å; Q67-E69 PolarHBondContact O-N 3.4Å; E69-L71 PolarHBondContact O-N 2.87Å
70	K	87.1	Confident	86.3	Confident	63 Å²	63	67.7 Å²	67.7	27%	0.274	34%	0.336	S	S	.	.			trans	-57.3	123.7	-178.5	-70.4	-175	173.9	172.5	0	110.2	Y64 Q67 Y80	Y64-K70 HydrophobicContact CD2-CG 4.14Å; Y64-K70 HydrophobicContact CE2-CD 4.44Å; Y64-K70 HydrophobicContact CG-CG 4.13Å; Y64-K70 WeakPolarHBondContact OH-CE 3.39Å; Y64-K70 PolarHBondContact OH-NZ 3.31Å; Q67-K70 WeakPolarHBondContact O-CB 3.37Å; Q67-K70 PolarHBondContact O-N 3.26Å; K70-Y80 HydrophobicContact CB-CD1 4.17Å; K70-Y80 HydrophobicContact CB-CE1 3.67Å; K70-Y80 HydrophobicContact CD-CD1 3.9Å; K70-Y80 HydrophobicContact CD-CD2 4.37Å; K70-Y80 HydrophobicContact CD-CE1 4Å; K70-Y80 HydrophobicContact CD-CE2 4.46Å; K70-Y80 HydrophobicContact CD-CG 4.08Å; K70-Y80 HydrophobicContact CG-CD1 3.7Å; K70-Y80 HydrophobicContact CG-CE1 3.74Å; K70-Y80 HydrophobicContact CG-CG 4.36Å
71	L	86.8	Confident	86	Confident	30 Å²	30	70.9 Å²	70.9	16%	0.157	35%	0.352	C	S	.	.			trans	-92.4	138.9	172.8	-60.4	172.2	0	0	0	108.4	P38 V41 K42 E69 F78 Y80	P38-L71 HydrophobicContact CB-CD1 4.14Å; V41-L71 HydrophobicContact CB-CD1 3.83Å; V41-L71 HydrophobicContact CG1-CD1 3.54Å; K42-L71 HydrophobicContact CD-CD1 4.44Å; K42-L71 VanDerWaalsContact CE-CD2 3.44Å; K42-L71 HydrophobicContact CG-CD1 3.72Å; E69-L71 PolarHBondContact O-N 2.87Å; L71-F78 HydrophobicContact CB-CE1 4Å; L71-F78 HydrophobicContact CB-CZ 4.27Å; L71-F78 WeakPolarHBondContact O-CD1 3.15Å; L71-F78 WeakPolarHBondContact O-CE1 3.48Å; L71-Y80 PolarHBondContact O-OH 3.46Å
72	S	87.6	Confident	85.6	Confident	101 Å²	101	73.1 Å²	73.1	71%	0.706	37%	0.368	S	S	*	.			trans	-120.7	141.4	169.9	59	0	0	0	0	108.5
73	E	84.6	Confident	85	Confident	69 Å²	69	74.5 Å²	74.5	32%	0.322	38%	0.376	S	S	.	.			trans	-144	135.3	176.3	-171.3	70.7	-138.4	0	0	108.9	L45 K49 N75 V76 F78	L45-E73 HydrophobicContact CD2-CB 4.3Å; L45-E73 HydrophobicContact CD2-CG 4.34Å; K49-E73 VanDerWaalsContact CE-CD 3.45Å; K49-E73 WeakPolarHBondContact CE-OE1 3.46Å; K49-E73 IonicContact NZ-OE1 3.19Å; K49-E73 PolarHBondContact NZ-OE1 3.41Å; K49-E73 IonicContact NZ-OE2 2.68Å; K49-E73 PolarHBondContact NZ-OE2 3.14Å; E73-N75 PolarHBondContact O-N 3.5Å; E73-V76 HydrophobicContact CB-CB 4.24Å; E73-V76 HydrophobicContact CB-CG2 4.3Å; E73-V76 HydrophobicContact CG-CG2 4.19Å; E73-V76 PolarHBondContact O-N 3.15Å; E73-V76 VanDerWaalsContact O-N 3.13Å; E73-F78 HydrophobicContact CB-CE2 3.74Å; E73-F78 HydrophobicContact CB-CZ 4.03Å
74	D	81.4	Confident	84.2	Confident	136 Å²	136	81.4 Å²	81.4	73%	0.727	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	133	-179.1	-68.9	-18.9	0	0	0	110.4	V76	D74-V76 PolarHBondContact O-N 3.46Å
75	N	78.3	Confident	83	Confident	117 Å²	117	83.2 Å²	83.2	63%	0.626	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	28.1	178.9	-53.1	-68.2	0	0	0	113.7	R52 E73	R52-N75 WeakPolarHBondContact CD-O 3.23Å; R52-N75 PolarHBondContact NE-O 2.91Å; R52-N75 PolarHBondContact NH1-O 3.48Å; E73-N75 PolarHBondContact O-N 3.5Å
76	V	84.6	Confident	82.1	Confident	15 Å²	15	88.1 Å²	88.1	9%	0.091	45%	0.448	C	S	.	.			trans	-123.5	123.9	164.3	179.8	0	0	0	0	107.2	K49 L60 E73 D74 F78	K49-V76 HydrophobicContact CG-CG2 4.4Å; L60-V76 HydrophobicContact CB-CG1 4Å; E73-V76 HydrophobicContact CB-CB 4.24Å; E73-V76 HydrophobicContact CB-CG2 4.3Å; E73-V76 HydrophobicContact CG-CG2 4.19Å; E73-V76 PolarHBondContact O-N 3.15Å; E73-V76 VanDerWaalsContact O-N 3.13Å; D74-V76 PolarHBondContact O-N 3.46Å; V76-F78 HydrophobicContact CB-CD2 4.4Å; V76-F78 HydrophobicContact CB-CE2 3.87Å; V76-F78 HydrophobicContact CG1-CD2 4.19Å; V76-F78 HydrophobicContact CG1-CE2 3.79Å; V76-F78 HydrophobicContact CG1-CZ 4.25Å; V76-F78 WeakPolarHBondContact O-CD2 3.31Å
77	E	90.9	Very high	81.2	Confident	109 Å²	109	86.9 Å²	86.9	51%	0.509	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	123.3	175.2	-175.9	-174	-164.7	0	0	108.8	I58 S59 L60	I58-E77 PolarHBondContact O-N 3.36Å; S59-E77 CarbonylContact C-O 3.58Å; S59-E77 VanDerWaalsContact CA-O 3.27Å; S59-E77 WeakPolarHBondContact CA-O 3.4Å; S59-E77 PolarHBondContact OG-OE2 2.83Å; L60-E77 PolarHBondContact N-O 2.75Å
78	F	93.3	Very high	80.2	Confident	25 Å²	25	83.9 Å²	83.9	11%	0.11	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.5	175.8	-76.1	-101.1	0	0	0	110.8	V41 L45 L60 Q62 L71 E73 V76 Y80	V41-F78 HydrophobicContact CG1-CE1 3.81Å; L45-F78 HydrophobicContact CD2-CZ 4.08Å; L60-F78 HydrophobicContact CB-CD1 4.5Å; L60-F78 HydrophobicContact CD2-CD1 4.13Å; L60-F78 HydrophobicContact CD2-CE1 3.91Å; L60-F78 CarbonylContact O-C 3.45Å; L60-F78 WeakPolarHBondContact O-CA 3.3Å; Q62-F78 HydrophobicContact CB-CD1 4.3Å; L71-F78 HydrophobicContact CB-CE1 4Å; L71-F78 HydrophobicContact CB-CZ 4.27Å; L71-F78 WeakPolarHBondContact O-CD1 3.15Å; L71-F78 WeakPolarHBondContact O-CE1 3.48Å; E73-F78 HydrophobicContact CB-CE2 3.74Å; E73-F78 HydrophobicContact CB-CZ 4.03Å; V76-F78 HydrophobicContact CB-CD2 4.4Å; V76-F78 HydrophobicContact CB-CE2 3.87Å; V76-F78 HydrophobicContact CG1-CD2 4.19Å; V76-F78 HydrophobicContact CG1-CE2 3.79Å; V76-F78 HydrophobicContact CG1-CZ 4.25Å; V76-F78 WeakPolarHBondContact O-CD2 3.31Å; F78-Y80 HydrophobicContact CB-CD1 4.34Å; F78-Y80 HydrophobicContact CB-CD2 4.37Å; F78-Y80 HydrophobicContact CB-CE1 3.73Å; F78-Y80 HydrophobicContact CB-CE2 3.76Å; F78-Y80 VanDerWaalsContact CB-CZ 3.41Å; F78-Y80 HydrophobicContact CD1-CE1 4.24Å; F78-Y80 HydrophobicContact CG-CE1 4.22Å
79	I	93.3	Very high	79.5	Confident	68 Å²	68	77.5 Å²	77.5	35%	0.349	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	103.8	170.4	-60.5	169.7	0	0	0	107	L30 L60 A61 Q62 L81	L30-I79 HydrophobicContact CD1-CD1 3.9Å; L60-I79 PolarHBondContact O-N 2.66Å; A61-I79 CarbonylContact C-O 3.49Å; A61-I79 WeakPolarHBondContact CA-O 3.48Å; Q62-I79 PolarHBondContact N-O 2.98Å; I79-L81 HydrophobicContact CG2-CD2 4.11Å; I79-L81 HydrophobicContact CG2-CG 4.41Å
80	Y	91.6	Very high	79.2	Confident	83 Å²	83	78.8 Å²	78.8	33%	0.325	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.1	-177	-58.2	-73.1	0	0	0	111.4	Q62 K70 L71 F78	Q62-Y80 HydrophobicContact CB-CD1 4.22Å; Q62-Y80 WeakPolarHBondContact O-CA 2.91Å; K70-Y80 HydrophobicContact CB-CD1 4.17Å; K70-Y80 HydrophobicContact CB-CE1 3.67Å; K70-Y80 HydrophobicContact CD-CD1 3.9Å; K70-Y80 HydrophobicContact CD-CD2 4.37Å; K70-Y80 HydrophobicContact CD-CE1 4Å; K70-Y80 HydrophobicContact CD-CE2 4.46Å; K70-Y80 HydrophobicContact CD-CG 4.08Å; K70-Y80 HydrophobicContact CG-CD1 3.7Å; K70-Y80 HydrophobicContact CG-CE1 3.74Å; K70-Y80 HydrophobicContact CG-CG 4.36Å; L71-Y80 PolarHBondContact O-OH 3.46Å; F78-Y80 HydrophobicContact CB-CD1 4.34Å; F78-Y80 HydrophobicContact CB-CD2 4.37Å; F78-Y80 HydrophobicContact CB-CE1 3.73Å; F78-Y80 HydrophobicContact CB-CE2 3.76Å; F78-Y80 VanDerWaalsContact CB-CZ 3.41Å; F78-Y80 HydrophobicContact CD1-CE1 4.24Å; F78-Y80 HydrophobicContact CG-CE1 4.22Å
81	L	87.8	Confident	79	Confident	66 Å²	66	83.2 Å²	83.2	35%	0.346	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	112.4	-179.4	-59	174.1	0	0	0	109	A61 Q62 Y63 Y64 I79	A61-L81 HydrophobicContact CB-CD1 4.24Å; Q62-L81 PolarHBondContact O-N 3.47Å; Y63-L81 CarbonylContact C-O 3.52Å; Y63-L81 VanDerWaalsContact CA-O 3.24Å; Y63-L81 WeakPolarHBondContact CA-O 3.32Å; Y63-L81 HydrophobicContact CD1-CB 3.69Å; Y63-L81 HydrophobicContact CD1-CD1 4.07Å; Y63-L81 HydrophobicContact CE1-CB 3.96Å; Y63-L81 HydrophobicContact CE1-CD1 3.53Å; Y63-L81 HydrophobicContact CE1-CG 4.4Å; Y64-L81 WeakPolarHBondContact CD1-O 3.26Å; Y64-L81 PolarHBondContact N-O 2.84Å; I79-L81 HydrophobicContact CG2-CD2 4.11Å; I79-L81 HydrophobicContact CG2-CG 4.41Å
82	S	84.4	Confident	78.8	Confident	51 Å²	51	89.4 Å²	89.4	36%	0.357	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	137	177.7	-176	0	0	0	0	110.4	Y64 Y84	Y64-S82 WeakPolarHBondContact O-CA 3.32Å; S82-Y84 PolarHBondContact OG-N 3.08Å
83	T	77.9	Confident	78.5	Confident	28 Å²	28	86.1 Å²	86.1	17%	0.172	44%	0.439	C	S	.	.			trans	-93.9	10.6	176.2	66.4	0	0	0	0	113.8	T36 Y63 Y64 G85 E86	T36-T83 HydrophobicContact CG2-CG2 4.26Å; Y63-T83 HydrophobicContact CD1-CG2 4.27Å; Y64-T83 PolarHBondContact O-N 3.21Å; Y64-T83 VanDerWaalsContact O-N 3.13Å; T83-G85 PolarHBondContact O-N 3.28Å; T83-E86 WeakPolarHBondContact CB-O 3.48Å; T83-E86 WeakPolarHBondContact O-CB 3.49Å; T83-E86 PolarHBondContact O-N 3.24Å; T83-E86 PolarHBondContact OG1-O 3.28Å
84	Y	69.1	Low	78.7	Confident	211 Å²	211	83.1 Å²	83.1	83%	0.827	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	35	177.1	-66.6	-80.2	0	0	0	115.4	S82 E86	S82-Y84 PolarHBondContact OG-N 3.08Å; Y84-E86 VanDerWaalsContact C-N 3.27Å; Y84-E86 PolarHBondContact O-N 3.13Å
85	G	58.9	Low	79	Confident	68 Å²	68	78.7 Å²	78.7	70%	0.701	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-3.2	179.5	0	0	0	0	0	115.1	T83 S87	T83-G85 PolarHBondContact O-N 3.28Å; G85-S87 VanDerWaalsContact C-N 3.32Å; G85-S87 PolarHBondContact O-N 2.9Å
86	E	59.8	Low	79.5	Confident	165 Å²	165	75.3 Å²	75.3	77%	0.771	39%	0.388	S	S	*	.			trans	-72.4	92.8	163.9	-68.5	-170.6	172.9	0	0	108.4	T83 Y84	T83-E86 WeakPolarHBondContact CB-O 3.48Å; T83-E86 WeakPolarHBondContact O-CB 3.49Å; T83-E86 PolarHBondContact O-N 3.24Å; T83-E86 PolarHBondContact OG1-O 3.28Å; Y84-E86 VanDerWaalsContact C-N 3.27Å; Y84-E86 PolarHBondContact O-N 3.13Å
87	S	60.8	Low	79.7	Confident	68 Å²	68	74.7 Å²	74.7	48%	0.476	38%	0.384	S	S	.	.			trans	-77.3	128.9	165	178.3	0	0	0	0	107.9	G85 M89 D90	G85-S87 VanDerWaalsContact C-N 3.32Å; G85-S87 PolarHBondContact O-N 2.9Å; S87-M89 WeakPolarHBondContact CB-O 3.43Å; S87-M89 PolarHBondContact O-N 3.28Å; S87-M89 VanDerWaalsContact OG-C 3.25Å; S87-M89 WeakPolarHBondContact OG-CA 3.47Å; S87-M89 WeakPolarHBondContact OG-CB 3.13Å; S87-M89 PolarHBondContact OG-N 2.66Å; S87-M89 PolarHBondContact OG-O 3.17Å; S87-D90 PolarHBondContact O-N 3.48Å
88	L	61.5	Low	79.7	Confident	62 Å²	62	69.8 Å²	69.8	33%	0.325	36%	0.361	S	S	.	.	S	Bend	trans	-55.7	-19.4	165.1	-71.9	173.8	0	0	0	111.9	T36 W106	T36-L88 HydrophobicContact CG2-CD1 3.78Å; T36-L88 HydrophobicContact CG2-CG 4.35Å; L88-W106 HydrophobicContact CB-CZ2 4.18Å; L88-W106 HydrophobicContact CD2-CH2 3.9Å; L88-W106 HydrophobicContact CD2-CZ2 3.67Å; L88-W106 HydrophobicContact CG-CZ2 4.5Å
89	M	68.5	Low	79.6	Confident	34 Å²	34	76.2 Å²	76.2	17%	0.167	39%	0.385	C	S	.	.	S	Bend	trans	-107.5	76	173.6	-55.1	-67.8	-58.3	0	0	109.7	S87 F93 V97 F158	S87-M89 WeakPolarHBondContact CB-O 3.43Å; S87-M89 PolarHBondContact O-N 3.28Å; S87-M89 VanDerWaalsContact OG-C 3.25Å; S87-M89 WeakPolarHBondContact OG-CA 3.47Å; S87-M89 WeakPolarHBondContact OG-CB 3.13Å; S87-M89 PolarHBondContact OG-N 2.66Å; S87-M89 PolarHBondContact OG-O 3.17Å; M89-F93 HydrophobicContact CE-CD1 3.42Å; M89-F93 VanDerWaalsContact CE-CD1 3.42Å; M89-F93 HydrophobicContact CE-CE1 3.38Å; M89-F93 HydrophobicContact SD-CD1 3.4Å; M89-F93 WeakPolarHBondContact SD-CD1 3.45Å; M89-F93 HydrophobicContact SD-CE1 3.22Å; M89-F93 WeakPolarHBondContact SD-CE1 3.4Å; M89-F93 HydrophobicContact SD-CZ 4.46Å; M89-V97 HydrophobicContact CE-CG2 4.38Å; M89-F158 HydrophobicContact CE-CB 3.93Å; M89-F158 WeakPolarHBondContact CE-O 3.3Å; M89-F158 HydrophobicContact CG-CB 4.43Å; M89-F158 HydrophobicContact CG-CD1 3.44Å; M89-F158 VanDerWaalsContact CG-CD1 3.44Å; M89-F158 HydrophobicContact CG-CE1 4.06Å; M89-F158 HydrophobicContact CG-CG 4.32Å; M89-F158 HydrophobicContact SD-CB 3.79Å; M89-F158 HydrophobicContact SD-CD1 3.64Å; M89-F158 HydrophobicContact SD-CE1 4.46Å; M89-F158 HydrophobicContact SD-CG 3.96Å
90	D	75.9	Confident	79.2	Confident	85 Å²	85	74.7 Å²	74.7	46%	0.455	38%	0.383	S	S	.	.			trans	-69.2	167.6	167.7	72	5.8	0	0	0	110.7	S87 K92 F93 A94	S87-D90 PolarHBondContact O-N 3.48Å; D90-K92 PolarHBondContact O-N 3.04Å; D90-K92 PolarHBondContact OD1-N 2.88Å; D90-F93 PolarHBondContact O-N 3.22Å; D90-F93 WeakPolarHBondContact OD1-CB 3.31Å; D90-F93 PolarHBondContact OD1-N 3.37Å; D90-A94 WeakPolarHBondContact O-CB 3.47Å; D90-A94 PolarHBondContact O-N 2.91Å
91	E	81.3	Confident	78.7	Confident	157 Å²	157	77.4 Å²	77.4	73%	0.734	40%	0.396	S	S	*	.	H	α-helix	trans	-59.1	-35.3	-178.9	-175.9	-179.5	175.7	0	0	112	A94 N95	E91-A94 PolarHBondContact O-N 3.33Å; E91-N95 WeakPolarHBondContact CG-ND2 3.45Å; E91-N95 WeakPolarHBondContact O-CB 2.96Å; E91-N95 PolarHBondContact O-N 3.19Å; E91-N95 PolarHBondContact O-ND2 2.9Å
92	K	83.2	Confident	78	Confident	160 Å²	160	78 Å²	78	70%	0.696	40%	0.402	S	S	*	.	H	α-helix	trans	-65	-45.2	178.9	-177.9	-179.2	178.4	-178.5	0	111.2	D90 S96	D90-K92 PolarHBondContact O-N 3.04Å; D90-K92 PolarHBondContact OD1-N 2.88Å; K92-S96 WeakPolarHBondContact O-CB 3.46Å; K92-S96 PolarHBondContact O-N 2.71Å; K92-S96 PolarHBondContact O-OG 2.86Å
93	F	82.4	Confident	77.5	Confident	31 Å²	31	76.6 Å²	76.6	14%	0.136	39%	0.392	C	S	.	.	H	α-helix	trans	-68.1	-45	177.2	-177.4	-98.4	0	0	0	110.7	M89 D90 N95 S96 V97 V103 P105 F246	M89-F93 HydrophobicContact CE-CD1 3.42Å; M89-F93 VanDerWaalsContact CE-CD1 3.42Å; M89-F93 HydrophobicContact CE-CE1 3.38Å; M89-F93 HydrophobicContact SD-CD1 3.4Å; M89-F93 WeakPolarHBondContact SD-CD1 3.45Å; M89-F93 HydrophobicContact SD-CE1 3.22Å; M89-F93 WeakPolarHBondContact SD-CE1 3.4Å; M89-F93 HydrophobicContact SD-CZ 4.46Å; D90-F93 PolarHBondContact O-N 3.22Å; D90-F93 WeakPolarHBondContact OD1-CB 3.31Å; D90-F93 PolarHBondContact OD1-N 3.37Å; F93-N95 VanDerWaalsContact C-N 3.32Å; F93-N95 PolarHBondContact O-N 3.03Å; F93-S96 WeakPolarHBondContact O-CB 3.42Å; F93-S96 PolarHBondContact O-N 3Å; F93-S96 VanDerWaalsContact O-N 3.08Å; F93-V97 HydrophobicContact CD1-CG2 3.89Å; F93-V97 HydrophobicContact CE1-CG2 3.31Å; F93-V97 HydrophobicContact CE2-CG2 4.11Å; F93-V97 HydrophobicContact CG-CG2 4.46Å; F93-V97 HydrophobicContact CZ-CG2 3.42Å; F93-V97 VanDerWaalsContact CZ-CG2 3.42Å; F93-V97 WeakPolarHBondContact O-CB 3.46Å; F93-V97 VanDerWaalsContact O-CG2 3.31Å; F93-V97 WeakPolarHBondContact O-CG2 3.48Å; F93-V97 PolarHBondContact O-N 2.8Å; F93-V103 HydrophobicContact CD2-CG1 4.34Å; F93-V103 HydrophobicContact CE2-CG1 3.61Å; F93-V103 HydrophobicContact CZ-CG1 4.36Å; F93-P105 HydrophobicContact CE2-CB 3.51Å; F93-P105 HydrophobicContact CE2-CG 3.59Å; F93-P105 HydrophobicContact CZ-CB 3.6Å; F93-P105 HydrophobicContact CZ-CG 3.34Å; F93-F246 HydrophobicContact CZ-CD2 4.38Å; F93-F246 HydrophobicContact CZ-CG 4.43Å
94	A	87.1	Confident	77.1	Confident	7 Å²	7	80.7 Å²	80.7	6%	0.058	41%	0.411	C	S	.	.	H	α-helix	trans	-56.7	-44.3	175.2	0	0	0	0	0	112.1	D90 E91 V97 W98 A163	D90-A94 WeakPolarHBondContact O-CB 3.47Å; D90-A94 PolarHBondContact O-N 2.91Å; E91-A94 PolarHBondContact O-N 3.33Å; A94-V97 WeakPolarHBondContact O-CB 3.44Å; A94-V97 PolarHBondContact O-N 3.04Å; A94-W98 VanDerWaalsContact O-CD1 3.27Å; A94-A163 HydrophobicContact CB-CB 3.78Å
95	N	88.2	Confident	76.7	Confident	43 Å²	43	71.6 Å²	71.6	23%	0.23	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-42.8	173.9	-87.2	-74.7	0	0	0	112.5	E91 F93 V97 W98 R99	E91-N95 WeakPolarHBondContact CG-ND2 3.45Å; E91-N95 WeakPolarHBondContact O-CB 2.96Å; E91-N95 PolarHBondContact O-N 3.19Å; E91-N95 PolarHBondContact O-ND2 2.9Å; F93-N95 VanDerWaalsContact C-N 3.32Å; F93-N95 PolarHBondContact O-N 3.03Å; N95-V97 VanDerWaalsContact C-N 3.32Å; N95-V97 PolarHBondContact O-N 2.8Å; N95-W98 PolarHBondContact O-N 3.45Å; N95-R99 WeakPolarHBondContact O-CB 3.48Å; N95-R99 WeakPolarHBondContact O-CG 3.32Å; N95-R99 PolarHBondContact O-N 2.97Å; N95-R99 VanDerWaalsContact O-N 3.13Å
96	S	88.2	Confident	76.7	Confident	46 Å²	46	74.6 Å²	74.6	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-39.6	180	-60.1	0	0	0	0	111.7	K92 F93 W98 R99 A100 V103	K92-S96 WeakPolarHBondContact O-CB 3.46Å; K92-S96 PolarHBondContact O-N 2.71Å; K92-S96 PolarHBondContact O-OG 2.86Å; F93-S96 WeakPolarHBondContact O-CB 3.42Å; F93-S96 PolarHBondContact O-N 3Å; F93-S96 VanDerWaalsContact O-N 3.08Å; S96-W98 PolarHBondContact O-N 3.33Å; S96-R99 PolarHBondContact O-N 2.98Å; S96-A100 WeakPolarHBondContact O-CB 3.22Å; S96-A100 PolarHBondContact O-N 3.38Å; S96-V103 VanDerWaalsContact O-CG2 3.31Å; S96-V103 WeakPolarHBondContact O-CG2 3.34Å
97	V	90.1	Very high	76.4	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-54.3	-36.4	176.7	159.3	0	0	0	0	112	M89 F93 A94 N95 L245 F246 K267	M89-V97 HydrophobicContact CE-CG2 4.38Å; F93-V97 HydrophobicContact CD1-CG2 3.89Å; F93-V97 HydrophobicContact CE1-CG2 3.31Å; F93-V97 HydrophobicContact CE2-CG2 4.11Å; F93-V97 HydrophobicContact CG-CG2 4.46Å; F93-V97 HydrophobicContact CZ-CG2 3.42Å; F93-V97 VanDerWaalsContact CZ-CG2 3.42Å; F93-V97 WeakPolarHBondContact O-CB 3.46Å; F93-V97 VanDerWaalsContact O-CG2 3.31Å; F93-V97 WeakPolarHBondContact O-CG2 3.48Å; F93-V97 PolarHBondContact O-N 2.8Å; A94-V97 WeakPolarHBondContact O-CB 3.44Å; A94-V97 PolarHBondContact O-N 3.04Å; N95-V97 VanDerWaalsContact C-N 3.32Å; N95-V97 PolarHBondContact O-N 2.8Å; V97-L245 HydrophobicContact CG1-CB 3.89Å; V97-L245 HydrophobicContact CG1-CD1 4.29Å; V97-F246 HydrophobicContact CB-CD1 4.33Å; V97-F246 HydrophobicContact CG1-CD1 3.7Å; V97-F246 HydrophobicContact CG1-CE1 4.18Å; V97-F246 HydrophobicContact CG2-CB 4.29Å; V97-F246 HydrophobicContact CG2-CD1 3.66Å; V97-F246 HydrophobicContact CG2-CE1 4.22Å; V97-F246 HydrophobicContact CG2-CG 4.12Å; V97-K267 WeakPolarHBondContact O-CE 3.44Å
98	W	91.4	Very high	75.6	Confident	6 Å²	6	72.3 Å²	72.3	2%	0.023	36%	0.363	C	S	.	.	H	α-helix	trans	-88.8	-33.9	179.1	-71.4	105	0	0	0	114	A94 N95 S96 F155 A159 D160 W161 A164 T168 L245	A94-W98 VanDerWaalsContact O-CD1 3.27Å; N95-W98 PolarHBondContact O-N 3.45Å; S96-W98 PolarHBondContact O-N 3.33Å; W98-F155 AromaticContact CH2-CD2 3.74Å; W98-F155 HydrophobicContact CH2-CD2 3.74Å; W98-F155 AromaticContact CH2-CE2 3.85Å; W98-F155 HydrophobicContact CH2-CE2 3.85Å; W98-F155 HydrophobicContact CZ2-CD2 4.5Å; W98-F155 HydrophobicContact CZ3-CD2 4.45Å; W98-F155 HydrophobicContact CZ3-CE2 4.19Å; W98-A159 HydrophobicContact CZ2-CB 4.39Å; W98-D160 PolarHBondContact NE1-O 2.86Å; W98-W161 AromaticContact CH2-CD2 3.86Å; W98-W161 HydrophobicContact CH2-CD2 3.86Å; W98-W161 AromaticContact CH2-CE2 3.96Å; W98-W161 AromaticContact CH2-CE3 3.68Å; W98-W161 HydrophobicContact CH2-CE3 3.68Å; W98-W161 AromaticContact CH2-CH2 3.8Å; W98-W161 HydrophobicContact CH2-CH2 3.8Å; W98-W161 AromaticContact CH2-CZ2 3.94Å; W98-W161 HydrophobicContact CH2-CZ2 3.94Å; W98-W161 AromaticContact CH2-CZ3 3.67Å; W98-W161 HydrophobicContact CH2-CZ3 3.67Å; W98-W161 AromaticContact CZ2-CD2 3.97Å; W98-W161 HydrophobicContact CZ2-CD2 3.97Å; W98-W161 HydrophobicContact CZ2-CE3 4.05Å; W98-W161 HydrophobicContact CZ2-CG 4.34Å; W98-W161 HydrophobicContact CZ2-CZ3 4.48Å; W98-W161 HydrophobicContact CZ3-CE3 4.46Å; W98-W161 HydrophobicContact CZ3-CH2 4.35Å; W98-W161 HydrophobicContact CZ3-CZ3 4.14Å; W98-A164 HydrophobicContact CD2-CB 3.64Å; W98-A164 HydrophobicContact CE3-CB 3.94Å; W98-A164 HydrophobicContact CG-CB 4.09Å; W98-A164 HydrophobicContact CH2-CB 4.09Å; W98-A164 HydrophobicContact CZ2-CB 3.82Å; W98-A164 HydrophobicContact CZ3-CB 4.15Å; W98-T168 HydrophobicContact CE3-CG2 4.48Å; W98-T168 HydrophobicContact CZ3-CG2 4.21Å; W98-L245 HydrophobicContact CE3-CD2 4.32Å; W98-L245 HydrophobicContact CZ3-CD2 4.15Å
99	R	89.4	Confident	74.9	Confident	160 Å²	160	72.6 Å²	72.6	60%	0.604	37%	0.368	S	S	*	.	H	α-helix	trans	-91.5	-26	-168.4	-64.7	173.3	-175.8	-87.5	1.2	114.1	N95 S96 P165	N95-R99 WeakPolarHBondContact O-CB 3.48Å; N95-R99 WeakPolarHBondContact O-CG 3.32Å; N95-R99 PolarHBondContact O-N 2.97Å; N95-R99 VanDerWaalsContact O-N 3.13Å; S96-R99 PolarHBondContact O-N 2.98Å; R99-P165 HydrophobicContact CG-CG 4.42Å
100	A	86	Confident	73.5	Confident	37 Å²	37	76.5 Å²	76.5	31%	0.306	39%	0.387	S	S	.	.	S	Bend	trans	-93.6	142.2	179.7	0	0	0	0	0	111.9	S96 T102 V103 K267	S96-A100 WeakPolarHBondContact O-CB 3.22Å; S96-A100 PolarHBondContact O-N 3.38Å; A100-T102 VanDerWaalsContact C-N 3.26Å; A100-T102 PolarHBondContact O-N 3.45Å; A100-V103 HydrophobicContact CB-CG2 3.68Å; A100-K267 WeakPolarHBondContact O-CE 3.22Å; A100-K267 PolarHBondContact O-NZ 2.9Å
101	K	80	Confident	71.8	Confident	140 Å²	140	77.6 Å²	77.6	61%	0.609	40%	0.397	S	S	*	.	S	Bend	trans	-57.2	-39	177.4	-80.3	-170.3	173.3	-174.9	0	112.8	D266 K267 T268	K101-D266 WeakPolarHBondContact CE-OD2 3.46Å; K101-K267 PolarHBondContact O-NZ 2.99Å; K101-T268 HydrophobicContact CG-CG2 3.91Å
102	T	73.4	Confident	69.8	Low	77 Å²	77	72.6 Å²	72.6	47%	0.472	39%	0.387	S	S	.	.			trans	-145.8	132.8	172	-60	0	0	0	0	108.3	A100 I104 P250	A100-T102 VanDerWaalsContact C-N 3.26Å; A100-T102 PolarHBondContact O-N 3.45Å; T102-I104 HydrophobicContact CG2-CG1 4.36Å; T102-P250 HydrophobicContact CG2-CG 4.05Å
103	V	74.2	Confident	67.7	Low	23 Å²	23	73.1 Å²	73.1	14%	0.139	39%	0.385	C	S	.	.			trans	-114.7	126	167.8	-176.7	0	0	0	0	106	F93 S96 A100 P105 F246 G247	F93-V103 HydrophobicContact CD2-CG1 4.34Å; F93-V103 HydrophobicContact CE2-CG1 3.61Å; F93-V103 HydrophobicContact CZ-CG1 4.36Å; S96-V103 VanDerWaalsContact O-CG2 3.31Å; S96-V103 WeakPolarHBondContact O-CG2 3.34Å; A100-V103 HydrophobicContact CB-CG2 3.68Å; V103-P105 WeakPolarHBondContact O-CD 3.36Å; V103-F246 HydrophobicContact CB-CB 3.98Å; V103-F246 CarbonylContact O-C 3.52Å; V103-F246 VanDerWaalsContact O-CA 3.3Å; V103-F246 WeakPolarHBondContact O-CA 3.37Å; V103-F246 VanDerWaalsContact O-CB 3.31Å; V103-F246 WeakPolarHBondContact O-CB 3.25Å; V103-G247 PolarHBondContact O-N 2.88Å
104	I	69.4	Low	65.7	Low	114 Å²	114	73.8 Å²	73.8	59%	0.585	40%	0.396	S	S	*	.			trans	-98.9	100	165.1	-58.4	177.5	0	0	0	105.2	T102 W106 G107	T102-I104 HydrophobicContact CG2-CG1 4.36Å; I104-W106 PolarHBondContact O-N 2.56Å; I104-G107 PolarHBondContact O-N 2.8Å
105	P	61.4	Low	63.7	Low	19 Å²	19	75 Å²	75	12%	0.123	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	135.4	175.2	-12.3	31.2	0	0	0	106.1	F93 V103 G107 F246	F93-P105 HydrophobicContact CE2-CB 3.51Å; F93-P105 HydrophobicContact CE2-CG 3.59Å; F93-P105 HydrophobicContact CZ-CB 3.6Å; F93-P105 HydrophobicContact CZ-CG 3.34Å; V103-P105 WeakPolarHBondContact O-CD 3.36Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 2.92Å; P105-F246 HydrophobicContact CG-CB 4.29Å; P105-F246 HydrophobicContact CG-CD2 3.47Å; P105-F246 VanDerWaalsContact CG-CD2 3.47Å; P105-F246 HydrophobicContact CG-CE2 4.14Å; P105-F246 HydrophobicContact CG-CG 4.2Å
106	W	59.3	Low	61.4	Low	131 Å²	131	74.1 Å²	74.1	50%	0.496	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	31.3	176	-30.2	109.2	0	0	0	113.6	L88 I104 N108 V109 M110	L88-W106 HydrophobicContact CB-CZ2 4.18Å; L88-W106 HydrophobicContact CD2-CH2 3.9Å; L88-W106 HydrophobicContact CD2-CZ2 3.67Å; L88-W106 HydrophobicContact CG-CZ2 4.5Å; I104-W106 PolarHBondContact O-N 2.56Å; W106-N108 PolarHBondContact O-N 3.34Å; W106-V109 HydrophobicContact CB-CB 4.05Å; W106-V109 HydrophobicContact CB-CG2 4.08Å; W106-V109 PolarHBondContact O-N 2.73Å; W106-M110 PolarHBondContact O-N 2.85Å; W106-M110 VanDerWaalsContact O-N 3.15Å
107	G	51.8	Low	59.4	Low	31 Å²	31	77.9 Å²	77.9	32%	0.32	42%	0.42	S	S	.	.	H	α-helix	trans	-50.1	-27	-178.2	0	0	0	0	0	115	I104 P105	I104-G107 PolarHBondContact O-N 2.8Å; P105-G107 VanDerWaalsContact C-N 3.28Å; P105-G107 PolarHBondContact O-N 2.92Å
108	N	45.7	Very low	57.3	Low	155 Å²	155	82 Å²	82	83%	0.829	45%	0.445	S	S	*	.	H	α-helix	trans	-83.3	-22.7	175.2	-65.1	-15.3	0	0	0	114.1	W106	W106-N108 PolarHBondContact O-N 3.34Å
109	V	46.6	Very low	55.3	Low	68 Å²	68	86.4 Å²	86.4	41%	0.412	47%	0.465	S	S	.	.	H	α-helix	trans	-87.6	-38.1	-177.4	-171.9	0	0	0	0	110.8	W106 T111 G112 W113	W106-V109 HydrophobicContact CB-CB 4.05Å; W106-V109 HydrophobicContact CB-CG2 4.08Å; W106-V109 PolarHBondContact O-N 2.73Å; V109-T111 PolarHBondContact O-N 2.82Å; V109-G112 PolarHBondContact O-N 3.03Å; V109-W113 HydrophobicContact CG1-CD2 4.32Å; V109-W113 HydrophobicContact CG1-CG 4.33Å; V109-W113 WeakPolarHBondContact O-CB 3.22Å; V109-W113 PolarHBondContact O-N 3.46Å
110	M	38.1	Very low	53.6	Low	115 Å²	115	80.9 Å²	80.9	57%	0.567	45%	0.447	S	S	*	.	H	α-helix	trans	-69	-32.6	-176	-71.4	-70.3	-80.3	0	0	113.3	W106 G112 A114	W106-M110 PolarHBondContact O-N 2.85Å; W106-M110 VanDerWaalsContact O-N 3.15Å; M110-G112 VanDerWaalsContact C-N 3.33Å; M110-G112 PolarHBondContact O-N 3.39Å; M110-A114 WeakPolarHBondContact O-CB 3.29Å; M110-A114 PolarHBondContact O-N 3.14Å
111	T	41	Very low	52.4	Low	109 Å²	109	83.4 Å²	83.4	67%	0.669	46%	0.459	S	S	*	.	H	α-helix	trans	-68.4	-34.3	178.4	52.3	0	0	0	0	112.1	V109	V109-T111 PolarHBondContact O-N 2.82Å
112	G	39	Very low	52	Low	52 Å²	52	79.5 Å²	79.5	54%	0.536	44%	0.442	S	S	.	.	H	α-helix	trans	-79.4	-42.9	176.4	0	0	0	0	0	113.6	V109 M110	V109-G112 PolarHBondContact O-N 3.03Å; M110-G112 VanDerWaalsContact C-N 3.33Å; M110-G112 PolarHBondContact O-N 3.39Å
113	W	39	Very low	51.8	Low	171 Å²	171	81.9 Å²	81.9	65%	0.648	45%	0.45	S	S	*	.	H	α-helix	trans	-82.3	-40.5	-175.1	-81.8	25.7	0	0	0	113.5	V109 A115 G116 E117	V109-W113 HydrophobicContact CG1-CD2 4.32Å; V109-W113 HydrophobicContact CG1-CG 4.33Å; V109-W113 WeakPolarHBondContact O-CB 3.22Å; V109-W113 PolarHBondContact O-N 3.46Å; W113-A115 PolarHBondContact O-N 2.93Å; W113-G116 PolarHBondContact O-N 2.79Å; W113-E117 PolarHBondContact O-N 3.13Å
114	A	41	Very low	51.8	Low	45 Å²	45	83.4 Å²	83.4	37%	0.372	46%	0.459	S	S	.	.	H	α-helix	trans	-66.6	-26.5	-177.3	0	0	0	0	0	112.3	M110 V118	M110-A114 WeakPolarHBondContact O-CB 3.29Å; M110-A114 PolarHBondContact O-N 3.14Å; A114-V118 WeakPolarHBondContact O-CG2 3.36Å
115	A	45.4	Very low	52	Low	31 Å²	31	82.9 Å²	82.9	26%	0.256	46%	0.458	S	S	.	.	H	α-helix	trans	-82.7	-16.7	-178	0	0	0	0	0	113.1	W113 F119 Y339	W113-A115 PolarHBondContact O-N 2.93Å; A115-F119 WeakPolarHBondContact O-CD2 3.42Å; A115-F119 WeakPolarHBondContact O-CE2 3.45Å; A115-Y339 VanDerWaalsContact C-OH 3.29Å; A115-Y339 WeakPolarHBondContact CB-OH 3.46Å; A115-Y339 PolarHBondContact O-OH 3.13Å
116	G	39.9	Very low	52.9	Low	26 Å²	26	84.8 Å²	84.8	27%	0.268	46%	0.463	S	S	.	.	H	α-helix	trans	-97.1	-41.3	177.5	0	0	0	0	0	113.7	W113 T332	W113-G116 PolarHBondContact O-N 2.79Å; G116-T332 WeakPolarHBondContact O-CG2 3.42Å
117	E	44.5	Very low	54.2	Low	124 Å²	124	80.4 Å²	80.4	58%	0.579	45%	0.448	S	S	*	.	H	α-helix	trans	-91.1	-35.4	-164.1	-64.4	-164.6	152.6	0	0	114.9	W113 F119 N120 T121	W113-E117 PolarHBondContact O-N 3.13Å; E117-F119 PolarHBondContact O-N 3.28Å; E117-N120 PolarHBondContact O-N 2.81Å; E117-T121 PolarHBondContact O-OG1 3.26Å; E117-T121 VanDerWaalsContact O-OG1 3.11Å
118	V	47.4	Very low	55.9	Low	88 Å²	88	80.5 Å²	80.5	53%	0.533	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-62.2	-16.2	-174	-65.3	0	0	0	0	114	A114	A114-V118 WeakPolarHBondContact O-CG2 3.36Å
119	F	48.7	Very low	57.8	Low	99 Å²	99	74.3 Å²	74.3	43%	0.434	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-84.3	-19	-173.8	-68.1	-58.4	0	0	0	112.9	A115 E117 L329	A115-F119 WeakPolarHBondContact O-CD2 3.42Å; A115-F119 WeakPolarHBondContact O-CE2 3.45Å; E117-F119 PolarHBondContact O-N 3.28Å; F119-L329 HydrophobicContact CB-CB 3.61Å; F119-L329 HydrophobicContact CB-CD1 3.64Å; F119-L329 HydrophobicContact CB-CD2 3.83Å; F119-L329 HydrophobicContact CB-CG 3.82Å; F119-L329 HydrophobicContact CD1-CD1 4.18Å; F119-L329 HydrophobicContact CD1-CD2 3.84Å; F119-L329 HydrophobicContact CG-CD1 4.34Å; F119-L329 HydrophobicContact CG-CD2 3.95Å; F119-L329 HydrophobicContact CG-CG 4.48Å; F119-L329 WeakPolarHBondContact O-CD1 3.36Å
120	N	54.5	Low	59.5	Low	44 Å²	44	79.5 Å²	79.5	24%	0.235	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-102.8	15.7	-179	-67.3	-12.8	0	0	0	113.7	E117 R328 L329 T332	E117-N120 PolarHBondContact O-N 2.81Å; N120-R328 HydrophobicContact CB-CB 4.44Å; N120-R328 HydrophobicContact CB-CG 4.27Å; N120-R328 PolarHBondContact ND2-NE 2.9Å; N120-R328 VanDerWaalsContact OD1-C 3.25Å; N120-R328 WeakPolarHBondContact OD1-CA 3.48Å; N120-R328 WeakPolarHBondContact OD1-CB 3.42Å; N120-L329 PolarHBondContact OD1-N 2.91Å; N120-T332 WeakPolarHBondContact ND2-CG2 3.16Å; N120-T332 PolarHBondContact ND2-OG1 3.36Å
121	T	60.5	Low	61.1	Low	89 Å²	89	78.9 Å²	78.9	55%	0.546	43%	0.433	S	S	.	.			trans	-117.6	126.9	-163.5	-44.2	0	0	0	0	111.1	E117 I123	E117-T121 PolarHBondContact O-OG1 3.26Å; E117-T121 VanDerWaalsContact O-OG1 3.11Å; T121-I123 PolarHBondContact O-N 2.83Å
122	F	70.9	Confident	63	Low	59 Å²	59	76.3 Å²	76.3	26%	0.259	42%	0.423	S	S	.	.			trans	-66.8	119.6	158.4	-58.3	-75.7	0	0	0	107.6	V124 W313 M327	F122-V124 PolarHBondContact O-N 3.23Å; F122-V124 VanDerWaalsContact O-N 3.1Å; F122-W313 HydrophobicContact CB-CB 3.92Å; F122-W313 HydrophobicContact CB-CG 3.96Å; F122-W313 HydrophobicContact CD1-CB 4.15Å; F122-W313 AromaticContact CD1-CD2 3.36Å; F122-W313 HydrophobicContact CD1-CD2 3.36Å; F122-W313 AromaticContact CD1-CE2 3.83Å; F122-W313 AromaticContact CD1-CE3 3.5Å; F122-W313 HydrophobicContact CD1-CE3 3.5Å; F122-W313 VanDerWaalsContact CD1-CE3 3.5Å; F122-W313 AromaticContact CD1-CG 3.68Å; F122-W313 HydrophobicContact CD1-CG 3.68Å; F122-W313 HydrophobicContact CD1-CH2 4.42Å; F122-W313 HydrophobicContact CD1-CZ2 4.34Å; F122-W313 HydrophobicContact CD1-CZ3 4.04Å; F122-W313 HydrophobicContact CD2-CB 3.81Å; F122-W313 HydrophobicContact CD2-CD2 4.46Å; F122-W313 HydrophobicContact CD2-CE3 4.42Å; F122-W313 HydrophobicContact CD2-CG 4.25Å; F122-W313 AromaticContact CE1-CD2 3.46Å; F122-W313 HydrophobicContact CE1-CD2 3.46Å; F122-W313 VanDerWaalsContact CE1-CD2 3.46Å; F122-W313 AromaticContact CE1-CE3 3.02Å; F122-W313 HydrophobicContact CE1-CE3 3.02Å; F122-W313 HydrophobicContact CE1-CG 4.18Å; F122-W313 AromaticContact CE1-CH2 3.89Å; F122-W313 HydrophobicContact CE1-CH2 3.89Å; F122-W313 HydrophobicContact CE1-CZ2 4.26Å; F122-W313 AromaticContact CE1-CZ3 3.27Å; F122-W313 HydrophobicContact CE1-CZ3 3.27Å; F122-W313 HydrophobicContact CE2-CB 4.3Å; F122-W313 HydrophobicContact CE2-CE3 4.03Å; F122-W313 HydrophobicContact CG-CB 3.7Å; F122-W313 AromaticContact CG-CD2 3.89Å; F122-W313 HydrophobicContact CG-CD2 3.89Å; F122-W313 HydrophobicContact CG-CE3 4.16Å; F122-W313 AromaticContact CG-CG 3.7Å; F122-W313 HydrophobicContact CG-CG 3.7Å; F122-W313 HydrophobicContact CZ-CD2 4.03Å; F122-W313 AromaticContact CZ-CE3 3.3Å; F122-W313 HydrophobicContact CZ-CE3 3.3Å; F122-W313 AromaticContact CZ-CZ3 3.72Å; F122-W313 HydrophobicContact CZ-CZ3 3.72Å; F122-M327 HydrophobicContact CE1-CE 3.43Å; F122-M327 VanDerWaalsContact CE1-CE 3.43Å; F122-M327 HydrophobicContact CE2-CE 4.42Å; F122-M327 HydrophobicContact CZ-CE 3.21Å; F122-M327 HydrophobicContact CZ-SD 3.75Å
123	I	69.8	Low	65.4	Low	126 Å²	126	83.8 Å²	83.8	65%	0.646	44%	0.441	S	S	*	.			trans	-71.3	111.9	177.4	-59.1	175.8	0	0	0	107.4	T121	T121-I123 PolarHBondContact O-N 2.83Å
124	V	74.2	Confident	68	Low	55 Å²	55	76.8 Å²	76.8	33%	0.333	42%	0.416	S	S	.	.			trans	-98.9	106.6	170	-172.7	0	0	0	0	107.4	L47 F122 A306 G310	L47-V124 HydrophobicContact CD2-CG1 4.1Å; F122-V124 PolarHBondContact O-N 3.23Å; F122-V124 VanDerWaalsContact O-N 3.1Å; V124-A306 WeakPolarHBondContact CG1-O 3.22Å; V124-G310 VanDerWaalsContact CG2-CA 3.44Å
125	D	74.1	Confident	70.6	Confident	104 Å²	104	77.1 Å²	77.1	56%	0.556	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-66.5	154	179.1	-72.7	-36.9	0	0	0	111.8	E127 A306	D125-E127 PolarHBondContact O-N 3.23Å; D125-A306 HydrophobicContact CB-CB 4.01Å; D125-A306 VanDerWaalsContact O-CB 3.32Å; D125-A306 WeakPolarHBondContact O-CB 3.42Å
126	Y	80.4	Confident	73	Confident	58 Å²	58	84 Å²	84	23%	0.227	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-66.3	116.7	169.6	176.7	-110.1	0	0	0	109.6	P129 K228 L231 E232	Y126-P129 HydrophobicContact CE1-CG 4.05Å; Y126-P129 WeakPolarHBondContact OH-CG 3.44Å; Y126-K228 HydrophobicContact CD1-CG 4.14Å; Y126-K228 HydrophobicContact CE1-CD 4.45Å; Y126-K228 HydrophobicContact CE1-CG 3.8Å; Y126-K228 HydrophobicContact CE2-CD 4.13Å; Y126-K228 HydrophobicContact CE2-CG 4.22Å; Y126-K228 HydrophobicContact CG-CG 4.44Å; Y126-L231 HydrophobicContact CD1-CB 4.26Å; Y126-L231 HydrophobicContact CD1-CD1 4.42Å; Y126-E232 HydrophobicContact CE1-CG 3.95Å; Y126-E232 PolarHBondContact OH-OE1 2.93Å
127	E	85.2	Confident	75.6	Confident	40 Å²	40	88 Å²	88	19%	0.187	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-67.6	135	176.5	-178.2	58	-156.8	0	0	110.7	D125 R302 A306 T307	D125-E127 PolarHBondContact O-N 3.23Å; E127-R302 IonicContact OE1-CZ 2.83Å; E127-R302 IonicContact OE1-NH2 2.66Å; E127-R302 PolarHBondContact OE1-NH2 3.38Å; E127-R302 IonicContact OE2-CZ 2.68Å; E127-R302 IonicContact OE2-NH1 2.74Å; E127-R302 PolarHBondContact OE2-NH1 3.16Å; E127-R302 IonicContact OE2-NH2 3.08Å; E127-R302 PolarHBondContact OE2-NH2 3.21Å; E127-A306 HydrophobicContact CB-CB 4.29Å; E127-A306 VanDerWaalsContact OE2-CB 3.24Å; E127-A306 WeakPolarHBondContact OE2-CB 3.34Å; E127-A306 PolarHBondContact OE2-N 3.04Å; E127-T307 WeakPolarHBondContact CB-OG1 2.96Å; E127-T307 WeakPolarHBondContact CG-OG1 3.1Å
128	C	88	Confident	78.1	Confident	32 Å²	32	83.3 Å²	83.3	22%	0.216	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-54.1	129	175.6	-71.9	0	0	0	0	110.6	K130 C235	C128-K130 PolarHBondContact O-N 3.41Å; C128-C235 WeakPolarHBondContact CA-SG 3.38Å; C128-C235 HydrophobicContact CB-CB 3.62Å; C128-C235 WeakPolarHBondContact CB-SG 3.42Å; C128-C235 VanDerWaalsContact SG-CA 3.56Å; C128-C235 WeakPolarHBondContact SG-CB 3.37Å; C128-C235 CovalentContact SG-SG 2.03Å; C128-C235 PolarHBondContact SG-SG 3.39Å
129	P	85.5	Confident	80.5	Confident	26 Å²	26	82.1 Å²	82.1	17%	0.169	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-58.9	137.7	-176.9	-23.7	32.4	0	0	0	111.5	Y126 A210 E232 F236	Y126-P129 HydrophobicContact CE1-CG 4.05Å; Y126-P129 WeakPolarHBondContact OH-CG 3.44Å; P129-A210 HydrophobicContact CB-CB 3.73Å; P129-A210 HydrophobicContact CG-CB 4Å; P129-E232 HydrophobicContact CG-CG 4.32Å; P129-F236 HydrophobicContact CB-CZ 4.06Å; P129-F236 HydrophobicContact CG-CE2 4.28Å; P129-F236 HydrophobicContact CG-CZ 4.27Å
130	K	81.9	Confident	82.8	Confident	177 Å²	177	85 Å²	85	77%	0.77	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-66.9	151.5	176.2	-70.2	-170.9	179.8	-175.5	0	110.8	C128 A132	C128-K130 PolarHBondContact O-N 3.41Å; K130-A132 PolarHBondContact O-N 3.24Å
131	P	71.7	Confident	84.8	Confident	101 Å²	101	84.2 Å²	84.2	66%	0.656	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-51.8	130.2	175.7	-21.3	26.5	0	0	0	113.2
132	A	81.7	Confident	86.6	Confident	55 Å²	55	80 Å²	80	46%	0.455	40%	0.402	S	S	.	.			trans	-126.1	133.5	173.7	0	0	0	0	0	108.6	K130 L134 A211	K130-A132 PolarHBondContact O-N 3.24Å; A132-L134 PolarHBondContact O-N 2.65Å; A132-A211 HydrophobicContact CB-CB 4.17Å; A132-A211 WeakPolarHBondContact O-CB 3.48Å
133	K	89.1	Confident	87.8	Confident	209 Å²	209	81.6 Å²	81.6	91%	0.909	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-68	133.5	177.1	-68.8	-175.3	179.3	-178.7	0	109.3
134	L	94	Very high	89.1	Confident	24 Å²	24	77.2 Å²	77.2	13%	0.126	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-64.4	150.2	167	-70.2	173.6	0	0	0	109.7	A132 Y138 L139 V142 P208 A211 I212 H215	A132-L134 PolarHBondContact O-N 2.65Å; L134-Y138 HydrophobicContact CD2-CG 4.4Å; L134-L139 HydrophobicContact CB-CB 4.34Å; L134-L139 HydrophobicContact CD1-CD1 4.49Å; L134-V142 HydrophobicContact CD1-CB 4.48Å; L134-V142 HydrophobicContact CD1-CG2 4.27Å; L134-P208 HydrophobicContact CD2-CG 4.22Å; L134-A211 HydrophobicContact CD2-CB 3.55Å; L134-A211 HydrophobicContact CG-CB 4.2Å; L134-I212 HydrophobicContact CD2-CG1 3.77Å; L134-H215 HydrophobicContact CD1-CB 4.38Å
135	S	95.2	Very high	90.1	Very high	52 Å²	52	80.2 Å²	80.2	36%	0.364	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-64.1	162.5	167.2	82.9	0	0	0	0	109.8	E137 Y138 L139	S135-E137 WeakPolarHBondContact CB-OE2 3.27Å; S135-E137 PolarHBondContact O-N 3.25Å; S135-E137 PolarHBondContact OG-OE2 3.27Å; S135-Y138 PolarHBondContact O-N 3.11Å; S135-Y138 WeakPolarHBondContact OG-CD2 3.45Å; S135-Y138 PolarHBondContact OG-N 3.45Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.88Å
136	K	96	Very high	91.1	Very high	177 Å²	177	81.4 Å²	81.4	77%	0.77	42%	0.42	S	S	*	.	H	α-helix	trans	-57.9	-37.9	-179.5	-70.5	-175.7	178.4	-179.2	0	111.6	L139 Q140	K136-L139 PolarHBondContact O-N 2.91Å; K136-Q140 WeakPolarHBondContact O-CB 3.22Å; K136-Q140 PolarHBondContact O-N 2.86Å
137	E	95.4	Very high	91.9	Very high	110 Å²	110	79.3 Å²	79.3	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-66.3	-45.3	-179.4	-54.7	72.5	-153.2	0	0	111.4	S135 F141	S135-E137 WeakPolarHBondContact CB-OE2 3.27Å; S135-E137 PolarHBondContact O-N 3.25Å; S135-E137 PolarHBondContact OG-OE2 3.27Å; E137-F141 PolarHBondContact O-N 3.01Å
138	Y	96.5	Very high	92.5	Very high	24 Å²	24	83.3 Å²	83.3	9%	0.094	43%	0.431	C	S	.	.	H	α-helix	trans	-67	-41.5	174.7	-85.2	-76.1	0	0	0	111.8	L134 S135 F141 V142 I185 P208 I212	L134-Y138 HydrophobicContact CD2-CG 4.4Å; S135-Y138 PolarHBondContact O-N 3.11Å; S135-Y138 WeakPolarHBondContact OG-CD2 3.45Å; S135-Y138 PolarHBondContact OG-N 3.45Å; Y138-F141 PolarHBondContact O-N 2.82Å; Y138-V142 WeakPolarHBondContact O-CB 3.39Å; Y138-V142 VanDerWaalsContact O-CG2 3.25Å; Y138-V142 WeakPolarHBondContact O-CG2 3.41Å; Y138-V142 PolarHBondContact O-N 3.33Å; Y138-I185 HydrophobicContact CD1-CD1 4.06Å; Y138-I185 HydrophobicContact CE1-CD1 4.2Å; Y138-I185 HydrophobicContact CE1-CG2 4.47Å; Y138-P208 HydrophobicContact CD1-CG 4.41Å; Y138-P208 HydrophobicContact CD2-CG 4.02Å; Y138-P208 HydrophobicContact CE1-CG 4.21Å; Y138-P208 HydrophobicContact CE2-CG 3.81Å; Y138-P208 HydrophobicContact CG-CG 4.33Å; Y138-P208 WeakPolarHBondContact OH-CD 3.35Å; Y138-I212 HydrophobicContact CD1-CD1 4.09Å; Y138-I212 HydrophobicContact CD1-CG1 4.44Å; Y138-I212 HydrophobicContact CE1-CD1 3.89Å
139	L	96.5	Very high	92.9	Very high	63 Å²	63	81.9 Å²	81.9	33%	0.33	42%	0.421	S	S	.	.	H	α-helix	trans	-61.8	-48.6	180	-169.9	69.6	0	0	0	110.6	L134 S135 K136 F141 V142 E143	L134-L139 HydrophobicContact CB-CB 4.34Å; L134-L139 HydrophobicContact CD1-CD1 4.49Å; S135-L139 WeakPolarHBondContact O-CB 3.49Å; S135-L139 PolarHBondContact O-N 2.88Å; K136-L139 PolarHBondContact O-N 2.91Å; L139-F141 VanDerWaalsContact C-N 3.28Å; L139-F141 PolarHBondContact O-N 2.96Å; L139-V142 PolarHBondContact O-N 3.29Å; L139-E143 VanDerWaalsContact CD1-CD 3.47Å; L139-E143 HydrophobicContact CD1-CG 3.89Å; L139-E143 HydrophobicContact CG-CG 4.19Å; L139-E143 WeakPolarHBondContact CG-OE2 3.4Å; L139-E143 WeakPolarHBondContact O-CB 3.22Å; L139-E143 WeakPolarHBondContact O-CG 3.34Å; L139-E143 PolarHBondContact O-N 3.38Å
140	Q	96.9	Very high	93.6	Very high	159 Å²	159	80.6 Å²	80.6	74%	0.743	41%	0.413	S	S	*	.	H	α-helix	trans	-57.9	-40.5	177	-176	179.4	6.7	0	0	112.2	K136	K136-Q140 WeakPolarHBondContact O-CB 3.22Å; K136-Q140 PolarHBondContact O-N 2.86Å
141	F	97.6	Very high	94.4	Very high	28 Å²	28	72.2 Å²	72.2	12%	0.123	38%	0.376	C	S	.	.	H	α-helix	trans	-68.9	-44.7	178.6	-174.5	-96	0	0	0	112.5	E137 Y138 L139 R183 I184 I185 H200 R202	E137-F141 PolarHBondContact O-N 3.01Å; Y138-F141 PolarHBondContact O-N 2.82Å; L139-F141 VanDerWaalsContact C-N 3.28Å; L139-F141 PolarHBondContact O-N 2.96Å; F141-R183 HydrophobicContact CD1-CB 4.14Å; F141-R183 HydrophobicContact CE1-CB 3.7Å; F141-R183 HydrophobicContact CZ-CB 4.1Å; F141-R183 VanDerWaalsContact O-CG 3.26Å; F141-R183 WeakPolarHBondContact O-CG 3.46Å; F141-I184 WeakPolarHBondContact CZ-O 3.48Å; F141-I185 HydrophobicContact CD1-CD1 4.2Å; F141-I185 HydrophobicContact CD1-CG1 3.95Å; F141-I185 HydrophobicContact CE1-CD1 4.38Å; F141-I185 HydrophobicContact CE1-CG1 3.64Å; F141-H200 WeakPolarHBondContact CZ-O 3.35Å; F141-R202 HydrophobicContact CD1-CB 4.33Å; F141-R202 HydrophobicContact CD2-CB 4.36Å; F141-R202 HydrophobicContact CE1-CB 3.81Å; F141-R202 HydrophobicContact CE2-CB 3.85Å; F141-R202 HydrophobicContact CZ-CB 3.54Å
142	V	97.5	Very high	95.6	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-72.4	-33.3	-178.4	169.6	0	0	0	0	111.9	L134 Y138 L139 T150 I185 H215 K217	L134-V142 HydrophobicContact CD1-CB 4.48Å; L134-V142 HydrophobicContact CD1-CG2 4.27Å; Y138-V142 WeakPolarHBondContact O-CB 3.39Å; Y138-V142 VanDerWaalsContact O-CG2 3.25Å; Y138-V142 WeakPolarHBondContact O-CG2 3.41Å; Y138-V142 PolarHBondContact O-N 3.33Å; L139-V142 PolarHBondContact O-N 3.29Å; V142-T150 HydrophobicContact CG2-CG2 4.17Å; V142-I185 HydrophobicContact CG2-CD1 3.99Å; V142-H215 HydrophobicContact CG1-CB 4.18Å; V142-H215 WeakPolarHBondContact CG1-ND1 3.17Å; V142-K217 HydrophobicContact CG1-CB 4.26Å; V142-K217 VanDerWaalsContact O-CD 3.29Å; V142-K217 WeakPolarHBondContact O-CD 3.31Å
143	E	96.2	Very high	96.4	Very high	93 Å²	93	64.8 Å²	64.8	44%	0.435	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	7.2	-175.5	-68.5	-167.2	148	0	0	115.2	L139 P145 H215 K217	L139-E143 VanDerWaalsContact CD1-CD 3.47Å; L139-E143 HydrophobicContact CD1-CG 3.89Å; L139-E143 HydrophobicContact CG-CG 4.19Å; L139-E143 WeakPolarHBondContact CG-OE2 3.4Å; L139-E143 WeakPolarHBondContact O-CB 3.22Å; L139-E143 WeakPolarHBondContact O-CG 3.34Å; L139-E143 PolarHBondContact O-N 3.38Å; E143-P145 VanDerWaalsContact O-N 3.12Å; E143-H215 IonicContact OE1-CE1 2.62Å; E143-H215 IonicContact OE1-NE2 3.93Å; E143-H215 PolarHBondContact OE1-NE2 3.34Å; E143-K217 VanDerWaalsContact C-NZ 3.33Å; E143-K217 PolarHBondContact O-NZ 3.41Å
144	D	96.6	Very high	96.9	Very high	34 Å²	34	55 Å²	55	18%	0.182	28%	0.281	C	S	.	.			trans	-44.6	121.9	175.9	-172.5	-46.5	0	0	0	111.4	V146 S147 R183 K217	D144-V146 VanDerWaalsContact C-N 3.3Å; D144-V146 PolarHBondContact O-N 3.46Å; D144-V146 WeakPolarHBondContact OD1-CB 3.34Å; D144-V146 PolarHBondContact OD1-N 2.9Å; D144-S147 PolarHBondContact O-N 3.39Å; D144-S147 PolarHBondContact OD1-N 2.82Å; D144-R183 HydrophobicContact CB-CG 4.04Å; D144-R183 IonicContact OD2-CZ 2.92Å; D144-R183 IonicContact OD2-NE 2.95Å; D144-R183 PolarHBondContact OD2-NE 3.31Å; D144-R183 IonicContact OD2-NH1 3.86Å; D144-R183 IonicContact OD2-NH2 2.63Å; D144-R183 PolarHBondContact OD2-NH2 3.46Å; D144-K217 PolarHBondContact O-NZ 2.82Å
145	P	95.4	Very high	97	Very high	118 Å²	118	54.3 Å²	54.3	77%	0.766	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.6	-174.1	28	-34.8	0	0	0	113.8	E143	E143-P145 VanDerWaalsContact O-N 3.12Å
146	V	95.6	Very high	96.8	Very high	129 Å²	129	52.5 Å²	52.5	78%	0.782	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.8	179.1	-172.8	0	0	0	0	111.2	D144	D144-V146 VanDerWaalsContact C-N 3.3Å; D144-V146 PolarHBondContact O-N 3.46Å; D144-V146 WeakPolarHBondContact OD1-CB 3.34Å; D144-V146 PolarHBondContact OD1-N 2.9Å
147	S	97.2	Very high	96.3	Very high	15 Å²	15	47 Å²	47	11%	0.105	24%	0.244	C	C	.	.			trans	-74.8	138.2	-179.3	-179.3	0	0	0	0	113.1	D144 G149 R183	D144-S147 PolarHBondContact O-N 3.39Å; D144-S147 PolarHBondContact OD1-N 2.82Å; S147-G149 PolarHBondContact O-N 2.92Å; S147-G149 PolarHBondContact OG-N 3.27Å; S147-G149 PolarHBondContact OG-O 3.46Å; S147-R183 PolarHBondContact OG-N 3.11Å
148	K	97.1	Very high	95.8	Very high	124 Å²	124	43.2 Å²	43.2	54%	0.539	23%	0.226	S	C	.	.	S	Bend	trans	-68.7	-17.2	167.8	-70.7	-170.8	179.1	178.7	0	113	Q181 Y182 E284	K148-Q181 WeakPolarHBondContact CB-O 3.21Å; K148-Q181 HydrophobicContact CD-CB 4.2Å; K148-Q181 HydrophobicContact CD-CG 3.83Å; K148-Q181 HydrophobicContact CG-CB 4.27Å; K148-Q181 HydrophobicContact CG-CG 4.35Å; K148-Q181 PolarHBondContact N-O 2.86Å; K148-Y182 HydrophobicContact CB-CD1 3.94Å; K148-Y182 HydrophobicContact CB-CE1 3.6Å; K148-Y182 HydrophobicContact CD-CE1 4.45Å; K148-E284 IonicContact NZ-OE1 2.72Å; K148-E284 PolarHBondContact NZ-OE1 3.26Å
149	G	98.1	Very high	95.5	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.01	22%	0.224	C	C	.	.			trans	154.8	179.1	-178.3	0	0	0	0	0	113.4	S147 Y182 R183 K217	S147-G149 PolarHBondContact O-N 2.92Å; S147-G149 PolarHBondContact OG-N 3.27Å; S147-G149 PolarHBondContact OG-O 3.46Å; G149-Y182 WeakPolarHBondContact O-CA 3.37Å; G149-R183 PolarHBondContact O-N 3.18Å; G149-K217 CarbonylContact C-O 3.6Å; G149-K217 VanDerWaalsContact CA-O 3.22Å; G149-K217 WeakPolarHBondContact CA-O 3.35Å
150	T	98.6	Very high	95.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.8	178.1	-63.3	0	0	0	0	111	V142 R183 I185 I212 K217 T218 V219	V142-T150 HydrophobicContact CG2-CG2 4.17Å; T150-R183 CarbonylContact C-O 3.56Å; T150-R183 WeakPolarHBondContact CA-O 3.47Å; T150-I185 HydrophobicContact CG2-CD1 4.04Å; T150-I185 HydrophobicContact CG2-CG1 4.27Å; T150-I212 HydrophobicContact CG2-CG2 4.38Å; T150-K217 PolarHBondContact N-O 3.03Å; T150-T218 CarbonylContact O-C 3.47Å; T150-T218 WeakPolarHBondContact O-CA 3.34Å; T150-V219 WeakPolarHBondContact O-CG2 3.39Å; T150-V219 PolarHBondContact O-N 3.46Å
151	I	98.8	Very high	95.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.5	170.4	-57.5	177.8	0	0	0	107.1	Y182 R183 I184 I185 V219 L220 I222 I279	I151-Y182 HydrophobicContact CD1-CD1 4.13Å; I151-Y182 HydrophobicContact CD1-CD2 3.73Å; I151-Y182 HydrophobicContact CD1-CE2 4.29Å; I151-Y182 HydrophobicContact CD1-CG 3.64Å; I151-Y182 HydrophobicContact CG1-CD1 4.21Å; I151-Y182 HydrophobicContact CG1-CG 4.08Å; I151-R183 PolarHBondContact N-O 3.47Å; I151-I184 HydrophobicContact CB-CG1 4.36Å; I151-I184 CarbonylContact O-C 3.57Å; I151-I184 VanDerWaalsContact O-CA 3.3Å; I151-I184 WeakPolarHBondContact O-CA 3.42Å; I151-I185 PolarHBondContact O-N 3.29Å; I151-V219 HydrophobicContact CG1-CG2 4.2Å; I151-L220 WeakPolarHBondContact CA-O 3.48Å; I151-L220 HydrophobicContact CD1-CD2 4.27Å; I151-L220 HydrophobicContact CG1-CB 4.09Å; I151-L220 HydrophobicContact CG1-CD2 4.43Å; I151-L220 HydrophobicContact CG2-CB 4.19Å; I151-L220 HydrophobicContact CG2-CD2 4.05Å; I151-L220 HydrophobicContact CG2-CG 4.34Å; I151-I222 HydrophobicContact CG2-CD1 3.75Å; I151-I222 HydrophobicContact CG2-CG1 4.04Å; I151-I279 HydrophobicContact CD1-CG2 3.54Å
152	I	98.6	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.9	174.6	178.3	157.4	0	0	0	110.2	I185 V207 L209 I212 L213 T218 L220 F221 I222	I152-I185 CarbonylContact C-O 3.59Å; I152-I185 VanDerWaalsContact CA-O 3.32Å; I152-I185 WeakPolarHBondContact CA-O 3.16Å; I152-I185 HydrophobicContact CB-CB 4.48Å; I152-I185 HydrophobicContact CD1-CB 4.49Å; I152-I185 HydrophobicContact CD1-CG2 4.3Å; I152-I185 HydrophobicContact CG1-CB 4.37Å; I152-V207 HydrophobicContact CD1-CB 4.42Å; I152-V207 HydrophobicContact CD1-CG2 3.95Å; I152-L209 HydrophobicContact CD1-CD1 3.57Å; I152-L209 HydrophobicContact CG1-CD1 4.17Å; I152-I212 HydrophobicContact CB-CG2 4.19Å; I152-I212 HydrophobicContact CD1-CB 4.04Å; I152-I212 HydrophobicContact CD1-CD1 3.65Å; I152-I212 HydrophobicContact CD1-CG1 4.46Å; I152-I212 HydrophobicContact CD1-CG2 3.76Å; I152-I212 HydrophobicContact CG2-CG2 4.29Å; I152-L213 HydrophobicContact CG2-CD2 3.72Å; I152-T218 HydrophobicContact CG2-CG2 4.26Å; I152-L220 PolarHBondContact N-O 2.84Å; I152-F221 HydrophobicContact CG2-CB 4.3Å; I152-F221 HydrophobicContact CG2-CD2 3.83Å; I152-F221 HydrophobicContact CG2-CG 4.32Å; I152-F221 CarbonylContact O-C 3.52Å; I152-F221 WeakPolarHBondContact O-CA 3.48Å; I152-I222 PolarHBondContact O-N 3.42Å
153	L	98.7	Very high	94.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.4	165.9	-166.7	164	0	0	0	108.9	F155 W161 V172 F176 I185 W186 Q187 I222	L153-F155 HydrophobicContact CD1-CZ 4.44Å; L153-F155 HydrophobicContact CD2-CD1 4.02Å; L153-F155 HydrophobicContact CD2-CD2 4.1Å; L153-F155 HydrophobicContact CD2-CE1 3.98Å; L153-F155 HydrophobicContact CD2-CE2 4.06Å; L153-F155 HydrophobicContact CD2-CG 4.09Å; L153-F155 HydrophobicContact CD2-CZ 4Å; L153-F155 HydrophobicContact CG-CE1 4.35Å; L153-F155 HydrophobicContact CG-CZ 4.38Å; L153-W161 HydrophobicContact CD1-CZ2 4.38Å; L153-W161 HydrophobicContact CD2-CZ2 3.66Å; L153-V172 HydrophobicContact CD1-CG1 3.85Å; L153-F176 HydrophobicContact CB-CZ 4.09Å; L153-F176 HydrophobicContact CD1-CE2 4.19Å; L153-F176 HydrophobicContact CD1-CZ 3.66Å; L153-I185 PolarHBondContact N-O 3.48Å; L153-W186 HydrophobicContact CB-CG 4.49Å; L153-Q187 WeakPolarHBondContact O-CB 3.5Å; L153-Q187 PolarHBondContact O-N 2.96Å; L153-I222 WeakPolarHBondContact CA-O 3.28Å; L153-I222 HydrophobicContact CB-CB 4.05Å; L153-I222 HydrophobicContact CB-CD1 4.43Å; L153-I222 HydrophobicContact CD1-CB 4.37Å; L153-I222 HydrophobicContact CD1-CD1 4.47Å; L153-I222 HydrophobicContact CD1-CG2 3.95Å; L153-I222 HydrophobicContact CG-CB 3.9Å; L153-I222 HydrophobicContact CG-CG2 3.82Å
154	S	98.1	Very high	94.8	Very high	3 Å²	3	37 Å²	37	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	123.4	169.6	167.1	0	0	0	0	111.7	Q187 I222 T223	S154-Q187 VanDerWaalsContact CB-OE1 3.3Å; S154-Q187 PolarHBondContact OG-OE1 2.95Å; S154-I222 PolarHBondContact N-O 2.81Å; S154-T223 WeakPolarHBondContact O-CA 3.43Å; S154-T223 PolarHBondContact O-OG1 3.44Å
155	F	96.3	Very high	94.7	Very high	9 Å²	9	36.7 Å²	36.7	4%	0.039	20%	0.2	C	C	.	.			trans	-103.1	11.4	175.8	-65.2	-20.8	0	0	0	113.4	W98 L153 A159 W161 I222 H224 V243 L245	W98-F155 AromaticContact CH2-CD2 3.74Å; W98-F155 HydrophobicContact CH2-CD2 3.74Å; W98-F155 AromaticContact CH2-CE2 3.85Å; W98-F155 HydrophobicContact CH2-CE2 3.85Å; W98-F155 HydrophobicContact CZ2-CD2 4.5Å; W98-F155 HydrophobicContact CZ3-CD2 4.45Å; W98-F155 HydrophobicContact CZ3-CE2 4.19Å; L153-F155 HydrophobicContact CD1-CZ 4.44Å; L153-F155 HydrophobicContact CD2-CD1 4.02Å; L153-F155 HydrophobicContact CD2-CD2 4.1Å; L153-F155 HydrophobicContact CD2-CE1 3.98Å; L153-F155 HydrophobicContact CD2-CE2 4.06Å; L153-F155 HydrophobicContact CD2-CG 4.09Å; L153-F155 HydrophobicContact CD2-CZ 4Å; L153-F155 HydrophobicContact CG-CE1 4.35Å; L153-F155 HydrophobicContact CG-CZ 4.38Å; F155-A159 HydrophobicContact CB-CB 3.23Å; F155-A159 HydrophobicContact CD2-CB 4.38Å; F155-A159 HydrophobicContact CG-CB 4.31Å; F155-A159 WeakPolarHBondContact O-CB 3.45Å; F155-W161 HydrophobicContact CD2-CH2 4.22Å; F155-W161 AromaticContact CD2-CZ2 3.55Å; F155-W161 HydrophobicContact CD2-CZ2 3.55Å; F155-W161 AromaticContact CE2-CH2 3.76Å; F155-W161 HydrophobicContact CE2-CH2 3.76Å; F155-W161 AromaticContact CE2-CZ2 3.51Å; F155-W161 HydrophobicContact CE2-CZ2 3.51Å; F155-I222 HydrophobicContact CE1-CG2 4.3Å; F155-H224 VanDerWaalsContact C-ND1 3.31Å; F155-H224 VanDerWaalsContact CA-ND1 3.35Å; F155-H224 WeakPolarHBondContact CA-ND1 3.43Å; F155-H224 HydrophobicContact CB-CB 4.4Å; F155-H224 HydrophobicContact CD1-CB 4.03Å; F155-H224 HydrophobicContact CG-CB 4.43Å; F155-H224 PolarHBondContact O-CE1 3.41Å; F155-H224 PolarHBondContact O-ND1 3.28Å; F155-V243 HydrophobicContact CE1-CB 3.96Å; F155-V243 HydrophobicContact CE1-CG2 4.41Å; F155-V243 HydrophobicContact CZ-CB 3.76Å; F155-V243 HydrophobicContact CZ-CG1 4.06Å; F155-V243 HydrophobicContact CZ-CG2 4.19Å; F155-L245 HydrophobicContact CB-CD1 4.1Å; F155-L245 HydrophobicContact CD2-CD1 4.13Å; F155-L245 HydrophobicContact CG-CD1 4.24Å
156	G	91.3	Very high	94.7	Very high	15 Å²	15	34.7 Å²	34.7	16%	0.155	19%	0.186	C	C	.	.			trans	77.5	-165.3	175.3	0	0	0	0	0	113.9
157	H	85.9	Confident	94.7	Very high	62 Å²	62	31.9 Å²	31.9	29%	0.287	18%	0.176	S	C	.	.	S	Bend	trans	-74.1	-28.4	-172.6	-75.9	94.4	0	0	0	114.2	A37 S39 W206	A37-H157 HydrophobicContact CB-CB 3.87Å; S39-H157 WeakPolarHBondContact CB-CE1 3.37Å; S39-H157 VanDerWaalsContact CB-ND1 3.3Å; S39-H157 WeakPolarHBondContact CB-ND1 3.45Å; S39-H157 PolarHBondContact N-CE1 2.99Å; S39-H157 PolarHBondContact OG-CE1 2.89Å; S39-H157 PolarHBondContact OG-ND1 3.32Å; H157-W206 AromaticContact CD2-CH2 3.97Å; H157-W206 AromaticContact CD2-CZ3 3.54Å; H157-W206 AromaticContact CE1-CH2 2.94Å; H157-W206 WeakPolarHBondContact CE1-CH2 3.18Å; H157-W206 AromaticContact CE1-CZ2 3.68Å; H157-W206 AromaticContact CE1-CZ3 3.37Å; H157-W206 WeakPolarHBondContact CE1-CZ3 3.45Å; H157-W206 AromaticContact CG-CZ3 3.77Å; H157-W206 AromaticContact ND1-CH2 3.45Å; H157-W206 WeakPolarHBondContact ND1-CH2 3.3Å; H157-W206 AromaticContact ND1-CZ3 3.67Å; H157-W206 AromaticContact NE2-CH2 3.32Å; H157-W206 VanDerWaalsContact NE2-CH2 3.32Å; H157-W206 WeakPolarHBondContact NE2-CH2 3.41Å; H157-W206 AromaticContact NE2-CZ2 3.97Å; H157-W206 AromaticContact NE2-CZ3 3.3Å; H157-W206 VanDerWaalsContact NE2-CZ3 3.3Å; H157-W206 WeakPolarHBondContact NE2-CZ3 3.49Å
158	F	85.2	Confident	94.7	Very high	30 Å²	30	31.8 Å²	31.8	13%	0.132	18%	0.175	C	C	.	.	S	Bend	trans	-97.9	-2.2	-170	-63.4	-55.1	0	0	0	113.5	M35 A37 M89 D160 F246	M35-F158 HydrophobicContact CB-CE2 4.39Å; M35-F158 HydrophobicContact CB-CZ 4.07Å; M35-F158 HydrophobicContact CE-CD2 4.06Å; M35-F158 HydrophobicContact CE-CE1 4.4Å; M35-F158 HydrophobicContact CE-CE2 3.33Å; M35-F158 HydrophobicContact CE-CZ 3.51Å; M35-F158 HydrophobicContact SD-CE2 3.66Å; M35-F158 HydrophobicContact SD-CZ 4.15Å; A37-F158 HydrophobicContact CB-CE1 3.9Å; A37-F158 HydrophobicContact CB-CE2 3.78Å; A37-F158 HydrophobicContact CB-CZ 3.34Å; M89-F158 HydrophobicContact CE-CB 3.93Å; M89-F158 WeakPolarHBondContact CE-O 3.3Å; M89-F158 HydrophobicContact CG-CB 4.43Å; M89-F158 HydrophobicContact CG-CD1 3.44Å; M89-F158 VanDerWaalsContact CG-CD1 3.44Å; M89-F158 HydrophobicContact CG-CE1 4.06Å; M89-F158 HydrophobicContact CG-CG 4.32Å; M89-F158 HydrophobicContact SD-CB 3.79Å; M89-F158 HydrophobicContact SD-CD1 3.64Å; M89-F158 HydrophobicContact SD-CE1 4.46Å; M89-F158 HydrophobicContact SD-CG 3.96Å; F158-D160 PolarHBondContact O-N 2.76Å; F158-F246 HydrophobicContact CB-CE1 4.08Å; F158-F246 HydrophobicContact CB-CZ 3.68Å; F158-F246 HydrophobicContact CD2-CZ 4.33Å; F158-F246 HydrophobicContact CG-CZ 4.34Å
159	A	89.6	Confident	94.7	Very high	7 Å²	7	26.2 Å²	26.2	6%	0.058	15%	0.151	C	C	.	.			trans	-89.6	92	174.2	0	0	0	0	0	109.5	W98 F155 W161 L245	W98-A159 HydrophobicContact CZ2-CB 4.39Å; F155-A159 HydrophobicContact CB-CB 3.23Å; F155-A159 HydrophobicContact CD2-CB 4.38Å; F155-A159 HydrophobicContact CG-CB 4.31Å; F155-A159 WeakPolarHBondContact O-CB 3.45Å; A159-W161 PolarHBondContact O-N 2.85Å; A159-L245 HydrophobicContact CB-CD1 3.52Å
160	D	91.5	Very high	94.6	Very high	50 Å²	50	30.9 Å²	30.9	27%	0.267	17%	0.172	S	C	.	.			trans	-83	107.8	176.1	-172.8	5	0	0	0	110.6	W98 F158 K162 A163 N189	W98-D160 PolarHBondContact NE1-O 2.86Å; F158-D160 PolarHBondContact O-N 2.76Å; D160-K162 PolarHBondContact O-N 3.24Å; D160-K162 VanDerWaalsContact OD1-CB 3.32Å; D160-K162 WeakPolarHBondContact OD1-CB 3.33Å; D160-K162 WeakPolarHBondContact OD1-CG 3.37Å; D160-K162 PolarHBondContact OD1-N 3.28Å; D160-A163 PolarHBondContact O-N 2.62Å; D160-A163 VanDerWaalsContact O-N 3.16Å; D160-N189 PolarHBondContact OD1-ND2 2.85Å; D160-N189 PolarHBondContact OD1-OD1 3.35Å
161	W	95.3	Very high	94.6	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.023	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-67.1	-17.1	178.4	-74.3	95.1	0	0	0	113.5	W98 L153 F155 A159 A163 A164 I169 V172 W186 Q187 F188 N189	W98-W161 AromaticContact CH2-CD2 3.86Å; W98-W161 HydrophobicContact CH2-CD2 3.86Å; W98-W161 AromaticContact CH2-CE2 3.96Å; W98-W161 AromaticContact CH2-CE3 3.68Å; W98-W161 HydrophobicContact CH2-CE3 3.68Å; W98-W161 AromaticContact CH2-CH2 3.8Å; W98-W161 HydrophobicContact CH2-CH2 3.8Å; W98-W161 AromaticContact CH2-CZ2 3.94Å; W98-W161 HydrophobicContact CH2-CZ2 3.94Å; W98-W161 AromaticContact CH2-CZ3 3.67Å; W98-W161 HydrophobicContact CH2-CZ3 3.67Å; W98-W161 AromaticContact CZ2-CD2 3.97Å; W98-W161 HydrophobicContact CZ2-CD2 3.97Å; W98-W161 HydrophobicContact CZ2-CE3 4.05Å; W98-W161 HydrophobicContact CZ2-CG 4.34Å; W98-W161 HydrophobicContact CZ2-CZ3 4.48Å; W98-W161 HydrophobicContact CZ3-CE3 4.46Å; W98-W161 HydrophobicContact CZ3-CH2 4.35Å; W98-W161 HydrophobicContact CZ3-CZ3 4.14Å; L153-W161 HydrophobicContact CD1-CZ2 4.38Å; L153-W161 HydrophobicContact CD2-CZ2 3.66Å; F155-W161 HydrophobicContact CD2-CH2 4.22Å; F155-W161 AromaticContact CD2-CZ2 3.55Å; F155-W161 HydrophobicContact CD2-CZ2 3.55Å; F155-W161 AromaticContact CE2-CH2 3.76Å; F155-W161 HydrophobicContact CE2-CH2 3.76Å; F155-W161 AromaticContact CE2-CZ2 3.51Å; F155-W161 HydrophobicContact CE2-CZ2 3.51Å; A159-W161 PolarHBondContact O-N 2.85Å; W161-A163 PolarHBondContact O-N 2.88Å; W161-A164 HydrophobicContact CE3-CB 3.89Å; W161-A164 HydrophobicContact CZ3-CB 4.49Å; W161-A164 WeakPolarHBondContact O-CB 3.4Å; W161-A164 PolarHBondContact O-N 3.43Å; W161-I169 HydrophobicContact CE3-CG1 3.96Å; W161-I169 HydrophobicContact CZ3-CG1 4.25Å; W161-V172 HydrophobicContact CH2-CG2 4.18Å; W161-W186 HydrophobicContact CD2-CZ2 4.47Å; W161-W186 AromaticContact CE2-NE1 3.5Å; W161-W186 HydrophobicContact CE3-CZ2 4.17Å; W161-W186 AromaticContact CH2-CZ2 3.8Å; W161-W186 HydrophobicContact CH2-CZ2 3.8Å; W161-W186 AromaticContact CH2-NE1 3.78Å; W161-W186 AromaticContact CZ2-CE2 3.99Å; W161-W186 HydrophobicContact CZ2-CZ2 4.12Å; W161-W186 AromaticContact CZ2-NE1 3.23Å; W161-W186 AromaticContact CZ3-CZ2 3.83Å; W161-W186 HydrophobicContact CZ3-CZ2 3.83Å; W161-W186 AromaticContact NE1-NE1 3.89Å; W161-Q187 PolarHBondContact NE1-O 3.36Å; W161-F188 HydrophobicContact CB-CD2 3.54Å; W161-F188 HydrophobicContact CB-CE2 3.55Å; W161-F188 HydrophobicContact CB-CG 4.37Å; W161-F188 HydrophobicContact CB-CZ 4.4Å; W161-F188 AromaticContact CD1-CD2 3.87Å; W161-F188 AromaticContact CD2-CD2 3.49Å; W161-F188 HydrophobicContact CD2-CD2 3.49Å; W161-F188 VanDerWaalsContact CD2-CD2 3.49Å; W161-F188 AromaticContact CD2-CE2 3.87Å; W161-F188 HydrophobicContact CD2-CE2 3.87Å; W161-F188 AromaticContact CE3-CD2 3.9Å; W161-F188 HydrophobicContact CE3-CD2 3.9Å; W161-F188 AromaticContact CE3-CE2 3.86Å; W161-F188 HydrophobicContact CE3-CE2 3.86Å; W161-F188 AromaticContact CG-CD2 3.34Å; W161-F188 HydrophobicContact CG-CD2 3.34Å; W161-F188 AromaticContact CG-CE2 3.78Å; W161-F188 HydrophobicContact CG-CE2 3.78Å; W161-F188 HydrophobicContact CG-CG 4.24Å; W161-N189 WeakPolarHBondContact CB-OD1 3.05Å; W161-N189 PolarHBondContact N-OD1 3.26Å
162	K	94.1	Very high	94.6	Very high	152 Å²	152	31.4 Å²	31.4	66%	0.661	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-64.1	-29.2	172.8	-60.3	173.3	-176.6	178.5	0	112.2	D160 N189	D160-K162 PolarHBondContact O-N 3.24Å; D160-K162 VanDerWaalsContact OD1-CB 3.32Å; D160-K162 WeakPolarHBondContact OD1-CB 3.33Å; D160-K162 WeakPolarHBondContact OD1-CG 3.37Å; D160-K162 PolarHBondContact OD1-N 3.28Å; K162-N189 WeakPolarHBondContact CE-O 3.32Å; K162-N189 VanDerWaalsContact CG-O 3.3Å; K162-N189 WeakPolarHBondContact CG-O 3.33Å
163	A	93.9	Very high	94.5	Very high	12 Å²	12	31.7 Å²	31.7	10%	0.099	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-90.6	-5.5	177.3	0	0	0	0	0	113.3	A94 D160 W161	A94-A163 HydrophobicContact CB-CB 3.78Å; D160-A163 PolarHBondContact O-N 2.62Å; D160-A163 VanDerWaalsContact O-N 3.16Å; W161-A163 PolarHBondContact O-N 2.88Å
164	A	95	Very high	94.5	Very high	8 Å²	8	33.3 Å²	33.3	7%	0.066	19%	0.19	C	C	.	.	S	Bend	trans	-70.8	140.7	-179.9	0	0	0	0	0	110.8	W98 W161 V166 I169	W98-A164 HydrophobicContact CD2-CB 3.64Å; W98-A164 HydrophobicContact CE3-CB 3.94Å; W98-A164 HydrophobicContact CG-CB 4.09Å; W98-A164 HydrophobicContact CH2-CB 4.09Å; W98-A164 HydrophobicContact CZ2-CB 3.82Å; W98-A164 HydrophobicContact CZ3-CB 4.15Å; W161-A164 HydrophobicContact CE3-CB 3.89Å; W161-A164 HydrophobicContact CZ3-CB 4.49Å; W161-A164 WeakPolarHBondContact O-CB 3.4Å; W161-A164 PolarHBondContact O-N 3.43Å; A164-V166 PolarHBondContact O-N 2.82Å; A164-I169 HydrophobicContact CB-CD1 4.17Å; A164-I169 HydrophobicContact CB-CG1 4Å
165	P	95	Very high	94.5	Very high	29 Å²	29	33.1 Å²	33.1	19%	0.188	19%	0.189	C	C	.	.			trans	-55.9	134.9	171	-24.5	32.8	0	0	0	111.2	R99 A167 T168 I169	R99-P165 HydrophobicContact CG-CG 4.42Å; P165-A167 PolarHBondContact O-N 3.03Å; P165-A167 VanDerWaalsContact O-N 3.15Å; P165-T168 WeakPolarHBondContact O-CA 3.4Å; P165-T168 WeakPolarHBondContact O-CB 3.24Å; P165-T168 PolarHBondContact O-N 3.01Å; P165-I169 PolarHBondContact O-N 3.23Å; P165-I169 VanDerWaalsContact O-N 3.16Å
166	V	95.2	Very high	94.6	Very high	76 Å²	76	32.8 Å²	32.8	46%	0.461	19%	0.187	S	C	.	.	H	α-helix	trans	-53.5	-39.1	178.2	175.8	0	0	0	0	111.3	A164 T168 I169 Q170	A164-V166 PolarHBondContact O-N 2.82Å; V166-T168 VanDerWaalsContact C-N 3.29Å; V166-T168 PolarHBondContact O-N 3.4Å; V166-I169 PolarHBondContact O-N 2.85Å; V166-I169 VanDerWaalsContact O-N 3.16Å; V166-Q170 HydrophobicContact CG1-CG 4.14Å; V166-Q170 WeakPolarHBondContact O-CB 3.32Å; V166-Q170 WeakPolarHBondContact O-CG 2.94Å; V166-Q170 PolarHBondContact O-N 3.22Å
167	A	95.2	Very high	94.9	Very high	69 Å²	69	35 Å²	35	57%	0.57	19%	0.194	S	C	*	.	H	α-helix	trans	-59	-37.3	175.8	0	0	0	0	0	113.2	P165 A171	P165-A167 PolarHBondContact O-N 3.03Å; P165-A167 VanDerWaalsContact O-N 3.15Å; A167-A171 VanDerWaalsContact O-CB 3.26Å; A167-A171 WeakPolarHBondContact O-CB 3.27Å; A167-A171 PolarHBondContact O-N 3.44Å
168	T	96.4	Very high	95.4	Very high	14 Å²	14	35.9 Å²	35.9	9%	0.086	20%	0.2	C	C	.	.	H	α-helix	trans	-69.1	-42.4	175.8	-54.8	0	0	0	0	111	W98 P165 V166 A171 V172 L270	W98-T168 HydrophobicContact CE3-CG2 4.48Å; W98-T168 HydrophobicContact CZ3-CG2 4.21Å; P165-T168 WeakPolarHBondContact O-CA 3.4Å; P165-T168 WeakPolarHBondContact O-CB 3.24Å; P165-T168 PolarHBondContact O-N 3.01Å; V166-T168 VanDerWaalsContact C-N 3.29Å; V166-T168 PolarHBondContact O-N 3.4Å; T168-A171 PolarHBondContact O-N 3.16Å; T168-V172 WeakPolarHBondContact O-CG2 3.48Å; T168-V172 PolarHBondContact O-N 2.85Å; T168-V172 VanDerWaalsContact O-N 3.07Å; T168-L270 HydrophobicContact CG2-CD2 4.11Å
169	I	97.5	Very high	96	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.036	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-47.6	176.6	-60.6	174.4	0	0	0	110.3	W161 A164 P165 V166 V172 S173 W186 F188 V194 V195	W161-I169 HydrophobicContact CE3-CG1 3.96Å; W161-I169 HydrophobicContact CZ3-CG1 4.25Å; A164-I169 HydrophobicContact CB-CD1 4.17Å; A164-I169 HydrophobicContact CB-CG1 4Å; P165-I169 PolarHBondContact O-N 3.23Å; P165-I169 VanDerWaalsContact O-N 3.16Å; V166-I169 PolarHBondContact O-N 2.85Å; V166-I169 VanDerWaalsContact O-N 3.16Å; I169-V172 PolarHBondContact O-N 2.76Å; I169-S173 WeakPolarHBondContact O-CB 3.43Å; I169-S173 PolarHBondContact O-N 3.22Å; I169-W186 HydrophobicContact CG2-CH2 4.08Å; I169-F188 HydrophobicContact CD1-CE2 4.24Å; I169-F188 HydrophobicContact CD1-CZ 4.41Å; I169-F188 HydrophobicContact CG1-CE2 4.33Å; I169-F188 HydrophobicContact CG2-CE2 3.99Å; I169-F188 HydrophobicContact CG2-CZ 4.14Å; I169-V194 HydrophobicContact CD1-CG2 4.41Å; I169-V194 HydrophobicContact CG2-CG2 3.86Å; I169-V195 HydrophobicContact CG2-CG1 3.52Å
170	Q	97.1	Very high	96.4	Very high	98 Å²	98	40.8 Å²	40.8	46%	0.458	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-41.2	177.8	-73	175.9	-26.3	0	0	112	V166 V172 S173 S174	V166-Q170 HydrophobicContact CG1-CG 4.14Å; V166-Q170 WeakPolarHBondContact O-CB 3.32Å; V166-Q170 WeakPolarHBondContact O-CG 2.94Å; V166-Q170 PolarHBondContact O-N 3.22Å; Q170-V172 VanDerWaalsContact C-N 3.31Å; Q170-V172 PolarHBondContact O-N 3.07Å; Q170-S173 PolarHBondContact O-N 3.48Å; Q170-S174 WeakPolarHBondContact O-CB 3.3Å; Q170-S174 PolarHBondContact O-N 3.32Å; Q170-S174 PolarHBondContact O-OG 3.05Å
171	A	97.5	Very high	96.7	Very high	10 Å²	10	41 Å²	41	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-43.1	174.8	0	0	0	0	0	112	A167 T168 A175	A167-A171 VanDerWaalsContact O-CB 3.26Å; A167-A171 WeakPolarHBondContact O-CB 3.27Å; A167-A171 PolarHBondContact O-N 3.44Å; T168-A171 PolarHBondContact O-N 3.16Å; A171-A175 WeakPolarHBondContact O-CB 3.36Å; A171-A175 PolarHBondContact O-N 3.13Å; A171-A175 VanDerWaalsContact O-N 3.16Å
172	V	98.4	Very high	96.8	Very high	2 Å²	2	41 Å²	41	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-50.3	175.9	175.3	0	0	0	0	111.1	L153 W161 T168 I169 Q170 S174 A175 F176 W186 L270 L275	L153-V172 HydrophobicContact CD1-CG1 3.85Å; W161-V172 HydrophobicContact CH2-CG2 4.18Å; T168-V172 WeakPolarHBondContact O-CG2 3.48Å; T168-V172 PolarHBondContact O-N 2.85Å; T168-V172 VanDerWaalsContact O-N 3.07Å; I169-V172 PolarHBondContact O-N 2.76Å; Q170-V172 VanDerWaalsContact C-N 3.31Å; Q170-V172 PolarHBondContact O-N 3.07Å; V172-S174 PolarHBondContact O-N 3.37Å; V172-A175 PolarHBondContact O-N 3.31Å; V172-F176 HydrophobicContact CG1-CD2 3.95Å; V172-F176 HydrophobicContact CG1-CE1 4.25Å; V172-F176 HydrophobicContact CG1-CE2 3.47Å; V172-F176 VanDerWaalsContact CG1-CE2 3.47Å; V172-F176 HydrophobicContact CG1-CZ 3.66Å; V172-F176 WeakPolarHBondContact O-CG 3.31Å; V172-F176 PolarHBondContact O-N 3.36Å; V172-W186 HydrophobicContact CB-CH2 4Å; V172-W186 HydrophobicContact CB-CZ2 4.04Å; V172-W186 HydrophobicContact CG1-CD2 4.28Å; V172-W186 HydrophobicContact CG1-CE3 4.38Å; V172-W186 HydrophobicContact CG1-CH2 3.67Å; V172-W186 HydrophobicContact CG1-CZ2 3.54Å; V172-W186 HydrophobicContact CG1-CZ3 4.1Å; V172-L270 HydrophobicContact CG2-CD2 3.97Å; V172-L275 HydrophobicContact CB-CD2 4.19Å; V172-L275 HydrophobicContact CG1-CD2 4.28Å; V172-L275 HydrophobicContact CG2-CD2 3.86Å
173	S	98.3	Very high	97.1	Very high	6 Å²	6	35.7 Å²	35.7	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-56.8	-51	-179.7	-168.3	0	0	0	0	111.8	I169 Q170 A175 F176 E177 S196	I169-S173 WeakPolarHBondContact O-CB 3.43Å; I169-S173 PolarHBondContact O-N 3.22Å; Q170-S173 PolarHBondContact O-N 3.48Å; S173-A175 VanDerWaalsContact C-N 3.31Å; S173-A175 PolarHBondContact O-N 3.23Å; S173-F176 WeakPolarHBondContact O-CB 3.42Å; S173-F176 PolarHBondContact O-N 3.48Å; S173-F176 VanDerWaalsContact O-N 3.09Å; S173-E177 PolarHBondContact O-N 3.39Å; S173-S196 WeakPolarHBondContact OG-CB 3.49Å; S173-S196 PolarHBondContact OG-N 2.84Å; S173-S196 PolarHBondContact OG-OG 3.34Å
174	S	97.8	Very high	97.3	Very high	34 Å²	34	35.1 Å²	35.1	24%	0.238	19%	0.193	C	C	.	.	H	α-helix	trans	-69.3	-26.5	-179.3	-63.8	0	0	0	0	113.8	Q170 V172 E177 K272	Q170-S174 WeakPolarHBondContact O-CB 3.3Å; Q170-S174 PolarHBondContact O-N 3.32Å; Q170-S174 PolarHBondContact O-OG 3.05Å; V172-S174 PolarHBondContact O-N 3.37Å; S174-E177 WeakPolarHBondContact CA-OE2 3.4Å; S174-K272 VanDerWaalsContact O-CE 3.31Å; S174-K272 WeakPolarHBondContact O-CE 3.43Å
175	A	98.4	Very high	97.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-41.8	170.4	0	0	0	0	0	110.5	A171 V172 S173 N178 L179 K272 L275	A171-A175 WeakPolarHBondContact O-CB 3.36Å; A171-A175 PolarHBondContact O-N 3.13Å; A171-A175 VanDerWaalsContact O-N 3.16Å; V172-A175 PolarHBondContact O-N 3.31Å; S173-A175 VanDerWaalsContact C-N 3.31Å; S173-A175 PolarHBondContact O-N 3.23Å; A175-N178 PolarHBondContact O-N 2.86Å; A175-L179 WeakPolarHBondContact O-CD1 3.3Å; A175-L179 WeakPolarHBondContact O-CG 2.97Å; A175-K272 HydrophobicContact CB-CG 4.42Å; A175-L275 HydrophobicContact CB-CB 4.16Å; A175-L275 HydrophobicContact CB-CD2 3.9Å; A175-L275 HydrophobicContact CB-CG 4.08Å
176	F	98.6	Very high	97.6	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-68.2	-38	179.4	-67.6	-9.8	0	0	0	113.2	L153 V172 S173 N178 L179 I184 W186 H200 V201 I222 L275 I279	L153-F176 HydrophobicContact CB-CZ 4.09Å; L153-F176 HydrophobicContact CD1-CE2 4.19Å; L153-F176 HydrophobicContact CD1-CZ 3.66Å; V172-F176 HydrophobicContact CG1-CD2 3.95Å; V172-F176 HydrophobicContact CG1-CE1 4.25Å; V172-F176 HydrophobicContact CG1-CE2 3.47Å; V172-F176 VanDerWaalsContact CG1-CE2 3.47Å; V172-F176 HydrophobicContact CG1-CZ 3.66Å; V172-F176 WeakPolarHBondContact O-CG 3.31Å; V172-F176 PolarHBondContact O-N 3.36Å; S173-F176 WeakPolarHBondContact O-CB 3.42Å; S173-F176 PolarHBondContact O-N 3.48Å; S173-F176 VanDerWaalsContact O-N 3.09Å; F176-N178 PolarHBondContact O-N 3.32Å; F176-L179 HydrophobicContact CD1-CD1 4.27Å; F176-L179 PolarHBondContact O-N 3.33Å; F176-I184 HydrophobicContact CB-CD1 3.68Å; F176-I184 HydrophobicContact CD1-CD1 3.79Å; F176-I184 HydrophobicContact CD1-CG2 4.2Å; F176-I184 HydrophobicContact CD2-CG2 3.7Å; F176-I184 HydrophobicContact CE1-CG2 4.18Å; F176-I184 HydrophobicContact CE2-CG2 3.68Å; F176-I184 HydrophobicContact CG-CD1 3.79Å; F176-I184 HydrophobicContact CG-CG2 3.96Å; F176-I184 HydrophobicContact CZ-CG2 3.91Å; F176-W186 HydrophobicContact CD2-CD2 4.25Å; F176-W186 AromaticContact CD2-CE3 3.8Å; F176-W186 HydrophobicContact CD2-CE3 3.8Å; F176-W186 HydrophobicContact CD2-CZ3 4.29Å; F176-W186 HydrophobicContact CE2-CB 4.08Å; F176-W186 AromaticContact CE2-CD2 3.75Å; F176-W186 HydrophobicContact CE2-CD2 3.75Å; F176-W186 AromaticContact CE2-CE3 3.79Å; F176-W186 HydrophobicContact CE2-CE3 3.79Å; F176-W186 AromaticContact CE2-CG 3.9Å; F176-W186 HydrophobicContact CE2-CG 3.9Å; F176-W186 HydrophobicContact CE2-CZ3 4.47Å; F176-H200 PolarHBondContact O-NE2 2.81Å; F176-V201 HydrophobicContact CB-CG2 3.99Å; F176-V201 HydrophobicContact CD2-CG1 4.37Å; F176-I222 HydrophobicContact CE1-CD1 3.77Å; F176-I222 HydrophobicContact CZ-CD1 3.96Å; F176-L275 HydrophobicContact CE1-CD2 4.46Å; F176-I279 HydrophobicContact CD1-CD1 4.43Å; F176-I279 HydrophobicContact CE1-CD1 4.04Å
177	E	97.2	Very high	97.7	Very high	62 Å²	62	30.4 Å²	30.4	29%	0.29	16%	0.162	S	C	.	.	H	α-helix	trans	-53.1	-36.6	173.3	-74.4	179.1	141.9	0	0	112.8	S173 S174 L179 Q180 S196 T198	S173-E177 PolarHBondContact O-N 3.39Å; S174-E177 WeakPolarHBondContact CA-OE2 3.4Å; E177-L179 VanDerWaalsContact C-N 3.3Å; E177-L179 PolarHBondContact O-N 3.29Å; E177-Q180 VanDerWaalsContact O-CG 3.32Å; E177-Q180 WeakPolarHBondContact O-CG 3.3Å; E177-Q180 PolarHBondContact O-NE2 2.72Å; E177-S196 VanDerWaalsContact CG-CB 3.48Å; E177-S196 WeakPolarHBondContact CG-OG 3.08Å; E177-S196 WeakPolarHBondContact OE1-CB 3.26Å; E177-S196 PolarHBondContact OE1-OG 3.16Å; E177-T198 HydrophobicContact CG-CG2 4.29Å
178	N	96.9	Very high	97.8	Very high	80 Å²	80	27.3 Å²	27.3	43%	0.428	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	4.2	-177.3	-78	-0.9	0	0	0	113.9	A175 F176 K272 Y276	A175-N178 PolarHBondContact O-N 2.86Å; F176-N178 PolarHBondContact O-N 3.32Å; N178-K272 VanDerWaalsContact ND2-CE 3.27Å; N178-K272 WeakPolarHBondContact ND2-CE 3.09Å; N178-K272 PolarHBondContact ND2-NZ 3.1Å; N178-Y276 HydrophobicContact CB-CD2 4.02Å; N178-Y276 HydrophobicContact CB-CE2 3.87Å; N178-Y276 WeakPolarHBondContact O-CE2 3.34Å
179	L	97.8	Very high	97.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.			trans	-113.3	38.7	-176.7	-71.5	167.6	0	0	0	112.2	A175 F176 E177 Q181 Y182 I184 Y276 I279 I280	A175-L179 WeakPolarHBondContact O-CD1 3.3Å; A175-L179 WeakPolarHBondContact O-CG 2.97Å; F176-L179 HydrophobicContact CD1-CD1 4.27Å; F176-L179 PolarHBondContact O-N 3.33Å; E177-L179 VanDerWaalsContact C-N 3.3Å; E177-L179 PolarHBondContact O-N 3.29Å; L179-Q181 PolarHBondContact O-N 3.33Å; L179-Y182 HydrophobicContact CB-CD2 4.4Å; L179-Y182 HydrophobicContact CD2-CD2 4.11Å; L179-Y182 HydrophobicContact CD2-CE2 4.3Å; L179-Y182 PolarHBondContact O-N 3.23Å; L179-I184 HydrophobicContact CB-CD1 3.82Å; L179-I184 HydrophobicContact CD1-CD1 4.28Å; L179-Y276 HydrophobicContact CD1-CD2 4.41Å; L179-Y276 HydrophobicContact CD2-CD2 3.82Å; L179-Y276 HydrophobicContact CD2-CE2 3.59Å; L179-Y276 HydrophobicContact CG-CD2 3.85Å; L179-Y276 HydrophobicContact CG-CE2 3.92Å; L179-I279 HydrophobicContact CD1-CB 4.31Å; L179-I279 HydrophobicContact CD1-CD1 3.6Å; L179-I279 HydrophobicContact CD1-CG2 3.79Å; L179-I279 HydrophobicContact CD2-CG2 4.03Å; L179-I280 HydrophobicContact CD2-CD1 3.65Å; L179-I280 HydrophobicContact CD2-CG1 4.26Å
180	Q	97.2	Very high	97.7	Very high	140 Å²	140	29.5 Å²	29.5	65%	0.654	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20	-175.5	-61.1	178.4	0.4	0	0	114.2	E177 Y182	E177-Q180 VanDerWaalsContact O-CG 3.32Å; E177-Q180 WeakPolarHBondContact O-CG 3.3Å; E177-Q180 PolarHBondContact O-NE2 2.72Å; Q180-Y182 PolarHBondContact O-N 3.23Å
181	Q	97.9	Very high	97.6	Very high	54 Å²	54	29.1 Å²	29.1	25%	0.252	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-8.1	173.5	73.4	-81	15.6	0	0	113.8	K148 L179	K148-Q181 WeakPolarHBondContact CB-O 3.21Å; K148-Q181 HydrophobicContact CD-CB 4.2Å; K148-Q181 HydrophobicContact CD-CG 3.83Å; K148-Q181 HydrophobicContact CG-CB 4.27Å; K148-Q181 HydrophobicContact CG-CG 4.35Å; K148-Q181 PolarHBondContact N-O 2.86Å; L179-Q181 PolarHBondContact O-N 3.33Å
182	Y	98.5	Very high	97.5	Very high	7 Å²	7	33.8 Å²	33.8	3%	0.027	17%	0.174	C	C	.	.	S	Bend	trans	-119	156.6	176.8	-64	-74.2	0	0	0	111.3	K148 G149 I151 L179 Q180 H200 V219 I280 E284	K148-Y182 HydrophobicContact CB-CD1 3.94Å; K148-Y182 HydrophobicContact CB-CE1 3.6Å; K148-Y182 HydrophobicContact CD-CE1 4.45Å; G149-Y182 WeakPolarHBondContact O-CA 3.37Å; I151-Y182 HydrophobicContact CD1-CD1 4.13Å; I151-Y182 HydrophobicContact CD1-CD2 3.73Å; I151-Y182 HydrophobicContact CD1-CE2 4.29Å; I151-Y182 HydrophobicContact CD1-CG 3.64Å; I151-Y182 HydrophobicContact CG1-CD1 4.21Å; I151-Y182 HydrophobicContact CG1-CG 4.08Å; L179-Y182 HydrophobicContact CB-CD2 4.4Å; L179-Y182 HydrophobicContact CD2-CD2 4.11Å; L179-Y182 HydrophobicContact CD2-CE2 4.3Å; L179-Y182 PolarHBondContact O-N 3.23Å; Q180-Y182 PolarHBondContact O-N 3.23Å; Y182-H200 PolarHBondContact O-CD2 3.02Å; Y182-V219 HydrophobicContact CD1-CG2 4.14Å; Y182-V219 HydrophobicContact CE1-CG2 3.97Å; Y182-I280 HydrophobicContact CE2-CD1 4.23Å; Y182-E284 WeakPolarHBondContact OH-CG 3.49Å
183	R	98.6	Very high	97.3	Very high	39 Å²	39	38.3 Å²	38.3	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.7	165.7	-65.7	-73.9	156.9	-162	-11	108	F141 D144 S147 G149 T150 I151 S199	F141-R183 HydrophobicContact CD1-CB 4.14Å; F141-R183 HydrophobicContact CE1-CB 3.7Å; F141-R183 HydrophobicContact CZ-CB 4.1Å; F141-R183 VanDerWaalsContact O-CG 3.26Å; F141-R183 WeakPolarHBondContact O-CG 3.46Å; D144-R183 HydrophobicContact CB-CG 4.04Å; D144-R183 IonicContact OD2-CZ 2.92Å; D144-R183 IonicContact OD2-NE 2.95Å; D144-R183 PolarHBondContact OD2-NE 3.31Å; D144-R183 IonicContact OD2-NH1 3.86Å; D144-R183 IonicContact OD2-NH2 2.63Å; D144-R183 PolarHBondContact OD2-NH2 3.46Å; S147-R183 PolarHBondContact OG-N 3.11Å; G149-R183 PolarHBondContact O-N 3.18Å; T150-R183 CarbonylContact C-O 3.56Å; T150-R183 WeakPolarHBondContact CA-O 3.47Å; I151-R183 PolarHBondContact N-O 3.47Å; R183-S199 PolarHBondContact NH1-O 2.89Å
184	I	98.7	Very high	97	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.5	-173.6	-60.2	173.3	0	0	0	108.5	F141 I151 F176 L179 H200 V201 R202	F141-I184 WeakPolarHBondContact CZ-O 3.48Å; I151-I184 HydrophobicContact CB-CG1 4.36Å; I151-I184 CarbonylContact O-C 3.57Å; I151-I184 VanDerWaalsContact O-CA 3.3Å; I151-I184 WeakPolarHBondContact O-CA 3.42Å; F176-I184 HydrophobicContact CB-CD1 3.68Å; F176-I184 HydrophobicContact CD1-CD1 3.79Å; F176-I184 HydrophobicContact CD1-CG2 4.2Å; F176-I184 HydrophobicContact CD2-CG2 3.7Å; F176-I184 HydrophobicContact CE1-CG2 4.18Å; F176-I184 HydrophobicContact CE2-CG2 3.68Å; F176-I184 HydrophobicContact CG-CD1 3.79Å; F176-I184 HydrophobicContact CG-CG2 3.96Å; F176-I184 HydrophobicContact CZ-CG2 3.91Å; L179-I184 HydrophobicContact CB-CD1 3.82Å; L179-I184 HydrophobicContact CD1-CD1 4.28Å; I184-H200 PolarHBondContact N-O 2.96Å; I184-V201 HydrophobicContact CB-CG1 4.42Å; I184-V201 HydrophobicContact CB-CG2 4.13Å; I184-V201 HydrophobicContact CD1-CG2 4.24Å; I184-V201 HydrophobicContact CG2-CG1 4.29Å; I184-V201 CarbonylContact O-C 3.51Å; I184-V201 WeakPolarHBondContact O-CA 3.47Å; I184-R202 PolarHBondContact O-N 3.21Å
185	I	98.5	Very high	96.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.1	171.8	-58.8	176.2	0	0	0	107.3	Y138 F141 V142 T150 I151 I152 L153 R202 V207 I212	Y138-I185 HydrophobicContact CD1-CD1 4.06Å; Y138-I185 HydrophobicContact CE1-CD1 4.2Å; Y138-I185 HydrophobicContact CE1-CG2 4.47Å; F141-I185 HydrophobicContact CD1-CD1 4.2Å; F141-I185 HydrophobicContact CD1-CG1 3.95Å; F141-I185 HydrophobicContact CE1-CD1 4.38Å; F141-I185 HydrophobicContact CE1-CG1 3.64Å; V142-I185 HydrophobicContact CG2-CD1 3.99Å; T150-I185 HydrophobicContact CG2-CD1 4.04Å; T150-I185 HydrophobicContact CG2-CG1 4.27Å; I151-I185 PolarHBondContact O-N 3.29Å; I152-I185 CarbonylContact C-O 3.59Å; I152-I185 VanDerWaalsContact CA-O 3.32Å; I152-I185 WeakPolarHBondContact CA-O 3.16Å; I152-I185 HydrophobicContact CB-CB 4.48Å; I152-I185 HydrophobicContact CD1-CB 4.49Å; I152-I185 HydrophobicContact CD1-CG2 4.3Å; I152-I185 HydrophobicContact CG1-CB 4.37Å; L153-I185 PolarHBondContact N-O 3.48Å; I185-R202 CarbonylContact C-O 3.51Å; I185-R202 WeakPolarHBondContact CA-O 3.5Å; I185-V207 HydrophobicContact CG2-CB 4.43Å; I185-V207 HydrophobicContact CG2-CG1 3.66Å; I185-I212 HydrophobicContact CD1-CD1 3.72Å; I185-I212 HydrophobicContact CD1-CG1 4.15Å; I185-I212 HydrophobicContact CD1-CG2 4.05Å; I185-I212 HydrophobicContact CG2-CD1 4.24Å
186	W	98.3	Very high	96.5	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.9	-178.1	-173.5	4.1	0	0	0	110.4	L153 W161 I169 V172 F176 F188 V195 R202 I203 E204	L153-W186 HydrophobicContact CB-CG 4.49Å; W161-W186 HydrophobicContact CD2-CZ2 4.47Å; W161-W186 AromaticContact CE2-NE1 3.5Å; W161-W186 HydrophobicContact CE3-CZ2 4.17Å; W161-W186 AromaticContact CH2-CZ2 3.8Å; W161-W186 HydrophobicContact CH2-CZ2 3.8Å; W161-W186 AromaticContact CH2-NE1 3.78Å; W161-W186 AromaticContact CZ2-CE2 3.99Å; W161-W186 HydrophobicContact CZ2-CZ2 4.12Å; W161-W186 AromaticContact CZ2-NE1 3.23Å; W161-W186 AromaticContact CZ3-CZ2 3.83Å; W161-W186 HydrophobicContact CZ3-CZ2 3.83Å; W161-W186 AromaticContact NE1-NE1 3.89Å; I169-W186 HydrophobicContact CG2-CH2 4.08Å; V172-W186 HydrophobicContact CB-CH2 4Å; V172-W186 HydrophobicContact CB-CZ2 4.04Å; V172-W186 HydrophobicContact CG1-CD2 4.28Å; V172-W186 HydrophobicContact CG1-CE3 4.38Å; V172-W186 HydrophobicContact CG1-CH2 3.67Å; V172-W186 HydrophobicContact CG1-CZ2 3.54Å; V172-W186 HydrophobicContact CG1-CZ3 4.1Å; F176-W186 HydrophobicContact CD2-CD2 4.25Å; F176-W186 AromaticContact CD2-CE3 3.8Å; F176-W186 HydrophobicContact CD2-CE3 3.8Å; F176-W186 HydrophobicContact CD2-CZ3 4.29Å; F176-W186 HydrophobicContact CE2-CB 4.08Å; F176-W186 AromaticContact CE2-CD2 3.75Å; F176-W186 HydrophobicContact CE2-CD2 3.75Å; F176-W186 AromaticContact CE2-CE3 3.79Å; F176-W186 HydrophobicContact CE2-CE3 3.79Å; F176-W186 AromaticContact CE2-CG 3.9Å; F176-W186 HydrophobicContact CE2-CG 3.9Å; F176-W186 HydrophobicContact CE2-CZ3 4.47Å; W186-F188 HydrophobicContact CD2-CB 4.18Å; W186-F188 HydrophobicContact CD2-CD2 4.46Å; W186-F188 AromaticContact CE2-CD2 3.68Å; W186-F188 HydrophobicContact CG-CB 4.12Å; W186-F188 HydrophobicContact CH2-CD2 4.18Å; W186-F188 HydrophobicContact CH2-CE2 4.26Å; W186-F188 AromaticContact CZ2-CD2 3.52Å; W186-F188 HydrophobicContact CZ2-CD2 3.52Å; W186-F188 AromaticContact CZ2-CE2 3.9Å; W186-F188 HydrophobicContact CZ2-CE2 3.9Å; W186-F188 HydrophobicContact CZ2-CG 4.33Å; W186-F188 AromaticContact NE1-CD2 3.91Å; W186-F188 PolarHBondContact O-N 2.99Å; W186-V195 HydrophobicContact CH2-CG1 3.78Å; W186-V195 HydrophobicContact CZ3-CB 4.2Å; W186-V195 HydrophobicContact CZ3-CG1 3.77Å; W186-R202 PolarHBondContact N-O 2.99Å; W186-I203 HydrophobicContact CB-CG1 4.41Å; W186-I203 HydrophobicContact CE3-CD1 4.02Å; W186-I203 HydrophobicContact CE3-CG1 4.33Å; W186-I203 HydrophobicContact CZ3-CD1 4.44Å; W186-I203 WeakPolarHBondContact O-CA 3.45Å; W186-E204 PolarHBondContact O-N 2.99Å
187	Q	97.8	Very high	96.2	Very high	13 Å²	13	48.4 Å²	48.4	6%	0.061	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	108.7	166.9	-173	-174.5	13.1	0	0	109.9	L153 S154 W161 E204 T205 V207	L153-Q187 WeakPolarHBondContact O-CB 3.5Å; L153-Q187 PolarHBondContact O-N 2.96Å; S154-Q187 VanDerWaalsContact CB-OE1 3.3Å; S154-Q187 PolarHBondContact OG-OE1 2.95Å; W161-Q187 PolarHBondContact NE1-O 3.36Å; Q187-E204 CarbonylContact C-O 3.54Å; Q187-E204 VanDerWaalsContact CA-O 3.25Å; Q187-E204 WeakPolarHBondContact CA-O 3.49Å; Q187-T205 PolarHBondContact NE2-O 2.66Å; Q187-V207 HydrophobicContact CB-CG1 4.25Å; Q187-V207 HydrophobicContact CB-CG2 4.14Å
188	F	97.5	Very high	96.1	Very high	5 Å²	5	47 Å²	47	2%	0.022	26%	0.257	C	S	.	.			trans	-149.1	135.3	-172.3	-180	-98.1	0	0	0	110.9	W161 I169 W186 G190 L192 V195 I203 E204 T205	W161-F188 HydrophobicContact CB-CD2 3.54Å; W161-F188 HydrophobicContact CB-CE2 3.55Å; W161-F188 HydrophobicContact CB-CG 4.37Å; W161-F188 HydrophobicContact CB-CZ 4.4Å; W161-F188 AromaticContact CD1-CD2 3.87Å; W161-F188 AromaticContact CD2-CD2 3.49Å; W161-F188 HydrophobicContact CD2-CD2 3.49Å; W161-F188 VanDerWaalsContact CD2-CD2 3.49Å; W161-F188 AromaticContact CD2-CE2 3.87Å; W161-F188 HydrophobicContact CD2-CE2 3.87Å; W161-F188 AromaticContact CE3-CD2 3.9Å; W161-F188 HydrophobicContact CE3-CD2 3.9Å; W161-F188 AromaticContact CE3-CE2 3.86Å; W161-F188 HydrophobicContact CE3-CE2 3.86Å; W161-F188 AromaticContact CG-CD2 3.34Å; W161-F188 HydrophobicContact CG-CD2 3.34Å; W161-F188 AromaticContact CG-CE2 3.78Å; W161-F188 HydrophobicContact CG-CE2 3.78Å; W161-F188 HydrophobicContact CG-CG 4.24Å; I169-F188 HydrophobicContact CD1-CE2 4.24Å; I169-F188 HydrophobicContact CD1-CZ 4.41Å; I169-F188 HydrophobicContact CG1-CE2 4.33Å; I169-F188 HydrophobicContact CG2-CE2 3.99Å; I169-F188 HydrophobicContact CG2-CZ 4.14Å; W186-F188 HydrophobicContact CD2-CB 4.18Å; W186-F188 HydrophobicContact CD2-CD2 4.46Å; W186-F188 AromaticContact CE2-CD2 3.68Å; W186-F188 HydrophobicContact CG-CB 4.12Å; W186-F188 HydrophobicContact CH2-CD2 4.18Å; W186-F188 HydrophobicContact CH2-CE2 4.26Å; W186-F188 AromaticContact CZ2-CD2 3.52Å; W186-F188 HydrophobicContact CZ2-CD2 3.52Å; W186-F188 AromaticContact CZ2-CE2 3.9Å; W186-F188 HydrophobicContact CZ2-CE2 3.9Å; W186-F188 HydrophobicContact CZ2-CG 4.33Å; W186-F188 AromaticContact NE1-CD2 3.91Å; W186-F188 PolarHBondContact O-N 2.99Å; F188-G190 VanDerWaalsContact CE1-CA 3.45Å; F188-G190 VanDerWaalsContact CE1-O 3.3Å; F188-G190 WeakPolarHBondContact CE1-O 3.03Å; F188-G190 VanDerWaalsContact CZ-C 3.47Å; F188-L192 HydrophobicContact CD1-CD2 3.95Å; F188-L192 HydrophobicContact CE1-CD2 3.98Å; F188-V195 HydrophobicContact CE1-CG1 4.14Å; F188-V195 HydrophobicContact CE2-CG1 4.35Å; F188-V195 HydrophobicContact CZ-CG1 3.86Å; F188-I203 HydrophobicContact CB-CG2 3.62Å; F188-I203 HydrophobicContact CD1-CG2 3.82Å; F188-I203 HydrophobicContact CG-CG2 4.11Å; F188-E204 PolarHBondContact N-O 2.86Å; F188-E204 CarbonylContact O-C 3.59Å; F188-T205 WeakPolarHBondContact O-CA 3.39Å
189	N	95.1	Very high	96	Very high	53 Å²	53	48.4 Å²	48.4	28%	0.283	27%	0.273	S	S	.	.			trans	-126.9	13.3	179.1	70.8	-37.2	0	0	0	112.4	D160 W161 K162 T205	D160-N189 PolarHBondContact OD1-ND2 2.85Å; D160-N189 PolarHBondContact OD1-OD1 3.35Å; W161-N189 WeakPolarHBondContact CB-OD1 3.05Å; W161-N189 PolarHBondContact N-OD1 3.26Å; K162-N189 WeakPolarHBondContact CE-O 3.32Å; K162-N189 VanDerWaalsContact CG-O 3.3Å; K162-N189 WeakPolarHBondContact CG-O 3.33Å; N189-T205 HydrophobicContact CB-CG2 4.36Å
190	G	95.3	Very high	96	Very high	14 Å²	14	48.9 Å²	48.9	14%	0.144	28%	0.275	C	S	.	.	S	Bend	trans	-84.6	-165.4	179.9	0	0	0	0	0	112.9	F188 L192	F188-G190 VanDerWaalsContact CE1-CA 3.45Å; F188-G190 VanDerWaalsContact CE1-O 3.3Å; F188-G190 WeakPolarHBondContact CE1-O 3.03Å; F188-G190 VanDerWaalsContact CZ-C 3.47Å; G190-L192 PolarHBondContact O-N 2.87Å
191	D	94.8	Very high	96	Very high	89 Å²	89	43 Å²	43	48%	0.476	25%	0.249	S	C	.	.			trans	-72.3	120.7	177.6	-177.5	7.4	0	0	0	111.2	S193 V194	D191-S193 VanDerWaalsContact C-N 3.26Å; D191-S193 PolarHBondContact O-N 3.35Å; D191-S193 VanDerWaalsContact OD1-CB 3.3Å; D191-S193 WeakPolarHBondContact OD1-CB 3.13Å; D191-S193 PolarHBondContact OD1-N 3.16Å; D191-S193 PolarHBondContact OD1-OG 2.99Å; D191-S193 VanDerWaalsContact OD1-OG 3.11Å; D191-S193 PolarHBondContact OD2-OG 3.41Å; D191-V194 HydrophobicContact CB-CG2 4.22Å; D191-V194 WeakPolarHBondContact O-CG2 3.23Å
192	L	95.7	Very high	96	Very high	109 Å²	109	44 Å²	44	57%	0.571	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-75.2	-14.4	178.1	-68.6	174.7	0	0	0	112.9	F188 G190 V194 V195 I203	F188-L192 HydrophobicContact CD1-CD2 3.95Å; F188-L192 HydrophobicContact CE1-CD2 3.98Å; G190-L192 PolarHBondContact O-N 2.87Å; L192-V194 PolarHBondContact O-N 3.47Å; L192-V195 HydrophobicContact CB-CG2 4.42Å; L192-V195 HydrophobicContact CD2-CG2 3.9Å; L192-V195 WeakPolarHBondContact O-CG2 3.5Å; L192-V195 PolarHBondContact O-N 3.21Å; L192-I203 HydrophobicContact CD2-CB 4.43Å; L192-I203 HydrophobicContact CD2-CD1 4.33Å; L192-I203 HydrophobicContact CD2-CG2 3.83Å
193	S	93.9	Very high	96	Very high	97 Å²	97	45.7 Å²	45.7	68%	0.678	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-69.9	-21.7	179.1	84.2	0	0	0	0	113.1	D191	D191-S193 VanDerWaalsContact C-N 3.26Å; D191-S193 PolarHBondContact O-N 3.35Å; D191-S193 VanDerWaalsContact OD1-CB 3.3Å; D191-S193 WeakPolarHBondContact OD1-CB 3.13Å; D191-S193 PolarHBondContact OD1-N 3.16Å; D191-S193 PolarHBondContact OD1-OG 2.99Å; D191-S193 VanDerWaalsContact OD1-OG 3.11Å; D191-S193 PolarHBondContact OD2-OG 3.41Å
194	V	93.6	Very high	95.8	Very high	41 Å²	41	46.5 Å²	46.5	25%	0.248	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-99.7	3.1	-179.2	-60.4	0	0	0	0	113.6	I169 D191 L192	I169-V194 HydrophobicContact CD1-CG2 4.41Å; I169-V194 HydrophobicContact CG2-CG2 3.86Å; D191-V194 HydrophobicContact CB-CG2 4.22Å; D191-V194 WeakPolarHBondContact O-CG2 3.23Å; L192-V194 PolarHBondContact O-N 3.47Å
195	V	95.8	Very high	95.6	Very high	18 Å²	18	51.3 Å²	51.3	11%	0.109	29%	0.294	C	S	.	.	S	Bend	trans	-113.9	150.9	176.1	-55.2	0	0	0	0	110.7	I169 W186 F188 L192 I203	I169-V195 HydrophobicContact CG2-CG1 3.52Å; W186-V195 HydrophobicContact CH2-CG1 3.78Å; W186-V195 HydrophobicContact CZ3-CB 4.2Å; W186-V195 HydrophobicContact CZ3-CG1 3.77Å; F188-V195 HydrophobicContact CE1-CG1 4.14Å; F188-V195 HydrophobicContact CE2-CG1 4.35Å; F188-V195 HydrophobicContact CZ-CG1 3.86Å; L192-V195 HydrophobicContact CB-CG2 4.42Å; L192-V195 HydrophobicContact CD2-CG2 3.9Å; L192-V195 WeakPolarHBondContact O-CG2 3.5Å; L192-V195 PolarHBondContact O-N 3.21Å; V195-I203 HydrophobicContact CB-CD1 4.22Å; V195-I203 HydrophobicContact CG2-CD1 3.57Å
196	S	90	Very high	95.2	Very high	27 Å²	27	56.4 Å²	56.4	19%	0.189	31%	0.313	C	S	.	.			trans	-79.1	132.9	-175.6	-51.9	0	0	0	0	110.7	S173 E177 T198	S173-S196 WeakPolarHBondContact OG-CB 3.49Å; S173-S196 PolarHBondContact OG-N 2.84Å; S173-S196 PolarHBondContact OG-OG 3.34Å; E177-S196 VanDerWaalsContact CG-CB 3.48Å; E177-S196 WeakPolarHBondContact CG-OG 3.08Å; E177-S196 WeakPolarHBondContact OE1-CB 3.26Å; E177-S196 PolarHBondContact OE1-OG 3.16Å; S196-T198 PolarHBondContact O-N 3.44Å
197	N	90.5	Very high	95	Very high	168 Å²	168	56.5 Å²	56.5	90%	0.898	31%	0.314	S	S	*	.			trans	-93.5	85.8	178.8	-172.5	18.2	0	0	0	111
198	T	95.3	Very high	94.8	Very high	33 Å²	33	58.2 Å²	58.2	20%	0.202	33%	0.326	C	S	.	.			trans	-115.3	140.6	178.3	56.8	0	0	0	0	111.3	E177 S196 H200 V201	E177-T198 HydrophobicContact CG-CG2 4.29Å; S196-T198 PolarHBondContact O-N 3.44Å; T198-H200 VanDerWaalsContact CB-CE1 3.49Å; T198-H200 WeakPolarHBondContact CB-CE1 2.96Å; T198-H200 PolarHBondContact O-N 3.41Å; T198-H200 VanDerWaalsContact O-N 3.15Å; T198-H200 PolarHBondContact OG1-CE1 3.38Å; T198-H200 PolarHBondContact OG1-ND1 3.37Å; T198-V201 PolarHBondContact O-N 3.43Å; T198-V201 WeakPolarHBondContact OG1-CG2 3.17Å
199	S	95.2	Very high	94.7	Very high	108 Å²	108	58.9 Å²	58.9	76%	0.755	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.5	-173.2	63.3	0	0	0	0	115.3	R183	R183-S199 PolarHBondContact NH1-O 2.89Å
200	H	97.6	Very high	94.6	Very high	10 Å²	10	57.5 Å²	57.5	5%	0.046	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-1.4	174.7	72	-68.7	0	0	0	114.1	F141 F176 Y182 I184 T198	F141-H200 WeakPolarHBondContact CZ-O 3.35Å; F176-H200 PolarHBondContact O-NE2 2.81Å; Y182-H200 PolarHBondContact O-CD2 3.02Å; I184-H200 PolarHBondContact N-O 2.96Å; T198-H200 VanDerWaalsContact CB-CE1 3.49Å; T198-H200 WeakPolarHBondContact CB-CE1 2.96Å; T198-H200 PolarHBondContact O-N 3.41Å; T198-H200 VanDerWaalsContact O-N 3.15Å; T198-H200 PolarHBondContact OG1-CE1 3.38Å; T198-H200 PolarHBondContact OG1-ND1 3.37Å
201	V	98.2	Very high	94.6	Very high	18 Å²	18	57.2 Å²	57.2	11%	0.109	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	115	175.6	-175.3	0	0	0	0	108.9	F176 I184 T198 I203	F176-V201 HydrophobicContact CB-CG2 3.99Å; F176-V201 HydrophobicContact CD2-CG1 4.37Å; I184-V201 HydrophobicContact CB-CG1 4.42Å; I184-V201 HydrophobicContact CB-CG2 4.13Å; I184-V201 HydrophobicContact CD1-CG2 4.24Å; I184-V201 HydrophobicContact CG2-CG1 4.29Å; I184-V201 CarbonylContact O-C 3.51Å; I184-V201 WeakPolarHBondContact O-CA 3.47Å; T198-V201 PolarHBondContact O-N 3.43Å; T198-V201 WeakPolarHBondContact OG1-CG2 3.17Å; V201-I203 HydrophobicContact CG1-CD1 4.34Å; V201-I203 HydrophobicContact CG1-CG1 3.89Å
202	R	97.4	Very high	94.7	Very high	74 Å²	74	53 Å²	53	28%	0.279	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.3	172.2	-175.6	178.9	-170.5	93.6	6.2	109	F141 I184 I185 W186 E204	F141-R202 HydrophobicContact CD1-CB 4.33Å; F141-R202 HydrophobicContact CD2-CB 4.36Å; F141-R202 HydrophobicContact CE1-CB 3.81Å; F141-R202 HydrophobicContact CE2-CB 3.85Å; F141-R202 HydrophobicContact CZ-CB 3.54Å; I184-R202 PolarHBondContact O-N 3.21Å; I185-R202 CarbonylContact C-O 3.51Å; I185-R202 WeakPolarHBondContact CA-O 3.5Å; W186-R202 PolarHBondContact N-O 2.99Å; R202-E204 HydrophobicContact CG-CG 4.06Å; R202-E204 IonicContact CZ-OE1 3.11Å; R202-E204 IonicContact NE-OE1 3.38Å; R202-E204 PolarHBondContact NE-OE1 3.32Å; R202-E204 IonicContact NH2-OE1 2.66Å; R202-E204 PolarHBondContact NH2-OE1 3.38Å
203	I	97.6	Very high	94.8	Very high	43 Å²	43	48 Å²	48	22%	0.221	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.9	-179.8	-55.3	-175.3	0	0	0	109.2	W186 F188 L192 V195 V201	W186-I203 HydrophobicContact CB-CG1 4.41Å; W186-I203 HydrophobicContact CE3-CD1 4.02Å; W186-I203 HydrophobicContact CE3-CG1 4.33Å; W186-I203 HydrophobicContact CZ3-CD1 4.44Å; W186-I203 WeakPolarHBondContact O-CA 3.45Å; F188-I203 HydrophobicContact CB-CG2 3.62Å; F188-I203 HydrophobicContact CD1-CG2 3.82Å; F188-I203 HydrophobicContact CG-CG2 4.11Å; L192-I203 HydrophobicContact CD2-CB 4.43Å; L192-I203 HydrophobicContact CD2-CD1 4.33Å; L192-I203 HydrophobicContact CD2-CG2 3.83Å; V195-I203 HydrophobicContact CB-CD1 4.22Å; V195-I203 HydrophobicContact CG2-CD1 3.57Å; V201-I203 HydrophobicContact CG1-CD1 4.34Å; V201-I203 HydrophobicContact CG1-CG1 3.89Å
204	E	95.3	Very high	94.8	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	144.6	-175.5	-66.6	-75.2	-171.8	0	0	110.6	W186 Q187 F188 R202 W206 V207	W186-E204 PolarHBondContact O-N 2.99Å; Q187-E204 CarbonylContact C-O 3.54Å; Q187-E204 VanDerWaalsContact CA-O 3.25Å; Q187-E204 WeakPolarHBondContact CA-O 3.49Å; F188-E204 PolarHBondContact N-O 2.86Å; F188-E204 CarbonylContact O-C 3.59Å; R202-E204 HydrophobicContact CG-CG 4.06Å; R202-E204 IonicContact CZ-OE1 3.11Å; R202-E204 IonicContact NE-OE1 3.38Å; R202-E204 PolarHBondContact NE-OE1 3.32Å; R202-E204 IonicContact NH2-OE1 2.66Å; R202-E204 PolarHBondContact NH2-OE1 3.38Å; E204-W206 VanDerWaalsContact C-N 3.26Å; E204-W206 PolarHBondContact O-N 2.87Å; E204-V207 HydrophobicContact CB-CG1 3.93Å
205	T	93.3	Very high	94.9	Very high	101 Å²	101	45.7 Å²	45.7	62%	0.62	25%	0.249	S	C	*	.	S	Bend	trans	-69.3	-28.8	175.1	56	0	0	0	0	112.1	Q187 F188 N189	Q187-T205 PolarHBondContact NE2-O 2.66Å; F188-T205 WeakPolarHBondContact O-CA 3.39Å; N189-T205 HydrophobicContact CB-CG2 4.36Å
206	W	91.8	Very high	94.9	Very high	107 Å²	107	50.6 Å²	50.6	41%	0.405	28%	0.281	S	S	.	.	S	Bend	trans	-145	141.3	177.2	-169.6	-97.6	0	0	0	111.5	H157 E204	H157-W206 AromaticContact CD2-CH2 3.97Å; H157-W206 AromaticContact CD2-CZ3 3.54Å; H157-W206 AromaticContact CE1-CH2 2.94Å; H157-W206 WeakPolarHBondContact CE1-CH2 3.18Å; H157-W206 AromaticContact CE1-CZ2 3.68Å; H157-W206 AromaticContact CE1-CZ3 3.37Å; H157-W206 WeakPolarHBondContact CE1-CZ3 3.45Å; H157-W206 AromaticContact CG-CZ3 3.77Å; H157-W206 AromaticContact ND1-CH2 3.45Å; H157-W206 WeakPolarHBondContact ND1-CH2 3.3Å; H157-W206 AromaticContact ND1-CZ3 3.67Å; H157-W206 AromaticContact NE2-CH2 3.32Å; H157-W206 VanDerWaalsContact NE2-CH2 3.32Å; H157-W206 WeakPolarHBondContact NE2-CH2 3.41Å; H157-W206 AromaticContact NE2-CZ2 3.97Å; H157-W206 AromaticContact NE2-CZ3 3.3Å; H157-W206 VanDerWaalsContact NE2-CZ3 3.3Å; H157-W206 WeakPolarHBondContact NE2-CZ3 3.49Å; E204-W206 VanDerWaalsContact C-N 3.26Å; E204-W206 PolarHBondContact O-N 2.87Å
207	V	94	Very high	95.2	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	29%	0.286	C	S	.	.			trans	-126.2	145.2	-174.6	-62.8	0	0	0	0	111.1	I152 I185 Q187 E204 L209 I212	I152-V207 HydrophobicContact CD1-CB 4.42Å; I152-V207 HydrophobicContact CD1-CG2 3.95Å; I185-V207 HydrophobicContact CG2-CB 4.43Å; I185-V207 HydrophobicContact CG2-CG1 3.66Å; Q187-V207 HydrophobicContact CB-CG1 4.25Å; Q187-V207 HydrophobicContact CB-CG2 4.14Å; E204-V207 HydrophobicContact CB-CG1 3.93Å; V207-L209 HydrophobicContact CG2-CB 4.35Å; V207-L209 PolarHBondContact O-N 3.13Å; V207-I212 HydrophobicContact CB-CD1 4.1Å
208	P	93.4	Very high	95.5	Very high	50 Å²	50	44.6 Å²	44.6	33%	0.325	24%	0.244	S	C	.	.			trans	-75.1	66.1	172.6	32.7	-35.5	0	0	0	110.5	L134 Y138 A210 A211 I212	L134-P208 HydrophobicContact CD2-CG 4.22Å; Y138-P208 HydrophobicContact CD1-CG 4.41Å; Y138-P208 HydrophobicContact CD2-CG 4.02Å; Y138-P208 HydrophobicContact CE1-CG 4.21Å; Y138-P208 HydrophobicContact CE2-CG 3.81Å; Y138-P208 HydrophobicContact CG-CG 4.33Å; Y138-P208 WeakPolarHBondContact OH-CD 3.35Å; P208-A210 PolarHBondContact O-N 3.33Å; P208-A211 HydrophobicContact CB-CB 4.28Å; P208-A211 WeakPolarHBondContact O-CB 3.31Å; P208-A211 PolarHBondContact O-N 2.77Å; P208-I212 HydrophobicContact CG-CD1 3.96Å; P208-I212 HydrophobicContact CG-CG1 4.19Å; P208-I212 PolarHBondContact O-N 2.94Å; P208-I212 VanDerWaalsContact O-N 3.07Å
209	L	94.4	Very high	95.7	Very high	18 Å²	18	44.8 Å²	44.8	9%	0.094	25%	0.245	C	C	.	.	H	α-helix	trans	-48.9	-51.5	-166.8	179.5	61.7	0	0	0	113.5	I152 V207 A211 I212 L213 F221 E232	I152-L209 HydrophobicContact CD1-CD1 3.57Å; I152-L209 HydrophobicContact CG1-CD1 4.17Å; V207-L209 HydrophobicContact CG2-CB 4.35Å; V207-L209 PolarHBondContact O-N 3.13Å; L209-A211 VanDerWaalsContact C-N 3.35Å; L209-A211 PolarHBondContact O-N 3.15Å; L209-I212 PolarHBondContact O-N 3.5Å; L209-L213 HydrophobicContact CD1-CD1 3.82Å; L209-L213 HydrophobicContact CD1-CD2 4.4Å; L209-L213 HydrophobicContact CD1-CG 3.86Å; L209-L213 HydrophobicContact CG-CD1 3.85Å; L209-L213 HydrophobicContact CG-CG 4.26Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 WeakPolarHBondContact O-CG 3.27Å; L209-L213 PolarHBondContact O-N 3.25Å; L209-F221 HydrophobicContact CD1-CD2 4.44Å; L209-F221 HydrophobicContact CD1-CE1 4.46Å; L209-F221 HydrophobicContact CD1-CE2 3.78Å; L209-F221 HydrophobicContact CD1-CZ 3.79Å; L209-F221 HydrophobicContact CD2-CE1 4.45Å; L209-F221 HydrophobicContact CD2-CZ 3.82Å; L209-F221 HydrophobicContact CG-CZ 4.37Å; L209-E232 WeakPolarHBondContact CD2-OE2 3.39Å
210	A	93.3	Very high	95.9	Very high	24 Å²	24	39.7 Å²	39.7	20%	0.198	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-40.7	-178.6	0	0	0	0	0	113	P129 P208 I212 L213 Q214 F236	P129-A210 HydrophobicContact CB-CB 3.73Å; P129-A210 HydrophobicContact CG-CB 4Å; P208-A210 PolarHBondContact O-N 3.33Å; A210-I212 VanDerWaalsContact C-N 3.34Å; A210-L213 PolarHBondContact O-N 3.05Å; A210-Q214 VanDerWaalsContact O-CB 3.27Å; A210-Q214 WeakPolarHBondContact O-CB 3.36Å; A210-Q214 PolarHBondContact O-N 3.13Å; A210-F236 HydrophobicContact CB-CE2 3.95Å; A210-F236 HydrophobicContact CB-CZ 4.15Å
211	A	95	Very high	95.9	Very high	9 Å²	9	39.2 Å²	39.2	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-37.6	178	0	0	0	0	0	111.5	A132 L134 P208 L209 H215	A132-A211 HydrophobicContact CB-CB 4.17Å; A132-A211 WeakPolarHBondContact O-CB 3.48Å; L134-A211 HydrophobicContact CD2-CB 3.55Å; L134-A211 HydrophobicContact CG-CB 4.2Å; P208-A211 HydrophobicContact CB-CB 4.28Å; P208-A211 WeakPolarHBondContact O-CB 3.31Å; P208-A211 PolarHBondContact O-N 2.77Å; L209-A211 VanDerWaalsContact C-N 3.35Å; L209-A211 PolarHBondContact O-N 3.15Å; A211-H215 PolarHBondContact O-N 2.99Å
212	I	97.1	Very high	95.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-49.7	175.9	-64.4	165.2	0	0	0	110.1	L134 Y138 T150 I152 I185 V207 P208 L209 A210 Q214 H215 T218	L134-I212 HydrophobicContact CD2-CG1 3.77Å; Y138-I212 HydrophobicContact CD1-CD1 4.09Å; Y138-I212 HydrophobicContact CD1-CG1 4.44Å; Y138-I212 HydrophobicContact CE1-CD1 3.89Å; T150-I212 HydrophobicContact CG2-CG2 4.38Å; I152-I212 HydrophobicContact CB-CG2 4.19Å; I152-I212 HydrophobicContact CD1-CB 4.04Å; I152-I212 HydrophobicContact CD1-CD1 3.65Å; I152-I212 HydrophobicContact CD1-CG1 4.46Å; I152-I212 HydrophobicContact CD1-CG2 3.76Å; I152-I212 HydrophobicContact CG2-CG2 4.29Å; I185-I212 HydrophobicContact CD1-CD1 3.72Å; I185-I212 HydrophobicContact CD1-CG1 4.15Å; I185-I212 HydrophobicContact CD1-CG2 4.05Å; I185-I212 HydrophobicContact CG2-CD1 4.24Å; V207-I212 HydrophobicContact CB-CD1 4.1Å; P208-I212 HydrophobicContact CG-CD1 3.96Å; P208-I212 HydrophobicContact CG-CG1 4.19Å; P208-I212 PolarHBondContact O-N 2.94Å; P208-I212 VanDerWaalsContact O-N 3.07Å; L209-I212 PolarHBondContact O-N 3.5Å; A210-I212 VanDerWaalsContact C-N 3.34Å; I212-Q214 VanDerWaalsContact C-N 3.26Å; I212-Q214 PolarHBondContact O-N 3.25Å; I212-H215 VanDerWaalsContact O-CB 3.3Å; I212-H215 WeakPolarHBondContact O-CB 3.34Å; I212-H215 PolarHBondContact O-N 3.09Å; I212-T218 HydrophobicContact CG2-CG2 4.44Å; I212-T218 WeakPolarHBondContact O-CB 3.37Å; I212-T218 PolarHBondContact O-OG1 3.26Å
213	L	97.1	Very high	96	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-35.3	-179.2	-71.4	178.6	0	0	0	112.8	I152 L209 A210 H215 T218 F221 E232 F236 T238	I152-L213 HydrophobicContact CG2-CD2 3.72Å; L209-L213 HydrophobicContact CD1-CD1 3.82Å; L209-L213 HydrophobicContact CD1-CD2 4.4Å; L209-L213 HydrophobicContact CD1-CG 3.86Å; L209-L213 HydrophobicContact CG-CD1 3.85Å; L209-L213 HydrophobicContact CG-CG 4.26Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 WeakPolarHBondContact O-CG 3.27Å; L209-L213 PolarHBondContact O-N 3.25Å; A210-L213 PolarHBondContact O-N 3.05Å; L213-H215 PolarHBondContact O-N 2.96Å; L213-T218 HydrophobicContact CD2-CG2 4.27Å; L213-F221 HydrophobicContact CD1-CD1 3.9Å; L213-F221 HydrophobicContact CD1-CE1 3.9Å; L213-F221 HydrophobicContact CD2-CB 3.71Å; L213-F221 HydrophobicContact CD2-CD1 3.85Å; L213-F221 HydrophobicContact CD2-CD2 4.3Å; L213-F221 HydrophobicContact CD2-CG 3.71Å; L213-E232 HydrophobicContact CD1-CB 3.93Å; L213-F236 HydrophobicContact CB-CB 3.99Å; L213-F236 HydrophobicContact CB-CD2 3.45Å; L213-F236 VanDerWaalsContact CB-CD2 3.45Å; L213-F236 HydrophobicContact CB-CE2 4.23Å; L213-F236 HydrophobicContact CB-CG 3.93Å; L213-F236 HydrophobicContact CD1-CD2 4.17Å; L213-F236 HydrophobicContact CG-CD2 4.48Å; L213-F236 WeakPolarHBondContact O-CB 3.39Å; L213-T238 HydrophobicContact CD2-CG2 3.99Å; L213-T238 PolarHBondContact O-OG1 3.43Å
214	Q	94.6	Very high	96	Very high	65 Å²	65	33.7 Å²	33.7	30%	0.304	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-29.6	175.5	174.7	168.3	73.7	0	0	113.4	A210 I212 F236	A210-Q214 VanDerWaalsContact O-CB 3.27Å; A210-Q214 WeakPolarHBondContact O-CB 3.36Å; A210-Q214 PolarHBondContact O-N 3.13Å; I212-Q214 VanDerWaalsContact C-N 3.26Å; I212-Q214 PolarHBondContact O-N 3.25Å; Q214-F236 HydrophobicContact CB-CD1 3.68Å; Q214-F236 HydrophobicContact CB-CE1 3.68Å; Q214-F236 HydrophobicContact CB-CG 4.32Å; Q214-F236 HydrophobicContact CB-CZ 4.32Å; Q214-F236 HydrophobicContact CG-CD1 4.25Å; Q214-F236 HydrophobicContact CG-CE1 4.21Å
215	H	96.3	Very high	96	Very high	26 Å²	26	31 Å²	31	12%	0.12	17%	0.17	C	C	.	.	S	Bend	trans	-63.3	131.9	-172.3	-166.4	-84.3	0	0	0	111	L134 V142 E143 A211 I212 L213 K217 T218	L134-H215 HydrophobicContact CD1-CB 4.38Å; V142-H215 HydrophobicContact CG1-CB 4.18Å; V142-H215 WeakPolarHBondContact CG1-ND1 3.17Å; E143-H215 IonicContact OE1-CE1 2.62Å; E143-H215 IonicContact OE1-NE2 3.93Å; E143-H215 PolarHBondContact OE1-NE2 3.34Å; A211-H215 PolarHBondContact O-N 2.99Å; I212-H215 VanDerWaalsContact O-CB 3.3Å; I212-H215 WeakPolarHBondContact O-CB 3.34Å; I212-H215 PolarHBondContact O-N 3.09Å; L213-H215 PolarHBondContact O-N 2.96Å; H215-K217 PolarHBondContact ND1-N 3.13Å; H215-K217 VanDerWaalsContact ND1-N 3.16Å; H215-K217 PolarHBondContact O-N 3.33Å; H215-K217 VanDerWaalsContact O-N 3.13Å; H215-T218 WeakPolarHBondContact O-CB 3.33Å; H215-T218 PolarHBondContact O-N 3.45Å
216	P	94.7	Very high	95.9	Very high	120 Å²	120	26.5 Å²	26.5	78%	0.779	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.2	-175.5	-26.8	34.8	0	0	0	114.8	T218	P216-T218 VanDerWaalsContact C-N 3.26Å; P216-T218 PolarHBondContact O-N 3.03Å
217	K	96.7	Very high	95.8	Very high	67 Å²	67	25.2 Å²	25.2	29%	0.291	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.7	174.5	-73.5	-168.8	170.9	-170.3	0	114	V142 E143 D144 G149 T150 H215 V219	V142-K217 HydrophobicContact CG1-CB 4.26Å; V142-K217 VanDerWaalsContact O-CD 3.29Å; V142-K217 WeakPolarHBondContact O-CD 3.31Å; E143-K217 VanDerWaalsContact C-NZ 3.33Å; E143-K217 PolarHBondContact O-NZ 3.41Å; D144-K217 PolarHBondContact O-NZ 2.82Å; G149-K217 CarbonylContact C-O 3.6Å; G149-K217 VanDerWaalsContact CA-O 3.22Å; G149-K217 WeakPolarHBondContact CA-O 3.35Å; T150-K217 PolarHBondContact N-O 3.03Å; H215-K217 PolarHBondContact ND1-N 3.13Å; H215-K217 VanDerWaalsContact ND1-N 3.16Å; H215-K217 PolarHBondContact O-N 3.33Å; H215-K217 VanDerWaalsContact O-N 3.13Å; K217-V219 PolarHBondContact O-N 3.36Å
218	T	98.1	Very high	95.6	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.018	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	114.9	177.2	-59.9	0	0	0	0	110.2	T150 I152 I212 L213 H215 P216 T238	T150-T218 CarbonylContact O-C 3.47Å; T150-T218 WeakPolarHBondContact O-CA 3.34Å; I152-T218 HydrophobicContact CG2-CG2 4.26Å; I212-T218 HydrophobicContact CG2-CG2 4.44Å; I212-T218 WeakPolarHBondContact O-CB 3.37Å; I212-T218 PolarHBondContact O-OG1 3.26Å; L213-T218 HydrophobicContact CD2-CG2 4.27Å; H215-T218 WeakPolarHBondContact O-CB 3.33Å; H215-T218 PolarHBondContact O-N 3.45Å; P216-T218 VanDerWaalsContact C-N 3.26Å; P216-T218 PolarHBondContact O-N 3.03Å; T218-T238 HydrophobicContact CG2-CG2 4.12Å
219	V	98.2	Very high	95.7	Very high	37 Å²	37	25.3 Å²	25.3	22%	0.224	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-22.6	-169.9	-65.5	0	0	0	0	113.2	T150 I151 Y182 K217	T150-V219 WeakPolarHBondContact O-CG2 3.39Å; T150-V219 PolarHBondContact O-N 3.46Å; I151-V219 HydrophobicContact CG1-CG2 4.2Å; Y182-V219 HydrophobicContact CD1-CG2 4.14Å; Y182-V219 HydrophobicContact CE1-CG2 3.97Å; K217-V219 PolarHBondContact O-N 3.36Å
220	L	98.9	Very high	95.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	139.1	-174.1	-173.6	67.7	0	0	0	112	I151 I152 I222 P239 V241 I279 V282 A283	I151-L220 WeakPolarHBondContact CA-O 3.48Å; I151-L220 HydrophobicContact CD1-CD2 4.27Å; I151-L220 HydrophobicContact CG1-CB 4.09Å; I151-L220 HydrophobicContact CG1-CD2 4.43Å; I151-L220 HydrophobicContact CG2-CB 4.19Å; I151-L220 HydrophobicContact CG2-CD2 4.05Å; I151-L220 HydrophobicContact CG2-CG 4.34Å; I152-L220 PolarHBondContact N-O 2.84Å; L220-I222 HydrophobicContact CD2-CG1 4.38Å; L220-P239 HydrophobicContact CD1-CB 4.31Å; L220-V241 HydrophobicContact CD1-CG2 3.99Å; L220-V241 HydrophobicContact CD2-CG2 4Å; L220-V241 HydrophobicContact CG-CG2 4.32Å; L220-I279 HydrophobicContact CD2-CB 4.04Å; L220-I279 HydrophobicContact CD2-CG1 3.88Å; L220-I279 HydrophobicContact CD2-CG2 3.76Å; L220-V282 HydrophobicContact CD1-CB 3.8Å; L220-V282 HydrophobicContact CD1-CG1 3.38Å; L220-A283 HydrophobicContact CD2-CB 4.37Å
221	F	98.8	Very high	95.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	106.8	173.5	-178.4	-160.3	0	0	0	111	I152 L209 L213 T223 A233 T238 P239 V240 V241	I152-F221 HydrophobicContact CG2-CB 4.3Å; I152-F221 HydrophobicContact CG2-CD2 3.83Å; I152-F221 HydrophobicContact CG2-CG 4.32Å; I152-F221 CarbonylContact O-C 3.52Å; I152-F221 WeakPolarHBondContact O-CA 3.48Å; L209-F221 HydrophobicContact CD1-CD2 4.44Å; L209-F221 HydrophobicContact CD1-CE1 4.46Å; L209-F221 HydrophobicContact CD1-CE2 3.78Å; L209-F221 HydrophobicContact CD1-CZ 3.79Å; L209-F221 HydrophobicContact CD2-CE1 4.45Å; L209-F221 HydrophobicContact CD2-CZ 3.82Å; L209-F221 HydrophobicContact CG-CZ 4.37Å; L213-F221 HydrophobicContact CD1-CD1 3.9Å; L213-F221 HydrophobicContact CD1-CE1 3.9Å; L213-F221 HydrophobicContact CD2-CB 3.71Å; L213-F221 HydrophobicContact CD2-CD1 3.85Å; L213-F221 HydrophobicContact CD2-CD2 4.3Å; L213-F221 HydrophobicContact CD2-CG 3.71Å; F221-T223 HydrophobicContact CD1-CG2 3.92Å; F221-T223 HydrophobicContact CD2-CG2 4.41Å; F221-T223 HydrophobicContact CE1-CG2 3.89Å; F221-T223 VanDerWaalsContact CE2-CB 3.44Å; F221-T223 HydrophobicContact CE2-CG2 4.38Å; F221-T223 HydrophobicContact CG-CG2 4.2Å; F221-T223 HydrophobicContact CZ-CG2 4.14Å; F221-T223 VanDerWaalsContact CZ-OG1 3.28Å; F221-T223 WeakPolarHBondContact CZ-OG1 3.46Å; F221-T223 PolarHBondContact O-N 2.86Å; F221-A233 HydrophobicContact CD1-CB 4.01Å; F221-T238 HydrophobicContact CB-CG2 3.92Å; F221-P239 PolarHBondContact N-O 3.38Å; F221-V240 HydrophobicContact CB-CG1 4.33Å; F221-V240 HydrophobicContact CD1-CG1 4.44Å; F221-V240 CarbonylContact O-C 3.43Å; F221-V240 WeakPolarHBondContact O-CA 3.24Å; F221-V240 WeakPolarHBondContact O-CB 3.01Å; F221-V241 PolarHBondContact O-N 3.46Å
222	I	98.9	Very high	95.8	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114.3	170.8	-50.5	170.2	0	0	0	107.5	I151 I152 L153 S154 F155 F176 L220 V241 V243 L275 I279	I151-I222 HydrophobicContact CG2-CD1 3.75Å; I151-I222 HydrophobicContact CG2-CG1 4.04Å; I152-I222 PolarHBondContact O-N 3.42Å; L153-I222 WeakPolarHBondContact CA-O 3.28Å; L153-I222 HydrophobicContact CB-CB 4.05Å; L153-I222 HydrophobicContact CB-CD1 4.43Å; L153-I222 HydrophobicContact CD1-CB 4.37Å; L153-I222 HydrophobicContact CD1-CD1 4.47Å; L153-I222 HydrophobicContact CD1-CG2 3.95Å; L153-I222 HydrophobicContact CG-CB 3.9Å; L153-I222 HydrophobicContact CG-CG2 3.82Å; S154-I222 PolarHBondContact N-O 2.81Å; F155-I222 HydrophobicContact CE1-CG2 4.3Å; F176-I222 HydrophobicContact CE1-CD1 3.77Å; F176-I222 HydrophobicContact CZ-CD1 3.96Å; L220-I222 HydrophobicContact CD2-CG1 4.38Å; I222-V241 WeakPolarHBondContact CA-O 3.32Å; I222-V241 HydrophobicContact CB-CB 4.46Å; I222-V241 HydrophobicContact CG1-CB 4.14Å; I222-V241 HydrophobicContact CG1-CG2 4.46Å; I222-V241 HydrophobicContact CG2-CB 4.27Å; I222-V241 HydrophobicContact CG2-CG1 4.45Å; I222-V243 HydrophobicContact CG2-CG2 4.27Å; I222-L275 HydrophobicContact CD1-CD1 4.49Å; I222-I279 HydrophobicContact CD1-CD1 3.7Å; I222-I279 HydrophobicContact CD1-CG1 4.03Å
223	T	98.6	Very high	95.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	153.8	-170	-172.2	0	0	0	0	112.7	S154 F221 T225 S229 V240 V241 A242 V243	S154-T223 WeakPolarHBondContact O-CA 3.43Å; S154-T223 PolarHBondContact O-OG1 3.44Å; F221-T223 HydrophobicContact CD1-CG2 3.92Å; F221-T223 HydrophobicContact CD2-CG2 4.41Å; F221-T223 HydrophobicContact CE1-CG2 3.89Å; F221-T223 VanDerWaalsContact CE2-CB 3.44Å; F221-T223 HydrophobicContact CE2-CG2 4.38Å; F221-T223 HydrophobicContact CG-CG2 4.2Å; F221-T223 HydrophobicContact CZ-CG2 4.14Å; F221-T223 VanDerWaalsContact CZ-OG1 3.28Å; F221-T223 WeakPolarHBondContact CZ-OG1 3.46Å; F221-T223 PolarHBondContact O-N 2.86Å; T223-T225 HydrophobicContact CG2-CG2 3.6Å; T223-T225 PolarHBondContact O-N 3.29Å; T223-T225 PolarHBondContact OG1-N 3.46Å; T223-S229 WeakPolarHBondContact OG1-CB 3.37Å; T223-V240 HydrophobicContact CG2-CB 4.26Å; T223-V240 HydrophobicContact CG2-CG1 4.08Å; T223-V241 PolarHBondContact N-O 3.39Å; T223-A242 CarbonylContact O-C 3.6Å; T223-A242 VanDerWaalsContact O-CA 3.31Å; T223-A242 WeakPolarHBondContact O-CA 3.44Å; T223-V243 PolarHBondContact O-N 3.03Å
224	H	96.6	Very high	95.8	Very high	18 Å²	18	26.1 Å²	26.1	8%	0.083	14%	0.138	C	C	.	.			trans	-67.6	-12.7	170.1	66	-68.5	0	0	0	112.6	F155 G226 S229 V243 L245 Q249	F155-H224 VanDerWaalsContact C-ND1 3.31Å; F155-H224 VanDerWaalsContact CA-ND1 3.35Å; F155-H224 WeakPolarHBondContact CA-ND1 3.43Å; F155-H224 HydrophobicContact CB-CB 4.4Å; F155-H224 HydrophobicContact CD1-CB 4.03Å; F155-H224 HydrophobicContact CG-CB 4.43Å; F155-H224 PolarHBondContact O-CE1 3.41Å; F155-H224 PolarHBondContact O-ND1 3.28Å; H224-G226 VanDerWaalsContact C-N 3.29Å; H224-G226 PolarHBondContact CD2-N 3.06Å; H224-G226 PolarHBondContact NE2-N 3.17Å; H224-G226 PolarHBondContact O-N 2.88Å; H224-S229 PolarHBondContact CE1-OG 3.12Å; H224-V243 WeakPolarHBondContact CA-O 3.18Å; H224-L245 HydrophobicContact CB-CD1 4.43Å; H224-L245 HydrophobicContact CB-CG 4.16Å; H224-Q249 HydrophobicContact CB-CG 4.48Å; H224-Q249 VanDerWaalsContact CD2-CD 3.41Å; H224-Q249 PolarHBondContact CD2-NE2 2.77Å; H224-Q249 VanDerWaalsContact O-CB 3.23Å; H224-Q249 WeakPolarHBondContact O-CB 3.33Å; H224-Q249 WeakPolarHBondContact O-CG 3Å
225	T	95.7	Very high	95.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.			trans	57.1	35.1	-177.3	55.3	0	0	0	0	113.9	T223 A242 Q249 Y252 S253	T223-T225 HydrophobicContact CG2-CG2 3.6Å; T223-T225 PolarHBondContact O-N 3.29Å; T223-T225 PolarHBondContact OG1-N 3.46Å; T225-A242 HydrophobicContact CG2-CB 3.45Å; T225-A242 VanDerWaalsContact CG2-CB 3.45Å; T225-Q249 PolarHBondContact OG1-O 3.43Å; T225-Y252 WeakPolarHBondContact O-CB 3.35Å; T225-S253 WeakPolarHBondContact OG1-CA 3.28Å; T225-S253 WeakPolarHBondContact OG1-CB 3.47Å; T225-S253 PolarHBondContact OG1-N 2.96Å
226	G	92.1	Very high	95.7	Very high	6 Å²	6	22.7 Å²	22.7	6%	0.062	12%	0.122	C	C	.	.			trans	-58.2	151.2	162.4	0	0	0	0	0	109.4	H224 K228 S229 F230	H224-G226 VanDerWaalsContact C-N 3.29Å; H224-G226 PolarHBondContact CD2-N 3.06Å; H224-G226 PolarHBondContact NE2-N 3.17Å; H224-G226 PolarHBondContact O-N 2.88Å; G226-K228 PolarHBondContact O-N 2.89Å; G226-S229 PolarHBondContact O-N 2.68Å; G226-F230 PolarHBondContact O-N 2.99Å
227	I	89.8	Confident	95.9	Very high	81 Å²	81	17.1 Å²	17.1	42%	0.415	9%	0.086	S	C	.	.	H	α-helix	trans	-44	-45.7	-171.2	-172.6	172.8	0	0	0	113.5	F230 L231 D248 Y252	I227-F230 PolarHBondContact O-N 2.95Å; I227-L231 HydrophobicContact CG1-CD1 4.26Å; I227-L231 WeakPolarHBondContact O-CG 3.29Å; I227-L231 PolarHBondContact O-N 3Å; I227-D248 WeakPolarHBondContact CB-OD2 3.32Å; I227-D248 PolarHBondContact N-OD2 2.81Å; I227-Y252 HydrophobicContact CB-CD2 4.15Å; I227-Y252 HydrophobicContact CB-CE2 3.59Å; I227-Y252 HydrophobicContact CD1-CE2 4.2Å; I227-Y252 WeakPolarHBondContact CD1-OH 2.91Å; I227-Y252 HydrophobicContact CG1-CE1 4.06Å; I227-Y252 HydrophobicContact CG1-CE2 3.86Å; I227-Y252 WeakPolarHBondContact CG1-OH 3.31Å
228	K	90.3	Very high	95.9	Very high	52 Å²	52	14 Å²	14	23%	0.226	7%	0.073	C	C	.	.	H	α-helix	trans	-65.1	-46.2	179.6	-168.7	-175.6	89.3	-70.4	0	112.3	Y126 G226 F230 L231 E232	Y126-K228 HydrophobicContact CD1-CG 4.14Å; Y126-K228 HydrophobicContact CE1-CD 4.45Å; Y126-K228 HydrophobicContact CE1-CG 3.8Å; Y126-K228 HydrophobicContact CE2-CD 4.13Å; Y126-K228 HydrophobicContact CE2-CG 4.22Å; Y126-K228 HydrophobicContact CG-CG 4.44Å; G226-K228 PolarHBondContact O-N 2.89Å; K228-F230 VanDerWaalsContact C-N 3.33Å; K228-L231 PolarHBondContact O-N 3.14Å; K228-E232 WeakPolarHBondContact CE-OE1 3.28Å; K228-E232 VanDerWaalsContact O-CG 3.31Å; K228-E232 WeakPolarHBondContact O-CG 3.44Å; K228-E232 PolarHBondContact O-N 2.72Å
229	S	94.5	Very high	96	Very high	1 Å²	1	14 Å²	14	1%	0.007	7%	0.073	C	C	.	.	H	α-helix	trans	-69.8	-32.4	179.8	-67.2	0	0	0	0	112.2	T223 H224 G226 E232 A233	T223-S229 WeakPolarHBondContact OG1-CB 3.37Å; H224-S229 PolarHBondContact CE1-OG 3.12Å; G226-S229 PolarHBondContact O-N 2.68Å; S229-E232 PolarHBondContact O-N 3.44Å; S229-A233 WeakPolarHBondContact O-CB 3.33Å; S229-A233 PolarHBondContact O-N 2.9Å
230	F	95.8	Very high	96	Very high	17 Å²	17	12.3 Å²	12.3	8%	0.075	6%	0.063	C	C	.	.	H	α-helix	trans	-61.1	-47.9	168.9	176.3	-90.4	0	0	0	111	G226 I227 K228 E232 A233 V234 Y252 A256 F261	G226-F230 PolarHBondContact O-N 2.99Å; I227-F230 PolarHBondContact O-N 2.95Å; K228-F230 VanDerWaalsContact C-N 3.33Å; F230-E232 PolarHBondContact O-N 3.06Å; F230-A233 WeakPolarHBondContact O-CB 3.4Å; F230-A233 PolarHBondContact O-N 3.46Å; F230-V234 HydrophobicContact CD1-CG2 4.4Å; F230-V234 HydrophobicContact CE1-CG2 4.01Å; F230-V234 HydrophobicContact CZ-CG2 4.21Å; F230-V234 WeakPolarHBondContact O-CG2 3.49Å; F230-V234 PolarHBondContact O-N 2.84Å; F230-Y252 HydrophobicContact CB-CD1 4.21Å; F230-Y252 HydrophobicContact CB-CG 4.43Å; F230-Y252 AromaticContact CD1-CD1 3.82Å; F230-Y252 HydrophobicContact CD1-CD1 3.82Å; F230-Y252 HydrophobicContact CD1-CE1 4.28Å; F230-Y252 HydrophobicContact CD2-CD1 4.31Å; F230-Y252 HydrophobicContact CE1-CD1 4.27Å; F230-Y252 AromaticContact CG-CD1 3.85Å; F230-Y252 HydrophobicContact CG-CD1 3.85Å; F230-Y252 HydrophobicContact CG-CG 4.43Å; F230-A256 HydrophobicContact CD2-CB 4.23Å; F230-A256 HydrophobicContact CE2-CB 3.89Å; F230-F261 HydrophobicContact CE2-CD2 4.05Å; F230-F261 HydrophobicContact CE2-CE2 4.4Å; F230-F261 HydrophobicContact CZ-CD2 4.08Å; F230-F261 AromaticContact CZ-CE2 3.97Å; F230-F261 HydrophobicContact CZ-CE2 3.97Å
231	L	93.5	Very high	96	Very high	42 Å²	42	12.3 Å²	12.3	22%	0.22	6%	0.063	C	C	.	.	H	α-helix	trans	-62.9	-41.5	176.6	-71.1	173.1	0	0	0	112	Y126 I227 K228 A233 V234 C235	Y126-L231 HydrophobicContact CD1-CB 4.26Å; Y126-L231 HydrophobicContact CD1-CD1 4.42Å; I227-L231 HydrophobicContact CG1-CD1 4.26Å; I227-L231 WeakPolarHBondContact O-CG 3.29Å; I227-L231 PolarHBondContact O-N 3Å; K228-L231 PolarHBondContact O-N 3.14Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 2.7Å; L231-V234 CarbonylContact O-C 3.52Å; L231-V234 PolarHBondContact O-N 3.13Å; L231-V234 VanDerWaalsContact O-N 3.14Å; L231-C235 WeakPolarHBondContact O-CB 3.33Å; L231-C235 PolarHBondContact O-N 3.23Å; L231-C235 PolarHBondContact O-SG 2.76Å
232	E	94.9	Very high	96	Very high	11 Å²	11	12.3 Å²	12.3	5%	0.051	6%	0.063	C	C	.	.	H	α-helix	trans	-60.1	-41.5	174.9	-72.4	167.3	155.8	0	0	111.9	Y126 P129 L209 L213 K228 S229 F230 V234 C235 F236	Y126-E232 HydrophobicContact CE1-CG 3.95Å; Y126-E232 PolarHBondContact OH-OE1 2.93Å; P129-E232 HydrophobicContact CG-CG 4.32Å; L209-E232 WeakPolarHBondContact CD2-OE2 3.39Å; L213-E232 HydrophobicContact CD1-CB 3.93Å; K228-E232 WeakPolarHBondContact CE-OE1 3.28Å; K228-E232 VanDerWaalsContact O-CG 3.31Å; K228-E232 WeakPolarHBondContact O-CG 3.44Å; K228-E232 PolarHBondContact O-N 2.72Å; S229-E232 PolarHBondContact O-N 3.44Å; F230-E232 PolarHBondContact O-N 3.06Å; E232-V234 VanDerWaalsContact C-N 3.33Å; E232-V234 PolarHBondContact O-N 2.03Å; E232-C235 PolarHBondContact O-N 3.26Å; E232-F236 WeakPolarHBondContact O-CD2 3.46Å; E232-F236 PolarHBondContact O-N 3.49Å; E232-F236 VanDerWaalsContact O-N 3.11Å
233	A	97.5	Very high	95.9	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.008	6%	0.063	C	C	.	.	H	α-helix	trans	-59.4	-44.7	173.8	0	0	0	0	0	111.5	F221 S229 F230 L231 A237 T238 V240 I292	F221-A233 HydrophobicContact CD1-CB 4.01Å; S229-A233 WeakPolarHBondContact O-CB 3.33Å; S229-A233 PolarHBondContact O-N 2.9Å; F230-A233 WeakPolarHBondContact O-CB 3.4Å; F230-A233 PolarHBondContact O-N 3.46Å; L231-A233 VanDerWaalsContact C-N 3.32Å; L231-A233 PolarHBondContact O-N 2.7Å; A233-A237 CarbonylContact O-C 3.57Å; A233-A237 WeakPolarHBondContact O-CA 3.4Å; A233-A237 PolarHBondContact O-N 3.4Å; A233-T238 PolarHBondContact O-N 3.18Å; A233-V240 HydrophobicContact CB-CG1 3.53Å; A233-I292 HydrophobicContact CB-CD1 4.26Å; A233-I292 WeakPolarHBondContact O-CD1 3.48Å
234	V	96.5	Very high	95.8	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67	-46.8	177	178.9	0	0	0	0	111.3	F230 L231 E232 F236 A237 F261 I292 F295 R296 I299	F230-V234 HydrophobicContact CD1-CG2 4.4Å; F230-V234 HydrophobicContact CE1-CG2 4.01Å; F230-V234 HydrophobicContact CZ-CG2 4.21Å; F230-V234 WeakPolarHBondContact O-CG2 3.49Å; F230-V234 PolarHBondContact O-N 2.84Å; L231-V234 CarbonylContact O-C 3.52Å; L231-V234 PolarHBondContact O-N 3.13Å; L231-V234 VanDerWaalsContact O-N 3.14Å; E232-V234 VanDerWaalsContact C-N 3.33Å; E232-V234 PolarHBondContact O-N 2.03Å; V234-F236 PolarHBondContact O-N 2.83Å; V234-A237 PolarHBondContact O-N 2.92Å; V234-F261 HydrophobicContact CG2-CE2 4.43Å; V234-I292 HydrophobicContact CG2-CD1 4.41Å; V234-I292 HydrophobicContact CG2-CG1 4.33Å; V234-F295 HydrophobicContact CB-CD1 4.4Å; V234-F295 HydrophobicContact CG1-CD1 3.48Å; V234-F295 VanDerWaalsContact CG1-CD1 3.48Å; V234-F295 HydrophobicContact CG1-CE1 3.87Å; V234-F295 HydrophobicContact CG2-CD1 3.93Å; V234-F295 HydrophobicContact CG2-CE1 4.09Å; V234-R296 HydrophobicContact CG1-CB 4.38Å; V234-R296 VanDerWaalsContact O-CB 3.31Å; V234-R296 WeakPolarHBondContact O-CB 3.5Å; V234-R296 WeakPolarHBondContact O-CD 3.38Å; V234-R296 WeakPolarHBondContact O-CG 3.3Å; V234-I299 HydrophobicContact CB-CD1 4.36Å; V234-I299 HydrophobicContact CG1-CD1 3.39Å; V234-I299 HydrophobicContact CG1-CG1 3.9Å
235	C	94.5	Very high	95.7	Very high	5 Å²	5	11.9 Å²	11.9	3%	0.034	6%	0.062	C	C	.	.	H	α-helix	trans	-53.9	-38.2	179.9	-74.6	0	0	0	0	112.7	C128 L231 E232 R296	C128-C235 WeakPolarHBondContact CA-SG 3.38Å; C128-C235 HydrophobicContact CB-CB 3.62Å; C128-C235 WeakPolarHBondContact CB-SG 3.42Å; C128-C235 VanDerWaalsContact SG-CA 3.56Å; C128-C235 WeakPolarHBondContact SG-CB 3.37Å; C128-C235 CovalentContact SG-SG 2.03Å; C128-C235 PolarHBondContact SG-SG 3.39Å; L231-C235 WeakPolarHBondContact O-CB 3.33Å; L231-C235 PolarHBondContact O-N 3.23Å; L231-C235 PolarHBondContact O-SG 2.76Å; E232-C235 PolarHBondContact O-N 3.26Å; C235-R296 VanDerWaalsContact O-CD 3.32Å; C235-R296 WeakPolarHBondContact O-CD 3.45Å; C235-R296 PolarHBondContact O-NE 3.42Å; C235-R296 PolarHBondContact O-NH1 3.11Å
236	F	96	Very high	95.5	Very high	14 Å²	14	12.8 Å²	12.8	6%	0.061	7%	0.066	C	C	.	.	H	α-helix	trans	-100.4	4	178	-57.2	-59.7	0	0	0	113.7	P129 A210 L213 Q214 E232 V234 T238	P129-F236 HydrophobicContact CB-CZ 4.06Å; P129-F236 HydrophobicContact CG-CE2 4.28Å; P129-F236 HydrophobicContact CG-CZ 4.27Å; A210-F236 HydrophobicContact CB-CE2 3.95Å; A210-F236 HydrophobicContact CB-CZ 4.15Å; L213-F236 HydrophobicContact CB-CB 3.99Å; L213-F236 HydrophobicContact CB-CD2 3.45Å; L213-F236 VanDerWaalsContact CB-CD2 3.45Å; L213-F236 HydrophobicContact CB-CE2 4.23Å; L213-F236 HydrophobicContact CB-CG 3.93Å; L213-F236 HydrophobicContact CD1-CD2 4.17Å; L213-F236 HydrophobicContact CG-CD2 4.48Å; L213-F236 WeakPolarHBondContact O-CB 3.39Å; Q214-F236 HydrophobicContact CB-CD1 3.68Å; Q214-F236 HydrophobicContact CB-CE1 3.68Å; Q214-F236 HydrophobicContact CB-CG 4.32Å; Q214-F236 HydrophobicContact CB-CZ 4.32Å; Q214-F236 HydrophobicContact CG-CD1 4.25Å; Q214-F236 HydrophobicContact CG-CE1 4.21Å; E232-F236 WeakPolarHBondContact O-CD2 3.46Å; E232-F236 PolarHBondContact O-N 3.49Å; E232-F236 VanDerWaalsContact O-N 3.11Å; V234-F236 PolarHBondContact O-N 2.83Å; F236-T238 VanDerWaalsContact C-N 3.28Å; F236-T238 PolarHBondContact O-N 2.97Å
237	A	97.5	Very high	95.2	Very high	4 Å²	4	13.8 Å²	13.8	3%	0.033	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	45.2	-176.3	0	0	0	0	0	112.7	A233 V234 K289 I292 A293 R296	A233-A237 CarbonylContact O-C 3.57Å; A233-A237 WeakPolarHBondContact O-CA 3.4Å; A233-A237 PolarHBondContact O-N 3.4Å; V234-A237 PolarHBondContact O-N 2.92Å; A237-K289 WeakPolarHBondContact O-CD 3.23Å; A237-K289 VanDerWaalsContact O-CE 3.24Å; A237-K289 WeakPolarHBondContact O-CE 3.16Å; A237-K289 PolarHBondContact O-NZ 2.95Å; A237-I292 HydrophobicContact CB-CG2 4.21Å; A237-I292 WeakPolarHBondContact O-CG2 3.47Å; A237-A293 HydrophobicContact CB-CB 3.98Å; A237-R296 HydrophobicContact CB-CB 4.22Å
238	T	98.3	Very high	95	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.072	C	C	.	.			trans	-101.9	116.9	-178.2	-55.9	0	0	0	0	110	L213 T218 F221 A233 F236 I292	L213-T238 HydrophobicContact CD2-CG2 3.99Å; L213-T238 PolarHBondContact O-OG1 3.43Å; T218-T238 HydrophobicContact CG2-CG2 4.12Å; F221-T238 HydrophobicContact CB-CG2 3.92Å; A233-T238 PolarHBondContact O-N 3.18Å; F236-T238 VanDerWaalsContact C-N 3.28Å; F236-T238 PolarHBondContact O-N 2.97Å; T238-I292 WeakPolarHBondContact O-CD1 3.12Å
239	P	98.8	Very high	95.2	Very high	3 Å²	3	10.6 Å²	10.6	2%	0.019	6%	0.062	C	C	.	.			trans	-52.7	153.2	175.1	-29.1	37.3	0	0	0	112.9	L220 F221 F261 V282 K289 I292	L220-P239 HydrophobicContact CD1-CB 4.31Å; F221-P239 PolarHBondContact N-O 3.38Å; P239-F261 CarbonylContact C-O 3.52Å; P239-F261 VanDerWaalsContact CA-O 3.28Å; P239-F261 WeakPolarHBondContact CA-O 3.39Å; P239-V282 HydrophobicContact CB-CG1 3.55Å; P239-K289 HydrophobicContact CG-CB 3.96Å; P239-K289 HydrophobicContact CG-CD 4.16Å; P239-I292 HydrophobicContact CG-CG2 4.38Å
240	V	98.8	Very high	95.2	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.012	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.5	-174.5	-58.4	0	0	0	0	114.4	F221 T223 A233 A256 F261 G262 I263	F221-V240 HydrophobicContact CB-CG1 4.33Å; F221-V240 HydrophobicContact CD1-CG1 4.44Å; F221-V240 CarbonylContact O-C 3.43Å; F221-V240 WeakPolarHBondContact O-CA 3.24Å; F221-V240 WeakPolarHBondContact O-CB 3.01Å; T223-V240 HydrophobicContact CG2-CB 4.26Å; T223-V240 HydrophobicContact CG2-CG1 4.08Å; A233-V240 HydrophobicContact CB-CG1 3.53Å; V240-A256 HydrophobicContact CG2-CB 3.81Å; V240-F261 PolarHBondContact N-O 2.74Å; V240-G262 WeakPolarHBondContact O-CA 3.32Å; V240-I263 PolarHBondContact O-N 3.04Å
241	V	98.9	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112	152	177.9	0	0	0	0	106.7	L220 F221 I222 T223 V243 I263 L265 L275 T278 I279 V282	L220-V241 HydrophobicContact CD1-CG2 3.99Å; L220-V241 HydrophobicContact CD2-CG2 4Å; L220-V241 HydrophobicContact CG-CG2 4.32Å; F221-V241 PolarHBondContact O-N 3.46Å; I222-V241 WeakPolarHBondContact CA-O 3.32Å; I222-V241 HydrophobicContact CB-CB 4.46Å; I222-V241 HydrophobicContact CG1-CB 4.14Å; I222-V241 HydrophobicContact CG1-CG2 4.46Å; I222-V241 HydrophobicContact CG2-CB 4.27Å; I222-V241 HydrophobicContact CG2-CG1 4.45Å; T223-V241 PolarHBondContact N-O 3.39Å; V241-V243 HydrophobicContact CG1-CG2 4.27Å; V241-I263 WeakPolarHBondContact CA-O 3.47Å; V241-L265 HydrophobicContact CG1-CD1 3.73Å; V241-L265 HydrophobicContact CG1-CG 4.18Å; V241-L275 HydrophobicContact CG1-CD1 4.32Å; V241-T278 HydrophobicContact CB-CG2 4.49Å; V241-T278 HydrophobicContact CG1-CG2 3.9Å; V241-T278 HydrophobicContact CG2-CG2 3.88Å; V241-I279 HydrophobicContact CG2-CG1 4.39Å; V241-V282 HydrophobicContact CG2-CG2 4.35Å
242	A	98.6	Very high	95	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.1	-173.2	0	0	0	0	0	110.9	T223 T225 P244 I263 R264 L265	T223-A242 CarbonylContact O-C 3.6Å; T223-A242 VanDerWaalsContact O-CA 3.31Å; T223-A242 WeakPolarHBondContact O-CA 3.44Å; T225-A242 HydrophobicContact CG2-CB 3.45Å; T225-A242 VanDerWaalsContact CG2-CB 3.45Å; A242-P244 WeakPolarHBondContact O-CD 3.34Å; A242-I263 PolarHBondContact N-O 3.43Å; A242-R264 HydrophobicContact CB-CB 4.36Å; A242-R264 CarbonylContact O-C 3.54Å; A242-R264 VanDerWaalsContact O-CA 3.27Å; A242-R264 WeakPolarHBondContact O-CA 3Å; A242-L265 PolarHBondContact O-N 3.11Å
243	V	97.8	Very high	95.1	Very high	2 Å²	2	19 Å²	19	1%	0.012	10%	0.095	C	C	.	.			trans	-122.3	77.4	179.2	-170.4	0	0	0	0	109.1	F155 I222 T223 H224 V241 L245 L265 K267	F155-V243 HydrophobicContact CE1-CB 3.96Å; F155-V243 HydrophobicContact CE1-CG2 4.41Å; F155-V243 HydrophobicContact CZ-CB 3.76Å; F155-V243 HydrophobicContact CZ-CG1 4.06Å; F155-V243 HydrophobicContact CZ-CG2 4.19Å; I222-V243 HydrophobicContact CG2-CG2 4.27Å; T223-V243 PolarHBondContact O-N 3.03Å; H224-V243 WeakPolarHBondContact CA-O 3.18Å; V241-V243 HydrophobicContact CG1-CG2 4.27Å; V243-L245 PolarHBondContact O-N 3.22Å; V243-L265 HydrophobicContact CG2-CB 4.35Å; V243-K267 HydrophobicContact CG1-CB 3.89Å
244	P	96.4	Very high	95.1	Very high	8 Å²	8	23.6 Å²	23.6	5%	0.052	12%	0.117	C	C	.	.			trans	-66.9	133	-173.8	29.5	-37.3	0	0	0	112.1	A242 Q249 P250 R264 L265 K267	A242-P244 WeakPolarHBondContact O-CD 3.34Å; P244-Q249 HydrophobicContact CB-CB 3.77Å; P244-P250 HydrophobicContact CB-CB 4.5Å; P244-P250 HydrophobicContact CB-CG 4.19Å; P244-R264 HydrophobicContact CG-CG 4.28Å; P244-L265 WeakPolarHBondContact CD-O 3.42Å; P244-K267 PolarHBondContact O-NZ 3.44Å; P244-K267 VanDerWaalsContact O-NZ 3.11Å
245	L	93.8	Very high	95.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.13	C	C	.	.			trans	-98.1	-53.7	179.7	-49.6	-177.8	0	0	0	111.2	V97 W98 F155 A159 H224 V243 Q249 K267	V97-L245 HydrophobicContact CG1-CB 3.89Å; V97-L245 HydrophobicContact CG1-CD1 4.29Å; W98-L245 HydrophobicContact CE3-CD2 4.32Å; W98-L245 HydrophobicContact CZ3-CD2 4.15Å; F155-L245 HydrophobicContact CB-CD1 4.1Å; F155-L245 HydrophobicContact CD2-CD1 4.13Å; F155-L245 HydrophobicContact CG-CD1 4.24Å; A159-L245 HydrophobicContact CB-CD1 3.52Å; H224-L245 HydrophobicContact CB-CD1 4.43Å; H224-L245 HydrophobicContact CB-CG 4.16Å; V243-L245 PolarHBondContact O-N 3.22Å; L245-Q249 VanDerWaalsContact CA-OE1 3.29Å; L245-Q249 VanDerWaalsContact CB-OE1 3.26Å; L245-K267 HydrophobicContact CB-CD 4.48Å; L245-K267 HydrophobicContact CD2-CB 4.43Å; L245-K267 HydrophobicContact CD2-CD 3.58Å; L245-K267 WeakPolarHBondContact O-CE 3.43Å; L245-K267 PolarHBondContact O-NZ 2.91Å
246	F	90.6	Very high	95.3	Very high	19 Å²	19	25.8 Å²	25.8	8%	0.083	13%	0.128	C	C	.	.	S	Bend	trans	-159.6	173.5	-174	65.5	-92.4	0	0	0	113.6	F93 V97 V103 P105 F158 D248 Q249	F93-F246 HydrophobicContact CZ-CD2 4.38Å; F93-F246 HydrophobicContact CZ-CG 4.43Å; V97-F246 HydrophobicContact CB-CD1 4.33Å; V97-F246 HydrophobicContact CG1-CD1 3.7Å; V97-F246 HydrophobicContact CG1-CE1 4.18Å; V97-F246 HydrophobicContact CG2-CB 4.29Å; V97-F246 HydrophobicContact CG2-CD1 3.66Å; V97-F246 HydrophobicContact CG2-CE1 4.22Å; V97-F246 HydrophobicContact CG2-CG 4.12Å; V103-F246 HydrophobicContact CB-CB 3.98Å; V103-F246 CarbonylContact O-C 3.52Å; V103-F246 VanDerWaalsContact O-CA 3.3Å; V103-F246 WeakPolarHBondContact O-CA 3.37Å; V103-F246 VanDerWaalsContact O-CB 3.31Å; V103-F246 WeakPolarHBondContact O-CB 3.25Å; P105-F246 HydrophobicContact CG-CB 4.29Å; P105-F246 HydrophobicContact CG-CD2 3.47Å; P105-F246 VanDerWaalsContact CG-CD2 3.47Å; P105-F246 HydrophobicContact CG-CE2 4.14Å; P105-F246 HydrophobicContact CG-CG 4.2Å; F158-F246 HydrophobicContact CB-CE1 4.08Å; F158-F246 HydrophobicContact CB-CZ 3.68Å; F158-F246 HydrophobicContact CD2-CZ 4.33Å; F158-F246 HydrophobicContact CG-CZ 4.34Å; F246-D248 PolarHBondContact O-N 2.84Å; F246-Q249 WeakPolarHBondContact O-CB 3.31Å; F246-Q249 WeakPolarHBondContact O-CG 3.42Å; F246-Q249 PolarHBondContact O-N 2.78Å; F246-Q249 PolarHBondContact O-NE2 3.38Å; F246-Q249 PolarHBondContact O-OE1 3.5Å
247	G	86.8	Confident	95.4	Very high	27 Å²	27	26.9 Å²	26.9	28%	0.278	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-128.5	168	0	0	0	0	0	113.9	V103 Q249 P250	V103-G247 PolarHBondContact O-N 2.88Å; G247-Q249 VanDerWaalsContact C-N 3.28Å; G247-Q249 PolarHBondContact O-N 3.44Å; G247-P250 VanDerWaalsContact O-CD 3.26Å; G247-P250 WeakPolarHBondContact O-CD 3.41Å
248	D	86.3	Confident	95.4	Very high	62 Å²	62	32.5 Å²	32.5	33%	0.332	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-16.7	-179.9	66.5	-42.4	0	0	0	113.6	I227 F246 R251 Y252	I227-D248 WeakPolarHBondContact CB-OD2 3.32Å; I227-D248 PolarHBondContact N-OD2 2.81Å; F246-D248 PolarHBondContact O-N 2.84Å; D248-R251 WeakPolarHBondContact O-CB 3.27Å; D248-R251 PolarHBondContact O-N 3.17Å; D248-R251 VanDerWaalsContact O-N 3.09Å; D248-Y252 HydrophobicContact CB-CD2 4.12Å; D248-Y252 HydrophobicContact CB-CE2 4.1Å; D248-Y252 WeakPolarHBondContact O-CD2 3.33Å; D248-Y252 PolarHBondContact O-N 3.41Å; D248-Y252 WeakPolarHBondContact OD2-CD2 3.48Å
249	Q	93.6	Very high	95.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.019	19%	0.185	C	C	.	.	H	α-helix	trans	-56.4	-43.1	-172.4	-62	164.4	29	0	0	114.1	H224 T225 P244 L245 F246 G247 R251 Y252 S253	H224-Q249 HydrophobicContact CB-CG 4.48Å; H224-Q249 VanDerWaalsContact CD2-CD 3.41Å; H224-Q249 PolarHBondContact CD2-NE2 2.77Å; H224-Q249 VanDerWaalsContact O-CB 3.23Å; H224-Q249 WeakPolarHBondContact O-CB 3.33Å; H224-Q249 WeakPolarHBondContact O-CG 3Å; T225-Q249 PolarHBondContact OG1-O 3.43Å; P244-Q249 HydrophobicContact CB-CB 3.77Å; L245-Q249 VanDerWaalsContact CA-OE1 3.29Å; L245-Q249 VanDerWaalsContact CB-OE1 3.26Å; F246-Q249 WeakPolarHBondContact O-CB 3.31Å; F246-Q249 WeakPolarHBondContact O-CG 3.42Å; F246-Q249 PolarHBondContact O-N 2.78Å; F246-Q249 PolarHBondContact O-NE2 3.38Å; F246-Q249 PolarHBondContact O-OE1 3.5Å; G247-Q249 VanDerWaalsContact C-N 3.28Å; G247-Q249 PolarHBondContact O-N 3.44Å; Q249-R251 VanDerWaalsContact C-N 3.28Å; Q249-R251 PolarHBondContact O-N 2.9Å; Q249-Y252 PolarHBondContact O-N 3.24Å; Q249-S253 VanDerWaalsContact O-CB 3.3Å; Q249-S253 WeakPolarHBondContact O-CB 3.37Å; Q249-S253 PolarHBondContact O-N 3.01Å; Q249-S253 PolarHBondContact O-OG 3.38Å
250	P	93.5	Very high	95.4	Very high	37 Å²	37	37.2 Å²	37.2	24%	0.24	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-39.2	176.9	-24.1	35.9	0	0	0	112.6	T102 P244 G247 S253 M254	T102-P250 HydrophobicContact CG2-CG 4.05Å; P244-P250 HydrophobicContact CB-CB 4.5Å; P244-P250 HydrophobicContact CB-CG 4.19Å; G247-P250 VanDerWaalsContact O-CD 3.26Å; G247-P250 WeakPolarHBondContact O-CD 3.41Å; P250-S253 WeakPolarHBondContact CA-OG 3.5Å; P250-S253 PolarHBondContact O-OG 2.82Å; P250-M254 WeakPolarHBondContact O-CB 3.08Å; P250-M254 PolarHBondContact O-N 3.45Å
251	R	92.1	Very high	95.3	Very high	172 Å²	172	37.4 Å²	37.4	65%	0.649	19%	0.19	S	C	*	.	H	α-helix	trans	-63.6	-50.3	178.1	-179	-175.4	175.1	-157.6	-0.6	111.1	D248 Q249 M254 L255	D248-R251 WeakPolarHBondContact O-CB 3.27Å; D248-R251 PolarHBondContact O-N 3.17Å; D248-R251 VanDerWaalsContact O-N 3.09Å; Q249-R251 VanDerWaalsContact C-N 3.28Å; Q249-R251 PolarHBondContact O-N 2.9Å; R251-M254 WeakPolarHBondContact O-CB 3.39Å; R251-M254 PolarHBondContact O-N 2.96Å; R251-L255 HydrophobicContact CG-CD1 4.49Å; R251-L255 WeakPolarHBondContact O-CG 3.25Å; R251-L255 PolarHBondContact O-N 3.01Å
252	Y	94.8	Very high	95.3	Very high	39 Å²	39	37.5 Å²	37.5	15%	0.153	19%	0.191	C	C	.	.	H	α-helix	trans	-69.5	-33.2	-179.6	-76.4	-73.3	0	0	0	113.1	T225 I227 F230 D248 Q249 M254 L255 A256	T225-Y252 WeakPolarHBondContact O-CB 3.35Å; I227-Y252 HydrophobicContact CB-CD2 4.15Å; I227-Y252 HydrophobicContact CB-CE2 3.59Å; I227-Y252 HydrophobicContact CD1-CE2 4.2Å; I227-Y252 WeakPolarHBondContact CD1-OH 2.91Å; I227-Y252 HydrophobicContact CG1-CE1 4.06Å; I227-Y252 HydrophobicContact CG1-CE2 3.86Å; I227-Y252 WeakPolarHBondContact CG1-OH 3.31Å; F230-Y252 HydrophobicContact CB-CD1 4.21Å; F230-Y252 HydrophobicContact CB-CG 4.43Å; F230-Y252 AromaticContact CD1-CD1 3.82Å; F230-Y252 HydrophobicContact CD1-CD1 3.82Å; F230-Y252 HydrophobicContact CD1-CE1 4.28Å; F230-Y252 HydrophobicContact CD2-CD1 4.31Å; F230-Y252 HydrophobicContact CE1-CD1 4.27Å; F230-Y252 AromaticContact CG-CD1 3.85Å; F230-Y252 HydrophobicContact CG-CD1 3.85Å; F230-Y252 HydrophobicContact CG-CG 4.43Å; D248-Y252 HydrophobicContact CB-CD2 4.12Å; D248-Y252 HydrophobicContact CB-CE2 4.1Å; D248-Y252 WeakPolarHBondContact O-CD2 3.33Å; D248-Y252 PolarHBondContact O-N 3.41Å; D248-Y252 WeakPolarHBondContact OD2-CD2 3.48Å; Q249-Y252 PolarHBondContact O-N 3.24Å; Y252-M254 VanDerWaalsContact C-N 3.3Å; Y252-M254 PolarHBondContact O-N 3.35Å; Y252-L255 HydrophobicContact CD1-CD1 4.09Å; Y252-L255 HydrophobicContact CE1-CD1 4.32Å; Y252-L255 PolarHBondContact O-N 2.87Å; Y252-A256 WeakPolarHBondContact O-CB 3.37Å; Y252-A256 PolarHBondContact O-N 2.7Å
253	S	96.8	Very high	95.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-37.7	172.1	73.4	0	0	0	0	112.3	T225 Q249 P250 S257 R264	T225-S253 WeakPolarHBondContact OG1-CA 3.28Å; T225-S253 WeakPolarHBondContact OG1-CB 3.47Å; T225-S253 PolarHBondContact OG1-N 2.96Å; Q249-S253 VanDerWaalsContact O-CB 3.3Å; Q249-S253 WeakPolarHBondContact O-CB 3.37Å; Q249-S253 PolarHBondContact O-N 3.01Å; Q249-S253 PolarHBondContact O-OG 3.38Å; P250-S253 WeakPolarHBondContact CA-OG 3.5Å; P250-S253 PolarHBondContact O-OG 2.82Å; S253-S257 PolarHBondContact O-N 2.79Å; S253-S257 VanDerWaalsContact O-N 3.13Å; S253-S257 PolarHBondContact O-OG 3.45Å; S253-R264 WeakPolarHBondContact OG-CD 3.05Å
254	M	96.5	Very high	95.3	Very high	96 Å²	96	45.1 Å²	45.1	47%	0.473	22%	0.223	S	C	.	.	H	α-helix	trans	-68.9	-45.6	175.6	-174.3	60.9	178.3	0	0	110.5	P250 R251 Y252 A256 S257 M258	P250-M254 WeakPolarHBondContact O-CB 3.08Å; P250-M254 PolarHBondContact O-N 3.45Å; R251-M254 WeakPolarHBondContact O-CB 3.39Å; R251-M254 PolarHBondContact O-N 2.96Å; Y252-M254 VanDerWaalsContact C-N 3.3Å; Y252-M254 PolarHBondContact O-N 3.35Å; M254-A256 VanDerWaalsContact C-N 3.34Å; M254-A256 PolarHBondContact O-N 3Å; M254-S257 PolarHBondContact O-N 2.79Å; M254-S257 VanDerWaalsContact O-N 3.13Å; M254-M258 HydrophobicContact CE-CG 3.8Å; M254-M258 HydrophobicContact CE-SD 3.85Å; M254-M258 HydrophobicContact CG-CG 4.18Å; M254-M258 HydrophobicContact CG-SD 3.8Å; M254-M258 WeakPolarHBondContact O-CB 3.33Å; M254-M258 VanDerWaalsContact O-CG 3.28Å; M254-M258 WeakPolarHBondContact O-CG 3.44Å; M254-M258 PolarHBondContact O-N 3.44Å; M254-M258 HydrophobicContact SD-CG 4.24Å; M254-M258 HydrophobicContact SD-SD 4.46Å
255	L	96.5	Very high	95.4	Very high	52 Å²	52	45.8 Å²	45.8	27%	0.272	23%	0.226	S	C	.	.	H	α-helix	trans	-57.7	-45.3	174.6	-69.8	173.3	0	0	0	111.9	R251 Y252 S257 M258 H259	R251-L255 HydrophobicContact CG-CD1 4.49Å; R251-L255 WeakPolarHBondContact O-CG 3.25Å; R251-L255 PolarHBondContact O-N 3.01Å; Y252-L255 HydrophobicContact CD1-CD1 4.09Å; Y252-L255 HydrophobicContact CE1-CD1 4.32Å; Y252-L255 PolarHBondContact O-N 2.87Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 3.2Å; L255-M258 PolarHBondContact O-N 2.97Å; L255-H259 WeakPolarHBondContact O-CB 3.4Å; L255-H259 PolarHBondContact O-CD2 3.18Å; L255-H259 PolarHBondContact O-N 3.44Å
256	A	98.2	Very high	95.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.4	-41.9	176	0	0	0	0	0	112	F230 V240 Y252 M254 G260 F261 G262	F230-A256 HydrophobicContact CD2-CB 4.23Å; F230-A256 HydrophobicContact CE2-CB 3.89Å; V240-A256 HydrophobicContact CG2-CB 3.81Å; Y252-A256 WeakPolarHBondContact O-CB 3.37Å; Y252-A256 PolarHBondContact O-N 2.7Å; M254-A256 VanDerWaalsContact C-N 3.34Å; M254-A256 PolarHBondContact O-N 3Å; A256-G260 PolarHBondContact O-N 3.44Å; A256-F261 HydrophobicContact CB-CB 4.4Å; A256-F261 PolarHBondContact O-N 2.94Å; A256-G262 PolarHBondContact O-N 2.87Å
257	S	98	Very high	95.6	Very high	37 Å²	37	46.8 Å²	46.8	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-70.8	-47.3	178.7	-57.1	0	0	0	0	112	S253 M254 L255 H259 G260 R264	S253-S257 PolarHBondContact O-N 2.79Å; S253-S257 VanDerWaalsContact O-N 3.13Å; S253-S257 PolarHBondContact O-OG 3.45Å; M254-S257 PolarHBondContact O-N 2.79Å; M254-S257 VanDerWaalsContact O-N 3.13Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 3.2Å; S257-H259 VanDerWaalsContact C-N 3.32Å; S257-H259 PolarHBondContact O-N 3.38Å; S257-G260 PolarHBondContact O-N 3.05Å; S257-R264 WeakPolarHBondContact OG-CB 3.5Å; S257-R264 PolarHBondContact OG-N 3.4Å
258	M	98.1	Very high	95.8	Very high	121 Å²	121	48.1 Å²	48.1	60%	0.596	24%	0.235	S	C	*	.	H	α-helix	trans	-59.5	-41.1	179.8	-73.2	176.1	69.1	0	0	112.3	M254 L255 G260	M254-M258 HydrophobicContact CE-CG 3.8Å; M254-M258 HydrophobicContact CE-SD 3.85Å; M254-M258 HydrophobicContact CG-CG 4.18Å; M254-M258 HydrophobicContact CG-SD 3.8Å; M254-M258 WeakPolarHBondContact O-CB 3.33Å; M254-M258 VanDerWaalsContact O-CG 3.28Å; M254-M258 WeakPolarHBondContact O-CG 3.44Å; M254-M258 PolarHBondContact O-N 3.44Å; M254-M258 HydrophobicContact SD-CG 4.24Å; M254-M258 HydrophobicContact SD-SD 4.46Å; L255-M258 PolarHBondContact O-N 2.97Å; M258-G260 VanDerWaalsContact C-N 3.26Å; M258-G260 PolarHBondContact O-N 2.87Å
259	H	98	Very high	96.2	Very high	92 Å²	92	49.4 Å²	49.4	43%	0.426	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.5	178.5	-67	-65.3	0	0	0	113.4	L255 S257 F261 R291	L255-H259 WeakPolarHBondContact O-CB 3.4Å; L255-H259 PolarHBondContact O-CD2 3.18Å; L255-H259 PolarHBondContact O-N 3.44Å; S257-H259 VanDerWaalsContact C-N 3.32Å; S257-H259 PolarHBondContact O-N 3.38Å; H259-F261 HydrophobicContact CB-CD1 4.1Å; H259-F261 HydrophobicContact CB-CD2 4.23Å; H259-F261 HydrophobicContact CB-CE1 3.65Å; H259-F261 HydrophobicContact CB-CE2 3.8Å; H259-F261 HydrophobicContact CB-CG 4.35Å; H259-F261 HydrophobicContact CB-CZ 3.47Å; H259-F261 VanDerWaalsContact CB-CZ 3.47Å; H259-R291 WeakPolarHBondContact O-CD 3.15Å
260	G	98.3	Very high	96.3	Very high	11 Å²	11	50.2 Å²	50.2	11%	0.113	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	34.2	178	0	0	0	0	0	113.1	A256 S257 M258 G262 Y288 R291	A256-G260 PolarHBondContact O-N 3.44Å; S257-G260 PolarHBondContact O-N 3.05Å; M258-G260 VanDerWaalsContact C-N 3.26Å; M258-G260 PolarHBondContact O-N 2.87Å; G260-G262 VanDerWaalsContact C-N 3.34Å; G260-Y288 WeakPolarHBondContact O-CA 3.49Å; G260-Y288 VanDerWaalsContact O-CD1 3.29Å; G260-Y288 WeakPolarHBondContact O-CD1 3.34Å; G260-R291 WeakPolarHBondContact O-CB 3.24Å
261	F	98.6	Very high	96.6	Very high	5 Å²	5	51.4 Å²	51.4	2%	0.022	26%	0.256	C	S	.	.	S	Bend	trans	-84.6	-15.2	170.6	-54.7	-19.8	0	0	0	112	F230 V234 P239 V240 A256 H259 R291 I292 F295	F230-F261 HydrophobicContact CE2-CD2 4.05Å; F230-F261 HydrophobicContact CE2-CE2 4.4Å; F230-F261 HydrophobicContact CZ-CD2 4.08Å; F230-F261 AromaticContact CZ-CE2 3.97Å; F230-F261 HydrophobicContact CZ-CE2 3.97Å; V234-F261 HydrophobicContact CG2-CE2 4.43Å; P239-F261 CarbonylContact C-O 3.52Å; P239-F261 VanDerWaalsContact CA-O 3.28Å; P239-F261 WeakPolarHBondContact CA-O 3.39Å; V240-F261 PolarHBondContact N-O 2.74Å; A256-F261 HydrophobicContact CB-CB 4.4Å; A256-F261 PolarHBondContact O-N 2.94Å; H259-F261 HydrophobicContact CB-CD1 4.1Å; H259-F261 HydrophobicContact CB-CD2 4.23Å; H259-F261 HydrophobicContact CB-CE1 3.65Å; H259-F261 HydrophobicContact CB-CE2 3.8Å; H259-F261 HydrophobicContact CB-CG 4.35Å; H259-F261 HydrophobicContact CB-CZ 3.47Å; H259-F261 VanDerWaalsContact CB-CZ 3.47Å; F261-R291 HydrophobicContact CD1-CB 4.22Å; F261-R291 HydrophobicContact CE1-CB 4.39Å; F261-I292 HydrophobicContact CB-CB 4.2Å; F261-I292 HydrophobicContact CB-CD1 4.15Å; F261-I292 HydrophobicContact CB-CG1 4.22Å; F261-I292 HydrophobicContact CD1-CB 3.76Å; F261-I292 HydrophobicContact CD1-CG1 4.07Å; F261-I292 HydrophobicContact CD2-CG1 4.34Å; F261-I292 HydrophobicContact CE1-CB 4.41Å; F261-I292 HydrophobicContact CG-CB 4.04Å; F261-I292 HydrophobicContact CG-CD1 4.35Å; F261-I292 HydrophobicContact CG-CG1 3.96Å; F261-F295 HydrophobicContact CE1-CB 3.71Å; F261-F295 HydrophobicContact CE1-CD1 4.49Å; F261-F295 HydrophobicContact CE1-CG 4.16Å; F261-F295 HydrophobicContact CE2-CB 4.42Å; F261-F295 AromaticContact CE2-CD1 3.7Å; F261-F295 HydrophobicContact CE2-CD1 3.7Å; F261-F295 HydrophobicContact CE2-CE1 4.18Å; F261-F295 HydrophobicContact CE2-CG 4.08Å; F261-F295 HydrophobicContact CZ-CB 3.45Å; F261-F295 VanDerWaalsContact CZ-CB 3.45Å; F261-F295 AromaticContact CZ-CD1 3.49Å; F261-F295 HydrophobicContact CZ-CD1 3.49Å; F261-F295 VanDerWaalsContact CZ-CD1 3.49Å; F261-F295 HydrophobicContact CZ-CD2 4.02Å; F261-F295 HydrophobicContact CZ-CE1 4.26Å; F261-F295 AromaticContact CZ-CG 3.37Å; F261-F295 HydrophobicContact CZ-CG 3.37Å
262	G	98.5	Very high	96.8	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-167.1	-175.5	0	0	0	0	0	113.8	V240 A256 G260	V240-G262 WeakPolarHBondContact O-CA 3.32Å; A256-G262 PolarHBondContact O-N 2.87Å; G260-G262 VanDerWaalsContact C-N 3.34Å
263	I	98.7	Very high	97	Very high	49 Å²	49	49.5 Å²	49.5	25%	0.251	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.1	173.5	-64	173.8	0	0	0	108.6	V240 V241 A242 T278 A281 V282 Y288	V240-I263 PolarHBondContact O-N 3.04Å; V241-I263 WeakPolarHBondContact CA-O 3.47Å; A242-I263 PolarHBondContact N-O 3.43Å; I263-T278 HydrophobicContact CB-CG2 3.63Å; I263-T278 HydrophobicContact CD1-CG2 4.12Å; I263-T278 HydrophobicContact CG1-CG2 4.44Å; I263-T278 HydrophobicContact CG2-CG2 3.69Å; I263-A281 HydrophobicContact CD1-CB 4.26Å; I263-V282 HydrophobicContact CB-CG2 4.09Å; I263-V282 HydrophobicContact CD1-CG2 3.81Å; I263-V282 HydrophobicContact CG1-CG2 3.79Å; I263-Y288 WeakPolarHBondContact CD1-OH 3.23Å; I263-Y288 HydrophobicContact CG1-CE1 4.2Å
264	R	98	Very high	97.1	Very high	112 Å²	112	51 Å²	51	42%	0.423	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.1	173.2	-175.4	-177.3	74	80.3	-3.2	111.5	A242 P244 S253 S257	A242-R264 HydrophobicContact CB-CB 4.36Å; A242-R264 CarbonylContact O-C 3.54Å; A242-R264 VanDerWaalsContact O-CA 3.27Å; A242-R264 WeakPolarHBondContact O-CA 3Å; P244-R264 HydrophobicContact CG-CG 4.28Å; S253-R264 WeakPolarHBondContact OG-CD 3.05Å; S257-R264 WeakPolarHBondContact OG-CB 3.5Å; S257-R264 PolarHBondContact OG-N 3.4Å
265	L	97.8	Very high	97.2	Very high	23 Å²	23	46.5 Å²	46.5	12%	0.12	25%	0.245	C	C	.	.			trans	-112.7	153.9	169	-65.8	175.8	0	0	0	110.6	V241 A242 V243 P244 L270 L275 T278	V241-L265 HydrophobicContact CG1-CD1 3.73Å; V241-L265 HydrophobicContact CG1-CG 4.18Å; A242-L265 PolarHBondContact O-N 3.11Å; V243-L265 HydrophobicContact CG2-CB 4.35Å; P244-L265 WeakPolarHBondContact CD-O 3.42Å; L265-L270 HydrophobicContact CB-CD1 4.15Å; L265-L270 HydrophobicContact CD1-CD1 3.72Å; L265-L275 HydrophobicContact CD1-CD1 4Å; L265-T278 HydrophobicContact CD1-CG2 4.19Å; L265-T278 HydrophobicContact CD2-CG2 4.46Å; L265-T278 HydrophobicContact CG-CG2 4.26Å
266	D	94.6	Very high	97.3	Very high	37 Å²	37	47.4 Å²	47.4	20%	0.198	25%	0.245	C	C	.	.			trans	-93.9	120.7	171.8	-174.2	-21.4	0	0	0	109.1	K101 T268 T269 L270	K101-D266 WeakPolarHBondContact CE-OD2 3.46Å; D266-T268 VanDerWaalsContact CG-OG1 3.25Å; D266-T268 PolarHBondContact O-N 3.25Å; D266-T268 WeakPolarHBondContact OD1-CB 3.5Å; D266-T268 PolarHBondContact OD1-N 3.24Å; D266-T268 PolarHBondContact OD1-OG1 3.19Å; D266-T268 PolarHBondContact OD2-OG1 3.23Å; D266-T269 CarbonylContact O-C 3.5Å; D266-T269 PolarHBondContact O-N 2.95Å; D266-L270 PolarHBondContact O-N 3.01Å; D266-L270 VanDerWaalsContact O-N 3.15Å
267	K	93.8	Very high	97.3	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.017	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-59.6	-30.4	179.1	68.8	-175.9	172.8	-65.9	0	113.4	V97 A100 K101 V243 P244 L245 T269 L270	V97-K267 WeakPolarHBondContact O-CE 3.44Å; A100-K267 WeakPolarHBondContact O-CE 3.22Å; A100-K267 PolarHBondContact O-NZ 2.9Å; K101-K267 PolarHBondContact O-NZ 2.99Å; V243-K267 HydrophobicContact CG1-CB 3.89Å; P244-K267 PolarHBondContact O-NZ 3.44Å; P244-K267 VanDerWaalsContact O-NZ 3.11Å; L245-K267 HydrophobicContact CB-CD 4.48Å; L245-K267 HydrophobicContact CD2-CB 4.43Å; L245-K267 HydrophobicContact CD2-CD 3.58Å; L245-K267 WeakPolarHBondContact O-CE 3.43Å; L245-K267 PolarHBondContact O-NZ 2.91Å; K267-T269 VanDerWaalsContact C-N 3.26Å; K267-T269 PolarHBondContact O-N 3.11Å; K267-L270 PolarHBondContact O-N 3.23Å
268	T	92	Very high	97.4	Very high	54 Å²	54	50.9 Å²	50.9	33%	0.331	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-76.8	-17.8	-175.7	64.2	0	0	0	0	112.5	K101 D266	K101-T268 HydrophobicContact CG-CG2 3.91Å; D266-T268 VanDerWaalsContact CG-OG1 3.25Å; D266-T268 PolarHBondContact O-N 3.25Å; D266-T268 WeakPolarHBondContact OD1-CB 3.5Å; D266-T268 PolarHBondContact OD1-N 3.24Å; D266-T268 PolarHBondContact OD1-OG1 3.19Å; D266-T268 PolarHBondContact OD2-OG1 3.23Å
269	T	93.8	Very high	97.4	Very high	90 Å²	90	45.1 Å²	45.1	55%	0.552	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-123.3	24.5	177.3	65.8	0	0	0	0	111.1	D266 K267 T271	D266-T269 CarbonylContact O-C 3.5Å; D266-T269 PolarHBondContact O-N 2.95Å; K267-T269 VanDerWaalsContact C-N 3.26Å; K267-T269 PolarHBondContact O-N 3.11Å; T269-T271 PolarHBondContact O-N 2.97Å
270	L	96.8	Very high	97.4	Very high	20 Å²	20	42.4 Å²	42.4	11%	0.105	22%	0.222	C	C	.	.			trans	-73.7	113.5	-177	-172.1	68.9	0	0	0	109.7	T168 V172 L265 D266 K267 L275	T168-L270 HydrophobicContact CG2-CD2 4.11Å; V172-L270 HydrophobicContact CG2-CD2 3.97Å; L265-L270 HydrophobicContact CB-CD1 4.15Å; L265-L270 HydrophobicContact CD1-CD1 3.72Å; D266-L270 PolarHBondContact O-N 3.01Å; D266-L270 VanDerWaalsContact O-N 3.15Å; K267-L270 PolarHBondContact O-N 3.23Å; L270-L275 HydrophobicContact CD1-CB 4.14Å
271	T	97.9	Very high	97.4	Very high	62 Å²	62	44 Å²	44	38%	0.38	23%	0.233	S	C	.	.			trans	-108.9	165.2	173	79.7	0	0	0	0	111	T269 E273 A274 L275	T269-T271 PolarHBondContact O-N 2.97Å; T271-E273 VanDerWaalsContact C-N 3.3Å; T271-E273 WeakPolarHBondContact CB-OE2 3.35Å; T271-E273 PolarHBondContact O-N 3.36Å; T271-E273 PolarHBondContact OG1-N 3.19Å; T271-E273 PolarHBondContact OG1-OE2 3.35Å; T271-A274 PolarHBondContact O-N 3.43Å; T271-A274 WeakPolarHBondContact OG1-CB 3.25Å; T271-A274 PolarHBondContact OG1-N 3.36Å; T271-A274 VanDerWaalsContact OG1-N 3.12Å; T271-L275 PolarHBondContact O-N 3.14Å
272	K	98	Very high	97.4	Very high	63 Å²	63	43.8 Å²	43.8	27%	0.274	23%	0.233	S	C	.	.	H	α-helix	trans	-52.8	-49.6	172.7	173.2	-171.8	180	169.2	0	111.2	S174 A175 N178 L275 Y276	S174-K272 VanDerWaalsContact O-CE 3.31Å; S174-K272 WeakPolarHBondContact O-CE 3.43Å; A175-K272 HydrophobicContact CB-CG 4.42Å; N178-K272 VanDerWaalsContact ND2-CE 3.27Å; N178-K272 WeakPolarHBondContact ND2-CE 3.09Å; N178-K272 PolarHBondContact ND2-NZ 3.1Å; K272-L275 PolarHBondContact O-N 3.23Å; K272-Y276 VanDerWaalsContact O-CB 3.23Å; K272-Y276 WeakPolarHBondContact O-CB 3.04Å; K272-Y276 PolarHBondContact O-N 3.15Å
273	E	98.5	Very high	97.4	Very high	108 Å²	108	44.8 Å²	44.8	51%	0.505	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-43.9	-175.3	-58.2	68.1	-145.3	0	0	110.6	T271 L275 Y276 N277	T271-E273 VanDerWaalsContact C-N 3.3Å; T271-E273 WeakPolarHBondContact CB-OE2 3.35Å; T271-E273 PolarHBondContact O-N 3.36Å; T271-E273 PolarHBondContact OG1-N 3.19Å; T271-E273 PolarHBondContact OG1-OE2 3.35Å; E273-L275 VanDerWaalsContact C-N 3.34Å; E273-L275 PolarHBondContact O-N 3.46Å; E273-Y276 PolarHBondContact O-N 3.42Å; E273-N277 VanDerWaalsContact O-CB 3.23Å; E273-N277 WeakPolarHBondContact O-CB 3.29Å; E273-N277 PolarHBondContact O-N 2.93Å; E273-N277 PolarHBondContact O-ND2 3.36Å; E273-N277 VanDerWaalsContact O-ND2 3.14Å
274	A	98.4	Very high	97.4	Very high	32 Å²	32	47.3 Å²	47.3	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-60	-46	178.2	0	0	0	0	0	111.1	T271 T278	T271-A274 PolarHBondContact O-N 3.43Å; T271-A274 WeakPolarHBondContact OG1-CB 3.25Å; T271-A274 PolarHBondContact OG1-N 3.36Å; T271-A274 VanDerWaalsContact OG1-N 3.12Å; A274-T278 VanDerWaalsContact O-CB 3.26Å; A274-T278 WeakPolarHBondContact O-CB 3.17Å; A274-T278 PolarHBondContact O-N 3.41Å; A274-T278 PolarHBondContact O-OG1 2.93Å
275	L	98.7	Very high	97.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-50	178.5	-177.6	59	0	0	0	111.9	V172 A175 F176 I222 V241 L265 L270 T271 K272 E273 N277 T278 I279	V172-L275 HydrophobicContact CB-CD2 4.19Å; V172-L275 HydrophobicContact CG1-CD2 4.28Å; V172-L275 HydrophobicContact CG2-CD2 3.86Å; A175-L275 HydrophobicContact CB-CB 4.16Å; A175-L275 HydrophobicContact CB-CD2 3.9Å; A175-L275 HydrophobicContact CB-CG 4.08Å; F176-L275 HydrophobicContact CE1-CD2 4.46Å; I222-L275 HydrophobicContact CD1-CD1 4.49Å; V241-L275 HydrophobicContact CG1-CD1 4.32Å; L265-L275 HydrophobicContact CD1-CD1 4Å; L270-L275 HydrophobicContact CD1-CB 4.14Å; T271-L275 PolarHBondContact O-N 3.14Å; K272-L275 PolarHBondContact O-N 3.23Å; E273-L275 VanDerWaalsContact C-N 3.34Å; E273-L275 PolarHBondContact O-N 3.46Å; L275-N277 PolarHBondContact O-N 3.47Å; L275-T278 PolarHBondContact O-N 2.68Å; L275-I279 HydrophobicContact CD1-CD1 3.9Å; L275-I279 HydrophobicContact CD1-CG1 4.16Å; L275-I279 HydrophobicContact CG-CD1 3.78Å; L275-I279 HydrophobicContact CG-CG1 4.45Å; L275-I279 VanDerWaalsContact O-CG1 3.32Å; L275-I279 WeakPolarHBondContact O-CG1 3.1Å; L275-I279 PolarHBondContact O-N 3.06Å
276	Y	98.7	Very high	97.4	Very high	71 Å²	71	52.7 Å²	52.7	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-56	-52.9	179.9	176.2	-91	0	0	0	111.8	N178 L179 K272 E273 T278 I279 I280	N178-Y276 HydrophobicContact CB-CD2 4.02Å; N178-Y276 HydrophobicContact CB-CE2 3.87Å; N178-Y276 WeakPolarHBondContact O-CE2 3.34Å; L179-Y276 HydrophobicContact CD1-CD2 4.41Å; L179-Y276 HydrophobicContact CD2-CD2 3.82Å; L179-Y276 HydrophobicContact CD2-CE2 3.59Å; L179-Y276 HydrophobicContact CG-CD2 3.85Å; L179-Y276 HydrophobicContact CG-CE2 3.92Å; K272-Y276 VanDerWaalsContact O-CB 3.23Å; K272-Y276 WeakPolarHBondContact O-CB 3.04Å; K272-Y276 PolarHBondContact O-N 3.15Å; E273-Y276 PolarHBondContact O-N 3.42Å; Y276-T278 VanDerWaalsContact C-N 3.28Å; Y276-T278 PolarHBondContact O-N 2.62Å; Y276-I279 WeakPolarHBondContact O-CB 3.29Å; Y276-I279 PolarHBondContact O-N 2.96Å; Y276-I280 HydrophobicContact CD1-CG1 4.43Å; Y276-I280 HydrophobicContact CE1-CG1 4Å; Y276-I280 HydrophobicContact CE2-CG1 4.42Å; Y276-I280 WeakPolarHBondContact O-CG1 3.5Å; Y276-I280 PolarHBondContact O-N 3.46Å
277	N	98.7	Very high	97.6	Very high	95 Å²	95	55.3 Å²	55.3	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-38.3	-178.4	-70.1	-26.6	0	0	0	111.5	E273 L275 A281	E273-N277 VanDerWaalsContact O-CB 3.23Å; E273-N277 WeakPolarHBondContact O-CB 3.29Å; E273-N277 PolarHBondContact O-N 2.93Å; E273-N277 PolarHBondContact O-ND2 3.36Å; E273-N277 VanDerWaalsContact O-ND2 3.14Å; L275-N277 PolarHBondContact O-N 3.47Å; N277-A281 VanDerWaalsContact O-CB 3.22Å; N277-A281 WeakPolarHBondContact O-CB 3.29Å; N277-A281 PolarHBondContact O-N 2.89Å
278	T	98.8	Very high	97.8	Very high	16 Å²	16	56.1 Å²	56.1	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-68.5	-40	177.9	-57.2	0	0	0	0	111.8	V241 I263 L265 A274 L275 Y276 A281 V282	V241-T278 HydrophobicContact CB-CG2 4.49Å; V241-T278 HydrophobicContact CG1-CG2 3.9Å; V241-T278 HydrophobicContact CG2-CG2 3.88Å; I263-T278 HydrophobicContact CB-CG2 3.63Å; I263-T278 HydrophobicContact CD1-CG2 4.12Å; I263-T278 HydrophobicContact CG1-CG2 4.44Å; I263-T278 HydrophobicContact CG2-CG2 3.69Å; L265-T278 HydrophobicContact CD1-CG2 4.19Å; L265-T278 HydrophobicContact CD2-CG2 4.46Å; L265-T278 HydrophobicContact CG-CG2 4.26Å; A274-T278 VanDerWaalsContact O-CB 3.26Å; A274-T278 WeakPolarHBondContact O-CB 3.17Å; A274-T278 PolarHBondContact O-N 3.41Å; A274-T278 PolarHBondContact O-OG1 2.93Å; L275-T278 PolarHBondContact O-N 2.68Å; Y276-T278 VanDerWaalsContact C-N 3.28Å; Y276-T278 PolarHBondContact O-N 2.62Å; T278-A281 PolarHBondContact O-N 3.22Å; T278-V282 HydrophobicContact CG2-CG2 4.31Å; T278-V282 WeakPolarHBondContact O-CG2 3.34Å; T278-V282 PolarHBondContact O-N 3.35Å
279	I	98.8	Very high	98.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.5	-52.1	174.9	-75	167.3	0	0	0	110.1	I151 F176 L179 L220 I222 V241 L275 Y276 A281 V282 A283	I151-I279 HydrophobicContact CD1-CG2 3.54Å; F176-I279 HydrophobicContact CD1-CD1 4.43Å; F176-I279 HydrophobicContact CE1-CD1 4.04Å; L179-I279 HydrophobicContact CD1-CB 4.31Å; L179-I279 HydrophobicContact CD1-CD1 3.6Å; L179-I279 HydrophobicContact CD1-CG2 3.79Å; L179-I279 HydrophobicContact CD2-CG2 4.03Å; L220-I279 HydrophobicContact CD2-CB 4.04Å; L220-I279 HydrophobicContact CD2-CG1 3.88Å; L220-I279 HydrophobicContact CD2-CG2 3.76Å; I222-I279 HydrophobicContact CD1-CD1 3.7Å; I222-I279 HydrophobicContact CD1-CG1 4.03Å; V241-I279 HydrophobicContact CG2-CG1 4.39Å; L275-I279 HydrophobicContact CD1-CD1 3.9Å; L275-I279 HydrophobicContact CD1-CG1 4.16Å; L275-I279 HydrophobicContact CG-CD1 3.78Å; L275-I279 HydrophobicContact CG-CG1 4.45Å; L275-I279 VanDerWaalsContact O-CG1 3.32Å; L275-I279 WeakPolarHBondContact O-CG1 3.1Å; L275-I279 PolarHBondContact O-N 3.06Å; Y276-I279 WeakPolarHBondContact O-CB 3.29Å; Y276-I279 PolarHBondContact O-N 2.96Å; I279-A281 PolarHBondContact O-N 3.06Å; I279-V282 PolarHBondContact O-N 2.79Å; I279-A283 WeakPolarHBondContact O-CB 3.46Å; I279-A283 PolarHBondContact O-N 3.37Å
280	I	98.6	Very high	98.4	Very high	35 Å²	35	57.5 Å²	57.5	18%	0.179	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-47.8	178.5	-64.6	-58.7	0	0	0	110.5	L179 Y182 Y276 V282 A283 E284	L179-I280 HydrophobicContact CD2-CD1 3.65Å; L179-I280 HydrophobicContact CD2-CG1 4.26Å; Y182-I280 HydrophobicContact CE2-CD1 4.23Å; Y276-I280 HydrophobicContact CD1-CG1 4.43Å; Y276-I280 HydrophobicContact CE1-CG1 4Å; Y276-I280 HydrophobicContact CE2-CG1 4.42Å; Y276-I280 WeakPolarHBondContact O-CG1 3.5Å; Y276-I280 PolarHBondContact O-N 3.46Å; I280-V282 VanDerWaalsContact C-N 3.31Å; I280-V282 PolarHBondContact O-N 2.93Å; I280-A283 PolarHBondContact O-N 3.06Å; I280-E284 HydrophobicContact CG2-CG 4.35Å; I280-E284 WeakPolarHBondContact CG2-OE2 3.46Å; I280-E284 WeakPolarHBondContact O-CB 3.16Å; I280-E284 PolarHBondContact O-N 3.42Å
281	A	98.6	Very high	98.5	Very high	43 Å²	43	63.2 Å²	63.2	36%	0.355	30%	0.303	S	S	.	.	H	α-helix	trans	-59.4	-38.3	-179.2	0	0	0	0	0	113.3	I263 N277 T278 I279 N285 Y288	I263-A281 HydrophobicContact CD1-CB 4.26Å; N277-A281 VanDerWaalsContact O-CB 3.22Å; N277-A281 WeakPolarHBondContact O-CB 3.29Å; N277-A281 PolarHBondContact O-N 2.89Å; T278-A281 PolarHBondContact O-N 3.22Å; I279-A281 PolarHBondContact O-N 3.06Å; A281-N285 WeakPolarHBondContact O-CB 3.47Å; A281-Y288 WeakPolarHBondContact O-CE2 3.36Å
282	V	98.8	Very high	98.5	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-84.5	-42.1	-179.3	-177.9	0	0	0	0	111.9	L220 P239 V241 I263 T278 I279 I280 Y288	L220-V282 HydrophobicContact CD1-CB 3.8Å; L220-V282 HydrophobicContact CD1-CG1 3.38Å; P239-V282 HydrophobicContact CB-CG1 3.55Å; V241-V282 HydrophobicContact CG2-CG2 4.35Å; I263-V282 HydrophobicContact CB-CG2 4.09Å; I263-V282 HydrophobicContact CD1-CG2 3.81Å; I263-V282 HydrophobicContact CG1-CG2 3.79Å; T278-V282 HydrophobicContact CG2-CG2 4.31Å; T278-V282 WeakPolarHBondContact O-CG2 3.34Å; T278-V282 PolarHBondContact O-N 3.35Å; I279-V282 PolarHBondContact O-N 2.79Å; I280-V282 VanDerWaalsContact C-N 3.31Å; I280-V282 PolarHBondContact O-N 2.93Å; V282-Y288 HydrophobicContact CB-CD2 4.25Å; V282-Y288 HydrophobicContact CB-CE2 4.45Å; V282-Y288 HydrophobicContact CG1-CD2 4.06Å; V282-Y288 HydrophobicContact CG1-CG 4.01Å; V282-Y288 HydrophobicContact CG2-CD2 4.38Å; V282-Y288 HydrophobicContact CG2-CE2 4.18Å
283	A	98.3	Very high	98.5	Very high	24 Å²	24	59.3 Å²	59.3	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-71.3	-36.1	-176.9	0	0	0	0	0	113	L220 I279 I280	L220-A283 HydrophobicContact CD2-CB 4.37Å; I279-A283 WeakPolarHBondContact O-CB 3.46Å; I279-A283 PolarHBondContact O-N 3.37Å; I280-A283 PolarHBondContact O-N 3.06Å
284	E	97.8	Very high	98.5	Very high	102 Å²	102	61.4 Å²	61.4	48%	0.477	30%	0.296	S	S	.	.	S	Bend	trans	-93.5	-13.8	-176.1	-58.3	-165.3	149.1	0	0	113	K148 Y182 I280	K148-E284 IonicContact NZ-OE1 2.72Å; K148-E284 PolarHBondContact NZ-OE1 3.26Å; Y182-E284 WeakPolarHBondContact OH-CG 3.49Å; I280-E284 HydrophobicContact CG2-CG 4.35Å; I280-E284 WeakPolarHBondContact CG2-OE2 3.46Å; I280-E284 WeakPolarHBondContact O-CB 3.16Å; I280-E284 PolarHBondContact O-N 3.42Å
285	N	98.2	Very high	98.4	Very high	66 Å²	66	62.9 Å²	62.9	35%	0.353	30%	0.297	S	S	.	.			trans	-96.3	106.4	177.6	-166.3	-31.6	0	0	0	112.3	A281 K287 Y288	A281-N285 WeakPolarHBondContact O-CB 3.47Å; N285-K287 PolarHBondContact O-N 3.45Å; N285-K287 WeakPolarHBondContact OD1-CB 3.44Å; N285-K287 WeakPolarHBondContact OD1-CD 3Å; N285-K287 WeakPolarHBondContact OD1-CG 3.5Å; N285-K287 PolarHBondContact OD1-N 3.41Å; N285-K287 VanDerWaalsContact OD1-N 3.11Å; N285-Y288 HydrophobicContact CB-CD2 3.96Å; N285-Y288 HydrophobicContact CB-CE2 3.99Å; N285-Y288 WeakPolarHBondContact O-CD2 3.49Å; N285-Y288 PolarHBondContact O-N 2.91Å
286	R	97.5	Very high	98.3	Very high	182 Å²	182	67.7 Å²	67.7	69%	0.687	32%	0.315	S	S	*	.	H	α-helix	trans	-57	-22.8	-177.1	-151.3	174.9	77.3	176.1	5.4	114.1	Y288 K289 E290	R286-Y288 PolarHBondContact O-N 3.35Å; R286-K289 PolarHBondContact O-N 3.39Å; R286-K289 VanDerWaalsContact O-N 3.12Å; R286-E290 HydrophobicContact CG-CG 4.2Å; R286-E290 IonicContact CZ-OE1 2.79Å; R286-E290 IonicContact NE-OE1 3.78Å; R286-E290 PolarHBondContact NE-OE1 2.99Å; R286-E290 IonicContact NH2-OE1 2.79Å; R286-E290 PolarHBondContact NH2-OE1 3.16Å; R286-E290 WeakPolarHBondContact O-CG 3.14Å; R286-E290 PolarHBondContact O-N 3.27Å
287	K	98.4	Very high	98.2	Very high	91 Å²	91	66.4 Å²	66.4	40%	0.396	32%	0.323	S	S	.	.	H	α-helix	trans	-55.6	-36.2	-179.8	82.6	-172.7	175.5	-179.5	0	112.7	N285 R291	N285-K287 PolarHBondContact O-N 3.45Å; N285-K287 WeakPolarHBondContact OD1-CB 3.44Å; N285-K287 WeakPolarHBondContact OD1-CD 3Å; N285-K287 WeakPolarHBondContact OD1-CG 3.5Å; N285-K287 PolarHBondContact OD1-N 3.41Å; N285-K287 VanDerWaalsContact OD1-N 3.11Å; K287-R291 WeakPolarHBondContact O-CB 3.45Å; K287-R291 VanDerWaalsContact O-CG 3.3Å; K287-R291 WeakPolarHBondContact O-CG 3.18Å; K287-R291 PolarHBondContact O-N 3.24Å
288	Y	98.8	Very high	98	Very high	22 Å²	22	67.1 Å²	67.1	9%	0.086	32%	0.324	C	S	.	.	H	α-helix	trans	-70.3	-44	-178.9	-63.3	-76.6	0	0	0	110.7	G260 I263 A281 V282 N285 R286 R291 I292	G260-Y288 WeakPolarHBondContact O-CA 3.49Å; G260-Y288 VanDerWaalsContact O-CD1 3.29Å; G260-Y288 WeakPolarHBondContact O-CD1 3.34Å; I263-Y288 WeakPolarHBondContact CD1-OH 3.23Å; I263-Y288 HydrophobicContact CG1-CE1 4.2Å; A281-Y288 WeakPolarHBondContact O-CE2 3.36Å; V282-Y288 HydrophobicContact CB-CD2 4.25Å; V282-Y288 HydrophobicContact CB-CE2 4.45Å; V282-Y288 HydrophobicContact CG1-CD2 4.06Å; V282-Y288 HydrophobicContact CG1-CG 4.01Å; V282-Y288 HydrophobicContact CG2-CD2 4.38Å; V282-Y288 HydrophobicContact CG2-CE2 4.18Å; N285-Y288 HydrophobicContact CB-CD2 3.96Å; N285-Y288 HydrophobicContact CB-CE2 3.99Å; N285-Y288 WeakPolarHBondContact O-CD2 3.49Å; N285-Y288 PolarHBondContact O-N 2.91Å; R286-Y288 PolarHBondContact O-N 3.35Å; Y288-R291 PolarHBondContact O-N 3.07Å; Y288-I292 WeakPolarHBondContact O-CG2 3.12Å; Y288-I292 PolarHBondContact O-N 3.01Å
289	K	98.5	Very high	97.5	Very high	82 Å²	82	69.1 Å²	69.1	36%	0.357	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-44	175.4	-175.4	65.8	176.7	-170.5	0	111.6	A237 P239 R286 I292 A293	A237-K289 WeakPolarHBondContact O-CD 3.23Å; A237-K289 VanDerWaalsContact O-CE 3.24Å; A237-K289 WeakPolarHBondContact O-CE 3.16Å; A237-K289 PolarHBondContact O-NZ 2.95Å; P239-K289 HydrophobicContact CG-CB 3.96Å; P239-K289 HydrophobicContact CG-CD 4.16Å; R286-K289 PolarHBondContact O-N 3.39Å; R286-K289 VanDerWaalsContact O-N 3.12Å; K289-I292 WeakPolarHBondContact O-CG2 2.85Å; K289-A293 WeakPolarHBondContact O-CB 3.43Å; K289-A293 PolarHBondContact O-N 3.43Å
290	E	98.6	Very high	97.1	Very high	91 Å²	91	72.1 Å²	72.1	43%	0.425	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-45.6	177.9	-72.5	170.8	169.7	0	0	112.1	R286 A293 K294	R286-E290 HydrophobicContact CG-CG 4.2Å; R286-E290 IonicContact CZ-OE1 2.79Å; R286-E290 IonicContact NE-OE1 3.78Å; R286-E290 PolarHBondContact NE-OE1 2.99Å; R286-E290 IonicContact NH2-OE1 2.79Å; R286-E290 PolarHBondContact NH2-OE1 3.16Å; R286-E290 WeakPolarHBondContact O-CG 3.14Å; R286-E290 PolarHBondContact O-N 3.27Å; E290-A293 PolarHBondContact O-N 2.9Å; E290-K294 WeakPolarHBondContact O-CB 3.36Å; E290-K294 PolarHBondContact O-N 3.06Å
291	R	98.7	Very high	96.8	Very high	140 Å²	140	77.3 Å²	77.3	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-66	-45.3	-179.4	-76.8	-175.6	174.4	-119.5	1.8	112.3	H259 G260 F261 K287 Y288 K294 F295	H259-R291 WeakPolarHBondContact O-CD 3.15Å; G260-R291 WeakPolarHBondContact O-CB 3.24Å; F261-R291 HydrophobicContact CD1-CB 4.22Å; F261-R291 HydrophobicContact CE1-CB 4.39Å; K287-R291 WeakPolarHBondContact O-CB 3.45Å; K287-R291 VanDerWaalsContact O-CG 3.3Å; K287-R291 WeakPolarHBondContact O-CG 3.18Å; K287-R291 PolarHBondContact O-N 3.24Å; Y288-R291 PolarHBondContact O-N 3.07Å; R291-K294 PolarHBondContact O-N 3.37Å; R291-F295 PolarHBondContact O-N 3.07Å
292	I	98.5	Very high	96.3	Very high	1 Å²	1	79.9 Å²	79.9	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-69.7	-35	178	-160.2	177.1	0	0	0	111.8	A233 V234 A237 T238 P239 F261 Y288 K289 F295 R296	A233-I292 HydrophobicContact CB-CD1 4.26Å; A233-I292 WeakPolarHBondContact O-CD1 3.48Å; V234-I292 HydrophobicContact CG2-CD1 4.41Å; V234-I292 HydrophobicContact CG2-CG1 4.33Å; A237-I292 HydrophobicContact CB-CG2 4.21Å; A237-I292 WeakPolarHBondContact O-CG2 3.47Å; T238-I292 WeakPolarHBondContact O-CD1 3.12Å; P239-I292 HydrophobicContact CG-CG2 4.38Å; F261-I292 HydrophobicContact CB-CB 4.2Å; F261-I292 HydrophobicContact CB-CD1 4.15Å; F261-I292 HydrophobicContact CB-CG1 4.22Å; F261-I292 HydrophobicContact CD1-CB 3.76Å; F261-I292 HydrophobicContact CD1-CG1 4.07Å; F261-I292 HydrophobicContact CD2-CG1 4.34Å; F261-I292 HydrophobicContact CE1-CB 4.41Å; F261-I292 HydrophobicContact CG-CB 4.04Å; F261-I292 HydrophobicContact CG-CD1 4.35Å; F261-I292 HydrophobicContact CG-CG1 3.96Å; Y288-I292 WeakPolarHBondContact O-CG2 3.12Å; Y288-I292 PolarHBondContact O-N 3.01Å; K289-I292 WeakPolarHBondContact O-CG2 2.85Å; I292-F295 PolarHBondContact O-N 3.19Å; I292-R296 WeakPolarHBondContact O-CB 3.12Å; I292-R296 PolarHBondContact O-N 3.24Å
293	A	98.3	Very high	95.9	Very high	41 Å²	41	88.5 Å²	88.5	34%	0.339	43%	0.428	S	S	.	.	H	α-helix	trans	-67	-40.3	174.5	0	0	0	0	0	112.4	A237 K289 E290 F295 R296 G297	A237-A293 HydrophobicContact CB-CB 3.98Å; K289-A293 WeakPolarHBondContact O-CB 3.43Å; K289-A293 PolarHBondContact O-N 3.43Å; E290-A293 PolarHBondContact O-N 2.9Å; A293-F295 VanDerWaalsContact C-N 3.34Å; A293-R296 WeakPolarHBondContact O-CB 3.35Å; A293-R296 PolarHBondContact O-N 2.63Å; A293-G297 PolarHBondContact O-N 3.13Å
294	K	98.4	Very high	95.6	Very high	153 Å²	153	90.8 Å²	90.8	67%	0.665	44%	0.436	S	S	*	.	H	α-helix	trans	-60.4	-45.5	172.4	-179.1	175.7	175.5	174.9	0	110.9	E290 R291 G297 M298	E290-K294 WeakPolarHBondContact O-CB 3.36Å; E290-K294 PolarHBondContact O-N 3.06Å; R291-K294 PolarHBondContact O-N 3.37Å; K294-G297 PolarHBondContact O-N 2.8Å; K294-M298 PolarHBondContact O-N 3.18Å; K294-M298 VanDerWaalsContact O-N 3.15Å
295	F	97.4	Very high	95.2	Very high	63 Å²	63	88.5 Å²	88.5	28%	0.276	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-42.6	177.3	-172.1	-110.8	0	0	0	112.5	V234 F261 R291 I292 A293 G297 M298 I299	V234-F295 HydrophobicContact CB-CD1 4.4Å; V234-F295 HydrophobicContact CG1-CD1 3.48Å; V234-F295 VanDerWaalsContact CG1-CD1 3.48Å; V234-F295 HydrophobicContact CG1-CE1 3.87Å; V234-F295 HydrophobicContact CG2-CD1 3.93Å; V234-F295 HydrophobicContact CG2-CE1 4.09Å; F261-F295 HydrophobicContact CE1-CB 3.71Å; F261-F295 HydrophobicContact CE1-CD1 4.49Å; F261-F295 HydrophobicContact CE1-CG 4.16Å; F261-F295 HydrophobicContact CE2-CB 4.42Å; F261-F295 AromaticContact CE2-CD1 3.7Å; F261-F295 HydrophobicContact CE2-CD1 3.7Å; F261-F295 HydrophobicContact CE2-CE1 4.18Å; F261-F295 HydrophobicContact CE2-CG 4.08Å; F261-F295 HydrophobicContact CZ-CB 3.45Å; F261-F295 VanDerWaalsContact CZ-CB 3.45Å; F261-F295 AromaticContact CZ-CD1 3.49Å; F261-F295 HydrophobicContact CZ-CD1 3.49Å; F261-F295 VanDerWaalsContact CZ-CD1 3.49Å; F261-F295 HydrophobicContact CZ-CD2 4.02Å; F261-F295 HydrophobicContact CZ-CE1 4.26Å; F261-F295 AromaticContact CZ-CG 3.37Å; F261-F295 HydrophobicContact CZ-CG 3.37Å; R291-F295 PolarHBondContact O-N 3.07Å; I292-F295 PolarHBondContact O-N 3.19Å; A293-F295 VanDerWaalsContact C-N 3.34Å; F295-G297 VanDerWaalsContact C-N 3.28Å; F295-G297 PolarHBondContact O-N 3.22Å; F295-M298 HydrophobicContact CB-CE 4.25Å; F295-M298 HydrophobicContact CD2-CE 3.6Å; F295-M298 HydrophobicContact CE2-CE 4.45Å; F295-M298 HydrophobicContact CG-CE 4.38Å; F295-M298 PolarHBondContact O-N 3.06Å; F295-M298 VanDerWaalsContact O-N 3.14Å; F295-I299 HydrophobicContact CD1-CG2 4.24Å; F295-I299 HydrophobicContact CD2-CG2 4.48Å; F295-I299 HydrophobicContact CE1-CG2 3.74Å; F295-I299 HydrophobicContact CE2-CG2 4.01Å; F295-I299 HydrophobicContact CZ-CG2 3.6Å; F295-I299 PolarHBondContact O-N 3.18Å
296	R	95.6	Very high	94.8	Very high	102 Å²	102	85.7 Å²	85.7	39%	0.385	41%	0.413	S	S	.	.	H	α-helix	trans	-52.7	-46.9	170.2	179.9	-174.7	167.4	174.1	1.6	111.6	V234 C235 A237 I292 A293 M298 I299 S300	V234-R296 HydrophobicContact CG1-CB 4.38Å; V234-R296 VanDerWaalsContact O-CB 3.31Å; V234-R296 WeakPolarHBondContact O-CB 3.5Å; V234-R296 WeakPolarHBondContact O-CD 3.38Å; V234-R296 WeakPolarHBondContact O-CG 3.3Å; C235-R296 VanDerWaalsContact O-CD 3.32Å; C235-R296 WeakPolarHBondContact O-CD 3.45Å; C235-R296 PolarHBondContact O-NE 3.42Å; C235-R296 PolarHBondContact O-NH1 3.11Å; A237-R296 HydrophobicContact CB-CB 4.22Å; I292-R296 WeakPolarHBondContact O-CB 3.12Å; I292-R296 PolarHBondContact O-N 3.24Å; A293-R296 WeakPolarHBondContact O-CB 3.35Å; A293-R296 PolarHBondContact O-N 2.63Å; R296-M298 VanDerWaalsContact C-N 3.32Å; R296-M298 PolarHBondContact O-N 3.28Å; R296-I299 WeakPolarHBondContact O-CG1 3.41Å; R296-I299 PolarHBondContact O-N 3.13Å; R296-S300 VanDerWaalsContact O-CB 3.29Å; R296-S300 WeakPolarHBondContact O-CB 3.36Å; R296-S300 PolarHBondContact O-N 3Å; R296-S300 PolarHBondContact O-OG 3.37Å
297	G	95.8	Very high	94.5	Very high	44 Å²	44	78 Å²	78	45%	0.454	39%	0.386	S	S	.	.	H	α-helix	trans	-55.7	-47.2	177.6	0	0	0	0	0	111.9	A293 K294 F295 S300 D301	A293-G297 PolarHBondContact O-N 3.13Å; K294-G297 PolarHBondContact O-N 2.8Å; F295-G297 VanDerWaalsContact C-N 3.28Å; F295-G297 PolarHBondContact O-N 3.22Å; G297-S300 PolarHBondContact O-N 3.26Å; G297-D301 PolarHBondContact O-N 2.99Å
298	M	94.7	Very high	94.2	Very high	109 Å²	109	75.4 Å²	75.4	54%	0.537	38%	0.38	S	S	.	.	H	α-helix	trans	-64.7	-44	178.6	-64.1	-175.4	-63.5	0	0	112.9	K294 F295 R296 S300 D301	K294-M298 PolarHBondContact O-N 3.18Å; K294-M298 VanDerWaalsContact O-N 3.15Å; F295-M298 HydrophobicContact CB-CE 4.25Å; F295-M298 HydrophobicContact CD2-CE 3.6Å; F295-M298 HydrophobicContact CE2-CE 4.45Å; F295-M298 HydrophobicContact CG-CE 4.38Å; F295-M298 PolarHBondContact O-N 3.06Å; F295-M298 VanDerWaalsContact O-N 3.14Å; R296-M298 VanDerWaalsContact C-N 3.32Å; R296-M298 PolarHBondContact O-N 3.28Å; M298-S300 VanDerWaalsContact C-N 3.3Å; M298-S300 PolarHBondContact O-N 3.46Å; M298-D301 PolarHBondContact O-N 3.22Å
299	I	89.5	Confident	93.9	Very high	58 Å²	58	76.3 Å²	76.3	30%	0.297	39%	0.386	S	S	.	.	H	α-helix	trans	-75.8	-20.3	-178.7	67.5	146.6	0	0	0	113.3	V234 F295 R296	V234-I299 HydrophobicContact CB-CD1 4.36Å; V234-I299 HydrophobicContact CG1-CD1 3.39Å; V234-I299 HydrophobicContact CG1-CG1 3.9Å; F295-I299 HydrophobicContact CD1-CG2 4.24Å; F295-I299 HydrophobicContact CD2-CG2 4.48Å; F295-I299 HydrophobicContact CE1-CG2 3.74Å; F295-I299 HydrophobicContact CE2-CG2 4.01Å; F295-I299 HydrophobicContact CZ-CG2 3.6Å; F295-I299 PolarHBondContact O-N 3.18Å; R296-I299 WeakPolarHBondContact O-CG1 3.41Å; R296-I299 PolarHBondContact O-N 3.13Å
300	S	89.3	Confident	93.5	Very high	63 Å²	63	72.4 Å²	72.4	44%	0.441	37%	0.369	S	S	.	.	H	α-helix	trans	-82.8	-19.8	175.7	-53.6	0	0	0	0	111.7	R296 G297 M298 R302	R296-S300 VanDerWaalsContact O-CB 3.29Å; R296-S300 WeakPolarHBondContact O-CB 3.36Å; R296-S300 PolarHBondContact O-N 3Å; R296-S300 PolarHBondContact O-OG 3.37Å; G297-S300 PolarHBondContact O-N 3.26Å; M298-S300 VanDerWaalsContact C-N 3.3Å; M298-S300 PolarHBondContact O-N 3.46Å; S300-R302 VanDerWaalsContact C-N 3.33Å; S300-R302 PolarHBondContact O-N 3.42Å
301	D	92.4	Very high	93.2	Very high	145 Å²	145	70.9 Å²	70.9	78%	0.775	36%	0.361	S	S	*	.			trans	-82	78.1	178.3	-167.3	9.9	0	0	0	110.5	G297 M298	G297-D301 PolarHBondContact O-N 2.99Å; M298-D301 PolarHBondContact O-N 3.22Å
302	R	88.7	Confident	92.8	Very high	97 Å²	97	68.6 Å²	68.6	37%	0.366	36%	0.355	S	S	.	.			trans	-132.6	147.8	-177.2	60.8	-171.4	171.5	166.8	6.7	110.6	E127 S300 I304	E127-R302 IonicContact OE1-CZ 2.83Å; E127-R302 IonicContact OE1-NH2 2.66Å; E127-R302 PolarHBondContact OE1-NH2 3.38Å; E127-R302 IonicContact OE2-CZ 2.68Å; E127-R302 IonicContact OE2-NH1 2.74Å; E127-R302 PolarHBondContact OE2-NH1 3.16Å; E127-R302 IonicContact OE2-NH2 3.08Å; E127-R302 PolarHBondContact OE2-NH2 3.21Å; S300-R302 VanDerWaalsContact C-N 3.33Å; S300-R302 PolarHBondContact O-N 3.42Å; R302-I304 VanDerWaalsContact C-N 3.31Å; R302-I304 WeakPolarHBondContact CD-O 3.47Å; R302-I304 WeakPolarHBondContact CG-O 3.43Å; R302-I304 PolarHBondContact O-N 3.05Å
303	I	90.7	Very high	92.3	Very high	182 Å²	182	72.1 Å²	72.1	93%	0.933	37%	0.368	S	S	*	.	S	Bend	trans	-63.5	-38.5	-178.7	-61.1	171.8	0	0	0	111.4
304	I	91.2	Very high	91.8	Very high	72 Å²	72	72.4 Å²	72.4	37%	0.369	36%	0.364	S	S	.	.	S	Bend	trans	-137.8	141.6	-177.3	-172.2	167	0	0	0	109	R302 S308 N309	R302-I304 VanDerWaalsContact C-N 3.31Å; R302-I304 WeakPolarHBondContact CD-O 3.47Å; R302-I304 WeakPolarHBondContact CG-O 3.43Å; R302-I304 PolarHBondContact O-N 3.05Å; I304-S308 VanDerWaalsContact CG1-CB 3.41Å; I304-N309 HydrophobicContact CG2-CB 3.99Å
305	D	90	Very high	91.3	Very high	55 Å²	55	65.5 Å²	65.5	29%	0.294	33%	0.334	S	S	.	.			trans	-69.4	160.5	176.1	72.6	87	0	0	0	111.9	T307 S308 N309	D305-T307 VanDerWaalsContact C-N 3.3Å; D305-T307 PolarHBondContact O-N 3.37Å; D305-T307 WeakPolarHBondContact OD1-CA 3.43Å; D305-T307 VanDerWaalsContact OD1-CB 3.29Å; D305-T307 WeakPolarHBondContact OD1-CB 3.32Å; D305-T307 PolarHBondContact OD1-N 2.79Å; D305-S308 PolarHBondContact O-N 3.47Å; D305-S308 PolarHBondContact OD1-N 3.5Å; D305-S308 PolarHBondContact OD1-OG 3.39Å; D305-S308 WeakPolarHBondContact OD2-CB 3.26Å; D305-S308 PolarHBondContact OD2-OG 3.48Å; D305-N309 WeakPolarHBondContact O-CB 3.49Å; D305-N309 PolarHBondContact O-N 3Å
306	A	89.5	Confident	90.8	Very high	6 Å²	6	65.1 Å²	65.1	5%	0.05	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-32	-171.3	0	0	0	0	0	112.2	V124 D125 E127 N309 G310	V124-A306 WeakPolarHBondContact CG1-O 3.22Å; D125-A306 HydrophobicContact CB-CB 4.01Å; D125-A306 VanDerWaalsContact O-CB 3.32Å; D125-A306 WeakPolarHBondContact O-CB 3.42Å; E127-A306 HydrophobicContact CB-CB 4.29Å; E127-A306 VanDerWaalsContact OE2-CB 3.24Å; E127-A306 WeakPolarHBondContact OE2-CB 3.34Å; E127-A306 PolarHBondContact OE2-N 3.04Å; A306-N309 PolarHBondContact O-N 2.93Å; A306-G310 PolarHBondContact O-N 2.99Å
307	T	91.8	Very high	90.2	Very high	20 Å²	20	64.8 Å²	64.8	12%	0.123	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-47.3	174.7	-60.9	0	0	0	0	110.1	P46 L47 A50 E127 D305 G310 K311	P46-T307 HydrophobicContact CB-CG2 4.42Å; L47-T307 WeakPolarHBondContact CD1-O 3.34Å; A50-T307 HydrophobicContact CB-CG2 3.62Å; E127-T307 WeakPolarHBondContact CB-OG1 2.96Å; E127-T307 WeakPolarHBondContact CG-OG1 3.1Å; D305-T307 VanDerWaalsContact C-N 3.3Å; D305-T307 PolarHBondContact O-N 3.37Å; D305-T307 WeakPolarHBondContact OD1-CA 3.43Å; D305-T307 VanDerWaalsContact OD1-CB 3.29Å; D305-T307 WeakPolarHBondContact OD1-CB 3.32Å; D305-T307 PolarHBondContact OD1-N 2.79Å; T307-G310 PolarHBondContact O-N 2.7Å; T307-K311 WeakPolarHBondContact O-CB 3.16Å; T307-K311 PolarHBondContact O-N 3.08Å
308	S	92.2	Very high	89.7	Confident	38 Å²	38	65 Å²	65	27%	0.266	32%	0.322	S	S	.	.	H	α-helix	trans	-66.8	-35.3	177.3	-62.1	0	0	0	0	112.6	I304 D305 K311 F312	I304-S308 VanDerWaalsContact CG1-CB 3.41Å; D305-S308 PolarHBondContact O-N 3.47Å; D305-S308 PolarHBondContact OD1-N 3.5Å; D305-S308 PolarHBondContact OD1-OG 3.39Å; D305-S308 WeakPolarHBondContact OD2-CB 3.26Å; D305-S308 PolarHBondContact OD2-OG 3.48Å; S308-K311 PolarHBondContact O-N 2.74Å; S308-F312 VanDerWaalsContact O-CB 3.32Å; S308-F312 WeakPolarHBondContact O-CB 3.46Å; S308-F312 PolarHBondContact O-N 3.29Å
309	N	91.4	Very high	89.4	Confident	40 Å²	40	64.5 Å²	64.5	21%	0.214	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-47.9	173.7	-174.2	54.6	0	0	0	111.4	I304 D305 A306 K311 F312 W313	I304-N309 HydrophobicContact CG2-CB 3.99Å; D305-N309 WeakPolarHBondContact O-CB 3.49Å; D305-N309 PolarHBondContact O-N 3Å; A306-N309 PolarHBondContact O-N 2.93Å; N309-K311 VanDerWaalsContact C-N 3.33Å; N309-K311 PolarHBondContact O-N 2.86Å; N309-F312 WeakPolarHBondContact O-CB 3.3Å; N309-F312 PolarHBondContact O-N 3.34Å; N309-W313 VanDerWaalsContact O-CD1 3.23Å; N309-W313 PolarHBondContact O-N 2.81Å; N309-W313 PolarHBondContact OD1-NE1 3.49Å; N309-W313 VanDerWaalsContact OD1-NE1 3.13Å
310	G	90.9	Very high	89.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-43.1	176.3	0	0	0	0	0	112.3	V124 A306 T307 F312 W313 I314	V124-G310 VanDerWaalsContact CG2-CA 3.44Å; A306-G310 PolarHBondContact O-N 2.99Å; T307-G310 PolarHBondContact O-N 2.7Å; G310-F312 VanDerWaalsContact C-N 3.35Å; G310-F312 PolarHBondContact O-N 3.47Å; G310-W313 PolarHBondContact O-N 2.85Å; G310-I314 WeakPolarHBondContact O-CB 3.48Å; G310-I314 VanDerWaalsContact O-CG1 3.29Å; G310-I314 WeakPolarHBondContact O-CG1 3.42Å; G310-I314 PolarHBondContact O-N 2.99Å
311	K	91.2	Very high	88.5	Confident	60 Å²	60	66.2 Å²	66.2	26%	0.261	32%	0.321	S	S	.	.	H	α-helix	trans	-58.5	-47.5	174.7	-166.3	-174	85	141.7	0	111.4	L47 A50 L51 D54 T307 S308 N309 W313 N315	L47-K311 HydrophobicContact CD1-CB 4.22Å; A50-K311 HydrophobicContact CB-CD 4Å; L51-K311 HydrophobicContact CD2-CB 4.45Å; L51-K311 HydrophobicContact CD2-CG 3.89Å; L51-K311 HydrophobicContact CG-CG 4.39Å; D54-K311 VanDerWaalsContact CG-NZ 3.34Å; D54-K311 IonicContact OD1-NZ 2.91Å; D54-K311 PolarHBondContact OD1-NZ 3.3Å; D54-K311 WeakPolarHBondContact OD2-CD 3.46Å; D54-K311 WeakPolarHBondContact OD2-CE 3.49Å; D54-K311 WeakPolarHBondContact OD2-CG 3.42Å; D54-K311 IonicContact OD2-NZ 3.1Å; D54-K311 PolarHBondContact OD2-NZ 2.9Å; D54-K311 VanDerWaalsContact OD2-NZ 3.08Å; T307-K311 WeakPolarHBondContact O-CB 3.16Å; T307-K311 PolarHBondContact O-N 3.08Å; S308-K311 PolarHBondContact O-N 2.74Å; N309-K311 VanDerWaalsContact C-N 3.33Å; N309-K311 PolarHBondContact O-N 2.86Å; K311-W313 PolarHBondContact O-N 3.13Å; K311-N315 WeakPolarHBondContact O-CB 3.27Å; K311-N315 VanDerWaalsContact O-CG 3.22Å; K311-N315 PolarHBondContact O-N 2.92Å; K311-N315 PolarHBondContact O-ND2 3.1Å
312	F	90.7	Very high	87.9	Confident	92 Å²	92	63.3 Å²	63.3	40%	0.404	31%	0.312	S	S	.	.	H	α-helix	trans	-57.6	-50.9	178.2	173.5	-92.9	0	0	0	111.8	S308 N309 G310 N315 F316	S308-F312 VanDerWaalsContact O-CB 3.32Å; S308-F312 WeakPolarHBondContact O-CB 3.46Å; S308-F312 PolarHBondContact O-N 3.29Å; N309-F312 WeakPolarHBondContact O-CB 3.3Å; N309-F312 PolarHBondContact O-N 3.34Å; G310-F312 VanDerWaalsContact C-N 3.35Å; G310-F312 PolarHBondContact O-N 3.47Å; F312-N315 PolarHBondContact O-N 3.01Å; F312-F316 HydrophobicContact CZ-CD2 4.39Å; F312-F316 VanDerWaalsContact O-CB 3.26Å; F312-F316 WeakPolarHBondContact O-CB 3.42Å; F312-F316 PolarHBondContact O-N 2.66Å
313	W	87.8	Confident	87.2	Confident	75 Å²	75	61.3 Å²	61.3	28%	0.284	31%	0.313	S	S	.	.	H	α-helix	trans	-68.7	-37.5	-176.6	-77.7	118.2	0	0	0	113.4	F122 N309 G310 K311 F316 Y317 M327	F122-W313 HydrophobicContact CB-CB 3.92Å; F122-W313 HydrophobicContact CB-CG 3.96Å; F122-W313 HydrophobicContact CD1-CB 4.15Å; F122-W313 AromaticContact CD1-CD2 3.36Å; F122-W313 HydrophobicContact CD1-CD2 3.36Å; F122-W313 AromaticContact CD1-CE2 3.83Å; F122-W313 AromaticContact CD1-CE3 3.5Å; F122-W313 HydrophobicContact CD1-CE3 3.5Å; F122-W313 VanDerWaalsContact CD1-CE3 3.5Å; F122-W313 AromaticContact CD1-CG 3.68Å; F122-W313 HydrophobicContact CD1-CG 3.68Å; F122-W313 HydrophobicContact CD1-CH2 4.42Å; F122-W313 HydrophobicContact CD1-CZ2 4.34Å; F122-W313 HydrophobicContact CD1-CZ3 4.04Å; F122-W313 HydrophobicContact CD2-CB 3.81Å; F122-W313 HydrophobicContact CD2-CD2 4.46Å; F122-W313 HydrophobicContact CD2-CE3 4.42Å; F122-W313 HydrophobicContact CD2-CG 4.25Å; F122-W313 AromaticContact CE1-CD2 3.46Å; F122-W313 HydrophobicContact CE1-CD2 3.46Å; F122-W313 VanDerWaalsContact CE1-CD2 3.46Å; F122-W313 AromaticContact CE1-CE3 3.02Å; F122-W313 HydrophobicContact CE1-CE3 3.02Å; F122-W313 HydrophobicContact CE1-CG 4.18Å; F122-W313 AromaticContact CE1-CH2 3.89Å; F122-W313 HydrophobicContact CE1-CH2 3.89Å; F122-W313 HydrophobicContact CE1-CZ2 4.26Å; F122-W313 AromaticContact CE1-CZ3 3.27Å; F122-W313 HydrophobicContact CE1-CZ3 3.27Å; F122-W313 HydrophobicContact CE2-CB 4.3Å; F122-W313 HydrophobicContact CE2-CE3 4.03Å; F122-W313 HydrophobicContact CG-CB 3.7Å; F122-W313 AromaticContact CG-CD2 3.89Å; F122-W313 HydrophobicContact CG-CD2 3.89Å; F122-W313 HydrophobicContact CG-CE3 4.16Å; F122-W313 AromaticContact CG-CG 3.7Å; F122-W313 HydrophobicContact CG-CG 3.7Å; F122-W313 HydrophobicContact CZ-CD2 4.03Å; F122-W313 AromaticContact CZ-CE3 3.3Å; F122-W313 HydrophobicContact CZ-CE3 3.3Å; F122-W313 AromaticContact CZ-CZ3 3.72Å; F122-W313 HydrophobicContact CZ-CZ3 3.72Å; N309-W313 VanDerWaalsContact O-CD1 3.23Å; N309-W313 PolarHBondContact O-N 2.81Å; N309-W313 PolarHBondContact OD1-NE1 3.49Å; N309-W313 VanDerWaalsContact OD1-NE1 3.13Å; G310-W313 PolarHBondContact O-N 2.85Å; K311-W313 PolarHBondContact O-N 3.13Å; W313-F316 HydrophobicContact CE3-CB 4.24Å; W313-F316 HydrophobicContact CE3-CD1 4.07Å; W313-F316 HydrophobicContact CE3-CG 4.17Å; W313-F316 HydrophobicContact CZ3-CD1 4.04Å; W313-F316 HydrophobicContact CZ3-CE1 4.32Å; W313-F316 HydrophobicContact CZ3-CG 4.24Å; W313-F316 PolarHBondContact O-N 3.47Å; W313-Y317 WeakPolarHBondContact O-CB 3.36Å; W313-Y317 PolarHBondContact O-N 3.37Å; W313-M327 HydrophobicContact CZ3-CE 4.4Å
314	I	87.8	Confident	86.3	Confident	47 Å²	47	52.7 Å²	52.7	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-48.2	174	-70.4	168.4	0	0	0	109.9	I29 L47 L51 G310 F316 Y317 L318	I29-I314 HydrophobicContact CD1-CG2 4Å; L47-I314 HydrophobicContact CD2-CD1 3.97Å; L47-I314 HydrophobicContact CG-CD1 4.46Å; L51-I314 HydrophobicContact CD1-CD1 3.68Å; L51-I314 HydrophobicContact CD1-CG2 4.16Å; L51-I314 HydrophobicContact CD2-CB 3.98Å; L51-I314 HydrophobicContact CD2-CD1 4.44Å; L51-I314 HydrophobicContact CD2-CG2 3.68Å; G310-I314 WeakPolarHBondContact O-CB 3.48Å; G310-I314 VanDerWaalsContact O-CG1 3.29Å; G310-I314 WeakPolarHBondContact O-CG1 3.42Å; G310-I314 PolarHBondContact O-N 2.99Å; I314-F316 VanDerWaalsContact C-N 3.3Å; I314-F316 PolarHBondContact O-N 3.12Å; I314-Y317 WeakPolarHBondContact O-CB 3.21Å; I314-Y317 PolarHBondContact O-N 3.31Å; I314-L318 HydrophobicContact CG2-CD1 4.24Å; I314-L318 WeakPolarHBondContact O-CG 3.45Å; I314-L318 PolarHBondContact O-N 2.79Å
315	N	89.1	Confident	85.2	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.043	28%	0.279	C	S	.	.	H	α-helix	trans	-66.8	-33.6	178	-64.8	-10.3	0	0	0	112.2	V24 L51 D54 H56 K311 F312 L318 R319	V24-N315 HydrophobicContact CG1-CB 4.28Å; V24-N315 HydrophobicContact CG2-CB 4.11Å; L51-N315 WeakPolarHBondContact CD2-OD1 3.34Å; D54-N315 PolarHBondContact OD2-ND2 3.28Å; H56-N315 PolarHBondContact NE2-OD1 3.44Å; K311-N315 WeakPolarHBondContact O-CB 3.27Å; K311-N315 VanDerWaalsContact O-CG 3.22Å; K311-N315 PolarHBondContact O-N 2.92Å; K311-N315 PolarHBondContact O-ND2 3.1Å; F312-N315 PolarHBondContact O-N 3.01Å; N315-L318 PolarHBondContact O-N 3.28Å; N315-R319 VanDerWaalsContact CB-NH1 3.27Å; N315-R319 WeakPolarHBondContact O-CG 3.46Å; N315-R319 PolarHBondContact O-N 3.02Å
316	F	86.4	Confident	84.5	Confident	54 Å²	54	62.2 Å²	62.2	24%	0.237	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-46.9	173.6	179.2	-84.7	0	0	0	110.9	F312 W313 I314 L318 R319 H320 M327	F312-F316 HydrophobicContact CZ-CD2 4.39Å; F312-F316 VanDerWaalsContact O-CB 3.26Å; F312-F316 WeakPolarHBondContact O-CB 3.42Å; F312-F316 PolarHBondContact O-N 2.66Å; W313-F316 HydrophobicContact CE3-CB 4.24Å; W313-F316 HydrophobicContact CE3-CD1 4.07Å; W313-F316 HydrophobicContact CE3-CG 4.17Å; W313-F316 HydrophobicContact CZ3-CD1 4.04Å; W313-F316 HydrophobicContact CZ3-CE1 4.32Å; W313-F316 HydrophobicContact CZ3-CG 4.24Å; W313-F316 PolarHBondContact O-N 3.47Å; I314-F316 VanDerWaalsContact C-N 3.3Å; I314-F316 PolarHBondContact O-N 3.12Å; F316-L318 VanDerWaalsContact C-N 3.29Å; F316-L318 PolarHBondContact O-N 3.28Å; F316-R319 VanDerWaalsContact CA-NH2 3.3Å; F316-R319 PolarHBondContact O-N 2.99Å; F316-H320 AromaticContact CD2-CD2 3.73Å; F316-H320 AromaticContact CE2-CD2 3.56Å; F316-H320 AromaticContact CE2-NE2 3.88Å; F316-H320 AromaticContact CZ-CD2 3.73Å; F316-H320 PolarHBondContact O-CD2 3.18Å; F316-H320 VanDerWaalsContact O-CD2 3.25Å; F316-H320 PolarHBondContact O-N 3.09Å; F316-H320 VanDerWaalsContact O-N 3.09Å; F316-M327 HydrophobicContact CD1-SD 4.43Å; F316-M327 HydrophobicContact CE1-CE 4.35Å; F316-M327 HydrophobicContact CE1-SD 3.82Å
317	Y	83.6	Confident	83.8	Confident	95 Å²	95	65.9 Å²	65.9	37%	0.373	32%	0.321	S	S	.	.	H	α-helix	trans	-57.3	-44.5	175.4	-173.6	-80.6	0	0	0	111.2	W313 I314 H320 A324	W313-Y317 WeakPolarHBondContact O-CB 3.36Å; W313-Y317 PolarHBondContact O-N 3.37Å; I314-Y317 WeakPolarHBondContact O-CB 3.21Å; I314-Y317 PolarHBondContact O-N 3.31Å; Y317-H320 CarbonylContact O-C 3.59Å; Y317-H320 PolarHBondContact O-N 3.39Å; Y317-A324 HydrophobicContact CD1-CB 4.27Å; Y317-A324 HydrophobicContact CD2-CB 3.4Å; Y317-A324 VanDerWaalsContact CD2-CB 3.4Å; Y317-A324 HydrophobicContact CE1-CB 4.07Å; Y317-A324 HydrophobicContact CE2-CB 3.18Å; Y317-A324 HydrophobicContact CG-CB 3.95Å
318	L	84.9	Confident	82.8	Confident	50 Å²	50	70.7 Å²	70.7	26%	0.262	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-31.6	180	-65.1	175	0	0	0	113.6	V24 N27 I29 I314 N315 F316	V24-L318 HydrophobicContact CG1-CB 4.28Å; V24-L318 HydrophobicContact CG1-CD1 4.48Å; N27-L318 HydrophobicContact CB-CD1 4.13Å; N27-L318 HydrophobicContact CB-CD2 4.38Å; I29-L318 HydrophobicContact CD1-CD1 4.19Å; I314-L318 HydrophobicContact CG2-CD1 4.24Å; I314-L318 WeakPolarHBondContact O-CG 3.45Å; I314-L318 PolarHBondContact O-N 2.79Å; N315-L318 PolarHBondContact O-N 3.28Å; F316-L318 VanDerWaalsContact C-N 3.29Å; F316-L318 PolarHBondContact O-N 3.28Å
319	R	87.4	Confident	81.9	Confident	98 Å²	98	73 Å²	73	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-74	-25.4	173.8	-73.5	-174.1	-58.9	-91.1	-2.1	113.2	N315 F316 P321	N315-R319 VanDerWaalsContact CB-NH1 3.27Å; N315-R319 WeakPolarHBondContact O-CG 3.46Å; N315-R319 PolarHBondContact O-N 3.02Å; F316-R319 VanDerWaalsContact CA-NH2 3.3Å; F316-R319 PolarHBondContact O-N 2.99Å; R319-P321 VanDerWaalsContact C-CD 3.45Å; R319-P321 WeakPolarHBondContact O-CD 3.43Å
320	H	84.5	Confident	81.1	Confident	74 Å²	74	79.8 Å²	79.8	34%	0.343	37%	0.374	S	S	.	.			trans	-127.9	59.5	-172.9	-54.2	-65.1	0	0	0	113.2	F316 Y317 S322 S323 A324	F316-H320 AromaticContact CD2-CD2 3.73Å; F316-H320 AromaticContact CE2-CD2 3.56Å; F316-H320 AromaticContact CE2-NE2 3.88Å; F316-H320 AromaticContact CZ-CD2 3.73Å; F316-H320 PolarHBondContact O-CD2 3.18Å; F316-H320 VanDerWaalsContact O-CD2 3.25Å; F316-H320 PolarHBondContact O-N 3.09Å; F316-H320 VanDerWaalsContact O-N 3.09Å; Y317-H320 CarbonylContact O-C 3.59Å; Y317-H320 PolarHBondContact O-N 3.39Å; H320-S322 VanDerWaalsContact C-N 3.31Å; H320-S322 PolarHBondContact O-N 3.3Å; H320-S323 PolarHBondContact O-N 3.26Å; H320-S323 VanDerWaalsContact O-N 3.13Å; H320-A324 WeakPolarHBondContact O-CB 3.28Å; H320-A324 PolarHBondContact O-N 3.25Å
321	P	76.8	Confident	80.4	Confident	82 Å²	82	81.1 Å²	81.1	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-33.2	-171	23.9	-34.8	0	0	0	114.2	R319 A324	R319-P321 VanDerWaalsContact C-CD 3.45Å; R319-P321 WeakPolarHBondContact O-CD 3.43Å; P321-A324 WeakPolarHBondContact O-CB 3.3Å
322	S	79.2	Confident	79.6	Confident	85 Å²	85	80.4 Å²	80.4	59%	0.594	39%	0.388	S	S	*	.	H	α-helix	trans	-75.3	-35.7	177.9	55.7	0	0	0	0	112.8	H320	H320-S322 VanDerWaalsContact C-N 3.31Å; H320-S322 PolarHBondContact O-N 3.3Å
323	S	75.1	Confident	78.9	Confident	55 Å²	55	83.4 Å²	83.4	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-73	-36	176.1	-58	0	0	0	0	111.4	H320 N325 R326 M327	H320-S323 PolarHBondContact O-N 3.26Å; H320-S323 VanDerWaalsContact O-N 3.13Å; S323-N325 VanDerWaalsContact C-N 3.28Å; S323-N325 PolarHBondContact O-N 3.28Å; S323-R326 WeakPolarHBondContact O-CA 3.27Å; S323-R326 VanDerWaalsContact O-CB 3.28Å; S323-R326 WeakPolarHBondContact O-CB 3.33Å; S323-R326 PolarHBondContact O-N 2.82Å; S323-M327 WeakPolarHBondContact O-CG 3.46Å; S323-M327 PolarHBondContact O-N 2.9Å
324	A	70.2	Confident	78.6	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.008	41%	0.412	C	S	.	.	H	α-helix	trans	-51.2	-42.9	175.3	0	0	0	0	0	113.2	Y317 H320 P321 R326 M327	Y317-A324 HydrophobicContact CD1-CB 4.27Å; Y317-A324 HydrophobicContact CD2-CB 3.4Å; Y317-A324 VanDerWaalsContact CD2-CB 3.4Å; Y317-A324 HydrophobicContact CE1-CB 4.07Å; Y317-A324 HydrophobicContact CE2-CB 3.18Å; Y317-A324 HydrophobicContact CG-CB 3.95Å; H320-A324 WeakPolarHBondContact O-CB 3.28Å; H320-A324 PolarHBondContact O-N 3.25Å; P321-A324 WeakPolarHBondContact O-CB 3.3Å; A324-R326 PolarHBondContact O-N 2.91Å; A324-M327 WeakPolarHBondContact O-CB 3.34Å; A324-M327 PolarHBondContact O-N 2.82Å
325	N	69.3	Low	78.5	Confident	107 Å²	107	86.2 Å²	86.2	57%	0.572	43%	0.426	S	S	*	.	H	α-helix	trans	-61.1	-25.9	175.5	-73.3	-24	0	0	0	113.2	S323	S323-N325 VanDerWaalsContact C-N 3.28Å; S323-N325 PolarHBondContact O-N 3.28Å
326	R	74.8	Confident	78.2	Confident	220 Å²	220	90.6 Å²	90.6	83%	0.83	46%	0.457	S	S	*	.	H	α-helix	trans	-86.8	-11.8	177	-54.3	179.4	-177.6	-100.2	0.4	113.1	S323 A324 R328	S323-R326 WeakPolarHBondContact O-CA 3.27Å; S323-R326 VanDerWaalsContact O-CB 3.28Å; S323-R326 WeakPolarHBondContact O-CB 3.33Å; S323-R326 PolarHBondContact O-N 2.82Å; A324-R326 PolarHBondContact O-N 2.91Å; R326-R328 VanDerWaalsContact C-N 3.3Å
327	M	73.8	Confident	78.1	Confident	82 Å²	82	93 Å²	93	40%	0.404	47%	0.468	S	S	.	.	H	α-helix	trans	-83.4	-13	175	-56.6	-173.2	74.3	0	0	112.2	F122 W313 F316 S323 A324 L329	F122-M327 HydrophobicContact CE1-CE 3.43Å; F122-M327 VanDerWaalsContact CE1-CE 3.43Å; F122-M327 HydrophobicContact CE2-CE 4.42Å; F122-M327 HydrophobicContact CZ-CE 3.21Å; F122-M327 HydrophobicContact CZ-SD 3.75Å; W313-M327 HydrophobicContact CZ3-CE 4.4Å; F316-M327 HydrophobicContact CD1-SD 4.43Å; F316-M327 HydrophobicContact CE1-CE 4.35Å; F316-M327 HydrophobicContact CE1-SD 3.82Å; S323-M327 WeakPolarHBondContact O-CG 3.46Å; S323-M327 PolarHBondContact O-N 2.9Å; A324-M327 WeakPolarHBondContact O-CB 3.34Å; A324-M327 PolarHBondContact O-N 2.82Å; M327-L329 PolarHBondContact O-N 3.25Å
328	R	72.5	Confident	78.4	Confident	121 Å²	121	90.6 Å²	90.6	46%	0.457	46%	0.463	S	S	.	.	S	Bend	trans	-67.3	128.3	171.5	-60.5	-179.6	75.4	134.7	-1.6	109	N120 R326 K330	N120-R328 HydrophobicContact CB-CB 4.44Å; N120-R328 HydrophobicContact CB-CG 4.27Å; N120-R328 PolarHBondContact ND2-NE 2.9Å; N120-R328 VanDerWaalsContact OD1-C 3.25Å; N120-R328 WeakPolarHBondContact OD1-CA 3.48Å; N120-R328 WeakPolarHBondContact OD1-CB 3.42Å; R326-R328 VanDerWaalsContact C-N 3.3Å; R328-K330 PolarHBondContact O-N 3.28Å
329	L	72.3	Confident	78.3	Confident	87 Å²	87	92.8 Å²	92.8	46%	0.455	47%	0.468	S	S	.	.			trans	-53.4	125.1	166.7	-107.8	104.6	0	0	0	110.1	F119 N120 M327 G331 T332	F119-L329 HydrophobicContact CB-CB 3.61Å; F119-L329 HydrophobicContact CB-CD1 3.64Å; F119-L329 HydrophobicContact CB-CD2 3.83Å; F119-L329 HydrophobicContact CB-CG 3.82Å; F119-L329 HydrophobicContact CD1-CD1 4.18Å; F119-L329 HydrophobicContact CD1-CD2 3.84Å; F119-L329 HydrophobicContact CG-CD1 4.34Å; F119-L329 HydrophobicContact CG-CD2 3.95Å; F119-L329 HydrophobicContact CG-CG 4.48Å; F119-L329 WeakPolarHBondContact O-CD1 3.36Å; N120-L329 PolarHBondContact OD1-N 2.91Å; M327-L329 PolarHBondContact O-N 3.25Å; L329-G331 PolarHBondContact O-N 3.47Å; L329-T332 PolarHBondContact O-N 2.92Å; L329-T332 PolarHBondContact O-OG1 3.34Å
330	K	75.9	Confident	78.1	Confident	183 Å²	183	90.8 Å²	90.8	80%	0.796	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-56.2	-25	-178.5	-68.7	-174.2	176.4	-178.3	0	113.3	R328 T332 M333	R328-K330 PolarHBondContact O-N 3.28Å; K330-T332 PolarHBondContact O-N 3Å; K330-M333 WeakPolarHBondContact O-CB 3.28Å; K330-M333 PolarHBondContact O-N 2.94Å
331	G	75.6	Confident	78.4	Confident	27 Å²	27	90.2 Å²	90.2	28%	0.278	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-54.2	-31.2	176	0	0	0	0	0	113.8	L329 M333 L334	L329-G331 PolarHBondContact O-N 3.47Å; G331-M333 PolarHBondContact O-N 3.46Å; G331-L334 WeakPolarHBondContact O-CB 3.36Å; G331-L334 PolarHBondContact O-N 3.5Å
332	T	73.6	Confident	79.1	Confident	45 Å²	45	92.5 Å²	92.5	28%	0.276	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-74.4	-7.2	179.8	71	0	0	0	0	113.9	G116 N120 L329 K330	G116-T332 WeakPolarHBondContact O-CG2 3.42Å; N120-T332 WeakPolarHBondContact ND2-CG2 3.16Å; N120-T332 PolarHBondContact ND2-OG1 3.36Å; L329-T332 PolarHBondContact O-N 2.92Å; L329-T332 PolarHBondContact O-OG1 3.34Å; K330-T332 PolarHBondContact O-N 3Å
333	M	76.3	Confident	79.8	Confident	155 Å²	155	91 Å²	91	76%	0.764	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-101.3	-3.7	175.8	-57.2	-61	-63.1	0	0	112.1	K330 G331	K330-M333 WeakPolarHBondContact O-CB 3.28Å; K330-M333 PolarHBondContact O-N 2.94Å; G331-M333 PolarHBondContact O-N 3.46Å
334	L	82.4	Confident	80.8	Confident	83 Å²	83	92 Å²	92	44%	0.435	46%	0.461	S	S	.	.	S	Bend	trans	-76.6	142.6	178.4	-59.5	176.8	0	0	0	109.8	G331 T338	G331-L334 WeakPolarHBondContact O-CB 3.36Å; G331-L334 PolarHBondContact O-N 3.5Å; L334-T338 HydrophobicContact CB-CG2 4.49Å; L334-T338 HydrophobicContact CD1-CG2 4.17Å; L334-T338 HydrophobicContact CD2-CG2 3.85Å; L334-T338 HydrophobicContact CG-CG2 4.38Å
335	N	85.9	Confident	82	Confident	98 Å²	98	97.9 Å²	97.9	52%	0.524	49%	0.486	S	S	.	.			trans	-68.9	161.6	166.2	65.5	51	0	0	0	109.8	F337 T338 Y339	N335-F337 PolarHBondContact O-N 2.9Å; N335-F337 VanDerWaalsContact O-N 3.13Å; N335-F337 WeakPolarHBondContact OD1-CA 3.19Å; N335-F337 WeakPolarHBondContact OD1-CB 3.37Å; N335-F337 PolarHBondContact OD1-N 3.3Å; N335-T338 PolarHBondContact O-N 2.94Å; N335-T338 PolarHBondContact OD1-N 3.28Å; N335-Y339 VanDerWaalsContact O-CB 3.23Å; N335-Y339 WeakPolarHBondContact O-CB 3.29Å; N335-Y339 PolarHBondContact O-N 3.25Å
336	S	82.8	Confident	83.2	Confident	101 Å²	101	96.1 Å²	96.1	71%	0.706	48%	0.48	S	S	*	.	H	α-helix	trans	-58.2	-29.5	-177.8	-53.5	0	0	0	0	113.5	S340	S336-S340 WeakPolarHBondContact O-CB 3.39Å; S336-S340 PolarHBondContact O-N 2.91Å; S336-S340 VanDerWaalsContact O-N 3.07Å; S336-S340 PolarHBondContact O-OG 3.3Å
337	F	83.2	Confident	84.3	Confident	104 Å²	104	90.5 Å²	90.5	46%	0.456	47%	0.465	S	S	.	.	H	α-helix	trans	-68.1	-52	-178.6	-174.5	-97.2	0	0	0	112.1	N335 C341 Y342 D343	N335-F337 PolarHBondContact O-N 2.9Å; N335-F337 VanDerWaalsContact O-N 3.13Å; N335-F337 WeakPolarHBondContact OD1-CA 3.19Å; N335-F337 WeakPolarHBondContact OD1-CB 3.37Å; N335-F337 PolarHBondContact OD1-N 3.3Å; F337-C341 PolarHBondContact O-N 2.93Å; F337-Y342 HydrophobicContact CD2-CD2 4.09Å; F337-Y342 HydrophobicContact CD2-CG 4.19Å; F337-Y342 HydrophobicContact CE2-CG 4.22Å; F337-Y342 PolarHBondContact O-N 2.85Å; F337-D343 HydrophobicContact CD1-CB 4.05Å; F337-D343 VanDerWaalsContact CE1-CA 3.48Å; F337-D343 HydrophobicContact CE1-CB 3.68Å; F337-D343 VanDerWaalsContact CE1-N 3.27Å
338	T	89	Confident	85.4	Confident	44 Å²	44	90.7 Å²	90.7	27%	0.27	47%	0.468	S	S	.	.	H	α-helix	trans	-70	-37.4	175.7	-64.8	0	0	0	0	111.8	L334 N335 S340 C341 D343	L334-T338 HydrophobicContact CB-CG2 4.49Å; L334-T338 HydrophobicContact CD1-CG2 4.17Å; L334-T338 HydrophobicContact CD2-CG2 3.85Å; L334-T338 HydrophobicContact CG-CG2 4.38Å; N335-T338 PolarHBondContact O-N 2.94Å; N335-T338 PolarHBondContact OD1-N 3.28Å; T338-S340 VanDerWaalsContact C-N 3.27Å; T338-S340 PolarHBondContact O-N 3.21Å; T338-C341 PolarHBondContact O-N 2.98Å; T338-D343 WeakPolarHBondContact CA-OD2 3.39Å; T338-D343 VanDerWaalsContact CB-OD2 3.27Å; T338-D343 WeakPolarHBondContact CB-OD2 3.34Å; T338-D343 WeakPolarHBondContact CG2-OD2 3.34Å; T338-D343 PolarHBondContact OG1-OD2 3.3Å
339	Y	83.1	Confident	86.6	Confident	97 Å²	97	88.9 Å²	88.9	38%	0.38	47%	0.472	S	S	.	.	H	α-helix	trans	-59.3	-39.6	177	-177.9	-90.9	0	0	0	112.1	A115 N335 C341	A115-Y339 VanDerWaalsContact C-OH 3.29Å; A115-Y339 WeakPolarHBondContact CB-OH 3.46Å; A115-Y339 PolarHBondContact O-OH 3.13Å; N335-Y339 VanDerWaalsContact O-CB 3.23Å; N335-Y339 WeakPolarHBondContact O-CB 3.29Å; N335-Y339 PolarHBondContact O-N 3.25Å; Y339-C341 PolarHBondContact O-N 2.82Å
340	S	84.2	Confident	87.8	Confident	55 Å²	55	89.6 Å²	89.6	39%	0.385	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	10.3	175.5	-64.1	0	0	0	0	113.9	S336 T338 Y342	S336-S340 WeakPolarHBondContact O-CB 3.39Å; S336-S340 PolarHBondContact O-N 2.91Å; S336-S340 VanDerWaalsContact O-N 3.07Å; S336-S340 PolarHBondContact O-OG 3.3Å; T338-S340 VanDerWaalsContact C-N 3.27Å; T338-S340 PolarHBondContact O-N 3.21Å; S340-Y342 PolarHBondContact O-N 2.99Å; S340-Y342 VanDerWaalsContact O-N 3.16Å
341	C	89.7	Confident	88.8	Confident	62 Å²	62	84.9 Å²	84.9	42%	0.419	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	20.8	179.6	-57.7	0	0	0	0	114.7	F337 T338 Y339 D343 V344 F345	F337-C341 PolarHBondContact O-N 2.93Å; T338-C341 PolarHBondContact O-N 2.98Å; Y339-C341 PolarHBondContact O-N 2.82Å; C341-D343 WeakPolarHBondContact CA-OD1 3.27Å; C341-D343 PolarHBondContact O-N 3.38Å; C341-V344 HydrophobicContact CB-CB 4.38Å; C341-V344 HydrophobicContact CB-CG2 4.47Å; C341-V344 PolarHBondContact O-N 3.49Å; C341-V344 VanDerWaalsContact O-N 3.12Å; C341-F345 HydrophobicContact CB-CD2 4.37Å; C341-F345 HydrophobicContact CB-CE2 4.25Å; C341-F345 WeakPolarHBondContact O-CD2 3.45Å; C341-F345 PolarHBondContact O-N 3.45Å
342	Y	92.6	Very high	89.8	Confident	130 Å²	130	89.1 Å²	89.1	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-28.1	-180	-69.4	-59.1	0	0	0	112.3	F337 S340 F345 T346	F337-Y342 HydrophobicContact CD2-CD2 4.09Å; F337-Y342 HydrophobicContact CD2-CG 4.19Å; F337-Y342 HydrophobicContact CE2-CG 4.22Å; F337-Y342 PolarHBondContact O-N 2.85Å; S340-Y342 PolarHBondContact O-N 2.99Å; S340-Y342 VanDerWaalsContact O-N 3.16Å; Y342-F345 PolarHBondContact O-N 2.84Å; Y342-T346 VanDerWaalsContact O-CB 3.3Å; Y342-T346 WeakPolarHBondContact O-CB 3.45Å; Y342-T346 PolarHBondContact O-N 2.83Å; Y342-T346 PolarHBondContact O-OG1 3.1Å
343	D	93.9	Very high	90.9	Very high	54 Å²	54	94.2 Å²	94.2	29%	0.289	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-45.6	170.1	48.8	0.7	0	0	0	112.3	F337 T338 C341 T346 L347	F337-D343 HydrophobicContact CD1-CB 4.05Å; F337-D343 VanDerWaalsContact CE1-CA 3.48Å; F337-D343 HydrophobicContact CE1-CB 3.68Å; F337-D343 VanDerWaalsContact CE1-N 3.27Å; T338-D343 WeakPolarHBondContact CA-OD2 3.39Å; T338-D343 VanDerWaalsContact CB-OD2 3.27Å; T338-D343 WeakPolarHBondContact CB-OD2 3.34Å; T338-D343 WeakPolarHBondContact CG2-OD2 3.34Å; T338-D343 PolarHBondContact OG1-OD2 3.3Å; C341-D343 WeakPolarHBondContact CA-OD1 3.27Å; C341-D343 PolarHBondContact O-N 3.38Å; D343-T346 PolarHBondContact O-N 3.27Å; D343-L347 WeakPolarHBondContact O-CB 3.45Å; D343-L347 PolarHBondContact O-N 3.09Å
344	V	94.8	Very high	91.8	Very high	77 Å²	77	89.7 Å²	89.7	47%	0.467	48%	0.477	S	S	.	.	H	α-helix	trans	-64.4	-44.7	175.8	-177.7	0	0	0	0	110.8	C341 T346 L347 L348	C341-V344 HydrophobicContact CB-CB 4.38Å; C341-V344 HydrophobicContact CB-CG2 4.47Å; C341-V344 PolarHBondContact O-N 3.49Å; C341-V344 VanDerWaalsContact O-N 3.12Å; V344-T346 VanDerWaalsContact C-N 3.34Å; V344-T346 PolarHBondContact O-N 2.83Å; V344-L347 PolarHBondContact O-N 3.27Å; V344-L348 HydrophobicContact CG1-CD1 4.12Å; V344-L348 HydrophobicContact CG1-CG 4.46Å; V344-L348 WeakPolarHBondContact O-CG 3.43Å; V344-L348 PolarHBondContact O-N 3.02Å
345	F	95.9	Very high	92.3	Very high	124 Å²	124	90.7 Å²	90.7	54%	0.544	48%	0.482	S	S	.	.	H	α-helix	trans	-61.7	-42.7	175.8	-75.7	-66	0	0	0	112	C341 Y342 L347 L348 C349	C341-F345 HydrophobicContact CB-CD2 4.37Å; C341-F345 HydrophobicContact CB-CE2 4.25Å; C341-F345 WeakPolarHBondContact O-CD2 3.45Å; C341-F345 PolarHBondContact O-N 3.45Å; Y342-F345 PolarHBondContact O-N 2.84Å; F345-L347 VanDerWaalsContact C-N 3.34Å; F345-L347 PolarHBondContact O-N 2.76Å; F345-L348 PolarHBondContact O-N 3.15Å; F345-C349 WeakPolarHBondContact O-CB 3.37Å; F345-C349 PolarHBondContact O-N 3.21Å; F345-C349 PolarHBondContact O-SG 3.27Å
346	T	95.9	Very high	92.6	Very high	70 Å²	70	94.2 Å²	94.2	43%	0.429	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-45.1	176.8	-57	0	0	0	0	110.6	Y342 D343 V344 C349 I350	Y342-T346 VanDerWaalsContact O-CB 3.3Å; Y342-T346 WeakPolarHBondContact O-CB 3.45Å; Y342-T346 PolarHBondContact O-N 2.83Å; Y342-T346 PolarHBondContact O-OG1 3.1Å; D343-T346 PolarHBondContact O-N 3.27Å; V344-T346 VanDerWaalsContact C-N 3.34Å; V344-T346 PolarHBondContact O-N 2.83Å; T346-C349 PolarHBondContact O-N 3.45Å; T346-I350 HydrophobicContact CG2-CD1 4.06Å; T346-I350 VanDerWaalsContact O-CG1 3.27Å; T346-I350 WeakPolarHBondContact O-CG1 3.12Å; T346-I350 PolarHBondContact O-N 3.03Å
347	L	96.6	Very high	93	Very high	101 Å²	101	92.2 Å²	92.2	53%	0.529	47%	0.474	S	S	.	.	H	α-helix	trans	-61.9	-44.6	176.2	-178.9	64.3	0	0	0	112.1	D343 V344 F345 I350 L351	D343-L347 WeakPolarHBondContact O-CB 3.45Å; D343-L347 PolarHBondContact O-N 3.09Å; V344-L347 PolarHBondContact O-N 3.27Å; F345-L347 VanDerWaalsContact C-N 3.34Å; F345-L347 PolarHBondContact O-N 2.76Å; L347-I350 PolarHBondContact O-N 2.78Å; L347-L351 HydrophobicContact CD1-CD1 4.45Å; L347-L351 HydrophobicContact CD1-CG 4.48Å; L347-L351 HydrophobicContact CG-CD1 4.14Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 2.99Å
348	L	97.3	Very high	93.2	Very high	86 Å²	86	90.2 Å²	90.2	45%	0.45	48%	0.476	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.2	-72.9	171.7	0	0	0	111.9	V344 F345 L351 L352	V344-L348 HydrophobicContact CG1-CD1 4.12Å; V344-L348 HydrophobicContact CG1-CG 4.46Å; V344-L348 WeakPolarHBondContact O-CG 3.43Å; V344-L348 PolarHBondContact O-N 3.02Å; F345-L348 PolarHBondContact O-N 3.15Å; L348-L351 PolarHBondContact O-N 3.3Å; L348-L352 WeakPolarHBondContact O-CB 3.31Å; L348-L352 VanDerWaalsContact O-CG 3.28Å; L348-L352 WeakPolarHBondContact O-CG 3.23Å; L348-L352 PolarHBondContact O-N 2.9Å
349	C	97.2	Very high	93.2	Very high	83 Å²	83	94.5 Å²	94.5	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-61.5	-42.7	175	-71.9	0	0	0	0	111.9	F345 T346 L352 F353	F345-C349 WeakPolarHBondContact O-CB 3.37Å; F345-C349 PolarHBondContact O-N 3.21Å; F345-C349 PolarHBondContact O-SG 3.27Å; T346-C349 PolarHBondContact O-N 3.45Å; C349-L352 PolarHBondContact O-N 2.74Å; C349-F353 VanDerWaalsContact O-CB 3.3Å; C349-F353 WeakPolarHBondContact O-CB 3.46Å; C349-F353 PolarHBondContact O-N 3.48Å
350	I	97.6	Very high	93.2	Very high	103 Å²	103	95.7 Å²	95.7	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-47.6	175.8	-68.8	164.8	0	0	0	110.5	T346 L347 F353 S354	T346-I350 HydrophobicContact CG2-CD1 4.06Å; T346-I350 VanDerWaalsContact O-CG1 3.27Å; T346-I350 WeakPolarHBondContact O-CG1 3.12Å; T346-I350 PolarHBondContact O-N 3.03Å; L347-I350 PolarHBondContact O-N 2.78Å; I350-F353 PolarHBondContact O-N 3.37Å; I350-S354 PolarHBondContact O-N 2.99Å; I350-S354 PolarHBondContact O-OG 3.47Å
351	L	97.3	Very high	92.6	Very high	84 Å²	84	99.9 Å²	99.9	44%	0.44	54%	0.538	S	S	.	.	H	α-helix	trans	-62.4	-45.1	-179.8	-71.5	171.2	0	0	0	112.1	L347 L348 F353 S354 L355	L347-L351 HydrophobicContact CD1-CD1 4.45Å; L347-L351 HydrophobicContact CD1-CG 4.48Å; L347-L351 HydrophobicContact CG-CD1 4.14Å; L347-L351 WeakPolarHBondContact O-CG 3.39Å; L347-L351 PolarHBondContact O-N 2.99Å; L348-L351 PolarHBondContact O-N 3.3Å; L351-F353 VanDerWaalsContact C-N 3.34Å; L351-F353 PolarHBondContact O-N 3.41Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 3.41Å; L351-S354 PolarHBondContact O-OG 2.82Å; L351-L355 WeakPolarHBondContact O-CB 3.42Å; L351-L355 PolarHBondContact O-N 3.28Å
352	L	96.7	Very high	92.8	Very high	116 Å²	116	101.8 Å²	101.8	61%	0.607	54%	0.544	S	S	*	.	H	α-helix	trans	-63.4	-39.7	176.5	-71.5	171.4	0	0	0	112	L348 C349 L355 R356	L348-L352 WeakPolarHBondContact O-CB 3.31Å; L348-L352 VanDerWaalsContact O-CG 3.28Å; L348-L352 WeakPolarHBondContact O-CG 3.23Å; L348-L352 PolarHBondContact O-N 2.9Å; C349-L352 PolarHBondContact O-N 2.74Å; L352-L355 PolarHBondContact O-N 2.85Å; L352-R356 WeakPolarHBondContact O-CB 3.4Å; L352-R356 PolarHBondContact O-N 2.88Å
353	F	95.8	Very high	92.8	Very high	151 Å²	151	100.3 Å²	100.3	66%	0.662	55%	0.546	S	S	*	.	H	α-helix	trans	-65.2	-42.1	176	-171.2	-93.3	0	0	0	111.7	C349 I350 L351 R356 S357	C349-F353 VanDerWaalsContact O-CB 3.3Å; C349-F353 WeakPolarHBondContact O-CB 3.46Å; C349-F353 PolarHBondContact O-N 3.48Å; I350-F353 PolarHBondContact O-N 3.37Å; L351-F353 VanDerWaalsContact C-N 3.34Å; L351-F353 PolarHBondContact O-N 3.41Å; F353-R356 PolarHBondContact O-N 2.93Å; F353-S357 WeakPolarHBondContact O-CB 3.23Å; F353-S357 PolarHBondContact O-N 3.42Å; F353-S357 PolarHBondContact O-OG 3.36Å
354	S	95.1	Very high	92.7	Very high	60 Å²	60	102.8 Å²	102.8	42%	0.42	56%	0.561	S	S	.	*	H	α-helix	trans	-66.1	-40	175.7	58.5	0	0	0	0	113	I350 L351 S357 A358	I350-S354 PolarHBondContact O-N 2.99Å; I350-S354 PolarHBondContact O-OG 3.47Å; L351-S354 WeakPolarHBondContact CA-OG 3.41Å; L351-S354 PolarHBondContact O-N 3.41Å; L351-S354 PolarHBondContact O-OG 2.82Å; S354-S357 PolarHBondContact O-N 2.89Å; S354-A358 WeakPolarHBondContact O-CB 3.23Å; S354-A358 PolarHBondContact O-N 3.34Å
355	L	94.4	Very high	92.6	Very high	105 Å²	105	104.4 Å²	104.4	55%	0.55	57%	0.566	S	S	.	*	H	α-helix	trans	-63.5	-44.2	176.4	-85.4	158.1	0	0	0	111.3	L351 L352 A358 I359	L351-L355 WeakPolarHBondContact O-CB 3.42Å; L351-L355 PolarHBondContact O-N 3.28Å; L352-L355 PolarHBondContact O-N 2.85Å; L355-A358 PolarHBondContact O-N 3.41Å; L355-I359 WeakPolarHBondContact O-CG1 3.5Å; L355-I359 PolarHBondContact O-N 3.14Å; L355-I359 VanDerWaalsContact O-N 3.09Å
356	R	92.1	Very high	92.4	Very high	172 Å²	172	103.1 Å²	103.1	65%	0.649	57%	0.567	S	S	*	*	H	α-helix	trans	-62.1	-45.4	176	-177.2	171.3	-178.8	172.6	1.6	111.7	L352 F353 A358 I359 D360	L352-R356 WeakPolarHBondContact O-CB 3.4Å; L352-R356 PolarHBondContact O-N 2.88Å; F353-R356 PolarHBondContact O-N 2.93Å; R356-A358 PolarHBondContact O-N 3.03Å; R356-I359 PolarHBondContact O-N 3.41Å; R356-I359 VanDerWaalsContact O-N 3.1Å; R356-D360 IonicContact NE-OD2 3.94Å; R356-D360 PolarHBondContact O-N 3.38Å
357	S	89.6	Confident	92.2	Very high	59 Å²	59	105.3 Å²	105.3	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-61.4	-31.3	178.2	-54.8	0	0	0	0	112.5	F353 S354 S361	F353-S357 WeakPolarHBondContact O-CB 3.23Å; F353-S357 PolarHBondContact O-N 3.42Å; F353-S357 PolarHBondContact O-OG 3.36Å; S354-S357 PolarHBondContact O-N 2.89Å; S357-S361 PolarHBondContact O-N 3.45Å; S357-S361 PolarHBondContact O-OG 3.4Å
358	A	89.1	Confident	91.9	Very high	61 Å²	61	105.6 Å²	105.6	50%	0.504	58%	0.58	S	S	.	*	H	α-helix	trans	-80.7	-20.7	176.7	0	0	0	0	0	114.2	S354 L355 R356 S361	S354-A358 WeakPolarHBondContact O-CB 3.23Å; S354-A358 PolarHBondContact O-N 3.34Å; L355-A358 PolarHBondContact O-N 3.41Å; R356-A358 PolarHBondContact O-N 3.03Å; A358-S361 WeakPolarHBondContact CA-OG 3.42Å; A358-S361 PolarHBondContact O-OG 3.48Å; A358-S361 VanDerWaalsContact O-OG 3.14Å
359	I	89	Confident	91.4	Very high	134 Å²	134	107.2 Å²	107.2	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-82.8	-34.2	173.8	-68.9	165	0	0	0	110.5	L355 R356 S361	L355-I359 WeakPolarHBondContact O-CG1 3.5Å; L355-I359 PolarHBondContact O-N 3.14Å; L355-I359 VanDerWaalsContact O-N 3.09Å; R356-I359 PolarHBondContact O-N 3.41Å; R356-I359 VanDerWaalsContact O-N 3.1Å; I359-S361 VanDerWaalsContact C-N 3.3Å
360	D	82.7	Confident	91	Very high	123 Å²	123	109.2 Å²	109.2	66%	0.658	59%	0.593	S	S	*	*			trans	-78.4	-14.3	179.4	-67.7	-24	0	0	0	112.8	R356	R356-D360 IonicContact NE-OD2 3.94Å; R356-D360 PolarHBondContact O-N 3.38Å
361	S	72.3	Confident	90.4	Very high	142 Å²	142	109.7 Å²	109.7	99%	0.993	60%	0.598	S	S	*	*			trans	-93.3	0	173.6	67	0	0	0	0	112.1	S357 A358 I359	S357-S361 PolarHBondContact O-N 3.45Å; S357-S361 PolarHBondContact O-OG 3.4Å; A358-S361 WeakPolarHBondContact CA-OG 3.42Å; A358-S361 PolarHBondContact O-OG 3.48Å; A358-S361 VanDerWaalsContact O-OG 3.14Å; I359-S361 VanDerWaalsContact C-N 3.3Å

Retrieved 361 of 361 residues in 343 ms (Link to these results)

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