A0A060X2I5_ONCMY Loading...

Prenylcysteine oxidase 1 like

AlphaFold DB , UniProt , Accession A0A060X2I5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110537783, Length 501 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	24.3	Very low	27.4	Very low	221 Å²	221	178.3 Å²	178.3	100%	1.089	85%	0.854	S	S	*	*				0	78.5	0	-73.4	169.3	112.2	0	0	106.2
2	H	30	Very low	27.1	Very low	184 Å²	184	174.1 Å²	174.1	85%	0.852	85%	0.848	S	S	*	*				55.9	77.6	59.6	-71.1	-41.8	0	0	0	114
3	W	22.1	Very low	26.9	Very low	221 Å²	221	173.5 Å²	173.5	84%	0.837	85%	0.85	S	S	*	*			trans	-141.9	94.4	150.9	-72.7	90.9	0	0	0	108.8	L5	W3-L5 HydrophobicContact CE3-CD1 4.06Å; W3-L5 HydrophobicContact CZ3-CD1 4.19Å
4	C	28.1	Very low	26.8	Very low	118 Å²	118	172.9 Å²	172.9	80%	0.797	85%	0.851	S	S	*	*			trans	-64.8	154.6	144.8	-65.1	0	0	0	0	108.4
5	L	34.4	Very low	26.9	Very low	130 Å²	130	169.3 Å²	169.3	68%	0.681	85%	0.849	S	S	*	*			trans	171.3	158	138.3	-91	146.3	0	0	0	110.4	W3	W3-L5 HydrophobicContact CE3-CD1 4.06Å; W3-L5 HydrophobicContact CZ3-CD1 4.19Å
6	P	36.2	Very low	27	Very low	101 Å²	101	165.4 Å²	165.4	66%	0.656	84%	0.843	S	S	*	*	S	Bend	cis	-128.7	123.7	3.1	33.7	-14.5	0	0	0	113.9
7	F	24.1	Very low	27.1	Very low	212 Å²	212	164.5 Å²	164.5	93%	0.93	84%	0.839	S	S	*	*			trans	-154	73.7	142.2	-106.5	-78.6	0	0	0	107.7
8	R	24.6	Very low	27.5	Very low	224 Å²	224	165.9 Å²	165.9	85%	0.845	85%	0.847	S	S	*	*			trans	-120.3	88.1	159.5	-93.5	-171.4	172.5	-164.1	-1.7	106.3
9	F	24.5	Very low	27.6	Very low	205 Å²	205	160.9 Å²	160.9	90%	0.899	83%	0.834	S	S	*	*	S	Bend	trans	-168.8	70.5	152.1	-101.5	-69.6	0	0	0	108.8
10	L	25.1	Very low	28	Very low	169 Å²	169	162.1 Å²	162.1	89%	0.885	84%	0.84	S	S	*	*	S	Bend	trans	-171.3	72.6	140.7	-138.1	85	0	0	0	109.8
11	L	27.7	Very low	27.8	Very low	176 Å²	176	157.6 Å²	157.6	92%	0.921	83%	0.834	S	S	*	*			trans	-161.4	73.2	164.9	-110.7	141	0	0	0	109.4
12	T	24.1	Very low	28.1	Very low	128 Å²	128	154.4 Å²	154.4	79%	0.785	82%	0.821	S	S	*	*			trans	-140	90.2	161.7	45.9	0	0	0	0	107.8
13	L	24.7	Very low	28.3	Very low	166 Å²	166	149.3 Å²	149.3	87%	0.869	81%	0.807	S	S	*	*			trans	155.4	105.7	137.6	-103.8	114.9	0	0	0	108.2
14	L	25.9	Very low	28.7	Very low	166 Å²	166	142.3 Å²	142.3	87%	0.869	80%	0.803	S	S	*	*			trans	178.7	83.2	139	-95.9	151.5	0	0	0	107.9
15	S	27.2	Very low	29.4	Very low	118 Å²	118	144 Å²	144	83%	0.825	80%	0.797	S	S	*	*			trans	-131.7	84.2	163.9	56.5	0	0	0	0	107.8
16	S	28.8	Very low	29.8	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	79%	0.785	S	S	*	*			trans	177.6	77.9	155.9	49.2	0	0	0	0	110.5
17	I	28.8	Very low	30	Very low	149 Å²	149	143.7 Å²	143.7	76%	0.764	79%	0.792	S	S	*	*			trans	-137.8	84.3	145.4	-56	-177.7	0	0	0	106.9	A19	I17-A19 VanDerWaalsContact C-N 3.34Å; I17-A19 HydrophobicContact CG2-CB 3.6Å; I17-A19 PolarHBondContact O-N 3.14Å
18	L	35.4	Very low	31.3	Very low	190 Å²	190	136.2 Å²	136.2	100%	0.995	76%	0.761	S	S	*	*			trans	-79.3	95.2	144.6	-95.2	157.6	0	0	0	104.9
19	A	27.8	Very low	32.3	Very low	71 Å²	71	131.9 Å²	131.9	59%	0.587	76%	0.755	S	S	*	*			trans	-135.7	128.9	161.5	0	0	0	0	0	106	I17 G21	I17-A19 VanDerWaalsContact C-N 3.34Å; I17-A19 HydrophobicContact CG2-CB 3.6Å; I17-A19 PolarHBondContact O-N 3.14Å; A19-G21 PolarHBondContact O-N 2.84Å
20	L	35.3	Very low	34	Very low	184 Å²	184	124.5 Å²	124.5	96%	0.963	74%	0.736	S	S	*	*			trans	-48.8	99.8	177.3	-70.6	121.8	0	0	0	110	D22	L20-D22 PolarHBondContact O-N 2.94Å
21	G	25.8	Very low	36.3	Very low	69 Å²	69	122 Å²	122	71%	0.711	73%	0.728	S	S	*	*			trans	-81.8	96	158.5	0	0	0	0	0	105.9	A19 S23	A19-G21 PolarHBondContact O-N 2.84Å; G21-S23 PolarHBondContact O-N 2.93Å
22	D	28.6	Very low	38.7	Very low	154 Å²	154	115.7 Å²	115.7	82%	0.824	70%	0.698	S	S	*	*			trans	-46.9	115.5	159	-155.3	6.4	0	0	0	106	L20 G24	L20-D22 PolarHBondContact O-N 2.94Å; D22-G24 PolarHBondContact O-N 2.85Å
23	S	34.7	Very low	41.8	Very low	77 Å²	77	109.7 Å²	109.7	54%	0.538	66%	0.661	S	S	.	*			trans	-63.7	92.8	173.9	48.1	0	0	0	0	105.3	G21 F25	G21-S23 PolarHBondContact O-N 2.93Å; S23-F25 VanDerWaalsContact O-CD2 3.28Å; S23-F25 WeakPolarHBondContact O-CD2 3.4Å; S23-F25 PolarHBondContact O-N 3.23Å; S23-F25 WeakPolarHBondContact OG-CE2 3.5Å
24	G	30.6	Very low	45	Very low	73 Å²	73	106.1 Å²	106.1	75%	0.753	65%	0.65	S	S	*	*			trans	-62.7	81.8	171.1	0	0	0	0	0	107.4	D22 A26	D22-G24 PolarHBondContact O-N 2.85Å; G24-A26 VanDerWaalsContact C-N 3.33Å; G24-A26 PolarHBondContact O-N 3.24Å
25	F	43.1	Very low	48.3	Very low	155 Å²	155	100.5 Å²	100.5	68%	0.68	62%	0.618	S	S	*	*			trans	-56.1	107	159.8	-72.1	-77.5	0	0	0	104.7	S23 Q27	S23-F25 VanDerWaalsContact O-CD2 3.28Å; S23-F25 WeakPolarHBondContact O-CD2 3.4Å; S23-F25 PolarHBondContact O-N 3.23Å; S23-F25 WeakPolarHBondContact OG-CE2 3.5Å; F25-Q27 PolarHBondContact O-N 2.85Å; F25-Q27 VanDerWaalsContact O-N 3.07Å
26	A	43.5	Very low	51.7	Low	51 Å²	51	94.9 Å²	94.9	42%	0.421	58%	0.579	S	S	.	*			trans	-52.8	121.3	166.9	0	0	0	0	0	106.3	G24 L28 Y478	G24-A26 VanDerWaalsContact C-N 3.33Å; G24-A26 PolarHBondContact O-N 3.24Å; A26-L28 PolarHBondContact O-N 3.3Å; A26-L28 VanDerWaalsContact O-N 3.1Å; A26-Y478 PolarHBondContact O-OH 2.88Å
27	Q	40.3	Very low	55	Low	173 Å²	173	89.7 Å²	89.7	81%	0.808	54%	0.543	S	S	*	.			trans	-53.4	118.1	-179	-165.6	166.8	-7	0	0	107.8	F25 D29	F25-Q27 PolarHBondContact O-N 2.85Å; F25-Q27 VanDerWaalsContact O-N 3.07Å; Q27-D29 PolarHBondContact O-N 3.46Å
28	L	50.1	Low	58.4	Low	55 Å²	55	82.6 Å²	82.6	29%	0.288	51%	0.507	S	S	.	.			trans	-56.7	113	172.3	-89.7	145	0	0	0	107.6	A26 G30 P32 Y478	A26-L28 PolarHBondContact O-N 3.3Å; A26-L28 VanDerWaalsContact O-N 3.1Å; L28-G30 WeakPolarHBondContact CB-O 3.32Å; L28-G30 PolarHBondContact O-N 3.45Å; L28-P32 HydrophobicContact CD1-CB 4.48Å; L28-Y478 HydrophobicContact CD2-CE2 4.23Å; L28-Y478 HydrophobicContact CG-CE2 4.44Å
29	D	46.7	Very low	61.4	Low	133 Å²	133	74 Å²	74	71%	0.711	46%	0.462	S	S	*	.	S	Bend	trans	-73.8	74.2	165.8	-88.7	-15.3	0	0	0	108.3	Q27	Q27-D29 PolarHBondContact O-N 3.46Å
30	G	59.6	Low	64.7	Low	49 Å²	49	71.1 Å²	71.1	51%	0.505	44%	0.439	S	S	.	.	S	Bend	trans	139.4	166.2	-179.8	0	0	0	0	0	113.7	L28	L28-G30 WeakPolarHBondContact CB-O 3.32Å; L28-G30 PolarHBondContact O-N 3.45Å
31	T	72.7	Confident	67.7	Low	117 Å²	117	62.4 Å²	62.4	72%	0.718	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-68.9	139.6	170	44.7	0	0	0	0	110.1	W481	T31-W481 PolarHBondContact O-NE1 3.26Å
32	P	79.2	Confident	71.2	Confident	44 Å²	44	59.9 Å²	59.9	29%	0.286	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-58.8	158	174.3	26.4	-34.2	0	0	0	111.1	L28 S34	L28-P32 HydrophobicContact CD1-CB 4.48Å; P32-S34 PolarHBondContact O-N 3.27Å
33	P	88.9	Confident	74.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-58.5	139	172.7	27.7	-33.3	0	0	0	108.8	I36 F56 V60 D303 I304 W481	P33-I36 HydrophobicContact CB-CG1 4.37Å; P33-I36 HydrophobicContact CG-CD1 3.97Å; P33-I36 HydrophobicContact CG-CG1 4.26Å; P33-F56 HydrophobicContact CG-CD1 3.63Å; P33-F56 HydrophobicContact CG-CD2 4.39Å; P33-F56 HydrophobicContact CG-CE1 3.59Å; P33-F56 HydrophobicContact CG-CE2 4.37Å; P33-F56 HydrophobicContact CG-CG 4.02Å; P33-F56 HydrophobicContact CG-CZ 3.96Å; P33-V60 HydrophobicContact CG-CG2 4.29Å; P33-V60 WeakPolarHBondContact O-CG2 3.36Å; P33-D303 HydrophobicContact CB-CB 3.97Å; P33-I304 HydrophobicContact CB-CD1 4.12Å; P33-I304 HydrophobicContact CB-CG1 4.45Å; P33-I304 HydrophobicContact CG-CD1 4.01Å; P33-W481 VanDerWaalsContact CA-CZ2 3.43Å; P33-W481 HydrophobicContact CB-CD2 4.15Å; P33-W481 HydrophobicContact CB-CE3 4.27Å; P33-W481 HydrophobicContact CB-CH2 3.86Å; P33-W481 HydrophobicContact CB-CZ2 3.72Å; P33-W481 HydrophobicContact CB-CZ3 4.13Å; P33-W481 HydrophobicContact CG-CD2 4.34Å
34	S	91.1	Very high	77.5	Confident	91 Å²	91	49.8 Å²	49.8	64%	0.636	31%	0.309	S	S	*	.	S	Bend	trans	-76.8	-43.9	-179.1	-64.4	0	0	0	0	110.5	P32 H61 D303	P32-S34 PolarHBondContact O-N 3.27Å; S34-H61 WeakPolarHBondContact O-CB 3.35Å; S34-H61 PolarHBondContact O-N 2.88Å; S34-D303 WeakPolarHBondContact CA-OD2 3.28Å; S34-D303 PolarHBondContact N-OD2 3.23Å
35	K	96	Very high	80.8	Confident	48 Å²	48	46.4 Å²	46.4	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	127.3	-172.4	-132.8	177.3	-171	164.4	0	112.3	H61 E300 F301 Y302 D303	K35-H61 WeakPolarHBondContact CA-O 3.48Å; K35-H61 HydrophobicContact CG-CB 4.06Å; K35-E300 HydrophobicContact CD-CG 4.26Å; K35-E300 IonicContact NZ-OE1 3.23Å; K35-E300 PolarHBondContact NZ-OE1 3.13Å; K35-E300 IonicContact NZ-OE2 3.43Å; K35-E300 PolarHBondContact NZ-OE2 3.14Å; K35-F301 WeakPolarHBondContact CD-O 3.19Å; K35-Y302 HydrophobicContact CB-CD1 3.84Å; K35-Y302 HydrophobicContact CB-CE1 4.33Å; K35-Y302 HydrophobicContact CD-CD1 4.01Å; K35-Y302 HydrophobicContact CD-CE1 3.76Å; K35-Y302 HydrophobicContact CG-CD1 3.75Å; K35-Y302 HydrophobicContact CG-CE1 3.71Å; K35-D303 PolarHBondContact N-OD2 2.86Å; K35-D303 PolarHBondContact O-N 3.17Å
36	I	98.4	Very high	83.4	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.8	175.8	-53.7	178.1	0	0	0	109.9	P33 L52 F56 V60 H61 I62 D63 I304	P33-I36 HydrophobicContact CB-CG1 4.37Å; P33-I36 HydrophobicContact CG-CD1 3.97Å; P33-I36 HydrophobicContact CG-CG1 4.26Å; I36-L52 HydrophobicContact CD1-CD1 4.26Å; I36-L52 HydrophobicContact CD1-CD2 4.3Å; I36-L52 HydrophobicContact CG2-CD1 3.83Å; I36-F56 HydrophobicContact CD1-CD2 3.94Å; I36-F56 HydrophobicContact CD1-CE2 4.11Å; I36-V60 HydrophobicContact CD1-CG2 3.67Å; I36-V60 HydrophobicContact CG1-CG2 3.77Å; I36-H61 PolarHBondContact N-O 3.18Å; I36-I62 WeakPolarHBondContact O-CA 3.43Å; I36-D63 PolarHBondContact O-N 3.37Å; I36-I304 WeakPolarHBondContact CA-O 3.31Å; I36-I304 HydrophobicContact CB-CB 4.45Å; I36-I304 HydrophobicContact CD1-CD1 4.15Å; I36-I304 HydrophobicContact CG1-CB 4.07Å; I36-I304 HydrophobicContact CG1-CD1 4.33Å; I36-I304 HydrophobicContact CG1-CG1 4.48Å; I36-I304 HydrophobicContact CG2-CB 3.98Å; I36-I304 HydrophobicContact CG2-CG2 4.13Å
37	A	98.7	Very high	86	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	139.1	172.8	0	0	0	0	0	111.9	D63 F65 L289 Y302 I304 V305 V306	A37-D63 CarbonylContact C-O 3.35Å; A37-D63 WeakPolarHBondContact CA-O 3.36Å; A37-F65 HydrophobicContact CB-CD2 4.38Å; A37-F65 HydrophobicContact CB-CE2 3.99Å; A37-L289 HydrophobicContact CB-CD2 3.53Å; A37-Y302 HydrophobicContact CB-CD1 3.54Å; A37-Y302 HydrophobicContact CB-CD2 3.68Å; A37-Y302 HydrophobicContact CB-CE1 3.78Å; A37-Y302 HydrophobicContact CB-CE2 3.9Å; A37-Y302 HydrophobicContact CB-CG 3.49Å; A37-Y302 VanDerWaalsContact CB-CG 3.49Å; A37-I304 PolarHBondContact N-O 3.32Å; A37-V305 HydrophobicContact CB-CG2 4.38Å; A37-V305 CarbonylContact O-C 3.39Å; A37-V305 WeakPolarHBondContact O-CA 3.47Å; A37-V306 PolarHBondContact O-N 3.11Å
38	I	98.9	Very high	88.8	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.3	171.8	-57.6	166.7	0	0	0	108.4	T48 A49 L52 I62 D63 V64 F65 V306 A308	I38-T48 HydrophobicContact CD1-CG2 4.04Å; I38-T48 HydrophobicContact CG1-CG2 4.43Å; I38-A49 VanDerWaalsContact CD1-CA 3.45Å; I38-A49 HydrophobicContact CD1-CB 3.56Å; I38-L52 HydrophobicContact CD1-CD1 4.11Å; I38-I62 HydrophobicContact CD1-CG2 3.89Å; I38-D63 PolarHBondContact N-O 2.7Å; I38-V64 HydrophobicContact CB-CG1 4.47Å; I38-V64 HydrophobicContact CB-CG2 4.19Å; I38-V64 HydrophobicContact CD1-CG2 4.18Å; I38-V64 CarbonylContact O-C 3.59Å; I38-V64 WeakPolarHBondContact O-CA 3.43Å; I38-F65 PolarHBondContact O-N 2.82Å; I38-V306 CarbonylContact C-O 3.51Å; I38-V306 WeakPolarHBondContact CA-O 3.15Å; I38-V306 HydrophobicContact CG1-CB 4.32Å; I38-A308 HydrophobicContact CG2-CB 4.27Å
39	V	98.7	Very high	91.1	Very high	10 Å²	10	25.7 Å²	25.7	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	100.6	-178	-170.6	0	0	0	0	109.7	V273 L289 V306 A308 T309 I319	V39-V273 HydrophobicContact CG1-CB 3.92Å; V39-V273 HydrophobicContact CG1-CG2 3.88Å; V39-V273 HydrophobicContact CG2-CB 4.4Å; V39-V273 HydrophobicContact CG2-CG1 4.49Å; V39-V273 HydrophobicContact CG2-CG2 3.95Å; V39-L289 HydrophobicContact CG2-CD2 4.3Å; V39-V306 PolarHBondContact N-O 2.81Å; V39-A308 CarbonylContact O-C 3.41Å; V39-A308 VanDerWaalsContact O-CA 3.24Å; V39-A308 WeakPolarHBondContact O-CA 3.44Å; V39-A308 WeakPolarHBondContact O-CB 3.37Å; V39-A308 PolarHBondContact O-N 2.95Å; V39-T309 HydrophobicContact CG1-CG2 4.32Å; V39-T309 PolarHBondContact O-N 2.8Å; V39-I319 HydrophobicContact CG1-CD1 3.85Å
40	G	98.3	Very high	93.6	Very high	10 Å²	10	19.9 Å²	19.9	10%	0.103	14%	0.137	C	C	.	.			trans	115.3	127.2	-178.3	0	0	0	0	0	112.7	G45 F65	G40-G45 WeakPolarHBondContact O-CA 3.47Å; G40-F65 WeakPolarHBondContact CA-O 3.15Å; G40-F65 PolarHBondContact N-O 3.5Å
41	A	98.3	Very high	95.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.114	C	C	.	.			trans	-105.5	34.1	179	0	0	0	0	0	112.9	T46 V64 E66 V70 G71 L261 L268	A41-T46 HydrophobicContact CB-CG2 4.15Å; A41-T46 WeakPolarHBondContact O-CG2 3.45Å; A41-V64 HydrophobicContact CB-CG1 3.86Å; A41-E66 WeakPolarHBondContact CA-OE2 3.4Å; A41-E66 HydrophobicContact CB-CB 3.66Å; A41-E66 HydrophobicContact CB-CG 3.85Å; A41-E66 PolarHBondContact N-OE2 3.45Å; A41-V70 HydrophobicContact CB-CB 4.45Å; A41-V70 HydrophobicContact CB-CG1 4.34Å; A41-V70 HydrophobicContact CB-CG2 4.06Å; A41-G71 PolarHBondContact O-N 2.73Å; A41-L261 HydrophobicContact CB-CD1 4.41Å; A41-L268 HydrophobicContact CB-CD1 4.22Å
42	G	98.1	Very high	96.7	Very high	16 Å²	16	12.2 Å²	12.2	17%	0.165	8%	0.08	C	C	.	.	B	Isolated β-bridge	trans	-73.5	-178.1	163.4	0	0	0	0	0	112.4	G44 G45 T46	G42-G44 VanDerWaalsContact C-N 3.3Å; G42-G44 PolarHBondContact O-N 3.27Å; G42-G45 PolarHBondContact O-N 2.87Å; G42-T46 WeakPolarHBondContact O-CG2 3.5Å; G42-T46 PolarHBondContact O-N 2.87Å; G42-T46 PolarHBondContact O-OG1 3.09Å
43	I	98.3	Very high	97.6	Very high	14 Å²	14	11.9 Å²	11.9	7%	0.072	7%	0.073	C	C	.	.	H	α-helix	trans	-54.6	-43.9	-179.6	-173.9	59.4	0	0	0	112.8	T46 A47 L74 M98 F101 V256 C257 L260 M463	I43-T46 PolarHBondContact O-OG1 2.9Å; I43-A47 WeakPolarHBondContact O-CB 3.49Å; I43-A47 PolarHBondContact O-N 2.8Å; I43-L74 HydrophobicContact CB-CD1 3.93Å; I43-L74 HydrophobicContact CG1-CD1 4.5Å; I43-L74 HydrophobicContact CG2-CD1 4.42Å; I43-M98 HydrophobicContact CD1-CE 4.36Å; I43-M98 HydrophobicContact CD1-SD 3.78Å; I43-M98 HydrophobicContact CG1-SD 3.96Å; I43-F101 HydrophobicContact CD1-CD2 4.46Å; I43-F101 HydrophobicContact CD1-CE2 4.45Å; I43-V256 HydrophobicContact CD1-CG1 3.81Å; I43-C257 VanDerWaalsContact CA-SG 3.52Å; I43-C257 PolarHBondContact N-SG 3.3Å; I43-L260 HydrophobicContact CD1-CD1 4.08Å; I43-M463 HydrophobicContact CG2-CG 4.48Å
44	G	98.4	Very high	97.9	Very high	6 Å²	6	15.8 Å²	15.8	6%	0.062	9%	0.091	C	C	.	.	H	α-helix	trans	-57.7	-56.3	176.1	0	0	0	0	0	112.9	G42 T46 A47 T48 L453 A470	G42-G44 VanDerWaalsContact C-N 3.3Å; G42-G44 PolarHBondContact O-N 3.27Å; G44-T46 PolarHBondContact O-N 3Å; G44-A47 PolarHBondContact O-N 2.74Å; G44-T48 PolarHBondContact O-N 2.96Å; G44-T48 PolarHBondContact O-OG1 3.43Å; G44-T48 VanDerWaalsContact O-OG1 3.07Å; G44-L453 VanDerWaalsContact C-CD1 3.48Å; G44-A470 WeakPolarHBondContact O-CB 3.2Å
45	G	98.6	Very high	98.1	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-65.1	-40.6	-177.5	0	0	0	0	0	113.7	G40 G42 T48 A49	G40-G45 WeakPolarHBondContact O-CA 3.47Å; G42-G45 PolarHBondContact O-N 2.87Å; G45-T48 PolarHBondContact O-N 2.87Å; G45-A49 PolarHBondContact O-N 2.81Å
46	T	98.8	Very high	98.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-68.1	-36.4	176.4	59.7	0	0	0	0	112.8	A41 G42 I43 G44 A49 H50 C257 L261	A41-T46 HydrophobicContact CB-CG2 4.15Å; A41-T46 WeakPolarHBondContact O-CG2 3.45Å; G42-T46 WeakPolarHBondContact O-CG2 3.5Å; G42-T46 PolarHBondContact O-N 2.87Å; G42-T46 PolarHBondContact O-OG1 3.09Å; I43-T46 PolarHBondContact O-OG1 2.9Å; G44-T46 PolarHBondContact O-N 3Å; T46-A49 PolarHBondContact O-N 3.08Å; T46-H50 PolarHBondContact O-N 2.95Å; T46-H50 VanDerWaalsContact O-N 3.14Å; T46-C257 HydrophobicContact CG2-CB 3.95Å; T46-C257 WeakPolarHBondContact OG1-CA 3.48Å; T46-L261 HydrophobicContact CG2-CD1 3.94Å; T46-L261 HydrophobicContact CG2-CD2 3.8Å; T46-L261 HydrophobicContact CG2-CG 3.56Å
47	A	98.8	Very high	97.9	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.6	-39	171.3	0	0	0	0	0	111.7	I43 G44 A49 H50 F51 F101 L260 A470	I43-A47 WeakPolarHBondContact O-CB 3.49Å; I43-A47 PolarHBondContact O-N 2.8Å; G44-A47 PolarHBondContact O-N 2.74Å; A47-A49 PolarHBondContact O-N 3.49Å; A47-H50 WeakPolarHBondContact O-CB 3.27Å; A47-H50 PolarHBondContact O-N 2.91Å; A47-F51 HydrophobicContact CB-CD2 4.39Å; A47-F51 HydrophobicContact CB-CE2 4.19Å; A47-F51 WeakPolarHBondContact O-CD2 3.3Å; A47-F51 WeakPolarHBondContact O-CG 3.17Å; A47-F51 PolarHBondContact O-N 2.91Å; A47-F101 HydrophobicContact CB-CE2 4.02Å; A47-F101 HydrophobicContact CB-CZ 3.87Å; A47-L260 HydrophobicContact CB-CD1 4.23Å; A47-A470 HydrophobicContact CB-CB 3.68Å
48	T	98.9	Very high	97.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-45	175.3	-64.7	0	0	0	0	110.8	I38 G44 G45 H50 F51 L52 V306 L453 A470 I473	I38-T48 HydrophobicContact CD1-CG2 4.04Å; I38-T48 HydrophobicContact CG1-CG2 4.43Å; G44-T48 PolarHBondContact O-N 2.96Å; G44-T48 PolarHBondContact O-OG1 3.43Å; G44-T48 VanDerWaalsContact O-OG1 3.07Å; G45-T48 PolarHBondContact O-N 2.87Å; T48-H50 VanDerWaalsContact C-N 3.3Å; T48-H50 PolarHBondContact O-N 2.79Å; T48-F51 PolarHBondContact O-N 3.19Å; T48-L52 HydrophobicContact CG2-CD1 3.56Å; T48-L52 HydrophobicContact CG2-CG 4Å; T48-L52 VanDerWaalsContact O-CB 3.32Å; T48-L52 WeakPolarHBondContact O-CB 3.27Å; T48-L52 VanDerWaalsContact O-CG 3.24Å; T48-L52 WeakPolarHBondContact O-CG 3.31Å; T48-L52 PolarHBondContact O-N 3.37Å; T48-V306 HydrophobicContact CG2-CB 4.35Å; T48-V306 HydrophobicContact CG2-CG1 4.18Å; T48-V306 HydrophobicContact CG2-CG2 4.05Å; T48-L453 VanDerWaalsContact OG1-CD1 3.27Å; T48-L453 WeakPolarHBondContact OG1-CD1 3.25Å; T48-A470 WeakPolarHBondContact OG1-CA 3.43Å; T48-A470 WeakPolarHBondContact OG1-CB 3.44Å; T48-I473 HydrophobicContact CG2-CG2 4.47Å
49	A	98.8	Very high	97.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.5	-45.9	175.7	0	0	0	0	0	111.5	I38 G45 T46 A47 R53 I62 V64 A264 A266	I38-A49 VanDerWaalsContact CD1-CA 3.45Å; I38-A49 HydrophobicContact CD1-CB 3.56Å; G45-A49 PolarHBondContact O-N 2.81Å; T46-A49 PolarHBondContact O-N 3.08Å; A47-A49 PolarHBondContact O-N 3.49Å; A49-R53 WeakPolarHBondContact O-CB 3.46Å; A49-R53 PolarHBondContact O-N 3.43Å; A49-I62 HydrophobicContact CB-CG2 4.18Å; A49-V64 HydrophobicContact CB-CG2 4.07Å; A49-A264 HydrophobicContact CB-CB 4.03Å; A49-A266 HydrophobicContact CB-CB 4.22Å
50	H	98.6	Very high	97.2	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.046	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-49	177.3	175.3	72.9	0	0	0	112.5	T46 A47 T48 R53 Q54 F101 Q104 L260 A264	T46-H50 PolarHBondContact O-N 2.95Å; T46-H50 VanDerWaalsContact O-N 3.14Å; A47-H50 WeakPolarHBondContact O-CB 3.27Å; A47-H50 PolarHBondContact O-N 2.91Å; T48-H50 VanDerWaalsContact C-N 3.3Å; T48-H50 PolarHBondContact O-N 2.79Å; H50-R53 WeakPolarHBondContact O-CB 3.21Å; H50-R53 PolarHBondContact O-N 3.47Å; H50-Q54 PolarHBondContact NE2-NE2 2.74Å; H50-Q54 WeakPolarHBondContact O-CG 3.46Å; H50-Q54 PolarHBondContact O-N 3.42Å; H50-Q54 VanDerWaalsContact O-N 3.11Å; H50-F101 AromaticContact CD2-CE1 3.96Å; H50-Q104 PolarHBondContact CE1-OE1 3.31Å; H50-Q104 VanDerWaalsContact CE1-OE1 3.3Å; H50-L260 HydrophobicContact CB-CB 4.39Å; H50-L260 HydrophobicContact CB-CD2 3.98Å; H50-A264 HydrophobicContact CB-CB 4.5Å
51	F	98.7	Very high	97.2	Very high	6 Å²	6	28 Å²	28	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-71.1	-35.2	-178.6	-66.9	-48.5	0	0	0	113.5	A47 T48 R53 Q54 H55 H97 F101 A470 K471 A474	A47-F51 HydrophobicContact CB-CD2 4.39Å; A47-F51 HydrophobicContact CB-CE2 4.19Å; A47-F51 WeakPolarHBondContact O-CD2 3.3Å; A47-F51 WeakPolarHBondContact O-CG 3.17Å; A47-F51 PolarHBondContact O-N 2.91Å; T48-F51 PolarHBondContact O-N 3.19Å; F51-R53 VanDerWaalsContact C-N 3.34Å; F51-Q54 WeakPolarHBondContact O-CB 3.24Å; F51-Q54 PolarHBondContact O-N 2.87Å; F51-H55 PolarHBondContact O-CD2 3.42Å; F51-H55 VanDerWaalsContact O-CD2 3.28Å; F51-H55 PolarHBondContact O-N 3.15Å; F51-H97 AromaticContact CZ-ND1 3.61Å; F51-F101 AromaticContact CE1-CE1 3.97Å; F51-F101 HydrophobicContact CE1-CE1 3.97Å; F51-F101 HydrophobicContact CE1-CZ 4.34Å; F51-F101 HydrophobicContact CE2-CE1 4.14Å; F51-F101 AromaticContact CE2-CZ 3.69Å; F51-F101 HydrophobicContact CE2-CZ 3.69Å; F51-F101 AromaticContact CZ-CE1 3.49Å; F51-F101 HydrophobicContact CZ-CE1 3.49Å; F51-F101 VanDerWaalsContact CZ-CE1 3.49Å; F51-F101 AromaticContact CZ-CZ 3.45Å; F51-F101 HydrophobicContact CZ-CZ 3.45Å; F51-F101 VanDerWaalsContact CZ-CZ 3.45Å; F51-A470 HydrophobicContact CD2-CB 4.19Å; F51-A470 HydrophobicContact CE2-CB 4.45Å; F51-K471 HydrophobicContact CB-CD 4.1Å; F51-K471 HydrophobicContact CD1-CD 3.54Å; F51-K471 VanDerWaalsContact CD2-CA 3.49Å; F51-K471 HydrophobicContact CD2-CB 3.72Å; F51-K471 HydrophobicContact CD2-CD 3.97Å; F51-K471 HydrophobicContact CD2-CG 4.46Å; F51-K471 HydrophobicContact CE1-CD 3.8Å; F51-K471 HydrophobicContact CE2-CB 3.6Å; F51-K471 HydrophobicContact CE2-CD 4.2Å; F51-K471 HydrophobicContact CE2-CG 4.41Å; F51-K471 HydrophobicContact CG-CB 4.27Å; F51-K471 HydrophobicContact CG-CD 3.62Å; F51-K471 HydrophobicContact CZ-CB 4.06Å; F51-K471 HydrophobicContact CZ-CD 4.11Å; F51-K471 HydrophobicContact CZ-CG 4.47Å; F51-A474 HydrophobicContact CB-CB 3.51Å
52	L	98.5	Very high	97.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-42.4	172.5	-73.4	170.7	0	0	0	110.9	I36 I38 T48 Q54 H55 F56 I62 A474 A477	I36-L52 HydrophobicContact CD1-CD1 4.26Å; I36-L52 HydrophobicContact CD1-CD2 4.3Å; I36-L52 HydrophobicContact CG2-CD1 3.83Å; I38-L52 HydrophobicContact CD1-CD1 4.11Å; T48-L52 HydrophobicContact CG2-CD1 3.56Å; T48-L52 HydrophobicContact CG2-CG 4Å; T48-L52 VanDerWaalsContact O-CB 3.32Å; T48-L52 WeakPolarHBondContact O-CB 3.27Å; T48-L52 VanDerWaalsContact O-CG 3.24Å; T48-L52 WeakPolarHBondContact O-CG 3.31Å; T48-L52 PolarHBondContact O-N 3.37Å; L52-Q54 VanDerWaalsContact C-N 3.29Å; L52-Q54 PolarHBondContact O-N 2.76Å; L52-H55 PolarHBondContact O-N 2.99Å; L52-F56 HydrophobicContact CB-CD2 4.39Å; L52-F56 HydrophobicContact CD2-CD2 3.88Å; L52-F56 HydrophobicContact CD2-CE2 3.59Å; L52-F56 WeakPolarHBondContact O-CB 3.36Å; L52-F56 PolarHBondContact O-N 2.63Å; L52-I62 HydrophobicContact CB-CD1 4.21Å; L52-A474 HydrophobicContact CD2-CB 3.97Å; L52-A474 HydrophobicContact CG-CB 4.05Å; L52-A477 HydrophobicContact CD2-CB 4.19Å
53	R	97.4	Very high	97.2	Very high	37 Å²	37	27.5 Å²	27.5	14%	0.14	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-39.5	174.5	176.9	60.9	68.4	-162.3	3	112.3	A49 H50 F51 H55 G57 P58 V60 I62 A264	A49-R53 WeakPolarHBondContact O-CB 3.46Å; A49-R53 PolarHBondContact O-N 3.43Å; H50-R53 WeakPolarHBondContact O-CB 3.21Å; H50-R53 PolarHBondContact O-N 3.47Å; F51-R53 VanDerWaalsContact C-N 3.34Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 2.98Å; R53-G57 VanDerWaalsContact CD-O 3.3Å; R53-G57 WeakPolarHBondContact CD-O 3.47Å; R53-G57 PolarHBondContact NH1-O 3.15Å; R53-G57 WeakPolarHBondContact O-CA 3.45Å; R53-G57 PolarHBondContact O-N 3.43Å; R53-G57 VanDerWaalsContact O-N 3.15Å; R53-P58 PolarHBondContact NH1-O 3.06Å; R53-V60 VanDerWaalsContact NH1-CG1 3.28Å; R53-V60 PolarHBondContact NH1-O 3.16Å; R53-V60 PolarHBondContact NH2-O 3.01Å; R53-I62 HydrophobicContact CB-CD1 4.05Å; R53-A264 HydrophobicContact CB-CB 4.35Å; R53-A264 PolarHBondContact NE-O 3.14Å
54	Q	96.4	Very high	97.2	Very high	83 Å²	83	26.8 Å²	26.8	39%	0.388	14%	0.14	S	C	.	.	H	α-helix	trans	-63.8	-37	177.3	-73.1	-177.6	-19.4	0	0	112.6	H50 F51 L52	H50-Q54 PolarHBondContact NE2-NE2 2.74Å; H50-Q54 WeakPolarHBondContact O-CG 3.46Å; H50-Q54 PolarHBondContact O-N 3.42Å; H50-Q54 VanDerWaalsContact O-N 3.11Å; F51-Q54 WeakPolarHBondContact O-CB 3.24Å; F51-Q54 PolarHBondContact O-N 2.87Å; L52-Q54 VanDerWaalsContact C-N 3.29Å; L52-Q54 PolarHBondContact O-N 2.76Å
55	H	95.5	Very high	97.2	Very high	42 Å²	42	26.6 Å²	26.6	19%	0.194	14%	0.137	C	C	.	.	H	α-helix	trans	-88.6	-42.8	-174.9	-71.6	-53.4	0	0	0	113.7	F51 L52 R53 K471 L475 Y478	F51-H55 PolarHBondContact O-CD2 3.42Å; F51-H55 VanDerWaalsContact O-CD2 3.28Å; F51-H55 PolarHBondContact O-N 3.15Å; L52-H55 PolarHBondContact O-N 2.99Å; R53-H55 VanDerWaalsContact C-N 3.32Å; R53-H55 PolarHBondContact O-N 2.98Å; H55-K471 PolarHBondContact NE2-NZ 2.82Å; H55-L475 WeakPolarHBondContact CE1-CD2 3.43Å; H55-L475 WeakPolarHBondContact NE2-CD2 3.39Å; H55-Y478 HydrophobicContact CB-CD2 3.88Å; H55-Y478 HydrophobicContact CB-CG 4.15Å; H55-Y478 WeakPolarHBondContact O-CE2 3.44Å
56	F	95.8	Very high	97.2	Very high	9 Å²	9	27.6 Å²	27.6	4%	0.039	14%	0.142	C	C	.	.	H	α-helix	trans	-89.5	-5.8	-178.1	-71.2	-69.1	0	0	0	114	P33 I36 L52 V60 I304 A477 Y478 W481	P33-F56 HydrophobicContact CG-CD1 3.63Å; P33-F56 HydrophobicContact CG-CD2 4.39Å; P33-F56 HydrophobicContact CG-CE1 3.59Å; P33-F56 HydrophobicContact CG-CE2 4.37Å; P33-F56 HydrophobicContact CG-CG 4.02Å; P33-F56 HydrophobicContact CG-CZ 3.96Å; I36-F56 HydrophobicContact CD1-CD2 3.94Å; I36-F56 HydrophobicContact CD1-CE2 4.11Å; L52-F56 HydrophobicContact CB-CD2 4.39Å; L52-F56 HydrophobicContact CD2-CD2 3.88Å; L52-F56 HydrophobicContact CD2-CE2 3.59Å; L52-F56 WeakPolarHBondContact O-CB 3.36Å; L52-F56 PolarHBondContact O-N 2.63Å; F56-V60 HydrophobicContact CB-CB 4.13Å; F56-V60 HydrophobicContact CB-CG1 3.71Å; F56-I304 HydrophobicContact CE2-CD1 4.28Å; F56-I304 HydrophobicContact CZ-CD1 4Å; F56-A477 HydrophobicContact CE2-CB 4.42Å; F56-Y478 HydrophobicContact CD1-CD2 4.08Å; F56-Y478 AromaticContact CE1-CD2 3.92Å; F56-Y478 HydrophobicContact CE1-CD2 3.92Å; F56-Y478 HydrophobicContact CZ-CD2 4.26Å; F56-W481 HydrophobicContact CE1-CB 4.03Å; F56-W481 HydrophobicContact CE1-CG 4.01Å; F56-W481 HydrophobicContact CZ-CB 4.15Å; F56-W481 HydrophobicContact CZ-CG 4.45Å
57	G	94.4	Very high	97	Very high	22 Å²	22	32.7 Å²	32.7	23%	0.227	16%	0.164	C	C	.	.			trans	79.2	-174.1	176.2	0	0	0	0	0	114.3	R53 E59 V60	R53-G57 VanDerWaalsContact CD-O 3.3Å; R53-G57 WeakPolarHBondContact CD-O 3.47Å; R53-G57 PolarHBondContact NH1-O 3.15Å; R53-G57 WeakPolarHBondContact O-CA 3.45Å; R53-G57 PolarHBondContact O-N 3.43Å; R53-G57 VanDerWaalsContact O-N 3.15Å; G57-E59 PolarHBondContact O-N 3.2Å; G57-V60 WeakPolarHBondContact O-CG1 3.33Å
58	P	93.6	Very high	96.8	Very high	100 Å²	100	34.2 Å²	34.2	65%	0.649	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-18.1	-171.3	29.6	-35.4	0	0	0	114.9	R53	R53-P58 PolarHBondContact NH1-O 3.06Å
59	E	91.6	Very high	96.6	Very high	162 Å²	162	39.7 Å²	39.7	76%	0.757	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-23.1	-173.6	-58.2	-53.4	121.7	0	0	113.6	G57 H61	G57-E59 PolarHBondContact O-N 3.2Å; E59-H61 PolarHBondContact O-N 2.5Å
60	V	95.1	Very high	96.6	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	22%	0.219	C	C	.	.	S	Bend	trans	-67.6	135.9	179.5	63.4	0	0	0	0	111.3	P33 I36 R53 F56 G57 I62	P33-V60 HydrophobicContact CG-CG2 4.29Å; P33-V60 WeakPolarHBondContact O-CG2 3.36Å; I36-V60 HydrophobicContact CD1-CG2 3.67Å; I36-V60 HydrophobicContact CG1-CG2 3.77Å; R53-V60 VanDerWaalsContact NH1-CG1 3.28Å; R53-V60 PolarHBondContact NH1-O 3.16Å; R53-V60 PolarHBondContact NH2-O 3.01Å; F56-V60 HydrophobicContact CB-CB 4.13Å; F56-V60 HydrophobicContact CB-CG1 3.71Å; G57-V60 WeakPolarHBondContact O-CG1 3.33Å; V60-I62 HydrophobicContact CG1-CD1 4.1Å; V60-I62 HydrophobicContact CG1-CG1 4.08Å; V60-I62 HydrophobicContact CG2-CG1 4.33Å
61	H	97.7	Very high	96.4	Very high	77 Å²	77	40.2 Å²	40.2	36%	0.356	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.4	171.5	-175.4	83.2	0	0	0	109.9	S34 K35 I36 E59 D63	S34-H61 WeakPolarHBondContact O-CB 3.35Å; S34-H61 PolarHBondContact O-N 2.88Å; K35-H61 WeakPolarHBondContact CA-O 3.48Å; K35-H61 HydrophobicContact CG-CB 4.06Å; I36-H61 PolarHBondContact N-O 3.18Å; E59-H61 PolarHBondContact O-N 2.5Å; H61-D63 IonicContact CD2-OD1 2.69Å; H61-D63 IonicContact CD2-OD2 3.66Å; H61-D63 PolarHBondContact CD2-OD2 3.33Å; H61-D63 IonicContact CE1-OD1 2.67Å; H61-D63 IonicContact NE2-OD1 3.63Å; H61-D63 PolarHBondContact NE2-OD1 3.33Å; H61-D63 IonicContact NE2-OD2 3.32Å; H61-D63 PolarHBondContact NE2-OD2 2.75Å; H61-D63 VanDerWaalsContact NE2-OD2 3.15Å
62	I	98.7	Very high	96.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.5	-178.1	-56.5	176	0	0	0	108.7	I36 I38 A49 L52 R53 V60 V64 A266 N267	I36-I62 WeakPolarHBondContact O-CA 3.43Å; I38-I62 HydrophobicContact CD1-CG2 3.89Å; A49-I62 HydrophobicContact CB-CG2 4.18Å; L52-I62 HydrophobicContact CB-CD1 4.21Å; R53-I62 HydrophobicContact CB-CD1 4.05Å; V60-I62 HydrophobicContact CG1-CD1 4.1Å; V60-I62 HydrophobicContact CG1-CG1 4.08Å; V60-I62 HydrophobicContact CG2-CG1 4.33Å; I62-V64 HydrophobicContact CG2-CG2 4.36Å; I62-A266 HydrophobicContact CB-CB 4.4Å; I62-A266 HydrophobicContact CG2-CB 4.17Å; I62-N267 PolarHBondContact O-N 2.95Å
63	D	98.7	Very high	96.1	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.7	171.7	-72.5	-37.7	0	0	0	110.1	I36 A37 I38 H61 F65 N267 I269 Y302	I36-D63 PolarHBondContact O-N 3.37Å; A37-D63 CarbonylContact C-O 3.35Å; A37-D63 WeakPolarHBondContact CA-O 3.36Å; I38-D63 PolarHBondContact N-O 2.7Å; H61-D63 IonicContact CD2-OD1 2.69Å; H61-D63 IonicContact CD2-OD2 3.66Å; H61-D63 PolarHBondContact CD2-OD2 3.33Å; H61-D63 IonicContact CE1-OD1 2.67Å; H61-D63 IonicContact NE2-OD1 3.63Å; H61-D63 PolarHBondContact NE2-OD1 3.33Å; H61-D63 IonicContact NE2-OD2 3.32Å; H61-D63 PolarHBondContact NE2-OD2 2.75Å; H61-D63 VanDerWaalsContact NE2-OD2 3.15Å; D63-F65 HydrophobicContact CB-CE2 4Å; D63-F65 HydrophobicContact CB-CZ 4.45Å; D63-N267 WeakPolarHBondContact CA-O 3.47Å; D63-N267 VanDerWaalsContact OD1-CB 3.31Å; D63-N267 WeakPolarHBondContact OD1-CB 3.36Å; D63-N267 PolarHBondContact OD1-ND2 3.03Å; D63-I269 HydrophobicContact CB-CD1 3.89Å; D63-Y302 HydrophobicContact CB-CE1 3.89Å; D63-Y302 VanDerWaalsContact OD2-CE1 3.24Å; D63-Y302 WeakPolarHBondContact OD2-CE1 3.14Å; D63-Y302 PolarHBondContact OD2-OH 2.96Å
64	V	98.8	Very high	96.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.2	173.3	-175.8	0	0	0	0	108.4	I38 A41 A49 I62 L261 A266 N267 L268 I269	I38-V64 HydrophobicContact CB-CG1 4.47Å; I38-V64 HydrophobicContact CB-CG2 4.19Å; I38-V64 HydrophobicContact CD1-CG2 4.18Å; I38-V64 CarbonylContact O-C 3.59Å; I38-V64 WeakPolarHBondContact O-CA 3.43Å; A41-V64 HydrophobicContact CB-CG1 3.86Å; A49-V64 HydrophobicContact CB-CG2 4.07Å; I62-V64 HydrophobicContact CG2-CG2 4.36Å; V64-L261 HydrophobicContact CB-CD2 4.04Å; V64-L261 HydrophobicContact CG1-CD2 4.14Å; V64-L261 HydrophobicContact CG2-CD2 3.69Å; V64-A266 HydrophobicContact CG2-CB 3.89Å; V64-N267 PolarHBondContact N-O 3.39Å; V64-L268 HydrophobicContact CG1-CD1 4.49Å; V64-I269 PolarHBondContact O-N 2.94Å
65	F	98.6	Very high	96	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.1	178.5	-66.2	-88.4	0	0	0	110.6	A37 I38 G40 D63 I269 A271 V273 L289 Y291 Y302	A37-F65 HydrophobicContact CB-CD2 4.38Å; A37-F65 HydrophobicContact CB-CE2 3.99Å; I38-F65 PolarHBondContact O-N 2.82Å; G40-F65 WeakPolarHBondContact CA-O 3.15Å; G40-F65 PolarHBondContact N-O 3.5Å; D63-F65 HydrophobicContact CB-CE2 4Å; D63-F65 HydrophobicContact CB-CZ 4.45Å; F65-I269 WeakPolarHBondContact CA-O 3.37Å; F65-I269 HydrophobicContact CD1-CB 3.82Å; F65-I269 HydrophobicContact CD1-CD1 4.3Å; F65-I269 HydrophobicContact CD1-CG2 3.82Å; F65-I269 HydrophobicContact CE1-CB 3.98Å; F65-I269 HydrophobicContact CE1-CD1 3.64Å; F65-I269 HydrophobicContact CE1-CG1 4.4Å; F65-I269 HydrophobicContact CE1-CG2 3.79Å; F65-I269 HydrophobicContact CE2-CD1 4.45Å; F65-I269 HydrophobicContact CZ-CD1 3.74Å; F65-A271 HydrophobicContact CD1-CB 4.24Å; F65-V273 HydrophobicContact CB-CG2 3.69Å; F65-V273 HydrophobicContact CD1-CG2 4.03Å; F65-V273 HydrophobicContact CD2-CG2 4.11Å; F65-V273 HydrophobicContact CG-CG2 3.68Å; F65-L289 HydrophobicContact CD2-CD2 4.29Å; F65-L289 HydrophobicContact CE2-CD2 3.95Å; F65-Y291 HydrophobicContact CD1-CD1 4.36Å; F65-Y291 HydrophobicContact CD1-CG 4.17Å; F65-Y291 AromaticContact CE1-CD1 3.44Å; F65-Y291 HydrophobicContact CE1-CD1 3.44Å; F65-Y291 VanDerWaalsContact CE1-CD1 3.44Å; F65-Y291 HydrophobicContact CE1-CD2 4.03Å; F65-Y291 AromaticContact CE1-CE1 3.7Å; F65-Y291 HydrophobicContact CE1-CE1 3.7Å; F65-Y291 HydrophobicContact CE1-CE2 4.26Å; F65-Y291 AromaticContact CE1-CG 3.61Å; F65-Y291 HydrophobicContact CE1-CG 3.61Å; F65-Y291 AromaticContact CZ-CD1 3.88Å; F65-Y291 HydrophobicContact CZ-CD1 3.88Å; F65-Y291 AromaticContact CZ-CE1 3.97Å; F65-Y291 HydrophobicContact CZ-CE1 3.97Å; F65-Y291 HydrophobicContact CZ-CG 4.48Å; F65-Y302 HydrophobicContact CE2-CE2 4.02Å; F65-Y302 AromaticContact CE2-CZ 3.81Å; F65-Y302 WeakPolarHBondContact CE2-OH 3.46Å; F65-Y302 HydrophobicContact CZ-CE2 4.09Å; F65-Y302 AromaticContact CZ-CZ 3.92Å; F65-Y302 WeakPolarHBondContact CZ-OH 3.44Å
66	E	97.9	Very high	96.1	Very high	21 Å²	21	39.4 Å²	39.4	10%	0.098	23%	0.227	C	C	.	.			trans	-133.2	125.3	176.5	178.4	53	-112	0	0	111.2	A41 G68 L268 I269 Q270 A271	A41-E66 WeakPolarHBondContact CA-OE2 3.4Å; A41-E66 HydrophobicContact CB-CB 3.66Å; A41-E66 HydrophobicContact CB-CG 3.85Å; A41-E66 PolarHBondContact N-OE2 3.45Å; E66-G68 WeakPolarHBondContact CG-O 3.39Å; E66-G68 WeakPolarHBondContact OE1-CA 3.45Å; E66-G68 PolarHBondContact OE1-N 2.85Å; E66-L268 HydrophobicContact CB-CD1 3.97Å; E66-I269 PolarHBondContact N-O 3.35Å; E66-Q270 CarbonylContact O-C 3.6Å; E66-Q270 VanDerWaalsContact O-CA 3.27Å; E66-Q270 WeakPolarHBondContact O-CA 3.41Å; E66-Q270 PolarHBondContact O-NE2 2.79Å; E66-A271 CarbonylContact C-O 3.41Å; E66-A271 VanDerWaalsContact C-O 3.31Å; E66-A271 PolarHBondContact O-N 3.13Å
67	K	94.9	Very high	96.1	Very high	108 Å²	108	40.2 Å²	40.2	47%	0.47	23%	0.233	S	C	.	.	S	Bend	trans	-83.8	-31.6	179.4	68.5	179.8	-179.5	-177.6	0	112.8	Q270 A271 Q272	K67-Q270 PolarHBondContact O-NE2 2.77Å; K67-A271 PolarHBondContact N-O 3.4Å; K67-Q272 HydrophobicContact CB-CB 3.94Å; K67-Q272 HydrophobicContact CB-CG 4.48Å; K67-Q272 HydrophobicContact CD-CG 4.24Å
68	G	93.9	Very high	96.3	Very high	32 Å²	32	43.3 Å²	43.3	33%	0.33	25%	0.247	S	C	.	.	S	Bend	trans	-111.8	-139.1	-176.5	0	0	0	0	0	112.3	E66 Q270	E66-G68 WeakPolarHBondContact CG-O 3.39Å; E66-G68 WeakPolarHBondContact OE1-CA 3.45Å; E66-G68 PolarHBondContact OE1-N 2.85Å; G68-Q270 PolarHBondContact O-NE2 3.27Å
69	T	95	Very high	96.4	Very high	114 Å²	114	38.6 Å²	38.6	70%	0.699	22%	0.217	S	C	*	.			trans	-95.5	137.1	179.9	-56	0	0	0	0	110.7	G71 G72	T69-G71 PolarHBondContact O-N 2.85Å; T69-G72 PolarHBondContact O-N 2.78Å; T69-G72 VanDerWaalsContact O-N 3.15Å
70	V	97.9	Very high	96.3	Very high	20 Å²	20	35.8 Å²	35.8	12%	0.121	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	131.9	170.8	176.5	0	0	0	0	110.2	A41 C257 L261 L268	A41-V70 HydrophobicContact CB-CB 4.45Å; A41-V70 HydrophobicContact CB-CG1 4.34Å; A41-V70 HydrophobicContact CB-CG2 4.06Å; V70-C257 HydrophobicContact CG1-CB 3.92Å; V70-L261 HydrophobicContact CG1-CD1 3.75Å; V70-L261 HydrophobicContact CG2-CD1 4.01Å; V70-L268 HydrophobicContact CG2-CD1 4.07Å; V70-L268 HydrophobicContact CG2-CD2 3.57Å
71	G	96.1	Very high	96.2	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.01	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	111.3	-27.3	-173.3	0	0	0	0	0	113.1	A41 T69 R73 L74	A41-G71 PolarHBondContact O-N 2.73Å; T69-G71 PolarHBondContact O-N 2.85Å; G71-R73 PolarHBondContact O-N 2.74Å; G71-R73 VanDerWaalsContact O-N 3.09Å; G71-L74 WeakPolarHBondContact O-CB 3.43Å; G71-L74 PolarHBondContact O-N 2.9Å
72	G	95.1	Very high	96.1	Very high	34 Å²	34	44.1 Å²	44.1	35%	0.351	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-114.1	-179.6	0	0	0	0	0	111.7	T69 L74	T69-G72 PolarHBondContact O-N 2.78Å; T69-G72 VanDerWaalsContact O-N 3.15Å; G72-L74 PolarHBondContact O-N 2.86Å
73	R	95.2	Very high	96	Very high	65 Å²	65	46.2 Å²	46.2	25%	0.245	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-2.5	176.2	-74.3	169.6	-71.4	172.8	-3.6	114.2	G71 G87 G88 W429 A431 E457	G71-R73 PolarHBondContact O-N 2.74Å; G71-R73 VanDerWaalsContact O-N 3.09Å; R73-G87 VanDerWaalsContact O-CA 3.28Å; R73-G87 WeakPolarHBondContact O-CA 3.37Å; R73-G88 PolarHBondContact O-N 2.81Å; R73-W429 HydrophobicContact CG-CD2 4.45Å; R73-W429 HydrophobicContact CG-CE3 3.88Å; R73-W429 HydrophobicContact CG-CZ3 4.23Å; R73-A431 PolarHBondContact NH1-O 3Å; R73-E457 IonicContact CZ-OE1 2.81Å; R73-E457 IonicContact CZ-OE2 3.91Å; R73-E457 IonicContact NH1-OE1 2.74Å; R73-E457 IonicContact NH1-OE2 2.62Å; R73-E457 PolarHBondContact NH1-OE2 3.49Å; R73-E457 VanDerWaalsContact NH2-CD 3.33Å; R73-E457 IonicContact NH2-OE1 3.62Å; R73-E457 PolarHBondContact NH2-OE1 2.84Å; R73-E457 IonicContact NH2-OE2 2.77Å; R73-E457 PolarHBondContact NH2-OE2 3.44Å
74	L	96.4	Very high	95.9	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.042	26%	0.258	C	S	.	.	S	Bend	trans	-93.7	93.8	163.9	-56.1	-173.3	0	0	0	107.7	I43 G71 G72 N253 K254 M463	I43-L74 HydrophobicContact CB-CD1 3.93Å; I43-L74 HydrophobicContact CG1-CD1 4.5Å; I43-L74 HydrophobicContact CG2-CD1 4.42Å; G71-L74 WeakPolarHBondContact O-CB 3.43Å; G71-L74 PolarHBondContact O-N 2.9Å; G72-L74 PolarHBondContact O-N 2.86Å; L74-N253 HydrophobicContact CD1-CB 4.39Å; L74-N253 HydrophobicContact CD2-CB 4.49Å; L74-K254 HydrophobicContact CB-CB 4.34Å; L74-K254 WeakPolarHBondContact O-CB 3.35Å; L74-M463 HydrophobicContact CD1-CG 4.14Å; L74-M463 HydrophobicContact CD1-SD 3.83Å; L74-M463 HydrophobicContact CD2-CE 4.2Å; L74-M463 HydrophobicContact CD2-CG 3.75Å; L74-M463 HydrophobicContact CD2-SD 3.53Å; L74-M463 VanDerWaalsContact CD2-SD 3.53Å; L74-M463 HydrophobicContact CG-CG 4.48Å; L74-M463 HydrophobicContact CG-SD 4.35Å
75	A	95.8	Very high	95.9	Very high	22 Å²	22	47 Å²	47	18%	0.182	26%	0.26	C	S	.	.			trans	-141.4	145.2	-172.5	0	0	0	0	0	112.1	S86 G87 W429	A75-S86 PolarHBondContact O-N 3.5Å; A75-S86 PolarHBondContact O-OG 3.49Å; A75-G87 PolarHBondContact O-N 2.73Å; A75-W429 HydrophobicContact CB-CH2 3.56Å; A75-W429 HydrophobicContact CB-CZ2 3.78Å
76	T	97.1	Very high	95.7	Very high	22 Å²	22	47 Å²	47	14%	0.135	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	154.9	174.6	64.8	0	0	0	0	110.8	D83 Y84 K254 V384	T76-D83 PolarHBondContact OG1-OD2 3.5Å; T76-Y84 CarbonylContact C-O 3.45Å; T76-Y84 WeakPolarHBondContact CA-O 3.45Å; T76-Y84 WeakPolarHBondContact CB-O 3.46Å; T76-K254 HydrophobicContact CG2-CD 4.28Å; T76-K254 WeakPolarHBondContact OG1-CE 3.36Å; T76-K254 PolarHBondContact OG1-NZ 2.82Å; T76-V384 HydrophobicContact CG2-CG1 3.91Å
77	V	96.8	Very high	95.4	Very high	27 Å²	27	46.5 Å²	46.5	16%	0.164	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.8	166.5	-61.3	0	0	0	0	109.5	V79 D83 Y84 I342 Q425	V77-V79 HydrophobicContact CG2-CG2 4.24Å; V77-D83 WeakPolarHBondContact O-CA 3.42Å; V77-Y84 PolarHBondContact N-O 3.4Å; V77-Y84 PolarHBondContact O-N 2.82Å; V77-I342 HydrophobicContact CG2-CB 4.1Å; V77-I342 HydrophobicContact CG2-CD1 3.2Å; V77-I342 HydrophobicContact CG2-CG1 4.16Å; V77-I342 HydrophobicContact CG2-CG2 4.27Å; V77-Q425 HydrophobicContact CB-CB 4.5Å; V77-Q425 HydrophobicContact CG2-CB 4.35Å
78	T	96.9	Very high	95.2	Very high	86 Å²	86	42.5 Å²	42.5	53%	0.528	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.4	178.7	-50.1	0	0	0	0	110.2	Q82 D83	T78-Q82 CarbonylContact C-O 3.52Å; T78-Q82 WeakPolarHBondContact CA-O 3.48Å; T78-D83 WeakPolarHBondContact CB-OD1 3.24Å; T78-D83 PolarHBondContact OG1-OD1 2.85Å
79	V	95.9	Very high	94.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.1	177.3	-176.4	0	0	0	0	108.1	V77 H81 Q82 Y84 I342 H344 V400 Q425	V77-V79 HydrophobicContact CG2-CG2 4.24Å; V79-H81 VanDerWaalsContact C-N 3.27Å; V79-H81 PolarHBondContact O-N 2.91Å; V79-Q82 PolarHBondContact N-O 3.18Å; V79-Q82 PolarHBondContact O-N 2.9Å; V79-Q82 VanDerWaalsContact O-O 3.06Å; V79-Y84 HydrophobicContact CB-CD2 4.04Å; V79-Y84 HydrophobicContact CB-CE2 4Å; V79-Y84 HydrophobicContact CG2-CD2 4.37Å; V79-I342 HydrophobicContact CG2-CG2 3.77Å; V79-H344 HydrophobicContact CG1-CB 3.71Å; V79-V400 HydrophobicContact CG1-CG1 4.49Å; V79-V400 HydrophobicContact CG1-CG2 4.12Å; V79-Q425 HydrophobicContact CG2-CG 4.26Å
80	N	90.8	Very high	94.6	Very high	103 Å²	103	40.4 Å²	40.4	55%	0.551	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	47.8	-178.8	-166.4	27.7	0	0	0	113	Q82	N80-Q82 PolarHBondContact O-N 2.86Å; N80-Q82 VanDerWaalsContact O-N 3.14Å
81	H	92.3	Very high	94.4	Very high	178 Å²	178	39.5 Å²	39.5	82%	0.824	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	16.1	-178.8	-48.8	-74	0	0	0	115.8	V79	V79-H81 VanDerWaalsContact C-N 3.27Å; V79-H81 PolarHBondContact O-N 2.91Å
82	Q	95.3	Very high	94.1	Very high	77 Å²	77	40.1 Å²	40.1	36%	0.36	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.4	174	-63.1	-170.6	-33.6	0	0	110.7	T78 V79 N80 Y84 P383	T78-Q82 CarbonylContact C-O 3.52Å; T78-Q82 WeakPolarHBondContact CA-O 3.48Å; V79-Q82 PolarHBondContact N-O 3.18Å; V79-Q82 PolarHBondContact O-N 2.9Å; V79-Q82 VanDerWaalsContact O-O 3.06Å; N80-Q82 PolarHBondContact O-N 2.86Å; N80-Q82 VanDerWaalsContact O-N 3.14Å; Q82-Y84 HydrophobicContact CB-CE2 3.73Å; Q82-Y84 WeakPolarHBondContact O-CD2 3.34Å; Q82-Y84 WeakPolarHBondContact O-CE2 3.37Å; Q82-Y84 PolarHBondContact OE1-OH 2.79Å; Q82-Y84 VanDerWaalsContact OE1-OH 3.06Å; Q82-P383 HydrophobicContact CB-CB 4.08Å
83	D	96.9	Very high	93.9	Very high	45 Å²	45	40.1 Å²	40.1	24%	0.241	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	139.8	178.5	-84.8	10.6	0	0	0	111.5	T76 V77 T78 P383 V384	T76-D83 PolarHBondContact OG1-OD2 3.5Å; V77-D83 WeakPolarHBondContact O-CA 3.42Å; T78-D83 WeakPolarHBondContact CB-OD1 3.24Å; T78-D83 PolarHBondContact OG1-OD1 2.85Å; D83-P383 CarbonylContact O-C 3.53Å; D83-P383 VanDerWaalsContact O-CA 3.27Å; D83-P383 WeakPolarHBondContact O-CA 3.43Å; D83-V384 HydrophobicContact CB-CG2 3.61Å; D83-V384 PolarHBondContact O-N 3.48Å
84	Y	97.3	Very high	93.6	Very high	12 Å²	12	40.1 Å²	40.1	5%	0.047	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.6	-179.6	-64.9	-92.8	0	0	0	111.3	T76 V77 V79 Q82 S86 I381 C382 P383 V400	T76-Y84 CarbonylContact C-O 3.45Å; T76-Y84 WeakPolarHBondContact CA-O 3.45Å; T76-Y84 WeakPolarHBondContact CB-O 3.46Å; V77-Y84 PolarHBondContact N-O 3.4Å; V77-Y84 PolarHBondContact O-N 2.82Å; V79-Y84 HydrophobicContact CB-CD2 4.04Å; V79-Y84 HydrophobicContact CB-CE2 4Å; V79-Y84 HydrophobicContact CG2-CD2 4.37Å; Q82-Y84 HydrophobicContact CB-CE2 3.73Å; Q82-Y84 WeakPolarHBondContact O-CD2 3.34Å; Q82-Y84 WeakPolarHBondContact O-CE2 3.37Å; Q82-Y84 PolarHBondContact OE1-OH 2.79Å; Q82-Y84 VanDerWaalsContact OE1-OH 3.06Å; Y84-S86 PolarHBondContact O-N 2.89Å; Y84-I381 HydrophobicContact CD1-CB 4.4Å; Y84-I381 HydrophobicContact CD1-CD1 3.54Å; Y84-I381 HydrophobicContact CD1-CG1 3.64Å; Y84-I381 HydrophobicContact CE1-CD1 4.46Å; Y84-I381 HydrophobicContact CE1-CG1 4.18Å; Y84-I381 HydrophobicContact CG-CD1 3.84Å; Y84-I381 HydrophobicContact CG-CG1 4.43Å; Y84-C382 WeakPolarHBondContact CD1-O 3.33Å; Y84-P383 HydrophobicContact CD1-CB 4.49Å; Y84-P383 HydrophobicContact CE1-CB 4.02Å; Y84-P383 VanDerWaalsContact CE1-N 3.29Å; Y84-V400 HydrophobicContact CD1-CG1 4.08Å; Y84-V400 HydrophobicContact CD2-CG1 4.21Å; Y84-V400 HydrophobicContact CE1-CB 3.92Å; Y84-V400 HydrophobicContact CE1-CG1 3.95Å; Y84-V400 HydrophobicContact CE1-CG2 4.3Å; Y84-V400 HydrophobicContact CE2-CB 4.38Å; Y84-V400 HydrophobicContact CE2-CG1 4.1Å; Y84-V400 HydrophobicContact CE2-CG2 4.07Å; Y84-V400 HydrophobicContact CG-CG1 4.2Å; Y84-V400 WeakPolarHBondContact OH-CG2 3.4Å
85	E	97.1	Very high	93.6	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	112.1	177.9	-69.3	-66.4	176.5	0	0	111.9	G252 N253 V384 K402	E85-G252 WeakPolarHBondContact OE1-CA 3.45Å; E85-N253 PolarHBondContact OE1-N 3.42Å; E85-V384 HydrophobicContact CG-CG1 3.93Å; E85-K402 PolarHBondContact O-NZ 3.49Å; E85-K402 VanDerWaalsContact O-NZ 3.08Å
86	S	94.9	Very high	93.6	Very high	2 Å²	2	43 Å²	43	1%	0.014	24%	0.237	C	C	.	.	S	Bend	trans	-90.7	-29.8	175.4	67.3	0	0	0	0	112.4	A75 Y84 A340 K402 W429	A75-S86 PolarHBondContact O-N 3.5Å; A75-S86 PolarHBondContact O-OG 3.49Å; Y84-S86 PolarHBondContact O-N 2.89Å; S86-A340 WeakPolarHBondContact O-CB 3.39Å; S86-K402 VanDerWaalsContact C-NZ 3.32Å; S86-K402 WeakPolarHBondContact O-CE 3.35Å; S86-K402 PolarHBondContact O-NZ 2.9Å; S86-W429 PolarHBondContact O-NE1 2.95Å
87	G	92.1	Very high	93.7	Very high	11 Å²	11	42.9 Å²	42.9	11%	0.113	24%	0.235	C	C	.	.	S	Bend	trans	-104	-133.4	177.4	0	0	0	0	0	113.3	R73 A75 S89 K402	R73-G87 VanDerWaalsContact O-CA 3.28Å; R73-G87 WeakPolarHBondContact O-CA 3.37Å; A75-G87 PolarHBondContact O-N 2.73Å; G87-S89 PolarHBondContact O-N 2.89Å; G87-S89 VanDerWaalsContact O-N 3.15Å; G87-K402 PolarHBondContact O-NZ 2.85Å
88	G	89.8	Confident	93.7	Very high	23 Å²	23	41.6 Å²	41.6	24%	0.237	23%	0.227	C	C	.	.			trans	-62.6	107.5	-179.4	0	0	0	0	0	113	R73 N253	R73-G88 PolarHBondContact O-N 2.81Å; G88-N253 PolarHBondContact O-ND2 2.94Å
89	S	88.1	Confident	93.7	Very high	37 Å²	37	40.1 Å²	40.1	26%	0.259	22%	0.215	S	C	.	.			trans	-105.9	-16.8	-163.7	52.7	0	0	0	0	116.2	G87	G87-S89 PolarHBondContact O-N 2.89Å; G87-S89 VanDerWaalsContact O-N 3.15Å
90	I	89.6	Confident	93.8	Very high	65 Å²	65	43.2 Å²	43.2	33%	0.333	23%	0.231	S	C	.	.			trans	-134.7	146.8	-173.4	52.5	166.7	0	0	0	111.1	G241 L246 M463	I90-G241 WeakPolarHBondContact CD1-O 3.43Å; I90-L246 HydrophobicContact CB-CB 4.47Å; I90-L246 HydrophobicContact CD1-CD1 3.78Å; I90-L246 HydrophobicContact CD1-CD2 4.36Å; I90-M463 WeakPolarHBondContact O-CE 3.49Å
91	I	92.3	Very high	94.2	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-129.4	135.8	179.8	-55.8	164.8	0	0	0	107.6	N95 M98 L246 W247 V249 M463	I91-N95 HydrophobicContact CG2-CB 3.81Å; I91-M98 HydrophobicContact CD1-CE 3.69Å; I91-M98 HydrophobicContact CG1-CE 4.47Å; I91-M98 HydrophobicContact CG2-CB 3.76Å; I91-M98 HydrophobicContact CG2-CG 4.17Å; I91-L246 CarbonylContact O-C 3.58Å; I91-L246 WeakPolarHBondContact O-CA 3.31Å; I91-W247 HydrophobicContact CB-CD2 3.92Å; I91-W247 HydrophobicContact CB-CE3 4.18Å; I91-W247 HydrophobicContact CB-CH2 4.14Å; I91-W247 HydrophobicContact CB-CZ2 3.84Å; I91-W247 HydrophobicContact CB-CZ3 4.28Å; I91-W247 HydrophobicContact CD1-CE3 3.95Å; I91-W247 HydrophobicContact CD1-CH2 3.57Å; I91-W247 HydrophobicContact CD1-CZ2 4.18Å; I91-W247 HydrophobicContact CD1-CZ3 3.42Å; I91-W247 VanDerWaalsContact CD1-CZ3 3.42Å; I91-W247 HydrophobicContact CG1-CH2 4.44Å; I91-W247 HydrophobicContact CG1-CZ3 4.42Å; I91-W247 HydrophobicContact CG2-CD2 4.24Å; I91-W247 VanDerWaalsContact CG2-CE2 3.49Å; I91-W247 HydrophobicContact CG2-CH2 3.82Å; I91-W247 HydrophobicContact CG2-CZ2 3.27Å; I91-W247 HydrophobicContact CG2-CZ3 4.46Å; I91-W247 PolarHBondContact N-O 2.63Å; I91-W247 PolarHBondContact O-N 2.94Å; I91-W247 PolarHBondContact O-NE1 2.99Å; I91-V249 HydrophobicContact CD1-CG2 4.34Å; I91-M463 HydrophobicContact CD1-CE 4.37Å; I91-M463 HydrophobicContact CD1-SD 4.19Å; I91-M463 HydrophobicContact CG1-CE 3.52Å; I91-M463 HydrophobicContact CG1-SD 3.88Å
92	H	91.7	Very high	94.4	Very high	15 Å²	15	30 Å²	30	7%	0.069	17%	0.166	C	C	.	.			trans	-84.5	154.1	179.2	-173.1	-97.9	0	0	0	111.3	L94 N95 A240 L246 W247	H92-L94 PolarHBondContact ND1-N 3.36Å; H92-L94 VanDerWaalsContact ND1-N 3.12Å; H92-L94 PolarHBondContact O-N 3.1Å; H92-N95 PolarHBondContact N-ND2 2.89Å; H92-N95 VanDerWaalsContact O-CB 3.31Å; H92-N95 WeakPolarHBondContact O-CB 3.25Å; H92-N95 PolarHBondContact O-N 3.24Å; H92-N95 VanDerWaalsContact O-N 3.17Å; H92-A240 PolarHBondContact CD2-O 3.27Å; H92-A240 VanDerWaalsContact CD2-O 3.25Å; H92-L246 HydrophobicContact CB-CD2 4.21Å; H92-W247 PolarHBondContact O-NE1 3.33Å
93	S	88.9	Confident	94.5	Very high	34 Å²	34	34.2 Å²	34.2	24%	0.238	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.2	-178.7	62.5	0	0	0	0	114.5	Q99 N245	S93-Q99 PolarHBondContact O-NE2 3.26Å; S93-N245 PolarHBondContact N-O 2.79Å; S93-N245 WeakPolarHBondContact OG-CB 3.43Å
94	L	90.9	Very high	94.6	Very high	65 Å²	65	35.7 Å²	35.7	34%	0.34	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	8.2	173.8	-59.4	-173.4	0	0	0	113.2	H92 L96 M159 M163 Y166	H92-L94 PolarHBondContact ND1-N 3.36Å; H92-L94 VanDerWaalsContact ND1-N 3.12Å; H92-L94 PolarHBondContact O-N 3.1Å; L94-L96 VanDerWaalsContact C-N 3.3Å; L94-L96 PolarHBondContact O-N 3.25Å; L94-L96 VanDerWaalsContact O-N 3.07Å; L94-M159 HydrophobicContact CD1-CE 3.31Å; L94-M159 HydrophobicContact CG-CE 4.28Å; L94-M163 HydrophobicContact CB-SD 3.95Å; L94-M163 HydrophobicContact CD1-SD 4.3Å; L94-Y166 PolarHBondContact O-OH 3.27Å
95	N	94.5	Very high	94.6	Very high	30 Å²	30	37 Å²	37	16%	0.16	20%	0.197	C	C	.	.			trans	-81.6	80.1	171.3	-66.3	7.2	0	0	0	108.2	I91 H92 H97 M98 Q99 E464	I91-N95 HydrophobicContact CG2-CB 3.81Å; H92-N95 PolarHBondContact N-ND2 2.89Å; H92-N95 VanDerWaalsContact O-CB 3.31Å; H92-N95 WeakPolarHBondContact O-CB 3.25Å; H92-N95 PolarHBondContact O-N 3.24Å; H92-N95 VanDerWaalsContact O-N 3.17Å; N95-H97 PolarHBondContact O-N 3.38Å; N95-M98 HydrophobicContact CB-CB 4.14Å; N95-M98 HydrophobicContact CB-CG 4.4Å; N95-M98 PolarHBondContact O-N 3.08Å; N95-Q99 PolarHBondContact O-N 3.22Å; N95-E464 VanDerWaalsContact CA-CD 3.45Å; N95-E464 WeakPolarHBondContact CA-OE2 3.49Å; N95-E464 HydrophobicContact CB-CB 3.92Å; N95-E464 HydrophobicContact CB-CG 3.91Å; N95-E464 VanDerWaalsContact CB-OE2 3.3Å; N95-E464 WeakPolarHBondContact CB-OE2 3.26Å
96	L	96.7	Very high	94.6	Very high	60 Å²	60	39.6 Å²	39.6	31%	0.314	23%	0.225	S	C	.	.	H	α-helix	trans	-70.4	-33.1	-166.2	-59.4	-168.2	0	0	0	112.3	L94 Q99 D100 M163 Y166 E464	L94-L96 VanDerWaalsContact C-N 3.3Å; L94-L96 PolarHBondContact O-N 3.25Å; L94-L96 VanDerWaalsContact O-N 3.07Å; L96-Q99 PolarHBondContact O-N 3.44Å; L96-D100 WeakPolarHBondContact O-CB 3.4Å; L96-D100 PolarHBondContact O-N 2.82Å; L96-M163 HydrophobicContact CD1-CE 3.56Å; L96-M163 HydrophobicContact CD2-CE 4.31Å; L96-M163 HydrophobicContact CG-CE 3.87Å; L96-Y166 HydrophobicContact CB-CD1 3.95Å; L96-Y166 HydrophobicContact CB-CD2 4.43Å; L96-Y166 HydrophobicContact CB-CE1 3.62Å; L96-Y166 HydrophobicContact CB-CE2 4.13Å; L96-Y166 HydrophobicContact CB-CG 4.33Å; L96-Y166 HydrophobicContact CD1-CD1 4.31Å; L96-Y166 HydrophobicContact CD1-CD2 3.64Å; L96-Y166 HydrophobicContact CD1-CE2 3.89Å; L96-Y166 HydrophobicContact CD1-CG 3.85Å; L96-Y166 HydrophobicContact CG-CD1 4.45Å; L96-Y166 HydrophobicContact CG-CD2 4.04Å; L96-Y166 HydrophobicContact CG-CE1 4.18Å; L96-Y166 HydrophobicContact CG-CE2 3.74Å; L96-Y166 HydrophobicContact CG-CG 4.36Å; L96-Y166 PolarHBondContact N-OH 3.02Å; L96-Y166 VanDerWaalsContact N-OH 3.13Å; L96-E464 PolarHBondContact N-OE1 3.18Å
97	H	98.3	Very high	94.8	Very high	20 Å²	20	41.7 Å²	41.7	9%	0.093	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-46.5	173.9	-68.9	-57.5	0	0	0	110.4	F51 N95 Q99 D100 F101 Y166 Q169 E464	F51-H97 AromaticContact CZ-ND1 3.61Å; N95-H97 PolarHBondContact O-N 3.38Å; H97-Q99 VanDerWaalsContact C-N 3.32Å; H97-Q99 PolarHBondContact O-N 3.16Å; H97-D100 PolarHBondContact O-N 2.79Å; H97-F101 HydrophobicContact CB-CE2 4.02Å; H97-F101 HydrophobicContact CB-CZ 3.97Å; H97-F101 WeakPolarHBondContact O-CD1 3.3Å; H97-F101 VanDerWaalsContact O-CD2 3.24Å; H97-F101 WeakPolarHBondContact O-CD2 3.4Å; H97-F101 WeakPolarHBondContact O-CG 3.45Å; H97-F101 PolarHBondContact O-N 2.93Å; H97-Y166 AromaticContact CD2-CE1 3.61Å; H97-Y166 AromaticContact NE2-CD1 3.79Å; H97-Y166 AromaticContact NE2-CE1 3.77Å; H97-Q169 PolarHBondContact CE1-OE1 3.19Å; H97-Q169 PolarHBondContact NE2-OE1 3.49Å; H97-E464 VanDerWaalsContact CB-OE1 3.24Å; H97-E464 WeakPolarHBondContact CB-OE1 3.28Å; H97-E464 IonicContact CD2-OE1 2.79Å; H97-E464 PolarHBondContact CD2-OE1 2.89Å; H97-E464 IonicContact CG-OE1 3.15Å; H97-E464 PolarHBondContact N-OE1 3.13Å
98	M	97.8	Very high	95	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-38.9	176.5	-69.7	-58.8	-62	0	0	113	I43 I91 N95 F101 V102 W247 V256 M463 E464	I43-M98 HydrophobicContact CD1-CE 4.36Å; I43-M98 HydrophobicContact CD1-SD 3.78Å; I43-M98 HydrophobicContact CG1-SD 3.96Å; I91-M98 HydrophobicContact CD1-CE 3.69Å; I91-M98 HydrophobicContact CG1-CE 4.47Å; I91-M98 HydrophobicContact CG2-CB 3.76Å; I91-M98 HydrophobicContact CG2-CG 4.17Å; N95-M98 HydrophobicContact CB-CB 4.14Å; N95-M98 HydrophobicContact CB-CG 4.4Å; N95-M98 PolarHBondContact O-N 3.08Å; M98-F101 HydrophobicContact SD-CD2 4.05Å; M98-F101 HydrophobicContact SD-CE2 4.45Å; M98-V102 WeakPolarHBondContact O-CG2 3.49Å; M98-V102 PolarHBondContact O-N 2.87Å; M98-V102 VanDerWaalsContact O-N 3.13Å; M98-W247 HydrophobicContact CB-CH2 4.27Å; M98-W247 HydrophobicContact CB-CZ2 4.26Å; M98-V256 HydrophobicContact CE-CB 4.28Å; M98-V256 HydrophobicContact CE-CG1 4.06Å; M98-V256 HydrophobicContact CE-CG2 3.95Å; M98-M463 HydrophobicContact CE-SD 3.95Å; M98-M463 HydrophobicContact CG-CB 4.18Å; M98-M463 HydrophobicContact SD-CB 4.08Å; M98-E464 WeakPolarHBondContact CG-OE2 3.47Å; M98-E464 PolarHBondContact N-OE2 2.91Å
99	Q	96.8	Very high	95.3	Very high	55 Å²	55	52.6 Å²	52.6	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-45.3	174.2	-76.8	-170	-7.4	0	0	112.2	S93 N95 L96 H97 V102 K103 W247	S93-Q99 PolarHBondContact O-NE2 3.26Å; N95-Q99 PolarHBondContact O-N 3.22Å; L96-Q99 PolarHBondContact O-N 3.44Å; H97-Q99 VanDerWaalsContact C-N 3.32Å; H97-Q99 PolarHBondContact O-N 3.16Å; Q99-V102 PolarHBondContact O-N 3.47Å; Q99-K103 WeakPolarHBondContact O-CB 3.45Å; Q99-K103 PolarHBondContact O-N 3.04Å; Q99-W247 HydrophobicContact CG-CZ2 3.8Å
100	D	97.8	Very high	95.6	Very high	66 Å²	66	53.4 Å²	53.4	35%	0.353	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-42.6	-180	-172.3	54.2	0	0	0	111.3	L96 H97 V102 K103 Q104	L96-D100 WeakPolarHBondContact O-CB 3.4Å; L96-D100 PolarHBondContact O-N 2.82Å; H97-D100 PolarHBondContact O-N 2.79Å; D100-V102 PolarHBondContact O-N 2.96Å; D100-K103 WeakPolarHBondContact O-CB 3.21Å; D100-K103 PolarHBondContact O-N 2.78Å; D100-Q104 WeakPolarHBondContact O-CB 3.33Å; D100-Q104 WeakPolarHBondContact O-CG 3.27Å; D100-Q104 PolarHBondContact O-N 3.03Å; D100-Q104 PolarHBondContact OD2-NE2 3.44Å
101	F	98.5	Very high	95.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-47.2	175.2	-59.4	-25.8	0	0	0	112.4	I43 A47 H50 F51 H97 M98 K103 Q104 L105 V256 L260	I43-F101 HydrophobicContact CD1-CD2 4.46Å; I43-F101 HydrophobicContact CD1-CE2 4.45Å; A47-F101 HydrophobicContact CB-CE2 4.02Å; A47-F101 HydrophobicContact CB-CZ 3.87Å; H50-F101 AromaticContact CD2-CE1 3.96Å; F51-F101 AromaticContact CE1-CE1 3.97Å; F51-F101 HydrophobicContact CE1-CE1 3.97Å; F51-F101 HydrophobicContact CE1-CZ 4.34Å; F51-F101 HydrophobicContact CE2-CE1 4.14Å; F51-F101 AromaticContact CE2-CZ 3.69Å; F51-F101 HydrophobicContact CE2-CZ 3.69Å; F51-F101 AromaticContact CZ-CE1 3.49Å; F51-F101 HydrophobicContact CZ-CE1 3.49Å; F51-F101 VanDerWaalsContact CZ-CE1 3.49Å; F51-F101 AromaticContact CZ-CZ 3.45Å; F51-F101 HydrophobicContact CZ-CZ 3.45Å; F51-F101 VanDerWaalsContact CZ-CZ 3.45Å; H97-F101 HydrophobicContact CB-CE2 4.02Å; H97-F101 HydrophobicContact CB-CZ 3.97Å; H97-F101 WeakPolarHBondContact O-CD1 3.3Å; H97-F101 VanDerWaalsContact O-CD2 3.24Å; H97-F101 WeakPolarHBondContact O-CD2 3.4Å; H97-F101 WeakPolarHBondContact O-CG 3.45Å; H97-F101 PolarHBondContact O-N 2.93Å; M98-F101 HydrophobicContact SD-CD2 4.05Å; M98-F101 HydrophobicContact SD-CE2 4.45Å; F101-K103 VanDerWaalsContact C-N 3.28Å; F101-K103 PolarHBondContact O-N 3.15Å; F101-Q104 PolarHBondContact O-N 3.15Å; F101-L105 VanDerWaalsContact O-CB 3.26Å; F101-L105 WeakPolarHBondContact O-CB 3.24Å; F101-L105 WeakPolarHBondContact O-CD1 3.32Å; F101-L105 WeakPolarHBondContact O-CG 3.49Å; F101-L105 PolarHBondContact O-N 3.35Å; F101-V256 HydrophobicContact CB-CG1 3.82Å; F101-V256 HydrophobicContact CD2-CG1 3.98Å; F101-V256 HydrophobicContact CG-CG1 4.32Å; F101-L260 HydrophobicContact CB-CD2 4.22Å; F101-L260 HydrophobicContact CD1-CD1 4.43Å; F101-L260 HydrophobicContact CD1-CD2 3.69Å; F101-L260 HydrophobicContact CD2-CD1 3.81Å; F101-L260 HydrophobicContact CD2-CD2 4.47Å; F101-L260 HydrophobicContact CE1-CD2 4.12Å; F101-L260 HydrophobicContact CE2-CD1 3.94Å; F101-L260 HydrophobicContact CG-CD1 4.06Å; F101-L260 HydrophobicContact CG-CD2 3.89Å; F101-L260 HydrophobicContact CG-CG 4.44Å; F101-L260 HydrophobicContact CZ-CD1 4.32Å
102	V	97.5	Very high	95.4	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-41.9	178.3	165.7	0	0	0	0	110.9	M98 Q99 D100 G106 L107 Y109 W247 V249 V256	M98-V102 WeakPolarHBondContact O-CG2 3.49Å; M98-V102 PolarHBondContact O-N 2.87Å; M98-V102 VanDerWaalsContact O-N 3.13Å; Q99-V102 PolarHBondContact O-N 3.47Å; D100-V102 PolarHBondContact O-N 2.96Å; V102-G106 PolarHBondContact O-N 2.96Å; V102-L107 HydrophobicContact CB-CB 4.47Å; V102-L107 HydrophobicContact CG1-CB 3.94Å; V102-L107 WeakPolarHBondContact CG1-O 3.45Å; V102-L107 PolarHBondContact O-N 3.07Å; V102-Y109 HydrophobicContact CG1-CD1 4.43Å; V102-Y109 HydrophobicContact CG1-CE1 4Å; V102-W247 HydrophobicContact CB-CH2 4.35Å; V102-W247 HydrophobicContact CG2-CH2 3.68Å; V102-W247 HydrophobicContact CG2-CZ3 3.8Å; V102-V249 HydrophobicContact CG2-CG2 3.73Å; V102-V256 HydrophobicContact CG2-CG2 4.05Å
103	K	97.6	Very high	95.2	Very high	166 Å²	166	63.3 Å²	63.3	72%	0.722	32%	0.319	S	S	*	.	H	α-helix	trans	-64.4	-50.4	176.8	-177.5	-175.5	175	-169.8	0	112	Q99 D100 F101 L105 G106	Q99-K103 WeakPolarHBondContact O-CB 3.45Å; Q99-K103 PolarHBondContact O-N 3.04Å; D100-K103 WeakPolarHBondContact O-CB 3.21Å; D100-K103 PolarHBondContact O-N 2.78Å; F101-K103 VanDerWaalsContact C-N 3.28Å; F101-K103 PolarHBondContact O-N 3.15Å; K103-L105 VanDerWaalsContact C-N 3.26Å; K103-L105 PolarHBondContact O-N 3.27Å; K103-G106 PolarHBondContact O-N 3.27Å; K103-G106 VanDerWaalsContact O-N 3.13Å
104	Q	97.8	Very high	95.1	Very high	76 Å²	76	65.9 Å²	65.9	36%	0.355	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-36.5	179.3	-73.7	-169.8	51.8	0	0	112.2	H50 D100 F101 G106 L263	H50-Q104 PolarHBondContact CE1-OE1 3.31Å; H50-Q104 VanDerWaalsContact CE1-OE1 3.3Å; D100-Q104 WeakPolarHBondContact O-CB 3.33Å; D100-Q104 WeakPolarHBondContact O-CG 3.27Å; D100-Q104 PolarHBondContact O-N 3.03Å; D100-Q104 PolarHBondContact OD2-NE2 3.44Å; F101-Q104 PolarHBondContact O-N 3.15Å; Q104-G106 VanDerWaalsContact C-N 3.29Å; Q104-G106 PolarHBondContact O-N 3.49Å; Q104-L263 HydrophobicContact CB-CD1 4.22Å
105	L	98.2	Very high	94.9	Very high	41 Å²	41	64.4 Å²	64.4	22%	0.215	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6.5	179.8	-67.4	170.5	0	0	0	113.9	F101 K103 L107 V256 G259 L260 L263	F101-L105 VanDerWaalsContact O-CB 3.26Å; F101-L105 WeakPolarHBondContact O-CB 3.24Å; F101-L105 WeakPolarHBondContact O-CD1 3.32Å; F101-L105 WeakPolarHBondContact O-CG 3.49Å; F101-L105 PolarHBondContact O-N 3.35Å; K103-L105 VanDerWaalsContact C-N 3.26Å; K103-L105 PolarHBondContact O-N 3.27Å; L105-L107 HydrophobicContact CB-CD1 3.84Å; L105-L107 HydrophobicContact CB-CG 3.73Å; L105-L107 HydrophobicContact CD1-CD1 3.76Å; L105-L107 HydrophobicContact CG-CD1 4.46Å; L105-L107 PolarHBondContact O-N 3.19Å; L105-V256 HydrophobicContact CD1-CG1 4.35Å; L105-G259 VanDerWaalsContact CD2-CA 3.45Å; L105-G259 WeakPolarHBondContact CD2-O 3.34Å; L105-L260 HydrophobicContact CD1-CG 4.45Å; L105-L263 HydrophobicContact CD2-CD1 3.32Å; L105-L263 HydrophobicContact CD2-CD2 4.41Å; L105-L263 HydrophobicContact CD2-CG 3.57Å; L105-L263 HydrophobicContact CG-CD1 3.93Å
106	G	97.8	Very high	94.8	Very high	62 Å²	62	65 Å²	65	64%	0.639	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	24.5	-173.8	0	0	0	0	0	113.3	V102 K103 Q104	V102-G106 PolarHBondContact O-N 2.96Å; K103-G106 PolarHBondContact O-N 3.27Å; K103-G106 VanDerWaalsContact O-N 3.13Å; Q104-G106 VanDerWaalsContact C-N 3.29Å; Q104-G106 PolarHBondContact O-N 3.49Å
107	L	97.6	Very high	94.6	Very high	46 Å²	46	64.3 Å²	64.3	24%	0.241	34%	0.342	C	S	.	.			trans	-77.2	155.2	177.4	-67.3	172.6	0	0	0	110.3	V102 L105 V249 L255 V256	V102-L107 HydrophobicContact CB-CB 4.47Å; V102-L107 HydrophobicContact CG1-CB 3.94Å; V102-L107 WeakPolarHBondContact CG1-O 3.45Å; V102-L107 PolarHBondContact O-N 3.07Å; L105-L107 HydrophobicContact CB-CD1 3.84Å; L105-L107 HydrophobicContact CB-CG 3.73Å; L105-L107 HydrophobicContact CD1-CD1 3.76Å; L105-L107 HydrophobicContact CG-CD1 4.46Å; L105-L107 PolarHBondContact O-N 3.19Å; L107-V249 HydrophobicContact CB-CG1 4.2Å; L107-V249 HydrophobicContact CD1-CG1 4.12Å; L107-L255 HydrophobicContact CD1-CB 4.29Å; L107-L255 HydrophobicContact CD2-CB 4.31Å; L107-L255 HydrophobicContact CD2-CD1 4.44Å; L107-V256 HydrophobicContact CD1-CG2 4.1Å
108	K	96.9	Very high	94.5	Very high	144 Å²	144	63.4 Å²	63.4	63%	0.626	34%	0.338	S	S	*	.			trans	-105.8	148.7	-178	-66.7	179.5	-176.3	174.3	0	111.3	R110 E250	K108-R110 PolarHBondContact O-N 2.86Å; K108-E250 HydrophobicContact CB-CB 4.12Å; K108-E250 WeakPolarHBondContact CB-OE2 3.14Å; K108-E250 WeakPolarHBondContact CD-OE2 3.2Å; K108-E250 WeakPolarHBondContact O-CB 3.33Å; K108-E250 PolarHBondContact O-N 3.45Å
109	Y	95.9	Very high	94.4	Very high	118 Å²	118	64 Å²	64	46%	0.463	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-70.7	127.9	167.3	-60.4	-56.1	0	0	0	109.9	V102 K111 W247	V102-Y109 HydrophobicContact CG1-CD1 4.43Å; V102-Y109 HydrophobicContact CG1-CE1 4Å; Y109-K111 PolarHBondContact O-N 2.79Å; Y109-W247 HydrophobicContact CD1-CB 4.45Å; Y109-W247 AromaticContact CD1-CD2 3.74Å; Y109-W247 HydrophobicContact CD1-CD2 3.74Å; Y109-W247 AromaticContact CD1-CE3 3.34Å; Y109-W247 HydrophobicContact CD1-CE3 3.34Å; Y109-W247 HydrophobicContact CD1-CG 4.25Å; Y109-W247 AromaticContact CD1-CZ3 3.78Å; Y109-W247 HydrophobicContact CD1-CZ3 3.78Å; Y109-W247 AromaticContact CE1-CD2 3.64Å; Y109-W247 HydrophobicContact CE1-CD2 3.64Å; Y109-W247 AromaticContact CE1-CE2 3.94Å; Y109-W247 AromaticContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CE3 3.48Å; Y109-W247 VanDerWaalsContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CG 4.33Å; Y109-W247 AromaticContact CE1-CH2 3.89Å; Y109-W247 HydrophobicContact CE1-CH2 3.89Å; Y109-W247 HydrophobicContact CE1-CZ2 4.05Å; Y109-W247 AromaticContact CE1-CZ3 3.61Å; Y109-W247 HydrophobicContact CE1-CZ3 3.61Å
110	R	94.6	Very high	94.4	Very high	55 Å²	55	61.4 Å²	61.4	21%	0.208	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-60	136.3	170.2	-171.4	-177	69.9	-174.7	-8.2	108.8	K108 N112 A248 E250 V384 I386	K108-R110 PolarHBondContact O-N 2.86Å; R110-N112 PolarHBondContact O-N 3.1Å; R110-A248 HydrophobicContact CB-CB 4.35Å; R110-A248 WeakPolarHBondContact CB-O 3.47Å; R110-A248 PolarHBondContact N-O 3.25Å; R110-E250 HydrophobicContact CB-CB 4.46Å; R110-V384 WeakPolarHBondContact CD-O 3.37Å; R110-I386 HydrophobicContact CG-CD1 3.82Å; R110-I386 HydrophobicContact CG-CG1 4Å
111	K	91.8	Very high	94.2	Very high	110 Å²	110	60 Å²	60	48%	0.478	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-55.6	140.5	175.4	-64.8	178.8	-177.8	170.1	0	110.7	Y109 I386	Y109-K111 PolarHBondContact O-N 2.79Å; K111-I386 HydrophobicContact CB-CB 4.27Å; K111-I386 HydrophobicContact CB-CG2 4.25Å; K111-I386 VanDerWaalsContact O-CD1 3.26Å; K111-I386 WeakPolarHBondContact O-CD1 3.46Å
112	N	86.4	Confident	94	Very high	145 Å²	145	61.4 Å²	61.4	78%	0.775	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-81	140.2	175.1	-167.4	9.1	0	0	0	110.3	R110	R110-N112 PolarHBondContact O-N 3.1Å
113	V	87.4	Confident	93.7	Very high	33 Å²	33	69.7 Å²	69.7	20%	0.2	38%	0.375	C	S	.	.			trans	-125.8	102.1	174.5	-179	0	0	0	0	107.9	I386 F390 R392	V113-I386 HydrophobicContact CG2-CD1 3.68Å; V113-I386 HydrophobicContact CG2-CG2 4.2Å; V113-F390 HydrophobicContact CG1-CE1 4.27Å; V113-F390 HydrophobicContact CG2-CD1 3.99Å; V113-F390 HydrophobicContact CG2-CE1 4.19Å; V113-R392 PolarHBondContact O-NH2 2.85Å
114	A	85.8	Confident	93.5	Very high	88 Å²	88	67.5 Å²	67.5	73%	0.727	37%	0.367	S	S	*	.			trans	-52.6	141.2	-179.3	0	0	0	0	0	111.5	R392	A114-R392 PolarHBondContact O-NH1 3.49Å
115	G	86.8	Confident	93.4	Very high	34 Å²	34	65.1 Å²	65.1	35%	0.351	36%	0.356	S	S	.	.			trans	-160.6	141.2	178.4	0	0	0	0	0	109.7
116	K	92.1	Very high	93.2	Very high	43 Å²	43	64.1 Å²	64.1	19%	0.187	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	147.9	-177.4	-62.5	172.7	-176.6	176.7	0	111.2	E129 D131 P361 F362 A363 S364	K116-E129 WeakPolarHBondContact CA-OE2 3.32Å; K116-E129 HydrophobicContact CB-CB 4.35Å; K116-D131 WeakPolarHBondContact CE-OD1 3.39Å; K116-D131 WeakPolarHBondContact CE-OD2 3.44Å; K116-D131 IonicContact NZ-OD1 3.05Å; K116-D131 PolarHBondContact NZ-OD1 2.99Å; K116-D131 IonicContact NZ-OD2 2.69Å; K116-D131 PolarHBondContact NZ-OD2 3.37Å; K116-P361 HydrophobicContact CD-CB 4.41Å; K116-F362 HydrophobicContact CB-CD1 3.97Å; K116-F362 CarbonylContact O-C 3.49Å; K116-A363 PolarHBondContact O-N 3.12Å; K116-S364 PolarHBondContact O-N 2.97Å; K116-S364 VanDerWaalsContact O-N 3.11Å
117	T	93.3	Very high	92.9	Very high	46 Å²	46	62.8 Å²	62.8	28%	0.282	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.2	176.3	-55.3	0	0	0	0	111.1	E129 S364 L366	T117-E129 PolarHBondContact N-OE2 2.93Å; T117-E129 WeakPolarHBondContact O-CB 3.48Å; T117-E129 PolarHBondContact O-N 2.93Å; T117-S364 CarbonylContact C-O 3.59Å; T117-S364 WeakPolarHBondContact CA-O 3.5Å; T117-L366 HydrophobicContact CG2-CD1 4.03Å; T117-L366 HydrophobicContact CG2-CG 3.84Å
118	A	95.6	Very high	92.6	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.008	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	157.2	170.4	0	0	0	0	0	111	F125 L127 E128 F362 S364 V365 L366	A118-F125 HydrophobicContact CB-CD1 3.48Å; A118-F125 VanDerWaalsContact CB-CD1 3.48Å; A118-F125 HydrophobicContact CB-CE1 3.59Å; A118-F125 HydrophobicContact CB-CG 4.3Å; A118-F125 HydrophobicContact CB-CZ 4.48Å; A118-L127 CarbonylContact C-O 3.59Å; A118-L127 WeakPolarHBondContact CA-O 3.37Å; A118-L127 WeakPolarHBondContact CB-O 3.21Å; A118-E128 HydrophobicContact CB-CG 4.43Å; A118-F362 HydrophobicContact CB-CD1 3.67Å; A118-F362 HydrophobicContact CB-CD2 3.81Å; A118-F362 HydrophobicContact CB-CE1 3.76Å; A118-F362 HydrophobicContact CB-CE2 3.89Å; A118-F362 HydrophobicContact CB-CG 3.72Å; A118-F362 HydrophobicContact CB-CZ 3.88Å; A118-S364 PolarHBondContact N-O 3.18Å; A118-V365 WeakPolarHBondContact O-CA 3.08Å; A118-L366 PolarHBondContact O-N 2.65Å
119	V	96.5	Very high	92.2	Very high	12 Å²	12	61.8 Å²	61.8	7%	0.073	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.6	174	-176.8	0	0	0	0	109	F125 I126 L127 P218 L366 T368	V119-F125 CarbonylContact O-C 3.58Å; V119-F125 WeakPolarHBondContact O-CA 3.46Å; V119-I126 HydrophobicContact CB-CD1 4.46Å; V119-I126 HydrophobicContact CB-CG1 3.95Å; V119-I126 HydrophobicContact CG1-CD1 3.81Å; V119-I126 HydrophobicContact CG1-CG1 3.79Å; V119-I126 WeakPolarHBondContact O-CG1 3.25Å; V119-I126 PolarHBondContact O-N 3.21Å; V119-L127 HydrophobicContact CB-CB 4.04Å; V119-L127 HydrophobicContact CB-CD1 4.48Å; V119-L127 HydrophobicContact CG2-CB 4.04Å; V119-L127 HydrophobicContact CG2-CD1 4.1Å; V119-L127 PolarHBondContact N-O 3.45Å; V119-P218 HydrophobicContact CG1-CB 4.16Å; V119-P218 HydrophobicContact CG1-CG 3.55Å; V119-P218 HydrophobicContact CG2-CB 4.41Å; V119-P218 HydrophobicContact CG2-CG 4.34Å; V119-L366 WeakPolarHBondContact CA-O 3.49Å; V119-T368 HydrophobicContact CG1-CG2 3.79Å
120	F	96.5	Very high	91.7	Very high	1 Å²	1	57.7 Å²	57.7	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.9	-179.2	-179.4	-116.7	0	0	0	110.1	G122 E124 F125 Y351 F352 V365 L366 T367 T368 L373 F375	F120-G122 VanDerWaalsContact CZ-O 3.29Å; F120-G122 WeakPolarHBondContact CZ-O 3.42Å; F120-E124 WeakPolarHBondContact CD2-O 3.19Å; F120-F125 HydrophobicContact CB-CD1 3.97Å; F120-F125 HydrophobicContact CB-CE1 3.83Å; F120-F125 HydrophobicContact CD2-CD1 4.34Å; F120-F125 HydrophobicContact CD2-CE1 4.35Å; F120-F125 HydrophobicContact CG-CE1 4.46Å; F120-Y351 AromaticContact CE1-CE1 3.84Å; F120-Y351 HydrophobicContact CE1-CE1 3.84Å; F120-Y351 HydrophobicContact CZ-CE1 4.34Å; F120-F352 HydrophobicContact CD1-CD1 4.16Å; F120-F352 HydrophobicContact CD1-CE1 4.17Å; F120-F352 HydrophobicContact CD2-CD1 4.24Å; F120-F352 HydrophobicContact CE1-CD1 4.27Å; F120-F352 HydrophobicContact CE1-CE1 4.39Å; F120-F352 HydrophobicContact CE2-CD1 4.37Å; F120-F352 HydrophobicContact CG-CD1 4.13Å; F120-F352 HydrophobicContact CG-CE1 4.46Å; F120-F352 HydrophobicContact CZ-CD1 4.37Å; F120-V365 HydrophobicContact CB-CG1 3.62Å; F120-V365 HydrophobicContact CG-CG1 4.5Å; F120-L366 PolarHBondContact N-O 3.22Å; F120-T367 WeakPolarHBondContact O-CA 3.47Å; F120-T368 PolarHBondContact O-N 2.73Å; F120-L373 HydrophobicContact CD1-CD2 4.28Å; F120-L373 HydrophobicContact CE1-CD2 4.09Å; F120-F375 HydrophobicContact CD1-CZ 4.38Å
121	N	94.2	Very high	91.1	Very high	37 Å²	37	61 Å²	61	20%	0.198	33%	0.334	C	S	.	.			trans	-96.6	2.6	-178.4	73.8	-6.8	0	0	0	114.6	E123 E124 I126 T368 S370	N121-E123 PolarHBondContact OD1-N 3.34Å; N121-E124 PolarHBondContact N-O 2.9Å; N121-E124 PolarHBondContact OD1-N 3.36Å; N121-E124 PolarHBondContact OD1-O 3.47Å; N121-E124 VanDerWaalsContact OD1-O 3.05Å; N121-I126 HydrophobicContact CB-CD1 4.48Å; N121-I126 HydrophobicContact CB-CG2 4.02Å; N121-T368 VanDerWaalsContact CA-OG1 3.27Å; N121-T368 WeakPolarHBondContact CA-OG1 3.47Å; N121-T368 HydrophobicContact CB-CG2 4.41Å; N121-S370 WeakPolarHBondContact O-CB 3.43Å; N121-S370 PolarHBondContact O-OG 2.82Å
122	G	93.2	Very high	90.7	Very high	29 Å²	29	65.2 Å²	65.2	30%	0.299	35%	0.347	S	S	.	.	S	Bend	trans	105.8	-20.8	-173	0	0	0	0	0	113.8	F120	F120-G122 VanDerWaalsContact CZ-O 3.29Å; F120-G122 WeakPolarHBondContact CZ-O 3.42Å
123	E	92.3	Very high	90.2	Very high	176 Å²	176	66.1 Å²	66.1	82%	0.822	34%	0.341	S	S	*	.	S	Bend	trans	-122.5	-47.3	-179.2	-61.5	-177.5	173.5	0	0	111.3	N121	N121-E123 PolarHBondContact OD1-N 3.34Å
124	E	93.7	Very high	89.6	Confident	121 Å²	121	70.9 Å²	70.9	57%	0.565	37%	0.365	S	S	*	.	S	Bend	trans	-142.2	166.6	-176.5	64.5	177.7	-171	0	0	112.9	F120 N121 I126	F120-E124 WeakPolarHBondContact CD2-O 3.19Å; N121-E124 PolarHBondContact N-O 2.9Å; N121-E124 PolarHBondContact OD1-N 3.36Å; N121-E124 PolarHBondContact OD1-O 3.47Å; N121-E124 VanDerWaalsContact OD1-O 3.05Å; E124-I126 HydrophobicContact CG-CG2 4.31Å
125	F	95	Very high	89.4	Confident	25 Å²	25	70.1 Å²	70.1	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	118.5	168.5	-73.1	-67.3	0	0	0	109.9	A118 V119 F120 E128 F352 F354 F360 F362 V365	A118-F125 HydrophobicContact CB-CD1 3.48Å; A118-F125 VanDerWaalsContact CB-CD1 3.48Å; A118-F125 HydrophobicContact CB-CE1 3.59Å; A118-F125 HydrophobicContact CB-CG 4.3Å; A118-F125 HydrophobicContact CB-CZ 4.48Å; V119-F125 CarbonylContact O-C 3.58Å; V119-F125 WeakPolarHBondContact O-CA 3.46Å; F120-F125 HydrophobicContact CB-CD1 3.97Å; F120-F125 HydrophobicContact CB-CE1 3.83Å; F120-F125 HydrophobicContact CD2-CD1 4.34Å; F120-F125 HydrophobicContact CD2-CE1 4.35Å; F120-F125 HydrophobicContact CG-CE1 4.46Å; F125-E128 HydrophobicContact CB-CG 3.93Å; F125-F352 HydrophobicContact CE2-CB 3.63Å; F125-F352 HydrophobicContact CE2-CG 4.48Å; F125-F352 VanDerWaalsContact CE2-O 3.3Å; F125-F352 WeakPolarHBondContact CE2-O 3.39Å; F125-F352 HydrophobicContact CZ-CB 3.67Å; F125-F352 AromaticContact CZ-CD1 3.97Å; F125-F352 HydrophobicContact CZ-CD1 3.97Å; F125-F352 HydrophobicContact CZ-CG 4.03Å; F125-F354 AromaticContact CD2-CE2 3.69Å; F125-F354 HydrophobicContact CD2-CE2 3.69Å; F125-F354 AromaticContact CE2-CD2 3.96Å; F125-F354 HydrophobicContact CE2-CD2 3.96Å; F125-F354 AromaticContact CE2-CE2 3.45Å; F125-F354 HydrophobicContact CE2-CE2 3.45Å; F125-F354 VanDerWaalsContact CE2-CE2 3.45Å; F125-F360 HydrophobicContact CE2-CE2 4.34Å; F125-F360 HydrophobicContact CZ-CE2 4.01Å; F125-F362 HydrophobicContact CD2-CE2 4.26Å; F125-F362 HydrophobicContact CE1-CD2 4.47Å; F125-F362 HydrophobicContact CE2-CD2 4.33Å; F125-F362 HydrophobicContact CE2-CE2 4.09Å; F125-F362 HydrophobicContact CZ-CD2 4.11Å; F125-F362 HydrophobicContact CZ-CE2 4.26Å; F125-V365 HydrophobicContact CE1-CG1 3.84Å; F125-V365 HydrophobicContact CE1-CG2 3.94Å; F125-V365 HydrophobicContact CZ-CG1 4.45Å; F125-V365 HydrophobicContact CZ-CG2 4.03Å
126	I	93.4	Very high	89.2	Confident	20 Å²	20	69.7 Å²	69.7	10%	0.103	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-21.6	-179.6	59	169.5	0	0	0	112.3	V119 N121 E124 E214 T368	V119-I126 HydrophobicContact CB-CD1 4.46Å; V119-I126 HydrophobicContact CB-CG1 3.95Å; V119-I126 HydrophobicContact CG1-CD1 3.81Å; V119-I126 HydrophobicContact CG1-CG1 3.79Å; V119-I126 WeakPolarHBondContact O-CG1 3.25Å; V119-I126 PolarHBondContact O-N 3.21Å; N121-I126 HydrophobicContact CB-CD1 4.48Å; N121-I126 HydrophobicContact CB-CG2 4.02Å; E124-I126 HydrophobicContact CG-CG2 4.31Å; I126-E214 HydrophobicContact CD1-CB 3.69Å; I126-E214 HydrophobicContact CD1-CG 3.68Å; I126-T368 HydrophobicContact CD1-CG2 3.55Å
127	L	91.6	Very high	88.6	Confident	34 Å²	34	70.6 Å²	70.6	18%	0.178	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.9	175	-67.4	169.5	0	0	0	110.1	A118 V119 L140 Y144 E214 V215	A118-L127 CarbonylContact C-O 3.59Å; A118-L127 WeakPolarHBondContact CA-O 3.37Å; A118-L127 WeakPolarHBondContact CB-O 3.21Å; V119-L127 HydrophobicContact CB-CB 4.04Å; V119-L127 HydrophobicContact CB-CD1 4.48Å; V119-L127 HydrophobicContact CG2-CB 4.04Å; V119-L127 HydrophobicContact CG2-CD1 4.1Å; V119-L127 PolarHBondContact N-O 3.45Å; L127-L140 HydrophobicContact CD2-CD2 4.41Å; L127-Y144 HydrophobicContact CD1-CE2 4.44Å; L127-Y144 WeakPolarHBondContact CD1-OH 3.48Å; L127-Y144 HydrophobicContact CD2-CE2 3.83Å; L127-Y144 WeakPolarHBondContact CD2-OH 3.27Å; L127-Y144 WeakPolarHBondContact CG-OH 3.38Å; L127-E214 WeakPolarHBondContact CD1-O 3.29Å; L127-V215 HydrophobicContact CD1-CG2 3.48Å; L127-V215 VanDerWaalsContact CD1-CG2 3.48Å
128	E	92.3	Very high	88	Confident	82 Å²	82	73.9 Å²	73.9	38%	0.383	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	121.7	-179.2	-61.4	179	-166	0	0	108.8	A118 F125 F362	A118-E128 HydrophobicContact CB-CG 4.43Å; F125-E128 HydrophobicContact CB-CG 3.93Å; E128-F362 HydrophobicContact CB-CE1 3.9Å; E128-F362 HydrophobicContact CB-CZ 3.8Å; E128-F362 HydrophobicContact CG-CE1 4.16Å; E128-F362 HydrophobicContact CG-CE2 4.41Å; E128-F362 HydrophobicContact CG-CZ 3.58Å
129	E	88.1	Confident	87.6	Confident	88 Å²	88	79.3 Å²	79.3	41%	0.411	38%	0.375	S	S	.	.			trans	-71.6	134.7	170.7	-172.6	-179.4	-175.3	0	0	110	K116 T117	K116-E129 WeakPolarHBondContact CA-OE2 3.32Å; K116-E129 HydrophobicContact CB-CB 4.35Å; T117-E129 PolarHBondContact N-OE2 2.93Å; T117-E129 WeakPolarHBondContact O-CB 3.48Å; T117-E129 PolarHBondContact O-N 2.93Å
130	T	85.4	Confident	87.1	Confident	31 Å²	31	80.4 Å²	80.4	19%	0.19	38%	0.38	C	S	.	.			trans	-110.5	175.1	179.6	70.4	0	0	0	0	111.3	W132 L135 D136 R139	T130-W132 PolarHBondContact O-N 3.05Å; T130-W132 PolarHBondContact OG1-N 2.72Å; T130-W132 PolarHBondContact OG1-O 3.14Å; T130-L135 HydrophobicContact CG2-CD2 4.47Å; T130-D136 WeakPolarHBondContact CB-OD1 3.34Å; T130-D136 WeakPolarHBondContact CG2-OD1 3.38Å; T130-D136 PolarHBondContact N-OD1 2.96Å; T130-D136 PolarHBondContact N-OD2 2.86Å; T130-D136 VanDerWaalsContact OG1-CG 3.27Å; T130-D136 PolarHBondContact OG1-OD1 2.97Å; T130-D136 PolarHBondContact OG1-OD2 3.05Å; T130-R139 VanDerWaalsContact CG2-NH1 3.33Å
131	D	82.9	Confident	86.7	Confident	126 Å²	126	86.9 Å²	86.9	67%	0.674	41%	0.405	S	S	*	.	S	Bend	trans	-73	-6.8	170.8	-60.6	-56.5	0	0	0	112.3	K116	K116-D131 WeakPolarHBondContact CE-OD1 3.39Å; K116-D131 WeakPolarHBondContact CE-OD2 3.44Å; K116-D131 IonicContact NZ-OD1 3.05Å; K116-D131 PolarHBondContact NZ-OD1 2.99Å; K116-D131 IonicContact NZ-OD2 2.69Å; K116-D131 PolarHBondContact NZ-OD2 3.37Å
132	W	81.4	Confident	86.4	Confident	197 Å²	197	94.3 Å²	94.3	75%	0.746	43%	0.43	S	S	*	.			trans	-112.8	88.1	-170.7	-65.2	75.7	0	0	0	110.4	T130 L134 L135 D136	T130-W132 PolarHBondContact O-N 3.05Å; T130-W132 PolarHBondContact OG1-N 2.72Å; T130-W132 PolarHBondContact OG1-O 3.14Å; W132-L134 PolarHBondContact O-N 3.06Å; W132-L134 VanDerWaalsContact O-N 3.08Å; W132-L135 HydrophobicContact CB-CB 3.79Å; W132-L135 HydrophobicContact CB-CD2 4.48Å; W132-L135 WeakPolarHBondContact O-CA 3.39Å; W132-L135 VanDerWaalsContact O-CB 3.29Å; W132-L135 WeakPolarHBondContact O-CB 3.44Å; W132-L135 PolarHBondContact O-N 3.17Å; W132-D136 PolarHBondContact O-N 2.82Å; W132-D136 VanDerWaalsContact O-N 3.11Å
133	Y	76.6	Confident	86.4	Confident	164 Å²	164	96.9 Å²	96.9	64%	0.643	43%	0.431	S	S	*	.	H	α-helix	trans	-47.1	-43.1	-179.9	173.5	-99.5	0	0	0	114.4	L135 D136 L137	Y133-L135 VanDerWaalsContact C-N 3.31Å; Y133-L135 PolarHBondContact O-N 3.32Å; Y133-D136 PolarHBondContact O-N 3.26Å; Y133-L137 HydrophobicContact CE1-CD2 4.42Å; Y133-L137 PolarHBondContact O-N 3.07Å
134	L	75.9	Confident	86.3	Confident	134 Å²	134	89 Å²	89	70%	0.702	39%	0.393	S	S	*	.	H	α-helix	trans	-66.4	-32.8	179.3	-66.3	178	0	0	0	112.8	W132 F138	W132-L134 PolarHBondContact O-N 3.06Å; W132-L134 VanDerWaalsContact O-N 3.08Å; L134-F138 WeakPolarHBondContact O-CB 3.38Å; L134-F138 PolarHBondContact O-N 3.34Å
135	L	80.8	Confident	86.2	Confident	71 Å²	71	84.7 Å²	84.7	37%	0.372	38%	0.382	S	S	.	.	H	α-helix	trans	-69.3	-42.4	175.4	178.9	61.6	0	0	0	110.5	T130 W132 Y133 L137 F138 R139	T130-L135 HydrophobicContact CG2-CD2 4.47Å; W132-L135 HydrophobicContact CB-CB 3.79Å; W132-L135 HydrophobicContact CB-CD2 4.48Å; W132-L135 WeakPolarHBondContact O-CA 3.39Å; W132-L135 VanDerWaalsContact O-CB 3.29Å; W132-L135 WeakPolarHBondContact O-CB 3.44Å; W132-L135 PolarHBondContact O-N 3.17Å; Y133-L135 VanDerWaalsContact C-N 3.31Å; Y133-L135 PolarHBondContact O-N 3.32Å; L135-L137 VanDerWaalsContact C-N 3.35Å; L135-F138 PolarHBondContact O-N 3.31Å; L135-R139 HydrophobicContact CD1-CG 4.5Å; L135-R139 WeakPolarHBondContact O-CB 3.36Å; L135-R139 WeakPolarHBondContact O-CG 3.41Å; L135-R139 PolarHBondContact O-N 3.4Å
136	D	82.3	Confident	86.1	Confident	25 Å²	25	87.3 Å²	87.3	13%	0.134	40%	0.396	C	S	.	.	H	α-helix	trans	-62.7	-44.4	176.5	-65.3	-16.3	0	0	0	110.6	T130 W132 Y133 F138 R139 L140	T130-D136 WeakPolarHBondContact CB-OD1 3.34Å; T130-D136 WeakPolarHBondContact CG2-OD1 3.38Å; T130-D136 PolarHBondContact N-OD1 2.96Å; T130-D136 PolarHBondContact N-OD2 2.86Å; T130-D136 VanDerWaalsContact OG1-CG 3.27Å; T130-D136 PolarHBondContact OG1-OD1 2.97Å; T130-D136 PolarHBondContact OG1-OD2 3.05Å; W132-D136 PolarHBondContact O-N 2.82Å; W132-D136 VanDerWaalsContact O-N 3.11Å; Y133-D136 PolarHBondContact O-N 3.26Å; D136-F138 PolarHBondContact O-N 2.54Å; D136-R139 PolarHBondContact O-N 3.2Å; D136-L140 VanDerWaalsContact O-CG 3.31Å; D136-L140 WeakPolarHBondContact O-CG 3.38Å; D136-L140 PolarHBondContact O-N 3.46Å
137	L	78.8	Confident	86	Confident	62 Å²	62	86.7 Å²	86.7	33%	0.325	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-42.7	175.5	-173	63.6	0	0	0	112.2	Y133 L135 L140 W141 F148	Y133-L137 HydrophobicContact CE1-CD2 4.42Å; Y133-L137 PolarHBondContact O-N 3.07Å; L135-L137 VanDerWaalsContact C-N 3.35Å; L137-L140 PolarHBondContact O-N 3.07Å; L137-W141 WeakPolarHBondContact O-CB 3.12Å; L137-W141 PolarHBondContact O-N 2.75Å; L137-F148 HydrophobicContact CD1-CD1 4.01Å; L137-F148 HydrophobicContact CD1-CE1 3.82Å
138	F	81.9	Confident	85.9	Confident	115 Å²	115	87.4 Å²	87.4	50%	0.504	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-43.1	175.3	177.1	-98.1	0	0	0	111.9	L134 L135 D136 W141 W142	L134-F138 WeakPolarHBondContact O-CB 3.38Å; L134-F138 PolarHBondContact O-N 3.34Å; L135-F138 PolarHBondContact O-N 3.31Å; D136-F138 PolarHBondContact O-N 2.54Å; F138-W141 HydrophobicContact CD2-CE3 4.49Å; F138-W141 HydrophobicContact CE2-CE3 4.39Å; F138-W141 HydrophobicContact CE2-CZ3 4.47Å; F138-W141 PolarHBondContact O-N 2.85Å; F138-W142 HydrophobicContact CE1-CB 4.47Å; F138-W142 HydrophobicContact CZ-CE3 4.31Å; F138-W142 VanDerWaalsContact O-CB 3.3Å; F138-W142 WeakPolarHBondContact O-CB 3.48Å; F138-W142 PolarHBondContact O-N 2.92Å
139	R	86.4	Confident	85.8	Confident	115 Å²	115	87.6 Å²	87.6	43%	0.434	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176.2	-76.2	173.3	172.6	-173	-4.3	111.6	T130 L135 D136 W142 R143	T130-R139 VanDerWaalsContact CG2-NH1 3.33Å; L135-R139 HydrophobicContact CD1-CG 4.5Å; L135-R139 WeakPolarHBondContact O-CB 3.36Å; L135-R139 WeakPolarHBondContact O-CG 3.41Å; L135-R139 PolarHBondContact O-N 3.4Å; D136-R139 PolarHBondContact O-N 3.2Å; R139-W142 PolarHBondContact O-N 2.62Å; R139-R143 VanDerWaalsContact O-CB 3.26Å; R139-R143 WeakPolarHBondContact O-CB 3.11Å; R139-R143 PolarHBondContact O-N 2.8Å
140	L	87.3	Confident	86	Confident	36 Å²	36	88.2 Å²	88.2	19%	0.188	40%	0.397	C	S	.	.	H	α-helix	trans	-60.9	-47.1	175.8	-71.2	176.9	0	0	0	110.9	L127 D136 L137 R143 Y144 F148	L127-L140 HydrophobicContact CD2-CD2 4.41Å; D136-L140 VanDerWaalsContact O-CG 3.31Å; D136-L140 WeakPolarHBondContact O-CG 3.38Å; D136-L140 PolarHBondContact O-N 3.46Å; L137-L140 PolarHBondContact O-N 3.07Å; L140-R143 PolarHBondContact O-N 3.33Å; L140-Y144 HydrophobicContact CB-CD2 4.43Å; L140-Y144 HydrophobicContact CD2-CD2 3.86Å; L140-Y144 HydrophobicContact CD2-CE2 3.71Å; L140-Y144 WeakPolarHBondContact O-CA 3.44Å; L140-Y144 WeakPolarHBondContact O-CB 3.18Å; L140-Y144 VanDerWaalsContact O-CD2 3.29Å; L140-Y144 WeakPolarHBondContact O-CD2 3.24Å; L140-Y144 PolarHBondContact O-N 3.2Å; L140-F148 HydrophobicContact CD1-CD2 4.12Å; L140-F148 HydrophobicContact CD1-CE2 4.27Å; L140-F148 HydrophobicContact CD1-CG 4.47Å
141	W	86.9	Confident	86.4	Confident	136 Å²	136	87.2 Å²	87.2	52%	0.515	39%	0.39	S	S	.	.	H	α-helix	trans	-64.9	-43	178.9	-178.1	77.9	0	0	0	112.5	L137 F138 G145	L137-W141 WeakPolarHBondContact O-CB 3.12Å; L137-W141 PolarHBondContact O-N 2.75Å; F138-W141 HydrophobicContact CD2-CE3 4.49Å; F138-W141 HydrophobicContact CE2-CE3 4.39Å; F138-W141 HydrophobicContact CE2-CZ3 4.47Å; F138-W141 PolarHBondContact O-N 2.85Å; W141-G145 WeakPolarHBondContact O-CA 3.48Å; W141-G145 PolarHBondContact O-N 3.35Å
142	W	88.6	Confident	86.7	Confident	193 Å²	193	83.6 Å²	83.6	73%	0.731	37%	0.369	S	S	*	.	H	α-helix	trans	-64.5	-41.6	178.3	-177.4	-99	0	0	0	112.2	F138 R139	F138-W142 HydrophobicContact CE1-CB 4.47Å; F138-W142 HydrophobicContact CZ-CE3 4.31Å; F138-W142 VanDerWaalsContact O-CB 3.3Å; F138-W142 WeakPolarHBondContact O-CB 3.48Å; F138-W142 PolarHBondContact O-N 2.92Å; R139-W142 PolarHBondContact O-N 2.62Å
143	R	92.1	Very high	87.3	Confident	84 Å²	84	80 Å²	80	32%	0.317	36%	0.362	S	S	.	.	H	α-helix	trans	-82	-33	-175.9	-170.8	172.1	176.7	115.9	-3.2	113.5	R139 L140 E214	R139-R143 VanDerWaalsContact O-CB 3.26Å; R139-R143 WeakPolarHBondContact O-CB 3.11Å; R139-R143 PolarHBondContact O-N 2.8Å; L140-R143 PolarHBondContact O-N 3.33Å; R143-E214 IonicContact CZ-OE1 3.8Å; R143-E214 IonicContact CZ-OE2 3.24Å; R143-E214 VanDerWaalsContact CZ-OE2 3.24Å; R143-E214 IonicContact NE-OE1 3.87Å; R143-E214 IonicContact NE-OE2 2.76Å; R143-E214 PolarHBondContact NE-OE2 2.86Å; R143-E214 VanDerWaalsContact NH2-CD 3.26Å; R143-E214 IonicContact NH2-OE1 2.86Å; R143-E214 PolarHBondContact NH2-OE1 3.24Å; R143-E214 IonicContact NH2-OE2 2.92Å; R143-E214 PolarHBondContact NH2-OE2 3.08Å
144	Y	91.6	Very high	88.2	Confident	9 Å²	9	73.2 Å²	73.2	4%	0.035	34%	0.336	C	S	.	.	H	α-helix	trans	-124	1.4	-170	-50.7	-69.1	0	0	0	114.5	L127 L140 S147 R210 F211 E214 V215	L127-Y144 HydrophobicContact CD1-CE2 4.44Å; L127-Y144 WeakPolarHBondContact CD1-OH 3.48Å; L127-Y144 HydrophobicContact CD2-CE2 3.83Å; L127-Y144 WeakPolarHBondContact CD2-OH 3.27Å; L127-Y144 WeakPolarHBondContact CG-OH 3.38Å; L140-Y144 HydrophobicContact CB-CD2 4.43Å; L140-Y144 HydrophobicContact CD2-CD2 3.86Å; L140-Y144 HydrophobicContact CD2-CE2 3.71Å; L140-Y144 WeakPolarHBondContact O-CA 3.44Å; L140-Y144 WeakPolarHBondContact O-CB 3.18Å; L140-Y144 VanDerWaalsContact O-CD2 3.29Å; L140-Y144 WeakPolarHBondContact O-CD2 3.24Å; L140-Y144 PolarHBondContact O-N 3.2Å; Y144-S147 VanDerWaalsContact O-CB 3.26Å; Y144-S147 WeakPolarHBondContact O-CB 3.38Å; Y144-S147 PolarHBondContact O-N 3.23Å; Y144-S147 PolarHBondContact O-OG 2.87Å; Y144-R210 HydrophobicContact CD1-CG 4.39Å; Y144-R210 HydrophobicContact CE1-CG 4.04Å; Y144-F211 HydrophobicContact CD1-CB 3.79Å; Y144-F211 AromaticContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CG 4.32Å; Y144-F211 AromaticContact CD2-CD2 3.64Å; Y144-F211 HydrophobicContact CD2-CD2 3.64Å; Y144-F211 HydrophobicContact CD2-CE2 4.13Å; Y144-F211 HydrophobicContact CE1-CB 4.47Å; Y144-F211 HydrophobicContact CE1-CD2 4.37Å; Y144-F211 HydrophobicContact CE2-CD2 4.21Å; Y144-F211 HydrophobicContact CG-CB 4.13Å; Y144-F211 AromaticContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CD2 3.43Å; Y144-F211 VanDerWaalsContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CE2 4.3Å; Y144-F211 HydrophobicContact CG-CG 4.23Å; Y144-E214 HydrophobicContact CE1-CB 4.17Å; Y144-E214 VanDerWaalsContact CE1-OE2 3.23Å; Y144-E214 WeakPolarHBondContact CE1-OE2 3.37Å; Y144-E214 VanDerWaalsContact CZ-OE2 3.27Å; Y144-E214 WeakPolarHBondContact OH-CB 3.4Å; Y144-E214 PolarHBondContact OH-OE2 3.3Å; Y144-V215 HydrophobicContact CE2-CG2 4.02Å
145	G	91.1	Very high	89	Confident	32 Å²	32	67 Å²	67	33%	0.33	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	-135.5	-176.9	0	0	0	0	0	112	W141 S147	W141-G145 WeakPolarHBondContact O-CA 3.48Å; W141-G145 PolarHBondContact O-N 3.35Å; G145-S147 VanDerWaalsContact C-N 3.27Å; G145-S147 PolarHBondContact O-N 3.43Å
146	I	91.6	Very high	89.5	Confident	80 Å²	80	69 Å²	69	41%	0.41	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	7.8	-179.9	62.7	171.4	0	0	0	113.8	F148 I149 R150	I146-F148 VanDerWaalsContact C-N 3.28Å; I146-F148 PolarHBondContact O-N 3.39Å; I146-I149 PolarHBondContact O-N 3.46Å; I146-I149 VanDerWaalsContact O-N 3.12Å; I146-R150 PolarHBondContact O-N 3.17Å
147	S	93.3	Very high	90.1	Very high	6 Å²	6	72.4 Å²	72.4	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-56.6	-40.9	-179.7	-60.9	0	0	0	0	112.2	Y144 G145 I149 R150 L151 S208	Y144-S147 VanDerWaalsContact O-CB 3.26Å; Y144-S147 WeakPolarHBondContact O-CB 3.38Å; Y144-S147 PolarHBondContact O-N 3.23Å; Y144-S147 PolarHBondContact O-OG 2.87Å; G145-S147 VanDerWaalsContact C-N 3.27Å; G145-S147 PolarHBondContact O-N 3.43Å; S147-I149 PolarHBondContact O-N 3.47Å; S147-R150 PolarHBondContact O-N 3.34Å; S147-L151 WeakPolarHBondContact O-CB 3.45Å; S147-L151 PolarHBondContact O-N 3.33Å; S147-S208 PolarHBondContact OG-N 3.16Å; S147-S208 PolarHBondContact OG-OG 2.78Å
148	F	88.9	Confident	90.8	Very high	49 Å²	49	70.1 Å²	70.1	22%	0.215	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-42.2	176.9	176.5	-101.6	0	0	0	112.3	L137 L140 I146 L151 Q152 F211	L137-F148 HydrophobicContact CD1-CD1 4.01Å; L137-F148 HydrophobicContact CD1-CE1 3.82Å; L140-F148 HydrophobicContact CD1-CD2 4.12Å; L140-F148 HydrophobicContact CD1-CE2 4.27Å; L140-F148 HydrophobicContact CD1-CG 4.47Å; I146-F148 VanDerWaalsContact C-N 3.28Å; I146-F148 PolarHBondContact O-N 3.39Å; F148-L151 PolarHBondContact O-N 3.22Å; F148-Q152 HydrophobicContact CD1-CG 4.41Å; F148-Q152 HydrophobicContact CE1-CG 3.96Å; F148-Q152 HydrophobicContact CE2-CG 4.21Å; F148-Q152 HydrophobicContact CZ-CG 3.85Å; F148-Q152 WeakPolarHBondContact O-CG 3.49Å; F148-Q152 PolarHBondContact O-N 2.9Å; F148-F211 HydrophobicContact CB-CE2 4.13Å; F148-F211 HydrophobicContact CB-CZ 3.98Å; F148-F211 HydrophobicContact CD2-CE2 4.48Å; F148-F211 HydrophobicContact CD2-CZ 4.06Å
149	I	89.3	Confident	91.3	Very high	87 Å²	87	66 Å²	66	45%	0.446	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-44.9	178.9	-60.8	173.4	0	0	0	110.2	I146 S147 L151 Q152 M153	I146-I149 PolarHBondContact O-N 3.46Å; I146-I149 VanDerWaalsContact O-N 3.12Å; S147-I149 PolarHBondContact O-N 3.47Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 2.85Å; I149-Q152 PolarHBondContact O-N 3.11Å; I149-M153 HydrophobicContact CG2-CG 4.38Å; I149-M153 HydrophobicContact CG2-SD 3.99Å; I149-M153 WeakPolarHBondContact O-CG 3.49Å; I149-M153 PolarHBondContact O-N 2.78Å
150	R	93.8	Very high	91.6	Very high	101 Å²	101	67.2 Å²	67.2	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-57.2	-44	175.8	-73.1	172.5	166.7	171.4	-3.5	111.6	I146 S147 W154 L205 G206 V207	I146-R150 PolarHBondContact O-N 3.17Å; S147-R150 PolarHBondContact O-N 3.34Å; R150-W154 WeakPolarHBondContact O-CB 3.48Å; R150-W154 PolarHBondContact O-N 3.25Å; R150-L205 VanDerWaalsContact CD-O 3.32Å; R150-L205 WeakPolarHBondContact CD-O 3.37Å; R150-G206 PolarHBondContact NH1-O 2.91Å; R150-V207 HydrophobicContact CB-CG2 4.13Å
151	L	93	Very high	91.9	Very high	10 Å²	10	68 Å²	68	5%	0.052	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-49.5	175.5	-178.3	71.1	0	0	0	111.8	S147 F148 I149 M153 W154 V155 L202 F211 I216 L239	S147-L151 WeakPolarHBondContact O-CB 3.45Å; S147-L151 PolarHBondContact O-N 3.33Å; F148-L151 PolarHBondContact O-N 3.22Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 2.85Å; L151-M153 PolarHBondContact O-N 2.91Å; L151-W154 HydrophobicContact CD1-CE3 4.27Å; L151-W154 PolarHBondContact O-N 3.4Å; L151-V155 HydrophobicContact CD1-CG2 4.29Å; L151-V155 HydrophobicContact CG-CG2 4.44Å; L151-V155 WeakPolarHBondContact O-CG2 3.5Å; L151-V155 PolarHBondContact O-N 2.88Å; L151-L202 HydrophobicContact CD1-CD2 3.85Å; L151-F211 HydrophobicContact CB-CE1 4.05Å; L151-F211 HydrophobicContact CD2-CE1 3.65Å; L151-F211 HydrophobicContact CD2-CZ 3.99Å; L151-F211 HydrophobicContact CG-CE1 4.39Å; L151-I216 HydrophobicContact CD1-CD1 3.88Å; L151-I216 HydrophobicContact CD2-CD1 4.17Å; L151-I216 HydrophobicContact CD2-CG1 4.31Å; L151-L239 HydrophobicContact CD1-CD1 3.73Å; L151-L239 HydrophobicContact CD2-CD2 4.29Å
152	Q	89.7	Confident	92.3	Very high	50 Å²	50	62.8 Å²	62.8	23%	0.234	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-48.7	-179.5	-70.7	-59.8	-41	0	0	111.2	F148 I149 W154 V155 E156	F148-Q152 HydrophobicContact CD1-CG 4.41Å; F148-Q152 HydrophobicContact CE1-CG 3.96Å; F148-Q152 HydrophobicContact CE2-CG 4.21Å; F148-Q152 HydrophobicContact CZ-CG 3.85Å; F148-Q152 WeakPolarHBondContact O-CG 3.49Å; F148-Q152 PolarHBondContact O-N 2.9Å; I149-Q152 PolarHBondContact O-N 3.11Å; Q152-W154 VanDerWaalsContact C-N 3.29Å; Q152-W154 PolarHBondContact O-N 2.79Å; Q152-V155 PolarHBondContact O-N 3.31Å; Q152-E156 WeakPolarHBondContact O-CB 3.46Å; Q152-E156 VanDerWaalsContact O-CG 3.27Å; Q152-E156 WeakPolarHBondContact O-CG 3.49Å; Q152-E156 PolarHBondContact O-N 2.9Å
153	M	93.1	Very high	92.6	Very high	121 Å²	121	56.2 Å²	56.2	60%	0.596	27%	0.268	S	S	*	.	H	α-helix	trans	-58.3	-42.4	177.8	-69.3	176.9	66.4	0	0	112	I149 L151 E157	I149-M153 HydrophobicContact CG2-CG 4.38Å; I149-M153 HydrophobicContact CG2-SD 3.99Å; I149-M153 WeakPolarHBondContact O-CG 3.49Å; I149-M153 PolarHBondContact O-N 2.78Å; L151-M153 PolarHBondContact O-N 2.91Å; M153-E157 WeakPolarHBondContact O-CB 3.38Å; M153-E157 PolarHBondContact O-N 2.89Å
154	W	95.4	Very high	92.7	Very high	22 Å²	22	55.6 Å²	55.6	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-45.8	179.2	178.9	71.4	0	0	0	112.6	R150 L151 Q152 E157 I158 M193 L198 L202 L205 A232 A236 L239	R150-W154 WeakPolarHBondContact O-CB 3.48Å; R150-W154 PolarHBondContact O-N 3.25Å; L151-W154 HydrophobicContact CD1-CE3 4.27Å; L151-W154 PolarHBondContact O-N 3.4Å; Q152-W154 VanDerWaalsContact C-N 3.29Å; Q152-W154 PolarHBondContact O-N 2.79Å; W154-E157 PolarHBondContact O-N 3.09Å; W154-I158 HydrophobicContact CD2-CD1 3.68Å; W154-I158 VanDerWaalsContact CE2-CD1 3.42Å; W154-I158 HydrophobicContact CE3-CD1 4.06Å; W154-I158 HydrophobicContact CG-CD1 4.21Å; W154-I158 HydrophobicContact CH2-CD1 4.03Å; W154-I158 HydrophobicContact CZ2-CD1 3.65Å; W154-I158 HydrophobicContact CZ3-CD1 4.21Å; W154-I158 WeakPolarHBondContact O-CD1 3.09Å; W154-I158 WeakPolarHBondContact O-CG1 3.42Å; W154-I158 PolarHBondContact O-N 3.47Å; W154-M193 HydrophobicContact CH2-CE 4.05Å; W154-M193 HydrophobicContact CZ2-CE 3.42Å; W154-M193 VanDerWaalsContact CZ2-CE 3.42Å; W154-L198 HydrophobicContact CH2-CD1 3.61Å; W154-L198 HydrophobicContact CZ3-CD1 4.01Å; W154-L202 HydrophobicContact CD2-CD2 4.39Å; W154-L202 HydrophobicContact CE3-CD2 3.99Å; W154-L202 HydrophobicContact CH2-CD2 4.46Å; W154-L202 HydrophobicContact CZ3-CD2 4.05Å; W154-L205 HydrophobicContact CB-CD1 4.05Å; W154-L205 HydrophobicContact CD2-CD1 3.93Å; W154-L205 HydrophobicContact CG-CD1 3.47Å; W154-L205 VanDerWaalsContact CG-CD1 3.47Å; W154-A232 WeakPolarHBondContact CH2-O 3.37Å; W154-A232 HydrophobicContact CZ2-CB 4.3Å; W154-A236 HydrophobicContact CH2-CB 3.8Å; W154-A236 HydrophobicContact CZ3-CB 3.94Å; W154-L239 HydrophobicContact CZ3-CD1 3.85Å
155	V	93.2	Very high	93	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-43.3	177.1	173.5	0	0	0	0	110.9	L151 Q152 I158 M159 L239 A240	L151-V155 HydrophobicContact CD1-CG2 4.29Å; L151-V155 HydrophobicContact CG-CG2 4.44Å; L151-V155 WeakPolarHBondContact O-CG2 3.5Å; L151-V155 PolarHBondContact O-N 2.88Å; Q152-V155 PolarHBondContact O-N 3.31Å; V155-I158 PolarHBondContact O-N 3.21Å; V155-M159 HydrophobicContact CG1-CG 4.3Å; V155-M159 HydrophobicContact CG1-SD 3.54Å; V155-M159 VanDerWaalsContact CG1-SD 3.54Å; V155-M159 WeakPolarHBondContact O-CB 3.33Å; V155-M159 VanDerWaalsContact O-CG 3.28Å; V155-M159 WeakPolarHBondContact O-CG 3.47Å; V155-M159 PolarHBondContact O-N 3.14Å; V155-L239 HydrophobicContact CG2-CB 3.86Å; V155-L239 HydrophobicContact CG2-CD1 4.2Å; V155-A240 HydrophobicContact CG1-CB 4.29Å
156	E	91.3	Very high	93.2	Very high	114 Å²	114	55 Å²	55	53%	0.533	25%	0.253	S	S	.	.	H	α-helix	trans	-61.1	-43.5	177.5	-75.7	176.2	177.8	0	0	112.2	Q152 I158 M159 E160	Q152-E156 WeakPolarHBondContact O-CB 3.46Å; Q152-E156 VanDerWaalsContact O-CG 3.27Å; Q152-E156 WeakPolarHBondContact O-CG 3.49Å; Q152-E156 PolarHBondContact O-N 2.9Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 2.95Å; E156-M159 PolarHBondContact O-N 3.37Å; E156-E160 WeakPolarHBondContact O-CB 3.49Å; E156-E160 PolarHBondContact O-N 3.11Å
157	E	94.3	Very high	93.4	Very high	97 Å²	97	54.9 Å²	54.9	45%	0.453	25%	0.25	S	C	.	.	H	α-helix	trans	-60.5	-43.2	177.1	-173.3	-168.7	152.5	0	0	111.7	M153 W154 K161	M153-E157 WeakPolarHBondContact O-CB 3.38Å; M153-E157 PolarHBondContact O-N 2.89Å; W154-E157 PolarHBondContact O-N 3.09Å; E157-K161 HydrophobicContact CG-CD 4.46Å; E157-K161 WeakPolarHBondContact O-CG 3.49Å; E157-K161 PolarHBondContact O-N 3.28Å; E157-K161 VanDerWaalsContact O-N 3.09Å; E157-K161 WeakPolarHBondContact OE1-CE 3.39Å; E157-K161 IonicContact OE1-NZ 3.94Å; E157-K161 PolarHBondContact OE1-NZ 3.35Å
158	I	94.8	Very high	93.5	Very high	13 Å²	13	54.7 Å²	54.7	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-44.8	177.5	-66.7	160.3	0	0	0	110.1	W154 V155 E156 K161 F162 F190 M193 F233 A236	W154-I158 HydrophobicContact CD2-CD1 3.68Å; W154-I158 VanDerWaalsContact CE2-CD1 3.42Å; W154-I158 HydrophobicContact CE3-CD1 4.06Å; W154-I158 HydrophobicContact CG-CD1 4.21Å; W154-I158 HydrophobicContact CH2-CD1 4.03Å; W154-I158 HydrophobicContact CZ2-CD1 3.65Å; W154-I158 HydrophobicContact CZ3-CD1 4.21Å; W154-I158 WeakPolarHBondContact O-CD1 3.09Å; W154-I158 WeakPolarHBondContact O-CG1 3.42Å; W154-I158 PolarHBondContact O-N 3.47Å; V155-I158 PolarHBondContact O-N 3.21Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 2.95Å; I158-K161 PolarHBondContact O-N 3.39Å; I158-F162 VanDerWaalsContact O-CB 3.31Å; I158-F162 WeakPolarHBondContact O-CB 3.28Å; I158-F162 PolarHBondContact O-N 3.5Å; I158-F190 HydrophobicContact CB-CE1 4.36Å; I158-F190 HydrophobicContact CG1-CE1 4.24Å; I158-F190 HydrophobicContact CG2-CE1 3.97Å; I158-F190 HydrophobicContact CG2-CZ 3.94Å; I158-M193 HydrophobicContact CD1-CE 3.39Å; I158-M193 HydrophobicContact CD1-SD 4.15Å; I158-M193 HydrophobicContact CG1-CE 4.13Å; I158-M193 HydrophobicContact CG1-SD 4.36Å; I158-F233 HydrophobicContact CG2-CE2 4.24Å; I158-A236 HydrophobicContact CD1-CB 3.6Å; I158-A236 HydrophobicContact CG2-CB 4.11Å
159	M	91.3	Very high	93.9	Very high	30 Å²	30	52.7 Å²	52.7	15%	0.148	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-47	177.5	-74.4	169.5	61.6	0	0	111	L94 V155 E156 K161 F162 M163 A240 Q243	L94-M159 HydrophobicContact CD1-CE 3.31Å; L94-M159 HydrophobicContact CG-CE 4.28Å; V155-M159 HydrophobicContact CG1-CG 4.3Å; V155-M159 HydrophobicContact CG1-SD 3.54Å; V155-M159 VanDerWaalsContact CG1-SD 3.54Å; V155-M159 WeakPolarHBondContact O-CB 3.33Å; V155-M159 VanDerWaalsContact O-CG 3.28Å; V155-M159 WeakPolarHBondContact O-CG 3.47Å; V155-M159 PolarHBondContact O-N 3.14Å; E156-M159 PolarHBondContact O-N 3.37Å; M159-K161 VanDerWaalsContact C-N 3.32Å; M159-K161 PolarHBondContact O-N 3.25Å; M159-F162 PolarHBondContact O-N 3.47Å; M159-F162 VanDerWaalsContact O-N 3.11Å; M159-M163 VanDerWaalsContact O-CG 3.26Å; M159-M163 WeakPolarHBondContact O-CG 3.13Å; M159-M163 PolarHBondContact O-N 3.3Å; M159-A240 HydrophobicContact CG-CB 4.27Å; M159-A240 HydrophobicContact SD-CB 3.74Å; M159-Q243 PolarHBondContact SD-OE1 3.45Å; M159-Q243 VanDerWaalsContact SD-OE1 3.38Å
160	E	92.5	Very high	94.2	Very high	139 Å²	139	52.5 Å²	52.5	65%	0.65	25%	0.251	S	S	*	.	H	α-helix	trans	-56.8	-45.2	177.5	-171.2	-169.7	153.8	0	0	111.8	E156	E156-E160 WeakPolarHBondContact O-CB 3.49Å; E156-E160 PolarHBondContact O-N 3.11Å
161	K	95.1	Very high	94.2	Very high	53 Å²	53	51.1 Å²	51.1	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-43	175	-74.4	170.4	176.5	172.3	0	111.7	E157 I158 M159 M163 R164 F190	E157-K161 HydrophobicContact CG-CD 4.46Å; E157-K161 WeakPolarHBondContact O-CG 3.49Å; E157-K161 PolarHBondContact O-N 3.28Å; E157-K161 VanDerWaalsContact O-N 3.09Å; E157-K161 WeakPolarHBondContact OE1-CE 3.39Å; E157-K161 IonicContact OE1-NZ 3.94Å; E157-K161 PolarHBondContact OE1-NZ 3.35Å; I158-K161 PolarHBondContact O-N 3.39Å; M159-K161 VanDerWaalsContact C-N 3.32Å; M159-K161 PolarHBondContact O-N 3.25Å; K161-M163 VanDerWaalsContact C-N 3.33Å; K161-M163 PolarHBondContact O-N 2.96Å; K161-R164 VanDerWaalsContact O-CB 3.27Å; K161-R164 WeakPolarHBondContact O-CB 3.43Å; K161-R164 VanDerWaalsContact O-CD 3.24Å; K161-R164 WeakPolarHBondContact O-CD 3.36Å; K161-R164 WeakPolarHBondContact O-CG 3.43Å; K161-R164 PolarHBondContact O-N 3.31Å; K161-F190 HydrophobicContact CB-CE1 4.14Å; K161-F190 HydrophobicContact CB-CE2 4.26Å; K161-F190 HydrophobicContact CB-CZ 3.54Å; K161-F190 HydrophobicContact CD-CE1 4.07Å; K161-F190 HydrophobicContact CD-CZ 4.33Å
162	F	95	Very high	94.3	Very high	27 Å²	27	51.2 Å²	51.2	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-38.4	179.6	-171.6	-93.8	0	0	0	112.1	I158 M159 R164 I165 L185 F233 M465 V468	I158-F162 VanDerWaalsContact O-CB 3.31Å; I158-F162 WeakPolarHBondContact O-CB 3.28Å; I158-F162 PolarHBondContact O-N 3.5Å; M159-F162 PolarHBondContact O-N 3.47Å; M159-F162 VanDerWaalsContact O-N 3.11Å; F162-R164 PolarHBondContact O-N 2.82Å; F162-I165 HydrophobicContact CD1-CG2 4.37Å; F162-I165 HydrophobicContact CE1-CG2 4.11Å; F162-I165 HydrophobicContact CZ-CG2 4.47Å; F162-I165 WeakPolarHBondContact O-CB 3.45Å; F162-I165 WeakPolarHBondContact O-CG2 3.47Å; F162-I165 PolarHBondContact O-N 2.64Å; F162-L185 HydrophobicContact CD2-CD1 3.94Å; F162-L185 HydrophobicContact CE2-CD1 4.2Å; F162-F233 HydrophobicContact CD2-CZ 4.1Å; F162-F233 HydrophobicContact CE2-CZ 4.43Å; F162-M465 HydrophobicContact CE1-SD 4.47Å; F162-M465 HydrophobicContact CE2-CE 4.23Å; F162-M465 HydrophobicContact CE2-SD 3.67Å; F162-M465 HydrophobicContact CZ-SD 3.44Å; F162-M465 WeakPolarHBondContact CZ-SD 3.41Å; F162-V468 HydrophobicContact CZ-CG2 4.3Å
163	M	93.9	Very high	94.7	Very high	55 Å²	55	49.5 Å²	49.5	27%	0.271	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-18.8	178.4	-70	-59.2	-64.5	0	0	113.9	L94 L96 M159 K161 I165 Y166	L94-M163 HydrophobicContact CB-SD 3.95Å; L94-M163 HydrophobicContact CD1-SD 4.3Å; L96-M163 HydrophobicContact CD1-CE 3.56Å; L96-M163 HydrophobicContact CD2-CE 4.31Å; L96-M163 HydrophobicContact CG-CE 3.87Å; M159-M163 VanDerWaalsContact O-CG 3.26Å; M159-M163 WeakPolarHBondContact O-CG 3.13Å; M159-M163 PolarHBondContact O-N 3.3Å; K161-M163 VanDerWaalsContact C-N 3.33Å; K161-M163 PolarHBondContact O-N 2.96Å; M163-I165 PolarHBondContact O-N 2.86Å; M163-Y166 HydrophobicContact CE-CD2 3.73Å; M163-Y166 HydrophobicContact CE-CE2 3.65Å; M163-Y166 WeakPolarHBondContact O-CD2 3.32Å; M163-Y166 PolarHBondContact O-N 2.87Å; M163-Y166 HydrophobicContact SD-CD2 4.07Å; M163-Y166 HydrophobicContact SD-CE2 3.54Å; M163-Y166 VanDerWaalsContact SD-CE2 3.54Å
164	R	95.1	Very high	94.9	Very high	70 Å²	70	43.8 Å²	43.8	26%	0.264	22%	0.215	S	C	.	.	H	α-helix	trans	-58.4	-27.6	174.2	-62.6	168.6	-175.6	-177.2	-1.8	112.4	K161 F162 Y166 K167 Y168 L185 M494	K161-R164 VanDerWaalsContact O-CB 3.27Å; K161-R164 WeakPolarHBondContact O-CB 3.43Å; K161-R164 VanDerWaalsContact O-CD 3.24Å; K161-R164 WeakPolarHBondContact O-CD 3.36Å; K161-R164 WeakPolarHBondContact O-CG 3.43Å; K161-R164 PolarHBondContact O-N 3.31Å; F162-R164 PolarHBondContact O-N 2.82Å; R164-Y166 VanDerWaalsContact C-N 3.26Å; R164-Y166 PolarHBondContact O-N 3.05Å; R164-K167 WeakPolarHBondContact O-CB 3.44Å; R164-K167 PolarHBondContact O-N 3.44Å; R164-Y168 HydrophobicContact CB-CE1 4.21Å; R164-Y168 HydrophobicContact CB-CE2 4.03Å; R164-Y168 WeakPolarHBondContact O-CD1 3.12Å; R164-Y168 PolarHBondContact O-N 2.91Å; R164-L185 HydrophobicContact CB-CD2 3.86Å; R164-L185 PolarHBondContact NH1-O 3.15Å; R164-M494 VanDerWaalsContact CD-SD 3.56Å; R164-M494 HydrophobicContact CG-SD 3.92Å
165	I	96.5	Very high	95	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.1	-39.3	-178	-167.4	53.7	0	0	0	112.4	F162 M163 K167 Y168 Q169 F175 L181 L185 V468	F162-I165 HydrophobicContact CD1-CG2 4.37Å; F162-I165 HydrophobicContact CE1-CG2 4.11Å; F162-I165 HydrophobicContact CZ-CG2 4.47Å; F162-I165 WeakPolarHBondContact O-CB 3.45Å; F162-I165 WeakPolarHBondContact O-CG2 3.47Å; F162-I165 PolarHBondContact O-N 2.64Å; M163-I165 PolarHBondContact O-N 2.86Å; I165-K167 VanDerWaalsContact C-N 3.32Å; I165-K167 PolarHBondContact O-N 3.02Å; I165-Y168 PolarHBondContact O-N 2.87Å; I165-Q169 HydrophobicContact CD1-CG 4.15Å; I165-Q169 HydrophobicContact CG1-CG 4.31Å; I165-Q169 WeakPolarHBondContact O-CB 3.4Å; I165-Q169 WeakPolarHBondContact O-CG 3.48Å; I165-Q169 PolarHBondContact O-N 2.89Å; I165-F175 HydrophobicContact CD1-CD2 4.39Å; I165-F175 HydrophobicContact CD1-CE2 3.8Å; I165-L181 HydrophobicContact CD1-CD1 4.23Å; I165-L181 HydrophobicContact CD1-CG 4.18Å; I165-L185 HydrophobicContact CB-CD1 4.17Å; I165-L185 HydrophobicContact CB-CD2 3.68Å; I165-L185 HydrophobicContact CD1-CD2 4.23Å; I165-L185 HydrophobicContact CG1-CD2 4.48Å; I165-L185 VanDerWaalsContact N-CD2 3.31Å; I165-V468 HydrophobicContact CD1-CG1 4.32Å; I165-V468 HydrophobicContact CG1-CG1 3.64Å; I165-V468 HydrophobicContact CG2-CG2 4.32Å
166	Y	96.6	Very high	95.2	Very high	28 Å²	28	44.1 Å²	44.1	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-37.2	-180	-55.5	-68.8	0	0	0	111.4	L94 L96 H97 M163 R164 A170 E464	L94-Y166 PolarHBondContact O-OH 3.27Å; L96-Y166 HydrophobicContact CB-CD1 3.95Å; L96-Y166 HydrophobicContact CB-CD2 4.43Å; L96-Y166 HydrophobicContact CB-CE1 3.62Å; L96-Y166 HydrophobicContact CB-CE2 4.13Å; L96-Y166 HydrophobicContact CB-CG 4.33Å; L96-Y166 HydrophobicContact CD1-CD1 4.31Å; L96-Y166 HydrophobicContact CD1-CD2 3.64Å; L96-Y166 HydrophobicContact CD1-CE2 3.89Å; L96-Y166 HydrophobicContact CD1-CG 3.85Å; L96-Y166 HydrophobicContact CG-CD1 4.45Å; L96-Y166 HydrophobicContact CG-CD2 4.04Å; L96-Y166 HydrophobicContact CG-CE1 4.18Å; L96-Y166 HydrophobicContact CG-CE2 3.74Å; L96-Y166 HydrophobicContact CG-CG 4.36Å; L96-Y166 PolarHBondContact N-OH 3.02Å; L96-Y166 VanDerWaalsContact N-OH 3.13Å; H97-Y166 AromaticContact CD2-CE1 3.61Å; H97-Y166 AromaticContact NE2-CD1 3.79Å; H97-Y166 AromaticContact NE2-CE1 3.77Å; M163-Y166 HydrophobicContact CE-CD2 3.73Å; M163-Y166 HydrophobicContact CE-CE2 3.65Å; M163-Y166 WeakPolarHBondContact O-CD2 3.32Å; M163-Y166 PolarHBondContact O-N 2.87Å; M163-Y166 HydrophobicContact SD-CD2 4.07Å; M163-Y166 HydrophobicContact SD-CE2 3.54Å; M163-Y166 VanDerWaalsContact SD-CE2 3.54Å; R164-Y166 VanDerWaalsContact C-N 3.26Å; R164-Y166 PolarHBondContact O-N 3.05Å; Y166-A170 WeakPolarHBondContact O-CB 3.42Å; Y166-A170 PolarHBondContact O-N 2.97Å; Y166-E464 VanDerWaalsContact CE1-OE1 3.24Å; Y166-E464 WeakPolarHBondContact CE1-OE1 3.29Å; Y166-E464 WeakPolarHBondContact OH-CG 3.22Å; Y166-E464 PolarHBondContact OH-OE1 3.43Å
167	K	94.8	Very high	95.5	Very high	79 Å²	79	40.1 Å²	40.1	34%	0.343	21%	0.206	S	C	.	.	H	α-helix	trans	-64.4	-45.2	173.8	-164.1	-176.5	-162.9	-164.8	0	110.1	R164 I165 A170 H171 I497 L501	R164-K167 WeakPolarHBondContact O-CB 3.44Å; R164-K167 PolarHBondContact O-N 3.44Å; I165-K167 VanDerWaalsContact C-N 3.32Å; I165-K167 PolarHBondContact O-N 3.02Å; K167-A170 PolarHBondContact O-N 3.07Å; K167-H171 PolarHBondContact O-N 3.04Å; K167-H171 VanDerWaalsContact O-N 3.14Å; K167-H171 PolarHBondContact O-ND1 3.33Å; K167-I497 HydrophobicContact CD-CD1 4.41Å; K167-I497 HydrophobicContact CD-CG2 3.81Å; K167-I497 HydrophobicContact CG-CD1 4.48Å; K167-I497 HydrophobicContact CG-CG2 4.26Å; K167-L501 VanDerWaalsContact NZ-CD1 3.33Å
168	Y	96.3	Very high	95.6	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-48.9	-179.4	-61.1	-12.4	0	0	0	111.4	R164 I165 A170 H171 G172 Y173 F175 S184 L185 L493 M494 I497	R164-Y168 HydrophobicContact CB-CE1 4.21Å; R164-Y168 HydrophobicContact CB-CE2 4.03Å; R164-Y168 WeakPolarHBondContact O-CD1 3.12Å; R164-Y168 PolarHBondContact O-N 2.91Å; I165-Y168 PolarHBondContact O-N 2.87Å; Y168-A170 VanDerWaalsContact C-N 3.31Å; Y168-A170 PolarHBondContact O-N 3.35Å; Y168-H171 CarbonylContact O-C 3.52Å; Y168-H171 PolarHBondContact O-N 3.21Å; Y168-H171 VanDerWaalsContact O-N 3.13Å; Y168-G172 PolarHBondContact O-N 3.11Å; Y168-Y173 PolarHBondContact O-N 3.23Å; Y168-F175 HydrophobicContact CD2-CE2 4.4Å; Y168-F175 AromaticContact CD2-CZ 3.86Å; Y168-F175 HydrophobicContact CD2-CZ 3.86Å; Y168-S184 PolarHBondContact OH-O 2.84Å; Y168-L185 HydrophobicContact CD2-CD2 3.91Å; Y168-L185 HydrophobicContact CE2-CD2 3.75Å; Y168-L493 HydrophobicContact CD1-CB 4.22Å; Y168-L493 HydrophobicContact CD1-CD1 4.29Å; Y168-L493 HydrophobicContact CD2-CD1 3.88Å; Y168-L493 HydrophobicContact CE1-CB 3.78Å; Y168-L493 HydrophobicContact CE1-CD1 4.47Å; Y168-L493 HydrophobicContact CE2-CB 4.37Å; Y168-L493 HydrophobicContact CE2-CD1 4.05Å; Y168-L493 HydrophobicContact CG-CD1 4Å; Y168-M494 HydrophobicContact CE1-SD 4.13Å; Y168-M494 WeakPolarHBondContact OH-CG 3.48Å; Y168-M494 PolarHBondContact OH-SD 3.29Å; Y168-I497 HydrophobicContact CD1-CD1 3.4Å; Y168-I497 HydrophobicContact CE1-CD1 3.61Å
169	Q	96.6	Very high	95.6	Very high	7 Å²	7	37.6 Å²	37.6	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-31.6	178.7	-69.5	-177.6	-26.8	0	0	113	H97 I165 H171 G172 V468 K471 L475	H97-Q169 PolarHBondContact CE1-OE1 3.19Å; H97-Q169 PolarHBondContact NE2-OE1 3.49Å; I165-Q169 HydrophobicContact CD1-CG 4.15Å; I165-Q169 HydrophobicContact CG1-CG 4.31Å; I165-Q169 WeakPolarHBondContact O-CB 3.4Å; I165-Q169 WeakPolarHBondContact O-CG 3.48Å; I165-Q169 PolarHBondContact O-N 2.89Å; Q169-H171 VanDerWaalsContact C-N 3.32Å; Q169-G172 PolarHBondContact O-N 3.28Å; Q169-V468 PolarHBondContact NE2-O 2.95Å; Q169-K471 HydrophobicContact CB-CG 3.95Å; Q169-K471 HydrophobicContact CG-CG 4.05Å; Q169-L475 HydrophobicContact CB-CD1 4.08Å; Q169-L475 HydrophobicContact CG-CD1 4.15Å
170	A	95.4	Very high	95.9	Very high	83 Å²	83	38.5 Å²	38.5	69%	0.686	20%	0.198	S	C	*	.	H	α-helix	trans	-68.2	-30.9	174.2	0	0	0	0	0	112.8	Y166 K167 Y168 G172	Y166-A170 WeakPolarHBondContact O-CB 3.42Å; Y166-A170 PolarHBondContact O-N 2.97Å; K167-A170 PolarHBondContact O-N 3.07Å; Y168-A170 VanDerWaalsContact C-N 3.31Å; Y168-A170 PolarHBondContact O-N 3.35Å; A170-G172 VanDerWaalsContact C-N 3.26Å
171	H	94.6	Very high	96.1	Very high	72 Å²	72	32 Å²	32	33%	0.333	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5	173.7	-65.9	71.1	0	0	0	112.4	K167 Y168 Q169 Y173 M487	K167-H171 PolarHBondContact O-N 3.04Å; K167-H171 VanDerWaalsContact O-N 3.14Å; K167-H171 PolarHBondContact O-ND1 3.33Å; Y168-H171 CarbonylContact O-C 3.52Å; Y168-H171 PolarHBondContact O-N 3.21Å; Y168-H171 VanDerWaalsContact O-N 3.13Å; Q169-H171 VanDerWaalsContact C-N 3.32Å; H171-Y173 HydrophobicContact CB-CD2 3.8Å; H171-Y173 HydrophobicContact CB-CE2 3.62Å; H171-M487 WeakPolarHBondContact O-CE 3.33Å
172	G	95.8	Very high	96.2	Very high	12 Å²	12	29.5 Å²	29.5	12%	0.124	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	3.2	177.7	0	0	0	0	0	115.2	Y168 Q169 A170 H479	Y168-G172 PolarHBondContact O-N 3.11Å; Q169-G172 PolarHBondContact O-N 3.28Å; A170-G172 VanDerWaalsContact C-N 3.26Å; G172-H479 PolarHBondContact O-CD2 3.22Å; G172-H479 PolarHBondContact O-NE2 3.29Å
173	Y	97.3	Very high	96.2	Very high	15 Å²	15	32 Å²	32	6%	0.059	17%	0.169	C	C	.	.			trans	-69.4	139	-179.7	-60.8	-66.6	0	0	0	112.4	Y168 H171 L475 M487 Q490 L493 I497	Y168-Y173 PolarHBondContact O-N 3.23Å; H171-Y173 HydrophobicContact CB-CD2 3.8Å; H171-Y173 HydrophobicContact CB-CE2 3.62Å; Y173-L475 WeakPolarHBondContact O-CD1 3.33Å; Y173-M487 WeakPolarHBondContact CA-O 3.45Å; Y173-M487 HydrophobicContact CD1-CE 3.88Å; Y173-M487 HydrophobicContact CE1-CE 3.86Å; Y173-M487 HydrophobicContact CE1-SD 4.23Å; Y173-M487 HydrophobicContact CG-CE 4.48Å; Y173-Q490 HydrophobicContact CD1-CB 4.03Å; Y173-Q490 HydrophobicContact CD1-CG 4.39Å; Y173-Q490 HydrophobicContact CE1-CB 4.18Å; Y173-Q490 HydrophobicContact CE1-CG 4.03Å; Y173-L493 HydrophobicContact CD1-CD2 3.54Å; Y173-L493 HydrophobicContact CD2-CD1 4.43Å; Y173-L493 HydrophobicContact CD2-CD2 3.53Å; Y173-L493 HydrophobicContact CE1-CD2 3.51Å; Y173-L493 HydrophobicContact CE2-CD2 3.48Å; Y173-L493 VanDerWaalsContact CE2-CD2 3.48Å; Y173-L493 HydrophobicContact CG-CD1 4.23Å; Y173-L493 HydrophobicContact CG-CD2 3.54Å; Y173-L493 VanDerWaalsContact CZ-CD2 3.46Å; Y173-I497 HydrophobicContact CD2-CD1 4.3Å; Y173-I497 HydrophobicContact CE2-CD1 3.9Å; Y173-I497 HydrophobicContact CE2-CG1 3.99Å
174	A	97.4	Very high	96.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-130.7	159.6	179	0	0	0	0	0	112.1	L475 L476 M487 V488 D489	A174-L475 HydrophobicContact CB-CB 3.76Å; A174-L476 HydrophobicContact CB-CB 4.05Å; A174-L476 HydrophobicContact CB-CD1 4.44Å; A174-M487 PolarHBondContact N-O 2.69Å; A174-V488 WeakPolarHBondContact O-CA 3.47Å; A174-D489 PolarHBondContact O-N 2.94Å
175	F	97.8	Very high	96.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.			trans	-127	134.2	-175.4	-53.8	-76.9	0	0	0	110.8	I165 Y168 E180 L181 S184 N472 D489 L493	I165-F175 HydrophobicContact CD1-CD2 4.39Å; I165-F175 HydrophobicContact CD1-CE2 3.8Å; Y168-F175 HydrophobicContact CD2-CE2 4.4Å; Y168-F175 AromaticContact CD2-CZ 3.86Å; Y168-F175 HydrophobicContact CD2-CZ 3.86Å; F175-E180 HydrophobicContact CD1-CG 4.17Å; F175-L181 HydrophobicContact CB-CB 3.83Å; F175-L181 HydrophobicContact CD2-CB 3.91Å; F175-L181 HydrophobicContact CD2-CD1 4.04Å; F175-L181 HydrophobicContact CD2-CG 3.85Å; F175-L181 HydrophobicContact CE2-CG 4.38Å; F175-L181 HydrophobicContact CG-CB 3.83Å; F175-L181 HydrophobicContact CG-CG 4.31Å; F175-S184 WeakPolarHBondContact CE1-OG 3.16Å; F175-S184 WeakPolarHBondContact CZ-OG 3.49Å; F175-N472 WeakPolarHBondContact CD2-OD1 3.32Å; F175-N472 PolarHBondContact N-OD1 3.21Å; F175-N472 PolarHBondContact O-ND2 2.99Å; F175-D489 VanDerWaalsContact CA-OD1 3.26Å; F175-D489 WeakPolarHBondContact CA-OD1 3.32Å; F175-L493 HydrophobicContact CE1-CD1 3.98Å; F175-L493 HydrophobicContact CZ-CD1 3.82Å
176	S	96.6	Very high	96.2	Very high	32 Å²	32	27.8 Å²	27.8	22%	0.224	16%	0.157	C	C	.	.	S	Bend	trans	-82.3	-14.7	-178	69.2	0	0	0	0	114.2	D489	S176-D489 WeakPolarHBondContact CB-OD2 3.27Å; S176-D489 PolarHBondContact N-OD1 2.86Å; S176-D489 VanDerWaalsContact OG-CG 3.3Å; S176-D489 PolarHBondContact OG-OD1 2.65Å; S176-D489 PolarHBondContact OG-OD2 2.67Å
177	S	97.1	Very high	96.1	Very high	29 Å²	29	27.6 Å²	27.6	20%	0.203	16%	0.164	C	C	.	.	S	Bend	trans	-140.4	163	176.3	70.5	0	0	0	0	111.7	E179 E180 L181	S177-E179 VanDerWaalsContact C-N 3.29Å; S177-E180 WeakPolarHBondContact OG-CB 3.39Å; S177-E180 PolarHBondContact OG-N 2.86Å; S177-L181 PolarHBondContact O-N 3.48Å
178	V	96.7	Very high	96	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-69.6	-35	174.2	-176.4	0	0	0	0	110	L181 L182 L441 V444 I456 A459	V178-L181 WeakPolarHBondContact O-CB 3.27Å; V178-L181 PolarHBondContact O-N 2.89Å; V178-L182 HydrophobicContact CG1-CD1 4.17Å; V178-L182 HydrophobicContact CG1-CG 4.24Å; V178-L182 WeakPolarHBondContact O-CB 3.36Å; V178-L182 WeakPolarHBondContact O-CG 3.45Å; V178-L182 PolarHBondContact O-N 3.47Å; V178-L441 HydrophobicContact CB-CB 4.29Å; V178-L441 HydrophobicContact CB-CD1 3.95Å; V178-L441 HydrophobicContact CG1-CD1 3.71Å; V178-V444 HydrophobicContact CG2-CG2 3.76Å; V178-I456 HydrophobicContact CG1-CD1 3.68Å; V178-I456 HydrophobicContact CG2-CD1 4.27Å; V178-A459 HydrophobicContact CG1-CB 3.73Å
179	E	96.2	Very high	95.9	Very high	55 Å²	55	29.2 Å²	29.2	26%	0.257	19%	0.191	S	C	.	.	H	α-helix	trans	-59.9	-48.5	175.6	-67.7	84.2	168	0	0	111.5	S177 L181 L182 H183 L191 L441	S177-E179 VanDerWaalsContact C-N 3.29Å; E179-L181 VanDerWaalsContact C-N 3.31Å; E179-L181 PolarHBondContact O-N 2.94Å; E179-L182 PolarHBondContact O-N 3.3Å; E179-H183 WeakPolarHBondContact O-CB 3.48Å; E179-H183 PolarHBondContact O-N 3.36Å; E179-L191 HydrophobicContact CB-CD2 3.95Å; E179-L191 HydrophobicContact CG-CD2 4.23Å; E179-L441 HydrophobicContact CG-CD1 4.1Å; E179-L441 WeakPolarHBondContact OE1-CB 3.48Å
180	E	96.4	Very high	95.9	Very high	48 Å²	48	29 Å²	29	22%	0.224	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-38	179.9	-165.8	58.9	-139.2	0	0	110.9	F175 S177 H183 S184 D489	F175-E180 HydrophobicContact CD1-CG 4.17Å; S177-E180 WeakPolarHBondContact OG-CB 3.39Å; S177-E180 PolarHBondContact OG-N 2.86Å; E180-H183 PolarHBondContact O-N 3.45Å; E180-H183 IonicContact OE1-ND1 3.29Å; E180-S184 WeakPolarHBondContact O-CB 3.45Å; E180-S184 PolarHBondContact O-N 3.3Å; E180-D489 HydrophobicContact CG-CB 4.03Å; E180-D489 WeakPolarHBondContact CG-OD1 3.44Å
181	L	97.1	Very high	95.9	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-57.3	-54.5	171.7	-175.3	156	0	0	0	110.7	I165 F175 S177 V178 E179 H183 S184 L185 V468	I165-L181 HydrophobicContact CD1-CD1 4.23Å; I165-L181 HydrophobicContact CD1-CG 4.18Å; F175-L181 HydrophobicContact CB-CB 3.83Å; F175-L181 HydrophobicContact CD2-CB 3.91Å; F175-L181 HydrophobicContact CD2-CD1 4.04Å; F175-L181 HydrophobicContact CD2-CG 3.85Å; F175-L181 HydrophobicContact CE2-CG 4.38Å; F175-L181 HydrophobicContact CG-CB 3.83Å; F175-L181 HydrophobicContact CG-CG 4.31Å; S177-L181 PolarHBondContact O-N 3.48Å; V178-L181 WeakPolarHBondContact O-CB 3.27Å; V178-L181 PolarHBondContact O-N 2.89Å; E179-L181 VanDerWaalsContact C-N 3.31Å; E179-L181 PolarHBondContact O-N 2.94Å; L181-H183 VanDerWaalsContact C-N 3.34Å; L181-H183 PolarHBondContact O-N 3.34Å; L181-S184 PolarHBondContact O-N 2.97Å; L181-S184 PolarHBondContact O-OG 3.03Å; L181-L185 HydrophobicContact CD2-CD1 3.6Å; L181-L185 HydrophobicContact CD2-CG 4.45Å; L181-L185 WeakPolarHBondContact O-CG 3.5Å; L181-L185 PolarHBondContact O-N 3.44Å; L181-V468 HydrophobicContact CD1-CG1 4.23Å
182	L	96.7	Very high	95.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-41	-178.6	-70.7	-179.7	0	0	0	112.2	V178 E179 S184 L185 G186 F190 L191 T194 F233 L441 A459	V178-L182 HydrophobicContact CG1-CD1 4.17Å; V178-L182 HydrophobicContact CG1-CG 4.24Å; V178-L182 WeakPolarHBondContact O-CB 3.36Å; V178-L182 WeakPolarHBondContact O-CG 3.45Å; V178-L182 PolarHBondContact O-N 3.47Å; E179-L182 PolarHBondContact O-N 3.3Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 3.02Å; L182-L185 PolarHBondContact O-N 2.97Å; L182-G186 PolarHBondContact O-N 3.33Å; L182-F190 HydrophobicContact CB-CB 4.12Å; L182-F190 HydrophobicContact CD2-CD2 4.26Å; L182-F190 WeakPolarHBondContact O-CD2 3.26Å; L182-L191 HydrophobicContact CB-CD2 4.16Å; L182-T194 HydrophobicContact CD1-CG2 3.67Å; L182-F233 HydrophobicContact CD2-CD1 4.41Å; L182-F233 HydrophobicContact CD2-CE1 3.74Å; L182-F233 HydrophobicContact CD2-CE2 4.05Å; L182-F233 HydrophobicContact CD2-CZ 3.52Å; L182-L441 HydrophobicContact CD1-CD1 3.95Å; L182-A459 HydrophobicContact CD1-CB 3.93Å
183	H	95.9	Very high	95.9	Very high	80 Å²	80	28 Å²	28	37%	0.37	17%	0.172	S	C	.	.	H	α-helix	trans	-61.8	-42	176.6	-176.7	-98.9	0	0	0	111.6	E179 E180 L181 L185 G187 L191	E179-H183 WeakPolarHBondContact O-CB 3.48Å; E179-H183 PolarHBondContact O-N 3.36Å; E180-H183 PolarHBondContact O-N 3.45Å; E180-H183 IonicContact OE1-ND1 3.29Å; L181-H183 VanDerWaalsContact C-N 3.34Å; L181-H183 PolarHBondContact O-N 3.34Å; H183-L185 VanDerWaalsContact C-N 3.26Å; H183-L185 PolarHBondContact O-N 2.84Å; H183-G187 WeakPolarHBondContact O-CA 3.35Å; H183-G187 PolarHBondContact O-N 3.36Å; H183-L191 HydrophobicContact CB-CD1 4.08Å; H183-L191 HydrophobicContact CB-CG 4.3Å
184	S	95.2	Very high	95.8	Very high	21 Å²	21	28 Å²	28	15%	0.147	17%	0.174	C	C	.	.	H	α-helix	trans	-62.9	-32.5	177.3	79.4	0	0	0	0	112.9	Y168 F175 E180 L181 L182	Y168-S184 PolarHBondContact OH-O 2.84Å; F175-S184 WeakPolarHBondContact CE1-OG 3.16Å; F175-S184 WeakPolarHBondContact CZ-OG 3.49Å; E180-S184 WeakPolarHBondContact O-CB 3.45Å; E180-S184 PolarHBondContact O-N 3.3Å; L181-S184 PolarHBondContact O-N 2.97Å; L181-S184 PolarHBondContact O-OG 3.03Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 3.02Å
185	L	94.9	Very high	95.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-81.2	-48.8	-177.1	-62.8	175.5	0	0	0	112.2	F162 R164 I165 Y168 L181 L182 H183 F190	F162-L185 HydrophobicContact CD2-CD1 3.94Å; F162-L185 HydrophobicContact CE2-CD1 4.2Å; R164-L185 HydrophobicContact CB-CD2 3.86Å; R164-L185 PolarHBondContact NH1-O 3.15Å; I165-L185 HydrophobicContact CB-CD1 4.17Å; I165-L185 HydrophobicContact CB-CD2 3.68Å; I165-L185 HydrophobicContact CD1-CD2 4.23Å; I165-L185 HydrophobicContact CG1-CD2 4.48Å; I165-L185 VanDerWaalsContact N-CD2 3.31Å; Y168-L185 HydrophobicContact CD2-CD2 3.91Å; Y168-L185 HydrophobicContact CE2-CD2 3.75Å; L181-L185 HydrophobicContact CD2-CD1 3.6Å; L181-L185 HydrophobicContact CD2-CG 4.45Å; L181-L185 WeakPolarHBondContact O-CG 3.5Å; L181-L185 PolarHBondContact O-N 3.44Å; L182-L185 PolarHBondContact O-N 2.97Å; H183-L185 VanDerWaalsContact C-N 3.26Å; H183-L185 PolarHBondContact O-N 2.84Å; L185-F190 HydrophobicContact CB-CD2 3.93Å; L185-F190 HydrophobicContact CB-CE2 3.7Å
186	G	94.1	Very high	95.4	Very high	14 Å²	14	37.5 Å²	37.5	14%	0.144	22%	0.216	C	C	.	.	H	α-helix	trans	-129.4	7.3	-168.9	0	0	0	0	0	115.5	L182	L182-G186 PolarHBondContact O-N 3.33Å
187	G	94.1	Very high	95.4	Very high	25 Å²	25	36.6 Å²	36.6	26%	0.258	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	-155.1	-177.2	0	0	0	0	0	112.9	H183 G189 F190	H183-G187 WeakPolarHBondContact O-CA 3.35Å; H183-G187 PolarHBondContact O-N 3.36Å; G187-G189 PolarHBondContact O-N 3.49Å; G187-G189 VanDerWaalsContact O-N 3.14Å; G187-F190 PolarHBondContact O-N 2.91Å
188	S	93.8	Very high	95.4	Very high	78 Å²	78	35.2 Å²	35.2	55%	0.545	20%	0.2	S	C	.	.	H	α-helix	trans	-59.1	-22.1	173.8	56.3	0	0	0	0	113.4	L191 N192	S188-L191 PolarHBondContact O-N 3.43Å; S188-N192 WeakPolarHBondContact O-CB 3.45Å; S188-N192 VanDerWaalsContact O-CG 3.25Å; S188-N192 PolarHBondContact O-N 3.11Å; S188-N192 PolarHBondContact O-OD1 3.08Å
189	G	94.9	Very high	95.3	Very high	35 Å²	35	36 Å²	36	36%	0.361	21%	0.205	S	C	.	.	H	α-helix	trans	-59.1	-49.1	176.6	0	0	0	0	0	112.5	G187 L191 N192 M193	G187-G189 PolarHBondContact O-N 3.49Å; G187-G189 VanDerWaalsContact O-N 3.14Å; G189-L191 PolarHBondContact O-N 2.73Å; G189-N192 PolarHBondContact O-N 3.08Å; G189-M193 VanDerWaalsContact O-CG 3.25Å; G189-M193 WeakPolarHBondContact O-CG 3.33Å; G189-M193 PolarHBondContact O-N 3.17Å
190	F	96.1	Very high	95.3	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-66.3	-38.1	177.8	-80.3	9.9	0	0	0	112.1	I158 K161 L182 L185 G187 M193 T194 F233	I158-F190 HydrophobicContact CB-CE1 4.36Å; I158-F190 HydrophobicContact CG1-CE1 4.24Å; I158-F190 HydrophobicContact CG2-CE1 3.97Å; I158-F190 HydrophobicContact CG2-CZ 3.94Å; K161-F190 HydrophobicContact CB-CE1 4.14Å; K161-F190 HydrophobicContact CB-CE2 4.26Å; K161-F190 HydrophobicContact CB-CZ 3.54Å; K161-F190 HydrophobicContact CD-CE1 4.07Å; K161-F190 HydrophobicContact CD-CZ 4.33Å; L182-F190 HydrophobicContact CB-CB 4.12Å; L182-F190 HydrophobicContact CD2-CD2 4.26Å; L182-F190 WeakPolarHBondContact O-CD2 3.26Å; L185-F190 HydrophobicContact CB-CD2 3.93Å; L185-F190 HydrophobicContact CB-CE2 3.7Å; G187-F190 PolarHBondContact O-N 2.91Å; F190-M193 HydrophobicContact CD1-SD 4.24Å; F190-M193 WeakPolarHBondContact O-CB 3.37Å; F190-M193 PolarHBondContact O-N 3.12Å; F190-T194 PolarHBondContact O-N 3.33Å; F190-F233 HydrophobicContact CB-CD2 4.35Å; F190-F233 HydrophobicContact CB-CE2 4.28Å; F190-F233 HydrophobicContact CD1-CD2 4.19Å; F190-F233 AromaticContact CD1-CE2 3.93Å; F190-F233 HydrophobicContact CD1-CE2 3.93Å; F190-F233 HydrophobicContact CD2-CD2 4.35Å; F190-F233 AromaticContact CD2-CE2 3.5Å; F190-F233 HydrophobicContact CD2-CE2 3.5Å; F190-F233 HydrophobicContact CD2-CZ 4.16Å; F190-F233 HydrophobicContact CE1-CE2 4.05Å; F190-F233 AromaticContact CE2-CE2 3.64Å; F190-F233 HydrophobicContact CE2-CE2 3.64Å; F190-F233 HydrophobicContact CE2-CZ 4.18Å; F190-F233 HydrophobicContact CG-CD2 4.06Å; F190-F233 AromaticContact CG-CE2 3.65Å; F190-F233 HydrophobicContact CG-CE2 3.65Å; F190-F233 AromaticContact CZ-CE2 3.9Å; F190-F233 HydrophobicContact CZ-CE2 3.9Å
191	L	94.6	Very high	95.3	Very high	34 Å²	34	36.7 Å²	36.7	18%	0.178	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-46.2	175.3	-65.1	-176.9	0	0	0	111.8	E179 L182 H183 S188 G189 M193 T194	E179-L191 HydrophobicContact CB-CD2 3.95Å; E179-L191 HydrophobicContact CG-CD2 4.23Å; L182-L191 HydrophobicContact CB-CD2 4.16Å; H183-L191 HydrophobicContact CB-CD1 4.08Å; H183-L191 HydrophobicContact CB-CG 4.3Å; S188-L191 PolarHBondContact O-N 3.43Å; G189-L191 PolarHBondContact O-N 2.73Å; L191-M193 PolarHBondContact O-N 3.32Å; L191-T194 PolarHBondContact O-N 2.82Å; L191-T194 PolarHBondContact O-OG1 2.83Å
192	N	94.9	Very high	95.3	Very high	90 Å²	90	36.5 Å²	36.5	48%	0.481	21%	0.21	S	C	.	.	H	α-helix	trans	-60.4	-36.9	177.3	-73.3	-4.1	0	0	0	111.6	S188 G189 T194 R195 C196	S188-N192 WeakPolarHBondContact O-CB 3.45Å; S188-N192 VanDerWaalsContact O-CG 3.25Å; S188-N192 PolarHBondContact O-N 3.11Å; S188-N192 PolarHBondContact O-OD1 3.08Å; G189-N192 PolarHBondContact O-N 3.08Å; N192-T194 PolarHBondContact O-N 2.82Å; N192-R195 CarbonylContact O-C 3.56Å; N192-R195 WeakPolarHBondContact O-CA 3.41Å; N192-R195 PolarHBondContact O-N 2.75Å; N192-C196 PolarHBondContact O-N 3.09Å
193	M	95.6	Very high	95.3	Very high	21 Å²	21	40 Å²	40	10%	0.103	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-18.4	175.7	-72.4	177	65.3	0	0	114.4	W154 I158 G189 F190 L191 R195 A232 F233 A236	W154-M193 HydrophobicContact CH2-CE 4.05Å; W154-M193 HydrophobicContact CZ2-CE 3.42Å; W154-M193 VanDerWaalsContact CZ2-CE 3.42Å; I158-M193 HydrophobicContact CD1-CE 3.39Å; I158-M193 HydrophobicContact CD1-SD 4.15Å; I158-M193 HydrophobicContact CG1-CE 4.13Å; I158-M193 HydrophobicContact CG1-SD 4.36Å; G189-M193 VanDerWaalsContact O-CG 3.25Å; G189-M193 WeakPolarHBondContact O-CG 3.33Å; G189-M193 PolarHBondContact O-N 3.17Å; F190-M193 HydrophobicContact CD1-SD 4.24Å; F190-M193 WeakPolarHBondContact O-CB 3.37Å; F190-M193 PolarHBondContact O-N 3.12Å; L191-M193 PolarHBondContact O-N 3.32Å; M193-R195 VanDerWaalsContact C-N 3.29Å; M193-A232 HydrophobicContact CB-CB 4.09Å; M193-A232 HydrophobicContact CE-CB 4.19Å; M193-A232 HydrophobicContact CG-CB 4.23Å; M193-A232 PolarHBondContact O-N 3.2Å; M193-F233 HydrophobicContact CB-CB 3.89Å; M193-F233 HydrophobicContact CE-CB 4.31Å; M193-F233 HydrophobicContact CE-CD2 4.2Å; M193-F233 PolarHBondContact O-N 3.33Å; M193-A236 HydrophobicContact CE-CB 4.24Å
194	T	94.9	Very high	95.3	Very high	15 Å²	15	44 Å²	44	9%	0.092	25%	0.247	C	C	.	.	H	α-helix	trans	-79.9	-15.4	170.1	67.3	0	0	0	0	112.6	L182 F190 L191 N192 F233 L441	L182-T194 HydrophobicContact CD1-CG2 3.67Å; F190-T194 PolarHBondContact O-N 3.33Å; L191-T194 PolarHBondContact O-N 2.82Å; L191-T194 PolarHBondContact O-OG1 2.83Å; N192-T194 PolarHBondContact O-N 2.82Å; T194-F233 HydrophobicContact CG2-CB 4.26Å; T194-L441 HydrophobicContact CG2-CD1 4.39Å
195	R	93.7	Very high	95.3	Very high	152 Å²	152	46.4 Å²	46.4	57%	0.574	26%	0.258	S	S	*	.	H	α-helix	trans	-111.8	-8.3	-173	-61.9	178.3	178.3	-174.2	-3.1	114.5	N192 M193 S437	N192-R195 CarbonylContact O-C 3.56Å; N192-R195 WeakPolarHBondContact O-CA 3.41Å; N192-R195 PolarHBondContact O-N 2.75Å; M193-R195 VanDerWaalsContact C-N 3.29Å; R195-S437 CarbonylContact C-O 3.18Å; R195-S437 WeakPolarHBondContact CA-O 3.43Å; R195-S437 WeakPolarHBondContact O-CB 3.3Å
196	C	93.9	Very high	95.3	Very high	47 Å²	47	47.9 Å²	47.9	32%	0.318	27%	0.272	S	S	.	.	S	Bend	trans	-115.2	146.4	174.9	-60.7	0	0	0	0	109.8	N192 P231 A232	N192-C196 PolarHBondContact O-N 3.09Å; C196-P231 WeakPolarHBondContact O-CA 3.22Å; C196-A232 PolarHBondContact O-N 3.49Å
197	S	96	Very high	95.4	Very high	13 Å²	13	47.3 Å²	47.3	9%	0.091	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-69.3	153.9	176.1	69.6	0	0	0	0	111.6	S199 E200 S201 I230 S437	S197-S199 VanDerWaalsContact C-N 3.26Å; S197-S199 PolarHBondContact O-N 2.77Å; S197-E200 WeakPolarHBondContact CB-OE2 3.45Å; S197-E200 PolarHBondContact N-OE2 3.23Å; S197-E200 PolarHBondContact O-N 2.91Å; S197-E200 WeakPolarHBondContact OG-CB 3.34Å; S197-E200 WeakPolarHBondContact OG-CG 3.37Å; S197-E200 PolarHBondContact OG-N 3.15Å; S197-E200 PolarHBondContact OG-OE2 3.1Å; S197-S201 PolarHBondContact O-N 3.23Å; S197-S201 VanDerWaalsContact O-N 3.09Å; S197-S201 PolarHBondContact O-OG 3.37Å; S197-I230 CarbonylContact C-O 3.5Å; S197-I230 WeakPolarHBondContact CA-O 3.5Å; S197-S437 PolarHBondContact N-OG 3.32Å
198	L	96.8	Very high	95.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.3	-42.3	174.1	177.2	64.1	0	0	0	111	W154 S201 L202 I216 M220 I230 L239	W154-L198 HydrophobicContact CH2-CD1 3.61Å; W154-L198 HydrophobicContact CZ3-CD1 4.01Å; L198-S201 PolarHBondContact O-N 3.17Å; L198-L202 HydrophobicContact CD1-CD1 3.64Å; L198-L202 HydrophobicContact CD1-CD2 4.42Å; L198-L202 HydrophobicContact CD1-CG 3.86Å; L198-L202 HydrophobicContact CD2-CD1 4.38Å; L198-L202 HydrophobicContact CG-CD1 3.68Å; L198-L202 HydrophobicContact CG-CG 4.28Å; L198-L202 WeakPolarHBondContact O-CB 3.49Å; L198-L202 WeakPolarHBondContact O-CG 3.47Å; L198-L202 PolarHBondContact O-N 3.2Å; L198-I216 HydrophobicContact CD2-CG2 3.78Å; L198-M220 HydrophobicContact CD2-CE 4.3Å; L198-M220 HydrophobicContact CD2-CG 3.95Å; L198-M220 HydrophobicContact CD2-SD 3.66Å; L198-I230 HydrophobicContact CB-CG1 4.29Å; L198-I230 HydrophobicContact CD2-CG1 4.48Å; L198-I230 PolarHBondContact N-O 3.4Å; L198-L239 HydrophobicContact CD1-CD1 4.43Å
199	S	96.3	Very high	95.6	Very high	19 Å²	19	48 Å²	48	13%	0.133	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-50	177.9	-168.2	0	0	0	0	112.1	S197 L202 L203 I228	S197-S199 VanDerWaalsContact C-N 3.26Å; S197-S199 PolarHBondContact O-N 2.77Å; S199-L202 PolarHBondContact O-N 3.28Å; S199-L203 WeakPolarHBondContact O-CB 3.4Å; S199-L203 VanDerWaalsContact O-CG 3.24Å; S199-L203 WeakPolarHBondContact O-CG 3.39Å; S199-L203 PolarHBondContact O-N 3Å; S199-I228 PolarHBondContact N-O 2.79Å; S199-I228 WeakPolarHBondContact OG-CD1 3.48Å
200	E	96	Very high	95.6	Very high	104 Å²	104	52 Å²	52	49%	0.486	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-49.1	-179.9	-71.5	158.8	152.8	0	0	111	S197 L202 L203 E204	S197-E200 WeakPolarHBondContact CB-OE2 3.45Å; S197-E200 PolarHBondContact N-OE2 3.23Å; S197-E200 PolarHBondContact O-N 2.91Å; S197-E200 WeakPolarHBondContact OG-CB 3.34Å; S197-E200 WeakPolarHBondContact OG-CG 3.37Å; S197-E200 PolarHBondContact OG-N 3.15Å; S197-E200 PolarHBondContact OG-OE2 3.1Å; E200-L202 VanDerWaalsContact C-N 3.31Å; E200-L202 PolarHBondContact O-N 2.98Å; E200-L203 PolarHBondContact O-N 3.25Å; E200-E204 WeakPolarHBondContact O-CG 3.46Å; E200-E204 PolarHBondContact O-N 2.8Å
201	S	96.1	Very high	95.5	Very high	15 Å²	15	51.8 Å²	51.8	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-39.1	179.6	-64.2	0	0	0	0	112.8	S197 L198 L205 A232	S197-S201 PolarHBondContact O-N 3.23Å; S197-S201 VanDerWaalsContact O-N 3.09Å; S197-S201 PolarHBondContact O-OG 3.37Å; L198-S201 PolarHBondContact O-N 3.17Å; S201-L205 WeakPolarHBondContact O-CD1 3.36Å; S201-L205 VanDerWaalsContact O-CG 3.24Å; S201-L205 WeakPolarHBondContact O-CG 3.39Å; S201-L205 PolarHBondContact O-N 3.22Å; S201-A232 VanDerWaalsContact OG-CB 3.3Å; S201-A232 WeakPolarHBondContact OG-CB 3.48Å
202	L	96.8	Very high	95.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.5	-38.8	179	-69.3	174.2	0	0	0	112.4	L151 W154 L198 S199 E200 E204 L205 G206 V207 I212 I216	L151-L202 HydrophobicContact CD1-CD2 3.85Å; W154-L202 HydrophobicContact CD2-CD2 4.39Å; W154-L202 HydrophobicContact CE3-CD2 3.99Å; W154-L202 HydrophobicContact CH2-CD2 4.46Å; W154-L202 HydrophobicContact CZ3-CD2 4.05Å; L198-L202 HydrophobicContact CD1-CD1 3.64Å; L198-L202 HydrophobicContact CD1-CD2 4.42Å; L198-L202 HydrophobicContact CD1-CG 3.86Å; L198-L202 HydrophobicContact CD2-CD1 4.38Å; L198-L202 HydrophobicContact CG-CD1 3.68Å; L198-L202 HydrophobicContact CG-CG 4.28Å; L198-L202 WeakPolarHBondContact O-CB 3.49Å; L198-L202 WeakPolarHBondContact O-CG 3.47Å; L198-L202 PolarHBondContact O-N 3.2Å; S199-L202 PolarHBondContact O-N 3.28Å; E200-L202 VanDerWaalsContact C-N 3.31Å; E200-L202 PolarHBondContact O-N 2.98Å; L202-E204 VanDerWaalsContact C-N 3.33Å; L202-L205 HydrophobicContact CD2-CD1 4.39Å; L202-L205 WeakPolarHBondContact O-CB 3.38Å; L202-L205 PolarHBondContact O-N 3.14Å; L202-G206 PolarHBondContact O-N 3.26Å; L202-V207 HydrophobicContact CB-CB 4.01Å; L202-V207 HydrophobicContact CB-CG1 4.46Å; L202-V207 HydrophobicContact CB-CG2 4.24Å; L202-V207 HydrophobicContact CD2-CG2 4.13Å; L202-V207 WeakPolarHBondContact O-CB 3.29Å; L202-V207 WeakPolarHBondContact O-CG2 3.43Å; L202-V207 PolarHBondContact O-N 3.21Å; L202-I212 HydrophobicContact CB-CD1 3.81Å; L202-I212 HydrophobicContact CB-CG1 4.23Å; L202-I212 HydrophobicContact CD1-CG1 4.21Å; L202-I216 HydrophobicContact CD1-CD1 3.4Å; L202-I216 HydrophobicContact CD1-CG2 4.1Å
203	L	96.8	Very high	95.6	Very high	74 Å²	74	49 Å²	49	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-41.5	174.5	-72.7	169.6	0	0	0	111.3	S199 E200 L205 G206 Q209 I212	S199-L203 WeakPolarHBondContact O-CB 3.4Å; S199-L203 VanDerWaalsContact O-CG 3.24Å; S199-L203 WeakPolarHBondContact O-CG 3.39Å; S199-L203 PolarHBondContact O-N 3Å; E200-L203 PolarHBondContact O-N 3.25Å; L203-L205 VanDerWaalsContact C-N 3.28Å; L203-L205 PolarHBondContact O-N 2.76Å; L203-G206 WeakPolarHBondContact O-CA 3.13Å; L203-G206 PolarHBondContact O-N 3Å; L203-Q209 HydrophobicContact CD2-CB 4.4Å; L203-I212 HydrophobicContact CD2-CD1 3.86Å; L203-I212 HydrophobicContact CG-CD1 3.78Å
204	E	95.8	Very high	95.5	Very high	162 Å²	162	49.4 Å²	49.4	76%	0.757	25%	0.249	S	C	*	.	H	α-helix	trans	-61.4	-34.7	174.6	-74.7	177.8	176.5	0	0	112.6	E200 L202 G206	E200-E204 WeakPolarHBondContact O-CG 3.46Å; E200-E204 PolarHBondContact O-N 2.8Å; L202-E204 VanDerWaalsContact C-N 3.33Å; E204-G206 PolarHBondContact O-N 2.82Å
205	L	94.5	Very high	95.4	Very high	73 Å²	73	50.2 Å²	50.2	38%	0.382	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.5	172.6	-67.6	164.2	0	0	0	113.3	R150 W154 S201 L202 L203 V207	R150-L205 VanDerWaalsContact CD-O 3.32Å; R150-L205 WeakPolarHBondContact CD-O 3.37Å; W154-L205 HydrophobicContact CB-CD1 4.05Å; W154-L205 HydrophobicContact CD2-CD1 3.93Å; W154-L205 HydrophobicContact CG-CD1 3.47Å; W154-L205 VanDerWaalsContact CG-CD1 3.47Å; S201-L205 WeakPolarHBondContact O-CD1 3.36Å; S201-L205 VanDerWaalsContact O-CG 3.24Å; S201-L205 WeakPolarHBondContact O-CG 3.39Å; S201-L205 PolarHBondContact O-N 3.22Å; L202-L205 HydrophobicContact CD2-CD1 4.39Å; L202-L205 WeakPolarHBondContact O-CB 3.38Å; L202-L205 PolarHBondContact O-N 3.14Å; L203-L205 VanDerWaalsContact C-N 3.28Å; L203-L205 PolarHBondContact O-N 2.76Å; L205-V207 HydrophobicContact CB-CG2 4.41Å
206	G	95.1	Very high	95.4	Very high	30 Å²	30	43 Å²	43	31%	0.309	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	20	-177.2	0	0	0	0	0	113.7	R150 L202 L203 E204	R150-G206 PolarHBondContact NH1-O 2.91Å; L202-G206 PolarHBondContact O-N 3.26Å; L203-G206 WeakPolarHBondContact O-CA 3.13Å; L203-G206 PolarHBondContact O-N 3Å; E204-G206 PolarHBondContact O-N 2.82Å
207	V	96.2	Very high	95.5	Very high	3 Å²	3	41 Å²	41	2%	0.018	21%	0.213	C	C	.	.			trans	-70.5	128.1	168.6	-179	0	0	0	0	108.1	R150 L202 L205 F211 I212 I216	R150-V207 HydrophobicContact CB-CG2 4.13Å; L202-V207 HydrophobicContact CB-CB 4.01Å; L202-V207 HydrophobicContact CB-CG1 4.46Å; L202-V207 HydrophobicContact CB-CG2 4.24Å; L202-V207 HydrophobicContact CD2-CG2 4.13Å; L202-V207 WeakPolarHBondContact O-CB 3.29Å; L202-V207 WeakPolarHBondContact O-CG2 3.43Å; L202-V207 PolarHBondContact O-N 3.21Å; L205-V207 HydrophobicContact CB-CG2 4.41Å; V207-F211 HydrophobicContact CG1-CB 4.27Å; V207-F211 HydrophobicContact CG1-CD1 3.49Å; V207-F211 VanDerWaalsContact CG1-CD1 3.49Å; V207-F211 HydrophobicContact CG1-CE1 4.29Å; V207-F211 HydrophobicContact CG1-CG 4.32Å; V207-I212 HydrophobicContact CG1-CD1 4.44Å; V207-I212 HydrophobicContact CG1-CG1 3.87Å; V207-I216 HydrophobicContact CG1-CD1 4.29Å
208	S	96.3	Very high	95.5	Very high	42 Å²	42	40.3 Å²	40.3	29%	0.294	21%	0.209	S	C	.	.			trans	-66.6	144.3	-177.4	65.8	0	0	0	0	112.4	S147 R210 F211 I212	S147-S208 PolarHBondContact OG-N 3.16Å; S147-S208 PolarHBondContact OG-OG 2.78Å; S208-R210 PolarHBondContact O-N 3.12Å; S208-F211 PolarHBondContact O-N 3.13Å; S208-F211 WeakPolarHBondContact OG-CB 3.32Å; S208-F211 PolarHBondContact OG-N 2.98Å; S208-I212 PolarHBondContact O-N 2.8Å
209	Q	95.8	Very high	95.4	Very high	76 Å²	76	41.3 Å²	41.3	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-51.4	-42.9	174	-173.7	63.1	48.1	0	0	111.8	L203 F211 I212 D213	L203-Q209 HydrophobicContact CD2-CB 4.4Å; Q209-F211 VanDerWaalsContact C-N 3.32Å; Q209-F211 PolarHBondContact O-N 3.09Å; Q209-I212 WeakPolarHBondContact O-CA 3.15Å; Q209-I212 WeakPolarHBondContact O-CB 3.26Å; Q209-I212 PolarHBondContact O-N 3.11Å; Q209-D213 WeakPolarHBondContact CG-OD2 3.46Å; Q209-D213 PolarHBondContact NE2-OD1 2.78Å; Q209-D213 PolarHBondContact NE2-OD2 2.83Å; Q209-D213 VanDerWaalsContact O-CG 3.29Å; Q209-D213 PolarHBondContact O-N 3.36Å
210	R	94.9	Very high	95.4	Very high	117 Å²	117	40.4 Å²	40.4	44%	0.442	21%	0.208	S	C	.	.	H	α-helix	trans	-57.5	-42.5	177.4	-167.1	-169.3	-173	166.2	10.6	112.8	Y144 S208 I212 D213 E214	Y144-R210 HydrophobicContact CD1-CG 4.39Å; Y144-R210 HydrophobicContact CE1-CG 4.04Å; S208-R210 PolarHBondContact O-N 3.12Å; R210-I212 VanDerWaalsContact C-N 3.34Å; R210-D213 PolarHBondContact O-N 3.45Å; R210-E214 HydrophobicContact CG-CG 4.13Å; R210-E214 WeakPolarHBondContact CG-OE1 3.34Å; R210-E214 IonicContact CZ-OE1 3.81Å; R210-E214 IonicContact NE-OE1 2.93Å; R210-E214 PolarHBondContact NE-OE1 3.08Å; R210-E214 IonicContact NE-OE2 3.52Å; R210-E214 IonicContact NH2-OE1 3.81Å; R210-E214 VanDerWaalsContact O-CB 3.22Å; R210-E214 WeakPolarHBondContact O-CB 3.48Å; R210-E214 VanDerWaalsContact O-CG 3.26Å; R210-E214 WeakPolarHBondContact O-CG 3.48Å; R210-E214 PolarHBondContact O-N 2.93Å
211	F	95.1	Very high	95.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-35.9	177.1	-174.4	-104.1	0	0	0	111.5	Y144 F148 L151 V207 S208 Q209 V215 I216	Y144-F211 HydrophobicContact CD1-CB 3.79Å; Y144-F211 AromaticContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CD2 3.83Å; Y144-F211 HydrophobicContact CD1-CG 4.32Å; Y144-F211 AromaticContact CD2-CD2 3.64Å; Y144-F211 HydrophobicContact CD2-CD2 3.64Å; Y144-F211 HydrophobicContact CD2-CE2 4.13Å; Y144-F211 HydrophobicContact CE1-CB 4.47Å; Y144-F211 HydrophobicContact CE1-CD2 4.37Å; Y144-F211 HydrophobicContact CE2-CD2 4.21Å; Y144-F211 HydrophobicContact CG-CB 4.13Å; Y144-F211 AromaticContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CD2 3.43Å; Y144-F211 VanDerWaalsContact CG-CD2 3.43Å; Y144-F211 HydrophobicContact CG-CE2 4.3Å; Y144-F211 HydrophobicContact CG-CG 4.23Å; F148-F211 HydrophobicContact CB-CE2 4.13Å; F148-F211 HydrophobicContact CB-CZ 3.98Å; F148-F211 HydrophobicContact CD2-CE2 4.48Å; F148-F211 HydrophobicContact CD2-CZ 4.06Å; L151-F211 HydrophobicContact CB-CE1 4.05Å; L151-F211 HydrophobicContact CD2-CE1 3.65Å; L151-F211 HydrophobicContact CD2-CZ 3.99Å; L151-F211 HydrophobicContact CG-CE1 4.39Å; V207-F211 HydrophobicContact CG1-CB 4.27Å; V207-F211 HydrophobicContact CG1-CD1 3.49Å; V207-F211 VanDerWaalsContact CG1-CD1 3.49Å; V207-F211 HydrophobicContact CG1-CE1 4.29Å; V207-F211 HydrophobicContact CG1-CG 4.32Å; S208-F211 PolarHBondContact O-N 3.13Å; S208-F211 WeakPolarHBondContact OG-CB 3.32Å; S208-F211 PolarHBondContact OG-N 2.98Å; Q209-F211 VanDerWaalsContact C-N 3.32Å; Q209-F211 PolarHBondContact O-N 3.09Å; F211-V215 HydrophobicContact CD2-CB 3.97Å; F211-V215 HydrophobicContact CD2-CG2 3.58Å; F211-V215 HydrophobicContact CE2-CB 3.86Å; F211-V215 HydrophobicContact CE2-CG1 3.93Å; F211-V215 HydrophobicContact CE2-CG2 3.59Å; F211-V215 HydrophobicContact CG-CB 4.41Å; F211-V215 HydrophobicContact CG-CG2 4.39Å; F211-V215 HydrophobicContact CZ-CB 4.18Å; F211-V215 HydrophobicContact CZ-CG1 3.93Å; F211-V215 HydrophobicContact CZ-CG2 4.38Å; F211-V215 WeakPolarHBondContact O-CA 3.5Å; F211-V215 VanDerWaalsContact O-CB 3.29Å; F211-V215 WeakPolarHBondContact O-CB 3.46Å; F211-V215 PolarHBondContact O-N 3.08Å; F211-I216 HydrophobicContact CD1-CD1 3.87Å; F211-I216 HydrophobicContact CD1-CG1 4.22Å; F211-I216 HydrophobicContact CE1-CD1 3.92Å; F211-I216 HydrophobicContact CE1-CG1 4.15Å; F211-I216 PolarHBondContact O-N 2.91Å
212	I	96.1	Very high	95.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-60.3	-49.5	174.1	-63.7	171.2	0	0	0	110.1	L202 L203 V207 S208 Q209 R210 I216 A217 I228	L202-I212 HydrophobicContact CB-CD1 3.81Å; L202-I212 HydrophobicContact CB-CG1 4.23Å; L202-I212 HydrophobicContact CD1-CG1 4.21Å; L203-I212 HydrophobicContact CD2-CD1 3.86Å; L203-I212 HydrophobicContact CG-CD1 3.78Å; V207-I212 HydrophobicContact CG1-CD1 4.44Å; V207-I212 HydrophobicContact CG1-CG1 3.87Å; S208-I212 PolarHBondContact O-N 2.8Å; Q209-I212 WeakPolarHBondContact O-CA 3.15Å; Q209-I212 WeakPolarHBondContact O-CB 3.26Å; Q209-I212 PolarHBondContact O-N 3.11Å; R210-I212 VanDerWaalsContact C-N 3.34Å; I212-I216 HydrophobicContact CG1-CD1 4.27Å; I212-I216 CarbonylContact O-C 3.59Å; I212-I216 WeakPolarHBondContact O-CA 3.24Å; I212-I216 WeakPolarHBondContact O-CB 3.06Å; I212-I216 PolarHBondContact O-N 3.3Å; I212-I216 VanDerWaalsContact O-N 3.12Å; I212-A217 PolarHBondContact O-N 3.37Å; I212-I228 HydrophobicContact CG2-CB 4.29Å; I212-I228 HydrophobicContact CG2-CD1 3.51Å; I212-I228 HydrophobicContact CG2-CG1 4.49Å; I212-I228 HydrophobicContact CG2-CG2 3.89Å
213	D	94.8	Very high	94.9	Very high	67 Å²	67	38.7 Å²	38.7	36%	0.358	20%	0.201	S	C	.	.	I	π-helix	trans	-72.3	-41	-175.8	-60.7	-22.9	0	0	0	112.9	Q209 R210 P218	Q209-D213 WeakPolarHBondContact CG-OD2 3.46Å; Q209-D213 PolarHBondContact NE2-OD1 2.78Å; Q209-D213 PolarHBondContact NE2-OD2 2.83Å; Q209-D213 VanDerWaalsContact O-CG 3.29Å; Q209-D213 PolarHBondContact O-N 3.36Å; R210-D213 PolarHBondContact O-N 3.45Å; D213-P218 WeakPolarHBondContact O-CD 3.42Å
214	E	93.5	Very high	94.7	Very high	29 Å²	29	35.5 Å²	35.5	14%	0.136	18%	0.184	C	C	.	.	I	π-helix	trans	-89	-22.4	-172.5	-61.7	-174.5	-178.1	0	0	113.5	I126 L127 R143 Y144 R210	I126-E214 HydrophobicContact CD1-CB 3.69Å; I126-E214 HydrophobicContact CD1-CG 3.68Å; L127-E214 WeakPolarHBondContact CD1-O 3.29Å; R143-E214 IonicContact CZ-OE1 3.8Å; R143-E214 IonicContact CZ-OE2 3.24Å; R143-E214 VanDerWaalsContact CZ-OE2 3.24Å; R143-E214 IonicContact NE-OE1 3.87Å; R143-E214 IonicContact NE-OE2 2.76Å; R143-E214 PolarHBondContact NE-OE2 2.86Å; R143-E214 VanDerWaalsContact NH2-CD 3.26Å; R143-E214 IonicContact NH2-OE1 2.86Å; R143-E214 PolarHBondContact NH2-OE1 3.24Å; R143-E214 IonicContact NH2-OE2 2.92Å; R143-E214 PolarHBondContact NH2-OE2 3.08Å; Y144-E214 HydrophobicContact CE1-CB 4.17Å; Y144-E214 VanDerWaalsContact CE1-OE2 3.23Å; Y144-E214 WeakPolarHBondContact CE1-OE2 3.37Å; Y144-E214 VanDerWaalsContact CZ-OE2 3.27Å; Y144-E214 WeakPolarHBondContact OH-CB 3.4Å; Y144-E214 PolarHBondContact OH-OE2 3.3Å; R210-E214 HydrophobicContact CG-CG 4.13Å; R210-E214 WeakPolarHBondContact CG-OE1 3.34Å; R210-E214 IonicContact CZ-OE1 3.81Å; R210-E214 IonicContact NE-OE1 2.93Å; R210-E214 PolarHBondContact NE-OE1 3.08Å; R210-E214 IonicContact NE-OE2 3.52Å; R210-E214 IonicContact NH2-OE1 3.81Å; R210-E214 VanDerWaalsContact O-CB 3.22Å; R210-E214 WeakPolarHBondContact O-CB 3.48Å; R210-E214 VanDerWaalsContact O-CG 3.26Å; R210-E214 WeakPolarHBondContact O-CG 3.48Å; R210-E214 PolarHBondContact O-N 2.93Å
215	V	92.6	Very high	94.6	Very high	32 Å²	32	28.3 Å²	28.3	19%	0.194	15%	0.153	C	C	.	.	I	π-helix	trans	-119.3	-48.3	-176.7	-179	0	0	0	0	112.2	L127 Y144 F211 V219	L127-V215 HydrophobicContact CD1-CG2 3.48Å; L127-V215 VanDerWaalsContact CD1-CG2 3.48Å; Y144-V215 HydrophobicContact CE2-CG2 4.02Å; F211-V215 HydrophobicContact CD2-CB 3.97Å; F211-V215 HydrophobicContact CD2-CG2 3.58Å; F211-V215 HydrophobicContact CE2-CB 3.86Å; F211-V215 HydrophobicContact CE2-CG1 3.93Å; F211-V215 HydrophobicContact CE2-CG2 3.59Å; F211-V215 HydrophobicContact CG-CB 4.41Å; F211-V215 HydrophobicContact CG-CG2 4.39Å; F211-V215 HydrophobicContact CZ-CB 4.18Å; F211-V215 HydrophobicContact CZ-CG1 3.93Å; F211-V215 HydrophobicContact CZ-CG2 4.38Å; F211-V215 WeakPolarHBondContact O-CA 3.5Å; F211-V215 VanDerWaalsContact O-CB 3.29Å; F211-V215 WeakPolarHBondContact O-CB 3.46Å; F211-V215 PolarHBondContact O-N 3.08Å; V215-V219 WeakPolarHBondContact O-CG2 3.28Å
216	I	95.1	Very high	94.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-82.1	-42.6	-170.2	-60.4	178.1	0	0	0	111.4	L151 L198 L202 V207 F211 I212 V219 M220 L239	L151-I216 HydrophobicContact CD1-CD1 3.88Å; L151-I216 HydrophobicContact CD2-CD1 4.17Å; L151-I216 HydrophobicContact CD2-CG1 4.31Å; L198-I216 HydrophobicContact CD2-CG2 3.78Å; L202-I216 HydrophobicContact CD1-CD1 3.4Å; L202-I216 HydrophobicContact CD1-CG2 4.1Å; V207-I216 HydrophobicContact CG1-CD1 4.29Å; F211-I216 HydrophobicContact CD1-CD1 3.87Å; F211-I216 HydrophobicContact CD1-CG1 4.22Å; F211-I216 HydrophobicContact CE1-CD1 3.92Å; F211-I216 HydrophobicContact CE1-CG1 4.15Å; F211-I216 PolarHBondContact O-N 2.91Å; I212-I216 HydrophobicContact CG1-CD1 4.27Å; I212-I216 CarbonylContact O-C 3.59Å; I212-I216 WeakPolarHBondContact O-CA 3.24Å; I212-I216 WeakPolarHBondContact O-CB 3.06Å; I212-I216 PolarHBondContact O-N 3.3Å; I212-I216 VanDerWaalsContact O-N 3.12Å; I216-V219 WeakPolarHBondContact O-CB 3.36Å; I216-V219 PolarHBondContact O-N 3Å; I216-V219 VanDerWaalsContact O-N 3.1Å; I216-M220 HydrophobicContact CG2-CE 4.22Å; I216-M220 HydrophobicContact CG2-CG 4.47Å; I216-M220 PolarHBondContact O-N 3.19Å; I216-L239 HydrophobicContact CG1-CD2 4.49Å; I216-L239 HydrophobicContact CG2-CD2 4.29Å
217	A	95.6	Very high	94.4	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-58.8	-44.5	177.9	0	0	0	0	0	112.8	I212 V219 M220 R221 I228	I212-A217 PolarHBondContact O-N 3.37Å; A217-V219 VanDerWaalsContact C-N 3.29Å; A217-V219 PolarHBondContact O-N 3.1Å; A217-M220 PolarHBondContact O-N 3.15Å; A217-M220 VanDerWaalsContact O-N 3.16Å; A217-R221 WeakPolarHBondContact O-CB 3.47Å; A217-R221 VanDerWaalsContact O-CG 3.28Å; A217-R221 WeakPolarHBondContact O-CG 3.44Å; A217-R221 PolarHBondContact O-N 3.45Å; A217-I228 HydrophobicContact CB-CG2 3.69Å
218	P	95.5	Very high	94.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.1	-38	172.6	-24.8	31.9	0	0	0	114.1	V119 D213 R221 V222 L366 T367 T368	V119-P218 HydrophobicContact CG1-CB 4.16Å; V119-P218 HydrophobicContact CG1-CG 3.55Å; V119-P218 HydrophobicContact CG2-CB 4.41Å; V119-P218 HydrophobicContact CG2-CG 4.34Å; D213-P218 WeakPolarHBondContact O-CD 3.42Å; P218-R221 PolarHBondContact O-N 3.07Å; P218-V222 WeakPolarHBondContact O-CG1 3.3Å; P218-V222 PolarHBondContact O-N 2.75Å; P218-L366 HydrophobicContact CB-CB 3.8Å; P218-L366 HydrophobicContact CB-CD1 4.29Å; P218-T367 VanDerWaalsContact CA-O 3.28Å; P218-T367 WeakPolarHBondContact CA-O 3.45Å; P218-T367 WeakPolarHBondContact CB-O 3.33Å; P218-T368 HydrophobicContact CG-CG2 4.1Å
219	V	94.9	Very high	94.2	Very high	20 Å²	20	29.3 Å²	29.3	12%	0.121	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-42.8	176.1	179.5	0	0	0	0	110.9	V215 I216 A217 R221 V222 N223 L239 A242	V215-V219 WeakPolarHBondContact O-CG2 3.28Å; I216-V219 WeakPolarHBondContact O-CB 3.36Å; I216-V219 PolarHBondContact O-N 3Å; I216-V219 VanDerWaalsContact O-N 3.1Å; A217-V219 VanDerWaalsContact C-N 3.29Å; A217-V219 PolarHBondContact O-N 3.1Å; V219-R221 VanDerWaalsContact C-N 3.32Å; V219-R221 PolarHBondContact O-N 3.03Å; V219-V222 VanDerWaalsContact O-CG1 3.31Å; V219-V222 WeakPolarHBondContact O-CG1 3.48Å; V219-V222 PolarHBondContact O-N 3.45Å; V219-N223 WeakPolarHBondContact O-CB 3.35Å; V219-N223 PolarHBondContact O-N 3.47Å; V219-L239 HydrophobicContact CG1-CD2 4.32Å; V219-A242 HydrophobicContact CG1-CB 3.58Å; V219-A242 HydrophobicContact CG2-CB 4.3Å
220	M	95.1	Very high	94.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-41.7	177.1	-62.4	-47.6	99.3	0	0	111.4	L198 I216 A217 N223 Y224 G225 Q226 I228 I230 S238 L239	L198-M220 HydrophobicContact CD2-CE 4.3Å; L198-M220 HydrophobicContact CD2-CG 3.95Å; L198-M220 HydrophobicContact CD2-SD 3.66Å; I216-M220 HydrophobicContact CG2-CE 4.22Å; I216-M220 HydrophobicContact CG2-CG 4.47Å; I216-M220 PolarHBondContact O-N 3.19Å; A217-M220 PolarHBondContact O-N 3.15Å; A217-M220 VanDerWaalsContact O-N 3.16Å; M220-N223 PolarHBondContact O-N 2.98Å; M220-Y224 WeakPolarHBondContact O-CA 3.49Å; M220-Y224 PolarHBondContact O-N 3.41Å; M220-G225 PolarHBondContact O-N 3.1Å; M220-Q226 CarbonylContact C-O 3.54Å; M220-Q226 VanDerWaalsContact C-O 3.3Å; M220-Q226 WeakPolarHBondContact CB-O 3.2Å; M220-I228 HydrophobicContact CG-CG2 4.48Å; M220-I230 HydrophobicContact CG-CD1 4.11Å; M220-I230 HydrophobicContact SD-CD1 3.44Å; M220-I230 WeakPolarHBondContact SD-CD1 3.44Å; M220-I230 HydrophobicContact SD-CG1 4.46Å; M220-S238 VanDerWaalsContact CE-CB 3.45Å; M220-S238 VanDerWaalsContact CE-OG 3.26Å; M220-S238 WeakPolarHBondContact CE-OG 3.32Å; M220-L239 HydrophobicContact CE-CD2 3.96Å; M220-L239 HydrophobicContact CE-CG 3.88Å
221	R	94.2	Very high	94.3	Very high	20 Å²	20	20.3 Å²	20.3	8%	0.075	12%	0.116	C	C	.	.	H	α-helix	trans	-65.6	-40.6	-179.4	-71.5	170.3	60.2	77.7	7.9	112.4	A217 P218 V219 G225 Q226 T367 T368 D369 F375 N376	A217-R221 WeakPolarHBondContact O-CB 3.47Å; A217-R221 VanDerWaalsContact O-CG 3.28Å; A217-R221 WeakPolarHBondContact O-CG 3.44Å; A217-R221 PolarHBondContact O-N 3.45Å; P218-R221 PolarHBondContact O-N 3.07Å; V219-R221 VanDerWaalsContact C-N 3.32Å; V219-R221 PolarHBondContact O-N 3.03Å; R221-G225 VanDerWaalsContact O-CA 3.22Å; R221-G225 WeakPolarHBondContact O-CA 3.44Å; R221-G225 PolarHBondContact O-N 3.22Å; R221-Q226 PolarHBondContact N-O 3.22Å; R221-T367 WeakPolarHBondContact CD-O 3.43Å; R221-T367 PolarHBondContact NE-O 3.31Å; R221-T367 PolarHBondContact NE-OG1 3.09Å; R221-T367 PolarHBondContact NH2-OG1 2.74Å; R221-T367 VanDerWaalsContact NH2-OG1 3.14Å; R221-T368 PolarHBondContact NE-O 3.34Å; R221-T368 VanDerWaalsContact NE-O 3.17Å; R221-D369 IonicContact CZ-OD1 3.47Å; R221-D369 IonicContact NH1-OD1 3.62Å; R221-D369 PolarHBondContact NH1-OD1 2.7Å; R221-F375 PolarHBondContact NH2-O 3.21Å; R221-N376 HydrophobicContact CB-CB 4.26Å; R221-N376 PolarHBondContact NH2-OD1 3.49Å; R221-N376 WeakPolarHBondContact O-CB 3.36Å; R221-N376 PolarHBondContact O-ND2 3.49Å
222	V	92.5	Very high	94.3	Very high	27 Å²	27	20.3 Å²	20.3	16%	0.164	12%	0.116	C	C	.	.	H	α-helix	trans	-73.9	-37.7	177.7	65.1	0	0	0	0	113	P218 V219 L366 S377 F404	P218-V222 WeakPolarHBondContact O-CG1 3.3Å; P218-V222 PolarHBondContact O-N 2.75Å; V219-V222 VanDerWaalsContact O-CG1 3.31Å; V219-V222 WeakPolarHBondContact O-CG1 3.48Å; V219-V222 PolarHBondContact O-N 3.45Å; V222-L366 HydrophobicContact CB-CD2 3.95Å; V222-L366 HydrophobicContact CG1-CD1 4.34Å; V222-L366 HydrophobicContact CG1-CD2 4.05Å; V222-L366 HydrophobicContact CG2-CD2 3.99Å; V222-S377 WeakPolarHBondContact CG2-OG 3.31Å; V222-F404 HydrophobicContact CG2-CD2 4.21Å; V222-F404 HydrophobicContact CG2-CE2 4.49Å
223	N	92.6	Very high	94.4	Very high	36 Å²	36	20.4 Å²	20.4	19%	0.193	12%	0.116	C	C	.	.	H	α-helix	trans	-83.8	-37.1	-175.9	-73.9	-14.2	0	0	0	113.2	V219 M220 S238 Y432	V219-N223 WeakPolarHBondContact O-CB 3.35Å; V219-N223 PolarHBondContact O-N 3.47Å; M220-N223 PolarHBondContact O-N 2.98Å; N223-S238 VanDerWaalsContact CB-OG 3.29Å; N223-S238 WeakPolarHBondContact CB-OG 3.49Å; N223-S238 PolarHBondContact ND2-O 3.32Å; N223-S238 VanDerWaalsContact ND2-O 3.11Å; N223-S238 PolarHBondContact ND2-OG 3.12Å; N223-Y432 WeakPolarHBondContact O-CE2 3.4Å; N223-Y432 PolarHBondContact O-OH 2.81Å
224	Y	93	Very high	94.4	Very high	7 Å²	7	17.3 Å²	17.3	3%	0.027	10%	0.1	C	C	.	.	H	α-helix	trans	-123.9	-8.9	-173.4	-70.3	-53.5	0	0	0	115	M220 Q226 I230 V234 H336 Y432 Y435 S461	M220-Y224 WeakPolarHBondContact O-CA 3.49Å; M220-Y224 PolarHBondContact O-N 3.41Å; Y224-Q226 PolarHBondContact O-N 3Å; Y224-I230 HydrophobicContact CD2-CD1 4.2Å; Y224-V234 HydrophobicContact CD2-CG1 4.06Å; Y224-V234 HydrophobicContact CE2-CG1 3.51Å; Y224-H336 PolarHBondContact O-CD2 3.04Å; Y224-Y432 AromaticContact CD1-CD1 3.55Å; Y224-Y432 HydrophobicContact CD1-CD1 3.55Å; Y224-Y432 AromaticContact CD1-CD2 3.84Å; Y224-Y432 HydrophobicContact CD1-CD2 3.84Å; Y224-Y432 AromaticContact CD1-CE1 3.7Å; Y224-Y432 HydrophobicContact CD1-CE1 3.7Å; Y224-Y432 AromaticContact CD1-CE2 4Å; Y224-Y432 HydrophobicContact CD1-CE2 4Å; Y224-Y432 AromaticContact CD1-CG 3.62Å; Y224-Y432 HydrophobicContact CD1-CG 3.62Å; Y224-Y432 AromaticContact CD1-CZ 3.93Å; Y224-Y432 AromaticContact CE1-CD1 3.74Å; Y224-Y432 HydrophobicContact CE1-CD1 3.74Å; Y224-Y432 AromaticContact CE1-CE1 3.79Å; Y224-Y432 HydrophobicContact CE1-CE1 3.79Å; Y224-Y432 HydrophobicContact CE1-CG 4.25Å; Y224-Y432 WeakPolarHBondContact O-CD2 3.39Å; Y224-Y435 HydrophobicContact CD1-CE2 4.15Å; Y224-Y435 HydrophobicContact CE1-CE2 4.34Å; Y224-Y435 HydrophobicContact CG-CE2 4.39Å; Y224-S461 PolarHBondContact OH-O 2.76Å
225	G	93.1	Very high	94.5	Very high	11 Å²	11	15.9 Å²	15.9	11%	0.113	9%	0.093	C	C	.	.	S	Bend	trans	68.3	8.5	-174.1	0	0	0	0	0	114.2	M220 R221 H336 N376	M220-G225 PolarHBondContact O-N 3.1Å; R221-G225 VanDerWaalsContact O-CA 3.22Å; R221-G225 WeakPolarHBondContact O-CA 3.44Å; R221-G225 PolarHBondContact O-N 3.22Å; G225-H336 PolarHBondContact O-CE1 2.77Å; G225-H336 PolarHBondContact O-NE2 3.48Å; G225-H336 VanDerWaalsContact O-NE2 3.15Å; G225-N376 WeakPolarHBondContact CA-ND2 3.48Å
226	Q	93.4	Very high	94.7	Very high	18 Å²	18	14.6 Å²	14.6	8%	0.084	9%	0.085	C	C	.	.			trans	-119.6	162.6	-173.6	-67.5	176.4	81.3	0	0	110.2	M220 R221 Y224 I230 H336 P433	M220-Q226 CarbonylContact C-O 3.54Å; M220-Q226 VanDerWaalsContact C-O 3.3Å; M220-Q226 WeakPolarHBondContact CB-O 3.2Å; R221-Q226 PolarHBondContact N-O 3.22Å; Y224-Q226 PolarHBondContact O-N 3Å; Q226-I230 HydrophobicContact CB-CG2 3.81Å; Q226-H336 HydrophobicContact CG-CB 4.41Å; Q226-P433 PolarHBondContact NE2-O 3.36Å
227	N	91.9	Very high	94.6	Very high	62 Å²	62	16 Å²	16	33%	0.332	9%	0.094	S	C	.	.			trans	-88	-168.6	-176.2	66.1	10.9	0	0	0	111.7	S229 I230	N227-S229 PolarHBondContact O-N 3.45Å; N227-S229 WeakPolarHBondContact OD1-CB 3.39Å; N227-S229 PolarHBondContact OD1-N 3.11Å; N227-S229 VanDerWaalsContact OD1-N 3.08Å; N227-S229 PolarHBondContact OD1-OG 2.9Å; N227-I230 WeakPolarHBondContact O-CG2 3.35Å
228	I	94.1	Very high	94.5	Very high	27 Å²	27	16 Å²	16	14%	0.138	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	0.2	-177.9	60.8	171.6	0	0	0	114.4	S199 I212 A217 M220 I230	S199-I228 PolarHBondContact N-O 2.79Å; S199-I228 WeakPolarHBondContact OG-CD1 3.48Å; I212-I228 HydrophobicContact CG2-CB 4.29Å; I212-I228 HydrophobicContact CG2-CD1 3.51Å; I212-I228 HydrophobicContact CG2-CG1 4.49Å; I212-I228 HydrophobicContact CG2-CG2 3.89Å; A217-I228 HydrophobicContact CB-CG2 3.69Å; M220-I228 HydrophobicContact CG-CG2 4.48Å; I228-I230 PolarHBondContact O-N 2.89Å
229	S	94.2	Very high	94.3	Very high	62 Å²	62	16.6 Å²	16.6	43%	0.434	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.1	177.3	78.2	0	0	0	0	113.1	N227	N227-S229 PolarHBondContact O-N 3.45Å; N227-S229 WeakPolarHBondContact OD1-CB 3.39Å; N227-S229 PolarHBondContact OD1-N 3.11Å; N227-S229 VanDerWaalsContact OD1-N 3.08Å; N227-S229 PolarHBondContact OD1-OG 2.9Å
230	I	95.3	Very high	93.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-62.3	156	171.8	65.2	175	0	0	0	110.8	S197 L198 M220 Y224 Q226 N227 I228 V234 Y435	S197-I230 CarbonylContact C-O 3.5Å; S197-I230 WeakPolarHBondContact CA-O 3.5Å; L198-I230 HydrophobicContact CB-CG1 4.29Å; L198-I230 HydrophobicContact CD2-CG1 4.48Å; L198-I230 PolarHBondContact N-O 3.4Å; M220-I230 HydrophobicContact CG-CD1 4.11Å; M220-I230 HydrophobicContact SD-CD1 3.44Å; M220-I230 WeakPolarHBondContact SD-CD1 3.44Å; M220-I230 HydrophobicContact SD-CG1 4.46Å; Y224-I230 HydrophobicContact CD2-CD1 4.2Å; Q226-I230 HydrophobicContact CB-CG2 3.81Å; N227-I230 WeakPolarHBondContact O-CG2 3.35Å; I228-I230 PolarHBondContact O-N 2.89Å; I230-V234 HydrophobicContact CD1-CB 4.32Å; I230-V234 HydrophobicContact CD1-CG1 3.97Å; I230-Y435 HydrophobicContact CG2-CD2 4.16Å; I230-Y435 HydrophobicContact CG2-CG 4.43Å
231	P	96.9	Very high	93	Very high	5 Å²	5	17.3 Å²	17.3	3%	0.032	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-55.5	143.1	174.2	-26	34.4	0	0	0	112.6	C196 F233 V234 G235	C196-P231 WeakPolarHBondContact O-CA 3.22Å; P231-F233 PolarHBondContact O-N 3.43Å; P231-V234 HydrophobicContact CB-CG2 4.05Å; P231-V234 HydrophobicContact CG-CG2 4.2Å; P231-V234 WeakPolarHBondContact O-CB 3.28Å; P231-V234 PolarHBondContact O-N 3.24Å; P231-V234 VanDerWaalsContact O-N 3.1Å; P231-G235 PolarHBondContact O-N 3.14Å
232	A	96.8	Very high	92.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.3	-35.8	-177.4	0	0	0	0	0	113	W154 M193 C196 S201 G235 A236	W154-A232 WeakPolarHBondContact CH2-O 3.37Å; W154-A232 HydrophobicContact CZ2-CB 4.3Å; M193-A232 HydrophobicContact CB-CB 4.09Å; M193-A232 HydrophobicContact CE-CB 4.19Å; M193-A232 HydrophobicContact CG-CB 4.23Å; M193-A232 PolarHBondContact O-N 3.2Å; C196-A232 PolarHBondContact O-N 3.49Å; S201-A232 VanDerWaalsContact OG-CB 3.3Å; S201-A232 WeakPolarHBondContact OG-CB 3.48Å; A232-G235 PolarHBondContact O-N 2.87Å; A232-A236 PolarHBondContact O-N 3.05Å
233	F	96.6	Very high	91.2	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.009	12%	0.124	C	C	.	.	H	α-helix	trans	-66.3	-42.4	177.6	-164.4	-90.7	0	0	0	112.2	I158 F162 L182 F190 M193 T194 P231 G235 A236 V237 A459 M465	I158-F233 HydrophobicContact CG2-CE2 4.24Å; F162-F233 HydrophobicContact CD2-CZ 4.1Å; F162-F233 HydrophobicContact CE2-CZ 4.43Å; L182-F233 HydrophobicContact CD2-CD1 4.41Å; L182-F233 HydrophobicContact CD2-CE1 3.74Å; L182-F233 HydrophobicContact CD2-CE2 4.05Å; L182-F233 HydrophobicContact CD2-CZ 3.52Å; F190-F233 HydrophobicContact CB-CD2 4.35Å; F190-F233 HydrophobicContact CB-CE2 4.28Å; F190-F233 HydrophobicContact CD1-CD2 4.19Å; F190-F233 AromaticContact CD1-CE2 3.93Å; F190-F233 HydrophobicContact CD1-CE2 3.93Å; F190-F233 HydrophobicContact CD2-CD2 4.35Å; F190-F233 AromaticContact CD2-CE2 3.5Å; F190-F233 HydrophobicContact CD2-CE2 3.5Å; F190-F233 HydrophobicContact CD2-CZ 4.16Å; F190-F233 HydrophobicContact CE1-CE2 4.05Å; F190-F233 AromaticContact CE2-CE2 3.64Å; F190-F233 HydrophobicContact CE2-CE2 3.64Å; F190-F233 HydrophobicContact CE2-CZ 4.18Å; F190-F233 HydrophobicContact CG-CD2 4.06Å; F190-F233 AromaticContact CG-CE2 3.65Å; F190-F233 HydrophobicContact CG-CE2 3.65Å; F190-F233 AromaticContact CZ-CE2 3.9Å; F190-F233 HydrophobicContact CZ-CE2 3.9Å; M193-F233 HydrophobicContact CB-CB 3.89Å; M193-F233 HydrophobicContact CE-CB 4.31Å; M193-F233 HydrophobicContact CE-CD2 4.2Å; M193-F233 PolarHBondContact O-N 3.33Å; T194-F233 HydrophobicContact CG2-CB 4.26Å; P231-F233 PolarHBondContact O-N 3.43Å; F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 3.21Å; F233-A236 WeakPolarHBondContact O-CB 3.44Å; F233-A236 PolarHBondContact O-N 3.35Å; F233-V237 HydrophobicContact CD1-CG2 4.25Å; F233-V237 HydrophobicContact CE1-CG2 4.03Å; F233-V237 WeakPolarHBondContact O-CG2 3.07Å; F233-V237 PolarHBondContact O-N 3.18Å; F233-A459 VanDerWaalsContact CD1-O 3.31Å; F233-A459 WeakPolarHBondContact CD1-O 3.23Å; F233-M465 HydrophobicContact CE1-CE 4.18Å
234	V	96.1	Very high	90.1	Very high	1 Å²	1	21 Å²	21	1%	0.006	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-43.4	173.6	-178.8	0	0	0	0	110.1	Y224 I230 P231 A236 V237 S238 Y435 A459	Y224-V234 HydrophobicContact CD2-CG1 4.06Å; Y224-V234 HydrophobicContact CE2-CG1 3.51Å; I230-V234 HydrophobicContact CD1-CB 4.32Å; I230-V234 HydrophobicContact CD1-CG1 3.97Å; P231-V234 HydrophobicContact CB-CG2 4.05Å; P231-V234 HydrophobicContact CG-CG2 4.2Å; P231-V234 WeakPolarHBondContact O-CB 3.28Å; P231-V234 PolarHBondContact O-N 3.24Å; P231-V234 VanDerWaalsContact O-N 3.1Å; V234-A236 PolarHBondContact O-N 2.83Å; V234-V237 PolarHBondContact O-N 3.04Å; V234-S238 PolarHBondContact O-N 3.21Å; V234-Y435 HydrophobicContact CB-CE1 4.41Å; V234-Y435 HydrophobicContact CG1-CD1 4.2Å; V234-Y435 HydrophobicContact CG1-CD2 3.81Å; V234-Y435 HydrophobicContact CG1-CE1 3.91Å; V234-Y435 HydrophobicContact CG1-CE2 3.5Å; V234-Y435 HydrophobicContact CG1-CG 4.16Å; V234-Y435 HydrophobicContact CG2-CD1 3.64Å; V234-Y435 HydrophobicContact CG2-CE1 3.54Å; V234-Y435 HydrophobicContact CG2-CG 4.23Å; V234-A459 WeakPolarHBondContact CG2-O 3.22Å
235	G	96	Very high	89.4	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.8	-43.7	174.9	0	0	0	0	0	113.2	P231 A232 F233 V237 S238 L239	P231-G235 PolarHBondContact O-N 3.14Å; A232-G235 PolarHBondContact O-N 2.87Å; F233-G235 VanDerWaalsContact C-N 3.29Å; F233-G235 PolarHBondContact O-N 3.21Å; G235-V237 PolarHBondContact O-N 2.94Å; G235-S238 VanDerWaalsContact O-CB 3.29Å; G235-S238 WeakPolarHBondContact O-CB 3.43Å; G235-S238 PolarHBondContact O-N 3.34Å; G235-L239 WeakPolarHBondContact O-CD1 3.46Å; G235-L239 VanDerWaalsContact O-CG 3.28Å; G235-L239 WeakPolarHBondContact O-CG 3.34Å; G235-L239 PolarHBondContact O-N 2.87Å
236	A	95.4	Very high	89.2	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-43.1	175.6	0	0	0	0	0	112.2	W154 I158 M193 A232 F233 V234 S238 L239 A240	W154-A236 HydrophobicContact CH2-CB 3.8Å; W154-A236 HydrophobicContact CZ3-CB 3.94Å; I158-A236 HydrophobicContact CD1-CB 3.6Å; I158-A236 HydrophobicContact CG2-CB 4.11Å; M193-A236 HydrophobicContact CE-CB 4.24Å; A232-A236 PolarHBondContact O-N 3.05Å; F233-A236 WeakPolarHBondContact O-CB 3.44Å; F233-A236 PolarHBondContact O-N 3.35Å; V234-A236 PolarHBondContact O-N 2.83Å; A236-S238 VanDerWaalsContact C-N 3.31Å; A236-S238 PolarHBondContact O-N 3.28Å; A236-L239 PolarHBondContact O-N 3.35Å; A236-A240 PolarHBondContact O-N 3.27Å
237	V	93.4	Very high	89.2	Confident	31 Å²	31	29.3 Å²	29.3	19%	0.188	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-42	174.1	174.7	0	0	0	0	111.1	F233 V234 G235 G241 A462	F233-V237 HydrophobicContact CD1-CG2 4.25Å; F233-V237 HydrophobicContact CE1-CG2 4.03Å; F233-V237 WeakPolarHBondContact O-CG2 3.07Å; F233-V237 PolarHBondContact O-N 3.18Å; V234-V237 PolarHBondContact O-N 3.04Å; G235-V237 PolarHBondContact O-N 2.94Å; V237-G241 PolarHBondContact O-N 3.27Å; V237-A462 HydrophobicContact CG1-CB 4.16Å
238	S	93.2	Very high	89.3	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-46.9	175.8	-166.7	0	0	0	0	112.5	M220 N223 V234 G235 A236 G241 A242	M220-S238 VanDerWaalsContact CE-CB 3.45Å; M220-S238 VanDerWaalsContact CE-OG 3.26Å; M220-S238 WeakPolarHBondContact CE-OG 3.32Å; N223-S238 VanDerWaalsContact CB-OG 3.29Å; N223-S238 WeakPolarHBondContact CB-OG 3.49Å; N223-S238 PolarHBondContact ND2-O 3.32Å; N223-S238 VanDerWaalsContact ND2-O 3.11Å; N223-S238 PolarHBondContact ND2-OG 3.12Å; V234-S238 PolarHBondContact O-N 3.21Å; G235-S238 VanDerWaalsContact O-CB 3.29Å; G235-S238 WeakPolarHBondContact O-CB 3.43Å; G235-S238 PolarHBondContact O-N 3.34Å; A236-S238 VanDerWaalsContact C-N 3.31Å; A236-S238 PolarHBondContact O-N 3.28Å; S238-G241 CarbonylContact O-C 3.14Å; S238-G241 WeakPolarHBondContact O-CA 3.21Å; S238-G241 PolarHBondContact O-N 3.43Å; S238-A242 PolarHBondContact O-N 3.24Å
239	L	92.1	Very high	89.5	Confident	12 Å²	12	25.1 Å²	25.1	6%	0.063	16%	0.162	C	C	.	.	H	α-helix	trans	-67.8	-37.7	-175.5	-71.9	162	0	0	0	111.7	L151 W154 V155 L198 I216 V219 M220 G235 A236 G241 A242 Q243	L151-L239 HydrophobicContact CD1-CD1 3.73Å; L151-L239 HydrophobicContact CD2-CD2 4.29Å; W154-L239 HydrophobicContact CZ3-CD1 3.85Å; V155-L239 HydrophobicContact CG2-CB 3.86Å; V155-L239 HydrophobicContact CG2-CD1 4.2Å; L198-L239 HydrophobicContact CD1-CD1 4.43Å; I216-L239 HydrophobicContact CG1-CD2 4.49Å; I216-L239 HydrophobicContact CG2-CD2 4.29Å; V219-L239 HydrophobicContact CG1-CD2 4.32Å; M220-L239 HydrophobicContact CE-CD2 3.96Å; M220-L239 HydrophobicContact CE-CG 3.88Å; G235-L239 WeakPolarHBondContact O-CD1 3.46Å; G235-L239 VanDerWaalsContact O-CG 3.28Å; G235-L239 WeakPolarHBondContact O-CG 3.34Å; G235-L239 PolarHBondContact O-N 2.87Å; A236-L239 PolarHBondContact O-N 3.35Å; L239-G241 PolarHBondContact O-N 3.45Å; L239-A242 PolarHBondContact O-N 2.8Å; L239-Q243 PolarHBondContact O-N 2.78Å
240	A	86.1	Confident	89.6	Confident	15 Å²	15	25.4 Å²	25.4	12%	0.124	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-37.8	170	0	0	0	0	0	111.4	H92 V155 M159 A236 A242 Q243	H92-A240 PolarHBondContact CD2-O 3.27Å; H92-A240 VanDerWaalsContact CD2-O 3.25Å; V155-A240 HydrophobicContact CG1-CB 4.29Å; M159-A240 HydrophobicContact CG-CB 4.27Å; M159-A240 HydrophobicContact SD-CB 3.74Å; A236-A240 PolarHBondContact O-N 3.27Å; A240-A242 PolarHBondContact O-N 3.08Å; A240-Q243 PolarHBondContact O-N 2.72Å
241	G	76.2	Confident	89.7	Confident	20 Å²	20	26.1 Å²	26.1	21%	0.206	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.1	174	0	0	0	0	0	115.5	I90 V237 S238 L239 L246	I90-G241 WeakPolarHBondContact CD1-O 3.43Å; V237-G241 PolarHBondContact O-N 3.27Å; S238-G241 CarbonylContact O-C 3.14Å; S238-G241 WeakPolarHBondContact O-CA 3.21Å; S238-G241 PolarHBondContact O-N 3.43Å; L239-G241 PolarHBondContact O-N 3.45Å; G241-L246 WeakPolarHBondContact O-CD1 3.49Å
242	A	76.3	Confident	89.7	Confident	53 Å²	53	25.9 Å²	25.9	44%	0.438	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	0.7	177.3	0	0	0	0	0	113.4	V219 S238 L239 A240	V219-A242 HydrophobicContact CG1-CB 3.58Å; V219-A242 HydrophobicContact CG2-CB 4.3Å; S238-A242 PolarHBondContact O-N 3.24Å; L239-A242 PolarHBondContact O-N 2.8Å; A240-A242 PolarHBondContact O-N 3.08Å
243	Q	73	Confident	89.7	Confident	36 Å²	36	25.9 Å²	25.9	17%	0.168	16%	0.162	C	C	.	.	S	Bend	trans	-76.1	174.6	174	-72.6	-179.7	-29.2	0	0	111.9	M159 L239 A240 L246	M159-Q243 PolarHBondContact SD-OE1 3.45Å; M159-Q243 VanDerWaalsContact SD-OE1 3.38Å; L239-Q243 PolarHBondContact O-N 2.78Å; A240-Q243 PolarHBondContact O-N 2.72Å; Q243-L246 WeakPolarHBondContact O-CG 3.32Å
244	A	68.7	Low	89.8	Confident	73 Å²	73	28.5 Å²	28.5	60%	0.603	17%	0.173	S	C	*	.	S	Bend	trans	-64.2	172.6	173.5	0	0	0	0	0	112.1
245	N	79.4	Confident	89.9	Confident	120 Å²	120	31.4 Å²	31.4	64%	0.642	19%	0.189	S	C	*	.			trans	70.2	29.7	176.4	-47.5	-46.7	0	0	0	115.6	S93	S93-N245 PolarHBondContact N-O 2.79Å; S93-N245 WeakPolarHBondContact OG-CB 3.43Å
246	L	87.3	Confident	90	Very high	57 Å²	57	31.4 Å²	31.4	30%	0.298	19%	0.189	S	C	.	.			trans	-76.1	141.2	169.5	-55.8	172.7	0	0	0	111.1	I90 I91 H92 G241 Q243	I90-L246 HydrophobicContact CB-CB 4.47Å; I90-L246 HydrophobicContact CD1-CD1 3.78Å; I90-L246 HydrophobicContact CD1-CD2 4.36Å; I91-L246 CarbonylContact O-C 3.58Å; I91-L246 WeakPolarHBondContact O-CA 3.31Å; H92-L246 HydrophobicContact CB-CD2 4.21Å; G241-L246 WeakPolarHBondContact O-CD1 3.49Å; Q243-L246 WeakPolarHBondContact O-CG 3.32Å
247	W	93.5	Very high	90.1	Very high	32 Å²	32	31.2 Å²	31.2	12%	0.121	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-139.1	169.5	178.2	60.5	-86.7	0	0	0	111	I91 H92 M98 Q99 V102 Y109 V249	I91-W247 HydrophobicContact CB-CD2 3.92Å; I91-W247 HydrophobicContact CB-CE3 4.18Å; I91-W247 HydrophobicContact CB-CH2 4.14Å; I91-W247 HydrophobicContact CB-CZ2 3.84Å; I91-W247 HydrophobicContact CB-CZ3 4.28Å; I91-W247 HydrophobicContact CD1-CE3 3.95Å; I91-W247 HydrophobicContact CD1-CH2 3.57Å; I91-W247 HydrophobicContact CD1-CZ2 4.18Å; I91-W247 HydrophobicContact CD1-CZ3 3.42Å; I91-W247 VanDerWaalsContact CD1-CZ3 3.42Å; I91-W247 HydrophobicContact CG1-CH2 4.44Å; I91-W247 HydrophobicContact CG1-CZ3 4.42Å; I91-W247 HydrophobicContact CG2-CD2 4.24Å; I91-W247 VanDerWaalsContact CG2-CE2 3.49Å; I91-W247 HydrophobicContact CG2-CH2 3.82Å; I91-W247 HydrophobicContact CG2-CZ2 3.27Å; I91-W247 HydrophobicContact CG2-CZ3 4.46Å; I91-W247 PolarHBondContact N-O 2.63Å; I91-W247 PolarHBondContact O-N 2.94Å; I91-W247 PolarHBondContact O-NE1 2.99Å; H92-W247 PolarHBondContact O-NE1 3.33Å; M98-W247 HydrophobicContact CB-CH2 4.27Å; M98-W247 HydrophobicContact CB-CZ2 4.26Å; Q99-W247 HydrophobicContact CG-CZ2 3.8Å; V102-W247 HydrophobicContact CB-CH2 4.35Å; V102-W247 HydrophobicContact CG2-CH2 3.68Å; V102-W247 HydrophobicContact CG2-CZ3 3.8Å; Y109-W247 HydrophobicContact CD1-CB 4.45Å; Y109-W247 AromaticContact CD1-CD2 3.74Å; Y109-W247 HydrophobicContact CD1-CD2 3.74Å; Y109-W247 AromaticContact CD1-CE3 3.34Å; Y109-W247 HydrophobicContact CD1-CE3 3.34Å; Y109-W247 HydrophobicContact CD1-CG 4.25Å; Y109-W247 AromaticContact CD1-CZ3 3.78Å; Y109-W247 HydrophobicContact CD1-CZ3 3.78Å; Y109-W247 AromaticContact CE1-CD2 3.64Å; Y109-W247 HydrophobicContact CE1-CD2 3.64Å; Y109-W247 AromaticContact CE1-CE2 3.94Å; Y109-W247 AromaticContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CE3 3.48Å; Y109-W247 VanDerWaalsContact CE1-CE3 3.48Å; Y109-W247 HydrophobicContact CE1-CG 4.33Å; Y109-W247 AromaticContact CE1-CH2 3.89Å; Y109-W247 HydrophobicContact CE1-CH2 3.89Å; Y109-W247 HydrophobicContact CE1-CZ2 4.05Å; Y109-W247 AromaticContact CE1-CZ3 3.61Å; Y109-W247 HydrophobicContact CE1-CZ3 3.61Å; W247-V249 HydrophobicContact CZ3-CG2 3.85Å
248	A	95.3	Very high	90.3	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	19%	0.192	C	C	.	.			trans	-143.5	161.8	174.8	0	0	0	0	0	109.3	R110	R110-A248 HydrophobicContact CB-CB 4.35Å; R110-A248 WeakPolarHBondContact CB-O 3.47Å; R110-A248 PolarHBondContact N-O 3.25Å
249	V	97.4	Very high	90.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-81.2	132.9	178.1	178.9	0	0	0	0	110.4	I91 V102 L107 W247 G251 G252 N253 V256	I91-V249 HydrophobicContact CD1-CG2 4.34Å; V102-V249 HydrophobicContact CG2-CG2 3.73Å; L107-V249 HydrophobicContact CB-CG1 4.2Å; L107-V249 HydrophobicContact CD1-CG1 4.12Å; W247-V249 HydrophobicContact CZ3-CG2 3.85Å; V249-G251 PolarHBondContact O-N 2.8Å; V249-G252 PolarHBondContact O-N 2.87Å; V249-N253 PolarHBondContact N-OD1 3.01Å; V249-V256 HydrophobicContact CG2-CG2 3.86Å
250	E	97.2	Very high	90.9	Very high	68 Å²	68	31.6 Å²	31.6	32%	0.318	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	126.4	169.6	-175.5	174.5	-167.9	0	0	109.4	K108 R110 G252 N385	K108-E250 HydrophobicContact CB-CB 4.12Å; K108-E250 WeakPolarHBondContact CB-OE2 3.14Å; K108-E250 WeakPolarHBondContact CD-OE2 3.2Å; K108-E250 WeakPolarHBondContact O-CB 3.33Å; K108-E250 PolarHBondContact O-N 3.45Å; R110-E250 HydrophobicContact CB-CB 4.46Å; E250-G252 VanDerWaalsContact C-N 3.29Å; E250-N385 WeakPolarHBondContact CG-OD1 3.36Å
251	G	96.3	Very high	91.5	Very high	15 Å²	15	31.4 Å²	31.4	16%	0.155	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	-6.2	-172.7	0	0	0	0	0	114.7	V249 V384 N385	V249-G251 PolarHBondContact O-N 2.8Å; G251-V384 PolarHBondContact N-O 2.81Å; G251-V384 VanDerWaalsContact N-O 3.08Å; G251-N385 VanDerWaalsContact CA-OD1 3.32Å; G251-N385 WeakPolarHBondContact CA-OD1 3.29Å; G251-N385 PolarHBondContact N-OD1 2.88Å
252	G	97.3	Very high	92.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.			trans	108.4	148.6	169.8	0	0	0	0	0	113.9	E85 V249 E250 K254 L255	E85-G252 WeakPolarHBondContact OE1-CA 3.45Å; V249-G252 PolarHBondContact O-N 2.87Å; E250-G252 VanDerWaalsContact C-N 3.29Å; G252-K254 PolarHBondContact O-N 2.98Å; G252-K254 VanDerWaalsContact O-N 3.16Å; G252-L255 WeakPolarHBondContact O-CB 3.41Å; G252-L255 WeakPolarHBondContact O-CG 3.18Å; G252-L255 PolarHBondContact O-N 3.35Å; G252-L255 VanDerWaalsContact O-N 3.09Å
253	N	97.8	Very high	93.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.5	-173.5	-65.9	-24.9	0	0	0	112.5	L74 E85 G88 V249 L255 V256 M463	L74-N253 HydrophobicContact CD1-CB 4.39Å; L74-N253 HydrophobicContact CD2-CB 4.49Å; E85-N253 PolarHBondContact OE1-N 3.42Å; G88-N253 PolarHBondContact O-ND2 2.94Å; V249-N253 PolarHBondContact N-OD1 3.01Å; N253-L255 PolarHBondContact O-N 3.39Å; N253-L255 VanDerWaalsContact O-N 3.12Å; N253-V256 WeakPolarHBondContact O-CB 3.37Å; N253-V256 WeakPolarHBondContact O-CG2 3.28Å; N253-V256 PolarHBondContact O-N 2.87Å; N253-V256 VanDerWaalsContact O-N 3.11Å; N253-M463 HydrophobicContact CB-SD 4.45Å
254	K	97	Very high	94.7	Very high	56 Å²	56	37.5 Å²	37.5	24%	0.243	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-23.9	174.9	75.6	-178	-178.3	-175.6	0	113.9	L74 T76 G252 V256 C257 S258	L74-K254 HydrophobicContact CB-CB 4.34Å; L74-K254 WeakPolarHBondContact O-CB 3.35Å; T76-K254 HydrophobicContact CG2-CD 4.28Å; T76-K254 WeakPolarHBondContact OG1-CE 3.36Å; T76-K254 PolarHBondContact OG1-NZ 2.82Å; G252-K254 PolarHBondContact O-N 2.98Å; G252-K254 VanDerWaalsContact O-N 3.16Å; K254-V256 PolarHBondContact O-N 3.05Å; K254-C257 PolarHBondContact O-N 2.92Å; K254-S258 PolarHBondContact O-N 3.48Å
255	L	98.3	Very high	96.1	Very high	62 Å²	62	42 Å²	42	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-27.5	178.6	-66	-178.8	0	0	0	112.4	L107 G252 N253 G259	L107-L255 HydrophobicContact CD1-CB 4.29Å; L107-L255 HydrophobicContact CD2-CB 4.31Å; L107-L255 HydrophobicContact CD2-CD1 4.44Å; G252-L255 WeakPolarHBondContact O-CB 3.41Å; G252-L255 WeakPolarHBondContact O-CG 3.18Å; G252-L255 PolarHBondContact O-N 3.35Å; G252-L255 VanDerWaalsContact O-N 3.09Å; N253-L255 PolarHBondContact O-N 3.39Å; N253-L255 VanDerWaalsContact O-N 3.12Å; L255-G259 PolarHBondContact O-N 3.29Å
256	V	98.5	Very high	97	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-48.1	174.7	179.4	0	0	0	0	109.8	I43 M98 F101 V102 L105 L107 V249 N253 K254 S258 G259 L260	I43-V256 HydrophobicContact CD1-CG1 3.81Å; M98-V256 HydrophobicContact CE-CB 4.28Å; M98-V256 HydrophobicContact CE-CG1 4.06Å; M98-V256 HydrophobicContact CE-CG2 3.95Å; F101-V256 HydrophobicContact CB-CG1 3.82Å; F101-V256 HydrophobicContact CD2-CG1 3.98Å; F101-V256 HydrophobicContact CG-CG1 4.32Å; V102-V256 HydrophobicContact CG2-CG2 4.05Å; L105-V256 HydrophobicContact CD1-CG1 4.35Å; L107-V256 HydrophobicContact CD1-CG2 4.1Å; V249-V256 HydrophobicContact CG2-CG2 3.86Å; N253-V256 WeakPolarHBondContact O-CB 3.37Å; N253-V256 WeakPolarHBondContact O-CG2 3.28Å; N253-V256 PolarHBondContact O-N 2.87Å; N253-V256 VanDerWaalsContact O-N 3.11Å; K254-V256 PolarHBondContact O-N 3.05Å; V256-S258 PolarHBondContact O-N 3.37Å; V256-G259 PolarHBondContact O-N 2.84Å; V256-L260 HydrophobicContact CG1-CD1 3.85Å; V256-L260 HydrophobicContact CG1-CG 4.24Å; V256-L260 VanDerWaalsContact O-CG 3.29Å; V256-L260 WeakPolarHBondContact O-CG 3.47Å; V256-L260 PolarHBondContact O-N 3.08Å
257	C	98.5	Very high	97.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-48.7	-180	-59.6	0	0	0	0	112.4	I43 T46 V70 K254 G259 L260 L261	I43-C257 VanDerWaalsContact CA-SG 3.52Å; I43-C257 PolarHBondContact N-SG 3.3Å; T46-C257 HydrophobicContact CG2-CB 3.95Å; T46-C257 WeakPolarHBondContact OG1-CA 3.48Å; V70-C257 HydrophobicContact CG1-CB 3.92Å; K254-C257 PolarHBondContact O-N 2.92Å; C257-G259 VanDerWaalsContact C-N 3.28Å; C257-G259 PolarHBondContact O-N 3.02Å; C257-L260 PolarHBondContact O-N 3.38Å; C257-L261 PolarHBondContact O-N 3.3Å; C257-L261 VanDerWaalsContact O-N 3.17Å
258	S	97.9	Very high	97.7	Very high	42 Å²	42	39.9 Å²	39.9	29%	0.294	20%	0.204	S	C	.	.	H	α-helix	trans	-64.5	-34.9	178.5	-62.8	0	0	0	0	112.2	K254 V256 K262	K254-S258 PolarHBondContact O-N 3.48Å; V256-S258 PolarHBondContact O-N 3.37Å; S258-K262 WeakPolarHBondContact O-CG 3.32Å; S258-K262 PolarHBondContact O-N 3.06Å
259	G	98.4	Very high	97.8	Very high	12 Å²	12	41.1 Å²	41.1	12%	0.124	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-46	175.3	0	0	0	0	0	112.7	L105 L255 V256 C257 L261 K262 L263	L105-G259 VanDerWaalsContact CD2-CA 3.45Å; L105-G259 WeakPolarHBondContact CD2-O 3.34Å; L255-G259 PolarHBondContact O-N 3.29Å; V256-G259 PolarHBondContact O-N 2.84Å; C257-G259 VanDerWaalsContact C-N 3.28Å; C257-G259 PolarHBondContact O-N 3.02Å; G259-L261 VanDerWaalsContact C-N 3.34Å; G259-L261 PolarHBondContact O-N 2.97Å; G259-K262 WeakPolarHBondContact O-CB 3.27Å; G259-K262 PolarHBondContact O-N 3.21Å; G259-K262 VanDerWaalsContact O-N 3.11Å; G259-L263 PolarHBondContact O-N 3.5Å
260	L	98.8	Very high	97.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-39.7	-179.8	-71.8	173.6	0	0	0	112.2	I43 A47 H50 F101 L105 V256 C257 K262 L263 A264	I43-L260 HydrophobicContact CD1-CD1 4.08Å; A47-L260 HydrophobicContact CB-CD1 4.23Å; H50-L260 HydrophobicContact CB-CB 4.39Å; H50-L260 HydrophobicContact CB-CD2 3.98Å; F101-L260 HydrophobicContact CB-CD2 4.22Å; F101-L260 HydrophobicContact CD1-CD1 4.43Å; F101-L260 HydrophobicContact CD1-CD2 3.69Å; F101-L260 HydrophobicContact CD2-CD1 3.81Å; F101-L260 HydrophobicContact CD2-CD2 4.47Å; F101-L260 HydrophobicContact CE1-CD2 4.12Å; F101-L260 HydrophobicContact CE2-CD1 3.94Å; F101-L260 HydrophobicContact CG-CD1 4.06Å; F101-L260 HydrophobicContact CG-CD2 3.89Å; F101-L260 HydrophobicContact CG-CG 4.44Å; F101-L260 HydrophobicContact CZ-CD1 4.32Å; L105-L260 HydrophobicContact CD1-CG 4.45Å; V256-L260 HydrophobicContact CG1-CD1 3.85Å; V256-L260 HydrophobicContact CG1-CG 4.24Å; V256-L260 VanDerWaalsContact O-CG 3.29Å; V256-L260 WeakPolarHBondContact O-CG 3.47Å; V256-L260 PolarHBondContact O-N 3.08Å; C257-L260 PolarHBondContact O-N 3.38Å; L260-K262 VanDerWaalsContact C-N 3.3Å; L260-K262 PolarHBondContact O-N 3.45Å; L260-L263 PolarHBondContact O-N 2.92Å; L260-A264 VanDerWaalsContact O-CB 3.24Å; L260-A264 WeakPolarHBondContact O-CB 3.47Å; L260-A264 PolarHBondContact O-N 2.94Å
261	L	98.1	Very high	97.8	Very high	12 Å²	12	42.8 Å²	42.8	6%	0.063	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-43.4	172.7	-72.8	175.4	0	0	0	112.2	A41 T46 V64 V70 C257 G259 A264 K265 A266 L268	A41-L261 HydrophobicContact CB-CD1 4.41Å; T46-L261 HydrophobicContact CG2-CD1 3.94Å; T46-L261 HydrophobicContact CG2-CD2 3.8Å; T46-L261 HydrophobicContact CG2-CG 3.56Å; V64-L261 HydrophobicContact CB-CD2 4.04Å; V64-L261 HydrophobicContact CG1-CD2 4.14Å; V64-L261 HydrophobicContact CG2-CD2 3.69Å; V70-L261 HydrophobicContact CG1-CD1 3.75Å; V70-L261 HydrophobicContact CG2-CD1 4.01Å; C257-L261 PolarHBondContact O-N 3.3Å; C257-L261 VanDerWaalsContact O-N 3.17Å; G259-L261 VanDerWaalsContact C-N 3.34Å; G259-L261 PolarHBondContact O-N 2.97Å; L261-A264 PolarHBondContact O-N 3.47Å; L261-K265 PolarHBondContact O-N 3.13Å; L261-K265 VanDerWaalsContact O-N 3.16Å; L261-A266 HydrophobicContact CD2-CB 4.07Å; L261-A266 PolarHBondContact O-N 3.01Å; L261-A266 VanDerWaalsContact O-N 3.08Å; L261-L268 HydrophobicContact CD1-CD1 4.18Å; L261-L268 HydrophobicContact CD1-CD2 4.45Å
262	K	98.1	Very high	97.8	Very high	164 Å²	164	45.5 Å²	45.5	71%	0.713	23%	0.227	S	C	*	.	H	α-helix	trans	-66.9	-44.9	178.2	-68.8	175.2	-177.3	-178.7	0	111.7	S258 G259 L260 A264 K265	S258-K262 WeakPolarHBondContact O-CG 3.32Å; S258-K262 PolarHBondContact O-N 3.06Å; G259-K262 WeakPolarHBondContact O-CB 3.27Å; G259-K262 PolarHBondContact O-N 3.21Å; G259-K262 VanDerWaalsContact O-N 3.11Å; L260-K262 VanDerWaalsContact C-N 3.3Å; L260-K262 PolarHBondContact O-N 3.45Å; K262-A264 VanDerWaalsContact C-N 3.3Å; K262-A264 PolarHBondContact O-N 2.85Å; K262-K265 PolarHBondContact O-N 2.89Å; K262-K265 VanDerWaalsContact O-N 3.07Å
263	L	97.4	Very high	97.9	Very high	73 Å²	73	45.7 Å²	45.7	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-40	175.9	-73.7	-176.6	0	0	0	111.9	Q104 L105 G259 L260 K265	Q104-L263 HydrophobicContact CB-CD1 4.22Å; L105-L263 HydrophobicContact CD2-CD1 3.32Å; L105-L263 HydrophobicContact CD2-CD2 4.41Å; L105-L263 HydrophobicContact CD2-CG 3.57Å; L105-L263 HydrophobicContact CG-CD1 3.93Å; G259-L263 PolarHBondContact O-N 3.5Å; L260-L263 PolarHBondContact O-N 2.92Å; L263-K265 PolarHBondContact O-N 3.02Å
264	A	97.7	Very high	97.8	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.3	176.6	0	0	0	0	0	113.2	A49 H50 R53 L260 L261 K262 A266	A49-A264 HydrophobicContact CB-CB 4.03Å; H50-A264 HydrophobicContact CB-CB 4.5Å; R53-A264 HydrophobicContact CB-CB 4.35Å; R53-A264 PolarHBondContact NE-O 3.14Å; L260-A264 VanDerWaalsContact O-CB 3.24Å; L260-A264 WeakPolarHBondContact O-CB 3.47Å; L260-A264 PolarHBondContact O-N 2.94Å; L261-A264 PolarHBondContact O-N 3.47Å; K262-A264 VanDerWaalsContact C-N 3.3Å; K262-A264 PolarHBondContact O-N 2.85Å; A264-A266 HydrophobicContact CB-CB 4.09Å; A264-A266 PolarHBondContact O-N 2.86Å
265	K	97.9	Very high	97.9	Very high	168 Å²	168	46.1 Å²	46.1	73%	0.73	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	40.3	-166.3	-57.5	180	-177.7	177.6	0	111.1	L261 K262 L263	L261-K265 PolarHBondContact O-N 3.13Å; L261-K265 VanDerWaalsContact O-N 3.16Å; K262-K265 PolarHBondContact O-N 2.89Å; K262-K265 VanDerWaalsContact O-N 3.07Å; L263-K265 PolarHBondContact O-N 3.02Å
266	A	97.9	Very high	97.9	Very high	17 Å²	17	43.2 Å²	43.2	14%	0.14	22%	0.22	C	C	.	.			trans	-78.9	142.2	-179.9	0	0	0	0	0	109.9	A49 I62 V64 L261 A264 L268	A49-A266 HydrophobicContact CB-CB 4.22Å; I62-A266 HydrophobicContact CB-CB 4.4Å; I62-A266 HydrophobicContact CG2-CB 4.17Å; V64-A266 HydrophobicContact CG2-CB 3.89Å; L261-A266 HydrophobicContact CD2-CB 4.07Å; L261-A266 PolarHBondContact O-N 3.01Å; L261-A266 VanDerWaalsContact O-N 3.08Å; A264-A266 HydrophobicContact CB-CB 4.09Å; A264-A266 PolarHBondContact O-N 2.86Å; A266-L268 PolarHBondContact O-N 3.21Å
267	N	98.2	Very high	97.8	Very high	77 Å²	77	44.1 Å²	44.1	41%	0.412	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	112	174	179.7	44.8	0	0	0	109.1	I62 D63 V64 I269	I62-N267 PolarHBondContact O-N 2.95Å; D63-N267 WeakPolarHBondContact CA-O 3.47Å; D63-N267 VanDerWaalsContact OD1-CB 3.31Å; D63-N267 WeakPolarHBondContact OD1-CB 3.36Å; D63-N267 PolarHBondContact OD1-ND2 3.03Å; V64-N267 PolarHBondContact N-O 3.39Å; N267-I269 PolarHBondContact O-N 3.37Å
268	L	98.2	Very high	97.7	Very high	69 Å²	69	45.8 Å²	45.8	36%	0.361	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115.7	178	178.4	67	0	0	0	109.5	A41 V64 E66 V70 L261 A266	A41-L268 HydrophobicContact CB-CD1 4.22Å; V64-L268 HydrophobicContact CG1-CD1 4.49Å; E66-L268 HydrophobicContact CB-CD1 3.97Å; V70-L268 HydrophobicContact CG2-CD1 4.07Å; V70-L268 HydrophobicContact CG2-CD2 3.57Å; L261-L268 HydrophobicContact CD1-CD1 4.18Å; L261-L268 HydrophobicContact CD1-CD2 4.45Å; A266-L268 PolarHBondContact O-N 3.21Å
269	I	97.5	Very high	97.5	Very high	27 Å²	27	48 Å²	48	14%	0.138	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	111.8	175.8	-55.7	177.8	0	0	0	108.2	D63 V64 F65 E66 N267 A271 Y291	D63-I269 HydrophobicContact CB-CD1 3.89Å; V64-I269 PolarHBondContact O-N 2.94Å; F65-I269 WeakPolarHBondContact CA-O 3.37Å; F65-I269 HydrophobicContact CD1-CB 3.82Å; F65-I269 HydrophobicContact CD1-CD1 4.3Å; F65-I269 HydrophobicContact CD1-CG2 3.82Å; F65-I269 HydrophobicContact CE1-CB 3.98Å; F65-I269 HydrophobicContact CE1-CD1 3.64Å; F65-I269 HydrophobicContact CE1-CG1 4.4Å; F65-I269 HydrophobicContact CE1-CG2 3.79Å; F65-I269 HydrophobicContact CE2-CD1 4.45Å; F65-I269 HydrophobicContact CZ-CD1 3.74Å; E66-I269 PolarHBondContact N-O 3.35Å; N267-I269 PolarHBondContact O-N 3.37Å; I269-A271 VanDerWaalsContact C-N 3.28Å; I269-A271 HydrophobicContact CG2-CB 3.88Å; I269-A271 PolarHBondContact O-N 2.82Å; I269-Y291 HydrophobicContact CG2-CE2 4.36Å
270	Q	97.2	Very high	97	Very high	100 Å²	100	51.4 Å²	51.4	47%	0.467	27%	0.27	S	S	.	.			trans	-76.3	79.8	177.7	-168	72	32.9	0	0	110.3	E66 K67 G68	E66-Q270 CarbonylContact O-C 3.6Å; E66-Q270 VanDerWaalsContact O-CA 3.27Å; E66-Q270 WeakPolarHBondContact O-CA 3.41Å; E66-Q270 PolarHBondContact O-NE2 2.79Å; K67-Q270 PolarHBondContact O-NE2 2.77Å; G68-Q270 PolarHBondContact O-NE2 3.27Å
271	A	96.9	Very high	96.2	Very high	4 Å²	4	53 Å²	53	3%	0.033	28%	0.284	C	S	.	.			trans	-150.5	155.3	-175.6	0	0	0	0	0	112.6	F65 E66 K67 I269 Y291 A292 T293	F65-A271 HydrophobicContact CD1-CB 4.24Å; E66-A271 CarbonylContact C-O 3.41Å; E66-A271 VanDerWaalsContact C-O 3.31Å; E66-A271 PolarHBondContact O-N 3.13Å; K67-A271 PolarHBondContact N-O 3.4Å; I269-A271 VanDerWaalsContact C-N 3.28Å; I269-A271 HydrophobicContact CG2-CB 3.88Å; I269-A271 PolarHBondContact O-N 2.82Å; A271-Y291 HydrophobicContact CB-CD2 3.68Å; A271-Y291 HydrophobicContact CB-CG 4.28Å; A271-A292 WeakPolarHBondContact CA-O 3.07Å; A271-A292 WeakPolarHBondContact CB-O 3.31Å; A271-T293 HydrophobicContact CB-CG2 3.9Å
272	Q	97.1	Very high	95.3	Very high	73 Å²	73	56.2 Å²	56.2	34%	0.341	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.2	169.1	-179	170.4	11.5	0	0	109.9	K67 Y291 A292 S317	K67-Q272 HydrophobicContact CB-CB 3.94Å; K67-Q272 HydrophobicContact CB-CG 4.48Å; K67-Q272 HydrophobicContact CD-CG 4.24Å; Q272-Y291 CarbonylContact O-C 3.4Å; Q272-Y291 WeakPolarHBondContact O-CA 3.29Å; Q272-Y291 WeakPolarHBondContact O-CB 3.48Å; Q272-A292 PolarHBondContact N-O 3.08Å; Q272-A292 PolarHBondContact O-N 3.17Å; Q272-S317 PolarHBondContact NE2-O 3.43Å
273	V	98.1	Very high	94.1	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	131.3	166.8	179.2	0	0	0	0	108.7	V39 F65 I276 L289	V39-V273 HydrophobicContact CG1-CB 3.92Å; V39-V273 HydrophobicContact CG1-CG2 3.88Å; V39-V273 HydrophobicContact CG2-CB 4.4Å; V39-V273 HydrophobicContact CG2-CG1 4.49Å; V39-V273 HydrophobicContact CG2-CG2 3.95Å; F65-V273 HydrophobicContact CB-CG2 3.69Å; F65-V273 HydrophobicContact CD1-CG2 4.03Å; F65-V273 HydrophobicContact CD2-CG2 4.11Å; F65-V273 HydrophobicContact CG-CG2 3.68Å; V273-I276 HydrophobicContact CG1-CD1 4.44Å; V273-I276 HydrophobicContact CG1-CG1 4Å; V273-L289 HydrophobicContact CG1-CD2 4.48Å; V273-L289 HydrophobicContact CG1-CG 4.28Å; V273-L289 HydrophobicContact CG2-CD2 4.38Å
274	T	97.1	Very high	93.3	Very high	48 Å²	48	58 Å²	58	29%	0.294	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-30.9	-175	56.9	0	0	0	0	112.4	N290 G318 S320	T274-N290 PolarHBondContact N-O 3.01Å; T274-N290 PolarHBondContact OG1-O 3.38Å; T274-G318 WeakPolarHBondContact CA-O 3.49Å; T274-S320 PolarHBondContact O-N 3.38Å
275	T	97.8	Very high	92.9	Very high	17 Å²	17	59.9 Å²	59.9	10%	0.104	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	139.3	179.8	-49.5	0	0	0	0	110.6	L289 N290 S320 Q322	T275-L289 WeakPolarHBondContact O-CA 3.46Å; T275-N290 PolarHBondContact N-O 2.89Å; T275-N290 PolarHBondContact O-N 3.49Å; T275-S320 VanDerWaalsContact CA-O 3.25Å; T275-S320 WeakPolarHBondContact CA-O 3.46Å; T275-S320 WeakPolarHBondContact CG2-O 3.4Å; T275-Q322 HydrophobicContact CG2-CB 4.09Å; T275-Q322 HydrophobicContact CG2-CG 3.82Å
276	I	98.1	Very high	92.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.8	169.3	-59.2	172.6	0	0	0	106.4	V273 Y287 L289 V305 V307 I319 S320 F321 Q322 F324 L450	V273-I276 HydrophobicContact CG1-CD1 4.44Å; V273-I276 HydrophobicContact CG1-CG1 4Å; I276-Y287 HydrophobicContact CG2-CD1 4.06Å; I276-L289 HydrophobicContact CG1-CD1 4.15Å; I276-L289 HydrophobicContact CG1-CG 4.16Å; I276-L289 HydrophobicContact CG2-CD1 4.11Å; I276-V305 HydrophobicContact CD1-CG1 4.23Å; I276-V307 HydrophobicContact CD1-CG2 3.91Å; I276-I319 HydrophobicContact CD1-CG2 3.87Å; I276-I319 HydrophobicContact CG1-CG2 4.08Å; I276-S320 PolarHBondContact N-O 3.25Å; I276-F321 HydrophobicContact CB-CD1 3.98Å; I276-F321 HydrophobicContact CB-CE1 4.07Å; I276-F321 HydrophobicContact CD1-CE1 3.78Å; I276-F321 HydrophobicContact CD1-CZ 4.27Å; I276-F321 HydrophobicContact CG1-CE1 4.44Å; I276-F321 HydrophobicContact CG2-CD1 4.33Å; I276-F321 HydrophobicContact CG2-CE1 4.33Å; I276-F321 WeakPolarHBondContact O-CA 3.45Å; I276-Q322 PolarHBondContact O-N 3.39Å; I276-Q322 VanDerWaalsContact O-N 3.08Å; I276-F324 HydrophobicContact CG2-CZ 4.39Å; I276-F324 WeakPolarHBondContact O-CE2 3.36Å; I276-L450 HydrophobicContact CG2-CD1 4.39Å
277	S	97.3	Very high	92.7	Very high	19 Å²	19	53.6 Å²	53.6	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.9	177.5	52.2	0	0	0	0	111.2	Y287 Q288 Q322	S277-Y287 WeakPolarHBondContact O-CA 3.42Å; S277-Q288 PolarHBondContact N-O 3.32Å; S277-Q288 VanDerWaalsContact N-O 3.09Å; S277-Q288 PolarHBondContact O-N 3.17Å; S277-Q322 VanDerWaalsContact CA-O 3.27Å; S277-Q322 WeakPolarHBondContact CA-O 3.46Å; S277-Q322 WeakPolarHBondContact CB-O 3.38Å
278	P	96.3	Very high	92.7	Very high	36 Å²	36	52.5 Å²	52.5	23%	0.234	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	147.2	174.2	32.2	-32.1	0	0	0	109.7	T285 Q286 Y287 Q322 G323 F324	P278-T285 HydrophobicContact CB-CG2 3.95Å; P278-Q286 CarbonylContact C-O 3.53Å; P278-Y287 HydrophobicContact CB-CD1 4.5Å; P278-Y287 HydrophobicContact CB-CE1 4.23Å; P278-Q322 WeakPolarHBondContact CD-O 3.28Å; P278-G323 WeakPolarHBondContact CG-O 3.41Å; P278-F324 HydrophobicContact CG-CD1 4.15Å; P278-F324 HydrophobicContact CG-CE1 4.26Å; P278-F324 HydrophobicContact CG-CG 4.3Å; P278-F324 HydrophobicContact CG-CZ 4.49Å
279	H	93.6	Very high	92.7	Very high	87 Å²	87	49.2 Å²	49.2	40%	0.403	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	123.6	177.1	-171.1	77.1	0	0	0	108.9	A281 Q286 F301	H279-A281 PolarHBondContact O-N 2.87Å; H279-Q286 PolarHBondContact N-O 2.97Å; H279-Q286 PolarHBondContact O-N 3.34Å; H279-F301 HydrophobicContact CB-CD1 4.28Å; H279-F301 HydrophobicContact CB-CE1 3.9Å; H279-F301 AromaticContact CD2-CE1 3.8Å; H279-F301 AromaticContact CG-CE1 3.65Å
280	A	87.2	Confident	92.7	Very high	85 Å²	85	50.2 Å²	50.2	70%	0.702	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	118.4	178.7	0	0	0	0	0	110.1
281	A	81.6	Confident	92.7	Very high	34 Å²	34	47.4 Å²	47.4	28%	0.281	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	67.6	178.5	0	0	0	0	0	109.7	H279 E283 S284 Q286	H279-A281 PolarHBondContact O-N 2.87Å; A281-E283 PolarHBondContact O-N 2.91Å; A281-S284 CarbonylContact C-O 3.53Å; A281-S284 WeakPolarHBondContact CA-O 3.21Å; A281-S284 PolarHBondContact N-O 2.68Å; A281-S284 PolarHBondContact O-N 3.21Å; A281-S284 PolarHBondContact O-OG 3.04Å; A281-Q286 HydrophobicContact CB-CB 4.25Å; A281-Q286 HydrophobicContact CB-CG 3.83Å
282	G	79.4	Confident	92.7	Very high	79 Å²	79	48.6 Å²	48.6	81%	0.814	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	-121	-175.1	0	0	0	0	0	111.7
283	E	73.9	Confident	92.5	Very high	211 Å²	211	47.3 Å²	47.3	99%	0.986	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8	176.1	-66	-172.4	171.4	0	0	113.4	A281	A281-E283 PolarHBondContact O-N 2.91Å
284	S	80.3	Confident	91.9	Very high	63 Å²	63	55.7 Å²	55.7	44%	0.441	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	156.6	178.4	63.5	0	0	0	0	112.3	A281	A281-S284 CarbonylContact C-O 3.53Å; A281-S284 WeakPolarHBondContact CA-O 3.21Å; A281-S284 PolarHBondContact N-O 2.68Å; A281-S284 PolarHBondContact O-N 3.21Å; A281-S284 PolarHBondContact O-OG 3.04Å
285	T	88.5	Confident	91.4	Very high	40 Å²	40	59.3 Å²	59.3	25%	0.245	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.8	172.7	-59.1	0	0	0	0	109.3	P278 Y287	P278-T285 HydrophobicContact CB-CG2 3.95Å; T285-Y287 HydrophobicContact CG2-CE2 4.48Å
286	Q	94.8	Very high	91.2	Very high	53 Å²	53	65.1 Å²	65.1	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	166.8	165.3	-73.3	-173.6	-32.3	0	0	110	P278 H279 A281 Y302 D303	P278-Q286 CarbonylContact C-O 3.53Å; H279-Q286 PolarHBondContact N-O 2.97Å; H279-Q286 PolarHBondContact O-N 3.34Å; A281-Q286 HydrophobicContact CB-CB 4.25Å; A281-Q286 HydrophobicContact CB-CG 3.83Å; Q286-Y302 CarbonylContact C-O 3.55Å; Q286-Y302 WeakPolarHBondContact CA-O 3.37Å; Q286-D303 PolarHBondContact NE2-OD1 2.87Å
287	Y	97.3	Very high	91	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127	178.8	-67.8	-82	0	0	0	111	I276 S277 P278 T285 F301 Y302 V305 F324 H447 E448 L450	I276-Y287 HydrophobicContact CG2-CD1 4.06Å; S277-Y287 WeakPolarHBondContact O-CA 3.42Å; P278-Y287 HydrophobicContact CB-CD1 4.5Å; P278-Y287 HydrophobicContact CB-CE1 4.23Å; T285-Y287 HydrophobicContact CG2-CE2 4.48Å; Y287-F301 CarbonylContact O-C 3.51Å; Y287-F301 VanDerWaalsContact O-CA 3.3Å; Y287-F301 WeakPolarHBondContact O-CA 3.34Å; Y287-Y302 PolarHBondContact N-O 2.87Å; Y287-Y302 PolarHBondContact O-N 3.34Å; Y287-V305 HydrophobicContact CD2-CG2 3.87Å; Y287-V305 HydrophobicContact CG-CG2 3.78Å; Y287-F324 HydrophobicContact CE1-CE1 4.02Å; Y287-F324 HydrophobicContact CE1-CZ 4.12Å; Y287-H447 AromaticContact CZ-ND1 3.85Å; Y287-H447 WeakPolarHBondContact OH-CB 3.38Å; Y287-H447 PolarHBondContact OH-ND1 3.06Å; Y287-E448 WeakPolarHBondContact CE2-O 3.33Å; Y287-E448 PolarHBondContact OH-O 2.98Å; Y287-L450 HydrophobicContact CE1-CB 4.04Å; Y287-L450 HydrophobicContact CE1-CD2 4.12Å; Y287-L450 HydrophobicContact CE2-CB 4.15Å; Y287-L450 WeakPolarHBondContact OH-CB 3.45Å
288	Q	97.7	Very high	90.9	Very high	54 Å²	54	74.2 Å²	74.2	25%	0.252	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.5	168.5	-169.1	178.4	3.9	0	0	109.2	S277 S299 E300 F301	S277-Q288 PolarHBondContact N-O 3.32Å; S277-Q288 VanDerWaalsContact N-O 3.09Å; S277-Q288 PolarHBondContact O-N 3.17Å; Q288-S299 WeakPolarHBondContact CG-OG 3.36Å; Q288-S299 PolarHBondContact NE2-OG 2.96Å; Q288-E300 WeakPolarHBondContact CA-O 3.3Å; Q288-F301 HydrophobicContact CB-CD1 3.95Å; Q288-F301 HydrophobicContact CB-CE1 3.64Å; Q288-F301 HydrophobicContact CB-CZ 4.31Å; Q288-F301 HydrophobicContact CG-CD1 4.36Å; Q288-F301 HydrophobicContact CG-CE1 3.9Å; Q288-F301 HydrophobicContact CG-CZ 4.06Å
289	L	98.1	Very high	90.9	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.7	174.2	-93.6	63	0	0	0	109.6	A37 V39 F65 V273 T275 I276 S299 E300 Y302 V305	A37-L289 HydrophobicContact CB-CD2 3.53Å; V39-L289 HydrophobicContact CG2-CD2 4.3Å; F65-L289 HydrophobicContact CD2-CD2 4.29Å; F65-L289 HydrophobicContact CE2-CD2 3.95Å; V273-L289 HydrophobicContact CG1-CD2 4.48Å; V273-L289 HydrophobicContact CG1-CG 4.28Å; V273-L289 HydrophobicContact CG2-CD2 4.38Å; T275-L289 WeakPolarHBondContact O-CA 3.46Å; I276-L289 HydrophobicContact CG1-CD1 4.15Å; I276-L289 HydrophobicContact CG1-CG 4.16Å; I276-L289 HydrophobicContact CG2-CD1 4.11Å; L289-S299 VanDerWaalsContact O-CA 3.28Å; L289-S299 WeakPolarHBondContact O-CA 3.44Å; L289-E300 PolarHBondContact N-O 3.33Å; L289-E300 PolarHBondContact O-N 3.38Å; L289-E300 VanDerWaalsContact O-N 3.11Å; L289-Y302 HydrophobicContact CB-CD2 4.13Å; L289-Y302 HydrophobicContact CB-CE2 4.05Å; L289-Y302 HydrophobicContact CD1-CD2 4.11Å; L289-Y302 HydrophobicContact CD2-CD2 4.02Å; L289-Y302 HydrophobicContact CD2-CE2 4.06Å; L289-Y302 HydrophobicContact CG-CD2 4.3Å; L289-V305 HydrophobicContact CD1-CG1 4.25Å; L289-V305 HydrophobicContact CD1-CG2 3.66Å; L289-V305 HydrophobicContact CD2-CG1 4.48Å
290	N	98	Very high	91.1	Very high	47 Å²	47	74 Å²	74	25%	0.251	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.1	169.1	-64.1	-39.8	0	0	0	109.6	T274 T275 G298 S299	T274-N290 PolarHBondContact N-O 3.01Å; T274-N290 PolarHBondContact OG1-O 3.38Å; T275-N290 PolarHBondContact N-O 2.89Å; T275-N290 PolarHBondContact O-N 3.49Å; N290-G298 WeakPolarHBondContact CA-O 3.38Å; N290-S299 VanDerWaalsContact OD1-CB 3.32Å; N290-S299 WeakPolarHBondContact OD1-CB 3.24Å; N290-S299 PolarHBondContact OD1-OG 3.05Å
291	Y	97.4	Very high	91.5	Very high	41 Å²	41	73.3 Å²	73.3	16%	0.161	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157	-178.7	59.9	-91.4	0	0	0	112	F65 I269 A271 Q272 K297 G298 E300	F65-Y291 HydrophobicContact CD1-CD1 4.36Å; F65-Y291 HydrophobicContact CD1-CG 4.17Å; F65-Y291 AromaticContact CE1-CD1 3.44Å; F65-Y291 HydrophobicContact CE1-CD1 3.44Å; F65-Y291 VanDerWaalsContact CE1-CD1 3.44Å; F65-Y291 HydrophobicContact CE1-CD2 4.03Å; F65-Y291 AromaticContact CE1-CE1 3.7Å; F65-Y291 HydrophobicContact CE1-CE1 3.7Å; F65-Y291 HydrophobicContact CE1-CE2 4.26Å; F65-Y291 AromaticContact CE1-CG 3.61Å; F65-Y291 HydrophobicContact CE1-CG 3.61Å; F65-Y291 AromaticContact CZ-CD1 3.88Å; F65-Y291 HydrophobicContact CZ-CD1 3.88Å; F65-Y291 AromaticContact CZ-CE1 3.97Å; F65-Y291 HydrophobicContact CZ-CE1 3.97Å; F65-Y291 HydrophobicContact CZ-CG 4.48Å; I269-Y291 HydrophobicContact CG2-CE2 4.36Å; A271-Y291 HydrophobicContact CB-CD2 3.68Å; A271-Y291 HydrophobicContact CB-CG 4.28Å; Q272-Y291 CarbonylContact O-C 3.4Å; Q272-Y291 WeakPolarHBondContact O-CA 3.29Å; Q272-Y291 WeakPolarHBondContact O-CB 3.48Å; Y291-K297 WeakPolarHBondContact O-CA 3.3Å; Y291-G298 PolarHBondContact N-O 2.88Å; Y291-G298 PolarHBondContact O-N 3.19Å; Y291-E300 HydrophobicContact CE1-CB 4.21Å
292	A	96.1	Very high	92.3	Very high	30 Å²	30	71.8 Å²	71.8	25%	0.248	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.8	176.1	0	0	0	0	0	109.8	A271 Q272 K297	A271-A292 WeakPolarHBondContact CA-O 3.07Å; A271-A292 WeakPolarHBondContact CB-O 3.31Å; Q272-A292 PolarHBondContact N-O 3.08Å; Q272-A292 PolarHBondContact O-N 3.17Å; A292-K297 HydrophobicContact CB-CG 4.41Å
293	T	93.1	Very high	93.1	Very high	46 Å²	46	68.6 Å²	68.6	28%	0.282	36%	0.36	S	S	.	.			trans	-85.5	-178.1	162.7	70	0	0	0	0	108.9	A271 T295 E296	A271-T293 HydrophobicContact CB-CG2 3.9Å; T293-T295 PolarHBondContact O-N 2.71Å; T293-T295 PolarHBondContact OG1-N 3.48Å; T293-T295 PolarHBondContact OG1-OG1 3.06Å; T293-E296 PolarHBondContact N-O 3.11Å; T293-E296 PolarHBondContact OG1-N 2.96Å; T293-E296 PolarHBondContact OG1-O 2.84Å; T293-E296 VanDerWaalsContact OG1-O 3.14Å
294	L	86.8	Confident	94.3	Very high	180 Å²	180	58.6 Å²	58.6	94%	0.942	31%	0.313	S	S	*	.	S	Bend	trans	-63.1	-22.4	173.6	-68.8	172.8	0	0	0	113.2
295	T	86.4	Confident	95.1	Very high	123 Å²	123	55.6 Å²	55.6	76%	0.755	29%	0.292	S	S	*	.	S	Bend	trans	-120	-26.8	-170.5	52.6	0	0	0	0	113.5	T293	T293-T295 PolarHBondContact O-N 2.71Å; T293-T295 PolarHBondContact OG1-N 3.48Å; T293-T295 PolarHBondContact OG1-OG1 3.06Å
296	E	92.8	Very high	95.6	Very high	139 Å²	139	53.7 Å²	53.7	65%	0.65	28%	0.28	S	S	*	.			trans	-142.2	155	-166.9	-67.1	176.1	-170.2	0	0	111.7	T293	T293-E296 PolarHBondContact N-O 3.11Å; T293-E296 PolarHBondContact OG1-N 2.96Å; T293-E296 PolarHBondContact OG1-O 2.84Å; T293-E296 VanDerWaalsContact OG1-O 3.14Å
297	K	94.6	Very high	95.8	Very high	191 Å²	191	51.1 Å²	51.1	83%	0.83	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.9	166.5	-67.1	-176.5	179.6	-177.9	0	108.2	Y291 A292	Y291-K297 WeakPolarHBondContact O-CA 3.3Å; A292-K297 HydrophobicContact CB-CG 4.41Å
298	G	95.2	Very high	95.8	Very high	20 Å²	20	51.7 Å²	51.7	21%	0.206	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	159.7	177	0	0	0	0	0	111.3	N290 Y291	N290-G298 WeakPolarHBondContact CA-O 3.38Å; Y291-G298 PolarHBondContact N-O 2.88Å; Y291-G298 PolarHBondContact O-N 3.19Å
299	S	96.4	Very high	95.7	Very high	50 Å²	50	50.5 Å²	50.5	35%	0.35	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138.9	171.5	173.2	0	0	0	0	108.4	Q288 L289 N290	Q288-S299 WeakPolarHBondContact CG-OG 3.36Å; Q288-S299 PolarHBondContact NE2-OG 2.96Å; L289-S299 VanDerWaalsContact O-CA 3.28Å; L289-S299 WeakPolarHBondContact O-CA 3.44Å; N290-S299 VanDerWaalsContact OD1-CB 3.32Å; N290-S299 WeakPolarHBondContact OD1-CB 3.24Å; N290-S299 PolarHBondContact OD1-OG 3.05Å
300	E	97.1	Very high	95.6	Very high	68 Å²	68	51.1 Å²	51.1	32%	0.318	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	153.8	-179.3	-170.5	63.2	-122.5	0	0	111	K35 Q288 L289 Y291 Y302	K35-E300 HydrophobicContact CD-CG 4.26Å; K35-E300 IonicContact NZ-OE1 3.23Å; K35-E300 PolarHBondContact NZ-OE1 3.13Å; K35-E300 IonicContact NZ-OE2 3.43Å; K35-E300 PolarHBondContact NZ-OE2 3.14Å; Q288-E300 WeakPolarHBondContact CA-O 3.3Å; L289-E300 PolarHBondContact N-O 3.33Å; L289-E300 PolarHBondContact O-N 3.38Å; L289-E300 VanDerWaalsContact O-N 3.11Å; Y291-E300 HydrophobicContact CE1-CB 4.21Å; E300-Y302 HydrophobicContact CB-CE2 3.71Å; E300-Y302 HydrophobicContact CG-CE1 4.48Å; E300-Y302 HydrophobicContact CG-CE2 3.79Å
301	F	97.2	Very high	95.4	Very high	71 Å²	71	50.1 Å²	50.1	31%	0.311	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141	180	-67.4	-85.5	0	0	0	112.1	K35 H279 Y287 Q288	K35-F301 WeakPolarHBondContact CD-O 3.19Å; H279-F301 HydrophobicContact CB-CD1 4.28Å; H279-F301 HydrophobicContact CB-CE1 3.9Å; H279-F301 AromaticContact CD2-CE1 3.8Å; H279-F301 AromaticContact CG-CE1 3.65Å; Y287-F301 CarbonylContact O-C 3.51Å; Y287-F301 VanDerWaalsContact O-CA 3.3Å; Y287-F301 WeakPolarHBondContact O-CA 3.34Å; Q288-F301 HydrophobicContact CB-CD1 3.95Å; Q288-F301 HydrophobicContact CB-CE1 3.64Å; Q288-F301 HydrophobicContact CB-CZ 4.31Å; Q288-F301 HydrophobicContact CG-CD1 4.36Å; Q288-F301 HydrophobicContact CG-CE1 3.9Å; Q288-F301 HydrophobicContact CG-CZ 4.06Å
302	Y	97.6	Very high	95.1	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.8	-178.1	-64	-83.4	0	0	0	111.8	K35 A37 D63 F65 Q286 Y287 L289 E300	K35-Y302 HydrophobicContact CB-CD1 3.84Å; K35-Y302 HydrophobicContact CB-CE1 4.33Å; K35-Y302 HydrophobicContact CD-CD1 4.01Å; K35-Y302 HydrophobicContact CD-CE1 3.76Å; K35-Y302 HydrophobicContact CG-CD1 3.75Å; K35-Y302 HydrophobicContact CG-CE1 3.71Å; A37-Y302 HydrophobicContact CB-CD1 3.54Å; A37-Y302 HydrophobicContact CB-CD2 3.68Å; A37-Y302 HydrophobicContact CB-CE1 3.78Å; A37-Y302 HydrophobicContact CB-CE2 3.9Å; A37-Y302 HydrophobicContact CB-CG 3.49Å; A37-Y302 VanDerWaalsContact CB-CG 3.49Å; D63-Y302 HydrophobicContact CB-CE1 3.89Å; D63-Y302 VanDerWaalsContact OD2-CE1 3.24Å; D63-Y302 WeakPolarHBondContact OD2-CE1 3.14Å; D63-Y302 PolarHBondContact OD2-OH 2.96Å; F65-Y302 HydrophobicContact CE2-CE2 4.02Å; F65-Y302 AromaticContact CE2-CZ 3.81Å; F65-Y302 WeakPolarHBondContact CE2-OH 3.46Å; F65-Y302 HydrophobicContact CZ-CE2 4.09Å; F65-Y302 AromaticContact CZ-CZ 3.92Å; F65-Y302 WeakPolarHBondContact CZ-OH 3.44Å; Q286-Y302 CarbonylContact C-O 3.55Å; Q286-Y302 WeakPolarHBondContact CA-O 3.37Å; Y287-Y302 PolarHBondContact N-O 2.87Å; Y287-Y302 PolarHBondContact O-N 3.34Å; L289-Y302 HydrophobicContact CB-CD2 4.13Å; L289-Y302 HydrophobicContact CB-CE2 4.05Å; L289-Y302 HydrophobicContact CD1-CD2 4.11Å; L289-Y302 HydrophobicContact CD2-CD2 4.02Å; L289-Y302 HydrophobicContact CD2-CE2 4.06Å; L289-Y302 HydrophobicContact CG-CD2 4.3Å; E300-Y302 HydrophobicContact CB-CE2 3.71Å; E300-Y302 HydrophobicContact CG-CE1 4.48Å; E300-Y302 HydrophobicContact CG-CE2 3.79Å
303	D	96.5	Very high	94.7	Very high	13 Å²	13	52 Å²	52	7%	0.07	29%	0.285	C	S	.	.	S	Bend	trans	-79.1	-34.1	176.7	-56.8	-51.5	0	0	0	111.4	P33 S34 K35 Q286 S449 W481	P33-D303 HydrophobicContact CB-CB 3.97Å; S34-D303 WeakPolarHBondContact CA-OD2 3.28Å; S34-D303 PolarHBondContact N-OD2 3.23Å; K35-D303 PolarHBondContact N-OD2 2.86Å; K35-D303 PolarHBondContact O-N 3.17Å; Q286-D303 PolarHBondContact NE2-OD1 2.87Å; D303-S449 WeakPolarHBondContact O-CB 3.29Å; D303-W481 HydrophobicContact CB-CH2 3.74Å; D303-W481 HydrophobicContact CB-CZ3 3.9Å
304	I	97.8	Very high	94.2	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138	179.9	-55.4	176.6	0	0	0	109	P33 I36 A37 F56 S449 Y451 A477 W481	P33-I304 HydrophobicContact CB-CD1 4.12Å; P33-I304 HydrophobicContact CB-CG1 4.45Å; P33-I304 HydrophobicContact CG-CD1 4.01Å; I36-I304 WeakPolarHBondContact CA-O 3.31Å; I36-I304 HydrophobicContact CB-CB 4.45Å; I36-I304 HydrophobicContact CD1-CD1 4.15Å; I36-I304 HydrophobicContact CG1-CB 4.07Å; I36-I304 HydrophobicContact CG1-CD1 4.33Å; I36-I304 HydrophobicContact CG1-CG1 4.48Å; I36-I304 HydrophobicContact CG2-CB 3.98Å; I36-I304 HydrophobicContact CG2-CG2 4.13Å; A37-I304 PolarHBondContact N-O 3.32Å; F56-I304 HydrophobicContact CE2-CD1 4.28Å; F56-I304 HydrophobicContact CZ-CD1 4Å; I304-S449 WeakPolarHBondContact CA-O 3.15Å; I304-Y451 HydrophobicContact CG2-CD2 4.1Å; I304-Y451 HydrophobicContact CG2-CE2 3.89Å; I304-A477 HydrophobicContact CD1-CB 4.31Å; I304-W481 HydrophobicContact CD1-CE3 4.02Å; I304-W481 HydrophobicContact CG1-CE3 4.2Å; I304-W481 HydrophobicContact CG1-CZ3 4.25Å
305	V	98.6	Very high	94.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.2	176.6	-179.4	0	0	0	0	109.8	A37 I276 Y287 L289 V307 S449 L450 Y451	A37-V305 HydrophobicContact CB-CG2 4.38Å; A37-V305 CarbonylContact O-C 3.39Å; A37-V305 WeakPolarHBondContact O-CA 3.47Å; I276-V305 HydrophobicContact CD1-CG1 4.23Å; Y287-V305 HydrophobicContact CD2-CG2 3.87Å; Y287-V305 HydrophobicContact CG-CG2 3.78Å; L289-V305 HydrophobicContact CD1-CG1 4.25Å; L289-V305 HydrophobicContact CD1-CG2 3.66Å; L289-V305 HydrophobicContact CD2-CG1 4.48Å; V305-V307 HydrophobicContact CG1-CG2 4.49Å; V305-S449 PolarHBondContact N-O 3.26Å; V305-L450 HydrophobicContact CB-CD1 3.58Å; V305-L450 HydrophobicContact CG1-CD1 3.55Å; V305-L450 WeakPolarHBondContact O-CA 3.39Å; V305-Y451 PolarHBondContact O-N 3.47Å
306	V	98.8	Very high	94.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.4	172.7	-174.7	0	0	0	0	109.6	A37 I38 V39 T48 A308 Y451 L453 I473	A37-V306 PolarHBondContact O-N 3.11Å; I38-V306 CarbonylContact C-O 3.51Å; I38-V306 WeakPolarHBondContact CA-O 3.15Å; I38-V306 HydrophobicContact CG1-CB 4.32Å; V39-V306 PolarHBondContact N-O 2.81Å; T48-V306 HydrophobicContact CG2-CB 4.35Å; T48-V306 HydrophobicContact CG2-CG1 4.18Å; T48-V306 HydrophobicContact CG2-CG2 4.05Å; V306-A308 PolarHBondContact O-N 3.46Å; V306-Y451 HydrophobicContact CG2-CD2 4.28Å; V306-L453 HydrophobicContact CG1-CB 4.39Å; V306-I473 HydrophobicContact CG1-CD1 4.19Å; V306-I473 HydrophobicContact CG1-CG2 4.1Å; V306-I473 HydrophobicContact CG2-CG2 3.77Å
307	V	98.6	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	108.1	174	-174.3	0	0	0	0	108.8	I276 V305 T309 L311 I319 F321 L450 Y451 Y452 L453	I276-V307 HydrophobicContact CD1-CG2 3.91Å; V305-V307 HydrophobicContact CG1-CG2 4.49Å; V307-T309 HydrophobicContact CG1-CG2 3.96Å; V307-L311 HydrophobicContact CG1-CD1 4.07Å; V307-L311 HydrophobicContact CG1-CD2 3.89Å; V307-L311 HydrophobicContact CG1-CG 3.99Å; V307-I319 HydrophobicContact CG1-CD1 4.31Å; V307-F321 HydrophobicContact CG2-CZ 4.35Å; V307-L450 HydrophobicContact CG2-CD1 4.14Å; V307-Y451 PolarHBondContact N-O 3.26Å; V307-Y452 HydrophobicContact CB-CD2 4.32Å; V307-Y452 HydrophobicContact CG1-CD2 4.33Å; V307-L453 PolarHBondContact O-N 3.05Å
308	A	98	Very high	93.8	Very high	11 Å²	11	28.3 Å²	28.3	9%	0.091	19%	0.194	C	C	.	.			trans	-110.9	34	179.9	0	0	0	0	0	112.4	I38 V39 V306 L453 N454	I38-A308 HydrophobicContact CG2-CB 4.27Å; V39-A308 CarbonylContact O-C 3.41Å; V39-A308 VanDerWaalsContact O-CA 3.24Å; V39-A308 WeakPolarHBondContact O-CA 3.44Å; V39-A308 WeakPolarHBondContact O-CB 3.37Å; V39-A308 PolarHBondContact O-N 2.95Å; V306-A308 PolarHBondContact O-N 3.46Å; A308-L453 HydrophobicContact CB-CB 4.23Å; A308-L453 HydrophobicContact CB-CD1 4.2Å; A308-N454 WeakPolarHBondContact CA-OD1 3.46Å; A308-N454 PolarHBondContact O-OD1 3.44Å
309	T	95.4	Very high	93.8	Very high	30 Å²	30	28.4 Å²	28.4	18%	0.184	19%	0.19	C	C	.	.	S	Bend	trans	-132.4	144.5	169.9	-169.9	0	0	0	0	110.2	V39 V307 L311 I319 Y452 N454	V39-T309 HydrophobicContact CG1-CG2 4.32Å; V39-T309 PolarHBondContact O-N 2.8Å; V307-T309 HydrophobicContact CG1-CG2 3.96Å; T309-L311 PolarHBondContact O-N 3.41Å; T309-I319 HydrophobicContact CG2-CD1 3.68Å; T309-Y452 WeakPolarHBondContact O-CE2 3.39Å; T309-N454 WeakPolarHBondContact CA-OD1 3.29Å; T309-N454 PolarHBondContact N-OD1 2.95Å
310	P	94.5	Very high	93.7	Very high	13 Å²	13	28.5 Å²	28.5	8%	0.084	19%	0.19	C	C	.	.			trans	-57	138.7	177	-24.8	34.4	0	0	0	112.9	V315 S317 Y335 N454	P310-V315 HydrophobicContact CB-CB 4.26Å; P310-V315 HydrophobicContact CB-CG1 4.1Å; P310-V315 HydrophobicContact CB-CG2 3.98Å; P310-V315 HydrophobicContact CG-CG1 4.46Å; P310-S317 WeakPolarHBondContact O-CB 3.39Å; P310-Y335 HydrophobicContact CB-CD2 4.49Å; P310-Y335 HydrophobicContact CB-CE1 4.04Å; P310-Y335 HydrophobicContact CB-CE2 3.79Å; P310-Y335 WeakPolarHBondContact CB-OH 3.24Å; P310-Y335 HydrophobicContact CG-CE1 3.68Å; P310-Y335 HydrophobicContact CG-CE2 4.34Å; P310-Y335 WeakPolarHBondContact CG-OH 3.47Å; P310-N454 HydrophobicContact CG-CB 4.5Å
311	L	94.3	Very high	93.7	Very high	25 Å²	25	28 Å²	28	13%	0.131	19%	0.187	C	C	.	.			trans	-105	-6.3	-176.5	-72.5	176.4	0	0	0	114.2	V307 T309 I319 F321 I331 L446 Y452	V307-L311 HydrophobicContact CG1-CD1 4.07Å; V307-L311 HydrophobicContact CG1-CD2 3.89Å; V307-L311 HydrophobicContact CG1-CG 3.99Å; T309-L311 PolarHBondContact O-N 3.41Å; L311-I319 HydrophobicContact CD2-CB 4.44Å; L311-I319 HydrophobicContact CD2-CD1 4.18Å; L311-F321 HydrophobicContact CD1-CE2 3.83Å; L311-F321 HydrophobicContact CD1-CZ 3.79Å; L311-F321 HydrophobicContact CD2-CE2 3.79Å; L311-F321 HydrophobicContact CD2-CZ 4.04Å; L311-F321 HydrophobicContact CG-CE2 4.41Å; L311-I331 HydrophobicContact CB-CD1 3.91Å; L311-I331 HydrophobicContact CB-CG1 4.42Å; L311-I331 HydrophobicContact CD1-CD1 3.75Å; L311-I331 HydrophobicContact CG-CD1 4.45Å; L311-L446 HydrophobicContact CD1-CD1 3.99Å; L311-Y452 HydrophobicContact CB-CE2 4.31Å; L311-Y452 HydrophobicContact CD1-CD2 3.81Å; L311-Y452 HydrophobicContact CD1-CE2 3.95Å; L311-Y452 HydrophobicContact CD1-CG 4.27Å; L311-Y452 HydrophobicContact CG-CD2 4.21Å; L311-Y452 HydrophobicContact CG-CE2 3.87Å; L311-Y452 PolarHBondContact N-OH 3.16Å
312	Q	91.8	Very high	93.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	19%	0.194	C	C	.	.	S	Bend	trans	-58.9	139.8	178	-72.8	74.3	7.7	0	0	110.9	S314 V315 I331 Y335 Y452 W458	Q312-S314 PolarHBondContact O-N 3.42Å; Q312-S314 VanDerWaalsContact O-N 3.1Å; Q312-V315 PolarHBondContact O-N 3.01Å; Q312-I331 HydrophobicContact CG-CG2 4.39Å; Q312-Y335 HydrophobicContact CB-CD2 4.32Å; Q312-Y335 HydrophobicContact CB-CE2 4.46Å; Q312-Y335 HydrophobicContact CG-CD2 4.34Å; Q312-Y335 HydrophobicContact CG-CE2 4.17Å; Q312-Y335 VanDerWaalsContact OE1-CE2 3.27Å; Q312-Y452 PolarHBondContact OE1-OH 3.01Å; Q312-W458 HydrophobicContact CG-CZ2 3.9Å
313	S	86.6	Confident	93.4	Very high	111 Å²	111	32.4 Å²	32.4	78%	0.776	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-52.9	-37	-179.2	58.5	0	0	0	0	113.2	V315 G316	S313-V315 PolarHBondContact O-N 3.32Å; S313-V315 VanDerWaalsContact O-N 3.16Å; S313-G316 PolarHBondContact O-N 3.48Å; S313-G316 VanDerWaalsContact O-N 3.15Å
314	S	83.9	Confident	93.3	Very high	45 Å²	45	32.5 Å²	32.5	32%	0.315	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-58.7	-25.4	177.6	65.2	0	0	0	0	114.9	Q312 S334 Y335 Q430	Q312-S314 PolarHBondContact O-N 3.42Å; Q312-S314 VanDerWaalsContact O-N 3.1Å; S314-S334 VanDerWaalsContact OG-CA 3.26Å; S314-S334 WeakPolarHBondContact OG-CA 3.2Å; S314-Y335 PolarHBondContact OG-N 3.18Å; S314-Q430 PolarHBondContact O-NE2 3.39Å
315	V	86.7	Confident	92.9	Very high	29 Å²	29	41 Å²	41	18%	0.176	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-88.3	-20.3	-178.1	179.1	0	0	0	0	112	P310 Q312 S313 Y335 Q430	P310-V315 HydrophobicContact CB-CB 4.26Å; P310-V315 HydrophobicContact CB-CG1 4.1Å; P310-V315 HydrophobicContact CB-CG2 3.98Å; P310-V315 HydrophobicContact CG-CG1 4.46Å; Q312-V315 PolarHBondContact O-N 3.01Å; S313-V315 PolarHBondContact O-N 3.32Å; S313-V315 VanDerWaalsContact O-N 3.16Å; V315-Y335 HydrophobicContact CG2-CD1 4.14Å; V315-Y335 HydrophobicContact CG2-CD2 3.58Å; V315-Y335 HydrophobicContact CG2-CE2 4.26Å; V315-Y335 HydrophobicContact CG2-CG 3.52Å; V315-Q430 VanDerWaalsContact CA-OE1 3.3Å
316	G	85.5	Confident	92.5	Very high	50 Å²	50	46.6 Å²	46.6	52%	0.515	30%	0.302	S	S	.	.			trans	56.7	53.8	-178.3	0	0	0	0	0	111.9	S313 G318	S313-G316 PolarHBondContact O-N 3.48Å; S313-G316 VanDerWaalsContact O-N 3.15Å; G316-G318 PolarHBondContact O-N 3.05Å
317	S	88.3	Confident	92.1	Very high	14 Å²	14	54.8 Å²	54.8	10%	0.098	34%	0.34	C	S	.	.			trans	-51.4	-34.1	179.6	68.3	0	0	0	0	112.2	Q272 P310 I319	Q272-S317 PolarHBondContact NE2-O 3.43Å; P310-S317 WeakPolarHBondContact O-CB 3.39Å; S317-I319 VanDerWaalsContact C-N 3.29Å; S317-I319 PolarHBondContact OG-N 3.27Å
318	G	90.4	Very high	91.7	Very high	43 Å²	43	56.3 Å²	56.3	44%	0.443	35%	0.348	S	S	.	.			trans	82.3	7.7	-175.5	0	0	0	0	0	113	T274 G316	T274-G318 WeakPolarHBondContact CA-O 3.49Å; G316-G318 PolarHBondContact O-N 3.05Å
319	I	95.3	Very high	91.1	Very high	22 Å²	22	60 Å²	60	11%	0.113	37%	0.371	C	S	.	.			trans	-94	127	179.8	-57.1	170.8	0	0	0	108.9	V39 I276 V307 T309 L311 S317 F321	V39-I319 HydrophobicContact CG1-CD1 3.85Å; I276-I319 HydrophobicContact CD1-CG2 3.87Å; I276-I319 HydrophobicContact CG1-CG2 4.08Å; V307-I319 HydrophobicContact CG1-CD1 4.31Å; T309-I319 HydrophobicContact CG2-CD1 3.68Å; L311-I319 HydrophobicContact CD2-CB 4.44Å; L311-I319 HydrophobicContact CD2-CD1 4.18Å; S317-I319 VanDerWaalsContact C-N 3.29Å; S317-I319 PolarHBondContact OG-N 3.27Å; I319-F321 HydrophobicContact CG2-CE2 4.17Å; I319-F321 HydrophobicContact CG2-CZ 4.16Å
320	S	95.3	Very high	90.7	Very high	51 Å²	51	66.3 Å²	66.3	36%	0.357	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.1	170.5	179.3	0	0	0	0	109.9	T274 T275 I276 Q322	T274-S320 PolarHBondContact O-N 3.38Å; T275-S320 VanDerWaalsContact CA-O 3.25Å; T275-S320 WeakPolarHBondContact CA-O 3.46Å; T275-S320 WeakPolarHBondContact CG2-O 3.4Å; I276-S320 PolarHBondContact N-O 3.25Å; S320-Q322 PolarHBondContact OG-NE2 3.2Å
321	F	96.1	Very high	90.5	Very high	58 Å²	58	67 Å²	67	25%	0.254	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.2	171.2	-65.9	-83.3	0	0	0	108.8	I276 V307 L311 I319 F324 L328 L446 L450	I276-F321 HydrophobicContact CB-CD1 3.98Å; I276-F321 HydrophobicContact CB-CE1 4.07Å; I276-F321 HydrophobicContact CD1-CE1 3.78Å; I276-F321 HydrophobicContact CD1-CZ 4.27Å; I276-F321 HydrophobicContact CG1-CE1 4.44Å; I276-F321 HydrophobicContact CG2-CD1 4.33Å; I276-F321 HydrophobicContact CG2-CE1 4.33Å; I276-F321 WeakPolarHBondContact O-CA 3.45Å; V307-F321 HydrophobicContact CG2-CZ 4.35Å; L311-F321 HydrophobicContact CD1-CE2 3.83Å; L311-F321 HydrophobicContact CD1-CZ 3.79Å; L311-F321 HydrophobicContact CD2-CE2 3.79Å; L311-F321 HydrophobicContact CD2-CZ 4.04Å; L311-F321 HydrophobicContact CG-CE2 4.41Å; I319-F321 HydrophobicContact CG2-CE2 4.17Å; I319-F321 HydrophobicContact CG2-CZ 4.16Å; F321-F324 HydrophobicContact CB-CD2 3.86Å; F321-F324 HydrophobicContact CB-CE2 3.66Å; F321-F324 AromaticContact CD1-CE2 3.75Å; F321-F324 HydrophobicContact CD1-CE2 3.75Å; F321-F324 AromaticContact CD1-CZ 3.97Å; F321-F324 HydrophobicContact CD1-CZ 3.97Å; F321-F324 HydrophobicContact CG-CE2 4.19Å; F321-L328 HydrophobicContact CB-CD1 3.95Å; F321-L328 HydrophobicContact CD1-CD1 3.6Å; F321-L328 HydrophobicContact CD2-CD1 4.39Å; F321-L328 HydrophobicContact CE1-CD1 4.17Å; F321-L328 HydrophobicContact CG-CD1 3.72Å; F321-L446 HydrophobicContact CE1-CD1 4.28Å; F321-L446 HydrophobicContact CZ-CD1 4.06Å; F321-L450 HydrophobicContact CD1-CD2 4.39Å; F321-L450 HydrophobicContact CE1-CD2 4.07Å
322	Q	96	Very high	90.3	Very high	100 Å²	100	69.7 Å²	69.7	47%	0.467	43%	0.432	S	S	.	.			trans	-127.5	145.8	-174	-64.7	-179.5	8.7	0	0	110.9	T275 I276 S277 P278 S320 F324	T275-Q322 HydrophobicContact CG2-CB 4.09Å; T275-Q322 HydrophobicContact CG2-CG 3.82Å; I276-Q322 PolarHBondContact O-N 3.39Å; I276-Q322 VanDerWaalsContact O-N 3.08Å; S277-Q322 VanDerWaalsContact CA-O 3.27Å; S277-Q322 WeakPolarHBondContact CA-O 3.46Å; S277-Q322 WeakPolarHBondContact CB-O 3.38Å; P278-Q322 WeakPolarHBondContact CD-O 3.28Å; S320-Q322 PolarHBondContact OG-NE2 3.2Å; Q322-F324 VanDerWaalsContact C-N 3.35Å; Q322-F324 WeakPolarHBondContact O-CD2 3.33Å; Q322-F324 PolarHBondContact O-N 3Å
323	G	93.1	Very high	90.2	Very high	65 Å²	65	71 Å²	71	67%	0.67	45%	0.446	S	S	*	.	S	Bend	trans	73.5	19.2	174.6	0	0	0	0	0	115.5	P278	P278-G323 WeakPolarHBondContact CG-O 3.41Å
324	F	94.3	Very high	90.4	Very high	14 Å²	14	67.3 Å²	67.3	6%	0.061	42%	0.42	C	S	.	.			trans	-85.9	132.8	174.7	-70.6	-92.7	0	0	0	111.5	I276 P278 Y287 F321 Q322 P326 Q327 L328 H447 L450	I276-F324 HydrophobicContact CG2-CZ 4.39Å; I276-F324 WeakPolarHBondContact O-CE2 3.36Å; P278-F324 HydrophobicContact CG-CD1 4.15Å; P278-F324 HydrophobicContact CG-CE1 4.26Å; P278-F324 HydrophobicContact CG-CG 4.3Å; P278-F324 HydrophobicContact CG-CZ 4.49Å; Y287-F324 HydrophobicContact CE1-CE1 4.02Å; Y287-F324 HydrophobicContact CE1-CZ 4.12Å; F321-F324 HydrophobicContact CB-CD2 3.86Å; F321-F324 HydrophobicContact CB-CE2 3.66Å; F321-F324 AromaticContact CD1-CE2 3.75Å; F321-F324 HydrophobicContact CD1-CE2 3.75Å; F321-F324 AromaticContact CD1-CZ 3.97Å; F321-F324 HydrophobicContact CD1-CZ 3.97Å; F321-F324 HydrophobicContact CG-CE2 4.19Å; Q322-F324 VanDerWaalsContact C-N 3.35Å; Q322-F324 WeakPolarHBondContact O-CD2 3.33Å; Q322-F324 PolarHBondContact O-N 3Å; F324-P326 CarbonylContact C-O 3.58Å; F324-P326 CarbonylContact O-C 3.57Å; F324-Q327 PolarHBondContact O-N 2.96Å; F324-L328 HydrophobicContact CB-CG 4.11Å; F324-L328 HydrophobicContact CD1-CD1 3.96Å; F324-L328 HydrophobicContact CD1-CD2 3.82Å; F324-L328 HydrophobicContact CD1-CG 3.8Å; F324-L328 HydrophobicContact CD2-CD1 4.07Å; F324-L328 HydrophobicContact CD2-CG 4.17Å; F324-L328 HydrophobicContact CE1-CD1 3.89Å; F324-L328 HydrophobicContact CE1-CD2 4.28Å; F324-L328 HydrophobicContact CE1-CG 4.24Å; F324-L328 HydrophobicContact CE2-CD1 4.01Å; F324-L328 HydrophobicContact CG-CD1 4.05Å; F324-L328 HydrophobicContact CG-CD2 4.23Å; F324-L328 HydrophobicContact CG-CG 3.76Å; F324-L328 HydrophobicContact CZ-CD1 3.92Å; F324-H447 HydrophobicContact CD1-CB 4.33Å; F324-H447 HydrophobicContact CE1-CB 3.94Å; F324-L450 HydrophobicContact CE1-CD2 3.81Å; F324-L450 HydrophobicContact CZ-CD2 3.72Å
325	E	90.1	Very high	90.8	Very high	179 Å²	179	65.4 Å²	65.4	84%	0.836	41%	0.406	S	S	*	.	S	Bend	trans	-130.5	112	175.5	-66.1	-173.4	-178.8	0	0	109.9
326	P	89.1	Confident	91	Very high	117 Å²	117	65.3 Å²	65.3	76%	0.76	40%	0.404	S	S	*	.	S	Bend	cis	-65.5	163.2	-6.3	31	-35.9	0	0	0	112.3	F324 L328	F324-P326 CarbonylContact C-O 3.58Å; F324-P326 CarbonylContact O-C 3.57Å; P326-L328 PolarHBondContact O-N 2.87Å
327	Q	90.9	Very high	91.1	Very high	172 Å²	172	66.3 Å²	66.3	80%	0.804	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-58	140.9	174.5	-70.7	-173.1	-9.1	0	0	110.6	F324	F324-Q327 PolarHBondContact O-N 2.96Å
328	L	91.3	Very high	91.1	Very high	33 Å²	33	65.9 Å²	65.9	17%	0.173	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-63.7	139	175.5	-62.7	-176.4	0	0	0	109.9	F321 F324 P326 L446 H447 L450	F321-L328 HydrophobicContact CB-CD1 3.95Å; F321-L328 HydrophobicContact CD1-CD1 3.6Å; F321-L328 HydrophobicContact CD2-CD1 4.39Å; F321-L328 HydrophobicContact CE1-CD1 4.17Å; F321-L328 HydrophobicContact CG-CD1 3.72Å; F324-L328 HydrophobicContact CB-CG 4.11Å; F324-L328 HydrophobicContact CD1-CD1 3.96Å; F324-L328 HydrophobicContact CD1-CD2 3.82Å; F324-L328 HydrophobicContact CD1-CG 3.8Å; F324-L328 HydrophobicContact CD2-CD1 4.07Å; F324-L328 HydrophobicContact CD2-CG 4.17Å; F324-L328 HydrophobicContact CE1-CD1 3.89Å; F324-L328 HydrophobicContact CE1-CD2 4.28Å; F324-L328 HydrophobicContact CE1-CG 4.24Å; F324-L328 HydrophobicContact CE2-CD1 4.01Å; F324-L328 HydrophobicContact CG-CD1 4.05Å; F324-L328 HydrophobicContact CG-CD2 4.23Å; F324-L328 HydrophobicContact CG-CG 3.76Å; F324-L328 HydrophobicContact CZ-CD1 3.92Å; P326-L328 PolarHBondContact O-N 2.87Å; L328-L446 HydrophobicContact CD1-CB 4.37Å; L328-L446 WeakPolarHBondContact CD2-O 3.3Å; L328-H447 HydrophobicContact CD2-CB 4.43Å; L328-L450 HydrophobicContact CD1-CD2 4.27Å
329	P	85	Confident	91.4	Very high	88 Å²	88	63.9 Å²	63.9	57%	0.571	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-64.9	141.1	177.9	27.3	-33.9	0	0	0	110.6	I331	P329-I331 PolarHBondContact O-N 3.21Å
330	D	86.6	Confident	91.4	Very high	163 Å²	163	62.9 Å²	62.9	87%	0.872	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-62	130	171.2	-78	-30.7	0	0	0	110.1	A332	D330-A332 PolarHBondContact O-N 3.01Å; D330-A332 VanDerWaalsContact O-N 3.13Å
331	I	90.2	Very high	91.5	Very high	28 Å²	28	60.4 Å²	60.4	14%	0.144	35%	0.349	C	S	.	.			trans	-81.3	101.2	176.3	-50.2	-161.8	0	0	0	108.5	L311 Q312 P329 P442 L446 Y452	L311-I331 HydrophobicContact CB-CD1 3.91Å; L311-I331 HydrophobicContact CB-CG1 4.42Å; L311-I331 HydrophobicContact CD1-CD1 3.75Å; L311-I331 HydrophobicContact CG-CD1 4.45Å; Q312-I331 HydrophobicContact CG-CG2 4.39Å; P329-I331 PolarHBondContact O-N 3.21Å; I331-P442 HydrophobicContact CG2-CB 3.87Å; I331-P442 HydrophobicContact CG2-CG 3.88Å; I331-L446 HydrophobicContact CD1-CD2 4.17Å; I331-Y452 HydrophobicContact CD1-CD1 3.67Å; I331-Y452 HydrophobicContact CD1-CE1 3.56Å; I331-Y452 HydrophobicContact CD1-CG 4.31Å; I331-Y452 HydrophobicContact CG2-CE1 4.37Å
332	A	89.6	Confident	91.6	Very high	80 Å²	80	57.7 Å²	57.7	66%	0.661	34%	0.337	S	S	*	.			trans	-64.4	164	-177	0	0	0	0	0	113.5	D330	D330-A332 PolarHBondContact O-N 3.01Å; D330-A332 VanDerWaalsContact O-N 3.13Å
333	G	89.2	Confident	91.7	Very high	29 Å²	29	53 Å²	53	30%	0.299	32%	0.315	S	S	.	.			trans	94.1	-177.1	174.4	0	0	0	0	0	114.4
334	S	92.3	Very high	92	Very high	34 Å²	34	51.2 Å²	51.2	24%	0.238	29%	0.289	C	S	.	.			trans	-138.5	161.4	-176.8	61.1	0	0	0	0	111.3	S314 R434	S314-S334 VanDerWaalsContact OG-CA 3.26Å; S314-S334 WeakPolarHBondContact OG-CA 3.2Å; S334-R434 WeakPolarHBondContact O-CB 3.3Å; S334-R434 PolarHBondContact O-N 2.76Å
335	Y	92	Very high	92.1	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	142.2	172.8	-85.7	-121.8	0	0	0	111.2	P310 Q312 S314 V315 Y432 P433 W458	P310-Y335 HydrophobicContact CB-CD2 4.49Å; P310-Y335 HydrophobicContact CB-CE1 4.04Å; P310-Y335 HydrophobicContact CB-CE2 3.79Å; P310-Y335 WeakPolarHBondContact CB-OH 3.24Å; P310-Y335 HydrophobicContact CG-CE1 3.68Å; P310-Y335 HydrophobicContact CG-CE2 4.34Å; P310-Y335 WeakPolarHBondContact CG-OH 3.47Å; Q312-Y335 HydrophobicContact CB-CD2 4.32Å; Q312-Y335 HydrophobicContact CB-CE2 4.46Å; Q312-Y335 HydrophobicContact CG-CD2 4.34Å; Q312-Y335 HydrophobicContact CG-CE2 4.17Å; Q312-Y335 VanDerWaalsContact OE1-CE2 3.27Å; S314-Y335 PolarHBondContact OG-N 3.18Å; V315-Y335 HydrophobicContact CG2-CD1 4.14Å; V315-Y335 HydrophobicContact CG2-CD2 3.58Å; V315-Y335 HydrophobicContact CG2-CE2 4.26Å; V315-Y335 HydrophobicContact CG2-CG 3.52Å; Y335-Y432 CarbonylContact C-O 3.53Å; Y335-Y432 VanDerWaalsContact CA-O 3.25Å; Y335-Y432 WeakPolarHBondContact CA-O 3.28Å; Y335-Y432 WeakPolarHBondContact CB-O 3.5Å; Y335-Y432 VanDerWaalsContact CD1-C 3.47Å; Y335-Y432 WeakPolarHBondContact CD1-O 3.26Å; Y335-P433 HydrophobicContact CE1-CG 4.44Å; Y335-P433 HydrophobicContact CE2-CG 4.34Å; Y335-W458 HydrophobicContact CE2-CZ2 4.24Å
336	H	90.1	Very high	92.4	Very high	28 Å²	28	45.3 Å²	45.3	13%	0.13	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.3	172	-175.1	84.2	0	0	0	110.4	Y224 G225 Q226 A431 Y432 R434	Y224-H336 PolarHBondContact O-CD2 3.04Å; G225-H336 PolarHBondContact O-CE1 2.77Å; G225-H336 PolarHBondContact O-NE2 3.48Å; G225-H336 VanDerWaalsContact O-NE2 3.15Å; Q226-H336 HydrophobicContact CG-CB 4.41Å; H336-A431 PolarHBondContact O-N 2.87Å; H336-Y432 PolarHBondContact N-O 3.45Å; H336-R434 HydrophobicContact CB-CB 4.49Å
337	H	89.1	Confident	92.8	Very high	71 Å²	71	40 Å²	40	33%	0.329	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.6	175.2	-78.1	-98.9	0	0	0	110.2	D428 W429 Q430	H337-D428 IonicContact CE1-OD1 3.86Å; H337-D428 IonicContact CG-OD1 3.19Å; H337-D428 IonicContact ND1-OD1 3.47Å; H337-D428 PolarHBondContact ND1-OD1 3.09Å; H337-D428 IonicContact ND1-OD2 2.87Å; H337-W429 CarbonylContact C-O 3.31Å; H337-W429 VanDerWaalsContact CA-O 3.32Å; H337-W429 WeakPolarHBondContact CA-O 3.49Å; H337-Q430 WeakPolarHBondContact CE1-CG 3.29Å; H337-Q430 PolarHBondContact CE1-NE2 3.34Å; H337-Q430 PolarHBondContact NE2-NE2 3.31Å; H337-Q430 VanDerWaalsContact NE2-NE2 3.18Å
338	T	88.4	Confident	93.1	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	112.9	174.7	-58.7	0	0	0	0	108.1	F404 W429	T338-F404 HydrophobicContact CG2-CD1 3.69Å; T338-F404 HydrophobicContact CG2-CE1 3.96Å; T338-W429 PolarHBondContact N-O 3.24Å; T338-W429 WeakPolarHBondContact O-CB 3.46Å; T338-W429 PolarHBondContact O-N 3.07Å
339	V	94.8	Very high	93.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	126.6	179.3	-175.8	0	0	0	0	109.9	F404 S405 P408 V426 T427 D428	V339-F404 WeakPolarHBondContact O-CA 3.39Å; V339-S405 WeakPolarHBondContact CB-O 3.43Å; V339-S405 PolarHBondContact N-O 3.37Å; V339-S405 PolarHBondContact O-N 3.21Å; V339-P408 HydrophobicContact CG1-CB 4.5Å; V339-P408 HydrophobicContact CG1-CG 4.35Å; V339-P408 HydrophobicContact CG2-CG 4.28Å; V339-V426 HydrophobicContact CG1-CG1 3.56Å; V339-T427 WeakPolarHBondContact CA-O 3.15Å; V339-D428 HydrophobicContact CG2-CB 4.4Å
340	A	96.8	Very high	93.8	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	111	170.4	0	0	0	0	0	109.2	S86 F404 T427	S86-A340 WeakPolarHBondContact O-CB 3.39Å; A340-F404 HydrophobicContact CB-CD1 4.17Å; A340-F404 HydrophobicContact CB-CE1 3.94Å; A340-T427 PolarHBondContact N-O 3.34Å; A340-T427 PolarHBondContact O-N 2.88Å
341	S	97.8	Very high	94.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.6	172.3	-61.4	0	0	0	0	109.5	K402 V403 Q425	S341-K402 WeakPolarHBondContact O-CA 3.44Å; S341-V403 PolarHBondContact N-O 3.43Å; S341-V403 PolarHBondContact O-N 3.29Å; S341-Q425 CarbonylContact C-O 3.55Å; S341-Q425 WeakPolarHBondContact CA-O 3.24Å
342	I	98.1	Very high	94.5	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	113.2	174.3	-66	174.5	0	0	0	108.4	V77 V79 I381 V400 Y401 K402 V424 Q425	V77-I342 HydrophobicContact CG2-CB 4.1Å; V77-I342 HydrophobicContact CG2-CD1 3.2Å; V77-I342 HydrophobicContact CG2-CG1 4.16Å; V77-I342 HydrophobicContact CG2-CG2 4.27Å; V79-I342 HydrophobicContact CG2-CG2 3.77Å; I342-I381 HydrophobicContact CD1-CD1 4.17Å; I342-I381 HydrophobicContact CG1-CD1 4.21Å; I342-I381 HydrophobicContact CG2-CD1 4.1Å; I342-V400 HydrophobicContact CG2-CG1 3.51Å; I342-Y401 CarbonylContact C-O 3.56Å; I342-Y401 VanDerWaalsContact CA-O 3.29Å; I342-Y401 WeakPolarHBondContact CA-O 3.44Å; I342-K402 HydrophobicContact CG1-CB 4.5Å; I342-K402 HydrophobicContact CG1-CG 4.3Å; I342-V424 CarbonylContact O-C 3.52Å; I342-V424 WeakPolarHBondContact O-CA 3.38Å; I342-Q425 HydrophobicContact CB-CB 4.49Å; I342-Q425 PolarHBondContact N-O 3.43Å; I342-Q425 PolarHBondContact O-N 3.2Å; I342-Q425 PolarHBondContact O-OE1 2.82Å
343	V	98	Very high	94.8	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124	-171.5	-175.2	0	0	0	0	109.3	V400 Y401 L414 F418 Y421 S423 V424	V343-V400 CarbonylContact O-C 3.54Å; V343-V400 WeakPolarHBondContact O-CA 3.44Å; V343-Y401 PolarHBondContact N-O 3.27Å; V343-Y401 PolarHBondContact O-N 3Å; V343-L414 HydrophobicContact CG2-CD2 4.1Å; V343-F418 HydrophobicContact CB-CE1 4.05Å; V343-F418 HydrophobicContact CB-CE2 3.97Å; V343-F418 HydrophobicContact CB-CZ 3.67Å; V343-F418 HydrophobicContact CG1-CD1 3.97Å; V343-F418 HydrophobicContact CG1-CD2 4.01Å; V343-F418 HydrophobicContact CG1-CE1 3.84Å; V343-F418 HydrophobicContact CG1-CE2 3.88Å; V343-F418 HydrophobicContact CG1-CG 4.06Å; V343-F418 HydrophobicContact CG1-CZ 3.79Å; V343-F418 HydrophobicContact CG2-CE2 3.79Å; V343-F418 HydrophobicContact CG2-CZ 3.91Å; V343-Y421 HydrophobicContact CG1-CG 4.27Å; V343-S423 WeakPolarHBondContact CA-O 3.44Å; V343-V424 HydrophobicContact CG1-CG2 4.23Å; V343-V424 HydrophobicContact CG2-CG1 4.13Å; V343-V424 HydrophobicContact CG2-CG2 4.15Å
344	H	97.9	Very high	95.1	Very high	29 Å²	29	23.6 Å²	23.6	13%	0.134	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.2	168.7	179.1	-150	0	0	0	108.8	V79 G399 V400 Y421 Y422 S423	V79-H344 HydrophobicContact CG1-CB 3.71Å; H344-G399 CarbonylContact C-O 3.49Å; H344-G399 WeakPolarHBondContact CA-O 3.47Å; H344-V400 HydrophobicContact CB-CG2 4.48Å; H344-Y421 CarbonylContact O-C 3.48Å; H344-Y421 WeakPolarHBondContact O-CA 3.48Å; H344-Y421 WeakPolarHBondContact O-CB 3.24Å; H344-Y422 AromaticContact CE1-CD2 3.67Å; H344-Y422 AromaticContact ND1-CD2 3.74Å; H344-Y422 AromaticContact NE2-CD2 3.99Å; H344-Y422 PolarHBondContact O-N 3.12Å; H344-S423 PolarHBondContact N-O 2.89Å
345	G	97	Very high	95.1	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	-165.4	-172.9	0	0	0	0	0	115.4	A398 G399 Y401 S420	G345-A398 WeakPolarHBondContact O-CA 3.38Å; G345-G399 PolarHBondContact N-O 2.72Å; G345-G399 PolarHBondContact O-N 3.17Å; G345-Y401 WeakPolarHBondContact O-CE2 3.26Å; G345-S420 WeakPolarHBondContact CA-O 3.37Å
346	Y	97.1	Very high	95.2	Very high	68 Å²	68	30.2 Å²	30.2	27%	0.267	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.5	179.5	-62.1	-93.6	0	0	0	109.6	N348 Q396 A398 F418 R419 S420 Y422	Y346-N348 PolarHBondContact O-N 3.1Å; Y346-Q396 WeakPolarHBondContact CE1-O 3.27Å; Y346-A398 HydrophobicContact CE1-CB 4.29Å; Y346-A398 HydrophobicContact CE2-CB 4.03Å; Y346-F418 CarbonylContact O-C 3.45Å; Y346-F418 VanDerWaalsContact O-CA 3.29Å; Y346-F418 WeakPolarHBondContact O-CA 3.28Å; Y346-R419 PolarHBondContact O-N 3.31Å; Y346-S420 VanDerWaalsContact CD2-OG 3.28Å; Y346-S420 WeakPolarHBondContact CD2-OG 3.47Å; Y346-S420 PolarHBondContact N-O 2.82Å; Y346-Y422 AromaticContact CE2-CE2 3.9Å; Y346-Y422 HydrophobicContact CE2-CE2 3.9Å; Y346-Y422 PolarHBondContact OH-OH 3.29Å
347	L	96.9	Very high	95.3	Very high	7 Å²	7	29.6 Å²	29.6	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.3	178.3	-169.5	75.2	0	0	0	110.5	C349 F352 F360 Y401 L417 F418	L347-C349 VanDerWaalsContact C-N 3.32Å; L347-C349 PolarHBondContact O-N 3.11Å; L347-F352 HydrophobicContact CD1-CE2 4.11Å; L347-F352 HydrophobicContact CD2-CD2 4.42Å; L347-F352 HydrophobicContact CD2-CE2 4.03Å; L347-F352 HydrophobicContact CG-CE2 4.11Å; L347-F360 HydrophobicContact CD2-CD1 4.47Å; L347-F360 HydrophobicContact CD2-CE1 3.81Å; L347-F360 HydrophobicContact CD2-CZ 3.84Å; L347-Y401 HydrophobicContact CB-CE1 3.92Å; L347-Y401 HydrophobicContact CB-CE2 4.33Å; L347-Y401 HydrophobicContact CD1-CD1 4.28Å; L347-Y401 HydrophobicContact CD1-CE1 4.22Å; L347-Y401 HydrophobicContact CD2-CE1 4.11Å; L347-Y401 HydrophobicContact CG-CE1 4.32Å; L347-L417 WeakPolarHBondContact CD1-O 3.47Å; L347-F418 HydrophobicContact CD1-CD1 4.38Å; L347-F418 HydrophobicContact CD1-CE1 4Å; L347-F418 HydrophobicContact CD1-CZ 4.38Å
348	N	96.9	Very high	95.4	Very high	32 Å²	32	32.6 Å²	32.6	17%	0.171	18%	0.181	C	C	.	.			trans	-81.4	78.6	172.2	-172.4	16.4	0	0	0	110.7	Y346 S350 Y351 T416 L417 R419	Y346-N348 PolarHBondContact O-N 3.1Å; N348-S350 PolarHBondContact O-N 3.38Å; N348-S350 VanDerWaalsContact O-N 3.08Å; N348-Y351 WeakPolarHBondContact O-CB 3.35Å; N348-Y351 PolarHBondContact O-N 3.3Å; N348-T416 WeakPolarHBondContact CB-O 3.5Å; N348-T416 PolarHBondContact ND2-O 3.24Å; N348-L417 WeakPolarHBondContact CB-O 3.19Å; N348-L417 PolarHBondContact N-O 3.11Å; N348-R419 HydrophobicContact CB-CG 3.96Å
349	C	96.4	Very high	95.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-57	-25.4	178.4	-62.6	0	0	0	0	113.5	L347 Y351 F352 G353 F354 P357 F360 P395	L347-C349 VanDerWaalsContact C-N 3.32Å; L347-C349 PolarHBondContact O-N 3.11Å; C349-Y351 VanDerWaalsContact C-N 3.28Å; C349-Y351 PolarHBondContact O-N 3.35Å; C349-F352 CarbonylContact O-C 3.56Å; C349-F352 WeakPolarHBondContact O-CA 3.13Å; C349-F352 PolarHBondContact O-N 3.49Å; C349-G353 PolarHBondContact O-N 3.43Å; C349-F354 CarbonylContact C-O 3.5Å; C349-F354 HydrophobicContact CB-CB 3.98Å; C349-F354 WeakPolarHBondContact CB-O 3.43Å; C349-F354 PolarHBondContact O-N 3.23Å; C349-P357 HydrophobicContact CB-CB 4.22Å; C349-P357 HydrophobicContact CB-CG 4.5Å; C349-F360 HydrophobicContact CB-CB 4.14Å; C349-F360 HydrophobicContact CB-CD2 4.16Å; C349-F360 HydrophobicContact CB-CG 4.27Å; C349-P395 WeakPolarHBondContact SG-CB 3.09Å
350	S	95.6	Very high	95.6	Very high	49 Å²	49	38.5 Å²	38.5	34%	0.343	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-68.3	-27.5	179.4	-50.6	0	0	0	0	112.7	N348 F352 G353 F354 R419	N348-S350 PolarHBondContact O-N 3.38Å; N348-S350 VanDerWaalsContact O-N 3.08Å; S350-F352 PolarHBondContact O-N 3.21Å; S350-G353 PolarHBondContact O-N 3.03Å; S350-G353 VanDerWaalsContact O-N 3.15Å; S350-F354 WeakPolarHBondContact CA-O 3.49Å; S350-F354 PolarHBondContact N-O 3.31Å; S350-F354 VanDerWaalsContact N-O 3.14Å; S350-F354 PolarHBondContact OG-O 2.97Å; S350-R419 PolarHBondContact OG-NH2 3.36Å
351	Y	95.3	Very high	95.3	Very high	62 Å²	62	41.5 Å²	41.5	24%	0.243	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-60.8	-30.7	170.4	175.3	-110.5	0	0	0	111.9	F120 N348 C349 G353 F375 T416 L417	F120-Y351 AromaticContact CE1-CE1 3.84Å; F120-Y351 HydrophobicContact CE1-CE1 3.84Å; F120-Y351 HydrophobicContact CZ-CE1 4.34Å; N348-Y351 WeakPolarHBondContact O-CB 3.35Å; N348-Y351 PolarHBondContact O-N 3.3Å; C349-Y351 VanDerWaalsContact C-N 3.28Å; C349-Y351 PolarHBondContact O-N 3.35Å; Y351-G353 VanDerWaalsContact C-N 3.35Å; Y351-F375 HydrophobicContact CE1-CE1 4.03Å; Y351-F375 HydrophobicContact CE1-CZ 4.32Å; Y351-T416 HydrophobicContact CD1-CG2 4.48Å; Y351-T416 HydrophobicContact CD2-CG2 3.52Å; Y351-T416 HydrophobicContact CE1-CG2 4.42Å; Y351-T416 HydrophobicContact CE2-CG2 3.46Å; Y351-T416 VanDerWaalsContact CE2-CG2 3.46Å; Y351-T416 HydrophobicContact CG-CG2 4.06Å; Y351-L417 HydrophobicContact CD1-CD2 4Å; Y351-L417 HydrophobicContact CE1-CD2 3.92Å
352	F	95.6	Very high	95.2	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.018	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-93.9	14.7	178.6	-57.2	-72.3	0	0	0	113.4	F120 F125 L347 C349 S350 F354 F360 V365 F375 L417	F120-F352 HydrophobicContact CD1-CD1 4.16Å; F120-F352 HydrophobicContact CD1-CE1 4.17Å; F120-F352 HydrophobicContact CD2-CD1 4.24Å; F120-F352 HydrophobicContact CE1-CD1 4.27Å; F120-F352 HydrophobicContact CE1-CE1 4.39Å; F120-F352 HydrophobicContact CE2-CD1 4.37Å; F120-F352 HydrophobicContact CG-CD1 4.13Å; F120-F352 HydrophobicContact CG-CE1 4.46Å; F120-F352 HydrophobicContact CZ-CD1 4.37Å; F125-F352 HydrophobicContact CE2-CB 3.63Å; F125-F352 HydrophobicContact CE2-CG 4.48Å; F125-F352 VanDerWaalsContact CE2-O 3.3Å; F125-F352 WeakPolarHBondContact CE2-O 3.39Å; F125-F352 HydrophobicContact CZ-CB 3.67Å; F125-F352 AromaticContact CZ-CD1 3.97Å; F125-F352 HydrophobicContact CZ-CD1 3.97Å; F125-F352 HydrophobicContact CZ-CG 4.03Å; L347-F352 HydrophobicContact CD1-CE2 4.11Å; L347-F352 HydrophobicContact CD2-CD2 4.42Å; L347-F352 HydrophobicContact CD2-CE2 4.03Å; L347-F352 HydrophobicContact CG-CE2 4.11Å; C349-F352 CarbonylContact O-C 3.56Å; C349-F352 WeakPolarHBondContact O-CA 3.13Å; C349-F352 PolarHBondContact O-N 3.49Å; S350-F352 PolarHBondContact O-N 3.21Å; F352-F354 HydrophobicContact CB-CD2 4.49Å; F352-F354 VanDerWaalsContact O-CD2 3.3Å; F352-F354 WeakPolarHBondContact O-CD2 3.3Å; F352-F360 HydrophobicContact CB-CE2 4.04Å; F352-F360 HydrophobicContact CD2-CE2 4.02Å; F352-F360 HydrophobicContact CD2-CZ 4.47Å; F352-F360 HydrophobicContact CG-CE2 4.18Å; F352-V365 HydrophobicContact CD1-CG1 4.31Å; F352-V365 HydrophobicContact CE1-CB 4.49Å; F352-V365 HydrophobicContact CE1-CG1 3.88Å; F352-F375 HydrophobicContact CE1-CZ 4.07Å; F352-F375 HydrophobicContact CZ-CZ 4.39Å; F352-L417 HydrophobicContact CZ-CD2 3.91Å
353	G	95.3	Very high	95	Very high	60 Å²	60	42.7 Å²	42.7	62%	0.619	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	14	-179.7	0	0	0	0	0	115.2	C349 S350 Y351 P355	C349-G353 PolarHBondContact O-N 3.43Å; S350-G353 PolarHBondContact O-N 3.03Å; S350-G353 VanDerWaalsContact O-N 3.15Å; Y351-G353 VanDerWaalsContact C-N 3.35Å; G353-P355 VanDerWaalsContact O-CD 3.3Å; G353-P355 WeakPolarHBondContact O-CD 3.25Å
354	F	95.1	Very high	94.9	Very high	41 Å²	41	43.7 Å²	43.7	18%	0.18	25%	0.245	C	C	.	.			trans	-112	91.5	175.8	-70.8	-99.8	0	0	0	111.1	F125 C349 S350 F352 D356 L359 F360 F362	F125-F354 AromaticContact CD2-CE2 3.69Å; F125-F354 HydrophobicContact CD2-CE2 3.69Å; F125-F354 AromaticContact CE2-CD2 3.96Å; F125-F354 HydrophobicContact CE2-CD2 3.96Å; F125-F354 AromaticContact CE2-CE2 3.45Å; F125-F354 HydrophobicContact CE2-CE2 3.45Å; F125-F354 VanDerWaalsContact CE2-CE2 3.45Å; C349-F354 CarbonylContact C-O 3.5Å; C349-F354 HydrophobicContact CB-CB 3.98Å; C349-F354 WeakPolarHBondContact CB-O 3.43Å; C349-F354 PolarHBondContact O-N 3.23Å; S350-F354 WeakPolarHBondContact CA-O 3.49Å; S350-F354 PolarHBondContact N-O 3.31Å; S350-F354 VanDerWaalsContact N-O 3.14Å; S350-F354 PolarHBondContact OG-O 2.97Å; F352-F354 HydrophobicContact CB-CD2 4.49Å; F352-F354 VanDerWaalsContact O-CD2 3.3Å; F352-F354 WeakPolarHBondContact O-CD2 3.3Å; F354-D356 VanDerWaalsContact C-N 3.34Å; F354-D356 PolarHBondContact O-N 3.01Å; F354-L359 HydrophobicContact CD1-CB 3.9Å; F354-L359 HydrophobicContact CE1-CB 4.37Å; F354-L359 WeakPolarHBondContact CE1-O 3.19Å; F354-F360 HydrophobicContact CB-CB 4.33Å; F354-F360 HydrophobicContact CB-CD2 4.29Å; F354-F360 HydrophobicContact CD1-CB 4.33Å; F354-F360 AromaticContact CD2-CD2 3.83Å; F354-F360 HydrophobicContact CD2-CD2 3.83Å; F354-F360 HydrophobicContact CD2-CE2 4.49Å; F354-F360 HydrophobicContact CE2-CD2 4.37Å; F354-F360 HydrophobicContact CG-CB 4.27Å; F354-F360 HydrophobicContact CG-CD2 4.01Å; F354-F362 HydrophobicContact CE2-CE2 4.29Å; F354-F362 HydrophobicContact CZ-CE2 4.13Å
355	P	92.9	Very high	94.8	Very high	106 Å²	106	42.5 Å²	42.5	69%	0.688	24%	0.24	S	C	*	.	S	Bend	trans	-59.1	-42.6	178	-25.5	34.6	0	0	0	113	G353 P357 R419	G353-P355 VanDerWaalsContact O-CD 3.3Å; G353-P355 WeakPolarHBondContact O-CD 3.25Å; P355-P357 WeakPolarHBondContact O-CD 3.35Å; P355-R419 PolarHBondContact O-NH2 3.26Å
356	D	93.4	Very high	94.8	Very high	71 Å²	71	43.4 Å²	43.4	38%	0.38	25%	0.245	S	C	.	.	S	Bend	trans	-90.4	111.9	172.2	-174	-3.5	0	0	0	110.5	F354 K358 L359	F354-D356 VanDerWaalsContact C-N 3.34Å; F354-D356 PolarHBondContact O-N 3.01Å; D356-K358 PolarHBondContact O-N 2.78Å; D356-K358 VanDerWaalsContact O-N 3.08Å; D356-K358 WeakPolarHBondContact OD1-CB 3.47Å; D356-K358 WeakPolarHBondContact OD1-CG 3.11Å; D356-K358 PolarHBondContact OD1-N 3.29Å; D356-L359 HydrophobicContact CB-CD1 4.27Å; D356-L359 HydrophobicContact CB-CG 4.28Å; D356-L359 PolarHBondContact O-N 3.5Å; D356-L359 VanDerWaalsContact O-N 3.08Å
357	P	92.3	Very high	94.8	Very high	14 Å²	14	40.2 Å²	40.2	9%	0.091	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-12.2	178.5	-18.6	32.1	0	0	0	114.3	C349 P355 L359 P395 Q396	C349-P357 HydrophobicContact CB-CB 4.22Å; C349-P357 HydrophobicContact CB-CG 4.5Å; P355-P357 WeakPolarHBondContact O-CD 3.35Å; P357-L359 VanDerWaalsContact C-N 3.26Å; P357-P395 HydrophobicContact CB-CB 4.02Å; P357-Q396 HydrophobicContact CB-CG 4.16Å
358	K	91.8	Very high	94.7	Very high	134 Å²	134	40.5 Å²	40.5	58%	0.583	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.6	172.1	-70.1	170.8	179.2	-179.5	0	113.7	D356 Q396	D356-K358 PolarHBondContact O-N 2.78Å; D356-K358 VanDerWaalsContact O-N 3.08Å; D356-K358 WeakPolarHBondContact OD1-CB 3.47Å; D356-K358 WeakPolarHBondContact OD1-CG 3.11Å; D356-K358 PolarHBondContact OD1-N 3.29Å; K358-Q396 VanDerWaalsContact CA-NE2 3.26Å; K358-Q396 HydrophobicContact CG-CG 4.01Å
359	L	92.9	Very high	94.3	Very high	121 Å²	121	43.3 Å²	43.3	63%	0.634	25%	0.249	S	C	*	.	S	Bend	trans	-87.2	-11	-177.5	-61.6	180	0	0	0	112.4	F354 D356 P357 P361	F354-L359 HydrophobicContact CD1-CB 3.9Å; F354-L359 HydrophobicContact CE1-CB 4.37Å; F354-L359 WeakPolarHBondContact CE1-O 3.19Å; D356-L359 HydrophobicContact CB-CD1 4.27Å; D356-L359 HydrophobicContact CB-CG 4.28Å; D356-L359 PolarHBondContact O-N 3.5Å; D356-L359 VanDerWaalsContact O-N 3.08Å; P357-L359 VanDerWaalsContact C-N 3.26Å; L359-P361 WeakPolarHBondContact O-CD 3.45Å
360	F	94.1	Very high	94	Very high	9 Å²	9	44.9 Å²	44.9	4%	0.039	26%	0.26	C	S	.	.			trans	-78.6	109	-179.2	-174.4	-87	0	0	0	110.6	F125 L347 C349 F352 F354 F362 V365 P395	F125-F360 HydrophobicContact CE2-CE2 4.34Å; F125-F360 HydrophobicContact CZ-CE2 4.01Å; L347-F360 HydrophobicContact CD2-CD1 4.47Å; L347-F360 HydrophobicContact CD2-CE1 3.81Å; L347-F360 HydrophobicContact CD2-CZ 3.84Å; C349-F360 HydrophobicContact CB-CB 4.14Å; C349-F360 HydrophobicContact CB-CD2 4.16Å; C349-F360 HydrophobicContact CB-CG 4.27Å; F352-F360 HydrophobicContact CB-CE2 4.04Å; F352-F360 HydrophobicContact CD2-CE2 4.02Å; F352-F360 HydrophobicContact CD2-CZ 4.47Å; F352-F360 HydrophobicContact CG-CE2 4.18Å; F354-F360 HydrophobicContact CB-CB 4.33Å; F354-F360 HydrophobicContact CB-CD2 4.29Å; F354-F360 HydrophobicContact CD1-CB 4.33Å; F354-F360 AromaticContact CD2-CD2 3.83Å; F354-F360 HydrophobicContact CD2-CD2 3.83Å; F354-F360 HydrophobicContact CD2-CE2 4.49Å; F354-F360 HydrophobicContact CE2-CD2 4.37Å; F354-F360 HydrophobicContact CG-CB 4.27Å; F354-F360 HydrophobicContact CG-CD2 4.01Å; F360-F362 HydrophobicContact CD2-CD2 4.41Å; F360-F362 HydrophobicContact CE1-CB 3.93Å; F360-F362 WeakPolarHBondContact CE1-O 3.4Å; F360-F362 HydrophobicContact CE2-CD2 4.06Å; F360-F362 HydrophobicContact CZ-CB 4.01Å; F360-F362 HydrophobicContact CZ-CD2 4.14Å; F360-V365 HydrophobicContact CE2-CG2 4.47Å; F360-V365 HydrophobicContact CZ-CG2 3.8Å; F360-P395 HydrophobicContact CB-CG 4.13Å; F360-P395 HydrophobicContact CD1-CG 3.67Å; F360-P395 HydrophobicContact CG-CG 4.27Å
361	P	91.7	Very high	93.3	Very high	63 Å²	63	49 Å²	49	41%	0.409	29%	0.286	S	S	.	.			trans	-99.1	-4.7	-168.7	38.6	-32	0	0	0	113.5	K116 L359	K116-P361 HydrophobicContact CD-CB 4.41Å; L359-P361 WeakPolarHBondContact O-CD 3.45Å
362	F	94.9	Very high	92.7	Very high	13 Å²	13	49.7 Å²	49.7	6%	0.057	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138	-167.5	-51.3	-62	0	0	0	112.1	K116 A118 F125 E128 F354 F360	K116-F362 HydrophobicContact CB-CD1 3.97Å; K116-F362 CarbonylContact O-C 3.49Å; A118-F362 HydrophobicContact CB-CD1 3.67Å; A118-F362 HydrophobicContact CB-CD2 3.81Å; A118-F362 HydrophobicContact CB-CE1 3.76Å; A118-F362 HydrophobicContact CB-CE2 3.89Å; A118-F362 HydrophobicContact CB-CG 3.72Å; A118-F362 HydrophobicContact CB-CZ 3.88Å; F125-F362 HydrophobicContact CD2-CE2 4.26Å; F125-F362 HydrophobicContact CE1-CD2 4.47Å; F125-F362 HydrophobicContact CE2-CD2 4.33Å; F125-F362 HydrophobicContact CE2-CE2 4.09Å; F125-F362 HydrophobicContact CZ-CD2 4.11Å; F125-F362 HydrophobicContact CZ-CE2 4.26Å; E128-F362 HydrophobicContact CB-CE1 3.9Å; E128-F362 HydrophobicContact CB-CZ 3.8Å; E128-F362 HydrophobicContact CG-CE1 4.16Å; E128-F362 HydrophobicContact CG-CE2 4.41Å; E128-F362 HydrophobicContact CG-CZ 3.58Å; F354-F362 HydrophobicContact CE2-CE2 4.29Å; F354-F362 HydrophobicContact CZ-CE2 4.13Å; F360-F362 HydrophobicContact CD2-CD2 4.41Å; F360-F362 HydrophobicContact CE1-CB 3.93Å; F360-F362 WeakPolarHBondContact CE1-O 3.4Å; F360-F362 HydrophobicContact CE2-CD2 4.06Å; F360-F362 HydrophobicContact CZ-CB 4.01Å; F360-F362 HydrophobicContact CZ-CD2 4.14Å
363	A	94.1	Very high	92.5	Very high	13 Å²	13	50.6 Å²	50.6	11%	0.107	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-27	167.7	0	0	0	0	0	111.5	K116 A379 S380	K116-A363 PolarHBondContact O-N 3.12Å; A363-A379 CarbonylContact O-C 3.58Å; A363-A379 VanDerWaalsContact O-CA 3.31Å; A363-A379 WeakPolarHBondContact O-CA 3.32Å; A363-S380 PolarHBondContact O-N 3.41Å
364	S	94.9	Very high	92.5	Very high	22 Å²	22	50.9 Å²	50.9	15%	0.154	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.5	-178.5	-170.2	0	0	0	0	111.1	K116 T117 A118	K116-S364 PolarHBondContact O-N 2.97Å; K116-S364 VanDerWaalsContact O-N 3.11Å; T117-S364 CarbonylContact C-O 3.59Å; T117-S364 WeakPolarHBondContact CA-O 3.5Å; A118-S364 PolarHBondContact N-O 3.18Å
365	V	97.2	Very high	92.5	Very high	3 Å²	3	49 Å²	49	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	118.1	170.6	176.6	0	0	0	0	108.1	A118 F120 F125 F352 F360 S377 A378	A118-V365 WeakPolarHBondContact O-CA 3.08Å; F120-V365 HydrophobicContact CB-CG1 3.62Å; F120-V365 HydrophobicContact CG-CG1 4.5Å; F125-V365 HydrophobicContact CE1-CG1 3.84Å; F125-V365 HydrophobicContact CE1-CG2 3.94Å; F125-V365 HydrophobicContact CZ-CG1 4.45Å; F125-V365 HydrophobicContact CZ-CG2 4.03Å; F352-V365 HydrophobicContact CD1-CG1 4.31Å; F352-V365 HydrophobicContact CE1-CB 4.49Å; F352-V365 HydrophobicContact CE1-CG1 3.88Å; F360-V365 HydrophobicContact CE2-CG2 4.47Å; F360-V365 HydrophobicContact CZ-CG2 3.8Å; V365-S377 CarbonylContact O-C 3.58Å; V365-S377 WeakPolarHBondContact O-CA 3.45Å; V365-S377 VanDerWaalsContact O-CB 3.3Å; V365-S377 WeakPolarHBondContact O-CB 3.47Å; V365-A378 PolarHBondContact N-O 3.25Å; V365-A378 PolarHBondContact O-N 2.86Å
366	L	97	Very high	92.6	Very high	20 Å²	20	44 Å²	44	11%	0.105	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	157.2	171.7	-49.1	-173.9	0	0	0	109.5	T117 A118 V119 F120 P218 V222	T117-L366 HydrophobicContact CG2-CD1 4.03Å; T117-L366 HydrophobicContact CG2-CG 3.84Å; A118-L366 PolarHBondContact O-N 2.65Å; V119-L366 WeakPolarHBondContact CA-O 3.49Å; F120-L366 PolarHBondContact N-O 3.22Å; P218-L366 HydrophobicContact CB-CB 3.8Å; P218-L366 HydrophobicContact CB-CD1 4.29Å; V222-L366 HydrophobicContact CB-CD2 3.95Å; V222-L366 HydrophobicContact CG1-CD1 4.34Å; V222-L366 HydrophobicContact CG1-CD2 4.05Å; V222-L366 HydrophobicContact CG2-CD2 3.99Å
367	T	96.3	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	143.2	180	60.2	0	0	0	0	112.3	F120 P218 R221 L373 F375 N376	F120-T367 WeakPolarHBondContact O-CA 3.47Å; P218-T367 VanDerWaalsContact CA-O 3.28Å; P218-T367 WeakPolarHBondContact CA-O 3.45Å; P218-T367 WeakPolarHBondContact CB-O 3.33Å; R221-T367 WeakPolarHBondContact CD-O 3.43Å; R221-T367 PolarHBondContact NE-O 3.31Å; R221-T367 PolarHBondContact NE-OG1 3.09Å; R221-T367 PolarHBondContact NH2-OG1 2.74Å; R221-T367 VanDerWaalsContact NH2-OG1 3.14Å; T367-L373 HydrophobicContact CG2-CD1 4.02Å; T367-F375 HydrophobicContact CG2-CD2 3.87Å; T367-F375 HydrophobicContact CG2-CE1 4.24Å; T367-F375 HydrophobicContact CG2-CE2 3.38Å; T367-F375 HydrophobicContact CG2-CG 4.47Å; T367-F375 HydrophobicContact CG2-CZ 3.58Å; T367-F375 PolarHBondContact OG1-O 3.47Å; T367-F375 VanDerWaalsContact OG1-O 3.05Å; T367-N376 PolarHBondContact N-O 2.79Å; T367-N376 VanDerWaalsContact N-O 3.08Å; T367-N376 VanDerWaalsContact OG1-C 3.23Å; T367-N376 VanDerWaalsContact OG1-CA 3.29Å; T367-N376 WeakPolarHBondContact OG1-CA 3.26Å; T367-N376 PolarHBondContact OG1-O 3.47Å
368	T	94.7	Very high	93	Very high	13 Å²	13	40.4 Å²	40.4	8%	0.08	24%	0.241	C	C	.	.			trans	-72.5	172.1	164.5	56.5	0	0	0	0	110.8	V119 F120 N121 I126 P218 R221 S370	V119-T368 HydrophobicContact CG1-CG2 3.79Å; F120-T368 PolarHBondContact O-N 2.73Å; N121-T368 VanDerWaalsContact CA-OG1 3.27Å; N121-T368 WeakPolarHBondContact CA-OG1 3.47Å; N121-T368 HydrophobicContact CB-CG2 4.41Å; I126-T368 HydrophobicContact CD1-CG2 3.55Å; P218-T368 HydrophobicContact CG-CG2 4.1Å; R221-T368 PolarHBondContact NE-O 3.34Å; R221-T368 VanDerWaalsContact NE-O 3.17Å; T368-S370 PolarHBondContact O-N 3.07Å; T368-S370 PolarHBondContact OG1-OG 3.14Å
369	D	89.9	Confident	93.2	Very high	91 Å²	91	35 Å²	35	49%	0.487	22%	0.222	S	C	.	.	S	Bend	trans	-80.7	56.2	175	-157	27.1	0	0	0	111.8	R221	R221-D369 IonicContact CZ-OD1 3.47Å; R221-D369 IonicContact NH1-OD1 3.62Å; R221-D369 PolarHBondContact NH1-OD1 2.7Å
370	S	89.1	Confident	93.3	Very high	33 Å²	33	29.9 Å²	29.9	23%	0.231	20%	0.196	C	C	.	.			trans	-89.1	137.2	-177.3	-61.5	0	0	0	0	111.6	N121 T368 G372 L373	N121-S370 WeakPolarHBondContact O-CB 3.43Å; N121-S370 PolarHBondContact O-OG 2.82Å; T368-S370 PolarHBondContact O-N 3.07Å; T368-S370 PolarHBondContact OG1-OG 3.14Å; S370-G372 PolarHBondContact O-N 2.77Å; S370-L373 PolarHBondContact O-N 2.97Å
371	P	81.2	Confident	93.3	Very high	136 Å²	136	31 Å²	31	88%	0.883	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	130.5	171.8	-23.5	33.1	0	0	0	111.5
372	G	81.8	Confident	93.5	Very high	77 Å²	77	28.6 Å²	28.6	79%	0.794	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	95	-9.2	177.2	0	0	0	0	0	115.8	S370 F374	S370-G372 PolarHBondContact O-N 2.77Å; G372-F374 PolarHBondContact O-N 2.84Å
373	L	92.4	Very high	93.5	Very high	22 Å²	22	28.1 Å²	28.1	12%	0.115	19%	0.185	C	C	.	.			trans	-77.4	117.6	170.5	-74.8	176.7	0	0	0	111.1	F120 T367 S370 F375	F120-L373 HydrophobicContact CD1-CD2 4.28Å; F120-L373 HydrophobicContact CE1-CD2 4.09Å; T367-L373 HydrophobicContact CG2-CD1 4.02Å; S370-L373 PolarHBondContact O-N 2.97Å; L373-F375 HydrophobicContact CD2-CE1 3.94Å
374	F	93.9	Very high	93.6	Very high	67 Å²	67	27.6 Å²	27.6	29%	0.294	18%	0.18	S	C	.	.			trans	-90.9	-0	-178.4	60.6	-95.1	0	0	0	114.1	G372 S405 P406 L409 A413 T416 L417	G372-F374 PolarHBondContact O-N 2.84Å; F374-S405 WeakPolarHBondContact O-CB 3.41Å; F374-P406 WeakPolarHBondContact O-CD 3.33Å; F374-L409 HydrophobicContact CD2-CD2 3.94Å; F374-L409 HydrophobicContact CE2-CD2 4.12Å; F374-A413 HydrophobicContact CD2-CB 3.69Å; F374-A413 HydrophobicContact CE2-CB 3.47Å; F374-A413 VanDerWaalsContact CE2-CB 3.47Å; F374-A413 HydrophobicContact CG-CB 4.38Å; F374-A413 HydrophobicContact CZ-CB 4Å; F374-T416 HydrophobicContact CE1-CG2 4.1Å; F374-T416 HydrophobicContact CZ-CG2 4.09Å; F374-L417 HydrophobicContact CE2-CD1 3.73Å; F374-L417 HydrophobicContact CE2-CG 3.97Å; F374-L417 HydrophobicContact CZ-CD1 4.13Å; F374-L417 HydrophobicContact CZ-CD2 4.34Å; F374-L417 HydrophobicContact CZ-CG 3.85Å
375	F	95.6	Very high	93.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	20%	0.196	C	C	.	.			trans	-135.3	156	-179.3	72.1	-77.5	0	0	0	110.7	F120 R221 Y351 F352 T367 L373 A378 V403 L417	F120-F375 HydrophobicContact CD1-CZ 4.38Å; R221-F375 PolarHBondContact NH2-O 3.21Å; Y351-F375 HydrophobicContact CE1-CE1 4.03Å; Y351-F375 HydrophobicContact CE1-CZ 4.32Å; F352-F375 HydrophobicContact CE1-CZ 4.07Å; F352-F375 HydrophobicContact CZ-CZ 4.39Å; T367-F375 HydrophobicContact CG2-CD2 3.87Å; T367-F375 HydrophobicContact CG2-CE1 4.24Å; T367-F375 HydrophobicContact CG2-CE2 3.38Å; T367-F375 HydrophobicContact CG2-CG 4.47Å; T367-F375 HydrophobicContact CG2-CZ 3.58Å; T367-F375 PolarHBondContact OG1-O 3.47Å; T367-F375 VanDerWaalsContact OG1-O 3.05Å; L373-F375 HydrophobicContact CD2-CE1 3.94Å; F375-A378 HydrophobicContact CD2-CB 4.39Å; F375-A378 HydrophobicContact CE2-CB 4.22Å; F375-V403 HydrophobicContact CB-CG1 3.86Å; F375-V403 HydrophobicContact CD2-CG1 4.45Å; F375-V403 HydrophobicContact CG-CG1 4.43Å; F375-L417 HydrophobicContact CD1-CD1 4.3Å; F375-L417 HydrophobicContact CD1-CD2 4.18Å; F375-L417 HydrophobicContact CE1-CD2 3.85Å; F375-L417 HydrophobicContact CG-CD1 4.27Å; F375-L417 HydrophobicContact CZ-CD2 4.04Å
376	N	95.3	Very high	93.5	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.011	20%	0.199	C	C	.	.	S	Bend	trans	-95.4	-39.3	-178.6	-62.1	-16.6	0	0	0	111.2	R221 G225 T367 F404	R221-N376 HydrophobicContact CB-CB 4.26Å; R221-N376 PolarHBondContact NH2-OD1 3.49Å; R221-N376 WeakPolarHBondContact O-CB 3.36Å; R221-N376 PolarHBondContact O-ND2 3.49Å; G225-N376 WeakPolarHBondContact CA-ND2 3.48Å; T367-N376 PolarHBondContact N-O 2.79Å; T367-N376 VanDerWaalsContact N-O 3.08Å; T367-N376 VanDerWaalsContact OG1-C 3.23Å; T367-N376 VanDerWaalsContact OG1-CA 3.29Å; T367-N376 WeakPolarHBondContact OG1-CA 3.26Å; T367-N376 PolarHBondContact OG1-O 3.47Å; N376-F404 HydrophobicContact CB-CB 4.16Å; N376-F404 PolarHBondContact N-O 3Å
377	S	96.6	Very high	93.1	Very high	3 Å²	3	34 Å²	34	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	158.1	174.5	60.2	0	0	0	0	111.9	V222 V365 V403 F404	V222-S377 WeakPolarHBondContact CG2-OG 3.31Å; V365-S377 CarbonylContact O-C 3.58Å; V365-S377 WeakPolarHBondContact O-CA 3.45Å; V365-S377 VanDerWaalsContact O-CB 3.3Å; V365-S377 WeakPolarHBondContact O-CB 3.47Å; S377-V403 VanDerWaalsContact O-CA 3.3Å; S377-V403 WeakPolarHBondContact O-CA 3.43Å; S377-V403 WeakPolarHBondContact O-CG1 3.49Å; S377-F404 PolarHBondContact N-O 3.31Å; S377-F404 PolarHBondContact O-N 3.25Å; S377-F404 WeakPolarHBondContact OG-CD2 3.35Å
378	A	97.3	Very high	92.5	Very high	6 Å²	6	40.7 Å²	40.7	5%	0.05	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	116.8	171	0	0	0	0	0	109.3	V365 F375 K402 V403	V365-A378 PolarHBondContact N-O 3.25Å; V365-A378 PolarHBondContact O-N 2.86Å; F375-A378 HydrophobicContact CD2-CB 4.39Å; F375-A378 HydrophobicContact CE2-CB 4.22Å; A378-K402 WeakPolarHBondContact CA-O 3.31Å; A378-V403 HydrophobicContact CB-CG2 4.16Å
379	A	95.9	Very high	91.9	Very high	21 Å²	21	43.2 Å²	43.2	17%	0.174	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.2	-175.2	0	0	0	0	0	112	A363 I381 Y401 K402	A363-A379 CarbonylContact O-C 3.58Å; A363-A379 VanDerWaalsContact O-CA 3.31Å; A363-A379 WeakPolarHBondContact O-CA 3.32Å; A379-I381 PolarHBondContact O-N 3.07Å; A379-Y401 CarbonylContact O-C 3.56Å; A379-Y401 WeakPolarHBondContact O-CA 3.28Å; A379-K402 PolarHBondContact N-O 2.83Å; A379-K402 PolarHBondContact O-N 3.13Å
380	S	95.7	Very high	91.8	Very high	13 Å²	13	41.5 Å²	41.5	9%	0.091	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	107.4	168.2	179	0	0	0	0	109.7	A363 R392 V400	A363-S380 PolarHBondContact O-N 3.41Å; S380-R392 PolarHBondContact O-NE 3.01Å; S380-R392 WeakPolarHBondContact OG-CD 3.45Å; S380-R392 WeakPolarHBondContact OG-CG 3.49Å; S380-V400 WeakPolarHBondContact CA-O 3.47Å
381	I	94.8	Very high	91.9	Very high	32 Å²	32	46.6 Å²	46.6	16%	0.164	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-92.5	154.1	-172.2	57.6	171.7	0	0	0	112.1	Y84 I342 A379 V400 K402	Y84-I381 HydrophobicContact CD1-CB 4.4Å; Y84-I381 HydrophobicContact CD1-CD1 3.54Å; Y84-I381 HydrophobicContact CD1-CG1 3.64Å; Y84-I381 HydrophobicContact CE1-CD1 4.46Å; Y84-I381 HydrophobicContact CE1-CG1 4.18Å; Y84-I381 HydrophobicContact CG-CD1 3.84Å; Y84-I381 HydrophobicContact CG-CG1 4.43Å; I342-I381 HydrophobicContact CD1-CD1 4.17Å; I342-I381 HydrophobicContact CG1-CD1 4.21Å; I342-I381 HydrophobicContact CG2-CD1 4.1Å; A379-I381 PolarHBondContact O-N 3.07Å; I381-V400 HydrophobicContact CD1-CG1 3.88Å; I381-V400 HydrophobicContact CG1-CB 4.35Å; I381-V400 HydrophobicContact CG1-CG1 3.86Å; I381-V400 PolarHBondContact N-O 3.07Å; I381-K402 HydrophobicContact CD1-CB 4.09Å; I381-K402 HydrophobicContact CG2-CB 3.52Å; I381-K402 HydrophobicContact CG2-CD 4.46Å
382	C	94.6	Very high	92.3	Very high	14 Å²	14	42.8 Å²	42.8	10%	0.095	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-99.2	149.3	174.8	-59.8	0	0	0	0	110.4	Y84 I386 F390 R392	Y84-C382 WeakPolarHBondContact CD1-O 3.33Å; C382-I386 HydrophobicContact CB-CD1 4.01Å; C382-F390 HydrophobicContact CB-CE1 4.17Å; C382-F390 HydrophobicContact CB-CZ 4.24Å; C382-R392 PolarHBondContact SG-NH2 2.75Å
383	P	96	Very high	92.7	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.019	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-61.6	157.7	172.4	28.4	-35.3	0	0	0	110.7	Q82 D83 Y84 N385 I386 F390	Q82-P383 HydrophobicContact CB-CB 4.08Å; D83-P383 CarbonylContact O-C 3.53Å; D83-P383 VanDerWaalsContact O-CA 3.27Å; D83-P383 WeakPolarHBondContact O-CA 3.43Å; Y84-P383 HydrophobicContact CD1-CB 4.49Å; Y84-P383 HydrophobicContact CE1-CB 4.02Å; Y84-P383 VanDerWaalsContact CE1-N 3.29Å; P383-N385 WeakPolarHBondContact CG-O 3.41Å; P383-N385 PolarHBondContact O-N 2.85Å; P383-I386 WeakPolarHBondContact O-CG1 3.33Å; P383-F390 VanDerWaalsContact CD-CE2 3.49Å; P383-F390 HydrophobicContact CG-CD2 4.27Å; P383-F390 HydrophobicContact CG-CE2 3.9Å; P383-F390 HydrophobicContact CG-CZ 4.41Å
384	V	96.4	Very high	92.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	26%	0.256	C	S	.	.	S	Bend	trans	-66.8	-21.2	178	-61.5	0	0	0	0	112.4	T76 D83 E85 R110 G251	T76-V384 HydrophobicContact CG2-CG1 3.91Å; D83-V384 HydrophobicContact CB-CG2 3.61Å; D83-V384 PolarHBondContact O-N 3.48Å; E85-V384 HydrophobicContact CG-CG1 3.93Å; R110-V384 WeakPolarHBondContact CD-O 3.37Å; G251-V384 PolarHBondContact N-O 2.81Å; G251-V384 VanDerWaalsContact N-O 3.08Å
385	N	95.6	Very high	92.2	Very high	89 Å²	89	44.3 Å²	44.3	48%	0.476	25%	0.246	S	C	.	.	S	Bend	trans	-115.5	121.7	173.7	-66.7	-48.9	0	0	0	109.8	E250 G251 P383	E250-N385 WeakPolarHBondContact CG-OD1 3.36Å; G251-N385 VanDerWaalsContact CA-OD1 3.32Å; G251-N385 WeakPolarHBondContact CA-OD1 3.29Å; G251-N385 PolarHBondContact N-OD1 2.88Å; P383-N385 WeakPolarHBondContact CG-O 3.41Å; P383-N385 PolarHBondContact O-N 2.85Å
386	I	93	Very high	91.8	Very high	15 Å²	15	48.1 Å²	48.1	8%	0.077	26%	0.263	C	S	.	.			trans	-113.8	109.7	-173.7	-59.6	-174.2	0	0	0	110.1	R110 K111 V113 C382 P383 F390	R110-I386 HydrophobicContact CG-CD1 3.82Å; R110-I386 HydrophobicContact CG-CG1 4Å; K111-I386 HydrophobicContact CB-CB 4.27Å; K111-I386 HydrophobicContact CB-CG2 4.25Å; K111-I386 VanDerWaalsContact O-CD1 3.26Å; K111-I386 WeakPolarHBondContact O-CD1 3.46Å; V113-I386 HydrophobicContact CG2-CD1 3.68Å; V113-I386 HydrophobicContact CG2-CG2 4.2Å; C382-I386 HydrophobicContact CB-CD1 4.01Å; P383-I386 WeakPolarHBondContact O-CG1 3.33Å; I386-F390 HydrophobicContact CG2-CB 3.7Å; I386-F390 HydrophobicContact CG2-CD1 4.02Å; I386-F390 HydrophobicContact CG2-CG 4.02Å
387	S	89.8	Confident	91.8	Very high	76 Å²	76	50.6 Å²	50.6	53%	0.531	28%	0.275	S	S	.	.			trans	-70.1	160.1	178.5	64.1	0	0	0	0	112.4	G389 F390	S387-G389 PolarHBondContact O-N 3.4Å; S387-F390 WeakPolarHBondContact O-CB 3.37Å; S387-F390 PolarHBondContact O-N 3.15Å; S387-F390 VanDerWaalsContact O-N 3.12Å
388	T	82.1	Confident	91.7	Very high	140 Å²	140	51.6 Å²	51.6	86%	0.859	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-7.9	-175.5	37.9	0	0	0	0	115.5
389	G	82.6	Confident	91.6	Very high	67 Å²	67	51.4 Å²	51.4	69%	0.691	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	13.9	174.7	0	0	0	0	0	114	S387 R391	S387-G389 PolarHBondContact O-N 3.4Å; G389-R391 PolarHBondContact O-N 3.07Å
390	F	89.1	Confident	91.6	Very high	54 Å²	54	50.9 Å²	50.9	24%	0.237	28%	0.277	C	S	.	.			trans	-63.2	129.5	-179	179.4	-92.2	0	0	0	110.9	V113 C382 P383 I386 S387	V113-F390 HydrophobicContact CG1-CE1 4.27Å; V113-F390 HydrophobicContact CG2-CD1 3.99Å; V113-F390 HydrophobicContact CG2-CE1 4.19Å; C382-F390 HydrophobicContact CB-CE1 4.17Å; C382-F390 HydrophobicContact CB-CZ 4.24Å; P383-F390 VanDerWaalsContact CD-CE2 3.49Å; P383-F390 HydrophobicContact CG-CD2 4.27Å; P383-F390 HydrophobicContact CG-CE2 3.9Å; P383-F390 HydrophobicContact CG-CZ 4.41Å; I386-F390 HydrophobicContact CG2-CB 3.7Å; I386-F390 HydrophobicContact CG2-CD1 4.02Å; I386-F390 HydrophobicContact CG2-CG 4.02Å; S387-F390 WeakPolarHBondContact O-CB 3.37Å; S387-F390 PolarHBondContact O-N 3.15Å; S387-F390 VanDerWaalsContact O-N 3.12Å
391	R	89.6	Confident	91.7	Very high	140 Å²	140	50.7 Å²	50.7	53%	0.528	27%	0.274	S	S	.	.			trans	-124.5	141.9	165.7	69.3	179.4	179.9	93.7	2.5	109.2	G389 K393 E397	G389-R391 PolarHBondContact O-N 3.07Å; R391-K393 PolarHBondContact O-N 3.33Å; R391-E397 IonicContact CZ-OE1 3.26Å; R391-E397 VanDerWaalsContact CZ-OE1 3.26Å; R391-E397 IonicContact NH1-OE1 2.86Å; R391-E397 PolarHBondContact NH1-OE1 3.39Å; R391-E397 IonicContact NH2-OE1 3.82Å; R391-E397 PolarHBondContact NH2-OE1 3.08Å; R391-E397 IonicContact NH2-OE2 2.93Å; R391-E397 PolarHBondContact NH2-OE2 3.02Å
392	R	89.4	Confident	91.9	Very high	56 Å²	56	49.5 Å²	49.5	21%	0.211	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-59.8	133.7	170.5	-170.8	174.9	-72.1	106.1	1.8	108.6	V113 A114 S380 C382 Q394	V113-R392 PolarHBondContact O-NH2 2.85Å; A114-R392 PolarHBondContact O-NH1 3.49Å; S380-R392 PolarHBondContact O-NE 3.01Å; S380-R392 WeakPolarHBondContact OG-CD 3.45Å; S380-R392 WeakPolarHBondContact OG-CG 3.49Å; C382-R392 PolarHBondContact SG-NH2 2.75Å; R392-Q394 PolarHBondContact O-N 3.11Å
393	K	90.7	Very high	92	Very high	92 Å²	92	48.9 Å²	48.9	40%	0.4	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-68.6	130.9	178.9	-67.3	-73.5	172.1	172.8	0	108.9	R391 E397	R391-K393 PolarHBondContact O-N 3.33Å; K393-E397 HydrophobicContact CB-CB 4.2Å; K393-E397 HydrophobicContact CD-CB 3.94Å; K393-E397 HydrophobicContact CD-CG 4.49Å; K393-E397 WeakPolarHBondContact CD-OE2 3.37Å; K393-E397 IonicContact NZ-OE2 3.67Å; K393-E397 PolarHBondContact NZ-OE2 2.95Å
394	Q	87.5	Confident	92.1	Very high	93 Å²	93	50.1 Å²	50.1	44%	0.435	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-69.2	156.3	172.9	-72.4	-114.9	-12.5	0	0	109.3	R392 Q396 E397	R392-Q394 PolarHBondContact O-N 3.11Å; Q394-Q396 PolarHBondContact O-N 3.49Å; Q394-E397 WeakPolarHBondContact O-CA 3.45Å; Q394-E397 PolarHBondContact O-N 3.17Å; Q394-E397 VanDerWaalsContact O-O 3.13Å
395	P	87.7	Confident	92	Very high	13 Å²	13	50.1 Å²	50.1	8%	0.084	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.5	-176.5	-25.7	35.8	0	0	0	115.9	C349 P357 F360 E397	C349-P395 WeakPolarHBondContact SG-CB 3.09Å; P357-P395 HydrophobicContact CB-CB 4.02Å; F360-P395 HydrophobicContact CB-CG 4.13Å; F360-P395 HydrophobicContact CD1-CG 3.67Å; F360-P395 HydrophobicContact CG-CG 4.27Å; P395-E397 VanDerWaalsContact C-N 3.32Å
396	Q	89.2	Confident	91.8	Very high	80 Å²	80	48.6 Å²	48.6	37%	0.374	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.1	172.9	-53.9	130.5	63.1	0	0	112.9	Y346 P357 K358 Q394	Y346-Q396 WeakPolarHBondContact CE1-O 3.27Å; P357-Q396 HydrophobicContact CB-CG 4.16Å; K358-Q396 VanDerWaalsContact CA-NE2 3.26Å; K358-Q396 HydrophobicContact CG-CG 4.01Å; Q394-Q396 PolarHBondContact O-N 3.49Å
397	E	93.3	Very high	91.8	Very high	54 Å²	54	54.9 Å²	54.9	25%	0.252	29%	0.292	S	S	.	.	S	Bend	trans	-101.2	151	176.2	-61.5	177.2	-119.3	0	0	108.7	R391 K393 Q394 P395 G399	R391-E397 IonicContact CZ-OE1 3.26Å; R391-E397 VanDerWaalsContact CZ-OE1 3.26Å; R391-E397 IonicContact NH1-OE1 2.86Å; R391-E397 PolarHBondContact NH1-OE1 3.39Å; R391-E397 IonicContact NH2-OE1 3.82Å; R391-E397 PolarHBondContact NH2-OE1 3.08Å; R391-E397 IonicContact NH2-OE2 2.93Å; R391-E397 PolarHBondContact NH2-OE2 3.02Å; K393-E397 HydrophobicContact CB-CB 4.2Å; K393-E397 HydrophobicContact CD-CB 3.94Å; K393-E397 HydrophobicContact CD-CG 4.49Å; K393-E397 WeakPolarHBondContact CD-OE2 3.37Å; K393-E397 IonicContact NZ-OE2 3.67Å; K393-E397 PolarHBondContact NZ-OE2 2.95Å; Q394-E397 WeakPolarHBondContact O-CA 3.45Å; Q394-E397 PolarHBondContact O-N 3.17Å; Q394-E397 VanDerWaalsContact O-O 3.13Å; P395-E397 VanDerWaalsContact C-N 3.32Å; E397-G399 PolarHBondContact O-N 3.24Å; E397-G399 VanDerWaalsContact O-N 3.14Å
398	A	94.4	Very high	92.1	Very high	24 Å²	24	54.4 Å²	54.4	20%	0.198	29%	0.288	C	S	.	.			trans	-64.4	118	173	0	0	0	0	0	109.8	G345 Y346 Y422	G345-A398 WeakPolarHBondContact O-CA 3.38Å; Y346-A398 HydrophobicContact CE1-CB 4.29Å; Y346-A398 HydrophobicContact CE2-CB 4.03Å; A398-Y422 HydrophobicContact CB-CD2 4.38Å; A398-Y422 HydrophobicContact CB-CE2 3.67Å
399	G	95.7	Very high	92.7	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	169.1	178.5	0	0	0	0	0	111.5	H344 G345 E397	H344-G399 CarbonylContact C-O 3.49Å; H344-G399 WeakPolarHBondContact CA-O 3.47Å; G345-G399 PolarHBondContact N-O 2.72Å; G345-G399 PolarHBondContact O-N 3.17Å; E397-G399 PolarHBondContact O-N 3.24Å; E397-G399 VanDerWaalsContact O-N 3.14Å
400	V	97.3	Very high	93.4	Very high	10 Å²	10	49.9 Å²	49.9	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125	170.5	-177.3	0	0	0	0	108.1	V79 Y84 I342 V343 H344 S380 I381	V79-V400 HydrophobicContact CG1-CG1 4.49Å; V79-V400 HydrophobicContact CG1-CG2 4.12Å; Y84-V400 HydrophobicContact CD1-CG1 4.08Å; Y84-V400 HydrophobicContact CD2-CG1 4.21Å; Y84-V400 HydrophobicContact CE1-CB 3.92Å; Y84-V400 HydrophobicContact CE1-CG1 3.95Å; Y84-V400 HydrophobicContact CE1-CG2 4.3Å; Y84-V400 HydrophobicContact CE2-CB 4.38Å; Y84-V400 HydrophobicContact CE2-CG1 4.1Å; Y84-V400 HydrophobicContact CE2-CG2 4.07Å; Y84-V400 HydrophobicContact CG-CG1 4.2Å; Y84-V400 WeakPolarHBondContact OH-CG2 3.4Å; I342-V400 HydrophobicContact CG2-CG1 3.51Å; V343-V400 CarbonylContact O-C 3.54Å; V343-V400 WeakPolarHBondContact O-CA 3.44Å; H344-V400 HydrophobicContact CB-CG2 4.48Å; S380-V400 WeakPolarHBondContact CA-O 3.47Å; I381-V400 HydrophobicContact CD1-CG1 3.88Å; I381-V400 HydrophobicContact CG1-CB 4.35Å; I381-V400 HydrophobicContact CG1-CG1 3.86Å; I381-V400 PolarHBondContact N-O 3.07Å
401	Y	97.6	Very high	93.7	Very high	9 Å²	9	54.6 Å²	54.6	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.1	-175.4	-63	-95.5	0	0	0	109.8	I342 V343 G345 L347 A379 F418	I342-Y401 CarbonylContact C-O 3.56Å; I342-Y401 VanDerWaalsContact CA-O 3.29Å; I342-Y401 WeakPolarHBondContact CA-O 3.44Å; V343-Y401 PolarHBondContact N-O 3.27Å; V343-Y401 PolarHBondContact O-N 3Å; G345-Y401 WeakPolarHBondContact O-CE2 3.26Å; L347-Y401 HydrophobicContact CB-CE1 3.92Å; L347-Y401 HydrophobicContact CB-CE2 4.33Å; L347-Y401 HydrophobicContact CD1-CD1 4.28Å; L347-Y401 HydrophobicContact CD1-CE1 4.22Å; L347-Y401 HydrophobicContact CD2-CE1 4.11Å; L347-Y401 HydrophobicContact CG-CE1 4.32Å; A379-Y401 CarbonylContact O-C 3.56Å; A379-Y401 WeakPolarHBondContact O-CA 3.28Å; Y401-F418 AromaticContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CZ 4.5Å; Y401-F418 HydrophobicContact CE2-CE1 4.34Å; Y401-F418 AromaticContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CZ 4.22Å
402	K	97.5	Very high	94.1	Very high	8 Å²	8	51.9 Å²	51.9	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.2	166.6	-169.5	173.9	-172	174.5	0	108.2	E85 S86 G87 S341 I342 A378 A379 I381 F404	E85-K402 PolarHBondContact O-NZ 3.49Å; E85-K402 VanDerWaalsContact O-NZ 3.08Å; S86-K402 VanDerWaalsContact C-NZ 3.32Å; S86-K402 WeakPolarHBondContact O-CE 3.35Å; S86-K402 PolarHBondContact O-NZ 2.9Å; G87-K402 PolarHBondContact O-NZ 2.85Å; S341-K402 WeakPolarHBondContact O-CA 3.44Å; I342-K402 HydrophobicContact CG1-CB 4.5Å; I342-K402 HydrophobicContact CG1-CG 4.3Å; A378-K402 WeakPolarHBondContact CA-O 3.31Å; A379-K402 PolarHBondContact N-O 2.83Å; A379-K402 PolarHBondContact O-N 3.13Å; I381-K402 HydrophobicContact CD1-CB 4.09Å; I381-K402 HydrophobicContact CG2-CB 3.52Å; I381-K402 HydrophobicContact CG2-CD 4.46Å; K402-F404 HydrophobicContact CD-CE2 3.99Å; K402-F404 HydrophobicContact CD-CZ 4.03Å; K402-F404 VanDerWaalsContact NZ-CZ 3.34Å
403	V	97.8	Very high	94.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.4	171.5	-174.1	0	0	0	0	108	S341 F375 S377 A378 L409 L417 F418	S341-V403 PolarHBondContact N-O 3.43Å; S341-V403 PolarHBondContact O-N 3.29Å; F375-V403 HydrophobicContact CB-CG1 3.86Å; F375-V403 HydrophobicContact CD2-CG1 4.45Å; F375-V403 HydrophobicContact CG-CG1 4.43Å; S377-V403 VanDerWaalsContact O-CA 3.3Å; S377-V403 WeakPolarHBondContact O-CA 3.43Å; S377-V403 WeakPolarHBondContact O-CG1 3.49Å; A378-V403 HydrophobicContact CB-CG2 4.16Å; V403-L409 HydrophobicContact CB-CD1 3.9Å; V403-L409 HydrophobicContact CG1-CD1 3.79Å; V403-L409 HydrophobicContact CG1-CD2 4.42Å; V403-L409 HydrophobicContact CG2-CD1 4.32Å; V403-L417 HydrophobicContact CG1-CD1 3.92Å; V403-L417 HydrophobicContact CG2-CD1 4.28Å; V403-F418 HydrophobicContact CG2-CE2 3.99Å; V403-F418 HydrophobicContact CG2-CZ 3.92Å
404	F	96.9	Very high	94.8	Very high	30 Å²	30	45.6 Å²	45.6	13%	0.132	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.1	168.9	-77.7	-65.5	0	0	0	109.3	V222 T338 V339 A340 N376 S377 K402	V222-F404 HydrophobicContact CG2-CD2 4.21Å; V222-F404 HydrophobicContact CG2-CE2 4.49Å; T338-F404 HydrophobicContact CG2-CD1 3.69Å; T338-F404 HydrophobicContact CG2-CE1 3.96Å; V339-F404 WeakPolarHBondContact O-CA 3.39Å; A340-F404 HydrophobicContact CB-CD1 4.17Å; A340-F404 HydrophobicContact CB-CE1 3.94Å; N376-F404 HydrophobicContact CB-CB 4.16Å; N376-F404 PolarHBondContact N-O 3Å; S377-F404 PolarHBondContact N-O 3.31Å; S377-F404 PolarHBondContact O-N 3.25Å; S377-F404 WeakPolarHBondContact OG-CD2 3.35Å; K402-F404 HydrophobicContact CD-CE2 3.99Å; K402-F404 HydrophobicContact CD-CZ 4.03Å; K402-F404 VanDerWaalsContact NZ-CZ 3.34Å
405	S	94.9	Very high	95.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	157.6	179.2	51.6	0	0	0	0	111.8	V339 F374 Q407	V339-S405 WeakPolarHBondContact CB-O 3.43Å; V339-S405 PolarHBondContact N-O 3.37Å; V339-S405 PolarHBondContact O-N 3.21Å; F374-S405 WeakPolarHBondContact O-CB 3.41Å; S405-Q407 WeakPolarHBondContact CB-O 3.24Å; S405-Q407 PolarHBondContact O-N 3.29Å; S405-Q407 PolarHBondContact OG-O 3.05Å
406	P	91.1	Very high	95.7	Very high	56 Å²	56	50.1 Å²	50.1	36%	0.364	26%	0.26	S	S	.	.	S	Bend	trans	-65.6	-23.4	175.8	-22.5	34.4	0	0	0	114.1	F374	F374-P406 WeakPolarHBondContact O-CD 3.33Å
407	Q	93	Very high	96	Very high	147 Å²	147	46.3 Å²	46.3	69%	0.687	24%	0.243	S	C	*	.	S	Bend	trans	-142.1	159.7	-176.3	-66.4	-91.1	-32.2	0	0	109.1	S405 L409	S405-Q407 WeakPolarHBondContact CB-O 3.24Å; S405-Q407 PolarHBondContact O-N 3.29Å; S405-Q407 PolarHBondContact OG-O 3.05Å; Q407-L409 PolarHBondContact O-N 3.37Å
408	P	95.8	Very high	96.2	Very high	66 Å²	66	43.9 Å²	43.9	43%	0.429	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-55	135.7	171.1	-24.7	36.1	0	0	0	111.9	V339 D410 V426	V339-P408 HydrophobicContact CG1-CB 4.5Å; V339-P408 HydrophobicContact CG1-CG 4.35Å; V339-P408 HydrophobicContact CG2-CG 4.28Å; P408-D410 PolarHBondContact O-N 3.25Å; P408-V426 HydrophobicContact CB-CG1 4.22Å; P408-V426 HydrophobicContact CG-CG1 4.43Å
409	L	96.5	Very high	96.3	Very high	21 Å²	21	48.9 Å²	48.9	11%	0.11	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-69.1	122.7	-179.2	-59	177	0	0	0	110.3	F374 V403 Q407 A413 L414 L417	F374-L409 HydrophobicContact CD2-CD2 3.94Å; F374-L409 HydrophobicContact CE2-CD2 4.12Å; V403-L409 HydrophobicContact CB-CD1 3.9Å; V403-L409 HydrophobicContact CG1-CD1 3.79Å; V403-L409 HydrophobicContact CG1-CD2 4.42Å; V403-L409 HydrophobicContact CG2-CD1 4.32Å; Q407-L409 PolarHBondContact O-N 3.37Å; L409-A413 HydrophobicContact CB-CB 4.28Å; L409-A413 HydrophobicContact CD2-CB 4.19Å; L409-L414 HydrophobicContact CB-CD2 4.01Å; L409-L414 HydrophobicContact CB-CG 3.89Å; L409-L414 HydrophobicContact CD1-CD2 3.85Å; L409-L417 HydrophobicContact CD1-CD1 4.47Å
410	D	96.1	Very high	96.4	Very high	92 Å²	92	51.7 Å²	51.7	49%	0.492	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-78.1	174	173.1	71.9	-1	0	0	0	111.7	P408 P412 A413 L414	P408-D410 PolarHBondContact O-N 3.25Å; D410-P412 VanDerWaalsContact CG-CD 3.48Å; D410-P412 WeakPolarHBondContact OD1-CD 3.19Å; D410-A413 PolarHBondContact O-N 3.05Å; D410-A413 WeakPolarHBondContact OD1-CB 3.27Å; D410-A413 PolarHBondContact OD1-N 2.85Å; D410-L414 WeakPolarHBondContact O-CB 3.22Å; D410-L414 WeakPolarHBondContact O-CG 3.43Å; D410-L414 PolarHBondContact O-N 3.12Å
411	K	96.5	Very high	96.4	Very high	153 Å²	153	55.3 Å²	55.3	67%	0.665	28%	0.277	S	S	*	.	H	α-helix	trans	-59.6	-44	-178.8	-67.3	-179.8	-177.7	176.8	0	112.6	K415	K411-K415 WeakPolarHBondContact O-CB 3.41Å; K411-K415 WeakPolarHBondContact O-CG 3.49Å; K411-K415 PolarHBondContact O-N 2.97Å
412	P	96.8	Very high	96.3	Very high	82 Å²	82	62 Å²	62	53%	0.532	30%	0.303	S	S	.	.	H	α-helix	trans	-55.2	-51.9	171.6	-27.7	34.2	0	0	0	113.6	D410 L414 K415 T416	D410-P412 VanDerWaalsContact CG-CD 3.48Å; D410-P412 WeakPolarHBondContact OD1-CD 3.19Å; P412-L414 VanDerWaalsContact C-N 3.32Å; P412-L414 PolarHBondContact O-N 2.92Å; P412-K415 PolarHBondContact O-N 3.26Å; P412-K415 VanDerWaalsContact O-N 3.13Å; P412-T416 PolarHBondContact O-N 2.93Å; P412-T416 PolarHBondContact O-OG1 3.43Å; P412-T416 VanDerWaalsContact O-OG1 3.08Å
413	A	96.9	Very high	96.3	Very high	8 Å²	8	63.1 Å²	63.1	7%	0.066	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-43.6	179.4	0	0	0	0	0	112.2	F374 L409 D410 T416 L417	F374-A413 HydrophobicContact CD2-CB 3.69Å; F374-A413 HydrophobicContact CE2-CB 3.47Å; F374-A413 VanDerWaalsContact CE2-CB 3.47Å; F374-A413 HydrophobicContact CG-CB 4.38Å; F374-A413 HydrophobicContact CZ-CB 4Å; L409-A413 HydrophobicContact CB-CB 4.28Å; L409-A413 HydrophobicContact CD2-CB 4.19Å; D410-A413 PolarHBondContact O-N 3.05Å; D410-A413 WeakPolarHBondContact OD1-CB 3.27Å; D410-A413 PolarHBondContact OD1-N 2.85Å; A413-T416 WeakPolarHBondContact O-CB 3.37Å; A413-T416 PolarHBondContact O-N 2.89Å; A413-L417 PolarHBondContact O-N 2.69Å; A413-L417 VanDerWaalsContact O-N 3.1Å
414	L	98	Very high	96.3	Very high	9 Å²	9	65.2 Å²	65.2	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-43	175.4	-73.4	167.5	0	0	0	112.3	V343 L409 D410 P412 T416 L417 F418 Y421 V424	V343-L414 HydrophobicContact CG2-CD2 4.1Å; L409-L414 HydrophobicContact CB-CD2 4.01Å; L409-L414 HydrophobicContact CB-CG 3.89Å; L409-L414 HydrophobicContact CD1-CD2 3.85Å; D410-L414 WeakPolarHBondContact O-CB 3.22Å; D410-L414 WeakPolarHBondContact O-CG 3.43Å; D410-L414 PolarHBondContact O-N 3.12Å; P412-L414 VanDerWaalsContact C-N 3.32Å; P412-L414 PolarHBondContact O-N 2.92Å; L414-T416 VanDerWaalsContact C-N 3.28Å; L414-T416 PolarHBondContact O-N 3.06Å; L414-L417 PolarHBondContact O-N 3.22Å; L414-F418 HydrophobicContact CD2-CD2 4.31Å; L414-F418 HydrophobicContact CD2-CE2 4.49Å; L414-F418 WeakPolarHBondContact O-CA 3.31Å; L414-F418 WeakPolarHBondContact O-CB 3.34Å; L414-F418 PolarHBondContact O-N 3.1Å; L414-Y421 HydrophobicContact CB-CD1 4.49Å; L414-Y421 HydrophobicContact CB-CE1 3.88Å; L414-Y421 HydrophobicContact CD1-CE1 4.25Å; L414-V424 HydrophobicContact CD1-CG2 4.06Å; L414-V424 HydrophobicContact CD2-CG2 4.01Å
415	K	97	Very high	96.4	Very high	151 Å²	151	66.3 Å²	66.3	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-67.8	-28.6	177.2	-75.1	179	178	-174	0	112.9	K411 P412	K411-K415 WeakPolarHBondContact O-CB 3.41Å; K411-K415 WeakPolarHBondContact O-CG 3.49Å; K411-K415 PolarHBondContact O-N 2.97Å; P412-K415 PolarHBondContact O-N 3.26Å; P412-K415 VanDerWaalsContact O-N 3.13Å
416	T	96.6	Very high	96.5	Very high	50 Å²	50	69.8 Å²	69.8	31%	0.307	35%	0.352	S	S	.	.	H	α-helix	trans	-66.8	-49.8	172.8	-61.1	0	0	0	0	110.4	N348 Y351 F374 P412 A413 L414	N348-T416 WeakPolarHBondContact CB-O 3.5Å; N348-T416 PolarHBondContact ND2-O 3.24Å; Y351-T416 HydrophobicContact CD1-CG2 4.48Å; Y351-T416 HydrophobicContact CD2-CG2 3.52Å; Y351-T416 HydrophobicContact CE1-CG2 4.42Å; Y351-T416 HydrophobicContact CE2-CG2 3.46Å; Y351-T416 VanDerWaalsContact CE2-CG2 3.46Å; Y351-T416 HydrophobicContact CG-CG2 4.06Å; F374-T416 HydrophobicContact CE1-CG2 4.1Å; F374-T416 HydrophobicContact CZ-CG2 4.09Å; P412-T416 PolarHBondContact O-N 2.93Å; P412-T416 PolarHBondContact O-OG1 3.43Å; P412-T416 VanDerWaalsContact O-OG1 3.08Å; A413-T416 WeakPolarHBondContact O-CB 3.37Å; A413-T416 PolarHBondContact O-N 2.89Å; L414-T416 VanDerWaalsContact C-N 3.28Å; L414-T416 PolarHBondContact O-N 3.06Å
417	L	97.1	Very high	96.7	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-80.2	-26.9	-176.3	-69.9	178.5	0	0	0	114.5	L347 N348 Y351 F352 F374 F375 V403 L409 A413 L414	L347-L417 WeakPolarHBondContact CD1-O 3.47Å; N348-L417 WeakPolarHBondContact CB-O 3.19Å; N348-L417 PolarHBondContact N-O 3.11Å; Y351-L417 HydrophobicContact CD1-CD2 4Å; Y351-L417 HydrophobicContact CE1-CD2 3.92Å; F352-L417 HydrophobicContact CZ-CD2 3.91Å; F374-L417 HydrophobicContact CE2-CD1 3.73Å; F374-L417 HydrophobicContact CE2-CG 3.97Å; F374-L417 HydrophobicContact CZ-CD1 4.13Å; F374-L417 HydrophobicContact CZ-CD2 4.34Å; F374-L417 HydrophobicContact CZ-CG 3.85Å; F375-L417 HydrophobicContact CD1-CD1 4.3Å; F375-L417 HydrophobicContact CD1-CD2 4.18Å; F375-L417 HydrophobicContact CE1-CD2 3.85Å; F375-L417 HydrophobicContact CG-CD1 4.27Å; F375-L417 HydrophobicContact CZ-CD2 4.04Å; V403-L417 HydrophobicContact CG1-CD1 3.92Å; V403-L417 HydrophobicContact CG2-CD1 4.28Å; L409-L417 HydrophobicContact CD1-CD1 4.47Å; A413-L417 PolarHBondContact O-N 2.69Å; A413-L417 VanDerWaalsContact O-N 3.1Å; L414-L417 PolarHBondContact O-N 3.22Å
418	F	97.7	Very high	96.7	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.009	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.8	-173.8	-60.5	-86.2	0	0	0	111.1	V343 Y346 L347 Y401 V403 L414 S420 Y421	V343-F418 HydrophobicContact CB-CE1 4.05Å; V343-F418 HydrophobicContact CB-CE2 3.97Å; V343-F418 HydrophobicContact CB-CZ 3.67Å; V343-F418 HydrophobicContact CG1-CD1 3.97Å; V343-F418 HydrophobicContact CG1-CD2 4.01Å; V343-F418 HydrophobicContact CG1-CE1 3.84Å; V343-F418 HydrophobicContact CG1-CE2 3.88Å; V343-F418 HydrophobicContact CG1-CG 4.06Å; V343-F418 HydrophobicContact CG1-CZ 3.79Å; V343-F418 HydrophobicContact CG2-CE2 3.79Å; V343-F418 HydrophobicContact CG2-CZ 3.91Å; Y346-F418 CarbonylContact O-C 3.45Å; Y346-F418 VanDerWaalsContact O-CA 3.29Å; Y346-F418 WeakPolarHBondContact O-CA 3.28Å; L347-F418 HydrophobicContact CD1-CD1 4.38Å; L347-F418 HydrophobicContact CD1-CE1 4Å; L347-F418 HydrophobicContact CD1-CZ 4.38Å; Y401-F418 AromaticContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CE1 3.66Å; Y401-F418 HydrophobicContact CD2-CZ 4.5Å; Y401-F418 HydrophobicContact CE2-CE1 4.34Å; Y401-F418 AromaticContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CE1 3.75Å; Y401-F418 HydrophobicContact CG-CZ 4.22Å; V403-F418 HydrophobicContact CG2-CE2 3.99Å; V403-F418 HydrophobicContact CG2-CZ 3.92Å; L414-F418 HydrophobicContact CD2-CD2 4.31Å; L414-F418 HydrophobicContact CD2-CE2 4.49Å; L414-F418 WeakPolarHBondContact O-CA 3.31Å; L414-F418 WeakPolarHBondContact O-CB 3.34Å; L414-F418 PolarHBondContact O-N 3.1Å; F418-S420 VanDerWaalsContact C-N 3.28Å; F418-S420 PolarHBondContact O-N 2.93Å; F418-Y421 HydrophobicContact CB-CD1 4.44Å
419	R	96.1	Very high	96.4	Very high	130 Å²	130	64.1 Å²	64.1	49%	0.491	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	-39.1	174.3	-72.4	178.1	176.7	-174.5	0.3	111	Y346 N348 S350 P355	Y346-R419 PolarHBondContact O-N 3.31Å; N348-R419 HydrophobicContact CB-CG 3.96Å; S350-R419 PolarHBondContact OG-NH2 3.36Å; P355-R419 PolarHBondContact O-NH2 3.26Å
420	S	96.6	Very high	96.1	Very high	60 Å²	60	65.8 Å²	65.8	42%	0.42	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	157.7	171.4	57.1	0	0	0	0	109.6	G345 Y346 F418	G345-S420 WeakPolarHBondContact CA-O 3.37Å; Y346-S420 VanDerWaalsContact CD2-OG 3.28Å; Y346-S420 WeakPolarHBondContact CD2-OG 3.47Å; Y346-S420 PolarHBondContact N-O 2.82Å; F418-S420 VanDerWaalsContact C-N 3.28Å; F418-S420 PolarHBondContact O-N 2.93Å
421	Y	97.3	Very high	95.6	Very high	86 Å²	86	61.7 Å²	61.7	34%	0.337	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.1	177.1	61.5	-91.5	0	0	0	110.4	V343 H344 L414 F418 V424	V343-Y421 HydrophobicContact CG1-CG 4.27Å; H344-Y421 CarbonylContact O-C 3.48Å; H344-Y421 WeakPolarHBondContact O-CA 3.48Å; H344-Y421 WeakPolarHBondContact O-CB 3.24Å; L414-Y421 HydrophobicContact CB-CD1 4.49Å; L414-Y421 HydrophobicContact CB-CE1 3.88Å; L414-Y421 HydrophobicContact CD1-CE1 4.25Å; F418-Y421 HydrophobicContact CB-CD1 4.44Å; Y421-V424 HydrophobicContact CD2-CG2 3.6Å; Y421-V424 HydrophobicContact CE2-CG2 3.65Å; Y421-V424 HydrophobicContact CG-CG2 4.29Å
422	Y	97.1	Very high	95.4	Very high	149 Å²	149	56.6 Å²	56.6	58%	0.584	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	-38.1	177.8	-60.4	-72.8	0	0	0	112	H344 Y346 A398	H344-Y422 AromaticContact CE1-CD2 3.67Å; H344-Y422 AromaticContact ND1-CD2 3.74Å; H344-Y422 AromaticContact NE2-CD2 3.99Å; H344-Y422 PolarHBondContact O-N 3.12Å; Y346-Y422 AromaticContact CE2-CE2 3.9Å; Y346-Y422 HydrophobicContact CE2-CE2 3.9Å; Y346-Y422 PolarHBondContact OH-OH 3.29Å; A398-Y422 HydrophobicContact CB-CD2 4.38Å; A398-Y422 HydrophobicContact CB-CE2 3.67Å
423	S	97.3	Very high	95.2	Very high	33 Å²	33	52.7 Å²	52.7	23%	0.231	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	154.8	-179.9	69.1	0	0	0	0	112.2	V343 H344 Q425	V343-S423 WeakPolarHBondContact CA-O 3.44Å; H344-S423 PolarHBondContact N-O 2.89Å; S423-Q425 PolarHBondContact OG-NE2 3.26Å; S423-Q425 PolarHBondContact OG-OE1 3.31Å
424	V	97.6	Very high	95.1	Very high	43 Å²	43	58.7 Å²	58.7	26%	0.261	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	121.5	170.8	-175.5	0	0	0	0	108	I342 V343 L414 Y421 V426	I342-V424 CarbonylContact O-C 3.52Å; I342-V424 WeakPolarHBondContact O-CA 3.38Å; V343-V424 HydrophobicContact CG1-CG2 4.23Å; V343-V424 HydrophobicContact CG2-CG1 4.13Å; V343-V424 HydrophobicContact CG2-CG2 4.15Å; L414-V424 HydrophobicContact CD1-CG2 4.06Å; L414-V424 HydrophobicContact CD2-CG2 4.01Å; Y421-V424 HydrophobicContact CD2-CG2 3.6Å; Y421-V424 HydrophobicContact CE2-CG2 3.65Å; Y421-V424 HydrophobicContact CG-CG2 4.29Å; V424-V426 HydrophobicContact CG1-CG2 3.88Å
425	Q	97.7	Very high	94.9	Very high	54 Å²	54	58.9 Å²	58.9	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.3	170.6	-70.3	72.6	32.8	0	0	107.7	V77 V79 S341 I342 S423	V77-Q425 HydrophobicContact CB-CB 4.5Å; V77-Q425 HydrophobicContact CG2-CB 4.35Å; V79-Q425 HydrophobicContact CG2-CG 4.26Å; S341-Q425 CarbonylContact C-O 3.55Å; S341-Q425 WeakPolarHBondContact CA-O 3.24Å; I342-Q425 HydrophobicContact CB-CB 4.49Å; I342-Q425 PolarHBondContact N-O 3.43Å; I342-Q425 PolarHBondContact O-N 3.2Å; I342-Q425 PolarHBondContact O-OE1 2.82Å; S423-Q425 PolarHBondContact OG-NE2 3.26Å; S423-Q425 PolarHBondContact OG-OE1 3.31Å
426	V	97.1	Very high	94.4	Very high	73 Å²	73	52.6 Å²	52.6	44%	0.442	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129	-177.8	-177.3	0	0	0	0	109	V339 P408 V424	V339-V426 HydrophobicContact CG1-CG1 3.56Å; P408-V426 HydrophobicContact CB-CG1 4.22Å; P408-V426 HydrophobicContact CG-CG1 4.43Å; V424-V426 HydrophobicContact CG1-CG2 3.88Å
427	T	95.3	Very high	93.6	Very high	28 Å²	28	51.6 Å²	51.6	17%	0.172	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.8	167.7	-42.4	0	0	0	0	109.4	V339 A340 W429	V339-T427 WeakPolarHBondContact CA-O 3.15Å; A340-T427 PolarHBondContact N-O 3.34Å; A340-T427 PolarHBondContact O-N 2.88Å; T427-W429 HydrophobicContact CG2-CD2 3.86Å; T427-W429 HydrophobicContact CG2-CE3 4.28Å; T427-W429 HydrophobicContact CG2-CH2 3.75Å; T427-W429 HydrophobicContact CG2-CZ2 3.27Å; T427-W429 HydrophobicContact CG2-CZ3 4.23Å
428	D	93.2	Very high	92.6	Very high	85 Å²	85	58.1 Å²	58.1	46%	0.455	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113.1	175.9	-175.3	-9.1	0	0	0	109.1	H337 V339	H337-D428 IonicContact CE1-OD1 3.86Å; H337-D428 IonicContact CG-OD1 3.19Å; H337-D428 IonicContact ND1-OD1 3.47Å; H337-D428 PolarHBondContact ND1-OD1 3.09Å; H337-D428 IonicContact ND1-OD2 2.87Å; V339-D428 HydrophobicContact CG2-CB 4.4Å
429	W	90.8	Very high	91.8	Very high	38 Å²	38	61.4 Å²	61.4	14%	0.144	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.3	-179.7	-60.2	114.9	0	0	0	110.7	R73 A75 S86 H337 T338 T427 A431	R73-W429 HydrophobicContact CG-CD2 4.45Å; R73-W429 HydrophobicContact CG-CE3 3.88Å; R73-W429 HydrophobicContact CG-CZ3 4.23Å; A75-W429 HydrophobicContact CB-CH2 3.56Å; A75-W429 HydrophobicContact CB-CZ2 3.78Å; S86-W429 PolarHBondContact O-NE1 2.95Å; H337-W429 CarbonylContact C-O 3.31Å; H337-W429 VanDerWaalsContact CA-O 3.32Å; H337-W429 WeakPolarHBondContact CA-O 3.49Å; T338-W429 PolarHBondContact N-O 3.24Å; T338-W429 WeakPolarHBondContact O-CB 3.46Å; T338-W429 PolarHBondContact O-N 3.07Å; T427-W429 HydrophobicContact CG2-CD2 3.86Å; T427-W429 HydrophobicContact CG2-CE3 4.28Å; T427-W429 HydrophobicContact CG2-CH2 3.75Å; T427-W429 HydrophobicContact CG2-CZ2 3.27Å; T427-W429 HydrophobicContact CG2-CZ3 4.23Å; W429-A431 HydrophobicContact CB-CB 3.71Å; W429-A431 PolarHBondContact O-N 2.97Å
430	Q	89.5	Confident	91.4	Very high	56 Å²	56	61.5 Å²	61.5	26%	0.262	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	74.1	152.1	-69.4	-179.8	-40.4	0	0	107.8	S314 V315 H337	S314-Q430 PolarHBondContact O-NE2 3.39Å; V315-Q430 VanDerWaalsContact CA-OE1 3.3Å; H337-Q430 WeakPolarHBondContact CE1-CG 3.29Å; H337-Q430 PolarHBondContact CE1-NE2 3.34Å; H337-Q430 PolarHBondContact NE2-NE2 3.31Å; H337-Q430 VanDerWaalsContact NE2-NE2 3.18Å
431	A	85.6	Confident	91.2	Very high	5 Å²	5	59.5 Å²	59.5	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-33	-161.4	0	0	0	0	0	112.8	R73 H336 W429	R73-A431 PolarHBondContact NH1-O 3Å; H336-A431 PolarHBondContact O-N 2.87Å; W429-A431 HydrophobicContact CB-CB 3.71Å; W429-A431 PolarHBondContact O-N 2.97Å
432	Y	92.2	Very high	91.1	Very high	47 Å²	47	55.9 Å²	55.9	18%	0.184	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	153.1	-168.2	-51.8	-62.8	0	0	0	110.4	N223 Y224 Y335 H336	N223-Y432 WeakPolarHBondContact O-CE2 3.4Å; N223-Y432 PolarHBondContact O-OH 2.81Å; Y224-Y432 AromaticContact CD1-CD1 3.55Å; Y224-Y432 HydrophobicContact CD1-CD1 3.55Å; Y224-Y432 AromaticContact CD1-CD2 3.84Å; Y224-Y432 HydrophobicContact CD1-CD2 3.84Å; Y224-Y432 AromaticContact CD1-CE1 3.7Å; Y224-Y432 HydrophobicContact CD1-CE1 3.7Å; Y224-Y432 AromaticContact CD1-CE2 4Å; Y224-Y432 HydrophobicContact CD1-CE2 4Å; Y224-Y432 AromaticContact CD1-CG 3.62Å; Y224-Y432 HydrophobicContact CD1-CG 3.62Å; Y224-Y432 AromaticContact CD1-CZ 3.93Å; Y224-Y432 AromaticContact CE1-CD1 3.74Å; Y224-Y432 HydrophobicContact CE1-CD1 3.74Å; Y224-Y432 AromaticContact CE1-CE1 3.79Å; Y224-Y432 HydrophobicContact CE1-CE1 3.79Å; Y224-Y432 HydrophobicContact CE1-CG 4.25Å; Y224-Y432 WeakPolarHBondContact O-CD2 3.39Å; Y335-Y432 CarbonylContact C-O 3.53Å; Y335-Y432 VanDerWaalsContact CA-O 3.25Å; Y335-Y432 WeakPolarHBondContact CA-O 3.28Å; Y335-Y432 WeakPolarHBondContact CB-O 3.5Å; Y335-Y432 VanDerWaalsContact CD1-C 3.47Å; Y335-Y432 WeakPolarHBondContact CD1-O 3.26Å; H336-Y432 PolarHBondContact N-O 3.45Å
433	P	93.6	Very high	91	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	142.9	160	-26.5	36.5	0	0	0	110.9	Q226 Y335 Y435 E457 W458	Q226-P433 PolarHBondContact NE2-O 3.36Å; Y335-P433 HydrophobicContact CE1-CG 4.44Å; Y335-P433 HydrophobicContact CE2-CG 4.34Å; P433-Y435 HydrophobicContact CB-CD1 4.09Å; P433-Y435 HydrophobicContact CB-CE1 3.88Å; P433-Y435 HydrophobicContact CG-CE1 4.07Å; P433-Y435 VanDerWaalsContact O-CD2 3.27Å; P433-Y435 WeakPolarHBondContact O-CD2 3.35Å; P433-Y435 WeakPolarHBondContact O-CE2 3.21Å; P433-Y435 PolarHBondContact O-N 2.81Å; P433-Y435 VanDerWaalsContact O-N 3.12Å; P433-E457 HydrophobicContact CG-CB 3.99Å; P433-W458 HydrophobicContact CB-CD2 3.85Å; P433-W458 HydrophobicContact CB-CE3 4.04Å; P433-W458 HydrophobicContact CB-CG 4.36Å; P433-W458 HydrophobicContact CB-CH2 3.97Å; P433-W458 HydrophobicContact CB-CZ2 3.83Å; P433-W458 HydrophobicContact CB-CZ3 4.1Å; P433-W458 HydrophobicContact CG-CD2 4.04Å; P433-W458 HydrophobicContact CG-CG 4.07Å; P433-W458 HydrophobicContact CG-CZ2 4.3Å
434	R	93.9	Very high	91	Very high	133 Å²	133	50.1 Å²	50.1	50%	0.502	27%	0.266	S	S	.	.			trans	-74.7	98.4	162.8	-178.5	176.5	-63.2	-170.4	0.6	106.5	S334 H336 Q439	S334-R434 WeakPolarHBondContact O-CB 3.3Å; S334-R434 PolarHBondContact O-N 2.76Å; H336-R434 HydrophobicContact CB-CB 4.49Å; R434-Q439 PolarHBondContact O-OE1 2.88Å
435	Y	93.3	Very high	91	Very high	13 Å²	13	49.6 Å²	49.6	5%	0.051	26%	0.264	C	S	.	.			trans	-72.3	142.9	-171	-66.4	-69.3	0	0	0	111.4	Y224 I230 V234 P433 E457 S461	Y224-Y435 HydrophobicContact CD1-CE2 4.15Å; Y224-Y435 HydrophobicContact CE1-CE2 4.34Å; Y224-Y435 HydrophobicContact CG-CE2 4.39Å; I230-Y435 HydrophobicContact CG2-CD2 4.16Å; I230-Y435 HydrophobicContact CG2-CG 4.43Å; V234-Y435 HydrophobicContact CB-CE1 4.41Å; V234-Y435 HydrophobicContact CG1-CD1 4.2Å; V234-Y435 HydrophobicContact CG1-CD2 3.81Å; V234-Y435 HydrophobicContact CG1-CE1 3.91Å; V234-Y435 HydrophobicContact CG1-CE2 3.5Å; V234-Y435 HydrophobicContact CG1-CG 4.16Å; V234-Y435 HydrophobicContact CG2-CD1 3.64Å; V234-Y435 HydrophobicContact CG2-CE1 3.54Å; V234-Y435 HydrophobicContact CG2-CG 4.23Å; P433-Y435 HydrophobicContact CB-CD1 4.09Å; P433-Y435 HydrophobicContact CB-CE1 3.88Å; P433-Y435 HydrophobicContact CG-CE1 4.07Å; P433-Y435 VanDerWaalsContact O-CD2 3.27Å; P433-Y435 WeakPolarHBondContact O-CD2 3.35Å; P433-Y435 WeakPolarHBondContact O-CE2 3.21Å; P433-Y435 PolarHBondContact O-N 2.81Å; P433-Y435 VanDerWaalsContact O-N 3.12Å; Y435-E457 VanDerWaalsContact CE1-O 3.27Å; Y435-E457 WeakPolarHBondContact CE1-O 3.39Å; Y435-E457 PolarHBondContact OH-O 3.37Å; Y435-S461 WeakPolarHBondContact OH-CB 3.26Å; Y435-S461 PolarHBondContact OH-N 3.08Å
436	G	86.8	Confident	90.9	Very high	20 Å²	20	48 Å²	48	21%	0.206	26%	0.257	C	S	.	.			trans	-151.9	151.5	169.7	0	0	0	0	0	110.8	T438	G436-T438 PolarHBondContact O-N 3.49Å
437	S	79.9	Confident	90.8	Very high	29 Å²	29	47 Å²	47	20%	0.203	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.3	-173.4	-49	0	0	0	0	114.6	R195 S197	R195-S437 CarbonylContact C-O 3.18Å; R195-S437 WeakPolarHBondContact CA-O 3.43Å; R195-S437 WeakPolarHBondContact O-CB 3.3Å; S197-S437 PolarHBondContact N-OG 3.32Å
438	T	77.2	Confident	90.6	Very high	136 Å²	136	51.7 Å²	51.7	83%	0.834	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	3.3	-177.2	57.1	0	0	0	0	113.6	G436	G436-T438 PolarHBondContact O-N 3.49Å
439	Q	79.9	Confident	90.7	Very high	71 Å²	71	48.5 Å²	48.5	33%	0.332	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-95.5	133.9	-175.3	-71.6	162.2	-16.8	0	0	110.5	R434 W458	R434-Q439 PolarHBondContact O-OE1 2.88Å; Q439-W458 HydrophobicContact CB-CZ3 4.48Å; Q439-W458 VanDerWaalsContact OE1-CZ3 3.27Å
440	D	87.8	Confident	91	Very high	132 Å²	132	46.7 Å²	46.7	71%	0.706	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-70.4	153.4	171.5	-63.2	-43.9	0	0	0	110.9
441	L	93.1	Very high	91.4	Very high	19 Å²	19	44 Å²	44	10%	0.099	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-79.3	138	177.3	-52.4	173.7	0	0	0	109.1	V178 E179 L182 T194 W458 A459	V178-L441 HydrophobicContact CB-CB 4.29Å; V178-L441 HydrophobicContact CB-CD1 3.95Å; V178-L441 HydrophobicContact CG1-CD1 3.71Å; E179-L441 HydrophobicContact CG-CD1 4.1Å; E179-L441 WeakPolarHBondContact OE1-CB 3.48Å; L182-L441 HydrophobicContact CD1-CD1 3.95Å; T194-L441 HydrophobicContact CG2-CD1 4.39Å; L441-W458 HydrophobicContact CD2-CB 3.85Å; L441-A459 HydrophobicContact CD2-CB 4.44Å
442	P	94.3	Very high	92	Very high	9 Å²	9	43.8 Å²	43.8	6%	0.058	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-63.1	148.6	177.2	-25.1	35.4	0	0	0	112.5	I331 Y452 W458	I331-P442 HydrophobicContact CG2-CB 3.87Å; I331-P442 HydrophobicContact CG2-CG 3.88Å; P442-Y452 HydrophobicContact CB-CD1 4.1Å; P442-Y452 HydrophobicContact CB-CE1 3.77Å; P442-Y452 HydrophobicContact CG-CE1 4.45Å; P442-W458 HydrophobicContact CG-CB 4.44Å; P442-W458 VanDerWaalsContact CG-CD1 3.42Å; P442-W458 HydrophobicContact CG-CD2 4.08Å; P442-W458 HydrophobicContact CG-CG 3.7Å
443	P	94.9	Very high	92.3	Very high	50 Å²	50	41.7 Å²	41.7	33%	0.325	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-66.3	148	179.7	28.8	-36.1	0	0	0	111.6	L446 Y452	P443-L446 HydrophobicContact CG-CD2 4.06Å; P443-Y452 WeakPolarHBondContact O-CD1 3.41Å
444	V	97.1	Very high	92.4	Very high	11 Å²	11	42 Å²	42	7%	0.067	22%	0.223	C	C	.	.	S	Bend	trans	-82.6	-31.4	170.6	175.8	0	0	0	0	110.9	V178 Y451 Y452 I473 L476	V178-V444 HydrophobicContact CG2-CG2 3.76Å; V444-Y451 CarbonylContact O-C 3.59Å; V444-Y451 VanDerWaalsContact O-CA 3.28Å; V444-Y451 WeakPolarHBondContact O-CA 3.34Å; V444-Y452 PolarHBondContact O-N 2.98Å; V444-I473 HydrophobicContact CG1-CD1 4.25Å; V444-I473 HydrophobicContact CG1-CG1 3.82Å; V444-L476 HydrophobicContact CG1-CD2 4.37Å
445	V	96.9	Very high	92.4	Very high	33 Å²	33	35.7 Å²	35.7	20%	0.2	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.2	178.5	-179.5	0	0	0	0	108.4	H447 Y451 L476 R480	V445-H447 WeakPolarHBondContact CG1-O 3.2Å; V445-Y451 HydrophobicContact CG2-CD1 4.05Å; V445-Y451 HydrophobicContact CG2-CE1 4.04Å; V445-L476 HydrophobicContact CG2-CD2 3.76Å; V445-R480 VanDerWaalsContact CG1-NH1 3.3Å
446	L	95.8	Very high	92.6	Very high	20 Å²	20	35.2 Å²	35.2	11%	0.105	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-42.3	174.6	-59.2	177.5	0	0	0	111	L311 F321 L328 I331 P443 L450	L311-L446 HydrophobicContact CD1-CD1 3.99Å; F321-L446 HydrophobicContact CE1-CD1 4.28Å; F321-L446 HydrophobicContact CZ-CD1 4.06Å; L328-L446 HydrophobicContact CD1-CB 4.37Å; L328-L446 WeakPolarHBondContact CD2-O 3.3Å; I331-L446 HydrophobicContact CD1-CD2 4.17Å; P443-L446 HydrophobicContact CG-CD2 4.06Å; L446-L450 HydrophobicContact CB-CD2 3.92Å; L446-L450 HydrophobicContact CB-CG 3.95Å; L446-L450 HydrophobicContact CD1-CD2 4.28Å; L446-L450 HydrophobicContact CD1-CG 4.18Å; L446-L450 PolarHBondContact N-O 3.09Å
447	H	95.3	Very high	93.1	Very high	52 Å²	52	34.3 Å²	34.3	24%	0.241	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	175.7	176.3	-169.7	-95.8	0	0	0	108.9	Y287 F324 L328 V445 S449 L450	Y287-H447 AromaticContact CZ-ND1 3.85Å; Y287-H447 WeakPolarHBondContact OH-CB 3.38Å; Y287-H447 PolarHBondContact OH-ND1 3.06Å; F324-H447 HydrophobicContact CD1-CB 4.33Å; F324-H447 HydrophobicContact CE1-CB 3.94Å; L328-H447 HydrophobicContact CD2-CB 4.43Å; V445-H447 WeakPolarHBondContact CG1-O 3.2Å; H447-S449 PolarHBondContact O-N 2.62Å; H447-L450 HydrophobicContact CB-CB 4.01Å; H447-L450 HydrophobicContact CB-CD2 4.11Å; H447-L450 PolarHBondContact N-O 2.96Å; H447-L450 PolarHBondContact O-N 2.88Å; H447-L450 VanDerWaalsContact O-O 3.1Å
448	E	91.4	Very high	93.8	Very high	127 Å²	127	33.4 Å²	33.4	59%	0.593	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	119.9	175.7	-174.3	177	-165.4	0	0	111.1	Y287 L450	Y287-E448 WeakPolarHBondContact CE2-O 3.33Å; Y287-E448 PolarHBondContact OH-O 2.98Å; E448-L450 PolarHBondContact O-N 3.46Å
449	S	94.6	Very high	94.6	Very high	17 Å²	17	27 Å²	27	12%	0.119	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	15.6	-175	-56.4	0	0	0	0	115.8	D303 I304 V305 H447	D303-S449 WeakPolarHBondContact O-CB 3.29Å; I304-S449 WeakPolarHBondContact CA-O 3.15Å; V305-S449 PolarHBondContact N-O 3.26Å; H447-S449 PolarHBondContact O-N 2.62Å
450	L	97.5	Very high	95.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	114.6	170.5	175.9	67.3	0	0	0	110.3	I276 Y287 V305 V307 F321 F324 L328 L446 H447 E448	I276-L450 HydrophobicContact CG2-CD1 4.39Å; Y287-L450 HydrophobicContact CE1-CB 4.04Å; Y287-L450 HydrophobicContact CE1-CD2 4.12Å; Y287-L450 HydrophobicContact CE2-CB 4.15Å; Y287-L450 WeakPolarHBondContact OH-CB 3.45Å; V305-L450 HydrophobicContact CB-CD1 3.58Å; V305-L450 HydrophobicContact CG1-CD1 3.55Å; V305-L450 WeakPolarHBondContact O-CA 3.39Å; V307-L450 HydrophobicContact CG2-CD1 4.14Å; F321-L450 HydrophobicContact CD1-CD2 4.39Å; F321-L450 HydrophobicContact CE1-CD2 4.07Å; F324-L450 HydrophobicContact CE1-CD2 3.81Å; F324-L450 HydrophobicContact CZ-CD2 3.72Å; L328-L450 HydrophobicContact CD1-CD2 4.27Å; L446-L450 HydrophobicContact CB-CD2 3.92Å; L446-L450 HydrophobicContact CB-CG 3.95Å; L446-L450 HydrophobicContact CD1-CD2 4.28Å; L446-L450 HydrophobicContact CD1-CG 4.18Å; L446-L450 PolarHBondContact N-O 3.09Å; H447-L450 HydrophobicContact CB-CB 4.01Å; H447-L450 HydrophobicContact CB-CD2 4.11Å; H447-L450 PolarHBondContact N-O 2.96Å; H447-L450 PolarHBondContact O-N 2.88Å; H447-L450 VanDerWaalsContact O-O 3.1Å; E448-L450 PolarHBondContact O-N 3.46Å
451	Y	98.3	Very high	95.6	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.4	-171.8	-55	-83	0	0	0	112.3	I304 V305 V306 V307 V444 V445 I473 L476 A477	I304-Y451 HydrophobicContact CG2-CD2 4.1Å; I304-Y451 HydrophobicContact CG2-CE2 3.89Å; V305-Y451 PolarHBondContact O-N 3.47Å; V306-Y451 HydrophobicContact CG2-CD2 4.28Å; V307-Y451 PolarHBondContact N-O 3.26Å; V444-Y451 CarbonylContact O-C 3.59Å; V444-Y451 VanDerWaalsContact O-CA 3.28Å; V444-Y451 WeakPolarHBondContact O-CA 3.34Å; V445-Y451 HydrophobicContact CG2-CD1 4.05Å; V445-Y451 HydrophobicContact CG2-CE1 4.04Å; Y451-I473 HydrophobicContact CD1-CG2 4.49Å; Y451-I473 HydrophobicContact CD2-CG2 4.14Å; Y451-I473 HydrophobicContact CG-CG2 3.9Å; Y451-L476 HydrophobicContact CD1-CD2 3.98Å; Y451-L476 HydrophobicContact CE1-CD2 3.6Å; Y451-L476 HydrophobicContact CE1-CG 3.85Å; Y451-A477 HydrophobicContact CE2-CB 3.86Å; Y451-A477 WeakPolarHBondContact OH-CA 3.16Å
452	Y	98.1	Very high	95.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.3	174.7	179.1	-134.6	0	0	0	110.9	V307 T309 L311 Q312 I331 P442 P443 V444 N454 G455	V307-Y452 HydrophobicContact CB-CD2 4.32Å; V307-Y452 HydrophobicContact CG1-CD2 4.33Å; T309-Y452 WeakPolarHBondContact O-CE2 3.39Å; L311-Y452 HydrophobicContact CB-CE2 4.31Å; L311-Y452 HydrophobicContact CD1-CD2 3.81Å; L311-Y452 HydrophobicContact CD1-CE2 3.95Å; L311-Y452 HydrophobicContact CD1-CG 4.27Å; L311-Y452 HydrophobicContact CG-CD2 4.21Å; L311-Y452 HydrophobicContact CG-CE2 3.87Å; L311-Y452 PolarHBondContact N-OH 3.16Å; Q312-Y452 PolarHBondContact OE1-OH 3.01Å; I331-Y452 HydrophobicContact CD1-CD1 3.67Å; I331-Y452 HydrophobicContact CD1-CE1 3.56Å; I331-Y452 HydrophobicContact CD1-CG 4.31Å; I331-Y452 HydrophobicContact CG2-CE1 4.37Å; P442-Y452 HydrophobicContact CB-CD1 4.1Å; P442-Y452 HydrophobicContact CB-CE1 3.77Å; P442-Y452 HydrophobicContact CG-CE1 4.45Å; P443-Y452 WeakPolarHBondContact O-CD1 3.41Å; V444-Y452 PolarHBondContact O-N 2.98Å; Y452-N454 HydrophobicContact CE2-CB 3.7Å; Y452-G455 VanDerWaalsContact CE1-N 3.29Å
453	L	98.1	Very high	95.8	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	11%	0.106	C	C	.	.	S	Bend	trans	-82.1	-43.6	-175.3	-174.4	152.3	0	0	0	112.4	G44 T48 V306 V307 A308 G455 I456 A469 A470 I473	G44-L453 VanDerWaalsContact C-CD1 3.48Å; T48-L453 VanDerWaalsContact OG1-CD1 3.27Å; T48-L453 WeakPolarHBondContact OG1-CD1 3.25Å; V306-L453 HydrophobicContact CG1-CB 4.39Å; V307-L453 PolarHBondContact O-N 3.05Å; A308-L453 HydrophobicContact CB-CB 4.23Å; A308-L453 HydrophobicContact CB-CD1 4.2Å; L453-G455 PolarHBondContact O-N 3.29Å; L453-I456 WeakPolarHBondContact O-CG2 3.3Å; L453-I456 PolarHBondContact O-N 2.79Å; L453-A469 HydrophobicContact CG-CB 4.25Å; L453-A470 HydrophobicContact CD1-CB 4.08Å; L453-I473 HydrophobicContact CB-CD1 3.78Å; L453-I473 HydrophobicContact CD1-CD1 4.46Å; L453-I473 HydrophobicContact CG-CD1 4.19Å
454	N	96.1	Very high	95.9	Very high	7 Å²	7	17 Å²	17	4%	0.037	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-73.5	-0	-170.8	-55	77.2	0	0	0	113.6	A308 T309 P310 Y452 I456 E457	A308-N454 WeakPolarHBondContact CA-OD1 3.46Å; A308-N454 PolarHBondContact O-OD1 3.44Å; T309-N454 WeakPolarHBondContact CA-OD1 3.29Å; T309-N454 PolarHBondContact N-OD1 2.95Å; P310-N454 HydrophobicContact CG-CB 4.5Å; Y452-N454 HydrophobicContact CE2-CB 3.7Å; N454-I456 PolarHBondContact O-N 3.32Å; N454-E457 HydrophobicContact CB-CG 4.45Å; N454-E457 PolarHBondContact ND2-OE1 3.18Å; N454-E457 WeakPolarHBondContact O-CB 3.41Å; N454-E457 PolarHBondContact O-N 3.39Å
455	G	94.9	Very high	95.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-56.1	-35.2	167.7	0	0	0	0	0	112.5	Y452 L453 E457 W458	Y452-G455 VanDerWaalsContact CE1-N 3.29Å; L453-G455 PolarHBondContact O-N 3.29Å; G455-E457 PolarHBondContact O-N 2.86Å; G455-E457 VanDerWaalsContact O-N 3.11Å; G455-W458 WeakPolarHBondContact O-CB 3.35Å; G455-W458 PolarHBondContact O-N 3.14Å
456	I	96.9	Very high	96	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.021	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-59.6	-26.4	178.4	-165	59.5	0	0	0	113.4	V178 L453 N454 W458 A459 G460 M465 A469	V178-I456 HydrophobicContact CG1-CD1 3.68Å; V178-I456 HydrophobicContact CG2-CD1 4.27Å; L453-I456 WeakPolarHBondContact O-CG2 3.3Å; L453-I456 PolarHBondContact O-N 2.79Å; N454-I456 PolarHBondContact O-N 3.32Å; I456-W458 PolarHBondContact O-N 3.12Å; I456-A459 HydrophobicContact CD1-CB 4.49Å; I456-A459 PolarHBondContact O-N 3.34Å; I456-A459 VanDerWaalsContact O-N 3.08Å; I456-G460 PolarHBondContact O-N 3.04Å; I456-G460 VanDerWaalsContact O-N 3.08Å; I456-M465 HydrophobicContact CD1-CE 3.97Å; I456-M465 HydrophobicContact CG1-CB 4.24Å; I456-M465 HydrophobicContact CG1-CE 4Å; I456-A469 HydrophobicContact CB-CB 3.76Å; I456-A469 HydrophobicContact CG1-CB 4.06Å; I456-A469 HydrophobicContact CG2-CB 3.61Å
457	E	96.1	Very high	96.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-66.1	-21.3	-177.1	-62.6	-168.9	-151.5	0	0	112.9	R73 P433 Y435 N454 G455 G460 S461	R73-E457 IonicContact CZ-OE1 2.81Å; R73-E457 IonicContact CZ-OE2 3.91Å; R73-E457 IonicContact NH1-OE1 2.74Å; R73-E457 IonicContact NH1-OE2 2.62Å; R73-E457 PolarHBondContact NH1-OE2 3.49Å; R73-E457 VanDerWaalsContact NH2-CD 3.33Å; R73-E457 IonicContact NH2-OE1 3.62Å; R73-E457 PolarHBondContact NH2-OE1 2.84Å; R73-E457 IonicContact NH2-OE2 2.77Å; R73-E457 PolarHBondContact NH2-OE2 3.44Å; P433-E457 HydrophobicContact CG-CB 3.99Å; Y435-E457 VanDerWaalsContact CE1-O 3.27Å; Y435-E457 WeakPolarHBondContact CE1-O 3.39Å; Y435-E457 PolarHBondContact OH-O 3.37Å; N454-E457 HydrophobicContact CB-CG 4.45Å; N454-E457 PolarHBondContact ND2-OE1 3.18Å; N454-E457 WeakPolarHBondContact O-CB 3.41Å; N454-E457 PolarHBondContact O-N 3.39Å; G455-E457 PolarHBondContact O-N 2.86Å; G455-E457 VanDerWaalsContact O-N 3.11Å; E457-G460 CarbonylContact O-C 3.56Å; E457-G460 PolarHBondContact O-N 3.08Å; E457-S461 PolarHBondContact O-N 2.95Å; E457-S461 PolarHBondContact OE2-OG 2.97Å; E457-S461 VanDerWaalsContact OE2-OG 3.11Å
458	W	95.1	Very high	96.3	Very high	11 Å²	11	12.1 Å²	12.1	4%	0.042	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-73.7	-30.2	176	-69.2	74.9	0	0	0	112.4	Q312 Y335 P433 Q439 L441 P442 G455 I456	Q312-W458 HydrophobicContact CG-CZ2 3.9Å; Y335-W458 HydrophobicContact CE2-CZ2 4.24Å; P433-W458 HydrophobicContact CB-CD2 3.85Å; P433-W458 HydrophobicContact CB-CE3 4.04Å; P433-W458 HydrophobicContact CB-CG 4.36Å; P433-W458 HydrophobicContact CB-CH2 3.97Å; P433-W458 HydrophobicContact CB-CZ2 3.83Å; P433-W458 HydrophobicContact CB-CZ3 4.1Å; P433-W458 HydrophobicContact CG-CD2 4.04Å; P433-W458 HydrophobicContact CG-CG 4.07Å; P433-W458 HydrophobicContact CG-CZ2 4.3Å; Q439-W458 HydrophobicContact CB-CZ3 4.48Å; Q439-W458 VanDerWaalsContact OE1-CZ3 3.27Å; L441-W458 HydrophobicContact CD2-CB 3.85Å; P442-W458 HydrophobicContact CG-CB 4.44Å; P442-W458 VanDerWaalsContact CG-CD1 3.42Å; P442-W458 HydrophobicContact CG-CD2 4.08Å; P442-W458 HydrophobicContact CG-CG 3.7Å; G455-W458 WeakPolarHBondContact O-CB 3.35Å; G455-W458 PolarHBondContact O-N 3.14Å; I456-W458 PolarHBondContact O-N 3.12Å
459	A	94.8	Very high	96.6	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-36.9	167.2	0	0	0	0	0	111	V178 L182 F233 V234 L441 I456 M465	V178-A459 HydrophobicContact CG1-CB 3.73Å; L182-A459 HydrophobicContact CD1-CB 3.93Å; F233-A459 VanDerWaalsContact CD1-O 3.31Å; F233-A459 WeakPolarHBondContact CD1-O 3.23Å; V234-A459 WeakPolarHBondContact CG2-O 3.22Å; L441-A459 HydrophobicContact CD2-CB 4.44Å; I456-A459 HydrophobicContact CD1-CB 4.49Å; I456-A459 PolarHBondContact O-N 3.34Å; I456-A459 VanDerWaalsContact O-N 3.08Å; A459-M465 HydrophobicContact CB-CE 4.46Å
460	G	93.8	Very high	96.8	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	4%	0.036	C	C	.	.			trans	174.8	132.9	172.7	0	0	0	0	0	110.9	I456 E457 M465	I456-G460 PolarHBondContact O-N 3.04Å; I456-G460 VanDerWaalsContact O-N 3.08Å; E457-G460 CarbonylContact O-C 3.56Å; E457-G460 PolarHBondContact O-N 3.08Å; G460-M465 WeakPolarHBondContact O-CB 3.39Å; G460-M465 VanDerWaalsContact O-CG 3.28Å; G460-M465 WeakPolarHBondContact O-CG 3.33Å
461	S	94.6	Very high	96.9	Very high	11 Å²	11	6.8 Å²	6.8	8%	0.077	4%	0.041	C	C	.	.			trans	-99.2	110	-177.4	-170.3	0	0	0	0	110.8	Y224 Y435 E457	Y224-S461 PolarHBondContact OH-O 2.76Å; Y435-S461 WeakPolarHBondContact OH-CB 3.26Å; Y435-S461 PolarHBondContact OH-N 3.08Å; E457-S461 PolarHBondContact O-N 2.95Å; E457-S461 PolarHBondContact OE2-OG 2.97Å; E457-S461 VanDerWaalsContact OE2-OG 3.11Å
462	A	95.4	Very high	96.9	Very high	34 Å²	34	6.9 Å²	6.9	28%	0.281	4%	0.041	S	C	.	.	S	Bend	trans	-152.7	160.3	173.1	0	0	0	0	0	109.4	V237 E464 M465 S466	V237-A462 HydrophobicContact CG1-CB 4.16Å; A462-E464 PolarHBondContact O-N 2.84Å; A462-M465 HydrophobicContact CB-CB 4.45Å; A462-M465 HydrophobicContact CB-CG 4.04Å; A462-M465 PolarHBondContact O-N 3.38Å; A462-M465 VanDerWaalsContact O-N 3.1Å; A462-S466 PolarHBondContact O-N 2.86Å; A462-S466 VanDerWaalsContact O-N 3.12Å
463	M	96.7	Very high	96.9	Very high	22 Å²	22	6.9 Å²	6.9	11%	0.108	4%	0.042	C	C	.	.	H	α-helix	trans	-51.3	-44.4	175.4	-74.2	178.6	-97.9	0	0	111.8	I43 L74 I90 I91 M98 N253 S466 S467	I43-M463 HydrophobicContact CG2-CG 4.48Å; L74-M463 HydrophobicContact CD1-CG 4.14Å; L74-M463 HydrophobicContact CD1-SD 3.83Å; L74-M463 HydrophobicContact CD2-CE 4.2Å; L74-M463 HydrophobicContact CD2-CG 3.75Å; L74-M463 HydrophobicContact CD2-SD 3.53Å; L74-M463 VanDerWaalsContact CD2-SD 3.53Å; L74-M463 HydrophobicContact CG-CG 4.48Å; L74-M463 HydrophobicContact CG-SD 4.35Å; I90-M463 WeakPolarHBondContact O-CE 3.49Å; I91-M463 HydrophobicContact CD1-CE 4.37Å; I91-M463 HydrophobicContact CD1-SD 4.19Å; I91-M463 HydrophobicContact CG1-CE 3.52Å; I91-M463 HydrophobicContact CG1-SD 3.88Å; M98-M463 HydrophobicContact CE-SD 3.95Å; M98-M463 HydrophobicContact CG-CB 4.18Å; M98-M463 HydrophobicContact SD-CB 4.08Å; N253-M463 HydrophobicContact CB-SD 4.45Å; M463-S466 PolarHBondContact O-N 2.69Å; M463-S467 PolarHBondContact O-N 3.49Å; M463-S467 VanDerWaalsContact O-N 3.07Å; M463-S467 PolarHBondContact O-OG 2.79Å
464	E	96.9	Very high	97	Very high	5 Å²	5	6.8 Å²	6.8	2%	0.023	4%	0.041	C	C	.	.	H	α-helix	trans	-68.6	-38.9	-179.4	-167	63	-165.7	0	0	112.6	N95 L96 H97 M98 Y166 A462 S466 S467 V468	N95-E464 VanDerWaalsContact CA-CD 3.45Å; N95-E464 WeakPolarHBondContact CA-OE2 3.49Å; N95-E464 HydrophobicContact CB-CB 3.92Å; N95-E464 HydrophobicContact CB-CG 3.91Å; N95-E464 VanDerWaalsContact CB-OE2 3.3Å; N95-E464 WeakPolarHBondContact CB-OE2 3.26Å; L96-E464 PolarHBondContact N-OE1 3.18Å; H97-E464 VanDerWaalsContact CB-OE1 3.24Å; H97-E464 WeakPolarHBondContact CB-OE1 3.28Å; H97-E464 IonicContact CD2-OE1 2.79Å; H97-E464 PolarHBondContact CD2-OE1 2.89Å; H97-E464 IonicContact CG-OE1 3.15Å; H97-E464 PolarHBondContact N-OE1 3.13Å; M98-E464 WeakPolarHBondContact CG-OE2 3.47Å; M98-E464 PolarHBondContact N-OE2 2.91Å; Y166-E464 VanDerWaalsContact CE1-OE1 3.24Å; Y166-E464 WeakPolarHBondContact CE1-OE1 3.29Å; Y166-E464 WeakPolarHBondContact OH-CG 3.22Å; Y166-E464 PolarHBondContact OH-OE1 3.43Å; A462-E464 PolarHBondContact O-N 2.84Å; E464-S466 VanDerWaalsContact C-N 3.31Å; E464-S466 PolarHBondContact O-N 2.93Å; E464-S467 CarbonylContact O-C 3.3Å; E464-S467 PolarHBondContact O-N 2.92Å; E464-S467 VanDerWaalsContact O-N 3.11Å; E464-V468 HydrophobicContact CG-CG2 4.38Å; E464-V468 WeakPolarHBondContact O-CB 3.43Å; E464-V468 WeakPolarHBondContact O-CG2 3.47Å; E464-V468 PolarHBondContact O-N 2.76Å
465	M	97.4	Very high	97.1	Very high	6 Å²	6	6.6 Å²	6.6	3%	0.03	4%	0.04	C	C	.	.	H	α-helix	trans	-61.2	-42.4	177.7	-65.5	-64.3	-72.9	0	0	111	F162 F233 I456 A459 G460 A462 V468 A469	F162-M465 HydrophobicContact CE1-SD 4.47Å; F162-M465 HydrophobicContact CE2-CE 4.23Å; F162-M465 HydrophobicContact CE2-SD 3.67Å; F162-M465 HydrophobicContact CZ-SD 3.44Å; F162-M465 WeakPolarHBondContact CZ-SD 3.41Å; F233-M465 HydrophobicContact CE1-CE 4.18Å; I456-M465 HydrophobicContact CD1-CE 3.97Å; I456-M465 HydrophobicContact CG1-CB 4.24Å; I456-M465 HydrophobicContact CG1-CE 4Å; A459-M465 HydrophobicContact CB-CE 4.46Å; G460-M465 WeakPolarHBondContact O-CB 3.39Å; G460-M465 VanDerWaalsContact O-CG 3.28Å; G460-M465 WeakPolarHBondContact O-CG 3.33Å; A462-M465 HydrophobicContact CB-CB 4.45Å; A462-M465 HydrophobicContact CB-CG 4.04Å; A462-M465 PolarHBondContact O-N 3.38Å; A462-M465 VanDerWaalsContact O-N 3.1Å; M465-V468 PolarHBondContact O-N 3.3Å; M465-A469 PolarHBondContact O-N 3.34Å
466	S	98.1	Very high	97.2	Very high	8 Å²	8	6.6 Å²	6.6	6%	0.056	4%	0.04	C	C	.	.	H	α-helix	trans	-64.9	-38	173.5	-59.7	0	0	0	0	112.8	A462 M463 E464 A469 A470	A462-S466 PolarHBondContact O-N 2.86Å; A462-S466 VanDerWaalsContact O-N 3.12Å; M463-S466 PolarHBondContact O-N 2.69Å; E464-S466 VanDerWaalsContact C-N 3.31Å; E464-S466 PolarHBondContact O-N 2.93Å; S466-A469 PolarHBondContact O-N 2.98Å; S466-A470 VanDerWaalsContact O-CB 3.32Å; S466-A470 WeakPolarHBondContact O-CB 3.44Å; S466-A470 PolarHBondContact O-N 2.54Å
467	S	98.6	Very high	97.2	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-68.8	-38.5	176.5	-59.8	0	0	0	0	112.6	M463 E464 A470 K471	M463-S467 PolarHBondContact O-N 3.49Å; M463-S467 VanDerWaalsContact O-N 3.07Å; M463-S467 PolarHBondContact O-OG 2.79Å; E464-S467 CarbonylContact O-C 3.3Å; E464-S467 PolarHBondContact O-N 2.92Å; E464-S467 VanDerWaalsContact O-N 3.11Å; S467-A470 WeakPolarHBondContact O-CB 3.32Å; S467-A470 PolarHBondContact O-N 2.87Å; S467-K471 PolarHBondContact O-N 3.46Å
468	V	98.6	Very high	97.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-61.5	-48.1	172.7	165.4	0	0	0	0	110.2	F162 I165 Q169 L181 E464 M465 A470 K471 N472	F162-V468 HydrophobicContact CZ-CG2 4.3Å; I165-V468 HydrophobicContact CD1-CG1 4.32Å; I165-V468 HydrophobicContact CG1-CG1 3.64Å; I165-V468 HydrophobicContact CG2-CG2 4.32Å; Q169-V468 PolarHBondContact NE2-O 2.95Å; L181-V468 HydrophobicContact CD1-CG1 4.23Å; E464-V468 HydrophobicContact CG-CG2 4.38Å; E464-V468 WeakPolarHBondContact O-CB 3.43Å; E464-V468 WeakPolarHBondContact O-CG2 3.47Å; E464-V468 PolarHBondContact O-N 2.76Å; M465-V468 PolarHBondContact O-N 3.3Å; V468-A470 VanDerWaalsContact C-N 3.3Å; V468-A470 PolarHBondContact O-N 3.5Å; V468-K471 PolarHBondContact O-N 2.97Å; V468-N472 WeakPolarHBondContact O-CB 3.39Å; V468-N472 PolarHBondContact O-N 3.09Å
469	A	98.7	Very high	97.3	Very high	8 Å²	8	7.3 Å²	7.3	7%	0.066	4%	0.043	C	C	.	.	H	α-helix	trans	-62.5	-38.2	175.9	0	0	0	0	0	112.1	L453 I456 M465 S466 N472 I473	L453-A469 HydrophobicContact CG-CB 4.25Å; I456-A469 HydrophobicContact CB-CB 3.76Å; I456-A469 HydrophobicContact CG1-CB 4.06Å; I456-A469 HydrophobicContact CG2-CB 3.61Å; M465-A469 PolarHBondContact O-N 3.34Å; S466-A469 PolarHBondContact O-N 2.98Å; A469-N472 WeakPolarHBondContact O-CB 3.21Å; A469-N472 PolarHBondContact O-N 3.31Å; A469-I473 WeakPolarHBondContact O-CG1 3.38Å; A469-I473 PolarHBondContact O-N 3.06Å
470	A	98.8	Very high	97.3	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.7	-47.3	175.8	0	0	0	0	0	112.5	G44 A47 T48 F51 L453 S466 S467 V468 N472 I473 A474	G44-A470 WeakPolarHBondContact O-CB 3.2Å; A47-A470 HydrophobicContact CB-CB 3.68Å; T48-A470 WeakPolarHBondContact OG1-CA 3.43Å; T48-A470 WeakPolarHBondContact OG1-CB 3.44Å; F51-A470 HydrophobicContact CD2-CB 4.19Å; F51-A470 HydrophobicContact CE2-CB 4.45Å; L453-A470 HydrophobicContact CD1-CB 4.08Å; S466-A470 VanDerWaalsContact O-CB 3.32Å; S466-A470 WeakPolarHBondContact O-CB 3.44Å; S466-A470 PolarHBondContact O-N 2.54Å; S467-A470 WeakPolarHBondContact O-CB 3.32Å; S467-A470 PolarHBondContact O-N 2.87Å; V468-A470 VanDerWaalsContact C-N 3.3Å; V468-A470 PolarHBondContact O-N 3.5Å; A470-N472 VanDerWaalsContact C-N 3.33Å; A470-I473 PolarHBondContact O-N 3.17Å; A470-A474 WeakPolarHBondContact O-CB 3.38Å; A470-A474 PolarHBondContact O-N 3.28Å
471	K	98.8	Very high	97.2	Very high	24 Å²	24	14.4 Å²	14.4	10%	0.104	7%	0.07	C	C	.	.	H	α-helix	trans	-64.3	-40.4	175.8	-176.5	61.7	173.5	-174.6	0	111.4	F51 H55 Q169 S467 V468 A474 L475	F51-K471 HydrophobicContact CB-CD 4.1Å; F51-K471 HydrophobicContact CD1-CD 3.54Å; F51-K471 VanDerWaalsContact CD2-CA 3.49Å; F51-K471 HydrophobicContact CD2-CB 3.72Å; F51-K471 HydrophobicContact CD2-CD 3.97Å; F51-K471 HydrophobicContact CD2-CG 4.46Å; F51-K471 HydrophobicContact CE1-CD 3.8Å; F51-K471 HydrophobicContact CE2-CB 3.6Å; F51-K471 HydrophobicContact CE2-CD 4.2Å; F51-K471 HydrophobicContact CE2-CG 4.41Å; F51-K471 HydrophobicContact CG-CB 4.27Å; F51-K471 HydrophobicContact CG-CD 3.62Å; F51-K471 HydrophobicContact CZ-CB 4.06Å; F51-K471 HydrophobicContact CZ-CD 4.11Å; F51-K471 HydrophobicContact CZ-CG 4.47Å; H55-K471 PolarHBondContact NE2-NZ 2.82Å; Q169-K471 HydrophobicContact CB-CG 3.95Å; Q169-K471 HydrophobicContact CG-CG 4.05Å; S467-K471 PolarHBondContact O-N 3.46Å; V468-K471 PolarHBondContact O-N 2.97Å; K471-A474 PolarHBondContact O-N 2.89Å; K471-L475 HydrophobicContact CD-CD1 4.49Å; K471-L475 HydrophobicContact CG-CD1 4.19Å; K471-L475 WeakPolarHBondContact O-CG 3.49Å; K471-L475 PolarHBondContact O-N 3.29Å
472	N	98.7	Very high	97.1	Very high	2 Å²	2	14 Å²	14	1%	0.011	7%	0.067	C	C	.	.	H	α-helix	trans	-60.2	-49.2	176.9	-175.5	70.3	0	0	0	111.8	F175 V468 A469 A470 A474 L475 L476	F175-N472 WeakPolarHBondContact CD2-OD1 3.32Å; F175-N472 PolarHBondContact N-OD1 3.21Å; F175-N472 PolarHBondContact O-ND2 2.99Å; V468-N472 WeakPolarHBondContact O-CB 3.39Å; V468-N472 PolarHBondContact O-N 3.09Å; A469-N472 WeakPolarHBondContact O-CB 3.21Å; A469-N472 PolarHBondContact O-N 3.31Å; A470-N472 VanDerWaalsContact C-N 3.33Å; N472-A474 VanDerWaalsContact C-N 3.34Å; N472-A474 PolarHBondContact O-N 2.91Å; N472-L475 PolarHBondContact O-N 3.27Å; N472-L476 VanDerWaalsContact O-CB 3.27Å; N472-L476 WeakPolarHBondContact O-CB 3.34Å; N472-L476 PolarHBondContact O-N 3.23Å
473	I	98.8	Very high	96.9	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-62.5	-41.2	177.7	-73.2	170.3	0	0	0	111	T48 V306 V444 Y451 L453 A469 A470 L475 L476 A477	T48-I473 HydrophobicContact CG2-CG2 4.47Å; V306-I473 HydrophobicContact CG1-CD1 4.19Å; V306-I473 HydrophobicContact CG1-CG2 4.1Å; V306-I473 HydrophobicContact CG2-CG2 3.77Å; V444-I473 HydrophobicContact CG1-CD1 4.25Å; V444-I473 HydrophobicContact CG1-CG1 3.82Å; Y451-I473 HydrophobicContact CD1-CG2 4.49Å; Y451-I473 HydrophobicContact CD2-CG2 4.14Å; Y451-I473 HydrophobicContact CG-CG2 3.9Å; L453-I473 HydrophobicContact CB-CD1 3.78Å; L453-I473 HydrophobicContact CD1-CD1 4.46Å; L453-I473 HydrophobicContact CG-CD1 4.19Å; A469-I473 WeakPolarHBondContact O-CG1 3.38Å; A469-I473 PolarHBondContact O-N 3.06Å; A470-I473 PolarHBondContact O-N 3.17Å; I473-L475 PolarHBondContact O-N 3.04Å; I473-L476 PolarHBondContact O-N 2.97Å; I473-A477 WeakPolarHBondContact O-CB 3.48Å; I473-A477 PolarHBondContact O-N 2.9Å
474	A	98.6	Very high	96.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.9	-41.9	178.7	0	0	0	0	0	112.3	F51 L52 A470 K471 N472 Y478	F51-A474 HydrophobicContact CB-CB 3.51Å; L52-A474 HydrophobicContact CD2-CB 3.97Å; L52-A474 HydrophobicContact CG-CB 4.05Å; A470-A474 WeakPolarHBondContact O-CB 3.38Å; A470-A474 PolarHBondContact O-N 3.28Å; K471-A474 PolarHBondContact O-N 2.89Å; N472-A474 VanDerWaalsContact C-N 3.34Å; N472-A474 PolarHBondContact O-N 2.91Å; A474-Y478 WeakPolarHBondContact O-CB 3.45Å; A474-Y478 PolarHBondContact O-N 3.38Å
475	L	98.4	Very high	96.3	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-66	-47.7	173.2	-72.8	166.6	0	0	0	111.5	H55 Q169 Y173 A174 K471 N472 I473 A477 Y478 H479	H55-L475 WeakPolarHBondContact CE1-CD2 3.43Å; H55-L475 WeakPolarHBondContact NE2-CD2 3.39Å; Q169-L475 HydrophobicContact CB-CD1 4.08Å; Q169-L475 HydrophobicContact CG-CD1 4.15Å; Y173-L475 WeakPolarHBondContact O-CD1 3.33Å; A174-L475 HydrophobicContact CB-CB 3.76Å; K471-L475 HydrophobicContact CD-CD1 4.49Å; K471-L475 HydrophobicContact CG-CD1 4.19Å; K471-L475 WeakPolarHBondContact O-CG 3.49Å; K471-L475 PolarHBondContact O-N 3.29Å; N472-L475 PolarHBondContact O-N 3.27Å; I473-L475 PolarHBondContact O-N 3.04Å; L475-A477 VanDerWaalsContact C-N 3.31Å; L475-A477 PolarHBondContact O-N 3.5Å; L475-Y478 WeakPolarHBondContact O-CB 2.83Å; L475-Y478 PolarHBondContact O-N 2.98Å; L475-Y478 VanDerWaalsContact O-N 3.14Å; L475-H479 PolarHBondContact O-CD2 3.23Å; L475-H479 PolarHBondContact O-N 3.39Å
476	L	97.7	Very high	96.1	Very high	0 Å²	0	33 Å²	33	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-42.8	-179.9	-175.4	62.5	0	0	0	112.1	A174 V444 V445 Y451 N472 I473 R480 V488	A174-L476 HydrophobicContact CB-CB 4.05Å; A174-L476 HydrophobicContact CB-CD1 4.44Å; V444-L476 HydrophobicContact CG1-CD2 4.37Å; V445-L476 HydrophobicContact CG2-CD2 3.76Å; Y451-L476 HydrophobicContact CD1-CD2 3.98Å; Y451-L476 HydrophobicContact CE1-CD2 3.6Å; Y451-L476 HydrophobicContact CE1-CG 3.85Å; N472-L476 VanDerWaalsContact O-CB 3.27Å; N472-L476 WeakPolarHBondContact O-CB 3.34Å; N472-L476 PolarHBondContact O-N 3.23Å; I473-L476 PolarHBondContact O-N 2.97Å; L476-R480 HydrophobicContact CD1-CG 4.49Å; L476-R480 WeakPolarHBondContact O-CB 3.27Å; L476-R480 WeakPolarHBondContact O-CG 3.26Å; L476-R480 PolarHBondContact O-N 3.41Å; L476-V488 HydrophobicContact CD1-CB 4.35Å; L476-V488 HydrophobicContact CD1-CG1 3.51Å; L476-V488 HydrophobicContact CD1-CG2 3.82Å
477	A	97.3	Very high	95.9	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-46.1	174.6	0	0	0	0	0	111.3	L52 F56 I304 Y451 I473 L475 W481	L52-A477 HydrophobicContact CD2-CB 4.19Å; F56-A477 HydrophobicContact CE2-CB 4.42Å; I304-A477 HydrophobicContact CD1-CB 4.31Å; Y451-A477 HydrophobicContact CE2-CB 3.86Å; Y451-A477 WeakPolarHBondContact OH-CA 3.16Å; I473-A477 WeakPolarHBondContact O-CB 3.48Å; I473-A477 PolarHBondContact O-N 2.9Å; L475-A477 VanDerWaalsContact C-N 3.31Å; L475-A477 PolarHBondContact O-N 3.5Å; A477-W481 VanDerWaalsContact O-CB 3.25Å; A477-W481 WeakPolarHBondContact O-CB 3.29Å; A477-W481 PolarHBondContact O-N 3.12Å
478	Y	96.8	Very high	95.8	Very high	21 Å²	21	35.3 Å²	35.3	8%	0.082	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-52.1	177.2	-179	-98.5	0	0	0	112.2	A26 L28 H55 F56 A474 L475 R480 W481 S482	A26-Y478 PolarHBondContact O-OH 2.88Å; L28-Y478 HydrophobicContact CD2-CE2 4.23Å; L28-Y478 HydrophobicContact CG-CE2 4.44Å; H55-Y478 HydrophobicContact CB-CD2 3.88Å; H55-Y478 HydrophobicContact CB-CG 4.15Å; H55-Y478 WeakPolarHBondContact O-CE2 3.44Å; F56-Y478 HydrophobicContact CD1-CD2 4.08Å; F56-Y478 AromaticContact CE1-CD2 3.92Å; F56-Y478 HydrophobicContact CE1-CD2 3.92Å; F56-Y478 HydrophobicContact CZ-CD2 4.26Å; A474-Y478 WeakPolarHBondContact O-CB 3.45Å; A474-Y478 PolarHBondContact O-N 3.38Å; L475-Y478 WeakPolarHBondContact O-CB 2.83Å; L475-Y478 PolarHBondContact O-N 2.98Å; L475-Y478 VanDerWaalsContact O-N 3.14Å; Y478-R480 PolarHBondContact O-N 3.31Å; Y478-W481 PolarHBondContact O-N 2.96Å; Y478-S482 WeakPolarHBondContact O-CB 3.22Å; Y478-S482 PolarHBondContact O-N 3.22Å; Y478-S482 PolarHBondContact O-OG 3.39Å
479	H	96.1	Very high	95.6	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-38.3	-177.8	-68.1	-49.5	0	0	0	113.4	G172 L475 R483 Q484 V488	G172-H479 PolarHBondContact O-CD2 3.22Å; G172-H479 PolarHBondContact O-NE2 3.29Å; L475-H479 PolarHBondContact O-CD2 3.23Å; L475-H479 PolarHBondContact O-N 3.39Å; H479-R483 CarbonylContact O-C 3.56Å; H479-R483 WeakPolarHBondContact O-CA 3.41Å; H479-R483 PolarHBondContact O-N 2.69Å; H479-Q484 HydrophobicContact CB-CB 4.25Å; H479-Q484 WeakPolarHBondContact CB-O 3.31Å; H479-Q484 PolarHBondContact ND1-OE1 2.79Å; H479-Q484 VanDerWaalsContact ND1-OE1 3.09Å; H479-Q484 PolarHBondContact O-N 3.31Å; H479-V488 HydrophobicContact CB-CG2 3.93Å
480	R	94.3	Very high	95.2	Very high	80 Å²	80	39.3 Å²	39.3	30%	0.302	18%	0.175	S	C	.	.	H	α-helix	trans	-67.5	-39.9	174.8	-74	-177	175.2	-168.7	-1.9	111.5	V445 L476 Y478 R483 L485	V445-R480 VanDerWaalsContact CG1-NH1 3.3Å; L476-R480 HydrophobicContact CD1-CG 4.49Å; L476-R480 WeakPolarHBondContact O-CB 3.27Å; L476-R480 WeakPolarHBondContact O-CG 3.26Å; L476-R480 PolarHBondContact O-N 3.41Å; Y478-R480 PolarHBondContact O-N 3.31Å; R480-R483 PolarHBondContact O-N 3.4Å; R480-L485 HydrophobicContact CG-CD2 4.16Å
481	W	92.8	Very high	94.7	Very high	68 Å²	68	46.5 Å²	46.5	26%	0.258	21%	0.206	S	C	.	.	H	α-helix	trans	-65.4	-42.8	177.1	-165.2	-87.1	0	0	0	112.4	T31 P33 F56 D303 I304 A477 Y478 R483	T31-W481 PolarHBondContact O-NE1 3.26Å; P33-W481 VanDerWaalsContact CA-CZ2 3.43Å; P33-W481 HydrophobicContact CB-CD2 4.15Å; P33-W481 HydrophobicContact CB-CE3 4.27Å; P33-W481 HydrophobicContact CB-CH2 3.86Å; P33-W481 HydrophobicContact CB-CZ2 3.72Å; P33-W481 HydrophobicContact CB-CZ3 4.13Å; P33-W481 HydrophobicContact CG-CD2 4.34Å; F56-W481 HydrophobicContact CE1-CB 4.03Å; F56-W481 HydrophobicContact CE1-CG 4.01Å; F56-W481 HydrophobicContact CZ-CB 4.15Å; F56-W481 HydrophobicContact CZ-CG 4.45Å; D303-W481 HydrophobicContact CB-CH2 3.74Å; D303-W481 HydrophobicContact CB-CZ3 3.9Å; I304-W481 HydrophobicContact CD1-CE3 4.02Å; I304-W481 HydrophobicContact CG1-CE3 4.2Å; I304-W481 HydrophobicContact CG1-CZ3 4.25Å; A477-W481 VanDerWaalsContact O-CB 3.25Å; A477-W481 WeakPolarHBondContact O-CB 3.29Å; A477-W481 PolarHBondContact O-N 3.12Å; Y478-W481 PolarHBondContact O-N 2.96Å; W481-R483 VanDerWaalsContact C-N 3.3Å; W481-R483 PolarHBondContact O-N 3Å
482	S	91.6	Very high	93.8	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.028	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	3.7	178.8	65	0	0	0	0	114.3	Y478 Q484	Y478-S482 WeakPolarHBondContact O-CB 3.22Å; Y478-S482 PolarHBondContact O-N 3.22Å; Y478-S482 PolarHBondContact O-OG 3.39Å; S482-Q484 VanDerWaalsContact C-N 3.26Å; S482-Q484 PolarHBondContact O-N 3.2Å; S482-Q484 WeakPolarHBondContact OG-CG 3.32Å; S482-Q484 PolarHBondContact OG-OE1 2.68Å
483	R	91	Very high	93.1	Very high	204 Å²	204	51.7 Å²	51.7	77%	0.77	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	28	-178.5	-55.8	179.4	175.9	-179.4	-2.3	114.9	H479 R480 W481 L485	H479-R483 CarbonylContact O-C 3.56Å; H479-R483 WeakPolarHBondContact O-CA 3.41Å; H479-R483 PolarHBondContact O-N 2.69Å; R480-R483 PolarHBondContact O-N 3.4Å; W481-R483 VanDerWaalsContact C-N 3.3Å; W481-R483 PolarHBondContact O-N 3Å; R483-L485 PolarHBondContact O-N 3.05Å
484	Q	91.1	Very high	92	Very high	37 Å²	37	54.7 Å²	54.7	17%	0.173	25%	0.249	C	C	.	.			trans	-90.7	59.7	176.6	-67.8	174.5	-9.2	0	0	111.9	H479 S482 E486 M487	H479-Q484 HydrophobicContact CB-CB 4.25Å; H479-Q484 WeakPolarHBondContact CB-O 3.31Å; H479-Q484 PolarHBondContact ND1-OE1 2.79Å; H479-Q484 VanDerWaalsContact ND1-OE1 3.09Å; H479-Q484 PolarHBondContact O-N 3.31Å; S482-Q484 VanDerWaalsContact C-N 3.26Å; S482-Q484 PolarHBondContact O-N 3.2Å; S482-Q484 WeakPolarHBondContact OG-CG 3.32Å; S482-Q484 PolarHBondContact OG-OE1 2.68Å; Q484-E486 WeakPolarHBondContact CA-OE1 3.26Å; Q484-E486 WeakPolarHBondContact CA-OE2 3.37Å; Q484-E486 WeakPolarHBondContact CB-OE1 3.36Å; Q484-E486 PolarHBondContact O-N 2.67Å; Q484-M487 HydrophobicContact CB-CG 4.41Å; Q484-M487 PolarHBondContact O-N 3.34Å
485	L	91.3	Very high	90.8	Very high	109 Å²	109	60.9 Å²	60.9	57%	0.571	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-67.7	-19	-173	-61.4	-179.8	0	0	0	113.4	R480 R483 M487 V488	R480-L485 HydrophobicContact CG-CD2 4.16Å; R483-L485 PolarHBondContact O-N 3.05Å; L485-M487 PolarHBondContact O-N 3.36Å; L485-V488 PolarHBondContact O-N 3.11Å; L485-V488 VanDerWaalsContact O-N 3.1Å
486	E	92.3	Very high	89.7	Confident	114 Å²	114	64.3 Å²	64.3	53%	0.533	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-63.6	-17.7	174.6	68.7	-74.4	172.9	0	0	114.1	Q484 Q490	Q484-E486 WeakPolarHBondContact CA-OE1 3.26Å; Q484-E486 WeakPolarHBondContact CA-OE2 3.37Å; Q484-E486 WeakPolarHBondContact CB-OE1 3.36Å; Q484-E486 PolarHBondContact O-N 2.67Å; E486-Q490 PolarHBondContact O-OE1 3.29Å
487	M	93.8	Very high	88.6	Confident	37 Å²	37	64.4 Å²	64.4	18%	0.182	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-87.7	-6.6	176.5	-60	-56.9	-66.6	0	0	112.8	H171 Y173 A174 Q484 L485	H171-M487 WeakPolarHBondContact O-CE 3.33Å; Y173-M487 WeakPolarHBondContact CA-O 3.45Å; Y173-M487 HydrophobicContact CD1-CE 3.88Å; Y173-M487 HydrophobicContact CE1-CE 3.86Å; Y173-M487 HydrophobicContact CE1-SD 4.23Å; Y173-M487 HydrophobicContact CG-CE 4.48Å; A174-M487 PolarHBondContact N-O 2.69Å; Q484-M487 HydrophobicContact CB-CG 4.41Å; Q484-M487 PolarHBondContact O-N 3.34Å; L485-M487 PolarHBondContact O-N 3.36Å
488	V	96	Very high	87.3	Confident	20 Å²	20	71.4 Å²	71.4	12%	0.121	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-105.7	132.6	-175.1	-176.7	0	0	0	0	110.6	A174 L476 H479 L485 Q490	A174-V488 WeakPolarHBondContact O-CA 3.47Å; L476-V488 HydrophobicContact CD1-CB 4.35Å; L476-V488 HydrophobicContact CD1-CG1 3.51Å; L476-V488 HydrophobicContact CD1-CG2 3.82Å; H479-V488 HydrophobicContact CB-CG2 3.93Å; L485-V488 PolarHBondContact O-N 3.11Å; L485-V488 VanDerWaalsContact O-N 3.1Å; V488-Q490 PolarHBondContact O-N 3.42Å; V488-Q490 VanDerWaalsContact O-N 3.15Å
489	D	95.1	Very high	85.7	Confident	48 Å²	48	74.7 Å²	74.7	26%	0.257	35%	0.346	S	S	.	.	S	Bend	trans	53.5	34.4	177.6	-57.5	-32.8	0	0	0	113.6	A174 F175 S176 E180 K491	A174-D489 PolarHBondContact O-N 2.94Å; F175-D489 VanDerWaalsContact CA-OD1 3.26Å; F175-D489 WeakPolarHBondContact CA-OD1 3.32Å; S176-D489 WeakPolarHBondContact CB-OD2 3.27Å; S176-D489 PolarHBondContact N-OD1 2.86Å; S176-D489 VanDerWaalsContact OG-CG 3.3Å; S176-D489 PolarHBondContact OG-OD1 2.65Å; S176-D489 PolarHBondContact OG-OD2 2.67Å; E180-D489 HydrophobicContact CG-CB 4.03Å; E180-D489 WeakPolarHBondContact CG-OD1 3.44Å; D489-K491 PolarHBondContact O-N 3.08Å
490	Q	91.1	Very high	83.7	Confident	45 Å²	45	79.9 Å²	79.9	21%	0.21	37%	0.37	C	S	.	.			trans	-67.5	127.8	-177.8	-177.7	55.6	47.7	0	0	110.4	Y173 E486 V488 L493 K496	Y173-Q490 HydrophobicContact CD1-CB 4.03Å; Y173-Q490 HydrophobicContact CD1-CG 4.39Å; Y173-Q490 HydrophobicContact CE1-CB 4.18Å; Y173-Q490 HydrophobicContact CE1-CG 4.03Å; E486-Q490 PolarHBondContact O-OE1 3.29Å; V488-Q490 PolarHBondContact O-N 3.42Å; V488-Q490 VanDerWaalsContact O-N 3.15Å; Q490-L493 HydrophobicContact CB-CD2 3.87Å; Q490-L493 HydrophobicContact CB-CG 4.41Å; Q490-L493 HydrophobicContact CG-CD2 3.72Å; Q490-L493 HydrophobicContact CG-CG 4.48Å; Q490-L493 WeakPolarHBondContact O-CG 3.29Å; Q490-K496 HydrophobicContact CG-CD 4.34Å
491	K	86.8	Confident	81.2	Confident	150 Å²	150	83.6 Å²	83.6	65%	0.652	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	155.5	177.2	-60.2	-173.8	-178.9	-178.2	0	112.1	D489 L493	D489-K491 PolarHBondContact O-N 3.08Å; K491-L493 VanDerWaalsContact C-N 3.29Å; K491-L493 PolarHBondContact O-N 3.42Å
492	D	80.8	Confident	80.7	Confident	130 Å²	130	84.4 Å²	84.4	70%	0.695	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	35.5	173.6	-58.6	-46.8	0	0	0	115.2	M494 H495 K496	D492-M494 PolarHBondContact O-N 2.86Å; D492-H495 PolarHBondContact O-N 3.24Å; D492-K496 PolarHBondContact O-N 3.3Å; D492-K496 VanDerWaalsContact O-N 3.12Å
493	L	84.1	Confident	80.1	Confident	5 Å²	5	88.6 Å²	88.6	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-52.5	-39.4	-179.8	-72.2	174.6	0	0	0	113.5	Y168 Y173 F175 Q490 K491 H495 K496 I497	Y168-L493 HydrophobicContact CD1-CB 4.22Å; Y168-L493 HydrophobicContact CD1-CD1 4.29Å; Y168-L493 HydrophobicContact CD2-CD1 3.88Å; Y168-L493 HydrophobicContact CE1-CB 3.78Å; Y168-L493 HydrophobicContact CE1-CD1 4.47Å; Y168-L493 HydrophobicContact CE2-CB 4.37Å; Y168-L493 HydrophobicContact CE2-CD1 4.05Å; Y168-L493 HydrophobicContact CG-CD1 4Å; Y173-L493 HydrophobicContact CD1-CD2 3.54Å; Y173-L493 HydrophobicContact CD2-CD1 4.43Å; Y173-L493 HydrophobicContact CD2-CD2 3.53Å; Y173-L493 HydrophobicContact CE1-CD2 3.51Å; Y173-L493 HydrophobicContact CE2-CD2 3.48Å; Y173-L493 VanDerWaalsContact CE2-CD2 3.48Å; Y173-L493 HydrophobicContact CG-CD1 4.23Å; Y173-L493 HydrophobicContact CG-CD2 3.54Å; Y173-L493 VanDerWaalsContact CZ-CD2 3.46Å; F175-L493 HydrophobicContact CE1-CD1 3.98Å; F175-L493 HydrophobicContact CZ-CD1 3.82Å; Q490-L493 HydrophobicContact CB-CD2 3.87Å; Q490-L493 HydrophobicContact CB-CG 4.41Å; Q490-L493 HydrophobicContact CG-CD2 3.72Å; Q490-L493 HydrophobicContact CG-CG 4.48Å; Q490-L493 WeakPolarHBondContact O-CG 3.29Å; K491-L493 VanDerWaalsContact C-N 3.29Å; K491-L493 PolarHBondContact O-N 3.42Å; L493-H495 VanDerWaalsContact C-N 3.26Å; L493-H495 PolarHBondContact O-N 2.89Å; L493-K496 PolarHBondContact O-N 3.44Å; L493-I497 HydrophobicContact CB-CD1 4.4Å; L493-I497 VanDerWaalsContact O-CG1 3.22Å; L493-I497 WeakPolarHBondContact O-CG1 3.41Å; L493-I497 PolarHBondContact O-N 3.47Å
494	M	74.5	Confident	79.5	Confident	64 Å²	64	82.2 Å²	82.2	32%	0.315	40%	0.403	S	S	.	.	H	α-helix	trans	-60.2	-36.1	178	-78.5	-54.3	-67.6	0	0	113.3	R164 Y168 D492 K498	R164-M494 VanDerWaalsContact CD-SD 3.56Å; R164-M494 HydrophobicContact CG-SD 3.92Å; Y168-M494 HydrophobicContact CE1-SD 4.13Å; Y168-M494 WeakPolarHBondContact OH-CG 3.48Å; Y168-M494 PolarHBondContact OH-SD 3.29Å; D492-M494 PolarHBondContact O-N 2.86Å; M494-K498 VanDerWaalsContact O-CG 3.31Å; M494-K498 WeakPolarHBondContact O-CG 3.32Å
495	H	74.7	Confident	78.8	Confident	131 Å²	131	84.9 Å²	84.9	61%	0.606	42%	0.416	S	S	*	.	H	α-helix	trans	-75.6	-48.7	177.6	-173.1	-73.7	0	0	0	110	D492 L493 I497 K498 T499	D492-H495 PolarHBondContact O-N 3.24Å; L493-H495 VanDerWaalsContact C-N 3.26Å; L493-H495 PolarHBondContact O-N 2.89Å; H495-I497 PolarHBondContact O-N 3.46Å; H495-K498 PolarHBondContact O-N 2.81Å; H495-K498 VanDerWaalsContact O-N 3.07Å; H495-T499 PolarHBondContact O-N 2.88Å; H495-T499 VanDerWaalsContact O-N 3.09Å; H495-T499 PolarHBondContact O-OG1 2.95Å; H495-T499 VanDerWaalsContact O-OG1 3.09Å
496	K	75.4	Confident	78	Confident	74 Å²	74	83.4 Å²	83.4	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-55.2	-49.8	-179.4	-77.9	-169.2	166.4	-167.8	0	112.9	Q490 D492 L493 K498 T499 E500	Q490-K496 HydrophobicContact CG-CD 4.34Å; D492-K496 PolarHBondContact O-N 3.3Å; D492-K496 VanDerWaalsContact O-N 3.12Å; L493-K496 PolarHBondContact O-N 3.44Å; K496-K498 PolarHBondContact O-N 3.31Å; K496-T499 WeakPolarHBondContact CA-OG1 3.48Å; K496-T499 PolarHBondContact O-N 2.92Å; K496-T499 PolarHBondContact O-OG1 2.96Å; K496-E500 WeakPolarHBondContact O-CB 3.3Å; K496-E500 WeakPolarHBondContact O-CG 3.5Å; K496-E500 PolarHBondContact O-N 2.82Å
497	I	74.4	Confident	77.1	Confident	2 Å²	2	81.3 Å²	81.3	1%	0.01	40%	0.398	C	S	.	.	H	α-helix	trans	-73.3	-17	-176.9	-49.2	165.5	0	0	0	111.6	K167 Y168 Y173 L493 H495 L501	K167-I497 HydrophobicContact CD-CD1 4.41Å; K167-I497 HydrophobicContact CD-CG2 3.81Å; K167-I497 HydrophobicContact CG-CD1 4.48Å; K167-I497 HydrophobicContact CG-CG2 4.26Å; Y168-I497 HydrophobicContact CD1-CD1 3.4Å; Y168-I497 HydrophobicContact CE1-CD1 3.61Å; Y173-I497 HydrophobicContact CD2-CD1 4.3Å; Y173-I497 HydrophobicContact CE2-CD1 3.9Å; Y173-I497 HydrophobicContact CE2-CG1 3.99Å; L493-I497 HydrophobicContact CB-CD1 4.4Å; L493-I497 VanDerWaalsContact O-CG1 3.22Å; L493-I497 WeakPolarHBondContact O-CG1 3.41Å; L493-I497 PolarHBondContact O-N 3.47Å; H495-I497 PolarHBondContact O-N 3.46Å; I497-L501 HydrophobicContact CG2-CD1 4.07Å; I497-L501 VanDerWaalsContact O-CD1 3.3Å; I497-L501 WeakPolarHBondContact O-CD1 3.38Å; I497-L501 WeakPolarHBondContact O-CG 3.09Å
498	K	70.2	Confident	75.9	Confident	148 Å²	148	84.5 Å²	84.5	64%	0.643	41%	0.414	S	S	*	.	H	α-helix	trans	-81.4	-22.3	169.9	-79.5	-177.4	-180	-175.1	0	113	M494 H495 K496	M494-K498 VanDerWaalsContact O-CG 3.31Å; M494-K498 WeakPolarHBondContact O-CG 3.32Å; H495-K498 PolarHBondContact O-N 2.81Å; H495-K498 VanDerWaalsContact O-N 3.07Å; K496-K498 PolarHBondContact O-N 3.31Å
499	T	62.1	Low	74.3	Confident	90 Å²	90	89.5 Å²	89.5	55%	0.552	44%	0.436	S	S	*	.	H	α-helix	trans	-94.8	-22	178.1	46.1	0	0	0	0	113.3	H495 K496	H495-T499 PolarHBondContact O-N 2.88Å; H495-T499 VanDerWaalsContact O-N 3.09Å; H495-T499 PolarHBondContact O-OG1 2.95Å; H495-T499 VanDerWaalsContact O-OG1 3.09Å; K496-T499 WeakPolarHBondContact CA-OG1 3.48Å; K496-T499 PolarHBondContact O-N 2.92Å; K496-T499 PolarHBondContact O-OG1 2.96Å
500	E	55	Low	72.6	Confident	117 Å²	117	92.9 Å²	92.9	55%	0.547	45%	0.451	S	S	.	.			trans	-87	-10.1	175.7	-70.4	170.7	-172	0	0	113	K496	K496-E500 WeakPolarHBondContact O-CB 3.3Å; K496-E500 WeakPolarHBondContact O-CG 3.5Å; K496-E500 PolarHBondContact O-N 2.82Å
501	L	41.9	Very low	70.9	Confident	159 Å²	159	97.3 Å²	97.3	83%	0.832	47%	0.473	S	S	*	.			trans	-108.7	0	169.7	-68.7	169.8	0	0	0	109.4	K167 I497	K167-L501 VanDerWaalsContact NZ-CD1 3.33Å; I497-L501 HydrophobicContact CG2-CD1 4.07Å; I497-L501 VanDerWaalsContact O-CD1 3.3Å; I497-L501 WeakPolarHBondContact O-CD1 3.38Å; I497-L501 WeakPolarHBondContact O-CG 3.09Å

Retrieved 501 of 501 residues in 584.9 ms (Link to these results)

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