A0A096M6R2_POEFO Loading...

alkaline phosphatase

AlphaFold DB , UniProt , Accession A0A096M6R2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 521 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	37.2	Very low	249 Å²	249	153 Å²	153	100%	1.227	85%	0.848	S	S	*	*				0	137.5	0	-75.5	177.4	-152.1	0	0	108.3
2	A	40.4	Very low	37.4	Very low	99 Å²	99	153.3 Å²	153.3	82%	0.818	85%	0.845	S	S	*	*			trans	-53.9	145.8	-164.7	0	0	0	0	0	115.5
3	K	33.6	Very low	37.6	Very low	209 Å²	209	152.8 Å²	152.8	91%	0.909	84%	0.84	S	S	*	*			trans	-132.4	120.7	147.6	-92.9	-173.4	177.2	179.6	0	109.6
4	T	37.7	Very low	37.7	Very low	129 Å²	129	150.8 Å²	150.8	79%	0.791	83%	0.825	S	S	*	*			trans	-56.8	124.9	-176	-26.1	0	0	0	0	111.5
5	Q	35.8	Very low	37.6	Very low	180 Å²	180	152.5 Å²	152.5	84%	0.841	82%	0.822	S	S	*	*			trans	-86	110.8	166.7	-83	179.7	-29.6	0	0	108.9
6	N	33.9	Very low	37.7	Very low	144 Å²	144	150 Å²	150	77%	0.77	81%	0.813	S	S	*	*			trans	-92	108.2	162.2	-80.3	-15.2	0	0	0	107.9	I8	N6-I8 PolarHBondContact O-N 2.73Å
7	L	36.2	Very low	37.6	Very low	154 Å²	154	146.2 Å²	146.2	81%	0.806	80%	0.8	S	S	*	*			trans	-77.1	110.9	167.4	-90.7	144	0	0	0	108.5
8	I	38.4	Very low	37.7	Very low	155 Å²	155	144.4 Å²	144.4	80%	0.795	80%	0.795	S	S	*	*			trans	-83.7	113.5	170.9	-64.2	175.2	0	0	0	107.5	N6 A10	N6-I8 PolarHBondContact O-N 2.73Å; I8-A10 PolarHBondContact O-N 3.34Å
9	F	39.7	Very low	37.8	Very low	201 Å²	201	145.3 Å²	145.3	88%	0.882	79%	0.793	S	S	*	*			trans	-70.3	104.8	164.5	-99.6	-91.4	0	0	0	108.6	G11	F9-G11 PolarHBondContact O-N 3.02Å
10	A	38.8	Very low	38.1	Very low	94 Å²	94	148.7 Å²	148.7	78%	0.777	79%	0.793	S	S	*	*			trans	-80.8	99	165.6	0	0	0	0	0	108.5	I8 L12	I8-A10 PolarHBondContact O-N 3.34Å; A10-L12 PolarHBondContact O-N 2.77Å
11	G	38.9	Very low	38.5	Very low	69 Å²	69	147.4 Å²	147.4	71%	0.711	79%	0.791	S	S	*	*			trans	-72.1	114.6	169.8	0	0	0	0	0	110.1	F9 L13	F9-G11 PolarHBondContact O-N 3.02Å; G11-L13 PolarHBondContact O-N 3.27Å
12	L	39.2	Very low	39.4	Very low	156 Å²	156	141.3 Å²	141.3	82%	0.817	76%	0.763	S	S	*	*			trans	-73.8	91.3	169.4	-150.3	88.7	0	0	0	107.9	A10 I14	A10-L12 PolarHBondContact O-N 2.77Å; L12-I14 VanDerWaalsContact C-N 3.31Å; L12-I14 HydrophobicContact CD2-CD1 4.24Å; L12-I14 HydrophobicContact CD2-CG1 3.97Å; L12-I14 PolarHBondContact O-N 3.35Å
13	L	40.3	Very low	40.5	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	74%	0.742	S	S	*	*			trans	-71.5	90	168.1	-106.4	145.3	0	0	0	107.9	G11 F15	G11-L13 PolarHBondContact O-N 3.27Å; L13-F15 VanDerWaalsContact C-N 3.28Å; L13-F15 HydrophobicContact CD2-CD2 4.45Å; L13-F15 HydrophobicContact CD2-CE2 4.27Å; L13-F15 PolarHBondContact O-N 3.18Å
14	I	38.6	Very low	42.4	Very low	124 Å²	124	131.7 Å²	131.7	64%	0.636	71%	0.713	S	S	*	*			trans	-69.8	94.2	164.3	-57.3	177.3	0	0	0	105.9	L12 V16	L12-I14 VanDerWaalsContact C-N 3.31Å; L12-I14 HydrophobicContact CD2-CD1 4.24Å; L12-I14 HydrophobicContact CD2-CG1 3.97Å; L12-I14 PolarHBondContact O-N 3.35Å; I14-V16 HydrophobicContact CG2-CG2 3.73Å; I14-V16 PolarHBondContact O-N 3.18Å
15	F	36.3	Very low	44.4	Very low	176 Å²	176	129 Å²	129	77%	0.772	69%	0.693	S	S	*	*			trans	-63.9	90.1	159.5	-96.4	-90.3	0	0	0	107	L13 S17	L13-F15 VanDerWaalsContact C-N 3.28Å; L13-F15 HydrophobicContact CD2-CD2 4.45Å; L13-F15 HydrophobicContact CD2-CE2 4.27Å; L13-F15 PolarHBondContact O-N 3.18Å; F15-S17 PolarHBondContact O-N 3.19Å
16	V	38.7	Very low	46.9	Very low	113 Å²	113	127.5 Å²	127.5	69%	0.685	69%	0.686	S	S	*	*			trans	-70.6	84.1	156.3	-176.5	0	0	0	0	105	I14 T18	I14-V16 HydrophobicContact CG2-CG2 3.73Å; I14-V16 PolarHBondContact O-N 3.18Å; V16-T18 VanDerWaalsContact C-N 3.26Å; V16-T18 HydrophobicContact CG1-CG2 4.35Å; V16-T18 PolarHBondContact O-N 3.34Å
17	S	37	Very low	49.6	Very low	85 Å²	85	126.4 Å²	126.4	59%	0.594	68%	0.677	S	S	*	*			trans	-60.2	103.1	158.4	57.4	0	0	0	0	105.2	F15 Q19	F15-S17 PolarHBondContact O-N 3.19Å; S17-Q19 PolarHBondContact O-N 3.18Å
18	T	39.1	Very low	52.3	Low	115 Å²	115	120 Å²	120	71%	0.706	64%	0.642	S	S	*	*			trans	-65.2	82.7	157.3	45.2	0	0	0	0	105.1	V16 R20	V16-T18 VanDerWaalsContact C-N 3.26Å; V16-T18 HydrophobicContact CG1-CG2 4.35Å; V16-T18 PolarHBondContact O-N 3.34Å; T18-R20 PolarHBondContact O-N 3.29Å
19	Q	38.8	Very low	54.9	Low	161 Å²	161	118.4 Å²	118.4	75%	0.752	64%	0.635	S	S	*	*			trans	-57.4	95.5	155.7	-94.9	177.2	-29	0	0	103.6	S17 T21	S17-Q19 PolarHBondContact O-N 3.18Å; Q19-T21 PolarHBondContact O-N 3.48Å
20	R	43.6	Very low	57.6	Low	212 Å²	212	113.2 Å²	113.2	80%	0.8	61%	0.613	S	S	*	*			trans	-57.4	92.6	158.5	-73.4	-177.4	174.7	-167	-3	103.5	T18 L22	T18-R20 PolarHBondContact O-N 3.29Å; R20-L22 PolarHBondContact O-N 2.9Å
21	T	47.1	Very low	60.4	Low	123 Å²	123	113 Å²	113	76%	0.755	60%	0.604	S	S	*	*			trans	-59.8	97.3	177.2	28.2	0	0	0	0	105.7	Q19 C23	Q19-T21 PolarHBondContact O-N 3.48Å; T21-C23 PolarHBondContact O-N 3.14Å
22	L	55.3	Low	63.3	Low	120 Å²	120	116.2 Å²	116.2	63%	0.628	60%	0.6	S	S	*	*			trans	-49.6	123.1	154.8	-89.3	146.4	0	0	0	105	R20 V24	R20-L22 PolarHBondContact O-N 2.9Å; L22-V24 HydrophobicContact CB-CB 4.31Å; L22-V24 HydrophobicContact CB-CG2 3.89Å; L22-V24 HydrophobicContact CD2-CG2 4.01Å; L22-V24 PolarHBondContact O-N 3.14Å
23	C	64.3	Low	66	Low	56 Å²	56	111.4 Å²	111.4	38%	0.378	57%	0.572	S	S	.	*			trans	-75.1	51.4	173.5	-157.6	0	0	0	0	108.7	T21 S85 R389	T21-C23 PolarHBondContact O-N 3.14Å; C23-S85 VanDerWaalsContact SG-CB 3.58Å; C23-R389 PolarHBondContact O-NH1 3.34Å
24	V	72.7	Confident	68.7	Low	51 Å²	51	110.2 Å²	110.2	31%	0.309	56%	0.557	S	S	.	*			trans	-103.7	117.9	177	175.3	0	0	0	0	104.8	L22 E28 L29	L22-V24 HydrophobicContact CB-CB 4.31Å; L22-V24 HydrophobicContact CB-CG2 3.89Å; L22-V24 HydrophobicContact CD2-CG2 4.01Å; L22-V24 PolarHBondContact O-N 3.14Å; V24-E28 HydrophobicContact CG1-CB 4.4Å; V24-L29 HydrophobicContact CG1-CD2 3.74Å; V24-L29 HydrophobicContact CG1-CG 4.15Å
25	I	80.7	Confident	71.5	Confident	72 Å²	72	109.4 Å²	109.4	37%	0.369	55%	0.554	S	S	.	*			trans	-66.7	132.9	174.5	-58.3	172.8	0	0	0	106.5	E27 E28	I25-E27 HydrophobicContact CG2-CB 4.2Å; I25-E27 HydrophobicContact CG2-CG 4.31Å; I25-E27 PolarHBondContact O-N 3.39Å; I25-E27 VanDerWaalsContact O-N 3.12Å; I25-E28 HydrophobicContact CB-CG 4.21Å; I25-E28 WeakPolarHBondContact O-CB 3.5Å; I25-E28 PolarHBondContact O-N 2.97Å
26	E	87.3	Confident	74.5	Confident	148 Å²	148	106 Å²	106	69%	0.692	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-52.9	-38.3	-175.4	-176.3	173.6	-174.9	0	0	112.2	E28 L29 H30	E26-E28 VanDerWaalsContact C-N 3.26Å; E26-E28 PolarHBondContact O-N 3.48Å; E26-L29 VanDerWaalsContact O-CB 3.25Å; E26-L29 WeakPolarHBondContact O-CB 3.44Å; E26-L29 WeakPolarHBondContact O-CG 3.29Å; E26-L29 PolarHBondContact O-N 3.49Å; E26-H30 PolarHBondContact O-CD2 2.8Å
27	E	89.9	Confident	77.2	Confident	122 Å²	122	104.8 Å²	104.8	57%	0.57	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-57	-35.9	176.4	-58.3	177.3	176.7	0	0	113.2	I25 L29 H30 Y33	I25-E27 HydrophobicContact CG2-CB 4.2Å; I25-E27 HydrophobicContact CG2-CG 4.31Å; I25-E27 PolarHBondContact O-N 3.39Å; I25-E27 VanDerWaalsContact O-N 3.12Å; E27-L29 PolarHBondContact O-N 3.28Å; E27-H30 PolarHBondContact O-N 3.06Å; E27-Y33 HydrophobicContact CB-CD2 3.7Å; E27-Y33 HydrophobicContact CB-CE2 4.29Å; E27-Y33 HydrophobicContact CB-CG 4.28Å; E27-Y33 WeakPolarHBondContact O-CB 3.43Å
28	E	93.6	Very high	80.1	Confident	19 Å²	19	103.6 Å²	103.6	9%	0.089	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-68.5	-15.7	-180	-70.1	178.4	-163.6	0	0	113	V24 I25 E26 H30 Y33 W34 R389	V24-E28 HydrophobicContact CG1-CB 4.4Å; I25-E28 HydrophobicContact CB-CG 4.21Å; I25-E28 WeakPolarHBondContact O-CB 3.5Å; I25-E28 PolarHBondContact O-N 2.97Å; E26-E28 VanDerWaalsContact C-N 3.26Å; E26-E28 PolarHBondContact O-N 3.48Å; E28-H30 PolarHBondContact O-N 2.81Å; E28-Y33 HydrophobicContact CG-CD1 3.95Å; E28-Y33 HydrophobicContact CG-CE1 3.64Å; E28-W34 HydrophobicContact CB-CZ2 3.82Å; E28-W34 HydrophobicContact CG-CH2 4.24Å; E28-W34 HydrophobicContact CG-CZ2 3.83Å; E28-W34 PolarHBondContact O-NE1 2.83Å; E28-R389 IonicContact OE1-CZ 3.32Å; E28-R389 IonicContact OE1-NH1 3.25Å; E28-R389 PolarHBondContact OE1-NH1 3.45Å; E28-R389 IonicContact OE1-NH2 2.75Å; E28-R389 PolarHBondContact OE1-NH2 3.34Å; E28-R389 IonicContact OE2-CZ 3.33Å; E28-R389 IonicContact OE2-NH1 3.18Å; E28-R389 PolarHBondContact OE2-NH1 2.97Å; E28-R389 IonicContact OE2-NH2 3.47Å; E28-R389 PolarHBondContact OE2-NH2 3.01Å
29	L	94.1	Very high	83	Confident	122 Å²	122	104.2 Å²	104.2	64%	0.639	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-71.3	-19.2	172.7	-59.8	175.7	0	0	0	112.1	V24 E26 E27	V24-L29 HydrophobicContact CG1-CD2 3.74Å; V24-L29 HydrophobicContact CG1-CG 4.15Å; E26-L29 VanDerWaalsContact O-CB 3.25Å; E26-L29 WeakPolarHBondContact O-CB 3.44Å; E26-L29 WeakPolarHBondContact O-CG 3.29Å; E26-L29 PolarHBondContact O-N 3.49Å; E27-L29 PolarHBondContact O-N 3.28Å
30	H	96.4	Very high	85.8	Confident	92 Å²	92	103.2 Å²	103.2	43%	0.426	51%	0.513	S	S	.	.	S	Bend	trans	-100.7	129.7	-174.8	-61.4	-75.4	0	0	0	111.3	E26 E27 E28 E32 Y33	E26-H30 PolarHBondContact O-CD2 2.8Å; E27-H30 PolarHBondContact O-N 3.06Å; E28-H30 PolarHBondContact O-N 2.81Å; H30-E32 PolarHBondContact O-N 2.95Å; H30-Y33 WeakPolarHBondContact O-CB 3.35Å; H30-Y33 PolarHBondContact O-N 3.08Å; H30-Y33 VanDerWaalsContact O-N 3.13Å
31	P	97.8	Very high	88.3	Confident	89 Å²	89	96 Å²	96	58%	0.578	50%	0.498	S	S	*	.	H	α-helix	trans	-56.6	-27	178.1	-26.9	34.9	0	0	0	114.3	Y33 W34 N35	P31-Y33 VanDerWaalsContact C-N 3.32Å; P31-Y33 PolarHBondContact O-N 3.05Å; P31-W34 PolarHBondContact O-N 2.93Å; P31-N35 WeakPolarHBondContact O-CB 3.15Å; P31-N35 VanDerWaalsContact O-CG 3.26Å; P31-N35 PolarHBondContact O-N 2.95Å; P31-N35 PolarHBondContact O-ND2 3.39Å
32	E	97.9	Very high	90.7	Very high	136 Å²	136	95 Å²	95	64%	0.636	49%	0.488	S	S	*	.	H	α-helix	trans	-61.2	-38.5	179.2	-69.1	160.3	175.8	0	0	112.3	H30 W34 N35 N36	H30-E32 PolarHBondContact O-N 2.95Å; E32-W34 PolarHBondContact O-N 3.47Å; E32-N35 PolarHBondContact O-N 3.18Å; E32-N36 VanDerWaalsContact O-CB 3.24Å; E32-N36 WeakPolarHBondContact O-CB 3.46Å; E32-N36 PolarHBondContact O-N 3.37Å; E32-N36 PolarHBondContact O-ND2 3.24Å; E32-N36 VanDerWaalsContact O-ND2 3.16Å
33	Y	96.6	Very high	92.8	Very high	55 Å²	55	94.1 Å²	94.1	22%	0.216	48%	0.481	C	S	.	.	H	α-helix	trans	-57.5	-51.1	175.3	174.1	-90.8	0	0	0	110.9	E27 E28 H30 P31 N36 K37	E27-Y33 HydrophobicContact CB-CD2 3.7Å; E27-Y33 HydrophobicContact CB-CE2 4.29Å; E27-Y33 HydrophobicContact CB-CG 4.28Å; E27-Y33 WeakPolarHBondContact O-CB 3.43Å; E28-Y33 HydrophobicContact CG-CD1 3.95Å; E28-Y33 HydrophobicContact CG-CE1 3.64Å; H30-Y33 WeakPolarHBondContact O-CB 3.35Å; H30-Y33 PolarHBondContact O-N 3.08Å; H30-Y33 VanDerWaalsContact O-N 3.13Å; P31-Y33 VanDerWaalsContact C-N 3.32Å; P31-Y33 PolarHBondContact O-N 3.05Å; Y33-N36 PolarHBondContact O-N 2.99Å; Y33-K37 HydrophobicContact CE1-CD 4.2Å; Y33-K37 WeakPolarHBondContact O-CB 3.34Å; Y33-K37 PolarHBondContact O-N 3.17Å
34	W	97.2	Very high	94.3	Very high	123 Å²	123	95.7 Å²	95.7	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-43.2	-179.7	-60.1	106.8	0	0	0	112.4	E28 P31 E32 N36 K37 A38	E28-W34 HydrophobicContact CB-CZ2 3.82Å; E28-W34 HydrophobicContact CG-CH2 4.24Å; E28-W34 HydrophobicContact CG-CZ2 3.83Å; E28-W34 PolarHBondContact O-NE1 2.83Å; P31-W34 PolarHBondContact O-N 2.93Å; E32-W34 PolarHBondContact O-N 3.47Å; W34-N36 VanDerWaalsContact C-N 3.35Å; W34-N36 PolarHBondContact O-N 2.87Å; W34-K37 PolarHBondContact O-N 3.35Å; W34-A38 WeakPolarHBondContact O-CB 3.41Å; W34-A38 PolarHBondContact O-N 2.85Å
35	N	98.2	Very high	95.4	Very high	107 Å²	107	96.3 Å²	96.3	57%	0.572	50%	0.499	S	S	*	.	H	α-helix	trans	-62.4	-41.7	176.9	-72.3	-26.9	0	0	0	111.7	P31 E32 K39	P31-N35 WeakPolarHBondContact O-CB 3.15Å; P31-N35 VanDerWaalsContact O-CG 3.26Å; P31-N35 PolarHBondContact O-N 2.95Å; P31-N35 PolarHBondContact O-ND2 3.39Å; E32-N35 PolarHBondContact O-N 3.18Å; N35-K39 VanDerWaalsContact O-CB 3.26Å; N35-K39 WeakPolarHBondContact O-CB 3.32Å; N35-K39 PolarHBondContact O-N 2.02Å
36	N	98	Very high	96.2	Very high	105 Å²	105	98.5 Å²	98.5	56%	0.561	51%	0.511	S	S	*	.	H	α-helix	trans	-67.7	-44.3	178.1	-72.5	-25.1	0	0	0	111.5	E32 Y33 W34 A38 K39 Q40	E32-N36 VanDerWaalsContact O-CB 3.24Å; E32-N36 WeakPolarHBondContact O-CB 3.46Å; E32-N36 PolarHBondContact O-N 3.37Å; E32-N36 PolarHBondContact O-ND2 3.24Å; E32-N36 VanDerWaalsContact O-ND2 3.16Å; Y33-N36 PolarHBondContact O-N 2.99Å; W34-N36 VanDerWaalsContact C-N 3.35Å; W34-N36 PolarHBondContact O-N 2.87Å; N36-A38 PolarHBondContact O-N 3.17Å; N36-K39 PolarHBondContact O-N 2.99Å; N36-Q40 WeakPolarHBondContact O-CB 3.23Å; N36-Q40 PolarHBondContact O-N 2.97Å
37	K	96.4	Very high	96.6	Very high	88 Å²	88	97 Å²	97	38%	0.383	51%	0.507	S	S	.	.	H	α-helix	trans	-59.8	-44.9	175.8	-166.9	170.9	-172.9	171.4	0	111.4	Y33 W34 Q40 A41	Y33-K37 HydrophobicContact CE1-CD 4.2Å; Y33-K37 WeakPolarHBondContact O-CB 3.34Å; Y33-K37 PolarHBondContact O-N 3.17Å; W34-K37 PolarHBondContact O-N 3.35Å; K37-Q40 PolarHBondContact O-N 3.4Å; K37-A41 PolarHBondContact O-N 2.91Å
38	A	98.3	Very high	96.8	Very high	60 Å²	60	93.6 Å²	93.6	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-41.8	176.1	0	0	0	0	0	112.6	W34 N36 Q40 A41 L42	W34-A38 WeakPolarHBondContact O-CB 3.41Å; W34-A38 PolarHBondContact O-N 2.85Å; N36-A38 PolarHBondContact O-N 3.17Å; A38-Q40 VanDerWaalsContact C-N 3.33Å; A38-Q40 PolarHBondContact O-N 3.13Å; A38-A41 PolarHBondContact O-N 2.72Å; A38-L42 WeakPolarHBondContact O-CB 3.37Å; A38-L42 PolarHBondContact O-N 2.82Å
39	K	98.4	Very high	96.9	Very high	128 Å²	128	99.6 Å²	99.6	56%	0.557	52%	0.523	S	S	*	.	H	α-helix	trans	-61.6	-42.1	176.2	-176.3	179.5	178.1	-175.9	0	111.4	N35 N36 L42 H43	N35-K39 VanDerWaalsContact O-CB 3.26Å; N35-K39 WeakPolarHBondContact O-CB 3.32Å; N35-K39 PolarHBondContact O-N 2.02Å; N36-K39 PolarHBondContact O-N 2.99Å; K39-L42 PolarHBondContact O-N 3.24Å; K39-H43 PolarHBondContact O-CD2 2.97Å; K39-H43 PolarHBondContact O-N 3.16Å
40	Q	97.4	Very high	96.9	Very high	139 Å²	139	97.1 Å²	97.1	65%	0.65	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-45.7	176	-171.4	177.1	5.7	0	0	111.5	N36 K37 A38 L42 H43 T44	N36-Q40 WeakPolarHBondContact O-CB 3.23Å; N36-Q40 PolarHBondContact O-N 2.97Å; K37-Q40 PolarHBondContact O-N 3.4Å; A38-Q40 VanDerWaalsContact C-N 3.33Å; A38-Q40 PolarHBondContact O-N 3.13Å; Q40-L42 VanDerWaalsContact C-N 3.32Å; Q40-L42 PolarHBondContact O-N 2.77Å; Q40-H43 WeakPolarHBondContact O-CB 3.47Å; Q40-H43 PolarHBondContact O-N 2.81Å; Q40-T44 PolarHBondContact O-N 3.28Å; Q40-T44 PolarHBondContact O-OG1 3.31Å
41	A	97.1	Very high	97	Very high	60 Å²	60	93.9 Å²	93.9	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-59.8	-41.7	176.1	0	0	0	0	0	112.2	K37 A38 T44 A45	K37-A41 PolarHBondContact O-N 2.91Å; A38-A41 PolarHBondContact O-N 2.72Å; A41-T44 WeakPolarHBondContact O-CB 3.44Å; A41-T44 PolarHBondContact O-N 2.68Å; A41-A45 PolarHBondContact O-N 3.28Å
42	L	98.3	Very high	96.9	Very high	104 Å²	104	92.5 Å²	92.5	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-42	174.9	180	61	0	0	0	111.9	A38 K39 Q40 T44 A45 L46	A38-L42 WeakPolarHBondContact O-CB 3.37Å; A38-L42 PolarHBondContact O-N 2.82Å; K39-L42 PolarHBondContact O-N 3.24Å; Q40-L42 VanDerWaalsContact C-N 3.32Å; Q40-L42 PolarHBondContact O-N 2.77Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 3.24Å; L42-A45 PolarHBondContact O-N 3.45Å; L42-L46 HydrophobicContact CD1-CD1 4.23Å; L42-L46 HydrophobicContact CD1-CG 4.18Å; L42-L46 HydrophobicContact CG-CD1 4.06Å; L42-L46 HydrophobicContact CG-CG 4.44Å; L42-L46 WeakPolarHBondContact O-CB 3.3Å; L42-L46 VanDerWaalsContact O-CG 3.32Å; L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 2.86Å
43	H	97.8	Very high	96.9	Very high	101 Å²	101	87.7 Å²	87.7	47%	0.468	47%	0.467	S	S	.	.	H	α-helix	trans	-60.9	-41.6	173.6	-84.4	-63.2	0	0	0	111.9	K39 Q40 N47	K39-H43 PolarHBondContact O-CD2 2.97Å; K39-H43 PolarHBondContact O-N 3.16Å; Q40-H43 WeakPolarHBondContact O-CB 3.47Å; Q40-H43 PolarHBondContact O-N 2.81Å; H43-N47 WeakPolarHBondContact O-CB 3.26Å; H43-N47 PolarHBondContact O-N 2.91Å; H43-N47 PolarHBondContact O-ND2 2.86Å
44	T	95.8	Very high	96.9	Very high	88 Å²	88	87.9 Å²	87.9	54%	0.54	47%	0.469	S	S	.	.	H	α-helix	trans	-60	-50.6	173.6	-59.6	0	0	0	0	110.5	Q40 A41 L42 L46 N47 V48	Q40-T44 PolarHBondContact O-N 3.28Å; Q40-T44 PolarHBondContact O-OG1 3.31Å; A41-T44 WeakPolarHBondContact O-CB 3.44Å; A41-T44 PolarHBondContact O-N 2.68Å; L42-T44 VanDerWaalsContact C-N 3.33Å; L42-T44 PolarHBondContact O-N 3.24Å; T44-L46 PolarHBondContact O-N 3.33Å; T44-N47 PolarHBondContact O-N 3.01Å; T44-V48 WeakPolarHBondContact O-CG2 3.16Å; T44-V48 PolarHBondContact O-N 3.45Å
45	A	96.6	Very high	97	Very high	64 Å²	64	82 Å²	82	53%	0.529	45%	0.447	S	S	.	.	H	α-helix	trans	-59	-42.4	-179	0	0	0	0	0	113.2	A41 L42 N47 V48	A41-A45 PolarHBondContact O-N 3.28Å; L42-A45 PolarHBondContact O-N 3.45Å; A45-N47 PolarHBondContact O-N 3.24Å; A45-V48 PolarHBondContact O-N 3.33Å
46	L	97.4	Very high	97	Very high	118 Å²	118	79.7 Å²	79.7	62%	0.618	43%	0.432	S	S	*	.	H	α-helix	trans	-66.9	-20.7	177.3	-70.8	171.5	0	0	0	113.4	L42 T44	L42-L46 HydrophobicContact CD1-CD1 4.23Å; L42-L46 HydrophobicContact CD1-CG 4.18Å; L42-L46 HydrophobicContact CG-CD1 4.06Å; L42-L46 HydrophobicContact CG-CG 4.44Å; L42-L46 WeakPolarHBondContact O-CB 3.3Å; L42-L46 VanDerWaalsContact O-CG 3.32Å; L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 2.86Å; T44-L46 PolarHBondContact O-N 3.33Å
47	N	95.9	Very high	97	Very high	117 Å²	117	75.1 Å²	75.1	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-97.3	-7.1	179.7	-72.4	-41.9	0	0	0	113.5	H43 T44 A45 Q49	H43-N47 WeakPolarHBondContact O-CB 3.26Å; H43-N47 PolarHBondContact O-N 2.91Å; H43-N47 PolarHBondContact O-ND2 2.86Å; T44-N47 PolarHBondContact O-N 3.01Å; A45-N47 PolarHBondContact O-N 3.24Å; N47-Q49 PolarHBondContact O-N 2.83Å; N47-Q49 VanDerWaalsContact O-N 3.14Å
48	V	94.4	Very high	97.2	Very high	51 Å²	51	71 Å²	71	31%	0.309	39%	0.389	S	S	.	.			trans	-65.2	115.5	174.7	177.3	0	0	0	0	108.8	T44 A45 P97	T44-V48 WeakPolarHBondContact O-CG2 3.16Å; T44-V48 PolarHBondContact O-N 3.45Å; A45-V48 PolarHBondContact O-N 3.33Å; V48-P97 HydrophobicContact CG1-CB 4.2Å; V48-P97 HydrophobicContact CG2-CB 4.2Å
49	Q	94.6	Very high	97.2	Very high	144 Å²	144	68.1 Å²	68.1	67%	0.673	37%	0.366	S	S	*	.			trans	-106.5	135	175.3	-63.6	-56.9	-49.1	0	0	110.1	N47 N51	N47-Q49 PolarHBondContact O-N 2.83Å; N47-Q49 VanDerWaalsContact O-N 3.14Å; Q49-N51 PolarHBondContact O-N 2.91Å; Q49-N51 VanDerWaalsContact O-N 3.13Å
50	P	95.4	Very high	97.2	Very high	70 Å²	70	62 Å²	62	46%	0.455	34%	0.339	S	S	.	.			trans	-57.2	117.4	172.2	-26.4	35.9	0	0	0	111.4	V52	P50-V52 HydrophobicContact CB-CG1 4.16Å; P50-V52 PolarHBondContact O-N 3.16Å
51	N	96.8	Very high	97.3	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.128	31%	0.308	C	S	.	.			trans	-78.4	104	166.9	-175.9	-6	0	0	0	108.7	Q49 H53 M367 M464	Q49-N51 PolarHBondContact O-N 2.91Å; Q49-N51 VanDerWaalsContact O-N 3.13Å; N51-H53 WeakPolarHBondContact OD1-CB 3.34Å; N51-H53 PolarHBondContact OD1-N 3.44Å; N51-H53 VanDerWaalsContact OD1-N 3.11Å; N51-H53 PolarHBondContact OD1-ND1 3.42Å; N51-M367 PolarHBondContact ND2-O 3.02Å; N51-M464 PolarHBondContact O-N 3.47Å
52	V	96.9	Very high	97.4	Very high	61 Å²	61	52.5 Å²	52.5	37%	0.37	29%	0.285	S	S	.	.			trans	-97.4	18.9	-178.8	-60.5	0	0	0	0	113.6	P50 M464 L496	P50-V52 HydrophobicContact CB-CG1 4.16Å; P50-V52 PolarHBondContact O-N 3.16Å; V52-M464 HydrophobicContact CB-SD 4.39Å; V52-L496 HydrophobicContact CG2-CD1 3.88Å; V52-L496 HydrophobicContact CG2-CG 4.36Å; V52-L496 PolarHBondContact O-N 3.36Å
53	H	96.7	Very high	97.4	Very high	34 Å²	34	47.6 Å²	47.6	16%	0.157	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-83.1	164.1	175.2	-58.9	85.7	0	0	0	111.5	N51 P463 L496 E497 H499	N51-H53 WeakPolarHBondContact OD1-CB 3.34Å; N51-H53 PolarHBondContact OD1-N 3.44Å; N51-H53 VanDerWaalsContact OD1-N 3.11Å; N51-H53 PolarHBondContact OD1-ND1 3.42Å; H53-P463 WeakPolarHBondContact O-CB 2.98Å; H53-L496 CarbonylContact C-O 3.55Å; H53-L496 VanDerWaalsContact CA-O 3.23Å; H53-L496 WeakPolarHBondContact CA-O 3.41Å; H53-L496 WeakPolarHBondContact CD2-CB 3.5Å; H53-E497 PolarHBondContact CD2-O 3.07Å; H53-H499 AromaticContact CD2-CE1 3.97Å; H53-H499 AromaticContact CD2-ND1 3.91Å; H53-H499 AromaticContact CE1-CE1 3.63Å; H53-H499 AromaticContact NE2-CE1 3.37Å; H53-H499 PolarHBondContact NE2-CE1 3.12Å; H53-H499 AromaticContact NE2-ND1 3.79Å
54	K	97.7	Very high	97.3	Very high	60 Å²	60	42.8 Å²	42.8	26%	0.261	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-69.4	131	169.9	-177.2	174.9	-176.3	168.2	0	110.9	K56 A484 A485 C486 L495 L496	K54-K56 PolarHBondContact O-N 3.06Å; K54-A484 CarbonylContact C-O 3.21Å; K54-A484 WeakPolarHBondContact CA-O 3.46Å; K54-A485 WeakPolarHBondContact CE-O 3.18Å; K54-C486 HydrophobicContact CD-CB 4.25Å; K54-L495 HydrophobicContact CB-CB 4.36Å; K54-L496 PolarHBondContact N-O 3.21Å
55	A	98.5	Very high	97.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-71.9	118.2	169	0	0	0	0	0	110.4	L58 D368 L370 P463 A484	A55-L58 HydrophobicContact CB-CD2 3.9Å; A55-D368 CarbonylContact C-O 3.48Å; A55-L370 HydrophobicContact CB-CB 3.96Å; A55-P463 HydrophobicContact CB-CB 4.1Å; A55-P463 HydrophobicContact CB-CG 4.17Å; A55-A484 HydrophobicContact CB-CB 4.03Å; A55-A484 PolarHBondContact N-O 3.49Å
56	K	98.5	Very high	97.4	Very high	57 Å²	57	35.7 Å²	35.7	25%	0.248	19%	0.187	C	C	.	.	S	Bend	trans	-71.5	-47.1	168.5	-179.2	-175.9	167.5	-175.4	0	109.7	K54 K163 P321 G323 D368	K54-K56 PolarHBondContact O-N 3.06Å; K56-K163 PolarHBondContact O-NZ 3.36Å; K56-P321 VanDerWaalsContact CE-O 3.3Å; K56-P321 WeakPolarHBondContact CE-O 3.41Å; K56-G323 WeakPolarHBondContact O-CA 3.43Å; K56-D368 WeakPolarHBondContact CA-O 2.97Å; K56-D368 HydrophobicContact CB-CB 4.03Å; K56-D368 WeakPolarHBondContact CB-O 3.44Å; K56-D368 PolarHBondContact N-O 3.17Å
57	N	98.9	Very high	97.5	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.053	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.6	-177.8	-41.8	-56.2	0	0	0	110.5	G323 Y324 D368 T369 L370	N57-G323 WeakPolarHBondContact OD1-CA 3.01Å; N57-Y324 CarbonylContact C-O 3.08Å; N57-Y324 WeakPolarHBondContact CA-O 3.28Å; N57-Y324 HydrophobicContact CB-CD1 4.1Å; N57-Y324 HydrophobicContact CB-CD2 4.48Å; N57-Y324 HydrophobicContact CB-CE1 3.75Å; N57-Y324 HydrophobicContact CB-CE2 4.18Å; N57-Y324 HydrophobicContact CB-CG 4.44Å; N57-Y324 VanDerWaalsContact CG-CE1 3.43Å; N57-Y324 VanDerWaalsContact OD1-CD1 3.31Å; N57-Y324 WeakPolarHBondContact OD1-CD1 3.46Å; N57-Y324 WeakPolarHBondContact OD1-CE1 3.17Å; N57-Y324 PolarHBondContact OD1-N 3.34Å; N57-D368 PolarHBondContact N-O 3Å; N57-D368 PolarHBondContact ND2-OD1 2.72Å; N57-T369 HydrophobicContact CB-CG2 3.88Å; N57-T369 PolarHBondContact ND2-OG1 3.46Å; N57-T369 WeakPolarHBondContact O-CA 3.4Å; N57-L370 PolarHBondContact O-N 2.81Å
58	L	98.9	Very high	97.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.1	176.2	-64.8	-179.4	0	0	0	108.2	A55 I154 Y324 F325 L326 L370 M481 A485 I487	A55-L58 HydrophobicContact CB-CD2 3.9Å; L58-I154 HydrophobicContact CD1-CD1 3.89Å; L58-I154 HydrophobicContact CD1-CG1 4.42Å; L58-Y324 PolarHBondContact N-O 3.01Å; L58-F325 HydrophobicContact CB-CB 4.43Å; L58-F325 HydrophobicContact CB-CD2 3.74Å; L58-F325 HydrophobicContact CD1-CD2 4.16Å; L58-F325 CarbonylContact O-C 3.54Å; L58-F325 WeakPolarHBondContact O-CA 3.45Å; L58-L326 PolarHBondContact O-N 3.26Å; L58-L370 WeakPolarHBondContact CA-O 3.24Å; L58-L370 HydrophobicContact CD2-CB 3.92Å; L58-L370 HydrophobicContact CD2-CD2 4.04Å; L58-L370 HydrophobicContact CD2-CG 4.37Å; L58-M481 HydrophobicContact CB-CE 3.83Å; L58-M481 HydrophobicContact CD1-CB 4.33Å; L58-M481 HydrophobicContact CD2-CB 4.33Å; L58-M481 HydrophobicContact CD2-CE 4.43Å; L58-A485 HydrophobicContact CD1-CB 3.69Å; L58-A485 HydrophobicContact CD2-CB 4.11Å; L58-A485 HydrophobicContact CG-CB 4.01Å; L58-I487 HydrophobicContact CD1-CD1 4.41Å
59	I	98.9	Very high	97.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.3	172.5	-49.7	-177.5	0	0	0	108.8	F61 I314 Y324 L326 V328 A360 T364 T369 L370 T371 V372	I59-F61 HydrophobicContact CB-CE2 4.34Å; I59-F61 HydrophobicContact CG2-CD2 3.67Å; I59-F61 HydrophobicContact CG2-CE2 3.35Å; I59-F61 HydrophobicContact CG2-CZ 4.01Å; I59-I314 HydrophobicContact CD1-CD1 4.26Å; I59-Y324 HydrophobicContact CD1-CE2 4.06Å; I59-Y324 HydrophobicContact CG1-CE2 3.91Å; I59-L326 WeakPolarHBondContact CA-O 3.46Å; I59-L326 HydrophobicContact CG1-CB 4.36Å; I59-L326 HydrophobicContact CG2-CB 4.34Å; I59-L326 HydrophobicContact CG2-CD2 4.34Å; I59-L326 HydrophobicContact CG2-CG 4.39Å; I59-V328 HydrophobicContact CG2-CG2 4.32Å; I59-A360 HydrophobicContact CD1-CB 4.37Å; I59-T364 HydrophobicContact CD1-CG2 3.96Å; I59-T369 HydrophobicContact CD1-CG2 4.1Å; I59-T369 HydrophobicContact CG1-CG2 4.17Å; I59-L370 PolarHBondContact N-O 2.56Å; I59-T371 HydrophobicContact CB-CG2 4.32Å; I59-T371 WeakPolarHBondContact O-CA 3.47Å; I59-V372 PolarHBondContact O-N 2.89Å
60	L	98.9	Very high	98	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.3	171.1	179	59.5	0	0	0	108.9	Y121 L122 F325 L326 F327 V328 V372 T374 I477 M481	L60-Y121 HydrophobicContact CD2-CD2 3.84Å; L60-Y121 HydrophobicContact CD2-CE2 4.42Å; L60-L122 HydrophobicContact CD2-CD2 3.97Å; L60-F325 HydrophobicContact CB-CE2 4.41Å; L60-F325 HydrophobicContact CB-CZ 4.38Å; L60-L326 PolarHBondContact N-O 3.01Å; L60-F327 HydrophobicContact CB-CD2 4.36Å; L60-F327 HydrophobicContact CD2-CD2 4.1Å; L60-F327 HydrophobicContact CD2-CE2 4.29Å; L60-F327 HydrophobicContact CG-CD2 4.2Å; L60-F327 HydrophobicContact CG-CE2 4.47Å; L60-V328 PolarHBondContact O-N 3.16Å; L60-V372 WeakPolarHBondContact CA-O 3.36Å; L60-V372 HydrophobicContact CD1-CB 3.97Å; L60-V372 HydrophobicContact CD1-CG1 3.96Å; L60-T374 HydrophobicContact CD1-CG2 4.01Å; L60-I477 HydrophobicContact CD1-CG2 4.11Å; L60-M481 HydrophobicContact CB-CE 3.97Å; L60-M481 HydrophobicContact CB-SD 4.15Å; L60-M481 HydrophobicContact CD1-SD 4.37Å
61	F	98.9	Very high	98.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.6	169.9	-78	-84.3	0	0	0	109.3	I59 T310 V328 F353 A356 I357 A360 T371 V372 V373 T374	I59-F61 HydrophobicContact CB-CE2 4.34Å; I59-F61 HydrophobicContact CG2-CD2 3.67Å; I59-F61 HydrophobicContact CG2-CE2 3.35Å; I59-F61 HydrophobicContact CG2-CZ 4.01Å; F61-T310 HydrophobicContact CE1-CG2 4.33Å; F61-T310 HydrophobicContact CZ-CG2 4.18Å; F61-V328 CarbonylContact C-O 3.57Å; F61-V328 VanDerWaalsContact CA-O 3.24Å; F61-V328 WeakPolarHBondContact CA-O 3.42Å; F61-V328 HydrophobicContact CD1-CB 3.55Å; F61-V328 HydrophobicContact CD1-CG1 3.76Å; F61-V328 HydrophobicContact CD1-CG2 4.18Å; F61-V328 HydrophobicContact CE1-CB 3.6Å; F61-V328 HydrophobicContact CE1-CG1 3.61Å; F61-V328 HydrophobicContact CE1-CG2 3.81Å; F61-V328 HydrophobicContact CG-CB 4.29Å; F61-V328 HydrophobicContact CZ-CB 4.38Å; F61-V328 HydrophobicContact CZ-CG2 4.14Å; F61-F353 HydrophobicContact CB-CE2 3.91Å; F61-F353 HydrophobicContact CB-CZ 3.6Å; F61-F353 HydrophobicContact CD1-CD2 4.47Å; F61-F353 AromaticContact CD1-CE2 3.82Å; F61-F353 HydrophobicContact CD1-CE2 3.82Å; F61-F353 HydrophobicContact CD1-CZ 4.3Å; F61-F353 HydrophobicContact CG-CE2 4.37Å; F61-F353 HydrophobicContact CG-CZ 4.44Å; F61-A356 HydrophobicContact CE1-CB 4.23Å; F61-I357 HydrophobicContact CB-CD1 4.34Å; F61-I357 HydrophobicContact CB-CG1 4.11Å; F61-I357 HydrophobicContact CD1-CD1 4.43Å; F61-I357 HydrophobicContact CD1-CG1 3.5Å; F61-I357 HydrophobicContact CD2-CG1 3.97Å; F61-I357 HydrophobicContact CE1-CG1 3.81Å; F61-I357 HydrophobicContact CE2-CG1 4.23Å; F61-I357 HydrophobicContact CG-CD1 4.36Å; F61-I357 HydrophobicContact CG-CG1 3.6Å; F61-I357 HydrophobicContact CZ-CG1 4.17Å; F61-A360 HydrophobicContact CE2-CB 3.86Å; F61-A360 HydrophobicContact CZ-CB 3.51Å; F61-T371 HydrophobicContact CD2-CG2 3.69Å; F61-T371 HydrophobicContact CE2-CG2 3.81Å; F61-V372 PolarHBondContact N-O 2.86Å; F61-V373 HydrophobicContact CB-CB 4.27Å; F61-V373 HydrophobicContact CB-CG1 4.2Å; F61-V373 HydrophobicContact CB-CG2 3.95Å; F61-V373 HydrophobicContact CD2-CG2 4.4Å; F61-V373 HydrophobicContact CG-CG2 4.48Å; F61-V373 WeakPolarHBondContact O-CA 3.38Å; F61-T374 PolarHBondContact O-N 3.4Å
62	L	98.8	Very high	98.2	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	112	-179.5	-165.1	-66.3	0	0	0	109.8	D64 Y121 F327 V328 E329 D330 F353 T374 D376	L62-D64 HydrophobicContact CD1-CB 4.06Å; L62-Y121 HydrophobicContact CD2-CD1 4.27Å; L62-Y121 HydrophobicContact CD2-CD2 4.33Å; L62-Y121 HydrophobicContact CD2-CE1 3.94Å; L62-Y121 HydrophobicContact CD2-CE2 4.03Å; L62-Y121 HydrophobicContact CD2-CG 4.48Å; L62-Y121 HydrophobicContact CG-CE1 4.3Å; L62-Y121 HydrophobicContact CG-CE2 4.01Å; L62-F327 HydrophobicContact CB-CE2 3.61Å; L62-F327 HydrophobicContact CB-CZ 3.86Å; L62-F327 HydrophobicContact CG-CE2 4.16Å; L62-F327 HydrophobicContact CG-CZ 4.24Å; L62-V328 PolarHBondContact N-O 2.95Å; L62-E329 VanDerWaalsContact O-CA 3.28Å; L62-E329 WeakPolarHBondContact O-CA 3.47Å; L62-D330 PolarHBondContact O-N 3.2Å; L62-F353 WeakPolarHBondContact O-CE2 3.16Å; L62-T374 WeakPolarHBondContact CA-O 3.19Å; L62-T374 HydrophobicContact CD2-CG2 3.56Å; L62-D376 HydrophobicContact CD1-CB 4.12Å; L62-D376 HydrophobicContact CD2-CB 4.27Å
63	G	98.1	Very high	98.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	99.6	168.7	0	0	0	0	0	109	G65 M66 F353 T374 A375	G63-G65 PolarHBondContact O-N 2.8Å; G63-M66 WeakPolarHBondContact O-CB 3.46Å; G63-M66 PolarHBondContact O-N 2.82Å; G63-F353 VanDerWaalsContact N-CZ 3.29Å; G63-T374 PolarHBondContact N-O 3.04Å; G63-A375 WeakPolarHBondContact O-CA 3.45Å; G63-A375 WeakPolarHBondContact O-CB 3.43Å
64	D	96.8	Very high	98.3	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	120.9	-177	-168.4	-35.9	0	0	0	109.9	L62 M66 S177 I334 D335 D376 H377	L62-D64 HydrophobicContact CD1-CB 4.06Å; D64-M66 VanDerWaalsContact C-N 3.26Å; D64-M66 PolarHBondContact O-N 2.75Å; D64-S177 PolarHBondContact OD2-OG 3.35Å; D64-I334 VanDerWaalsContact O-CB 3.22Å; D64-I334 WeakPolarHBondContact O-CB 3.19Å; D64-I334 VanDerWaalsContact O-CG2 3.27Å; D64-I334 WeakPolarHBondContact O-CG2 3.4Å; D64-D335 HydrophobicContact CB-CB 4.25Å; D64-D335 PolarHBondContact O-N 3.28Å; D64-D335 VanDerWaalsContact O-N 3.1Å; D64-D335 WeakPolarHBondContact OD1-CB 3.28Å; D64-D376 WeakPolarHBondContact CA-OD1 3.34Å; D64-H377 IonicContact OD1-CE1 3.92Å; D64-H377 IonicContact OD1-NE2 3.34Å
65	G	96.3	Very high	98.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	6.1	-172.6	0	0	0	0	0	115.6	G63 G67 D376 H377 H379	G63-G65 PolarHBondContact O-N 2.8Å; G65-G67 VanDerWaalsContact C-N 3.29Å; G65-G67 PolarHBondContact O-N 3.34Å; G65-D376 PolarHBondContact N-OD1 3.1Å; G65-H377 CarbonylContact C-O 3.55Å; G65-H377 VanDerWaalsContact C-O 3.28Å; G65-H377 WeakPolarHBondContact CA-O 3.46Å; G65-H379 PolarHBondContact O-CD2 3.47Å
66	M	98.3	Very high	98.3	Very high	4 Å²	4	14 Å²	14	2%	0.02	7%	0.071	C	C	.	.			trans	-82	60.1	-173	-163.5	-169.1	63.9	0	0	113.6	G63 D64 T70 V71 M93 I334 F353 V373 A375	G63-M66 WeakPolarHBondContact O-CB 3.46Å; G63-M66 PolarHBondContact O-N 2.82Å; D64-M66 VanDerWaalsContact C-N 3.26Å; D64-M66 PolarHBondContact O-N 2.75Å; M66-T70 HydrophobicContact CG-CG2 3.95Å; M66-V71 HydrophobicContact CE-CG2 4Å; M66-V71 HydrophobicContact CG-CG2 4.02Å; M66-V71 HydrophobicContact SD-CG2 4.28Å; M66-M93 HydrophobicContact CE-CE 3.88Å; M66-M93 HydrophobicContact CE-SD 3.82Å; M66-M93 HydrophobicContact SD-CE 3.99Å; M66-M93 HydrophobicContact SD-SD 4.41Å; M66-I334 HydrophobicContact CB-CD1 4.07Å; M66-I334 HydrophobicContact CB-CG2 4.17Å; M66-I334 HydrophobicContact CG-CD1 4.11Å; M66-I334 HydrophobicContact SD-CD1 4.18Å; M66-F353 HydrophobicContact CE-CD1 4.17Å; M66-F353 HydrophobicContact CE-CE1 3.69Å; M66-F353 HydrophobicContact SD-CD1 3.72Å; M66-F353 HydrophobicContact SD-CE1 3.87Å; M66-V373 HydrophobicContact CE-CG1 4.36Å; M66-A375 HydrophobicContact CB-CB 4.13Å; M66-A375 WeakPolarHBondContact O-CB 3.23Å
67	G	98.3	Very high	98.3	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.01	6%	0.061	C	C	.	.			trans	-70.4	-179.6	175.9	0	0	0	0	0	114.4	G65 P69 T70 V71 S378	G65-G67 VanDerWaalsContact C-N 3.29Å; G65-G67 PolarHBondContact O-N 3.34Å; G67-P69 VanDerWaalsContact C-CD 3.48Å; G67-T70 WeakPolarHBondContact O-CB 3.48Å; G67-T70 PolarHBondContact O-N 3.48Å; G67-V71 PolarHBondContact O-N 2.88Å; G67-S378 VanDerWaalsContact CA-OG 3.29Å; G67-S378 WeakPolarHBondContact CA-OG 3.43Å
68	I	98.5	Very high	98.3	Very high	77 Å²	77	12.6 Å²	12.6	40%	0.395	7%	0.065	S	C	.	.	H	α-helix	trans	-55	-41.7	-172.8	-63.3	171.6	0	0	0	113.4	T70 V71 T72 L101	I68-T70 VanDerWaalsContact C-N 3.34Å; I68-T70 PolarHBondContact O-N 3.12Å; I68-V71 PolarHBondContact O-N 2.84Å; I68-T72 PolarHBondContact O-N 3.1Å; I68-T72 VanDerWaalsContact O-N 3.08Å; I68-T72 PolarHBondContact O-OG1 3.07Å; I68-L101 HydrophobicContact CD1-CD2 3.91Å
69	P	98.4	Very high	98.2	Very high	30 Å²	30	12.6 Å²	12.6	20%	0.195	7%	0.065	C	C	.	.	H	α-helix	trans	-61	-42.5	175.9	-24.2	35.7	0	0	0	112.4	G67 T72 A73 F381 F383	G67-P69 VanDerWaalsContact C-CD 3.48Å; P69-T72 PolarHBondContact O-N 3.28Å; P69-A73 WeakPolarHBondContact O-CB 3.33Å; P69-A73 PolarHBondContact O-N 3.37Å; P69-F381 HydrophobicContact CB-CD1 3.86Å; P69-F381 HydrophobicContact CB-CE1 4.3Å; P69-F381 WeakPolarHBondContact CB-O 3.16Å; P69-F383 HydrophobicContact CB-CD1 4.45Å; P69-F383 HydrophobicContact CB-CE1 4.27Å; P69-F383 VanDerWaalsContact O-CE1 3.25Å; P69-F383 WeakPolarHBondContact O-CE1 3.45Å
70	T	98.6	Very high	98.1	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.8	-45.4	178.3	-55	0	0	0	0	111.5	M66 G67 I68 T72 A73 A74 I334 H338 L347 A350	M66-T70 HydrophobicContact CG-CG2 3.95Å; G67-T70 WeakPolarHBondContact O-CB 3.48Å; G67-T70 PolarHBondContact O-N 3.48Å; I68-T70 VanDerWaalsContact C-N 3.34Å; I68-T70 PolarHBondContact O-N 3.12Å; T70-T72 VanDerWaalsContact C-N 3.31Å; T70-T72 PolarHBondContact O-N 3.16Å; T70-A73 PolarHBondContact O-N 3.29Å; T70-A74 VanDerWaalsContact O-CB 3.26Å; T70-A74 WeakPolarHBondContact O-CB 3.46Å; T70-A74 PolarHBondContact O-N 2.77Å; T70-I334 HydrophobicContact CG2-CG2 3.83Å; T70-H338 WeakPolarHBondContact CG2-NE2 3.32Å; T70-H338 PolarHBondContact OG1-CE1 3.3Å; T70-H338 PolarHBondContact OG1-NE2 3.27Å; T70-L347 HydrophobicContact CG2-CD2 4.07Å; T70-A350 HydrophobicContact CG2-CB 4.42Å
71	V	98.6	Very high	98	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.03	10%	0.096	C	C	.	.	H	α-helix	trans	-55.3	-47.8	175.3	173.9	0	0	0	0	110.8	M66 G67 I68 A74 R75 L91 M93 F459	M66-V71 HydrophobicContact CE-CG2 4Å; M66-V71 HydrophobicContact CG-CG2 4.02Å; M66-V71 HydrophobicContact SD-CG2 4.28Å; G67-V71 PolarHBondContact O-N 2.88Å; I68-V71 PolarHBondContact O-N 2.84Å; V71-A74 PolarHBondContact O-N 3.07Å; V71-R75 PolarHBondContact O-N 3.12Å; V71-L91 HydrophobicContact CG1-CD1 3.88Å; V71-L91 WeakPolarHBondContact O-CD1 3.44Å; V71-M93 HydrophobicContact CG1-SD 4.27Å; V71-M93 HydrophobicContact CG2-SD 4.39Å; V71-F459 HydrophobicContact CG1-CZ 4.26Å
72	T	98.5	Very high	97.9	Very high	42 Å²	42	24.3 Å²	24.3	26%	0.258	12%	0.122	S	C	.	.	H	α-helix	trans	-68.9	-41.4	-178.3	-55.5	0	0	0	0	112.1	I68 P69 T70 A74 R75 I76 F383	I68-T72 PolarHBondContact O-N 3.1Å; I68-T72 VanDerWaalsContact O-N 3.08Å; I68-T72 PolarHBondContact O-OG1 3.07Å; P69-T72 PolarHBondContact O-N 3.28Å; T70-T72 VanDerWaalsContact C-N 3.31Å; T70-T72 PolarHBondContact O-N 3.16Å; T72-A74 VanDerWaalsContact C-N 3.34Å; T72-A74 PolarHBondContact O-N 3.39Å; T72-R75 WeakPolarHBondContact O-CB 3.4Å; T72-R75 PolarHBondContact O-N 3.1Å; T72-R75 PolarHBondContact OG1-NH1 3.19Å; T72-I76 HydrophobicContact CG2-CD1 4.4Å; T72-I76 WeakPolarHBondContact O-CG1 3.42Å; T72-I76 PolarHBondContact O-N 2.62Å; T72-I76 VanDerWaalsContact O-N 3.14Å; T72-F383 HydrophobicContact CG2-CE1 4.37Å; T72-F383 HydrophobicContact CG2-CE2 4.29Å; T72-F383 HydrophobicContact CG2-CZ 3.52Å
73	A	98	Very high	97.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.3	-37	177.5	0	0	0	0	0	112.2	P69 T70 I76 L77 L347 F381 F383 V393	P69-A73 WeakPolarHBondContact O-CB 3.33Å; P69-A73 PolarHBondContact O-N 3.37Å; T70-A73 PolarHBondContact O-N 3.29Å; A73-I76 PolarHBondContact O-N 2.88Å; A73-L77 WeakPolarHBondContact O-CB 3.45Å; A73-L77 PolarHBondContact O-N 3.46Å; A73-L347 HydrophobicContact CB-CD1 3.73Å; A73-L347 HydrophobicContact CB-CD2 3.62Å; A73-L347 HydrophobicContact CB-CG 4.34Å; A73-F381 HydrophobicContact CB-CE1 3.78Å; A73-F381 HydrophobicContact CB-CZ 3.96Å; A73-F383 HydrophobicContact CB-CD1 4.04Å; A73-F383 HydrophobicContact CB-CE1 4.16Å; A73-F383 HydrophobicContact CB-CG 4.49Å; A73-V393 HydrophobicContact CB-CG2 3.85Å
74	A	98.2	Very high	97.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-39.6	174.8	0	0	0	0	0	112	T70 V71 T72 I76 L77 K78 L347 A350	T70-A74 VanDerWaalsContact O-CB 3.26Å; T70-A74 WeakPolarHBondContact O-CB 3.46Å; T70-A74 PolarHBondContact O-N 2.77Å; V71-A74 PolarHBondContact O-N 3.07Å; T72-A74 VanDerWaalsContact C-N 3.34Å; T72-A74 PolarHBondContact O-N 3.39Å; A74-I76 VanDerWaalsContact C-N 3.35Å; A74-I76 PolarHBondContact O-N 3.34Å; A74-L77 PolarHBondContact O-N 3.19Å; A74-K78 WeakPolarHBondContact O-CB 3.48Å; A74-K78 PolarHBondContact O-N 2.87Å; A74-L347 HydrophobicContact CB-CD2 4.45Å; A74-A350 HydrophobicContact CB-CB 3.62Å
75	R	98.5	Very high	97.4	Very high	51 Å²	51	31.8 Å²	31.8	19%	0.192	18%	0.179	C	C	.	.	H	α-helix	trans	-56	-48.9	172.3	-175.7	-170.7	-60.7	116.9	5.9	111.5	V71 T72 K78 G79 G89 L91 D94	V71-R75 PolarHBondContact O-N 3.12Å; T72-R75 WeakPolarHBondContact O-CB 3.4Å; T72-R75 PolarHBondContact O-N 3.1Å; T72-R75 PolarHBondContact OG1-NH1 3.19Å; R75-K78 PolarHBondContact O-N 3.27Å; R75-G79 PolarHBondContact O-N 2.77Å; R75-G79 VanDerWaalsContact O-N 3.12Å; R75-G89 VanDerWaalsContact CD-O 3.24Å; R75-G89 WeakPolarHBondContact CD-O 3.07Å; R75-G89 VanDerWaalsContact CG-O 3.31Å; R75-G89 WeakPolarHBondContact CG-O 3.47Å; R75-L91 HydrophobicContact CB-CD1 4.17Å; R75-L91 HydrophobicContact CB-CD2 4.41Å; R75-L91 HydrophobicContact CB-CG 3.9Å; R75-L91 HydrophobicContact CG-CG 4.34Å; R75-D94 IonicContact CZ-OD1 3.4Å; R75-D94 IonicContact CZ-OD2 2.79Å; R75-D94 IonicContact NE-OD1 3.2Å; R75-D94 IonicContact NE-OD2 2.71Å; R75-D94 PolarHBondContact NE-OD2 3.33Å; R75-D94 IonicContact NH2-OD1 3.8Å; R75-D94 PolarHBondContact NH2-OD1 3.42Å; R75-D94 IonicContact NH2-OD2 2.75Å; R75-D94 PolarHBondContact NH2-OD2 2.9Å
76	I	97.9	Very high	97.3	Very high	16 Å²	16	31.8 Å²	31.8	8%	0.082	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-47.9	178.4	-62.1	167.8	0	0	0	110.2	T72 A73 A74 K78 G79 Q80 G86 E87 F383 V393	T72-I76 HydrophobicContact CG2-CD1 4.4Å; T72-I76 WeakPolarHBondContact O-CG1 3.42Å; T72-I76 PolarHBondContact O-N 2.62Å; T72-I76 VanDerWaalsContact O-N 3.14Å; A73-I76 PolarHBondContact O-N 2.88Å; A74-I76 VanDerWaalsContact C-N 3.35Å; A74-I76 PolarHBondContact O-N 3.34Å; I76-K78 VanDerWaalsContact C-N 3.34Å; I76-K78 PolarHBondContact O-N 3.37Å; I76-G79 PolarHBondContact O-N 2.88Å; I76-Q80 HydrophobicContact CG2-CG 4.35Å; I76-Q80 WeakPolarHBondContact O-CB 3.33Å; I76-Q80 VanDerWaalsContact O-CG 3.27Å; I76-Q80 WeakPolarHBondContact O-CG 3.41Å; I76-Q80 PolarHBondContact O-N 2.95Å; I76-G86 WeakPolarHBondContact O-CA 3.46Å; I76-E87 HydrophobicContact CD1-CG 4.2Å; I76-E87 HydrophobicContact CG1-CG 4.15Å; I76-F383 HydrophobicContact CD1-CE2 4Å; I76-V393 HydrophobicContact CB-CB 4.2Å; I76-V393 HydrophobicContact CB-CG2 4.31Å; I76-V393 HydrophobicContact CD1-CG2 4.36Å; I76-V393 HydrophobicContact CG2-CB 3.81Å; I76-V393 HydrophobicContact CG2-CG1 4.43Å; I76-V393 HydrophobicContact CG2-CG2 4.34Å
77	L	97.8	Very high	97.2	Very high	9 Å²	9	35 Å²	35	5%	0.047	19%	0.194	C	C	.	.	H	α-helix	trans	-58	-46.8	178.2	179	63	0	0	0	111.5	A73 A74 G79 Q80 L81 L347 V351 V393	A73-L77 WeakPolarHBondContact O-CB 3.45Å; A73-L77 PolarHBondContact O-N 3.46Å; A74-L77 PolarHBondContact O-N 3.19Å; L77-G79 PolarHBondContact O-N 2.92Å; L77-Q80 WeakPolarHBondContact O-CB 3.39Å; L77-Q80 PolarHBondContact O-N 3.37Å; L77-L81 HydrophobicContact CD1-CD1 4.27Å; L77-L81 HydrophobicContact CD1-CG 4.13Å; L77-L81 HydrophobicContact CG-CD1 3.97Å; L77-L81 HydrophobicContact CG-CG 4.27Å; L77-L81 VanDerWaalsContact O-CG 3.3Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.37Å; L77-L347 HydrophobicContact CD2-CB 3.47Å; L77-L347 VanDerWaalsContact CD2-CB 3.47Å; L77-V351 HydrophobicContact CB-CG2 4.49Å; L77-V351 HydrophobicContact CD2-CG2 4.1Å; L77-V351 HydrophobicContact CG-CG2 4.3Å; L77-V393 HydrophobicContact CB-CG1 3.95Å; L77-V393 HydrophobicContact CD1-CG1 4.48Å
78	K	98.3	Very high	97	Very high	28 Å²	28	37.3 Å²	37.3	12%	0.122	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-51	179.6	-173.6	-177.7	175.7	-172.4	0	111.2	A74 R75 I76 Q80 L81 E82 S90 L91 V351 D354	A74-K78 WeakPolarHBondContact O-CB 3.48Å; A74-K78 PolarHBondContact O-N 2.87Å; R75-K78 PolarHBondContact O-N 3.27Å; I76-K78 VanDerWaalsContact C-N 3.34Å; I76-K78 PolarHBondContact O-N 3.37Å; K78-Q80 VanDerWaalsContact C-N 3.29Å; K78-Q80 PolarHBondContact O-N 2.94Å; K78-L81 PolarHBondContact O-N 3.34Å; K78-L81 VanDerWaalsContact O-N 3.17Å; K78-E82 WeakPolarHBondContact CE-OE1 3.47Å; K78-E82 WeakPolarHBondContact O-CG 3.39Å; K78-E82 PolarHBondContact O-N 3.22Å; K78-E82 VanDerWaalsContact O-N 3.08Å; K78-S90 PolarHBondContact NZ-O 3.46Å; K78-L91 HydrophobicContact CB-CD2 4.27Å; K78-L91 HydrophobicContact CD-CD2 3.73Å; K78-V351 HydrophobicContact CB-CG2 4.08Å; K78-V351 HydrophobicContact CG-CG1 4.44Å; K78-D354 IonicContact NZ-OD2 2.87Å; K78-D354 PolarHBondContact NZ-OD2 2.72Å
79	G	97.8	Very high	96.7	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-33.6	178.4	0	0	0	0	0	112.8	R75 I76 L77 E82 G83 N84	R75-G79 PolarHBondContact O-N 2.77Å; R75-G79 VanDerWaalsContact O-N 3.12Å; I76-G79 PolarHBondContact O-N 2.88Å; L77-G79 PolarHBondContact O-N 2.92Å; G79-E82 CarbonylContact O-C 3.58Å; G79-E82 PolarHBondContact O-N 3.22Å; G79-G83 PolarHBondContact O-N 3.42Å; G79-N84 WeakPolarHBondContact O-CA 3.34Å; G79-N84 WeakPolarHBondContact O-CB 3.22Å; G79-N84 PolarHBondContact O-N 3Å
80	Q	96.8	Very high	96.6	Very high	37 Å²	37	36 Å²	36	17%	0.173	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-39.4	173.1	-73.1	175	-5.5	0	0	112.8	I76 L77 K78 E82 G83 S85 N391	I76-Q80 HydrophobicContact CG2-CG 4.35Å; I76-Q80 WeakPolarHBondContact O-CB 3.33Å; I76-Q80 VanDerWaalsContact O-CG 3.27Å; I76-Q80 WeakPolarHBondContact O-CG 3.41Å; I76-Q80 PolarHBondContact O-N 2.95Å; L77-Q80 WeakPolarHBondContact O-CB 3.39Å; L77-Q80 PolarHBondContact O-N 3.37Å; K78-Q80 VanDerWaalsContact C-N 3.29Å; K78-Q80 PolarHBondContact O-N 2.94Å; Q80-E82 PolarHBondContact O-N 2.77Å; Q80-G83 PolarHBondContact O-N 3.37Å; Q80-G83 VanDerWaalsContact O-N 3.07Å; Q80-S85 WeakPolarHBondContact CG-O 3.08Å; Q80-S85 PolarHBondContact NE2-O 3.01Å; Q80-N391 PolarHBondContact NE2-O 2.71Å
81	L	96.7	Very high	96.6	Very high	89 Å²	89	36.1 Å²	36.1	47%	0.466	21%	0.207	S	C	.	.	H	α-helix	trans	-66.1	-25.8	174.3	-68.4	173.1	0	0	0	112.2	L77 K78 G83 V351	L77-L81 HydrophobicContact CD1-CD1 4.27Å; L77-L81 HydrophobicContact CD1-CG 4.13Å; L77-L81 HydrophobicContact CG-CD1 3.97Å; L77-L81 HydrophobicContact CG-CG 4.27Å; L77-L81 VanDerWaalsContact O-CG 3.3Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.37Å; K78-L81 PolarHBondContact O-N 3.34Å; K78-L81 VanDerWaalsContact O-N 3.17Å; L81-G83 VanDerWaalsContact C-N 3.28Å; L81-V351 HydrophobicContact CD1-CG1 4.41Å
82	E	96.4	Very high	96.6	Very high	119 Å²	119	37.4 Å²	37.4	56%	0.556	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	0.3	173.6	-67.5	168.7	-179.2	0	0	113.1	K78 G79 Q80	K78-E82 WeakPolarHBondContact CE-OE1 3.47Å; K78-E82 WeakPolarHBondContact O-CG 3.39Å; K78-E82 PolarHBondContact O-N 3.22Å; K78-E82 VanDerWaalsContact O-N 3.08Å; G79-E82 CarbonylContact O-C 3.58Å; G79-E82 PolarHBondContact O-N 3.22Å; Q80-E82 PolarHBondContact O-N 2.77Å
83	G	94.4	Very high	96.6	Very high	69 Å²	69	35.5 Å²	35.5	71%	0.711	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	7.4	178.4	0	0	0	0	0	115.1	G79 Q80 L81	G79-G83 PolarHBondContact O-N 3.42Å; Q80-G83 PolarHBondContact O-N 3.37Å; Q80-G83 VanDerWaalsContact O-N 3.07Å; L81-G83 VanDerWaalsContact C-N 3.28Å
84	N	94.6	Very high	96.6	Very high	85 Å²	85	37.6 Å²	37.6	46%	0.455	21%	0.213	S	C	.	.	S	Bend	trans	-91.9	179.8	174.9	-55.7	-56.1	0	0	0	111.5	G79 G86 E88	G79-N84 WeakPolarHBondContact O-CA 3.34Å; G79-N84 WeakPolarHBondContact O-CB 3.22Å; G79-N84 PolarHBondContact O-N 3Å; N84-G86 VanDerWaalsContact C-N 3.32Å; N84-E88 WeakPolarHBondContact CB-OE1 3.33Å
85	S	94.4	Very high	96.5	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.021	24%	0.24	C	C	.	.			trans	-66.3	-35.7	174.4	28.4	0	0	0	0	112.5	C23 Q80 E87 E88 R389 G390	C23-S85 VanDerWaalsContact SG-CB 3.58Å; Q80-S85 WeakPolarHBondContact CG-O 3.08Å; Q80-S85 PolarHBondContact NE2-O 3.01Å; S85-E87 VanDerWaalsContact C-OE2 3.25Å; S85-E87 WeakPolarHBondContact CB-OE2 3.41Å; S85-E87 VanDerWaalsContact O-OE2 3.1Å; S85-E88 PolarHBondContact OG-OE1 3.45Å; S85-E88 PolarHBondContact OG-OE2 2.83Å; S85-R389 PolarHBondContact OG-NH1 2.93Å; S85-R389 VanDerWaalsContact OG-NH1 3.08Å; S85-R389 PolarHBondContact OG-NH2 2.75Å; S85-G390 WeakPolarHBondContact O-CA 2.87Å
86	G	95.4	Very high	96.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	110.7	-45.2	174.8	0	0	0	0	0	113.5	I76 N84 E88 G89	I76-G86 WeakPolarHBondContact O-CA 3.46Å; N84-G86 VanDerWaalsContact C-N 3.32Å; G86-E88 PolarHBondContact N-OE1 3.3Å; G86-E88 PolarHBondContact N-OE2 3.46Å; G86-E88 PolarHBondContact O-N 3.24Å; G86-G89 PolarHBondContact O-N 3.49Å
87	E	94.9	Very high	96.5	Very high	73 Å²	73	42.6 Å²	42.6	34%	0.341	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.4	-171.7	-61.3	87.9	160.4	0	0	114	I76 S85 R389 G390	I76-E87 HydrophobicContact CD1-CG 4.2Å; I76-E87 HydrophobicContact CG1-CG 4.15Å; S85-E87 VanDerWaalsContact C-OE2 3.25Å; S85-E87 WeakPolarHBondContact CB-OE2 3.41Å; S85-E87 VanDerWaalsContact O-OE2 3.1Å; E87-R389 HydrophobicContact CG-CG 4.46Å; E87-R389 WeakPolarHBondContact OE1-CA 3.46Å; E87-R389 VanDerWaalsContact OE2-CG 3.26Å; E87-R389 WeakPolarHBondContact OE2-CG 3.39Å; E87-R389 IonicContact OE2-NE 3.62Å; E87-G390 PolarHBondContact OE1-N 2.79Å; E87-G390 PolarHBondContact OE2-N 2.75Å
88	E	93.9	Very high	96.5	Very high	48 Å²	48	43.6 Å²	43.6	22%	0.224	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.7	175.3	72.7	-58.2	151.1	0	0	114.9	N84 S85 G86 R389	N84-E88 WeakPolarHBondContact CB-OE1 3.33Å; S85-E88 PolarHBondContact OG-OE1 3.45Å; S85-E88 PolarHBondContact OG-OE2 2.83Å; G86-E88 PolarHBondContact N-OE1 3.3Å; G86-E88 PolarHBondContact N-OE2 3.46Å; G86-E88 PolarHBondContact O-N 3.24Å; E88-R389 VanDerWaalsContact CB-NH2 3.29Å; E88-R389 VanDerWaalsContact CD-NH2 3.33Å; E88-R389 IonicContact OE2-CZ 3.49Å; E88-R389 VanDerWaalsContact OE2-CZ 3.26Å; E88-R389 IonicContact OE2-NE 2.8Å; E88-R389 IonicContact OE2-NH2 3.31Å; E88-R389 PolarHBondContact OE2-NH2 2.83Å
89	G	93.2	Very high	96.5	Very high	19 Å²	19	46.8 Å²	46.8	20%	0.196	27%	0.273	C	S	.	.			trans	-62.8	168.3	179.8	0	0	0	0	0	111.9	R75 G86	R75-G89 VanDerWaalsContact CD-O 3.24Å; R75-G89 WeakPolarHBondContact CD-O 3.07Å; R75-G89 VanDerWaalsContact CG-O 3.31Å; R75-G89 WeakPolarHBondContact CG-O 3.47Å; G86-G89 PolarHBondContact O-N 3.49Å
90	S	96.2	Very high	96.6	Very high	62 Å²	62	46.8 Å²	46.8	43%	0.434	27%	0.273	S	S	.	.			trans	-129.8	131.6	176.5	-169.5	0	0	0	0	109.4	K78 D94	K78-S90 PolarHBondContact NZ-O 3.46Å; S90-D94 WeakPolarHBondContact OG-CB 3.44Å
91	L	98.4	Very high	96.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	28%	0.278	C	S	.	.			trans	-69.6	159.8	158.7	-62.4	177.5	0	0	0	109	V71 R75 K78 M93 D94 D354	V71-L91 HydrophobicContact CG1-CD1 3.88Å; V71-L91 WeakPolarHBondContact O-CD1 3.44Å; R75-L91 HydrophobicContact CB-CD1 4.17Å; R75-L91 HydrophobicContact CB-CD2 4.41Å; R75-L91 HydrophobicContact CB-CG 3.9Å; R75-L91 HydrophobicContact CG-CG 4.34Å; K78-L91 HydrophobicContact CB-CD2 4.27Å; K78-L91 HydrophobicContact CD-CD2 3.73Å; L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 HydrophobicContact CB-CG 3.81Å; L91-M93 HydrophobicContact CD1-CE 4.34Å; L91-M93 HydrophobicContact CD1-CG 4.11Å; L91-M93 HydrophobicContact CD1-SD 4.04Å; L91-D94 HydrophobicContact CB-CB 4.46Å; L91-D94 WeakPolarHBondContact CB-OD2 3.17Å; L91-D94 PolarHBondContact N-OD2 3.36Å; L91-D94 WeakPolarHBondContact O-CB 3.22Å; L91-D94 PolarHBondContact O-N 3.46Å; L91-D354 WeakPolarHBondContact CA-OD2 3.03Å; L91-D354 WeakPolarHBondContact CB-OD1 3.31Å; L91-D354 HydrophobicContact CD2-CB 4.06Å
92	V	98.4	Very high	96.8	Very high	32 Å²	32	43.4 Å²	43.4	19%	0.194	26%	0.256	C	S	.	.	S	Bend	trans	-63.6	-41.5	171	-179.8	0	0	0	0	109.5	D94 T95 F96 D354 I357	V92-D94 PolarHBondContact O-N 3.3Å; V92-T95 WeakPolarHBondContact O-CB 3.48Å; V92-T95 PolarHBondContact O-N 3.41Å; V92-T95 PolarHBondContact O-OG1 3.23Å; V92-F96 HydrophobicContact CG1-CE1 4.38Å; V92-D354 WeakPolarHBondContact CA-OD1 3.46Å; V92-D354 WeakPolarHBondContact CB-OD1 3.43Å; V92-D354 PolarHBondContact N-OD1 3.22Å; V92-D354 PolarHBondContact N-OD2 2.89Å; V92-I357 HydrophobicContact CB-CG2 4.24Å; V92-I357 HydrophobicContact CG1-CG2 3.85Å
93	M	97.6	Very high	96.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.8	-27.4	177.2	67.6	-175.7	73.5	0	0	113.4	M66 V71 L91 T95 F96 F353 D354 I357 V373 F459	M66-M93 HydrophobicContact CE-CE 3.88Å; M66-M93 HydrophobicContact CE-SD 3.82Å; M66-M93 HydrophobicContact SD-CE 3.99Å; M66-M93 HydrophobicContact SD-SD 4.41Å; V71-M93 HydrophobicContact CG1-SD 4.27Å; V71-M93 HydrophobicContact CG2-SD 4.39Å; L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 HydrophobicContact CB-CG 3.81Å; L91-M93 HydrophobicContact CD1-CE 4.34Å; L91-M93 HydrophobicContact CD1-CG 4.11Å; L91-M93 HydrophobicContact CD1-SD 4.04Å; M93-T95 PolarHBondContact O-N 2.94Å; M93-F96 WeakPolarHBondContact O-CB 3.2Å; M93-F96 PolarHBondContact O-N 3.47Å; M93-F353 HydrophobicContact CE-CD1 3.92Å; M93-F353 HydrophobicContact CE-CE1 4.03Å; M93-D354 HydrophobicContact CE-CB 4.27Å; M93-D354 PolarHBondContact N-OD1 3.01Å; M93-I357 HydrophobicContact CB-CD1 4.39Å; M93-I357 HydrophobicContact CE-CD1 3.61Å; M93-V373 HydrophobicContact CB-CB 4.41Å; M93-V373 HydrophobicContact CB-CG1 4.2Å; M93-V373 HydrophobicContact CB-CG2 4.3Å; M93-V373 HydrophobicContact CE-CG1 4.14Å; M93-V373 HydrophobicContact SD-CG1 4.2Å; M93-F459 HydrophobicContact CB-CD2 4.31Å; M93-F459 HydrophobicContact CB-CG 4.27Å; M93-F459 HydrophobicContact CG-CD2 4.46Å; M93-F459 HydrophobicContact CG-CE2 4.39Å; M93-F459 VanDerWaalsContact O-CD1 3.29Å; M93-F459 WeakPolarHBondContact O-CD1 3.49Å; M93-F459 HydrophobicContact SD-CD2 4.35Å; M93-F459 HydrophobicContact SD-CE2 4.02Å
94	D	98	Very high	97.1	Very high	44 Å²	44	37.7 Å²	37.7	24%	0.235	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-67	-20.3	175.8	-64.4	-31.5	0	0	0	112.8	R75 S90 L91 V92 F96	R75-D94 IonicContact CZ-OD1 3.4Å; R75-D94 IonicContact CZ-OD2 2.79Å; R75-D94 IonicContact NE-OD1 3.2Å; R75-D94 IonicContact NE-OD2 2.71Å; R75-D94 PolarHBondContact NE-OD2 3.33Å; R75-D94 IonicContact NH2-OD1 3.8Å; R75-D94 PolarHBondContact NH2-OD1 3.42Å; R75-D94 IonicContact NH2-OD2 2.75Å; R75-D94 PolarHBondContact NH2-OD2 2.9Å; S90-D94 WeakPolarHBondContact OG-CB 3.44Å; L91-D94 HydrophobicContact CB-CB 4.46Å; L91-D94 WeakPolarHBondContact CB-OD2 3.17Å; L91-D94 PolarHBondContact N-OD2 3.36Å; L91-D94 WeakPolarHBondContact O-CB 3.22Å; L91-D94 PolarHBondContact O-N 3.46Å; V92-D94 PolarHBondContact O-N 3.3Å; D94-F96 VanDerWaalsContact C-N 3.28Å
95	T	97.1	Very high	97.3	Very high	91 Å²	91	38.5 Å²	38.5	56%	0.558	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-82.8	-6	-179.5	71.1	0	0	0	0	113.1	V92 M93	V92-T95 WeakPolarHBondContact O-CB 3.48Å; V92-T95 PolarHBondContact O-N 3.41Å; V92-T95 PolarHBondContact O-OG1 3.23Å; M93-T95 PolarHBondContact O-N 2.94Å
96	F	98.1	Very high	97.5	Very high	13 Å²	13	38.5 Å²	38.5	6%	0.057	21%	0.207	C	C	.	.			trans	-72.5	132.3	-177.9	-77.7	37.2	0	0	0	109.5	V92 M93 D94 H98 I357 T371 V373 F459 A460 K461	V92-F96 HydrophobicContact CG1-CE1 4.38Å; M93-F96 WeakPolarHBondContact O-CB 3.2Å; M93-F96 PolarHBondContact O-N 3.47Å; D94-F96 VanDerWaalsContact C-N 3.28Å; F96-H98 VanDerWaalsContact C-N 3.27Å; F96-H98 PolarHBondContact O-N 2.93Å; F96-I357 HydrophobicContact CE1-CG2 4.06Å; F96-I357 HydrophobicContact CZ-CG2 3.87Å; F96-T371 HydrophobicContact CE2-CG2 3.8Å; F96-T371 HydrophobicContact CZ-CG2 3.85Å; F96-V373 HydrophobicContact CD2-CG2 4.49Å; F96-V373 HydrophobicContact CE2-CG2 3.78Å; F96-V373 HydrophobicContact CZ-CG2 3.99Å; F96-F459 HydrophobicContact CB-CB 4Å; F96-F459 HydrophobicContact CD2-CB 4.04Å; F96-F459 HydrophobicContact CG-CB 4.23Å; F96-A460 VanDerWaalsContact CD2-C 3.49Å; F96-K461 HydrophobicContact CB-CB 4.47Å; F96-K461 HydrophobicContact CD1-CD 3.88Å; F96-K461 HydrophobicContact CD1-CG 4.39Å; F96-K461 HydrophobicContact CD2-CB 3.89Å; F96-K461 HydrophobicContact CD2-CD 4.21Å; F96-K461 HydrophobicContact CD2-CG 3.82Å; F96-K461 HydrophobicContact CE1-CD 3.65Å; F96-K461 HydrophobicContact CE1-CG 4.26Å; F96-K461 HydrophobicContact CE2-CB 4.26Å; F96-K461 HydrophobicContact CE2-CD 3.99Å; F96-K461 HydrophobicContact CE2-CG 3.67Å; F96-K461 HydrophobicContact CG-CB 4.07Å; F96-K461 HydrophobicContact CG-CD 4.17Å; F96-K461 HydrophobicContact CG-CG 4.19Å; F96-K461 HydrophobicContact CZ-CD 3.71Å; F96-K461 HydrophobicContact CZ-CG 3.9Å
97	P	97.6	Very high	97.6	Very high	69 Å²	69	42.3 Å²	42.3	45%	0.448	23%	0.23	S	C	.	.	S	Bend	trans	-75	-13.5	-169.3	28.6	-34.4	0	0	0	114.3	V48 A460 K461	V48-P97 HydrophobicContact CG1-CB 4.2Å; V48-P97 HydrophobicContact CG2-CB 4.2Å; P97-A460 WeakPolarHBondContact CD-O 3.24Å; P97-K461 HydrophobicContact CG-CB 4.38Å
98	H	98.6	Very high	97.8	Very high	30 Å²	30	42.4 Å²	42.4	14%	0.139	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.9	-176.9	-56.5	-62.5	0	0	0	111.5	F96 F459 A460 S465 H466	F96-H98 VanDerWaalsContact C-N 3.27Å; F96-H98 PolarHBondContact O-N 2.93Å; H98-F459 WeakPolarHBondContact O-CA 3.3Å; H98-A460 HydrophobicContact CB-CB 4.42Å; H98-A460 PolarHBondContact N-O 3.09Å; H98-A460 PolarHBondContact O-N 3.1Å; H98-S465 VanDerWaalsContact CB-O 3.32Å; H98-S465 WeakPolarHBondContact CB-O 3.19Å; H98-S465 VanDerWaalsContact CD2-C 3.4Å; H98-S465 PolarHBondContact CD2-OG 2.87Å; H98-H466 PolarHBondContact CD2-N 2.94Å
99	L	98.1	Very high	98	Very high	96 Å²	96	44.4 Å²	44.4	50%	0.503	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.2	-176.8	-175.7	146.4	0	0	0	110.6	I458 F459	L99-I458 CarbonylContact C-O 3.56Å; L99-I458 VanDerWaalsContact CA-O 3.23Å; L99-I458 WeakPolarHBondContact CA-O 3.29Å; L99-F459 HydrophobicContact CD1-CD1 3.94Å; L99-F459 HydrophobicContact CD1-CE1 3.61Å; L99-F459 HydrophobicContact CD1-CZ 4.35Å
100	A	98.8	Very high	98.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	164.5	169.8	0	0	0	0	0	110.9	I458 F468 G470	A100-I458 HydrophobicContact CB-CB 4.33Å; A100-I458 HydrophobicContact CB-CD1 4.29Å; A100-I458 PolarHBondContact N-O 3.34Å; A100-I458 PolarHBondContact O-N 3.3Å; A100-F468 HydrophobicContact CB-CB 4.41Å; A100-G470 CarbonylContact C-O 3.52Å; A100-G470 WeakPolarHBondContact CA-O 3.47Å; A100-G470 WeakPolarHBondContact CB-O 3.3Å
101	L	98.9	Very high	98.2	Very high	54 Å²	54	50.7 Å²	50.7	28%	0.283	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	145.2	166.1	-66.9	178.5	0	0	0	110.2	I68 D455 V456 G470 V471 Q472	I68-L101 HydrophobicContact CD1-CD2 3.91Å; L101-D455 HydrophobicContact CB-CB 4.05Å; L101-D455 HydrophobicContact CD2-CB 4.45Å; L101-V456 CarbonylContact C-O 3.58Å; L101-V456 WeakPolarHBondContact CA-O 3.41Å; L101-G470 PolarHBondContact N-O 3.38Å; L101-V471 HydrophobicContact CB-CB 4.49Å; L101-V471 HydrophobicContact CB-CG1 4.26Å; L101-V471 HydrophobicContact CB-CG2 4.19Å; L101-V471 HydrophobicContact CD1-CG2 4.27Å; L101-V471 WeakPolarHBondContact O-CA 3.48Å; L101-Q472 PolarHBondContact O-N 3.28Å
102	S	98.9	Very high	98.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	119.9	-176.6	-179.7	0	0	0	0	110.2	T104 D455 V456 Q472 Q474	S102-T104 WeakPolarHBondContact O-CG2 3.32Å; S102-D455 VanDerWaalsContact O-CA 3.25Å; S102-D455 WeakPolarHBondContact O-CA 3.39Å; S102-V456 PolarHBondContact N-O 3.12Å; S102-V456 PolarHBondContact O-N 3.17Å; S102-Q472 WeakPolarHBondContact CA-O 3.26Å; S102-Q474 VanDerWaalsContact OG-CA 3.26Å; S102-Q474 WeakPolarHBondContact OG-CA 3.48Å; S102-Q474 VanDerWaalsContact OG-CB 3.29Å; S102-Q474 WeakPolarHBondContact OG-CB 3.5Å
103	K	98.9	Very high	98.1	Very high	67 Å²	67	49 Å²	49	29%	0.291	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.5	177.4	-59.9	-179.2	-61.6	172.6	0	110.5	Y105 K126 V471 Q472 E473 Q474	K103-Y105 HydrophobicContact CB-CD1 4.19Å; K103-Y105 HydrophobicContact CB-CE1 4.18Å; K103-K126 PolarHBondContact O-NZ 2.81Å; K103-V471 HydrophobicContact CD-CG1 4.01Å; K103-V471 HydrophobicContact CG-CG1 3.85Å; K103-Q472 PolarHBondContact N-O 3.31Å; K103-E473 WeakPolarHBondContact CE-OE1 3.5Å; K103-E473 IonicContact NZ-OE1 3.11Å; K103-E473 PolarHBondContact NZ-OE1 3.03Å; K103-Q474 WeakPolarHBondContact O-CB 3.47Å; K103-Q474 PolarHBondContact O-N 2.91Å
104	T	98.7	Very high	98.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.251	C	S	.	.			trans	-96.7	-11.2	-162.1	58.4	0	0	0	0	115.4	S102 N106 P112 D376 V456	S102-T104 WeakPolarHBondContact O-CG2 3.32Å; T104-N106 PolarHBondContact O-N 2.86Å; T104-P112 VanDerWaalsContact O-CB 3.29Å; T104-P112 WeakPolarHBondContact O-CB 3.47Å; T104-P112 WeakPolarHBondContact O-CG 3.33Å; T104-D376 WeakPolarHBondContact CB-O 3.3Å; T104-D376 VanDerWaalsContact CG2-O 3.26Å; T104-D376 WeakPolarHBondContact CG2-O 3.44Å; T104-V456 HydrophobicContact CG2-CB 4.4Å; T104-V456 HydrophobicContact CG2-CG1 4.03Å; T104-V456 HydrophobicContact CG2-CG2 3.65Å
105	Y	98.8	Very high	98.1	Very high	103 Å²	103	47 Å²	47	40%	0.404	24%	0.24	S	C	.	.			trans	-47.6	136.6	-178.5	72.8	-87.1	0	0	0	113	K103 K126 E473	K103-Y105 HydrophobicContact CB-CD1 4.19Å; K103-Y105 HydrophobicContact CB-CE1 4.18Å; Y105-K126 HydrophobicContact CE2-CD 4.14Å; Y105-K126 VanDerWaalsContact CZ-NZ 3.3Å; Y105-K126 WeakPolarHBondContact O-CD 3.36Å; Y105-K126 VanDerWaalsContact O-CE 3.29Å; Y105-K126 WeakPolarHBondContact O-CE 3.49Å; Y105-K126 PolarHBondContact O-NZ 3.35Å; Y105-E473 WeakPolarHBondContact CE1-OE2 3.33Å; Y105-E473 PolarHBondContact OH-OE1 3.17Å; Y105-E473 VanDerWaalsContact OH-OE1 3.07Å; Y105-E473 PolarHBondContact OH-OE2 2.59Å
106	N	98.8	Very high	98.1	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.016	21%	0.213	C	C	.	.			trans	-79.2	164.8	167.9	-66.2	154.8	0	0	0	109.9	T104 D108 Q109 P112 D113 G116 T117 A127	T104-N106 PolarHBondContact O-N 2.86Å; N106-D108 PolarHBondContact O-N 3.06Å; N106-Q109 HydrophobicContact CB-CB 4.37Å; N106-Q109 PolarHBondContact N-O 3.36Å; N106-Q109 PolarHBondContact O-N 3.24Å; N106-Q109 VanDerWaalsContact O-O 3.06Å; N106-P112 HydrophobicContact CB-CB 4.48Å; N106-P112 WeakPolarHBondContact ND2-CB 3.23Å; N106-P112 WeakPolarHBondContact OD1-CA 3.18Å; N106-P112 WeakPolarHBondContact OD1-CB 3.37Å; N106-D113 PolarHBondContact OD1-N 3.04Å; N106-D113 PolarHBondContact OD1-OD1 3.02Å; N106-G116 VanDerWaalsContact ND2-C 3.25Å; N106-G116 WeakPolarHBondContact ND2-CA 3.32Å; N106-T117 PolarHBondContact ND2-N 2.92Å; N106-A127 WeakPolarHBondContact CB-O 3.44Å
107	V	98.8	Very high	98.2	Very high	80 Å²	80	42 Å²	42	49%	0.485	21%	0.211	S	C	.	.	S	Bend	trans	-60.7	-35.7	-176.3	176.2	0	0	0	0	112	K126 A127 A136	V107-K126 HydrophobicContact CG2-CB 3.7Å; V107-A127 PolarHBondContact N-O 2.76Å; V107-A136 HydrophobicContact CB-CB 3.7Å; V107-A136 HydrophobicContact CG1-CB 3.71Å; V107-A136 HydrophobicContact CG2-CB 3.68Å
108	D	98.4	Very high	98.2	Very high	75 Å²	75	38.8 Å²	38.8	40%	0.401	19%	0.189	S	C	.	.	S	Bend	trans	-105.3	-9.3	-176.8	67.7	-30.3	0	0	0	114.4	N106 N128 Y129	N106-D108 PolarHBondContact O-N 3.06Å; D108-N128 VanDerWaalsContact OD1-CA 3.28Å; D108-N128 WeakPolarHBondContact OD1-CA 3.46Å; D108-Y129 PolarHBondContact OD1-N 3.45Å
109	Q	97.5	Very high	98.2	Very high	90 Å²	90	37.3 Å²	37.3	42%	0.421	18%	0.183	S	C	.	.			trans	-135.8	134.7	-177.2	-62.4	-65.9	-20.1	0	0	113.1	N106 M111 Y129	N106-Q109 HydrophobicContact CB-CB 4.37Å; N106-Q109 PolarHBondContact N-O 3.36Å; N106-Q109 PolarHBondContact O-N 3.24Å; N106-Q109 VanDerWaalsContact O-O 3.06Å; Q109-M111 VanDerWaalsContact CB-O 3.3Å; Q109-M111 WeakPolarHBondContact CB-O 3.28Å; Q109-Y129 HydrophobicContact CB-CD2 4.31Å; Q109-Y129 HydrophobicContact CG-CD2 3.88Å; Q109-Y129 HydrophobicContact CG-CG 3.96Å
110	Q	97	Very high	98.3	Very high	151 Å²	151	32.8 Å²	32.8	71%	0.706	16%	0.159	S	C	*	.	S	Bend	trans	-70.7	-41.5	170.9	-68.8	176.5	49.1	0	0	111.7	P112	Q110-P112 VanDerWaalsContact O-CD 3.26Å; Q110-P112 WeakPolarHBondContact O-CD 3.4Å
111	M	97	Very high	98.3	Very high	61 Å²	61	32.8 Å²	32.8	30%	0.3	16%	0.159	S	C	.	.	S	Bend	trans	-87.6	104.7	169.7	-176	-169.6	80.4	0	0	107.7	Q109 T450 H451 I453	Q109-M111 VanDerWaalsContact CB-O 3.3Å; Q109-M111 WeakPolarHBondContact CB-O 3.28Å; M111-T450 HydrophobicContact SD-CG2 4.44Å; M111-H451 HydrophobicContact CG-CB 3.88Å; M111-H451 HydrophobicContact SD-CB 4.32Å; M111-I453 HydrophobicContact CB-CG2 3.64Å; M111-I453 HydrophobicContact CG-CG2 4.05Å
112	P	97.3	Very high	98.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.			trans	-74	167.8	-178.2	34.1	-38	0	0	0	111.7	T104 N106 Q110 T117 H377 H451	T104-P112 VanDerWaalsContact O-CB 3.29Å; T104-P112 WeakPolarHBondContact O-CB 3.47Å; T104-P112 WeakPolarHBondContact O-CG 3.33Å; N106-P112 HydrophobicContact CB-CB 4.48Å; N106-P112 WeakPolarHBondContact ND2-CB 3.23Å; N106-P112 WeakPolarHBondContact OD1-CA 3.18Å; N106-P112 WeakPolarHBondContact OD1-CB 3.37Å; Q110-P112 VanDerWaalsContact O-CD 3.26Å; Q110-P112 WeakPolarHBondContact O-CD 3.4Å; P112-T117 HydrophobicContact CB-CG2 3.49Å; P112-T117 VanDerWaalsContact CB-CG2 3.49Å; P112-T117 HydrophobicContact CG-CG2 3.93Å; P112-H377 HydrophobicContact CG-CB 3.74Å; P112-H451 PolarHBondContact O-ND1 2.69Å
113	D	97.1	Very high	98.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.			trans	-109.1	171.6	157.4	79	-44.6	0	0	0	112.3	N106 A115 G116 T117 Y129 G130 R188	N106-D113 PolarHBondContact OD1-N 3.04Å; N106-D113 PolarHBondContact OD1-OD1 3.02Å; D113-A115 VanDerWaalsContact C-N 3.25Å; D113-A115 PolarHBondContact O-N 3.04Å; D113-A115 WeakPolarHBondContact OD2-CB 3.48Å; D113-A115 PolarHBondContact OD2-N 3.14Å; D113-A115 VanDerWaalsContact OD2-N 3.09Å; D113-G116 PolarHBondContact OD1-N 2.75Å; D113-T117 WeakPolarHBondContact O-CB 3.4Å; D113-T117 VanDerWaalsContact O-CG2 3.31Å; D113-T117 WeakPolarHBondContact O-CG2 3.37Å; D113-T117 PolarHBondContact O-N 2.86Å; D113-T117 PolarHBondContact O-OG1 3.39Å; D113-Y129 HydrophobicContact CB-CD2 3.68Å; D113-Y129 HydrophobicContact CB-CE1 4.41Å; D113-Y129 HydrophobicContact CB-CE2 3.46Å; D113-Y129 VanDerWaalsContact CB-CE2 3.46Å; D113-Y129 HydrophobicContact CB-CG 4.28Å; D113-Y129 VanDerWaalsContact OD1-CA 3.31Å; D113-Y129 WeakPolarHBondContact OD1-CA 3.47Å; D113-G130 PolarHBondContact OD1-N 2.93Å; D113-G130 WeakPolarHBondContact OD2-CA 3.48Å; D113-G130 PolarHBondContact OD2-N 3.28Å; D113-G130 VanDerWaalsContact OD2-N 3.14Å; D113-R188 VanDerWaalsContact OD2-CD 3.31Å; D113-R188 WeakPolarHBondContact OD2-CD 3.34Å; D113-R188 IonicContact OD2-CZ 3.39Å; D113-R188 IonicContact OD2-NE 3.59Å; D113-R188 IonicContact OD2-NH1 2.72Å; D113-R188 PolarHBondContact OD2-NH1 3.05Å
114	S	97	Very high	98.3	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.014	13%	0.133	C	C	.	.	H	α-helix	trans	-59.8	-29.1	175.6	-15.6	0	0	0	0	113.3	T117 A118 R188 D376	S114-T117 VanDerWaalsContact C-OG1 3.3Å; S114-T117 VanDerWaalsContact CA-OG1 3.23Å; S114-T117 WeakPolarHBondContact CA-OG1 3.31Å; S114-T117 PolarHBondContact O-OG1 3.36Å; S114-T117 VanDerWaalsContact O-OG1 3.05Å; S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.48Å; S114-R188 PolarHBondContact OG-NH1 3.02Å; S114-R188 PolarHBondContact OG-NH2 3.47Å; S114-D376 WeakPolarHBondContact CB-OD2 3.45Å
115	A	98.1	Very high	98.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-74.4	-50.2	-178	0	0	0	0	0	112.8	D113 T117 A118 T119 T131 L132 A176 R188	D113-A115 VanDerWaalsContact C-N 3.25Å; D113-A115 PolarHBondContact O-N 3.04Å; D113-A115 WeakPolarHBondContact OD2-CB 3.48Å; D113-A115 PolarHBondContact OD2-N 3.14Å; D113-A115 VanDerWaalsContact OD2-N 3.09Å; A115-T117 VanDerWaalsContact C-N 3.29Å; A115-T117 PolarHBondContact O-N 2.73Å; A115-A118 PolarHBondContact O-N 2.91Å; A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 VanDerWaalsContact O-N 3.12Å; A115-T119 PolarHBondContact O-OG1 3.24Å; A115-T119 VanDerWaalsContact O-OG1 3.1Å; A115-T131 CarbonylContact C-O 3.59Å; A115-T131 VanDerWaalsContact CB-O 3.3Å; A115-T131 WeakPolarHBondContact CB-O 3.37Å; A115-T131 VanDerWaalsContact O-O 3.13Å; A115-L132 HydrophobicContact CB-CB 4.2Å; A115-A176 HydrophobicContact CB-CB 3.81Å; A115-R188 HydrophobicContact CB-CB 3.86Å; A115-R188 HydrophobicContact CB-CG 4.39Å
116	G	98.6	Very high	98.3	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.5	-36.5	178.5	0	0	0	0	0	112.2	N106 D113 A120 T131	N106-G116 VanDerWaalsContact ND2-C 3.25Å; N106-G116 WeakPolarHBondContact ND2-CA 3.32Å; D113-G116 PolarHBondContact OD1-N 2.75Å; G116-A120 PolarHBondContact O-N 3.21Å; G116-T131 PolarHBondContact N-O 3.34Å
117	T	98.8	Very high	98.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-71.7	-40.3	176.1	50.6	0	0	0	0	112.1	N106 P112 D113 S114 A115 T119 A120 Y121 D376 Q474	N106-T117 PolarHBondContact ND2-N 2.92Å; P112-T117 HydrophobicContact CB-CG2 3.49Å; P112-T117 VanDerWaalsContact CB-CG2 3.49Å; P112-T117 HydrophobicContact CG-CG2 3.93Å; D113-T117 WeakPolarHBondContact O-CB 3.4Å; D113-T117 VanDerWaalsContact O-CG2 3.31Å; D113-T117 WeakPolarHBondContact O-CG2 3.37Å; D113-T117 PolarHBondContact O-N 2.86Å; D113-T117 PolarHBondContact O-OG1 3.39Å; S114-T117 VanDerWaalsContact C-OG1 3.3Å; S114-T117 VanDerWaalsContact CA-OG1 3.23Å; S114-T117 WeakPolarHBondContact CA-OG1 3.31Å; S114-T117 PolarHBondContact O-OG1 3.36Å; S114-T117 VanDerWaalsContact O-OG1 3.05Å; A115-T117 VanDerWaalsContact C-N 3.29Å; A115-T117 PolarHBondContact O-N 2.73Å; T117-T119 VanDerWaalsContact C-N 3.27Å; T117-T119 PolarHBondContact O-N 3.15Å; T117-A120 CarbonylContact O-C 3.34Å; T117-A120 WeakPolarHBondContact O-CA 3.21Å; T117-A120 VanDerWaalsContact O-CB 3.23Å; T117-A120 WeakPolarHBondContact O-CB 3.3Å; T117-A120 PolarHBondContact O-N 3.15Å; T117-Y121 VanDerWaalsContact C-CD1 3.45Å; T117-Y121 VanDerWaalsContact C-CE1 3.48Å; T117-Y121 WeakPolarHBondContact O-CD1 3.31Å; T117-Y121 WeakPolarHBondContact O-CE1 3.35Å; T117-Y121 PolarHBondContact O-N 3.4Å; T117-D376 WeakPolarHBondContact CG2-O 3.3Å; T117-Q474 VanDerWaalsContact CA-OE1 3.3Å; T117-Q474 VanDerWaalsContact CG2-OE1 3.28Å; T117-Q474 PolarHBondContact O-OE1 3.25Å
118	A	98.7	Very high	98.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59	-39.6	174.9	0	0	0	0	0	112.5	S114 A115 A120 Y121 L122 A180	S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.48Å; A115-A118 PolarHBondContact O-N 2.91Å; A118-A120 VanDerWaalsContact C-N 3.26Å; A118-A120 PolarHBondContact O-N 3.48Å; A118-Y121 HydrophobicContact CB-CE1 3.98Å; A118-Y121 HydrophobicContact CB-CE2 4.36Å; A118-Y121 WeakPolarHBondContact CB-OH 3.29Å; A118-Y121 PolarHBondContact O-N 2.77Å; A118-L122 HydrophobicContact CB-CD1 4.28Å; A118-L122 WeakPolarHBondContact O-CB 3.44Å; A118-L122 PolarHBondContact O-N 2.94Å; A118-A180 HydrophobicContact CB-CB 3.47Å; A118-A180 VanDerWaalsContact CB-CB 3.47Å
119	T	98.9	Very high	98.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-61.1	-37.9	171.7	-50.3	0	0	0	0	111.8	A115 T117 C123 G124 V125 A127 L132 G133 V151	A115-T119 PolarHBondContact O-N 3.31Å; A115-T119 VanDerWaalsContact O-N 3.12Å; A115-T119 PolarHBondContact O-OG1 3.24Å; A115-T119 VanDerWaalsContact O-OG1 3.1Å; T117-T119 VanDerWaalsContact C-N 3.27Å; T117-T119 PolarHBondContact O-N 3.15Å; T119-C123 HydrophobicContact CG2-CB 4.21Å; T119-C123 WeakPolarHBondContact O-CA 3.17Å; T119-C123 WeakPolarHBondContact O-CB 3.24Å; T119-C123 PolarHBondContact O-N 2.84Å; T119-G124 PolarHBondContact O-N 3Å; T119-V125 CarbonylContact C-O 3.5Å; T119-V125 WeakPolarHBondContact CG2-O 3.29Å; T119-A127 HydrophobicContact CG2-CB 3.84Å; T119-L132 WeakPolarHBondContact OG1-CA 3.45Å; T119-G133 PolarHBondContact OG1-N 2.99Å; T119-V151 HydrophobicContact CG2-CG2 3.46Å; T119-V151 VanDerWaalsContact CG2-CG2 3.46Å
120	A	98.9	Very high	98.3	Very high	1 Å²	1	19 Å²	19	1%	0.008	9%	0.092	C	C	.	.	I	π-helix	trans	-64.7	-59.6	175.1	0	0	0	0	0	111.6	G116 T117 A118 L122 G124 V125 K126 Q474 N475 P478	G116-A120 PolarHBondContact O-N 3.21Å; T117-A120 CarbonylContact O-C 3.34Å; T117-A120 WeakPolarHBondContact O-CA 3.21Å; T117-A120 VanDerWaalsContact O-CB 3.23Å; T117-A120 WeakPolarHBondContact O-CB 3.3Å; T117-A120 PolarHBondContact O-N 3.15Å; A118-A120 VanDerWaalsContact C-N 3.26Å; A118-A120 PolarHBondContact O-N 3.48Å; A120-L122 PolarHBondContact O-N 3.3Å; A120-G124 WeakPolarHBondContact O-CA 3.14Å; A120-G124 PolarHBondContact O-N 3.03Å; A120-V125 VanDerWaalsContact CA-O 3.3Å; A120-V125 WeakPolarHBondContact CA-O 3.24Å; A120-V125 PolarHBondContact N-O 3.26Å; A120-K126 HydrophobicContact CB-CG 4.03Å; A120-Q474 HydrophobicContact CB-CB 4.23Å; A120-Q474 HydrophobicContact CB-CG 4.12Å; A120-N475 HydrophobicContact CB-CB 4.06Å; A120-N475 WeakPolarHBondContact O-CA 3.39Å; A120-P478 WeakPolarHBondContact O-CG 3.42Å
121	Y	98.9	Very high	98.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-79.8	-10.1	-172.1	67.6	-107.3	0	0	0	114.8	L60 L62 T117 A118 S177 F327 D376 Q474 P478	L60-Y121 HydrophobicContact CD2-CD2 3.84Å; L60-Y121 HydrophobicContact CD2-CE2 4.42Å; L62-Y121 HydrophobicContact CD2-CD1 4.27Å; L62-Y121 HydrophobicContact CD2-CD2 4.33Å; L62-Y121 HydrophobicContact CD2-CE1 3.94Å; L62-Y121 HydrophobicContact CD2-CE2 4.03Å; L62-Y121 HydrophobicContact CD2-CG 4.48Å; L62-Y121 HydrophobicContact CG-CE1 4.3Å; L62-Y121 HydrophobicContact CG-CE2 4.01Å; T117-Y121 VanDerWaalsContact C-CD1 3.45Å; T117-Y121 VanDerWaalsContact C-CE1 3.48Å; T117-Y121 WeakPolarHBondContact O-CD1 3.31Å; T117-Y121 WeakPolarHBondContact O-CE1 3.35Å; T117-Y121 PolarHBondContact O-N 3.4Å; A118-Y121 HydrophobicContact CB-CE1 3.98Å; A118-Y121 HydrophobicContact CB-CE2 4.36Å; A118-Y121 WeakPolarHBondContact CB-OH 3.29Å; A118-Y121 PolarHBondContact O-N 2.77Å; Y121-S177 WeakPolarHBondContact OH-CA 3.46Å; Y121-S177 VanDerWaalsContact OH-CB 3.29Å; Y121-S177 WeakPolarHBondContact OH-CB 3.33Å; Y121-F327 AromaticContact CE2-CE2 3.82Å; Y121-F327 HydrophobicContact CE2-CE2 3.82Å; Y121-F327 HydrophobicContact CE2-CZ 4.27Å; Y121-D376 HydrophobicContact CD1-CB 4.25Å; Y121-D376 HydrophobicContact CE1-CB 3.54Å; Y121-Q474 HydrophobicContact CD1-CG 4.42Å; Y121-P478 VanDerWaalsContact O-CD 3.26Å; Y121-P478 WeakPolarHBondContact O-CD 3.36Å; Y121-P478 WeakPolarHBondContact O-CG 3.39Å
122	L	98.9	Very high	98.4	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-107.5	-34.1	173.7	-66.8	160.2	0	0	0	113.4	L60 A118 A120 S153 I154 S177 A180 S181 F325 F327	L60-L122 HydrophobicContact CD2-CD2 3.97Å; A118-L122 HydrophobicContact CB-CD1 4.28Å; A118-L122 WeakPolarHBondContact O-CB 3.44Å; A118-L122 PolarHBondContact O-N 2.94Å; A120-L122 PolarHBondContact O-N 3.3Å; L122-S153 CarbonylContact O-C 3.59Å; L122-S153 WeakPolarHBondContact O-CA 3.1Å; L122-I154 HydrophobicContact CD2-CG2 4.41Å; L122-I154 WeakPolarHBondContact O-CG2 3.48Å; L122-I154 PolarHBondContact O-N 3.47Å; L122-S177 WeakPolarHBondContact CD1-O 3.27Å; L122-A180 HydrophobicContact CD1-CB 3.99Å; L122-S181 VanDerWaalsContact CD1-OG 3.26Å; L122-S181 WeakPolarHBondContact CD1-OG 3.4Å; L122-S181 WeakPolarHBondContact CD2-OG 3.35Å; L122-F325 HydrophobicContact CD2-CZ 4.18Å; L122-F327 HydrophobicContact CD2-CD2 3.94Å; L122-F327 HydrophobicContact CD2-CE2 4.27Å
123	C	98.9	Very high	98.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-105.5	-18.4	-175.8	-50	0	0	0	0	113.9	T119 V151 R157 A180	T119-C123 HydrophobicContact CG2-CB 4.21Å; T119-C123 WeakPolarHBondContact O-CA 3.17Å; T119-C123 WeakPolarHBondContact O-CB 3.24Å; T119-C123 PolarHBondContact O-N 2.84Å; C123-V151 HydrophobicContact CB-CB 4.12Å; C123-V151 HydrophobicContact CB-CG2 3.61Å; C123-R157 PolarHBondContact O-NH2 2.84Å; C123-A180 PolarHBondContact SG-O 2.89Å
124	G	98.8	Very high	98.6	Very high	4 Å²	4	8.9 Å²	8.9	4%	0.041	4%	0.044	C	C	.	.	S	Bend	trans	82.8	17.1	-178.6	0	0	0	0	0	113.4	T119 A120 N475 P478 H479	T119-G124 PolarHBondContact O-N 3Å; A120-G124 WeakPolarHBondContact O-CA 3.14Å; A120-G124 PolarHBondContact O-N 3.03Å; G124-N475 WeakPolarHBondContact CA-O 3.25Å; G124-N475 PolarHBondContact O-ND2 3.17Å; G124-P478 VanDerWaalsContact CA-CG 3.42Å; G124-H479 PolarHBondContact O-NE2 2.62Å; G124-H479 VanDerWaalsContact O-NE2 3.12Å
125	V	98.9	Very high	98.7	Very high	53 Å²	53	9.9 Å²	9.9	32%	0.321	5%	0.051	S	C	.	.	S	Bend	trans	-133	128	178.8	-178.4	0	0	0	0	109.2	T119 A120 V151	T119-V125 CarbonylContact C-O 3.5Å; T119-V125 WeakPolarHBondContact CG2-O 3.29Å; A120-V125 VanDerWaalsContact CA-O 3.3Å; A120-V125 WeakPolarHBondContact CA-O 3.24Å; A120-V125 PolarHBondContact N-O 3.26Å; V125-V151 HydrophobicContact CB-CB 4.44Å; V125-V151 HydrophobicContact CB-CG1 4.1Å; V125-V151 HydrophobicContact CB-CG2 4.41Å; V125-V151 HydrophobicContact CG1-CG1 4.21Å; V125-V151 HydrophobicContact CG2-CB 4.28Å; V125-V151 HydrophobicContact CG2-CG1 3.94Å
126	K	98.9	Very high	98.7	Very high	24 Å²	24	11.4 Å²	11.4	10%	0.104	6%	0.064	C	C	.	.			trans	-70.8	140.5	171.7	-74.9	-165	162.6	-172.4	0	110.4	K103 Y105 V107 A120 E473 N475	K103-K126 PolarHBondContact O-NZ 2.81Å; Y105-K126 HydrophobicContact CE2-CD 4.14Å; Y105-K126 VanDerWaalsContact CZ-NZ 3.3Å; Y105-K126 WeakPolarHBondContact O-CD 3.36Å; Y105-K126 VanDerWaalsContact O-CE 3.29Å; Y105-K126 WeakPolarHBondContact O-CE 3.49Å; Y105-K126 PolarHBondContact O-NZ 3.35Å; V107-K126 HydrophobicContact CG2-CB 3.7Å; A120-K126 HydrophobicContact CB-CG 4.03Å; K126-E473 VanDerWaalsContact CE-OE2 3.3Å; K126-E473 WeakPolarHBondContact CE-OE2 3.47Å; K126-E473 IonicContact NZ-OE2 3.48Å; K126-E473 PolarHBondContact NZ-OE2 3.36Å; K126-N475 HydrophobicContact CG-CB 4.32Å
127	A	98.8	Very high	98.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.088	C	C	.	.			trans	-124.7	-179.8	-176	0	0	0	0	0	111.9	N106 V107 T119 V134	N106-A127 WeakPolarHBondContact CB-O 3.44Å; V107-A127 PolarHBondContact N-O 2.76Å; T119-A127 HydrophobicContact CG2-CB 3.84Å; A127-V134 WeakPolarHBondContact CB-O 3.46Å
128	N	98.8	Very high	98.7	Very high	17 Å²	17	14.3 Å²	14.3	9%	0.091	9%	0.088	C	C	.	.			trans	-82	153	173.9	-65	-29.7	0	0	0	110.6	D108 G130 T131 A136 T138	D108-N128 VanDerWaalsContact OD1-CA 3.28Å; D108-N128 WeakPolarHBondContact OD1-CA 3.46Å; N128-G130 PolarHBondContact O-N 3.04Å; N128-T131 HydrophobicContact CB-CG2 4.2Å; N128-T131 PolarHBondContact O-N 2.55Å; N128-T131 PolarHBondContact O-OG1 3.03Å; N128-A136 PolarHBondContact ND2-O 2.94Å; N128-A136 WeakPolarHBondContact OD1-CB 3.23Å; N128-T138 PolarHBondContact ND2-O 2.93Å
129	Y	98.6	Very high	98.7	Very high	83 Å²	83	17.4 Å²	17.4	33%	0.325	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	134.1	172.8	-179.3	-75.7	0	0	0	111.4	D108 Q109 D113 T131	D108-Y129 PolarHBondContact OD1-N 3.45Å; Q109-Y129 HydrophobicContact CB-CD2 4.31Å; Q109-Y129 HydrophobicContact CG-CD2 3.88Å; Q109-Y129 HydrophobicContact CG-CG 3.96Å; D113-Y129 HydrophobicContact CB-CD2 3.68Å; D113-Y129 HydrophobicContact CB-CE1 4.41Å; D113-Y129 HydrophobicContact CB-CE2 3.46Å; D113-Y129 VanDerWaalsContact CB-CE2 3.46Å; D113-Y129 HydrophobicContact CB-CG 4.28Å; D113-Y129 VanDerWaalsContact OD1-CA 3.31Å; D113-Y129 WeakPolarHBondContact OD1-CA 3.47Å; Y129-T131 PolarHBondContact O-N 2.89Å
130	G	98.3	Very high	98.7	Very high	2 Å²	2	21.7 Å²	21.7	2%	0.021	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	1	175.6	0	0	0	0	0	115.1	D113 N128 L140 D187 R188	D113-G130 PolarHBondContact OD1-N 2.93Å; D113-G130 WeakPolarHBondContact OD2-CA 3.48Å; D113-G130 PolarHBondContact OD2-N 3.28Å; D113-G130 VanDerWaalsContact OD2-N 3.14Å; N128-G130 PolarHBondContact O-N 3.04Å; G130-L140 WeakPolarHBondContact O-CD1 3.2Å; G130-D187 CarbonylContact O-C 3.54Å; G130-D187 WeakPolarHBondContact O-CA 3.01Å; G130-R188 PolarHBondContact O-N 3.12Å
131	T	98.8	Very high	98.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.146	C	C	.	.			trans	-106.3	144.6	175.9	71.5	0	0	0	0	110.6	A115 G116 N128 Y129 L140	A115-T131 CarbonylContact C-O 3.59Å; A115-T131 VanDerWaalsContact CB-O 3.3Å; A115-T131 WeakPolarHBondContact CB-O 3.37Å; A115-T131 VanDerWaalsContact O-O 3.13Å; G116-T131 PolarHBondContact N-O 3.34Å; N128-T131 HydrophobicContact CB-CG2 4.2Å; N128-T131 PolarHBondContact O-N 2.55Å; N128-T131 PolarHBondContact O-OG1 3.03Å; Y129-T131 PolarHBondContact O-N 2.89Å; T131-L140 HydrophobicContact CG2-CB 4.47Å; T131-L140 HydrophobicContact CG2-CD1 4.41Å
132	L	97.7	Very high	98.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-131.4	138.2	179.6	61	89.3	0	0	0	112.6	A115 T119 V134 A179 A180 A183 H184 S185 R188 I208	A115-L132 HydrophobicContact CB-CB 4.2Å; T119-L132 WeakPolarHBondContact OG1-CA 3.45Å; L132-V134 PolarHBondContact O-N 3.07Å; L132-V134 VanDerWaalsContact O-N 3.16Å; L132-A179 HydrophobicContact CD1-CB 4Å; L132-A179 HydrophobicContact CD2-CB 3.8Å; L132-A180 HydrophobicContact CB-CB 4.16Å; L132-A183 HydrophobicContact CD1-CB 3.62Å; L132-H184 WeakPolarHBondContact O-CA 3.3Å; L132-S185 PolarHBondContact N-O 3.37Å; L132-S185 PolarHBondContact O-N 3.03Å; L132-R188 HydrophobicContact CD2-CB 3.95Å; L132-I208 HydrophobicContact CD2-CD1 4.02Å
133	G	98.6	Very high	98.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	65.5	14.6	178.4	0	0	0	0	0	114.4	T119 V151 A183 H184	T119-G133 PolarHBondContact OG1-N 2.99Å; G133-V151 VanDerWaalsContact C-CG2 3.49Å; G133-V151 WeakPolarHBondContact O-CG2 3.06Å; G133-V151 PolarHBondContact O-N 2.89Å; G133-A183 WeakPolarHBondContact CA-O 3.4Å; G133-H184 PolarHBondContact O-ND1 2.9Å
134	V	98.9	Very high	98.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-127.6	151.7	178.5	-66.3	0	0	0	0	110.3	A127 L132 T138 T146 N149 H184	A127-V134 WeakPolarHBondContact CB-O 3.46Å; L132-V134 PolarHBondContact O-N 3.07Å; L132-V134 VanDerWaalsContact O-N 3.16Å; V134-T138 HydrophobicContact CB-CG2 4.42Å; V134-T138 HydrophobicContact CG2-CG2 3.97Å; V134-T146 HydrophobicContact CG1-CG2 3.91Å; V134-N149 CarbonylContact C-O 3.55Å; V134-N149 VanDerWaalsContact CA-O 3.3Å; V134-N149 WeakPolarHBondContact CA-O 3.31Å; V134-H184 HydrophobicContact CG1-CB 4.09Å
135	S	98.8	Very high	98.4	Very high	24 Å²	24	29.9 Å²	29.9	17%	0.168	19%	0.188	C	C	.	.			trans	-69.8	165.7	175.4	80	0	0	0	0	111.8	A137 T138 N149	S135-A137 PolarHBondContact O-N 3.32Å; S135-A137 WeakPolarHBondContact OG-CB 3.42Å; S135-A137 PolarHBondContact OG-N 3.04Å; S135-T138 PolarHBondContact O-N 1.99Å; S135-N149 PolarHBondContact N-O 2.99Å
136	A	98.6	Very high	98.4	Very high	32 Å²	32	27.6 Å²	27.6	26%	0.264	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-2.9	175.3	0	0	0	0	0	114.9	V107 N128 T138	V107-A136 HydrophobicContact CB-CB 3.7Å; V107-A136 HydrophobicContact CG1-CB 3.71Å; V107-A136 HydrophobicContact CG2-CB 3.68Å; N128-A136 PolarHBondContact ND2-O 2.94Å; N128-A136 WeakPolarHBondContact OD1-CB 3.23Å; A136-T138 PolarHBondContact O-N 2.89Å
137	A	98.7	Very high	98.3	Very high	61 Å²	61	31.5 Å²	31.5	50%	0.504	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.8	168.8	0	0	0	0	0	113.1	S135 P139 N149	S135-A137 PolarHBondContact O-N 3.32Å; S135-A137 WeakPolarHBondContact OG-CB 3.42Å; S135-A137 PolarHBondContact OG-N 3.04Å; A137-P139 WeakPolarHBondContact O-CD 3.43Å; A137-N149 WeakPolarHBondContact CB-OD1 3.27Å
138	T	98.7	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-96.4	110.4	174.4	-55.3	0	0	0	0	110.4	N128 V134 S135 A136 A145 N149 A186	N128-T138 PolarHBondContact ND2-O 2.93Å; V134-T138 HydrophobicContact CB-CG2 4.42Å; V134-T138 HydrophobicContact CG2-CG2 3.97Å; S135-T138 PolarHBondContact O-N 1.99Å; A136-T138 PolarHBondContact O-N 2.89Å; T138-A145 HydrophobicContact CG2-CB 4.14Å; T138-A145 PolarHBondContact OG1-O 2.81Å; T138-N149 VanDerWaalsContact OG1-CB 3.26Å; T138-N149 WeakPolarHBondContact OG1-CB 3.38Å; T138-A186 HydrophobicContact CG2-CB 3.66Å
139	P	98.2	Very high	98.3	Very high	65 Å²	65	36 Å²	36	42%	0.422	23%	0.232	S	C	.	.			trans	-68.9	147.3	171.2	-18.5	33.3	0	0	0	111.4	A137 G141 N142	A137-P139 WeakPolarHBondContact O-CD 3.43Å; P139-G141 PolarHBondContact O-N 3.43Å; P139-N142 HydrophobicContact CB-CB 4.2Å; P139-N142 HydrophobicContact CG-CB 4.43Å; P139-N142 WeakPolarHBondContact O-CB 3.27Å; P139-N142 PolarHBondContact O-N 3.25Å; P139-N142 VanDerWaalsContact O-N 3.08Å
140	L	98.2	Very high	98.3	Very high	90 Å²	90	35.7 Å²	35.7	47%	0.471	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	130.1	175.4	-179.5	63.4	0	0	0	111.6	G130 T131 N142 A186 D187	G130-L140 WeakPolarHBondContact O-CD1 3.2Å; T131-L140 HydrophobicContact CG2-CB 4.47Å; T131-L140 HydrophobicContact CG2-CD1 4.41Å; L140-N142 PolarHBondContact O-N 3.29Å; L140-A186 CarbonylContact C-O 3.53Å; L140-A186 WeakPolarHBondContact CA-O 3.45Å; L140-A186 WeakPolarHBondContact CD1-O 3.23Å; L140-D187 HydrophobicContact CD1-CB 4.41Å
141	G	97.9	Very high	98.3	Very high	32 Å²	32	36.5 Å²	36.5	33%	0.33	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	-5.8	178.8	0	0	0	0	0	115.4	P139 C143 A186	P139-G141 PolarHBondContact O-N 3.43Å; G141-C143 PolarHBondContact O-N 3.43Å; G141-A186 PolarHBondContact N-O 2.92Å
142	N	98.1	Very high	98.3	Very high	65 Å²	65	38.8 Å²	38.8	35%	0.348	25%	0.252	S	S	.	.			trans	-86.8	89.6	-179.2	-172.3	-20.7	0	0	0	111.5	P139 L140 S144 A145 A186	P139-N142 HydrophobicContact CB-CB 4.2Å; P139-N142 HydrophobicContact CG-CB 4.43Å; P139-N142 WeakPolarHBondContact O-CB 3.27Å; P139-N142 PolarHBondContact O-N 3.25Å; P139-N142 VanDerWaalsContact O-N 3.08Å; L140-N142 PolarHBondContact O-N 3.29Å; N142-S144 PolarHBondContact O-N 2.99Å; N142-S144 PolarHBondContact OD1-N 3.15Å; N142-A145 HydrophobicContact CB-CB 4.14Å; N142-A145 PolarHBondContact O-N 2.97Å; N142-A145 PolarHBondContact OD1-N 2.84Å; N142-A186 WeakPolarHBondContact O-CB 3.09Å
143	C	97.8	Very high	98.4	Very high	2 Å²	2	39 Å²	39	1%	0.014	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-53.4	-47.7	-179.5	171.4	0	0	0	0	113.7	G141 A145 T146 W190 A200 N203 C205	G141-C143 PolarHBondContact O-N 3.43Å; C143-A145 PolarHBondContact O-N 2.91Å; C143-T146 WeakPolarHBondContact O-CB 3.48Å; C143-T146 PolarHBondContact O-N 3.29Å; C143-T146 PolarHBondContact O-OG1 3.12Å; C143-W190 HydrophobicContact CB-CH2 3.91Å; C143-W190 HydrophobicContact CB-CZ3 4.22Å; C143-A200 HydrophobicContact CB-CB 3.77Å; C143-A200 PolarHBondContact SG-O 3.06Å; C143-A200 VanDerWaalsContact SG-O 3.37Å; C143-N203 HydrophobicContact CB-CB 4.12Å; C143-N203 VanDerWaalsContact SG-CB 3.51Å; C143-C205 WeakPolarHBondContact CA-SG 3.36Å; C143-C205 HydrophobicContact CB-CB 4.02Å; C143-C205 WeakPolarHBondContact CB-SG 3.4Å; C143-C205 WeakPolarHBondContact SG-CB 3.42Å; C143-C205 PolarHBondContact SG-N 3.37Å; C143-C205 VanDerWaalsContact SG-N 3.39Å; C143-C205 CovalentContact SG-SG 2.02Å; C143-C205 PolarHBondContact SG-SG 3.26Å
144	S	97.4	Very high	98.4	Very high	59 Å²	59	39 Å²	39	41%	0.413	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-63.3	-26.5	-176	-59.3	0	0	0	0	112.9	N142 T146 N203	N142-S144 PolarHBondContact O-N 2.99Å; N142-S144 PolarHBondContact OD1-N 3.15Å; S144-T146 VanDerWaalsContact C-N 3.26Å; S144-T146 PolarHBondContact O-N 3.15Å; S144-N203 VanDerWaalsContact OG-CG 3.22Å; S144-N203 PolarHBondContact OG-ND2 3.13Å
145	A	97.9	Very high	98.4	Very high	19 Å²	19	39 Å²	39	16%	0.157	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-76.3	-11.1	176.4	0	0	0	0	0	113.2	T138 N142 C143 F147 N149	T138-A145 HydrophobicContact CG2-CB 4.14Å; T138-A145 PolarHBondContact OG1-O 2.81Å; N142-A145 HydrophobicContact CB-CB 4.14Å; N142-A145 PolarHBondContact O-N 2.97Å; N142-A145 PolarHBondContact OD1-N 2.84Å; C143-A145 PolarHBondContact O-N 2.91Å; A145-F147 VanDerWaalsContact C-N 3.34Å; A145-N149 WeakPolarHBondContact O-CB 3.33Å; A145-N149 PolarHBondContact O-ND2 2.96Å
146	T	98	Very high	98.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.031	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-44.5	173.8	-56.1	0	0	0	0	111.2	V134 C143 S144 G148 N149 E150 H184	V134-T146 HydrophobicContact CG1-CG2 3.91Å; C143-T146 WeakPolarHBondContact O-CB 3.48Å; C143-T146 PolarHBondContact O-N 3.29Å; C143-T146 PolarHBondContact O-OG1 3.12Å; S144-T146 VanDerWaalsContact C-N 3.26Å; S144-T146 PolarHBondContact O-N 3.15Å; T146-G148 PolarHBondContact O-N 3.1Å; T146-N149 PolarHBondContact O-N 2.84Å; T146-E150 HydrophobicContact CG2-CG 4.46Å; T146-E150 VanDerWaalsContact O-CD 3.27Å; T146-E150 PolarHBondContact O-N 3.36Å; T146-H184 HydrophobicContact CG2-CB 4.29Å
147	F	98.1	Very high	98.4	Very high	106 Å²	106	40.1 Å²	40.1	47%	0.465	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	120.7	-171.5	-52.8	-72.7	0	0	0	112.2	A145 N149 E150 N203	A145-F147 VanDerWaalsContact C-N 3.34Å; F147-N149 VanDerWaalsContact C-N 3.34Å; F147-E150 WeakPolarHBondContact CA-OE1 3.46Å; F147-N203 WeakPolarHBondContact CE2-O 3.33Å; F147-N203 WeakPolarHBondContact CZ-O 3.18Å
148	G	98.1	Very high	98.4	Very high	69 Å²	69	37.2 Å²	37.2	71%	0.711	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.7	-6.1	-174.4	0	0	0	0	0	114.1	T146 E150	T146-G148 PolarHBondContact O-N 3.1Å; G148-E150 VanDerWaalsContact CA-OE2 3.29Å; G148-E150 WeakPolarHBondContact CA-OE2 2.91Å; G148-E150 PolarHBondContact N-OE2 3.34Å
149	N	98.8	Very high	98.4	Very high	42 Å²	42	39.1 Å²	39.1	23%	0.225	23%	0.234	C	C	.	.			trans	-112.3	6.5	177.9	-72.5	-37	0	0	0	112.7	V134 S135 A137 T138 A145 T146 F147	V134-N149 CarbonylContact C-O 3.55Å; V134-N149 VanDerWaalsContact CA-O 3.3Å; V134-N149 WeakPolarHBondContact CA-O 3.31Å; S135-N149 PolarHBondContact N-O 2.99Å; A137-N149 WeakPolarHBondContact CB-OD1 3.27Å; T138-N149 VanDerWaalsContact OG1-CB 3.26Å; T138-N149 WeakPolarHBondContact OG1-CB 3.38Å; A145-N149 WeakPolarHBondContact O-CB 3.33Å; A145-N149 PolarHBondContact O-ND2 2.96Å; T146-N149 PolarHBondContact O-N 2.84Å; F147-N149 VanDerWaalsContact C-N 3.34Å
150	E	98.8	Very high	98.4	Very high	76 Å²	76	40.9 Å²	40.9	36%	0.355	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-61.5	138.9	174.9	-56.2	92.3	155.2	0	0	110.9	T146 F147 G148 H184	T146-E150 HydrophobicContact CG2-CG 4.46Å; T146-E150 VanDerWaalsContact O-CD 3.27Å; T146-E150 PolarHBondContact O-N 3.36Å; F147-E150 WeakPolarHBondContact CA-OE1 3.46Å; G148-E150 VanDerWaalsContact CA-OE2 3.29Å; G148-E150 WeakPolarHBondContact CA-OE2 2.91Å; G148-E150 PolarHBondContact N-OE2 3.34Å; E150-H184 HydrophobicContact CB-CB 4.29Å; E150-H184 HydrophobicContact CG-CB 3.74Å
151	V	98.8	Very high	98.4	Very high	19 Å²	19	38.6 Å²	38.6	12%	0.115	23%	0.234	C	C	.	.			trans	-121.5	127.8	175.6	-65.7	0	0	0	0	110.5	T119 C123 V125 G133 S153 H184	T119-V151 HydrophobicContact CG2-CG2 3.46Å; T119-V151 VanDerWaalsContact CG2-CG2 3.46Å; C123-V151 HydrophobicContact CB-CB 4.12Å; C123-V151 HydrophobicContact CB-CG2 3.61Å; V125-V151 HydrophobicContact CB-CB 4.44Å; V125-V151 HydrophobicContact CB-CG1 4.1Å; V125-V151 HydrophobicContact CB-CG2 4.41Å; V125-V151 HydrophobicContact CG1-CG1 4.21Å; V125-V151 HydrophobicContact CG2-CB 4.28Å; V125-V151 HydrophobicContact CG2-CG1 3.94Å; G133-V151 VanDerWaalsContact C-CG2 3.49Å; G133-V151 WeakPolarHBondContact O-CG2 3.06Å; G133-V151 PolarHBondContact O-N 2.89Å; V151-S153 PolarHBondContact O-N 3.48Å; V151-H184 PolarHBondContact O-CE1 2.89Å; V151-H184 VanDerWaalsContact O-CE1 3.28Å
152	T	98.5	Very high	98.5	Very high	49 Å²	49	38.3 Å²	38.3	30%	0.301	23%	0.23	S	C	.	.			trans	-76.5	126.3	-172.5	-47.8	0	0	0	0	111.8	H156 R157	T152-H156 HydrophobicContact CG2-CB 3.86Å; T152-H156 WeakPolarHBondContact CG2-CD2 3.37Å; T152-R157 HydrophobicContact CG2-CG 3.85Å; T152-R157 PolarHBondContact O-NE 2.84Å; T152-R157 PolarHBondContact O-NH2 3.29Å
153	S	98.9	Very high	98.5	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.028	22%	0.216	C	C	.	.			trans	-72.9	158.7	178.1	76.8	0	0	0	0	113.1	L122 V151 L155 H156 R157 S181	L122-S153 CarbonylContact O-C 3.59Å; L122-S153 WeakPolarHBondContact O-CA 3.1Å; V151-S153 PolarHBondContact O-N 3.48Å; S153-L155 PolarHBondContact O-N 2.88Å; S153-L155 PolarHBondContact OG-N 2.73Å; S153-H156 PolarHBondContact O-N 3.38Å; S153-H156 PolarHBondContact OG-N 3.34Å; S153-R157 VanDerWaalsContact O-CG 3.28Å; S153-R157 WeakPolarHBondContact O-CG 3.48Å; S153-R157 PolarHBondContact O-N 2.97Å; S153-S181 WeakPolarHBondContact CB-O 3.47Å; S153-S181 PolarHBondContact OG-O 2.86Å
154	I	98.9	Very high	98.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-30.4	170.6	-169.5	169.6	0	0	0	112.3	L58 L122 R157 A158 F325 P478 M481 A482 I487	L58-I154 HydrophobicContact CD1-CD1 3.89Å; L58-I154 HydrophobicContact CD1-CG1 4.42Å; L122-I154 HydrophobicContact CD2-CG2 4.41Å; L122-I154 WeakPolarHBondContact O-CG2 3.48Å; L122-I154 PolarHBondContact O-N 3.47Å; I154-R157 PolarHBondContact O-N 2.92Å; I154-A158 WeakPolarHBondContact O-CB 3.24Å; I154-A158 PolarHBondContact O-N 3.4Å; I154-F325 HydrophobicContact CD1-CD2 4.42Å; I154-F325 HydrophobicContact CD1-CE2 4.28Å; I154-F325 HydrophobicContact CG1-CD2 4.31Å; I154-F325 HydrophobicContact CG1-CE2 4.33Å; I154-F325 HydrophobicContact CG2-CD2 4.16Å; I154-F325 HydrophobicContact CG2-CE1 4.28Å; I154-F325 HydrophobicContact CG2-CE2 3.47Å; I154-F325 VanDerWaalsContact CG2-CE2 3.47Å; I154-F325 HydrophobicContact CG2-CZ 3.54Å; I154-P478 HydrophobicContact CB-CB 4.19Å; I154-P478 HydrophobicContact CD1-CB 4.43Å; I154-P478 HydrophobicContact CG2-CB 4.35Å; I154-M481 HydrophobicContact CD1-CB 3.23Å; I154-M481 HydrophobicContact CD1-CG 4.39Å; I154-M481 HydrophobicContact CD1-SD 4.45Å; I154-A482 HydrophobicContact CD1-CB 4.37Å; I154-I487 HydrophobicContact CG1-CD1 4.05Å
155	L	98.8	Very high	98.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-49.9	173.8	-176.8	149.5	0	0	0	110	S153 R157 A158 K159 V165 I167 T216 I218 F325	S153-L155 PolarHBondContact O-N 2.88Å; S153-L155 PolarHBondContact OG-N 2.73Å; L155-R157 PolarHBondContact O-N 3.17Å; L155-A158 PolarHBondContact O-N 2.71Å; L155-K159 PolarHBondContact O-N 2.92Å; L155-V165 HydrophobicContact CD1-CB 4.27Å; L155-V165 HydrophobicContact CD1-CG2 4.45Å; L155-V165 HydrophobicContact CD2-CB 4.17Å; L155-V165 HydrophobicContact CD2-CG2 3.78Å; L155-V165 HydrophobicContact CG-CB 3.86Å; L155-V165 HydrophobicContact CG-CG1 4.23Å; L155-V165 HydrophobicContact CG-CG2 4.04Å; L155-I167 HydrophobicContact CD1-CD1 3.94Å; L155-I167 HydrophobicContact CD1-CG1 3.67Å; L155-T216 HydrophobicContact CD2-CG2 3.78Å; L155-I218 HydrophobicContact CD2-CG1 4.13Å; L155-F325 HydrophobicContact CB-CD1 3.81Å; L155-F325 HydrophobicContact CB-CE1 3.78Å; L155-F325 HydrophobicContact CD1-CD1 4.14Å; L155-F325 HydrophobicContact CD1-CE1 4.15Å; L155-F325 HydrophobicContact CG-CD1 4.02Å; L155-F325 HydrophobicContact CG-CE1 4.28Å
156	H	98.8	Very high	98.7	Very high	51 Å²	51	32.5 Å²	32.5	24%	0.236	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-44	178.5	-173	88.4	0	0	0	111.4	T152 S153 A158 K159 N160 T216	T152-H156 HydrophobicContact CG2-CB 3.86Å; T152-H156 WeakPolarHBondContact CG2-CD2 3.37Å; S153-H156 PolarHBondContact O-N 3.38Å; S153-H156 PolarHBondContact OG-N 3.34Å; H156-A158 PolarHBondContact O-N 3.3Å; H156-K159 PolarHBondContact O-N 3.35Å; H156-N160 PolarHBondContact CD2-ND2 2.98Å; H156-N160 PolarHBondContact NE2-ND2 3.05Å; H156-N160 PolarHBondContact O-N 3.01Å; H156-T216 PolarHBondContact ND1-OG1 3.42Å
157	R	98.9	Very high	98.7	Very high	28 Å²	28	32.2 Å²	32.2	11%	0.106	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-40.5	176.9	-64.8	171.9	-167	-179.8	14.6	112.5	C123 T152 S153 I154 L155 N160 A161 I487 E488	C123-R157 PolarHBondContact O-NH2 2.84Å; T152-R157 HydrophobicContact CG2-CG 3.85Å; T152-R157 PolarHBondContact O-NE 2.84Å; T152-R157 PolarHBondContact O-NH2 3.29Å; S153-R157 VanDerWaalsContact O-CG 3.28Å; S153-R157 WeakPolarHBondContact O-CG 3.48Å; S153-R157 PolarHBondContact O-N 2.97Å; I154-R157 PolarHBondContact O-N 2.92Å; L155-R157 PolarHBondContact O-N 3.17Å; R157-N160 PolarHBondContact O-N 2.96Å; R157-A161 WeakPolarHBondContact O-CB 3.38Å; R157-A161 PolarHBondContact O-N 2.82Å; R157-I487 HydrophobicContact CB-CD1 4.15Å; R157-E488 HydrophobicContact CB-CB 4.47Å; R157-E488 WeakPolarHBondContact CD-O 3.42Å; R157-E488 HydrophobicContact CG-CB 4.16Å; R157-E488 PolarHBondContact NH1-O 3.07Å
158	A	98.9	Very high	98.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-43.4	175.3	0	0	0	0	0	111.1	I154 L155 H156 A161 G162 K163 V165 F325 I487	I154-A158 WeakPolarHBondContact O-CB 3.24Å; I154-A158 PolarHBondContact O-N 3.4Å; L155-A158 PolarHBondContact O-N 2.71Å; H156-A158 PolarHBondContact O-N 3.3Å; A158-A161 PolarHBondContact O-N 3.09Å; A158-G162 PolarHBondContact O-N 3.34Å; A158-K163 HydrophobicContact CB-CB 4.29Å; A158-K163 HydrophobicContact CB-CD 4.1Å; A158-K163 VanDerWaalsContact O-CB 3.24Å; A158-K163 WeakPolarHBondContact O-CB 3.38Å; A158-K163 PolarHBondContact O-N 3.01Å; A158-V165 HydrophobicContact CB-CG1 4.01Å; A158-F325 HydrophobicContact CB-CB 3.59Å; A158-F325 HydrophobicContact CB-CG 4.41Å; A158-I487 HydrophobicContact CB-CD1 4.16Å
159	K	98.8	Very high	98.7	Very high	40 Å²	40	23.9 Å²	23.9	17%	0.174	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-44.5	175.2	-173.7	65.5	-178.3	-152.4	0	111.6	L155 H156 A161 G162 V165 T216 E217 D219	L155-K159 PolarHBondContact O-N 2.92Å; H156-K159 PolarHBondContact O-N 3.35Å; K159-A161 VanDerWaalsContact C-N 3.28Å; K159-A161 PolarHBondContact O-N 3.27Å; K159-G162 WeakPolarHBondContact O-CA 3.32Å; K159-G162 PolarHBondContact O-N 2.88Å; K159-V165 HydrophobicContact CB-CG1 3.93Å; K159-V165 HydrophobicContact CB-CG2 4.3Å; K159-V165 HydrophobicContact CD-CG2 4.17Å; K159-T216 HydrophobicContact CB-CG2 3.98Å; K159-T216 HydrophobicContact CG-CG2 4.01Å; K159-E217 WeakPolarHBondContact CD-O 3.49Å; K159-E217 WeakPolarHBondContact CE-O 3.33Å; K159-E217 WeakPolarHBondContact CE-OE2 3.43Å; K159-E217 PolarHBondContact NZ-O 3.46Å; K159-E217 IonicContact NZ-OE2 3.79Å; K159-E217 PolarHBondContact NZ-OE2 3.32Å; K159-D219 IonicContact NZ-OD2 3.24Å; K159-D219 PolarHBondContact NZ-OD2 3.29Å
160	N	98.5	Very high	98.3	Very high	102 Å²	102	22.3 Å²	22.3	55%	0.545	13%	0.127	S	C	.	.	H	α-helix	trans	-62.8	-33.9	176.8	-72.6	-8.6	0	0	0	112.6	H156 R157 G162	H156-N160 PolarHBondContact CD2-ND2 2.98Å; H156-N160 PolarHBondContact NE2-ND2 3.05Å; H156-N160 PolarHBondContact O-N 3.01Å; R157-N160 PolarHBondContact O-N 2.96Å; N160-G162 PolarHBondContact O-N 2.67Å
161	A	98.6	Very high	98	Very high	42 Å²	42	18.7 Å²	18.7	35%	0.347	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-1.9	171.5	0	0	0	0	0	113.8	R157 A158 K159 I487	R157-A161 WeakPolarHBondContact O-CB 3.38Å; R157-A161 PolarHBondContact O-N 2.82Å; A158-A161 PolarHBondContact O-N 3.09Å; K159-A161 VanDerWaalsContact C-N 3.28Å; K159-A161 PolarHBondContact O-N 3.27Å; A161-I487 HydrophobicContact CB-CB 4.24Å; A161-I487 HydrophobicContact CB-CG2 3.41Å; A161-I487 VanDerWaalsContact CB-CG2 3.41Å
162	G	98.5	Very high	97.8	Very high	25 Å²	25	19.5 Å²	19.5	26%	0.258	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	13.6	178.7	0	0	0	0	0	114.6	A158 K159 N160 N320 K322	A158-G162 PolarHBondContact O-N 3.34Å; K159-G162 WeakPolarHBondContact O-CA 3.32Å; K159-G162 PolarHBondContact O-N 2.88Å; N160-G162 PolarHBondContact O-N 2.67Å; G162-N320 PolarHBondContact O-ND2 3.34Å; G162-K322 VanDerWaalsContact O-CD 3.32Å; G162-K322 WeakPolarHBondContact O-CD 3.49Å
163	K	98.8	Very high	97.8	Very high	11 Å²	11	17.1 Å²	17.1	5%	0.048	10%	0.096	C	C	.	.			trans	-74.5	153.8	169.6	-59.1	-177.7	177.7	-71.1	0	109.6	K56 A158 K322 G323	K56-K163 PolarHBondContact O-NZ 3.36Å; A158-K163 HydrophobicContact CB-CB 4.29Å; A158-K163 HydrophobicContact CB-CD 4.1Å; A158-K163 VanDerWaalsContact O-CB 3.24Å; A158-K163 WeakPolarHBondContact O-CB 3.38Å; A158-K163 PolarHBondContact O-N 3.01Å; K163-K322 PolarHBondContact NZ-O 3.37Å; K163-G323 WeakPolarHBondContact CA-O 3.43Å; K163-G323 WeakPolarHBondContact CB-O 3.35Å
164	S	98.9	Very high	97.8	Very high	12 Å²	12	17 Å²	17	8%	0.084	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	152	166.1	-74.9	0	0	0	0	109.1	D219 N320 G323 Y324 F325	S164-D219 WeakPolarHBondContact CA-OD2 3.5Å; S164-D219 VanDerWaalsContact CB-OD1 3.27Å; S164-D219 WeakPolarHBondContact CB-OD1 3.29Å; S164-D219 PolarHBondContact OG-OD1 3.22Å; S164-N320 PolarHBondContact N-ND2 3.14Å; S164-N320 WeakPolarHBondContact OG-CB 3.37Å; S164-N320 PolarHBondContact OG-ND2 3.43Å; S164-N320 VanDerWaalsContact OG-ND2 3.12Å; S164-G323 PolarHBondContact N-O 3.47Å; S164-G323 VanDerWaalsContact N-O 3.09Å; S164-Y324 CarbonylContact O-C 3.57Å; S164-Y324 WeakPolarHBondContact O-CA 3.16Å; S164-Y324 WeakPolarHBondContact O-CB 3.31Å; S164-F325 PolarHBondContact O-N 3.5Å
165	V	98.9	Very high	97.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.3	-178	-57.7	0	0	0	0	112.2	L155 A158 K159 I218 D219 V220 F325	L155-V165 HydrophobicContact CD1-CB 4.27Å; L155-V165 HydrophobicContact CD1-CG2 4.45Å; L155-V165 HydrophobicContact CD2-CB 4.17Å; L155-V165 HydrophobicContact CD2-CG2 3.78Å; L155-V165 HydrophobicContact CG-CB 3.86Å; L155-V165 HydrophobicContact CG-CG1 4.23Å; L155-V165 HydrophobicContact CG-CG2 4.04Å; A158-V165 HydrophobicContact CB-CG1 4.01Å; K159-V165 HydrophobicContact CB-CG1 3.93Å; K159-V165 HydrophobicContact CB-CG2 4.3Å; K159-V165 HydrophobicContact CD-CG2 4.17Å; V165-I218 HydrophobicContact CG2-CB 4.29Å; V165-I218 HydrophobicContact CG2-CG1 4.22Å; V165-I218 HydrophobicContact CG2-CG2 4.24Å; V165-I218 WeakPolarHBondContact O-CG2 3.26Å; V165-D219 PolarHBondContact N-OD2 3.05Å; V165-D219 WeakPolarHBondContact O-CB 3.38Å; V165-D219 PolarHBondContact O-N 2.7Å; V165-V220 PolarHBondContact O-N 3.38Å; V165-F325 CarbonylContact C-O 3.58Å; V165-F325 VanDerWaalsContact CA-O 3.28Å; V165-F325 WeakPolarHBondContact CA-O 3.42Å; V165-F325 HydrophobicContact CG1-CB 4.25Å
166	G	98.9	Very high	97.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.6	178.3	0	0	0	0	0	114.1	V220 F325 F327	G166-V220 CarbonylContact C-O 3.49Å; G166-V220 WeakPolarHBondContact CA-O 3.49Å; G166-F325 PolarHBondContact N-O 2.93Å; G166-F327 PolarHBondContact O-N 3.14Å
167	I	98.9	Very high	97.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.4	173.3	-63.6	178.3	0	0	0	106.8	L155 P178 Y182 I218 V220 I221 L222 F327	L155-I167 HydrophobicContact CD1-CD1 3.94Å; L155-I167 HydrophobicContact CD1-CG1 3.67Å; I167-P178 HydrophobicContact CG2-CB 3.7Å; I167-Y182 HydrophobicContact CD1-CD1 3.5Å; I167-Y182 HydrophobicContact CD1-CE1 3.78Å; I167-I218 HydrophobicContact CD1-CD1 3.84Å; I167-V220 PolarHBondContact N-O 2.64Å; I167-I221 CarbonylContact O-C 3.48Å; I167-I221 WeakPolarHBondContact O-CA 3.25Å; I167-L222 PolarHBondContact O-N 2.99Å; I167-F327 HydrophobicContact CG2-CD1 4.33Å
168	V	98.8	Very high	97.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	120.9	168.8	177.8	0	0	0	0	106.3	L222 L306 M309 A313 L326 F327 V328 E329	V168-L222 WeakPolarHBondContact CA-O 3.26Å; V168-L222 HydrophobicContact CG2-CB 4.22Å; V168-L222 HydrophobicContact CG2-CD1 4.15Å; V168-L306 HydrophobicContact CG1-CD1 3.76Å; V168-M309 HydrophobicContact CG1-CB 3.6Å; V168-M309 HydrophobicContact CG1-CE 4.16Å; V168-A313 HydrophobicContact CG2-CB 3.52Å; V168-L326 HydrophobicContact CG2-CD1 3.93Å; V168-F327 PolarHBondContact N-O 3.02Å; V168-V328 HydrophobicContact CB-CG1 4.34Å; V168-V328 HydrophobicContact CB-CG2 4.41Å; V168-V328 HydrophobicContact CG1-CG1 4.29Å; V168-V328 CarbonylContact O-C 3.57Å; V168-V328 VanDerWaalsContact O-CA 3.22Å; V168-V328 WeakPolarHBondContact O-CA 3.45Å; V168-E329 PolarHBondContact O-N 2.85Å
169	T	97.6	Very high	97.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	164.9	171	179.5	0	0	0	0	107.3	T171 V173 P178 L222 G223 M309 E329	T169-T171 PolarHBondContact OG1-N 3.17Å; T169-T171 PolarHBondContact OG1-OG1 2.83Å; T169-V173 HydrophobicContact CG2-CG1 3.97Å; T169-P178 HydrophobicContact CG2-CB 4.37Å; T169-P178 HydrophobicContact CG2-CG 4.17Å; T169-L222 PolarHBondContact N-O 2.87Å; T169-L222 VanDerWaalsContact O-O 3.07Å; T169-G223 WeakPolarHBondContact O-CA 3.47Å; T169-M309 WeakPolarHBondContact O-CE 3.22Å; T169-E329 WeakPolarHBondContact CB-OE2 3.36Å; T169-E329 PolarHBondContact OG1-OE2 2.93Å
170	T	90.4	Very high	97.1	Very high	9 Å²	9	11.7 Å²	11.7	6%	0.055	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	2.3	168.1	37	0	0	0	0	111	C292 L306 M309 K331	T170-C292 WeakPolarHBondContact O-CB 3.26Å; T170-C292 PolarHBondContact O-N 3.04Å; T170-C292 PolarHBondContact O-SG 3.27Å; T170-L306 HydrophobicContact CG2-CB 4.14Å; T170-L306 HydrophobicContact CG2-CD1 4.12Å; T170-M309 HydrophobicContact CG2-CE 3.15Å; T170-K331 VanDerWaalsContact C-CG 3.48Å; T170-K331 HydrophobicContact CG2-CD 4.23Å; T170-K331 HydrophobicContact CG2-CG 4.45Å; T170-K331 VanDerWaalsContact O-CG 3.31Å; T170-K331 WeakPolarHBondContact O-CG 2.89Å; T170-K331 WeakPolarHBondContact OG1-CA 3.31Å; T170-K331 WeakPolarHBondContact OG1-CB 2.84Å; T170-K331 WeakPolarHBondContact OG1-CD 3.34Å; T170-K331 WeakPolarHBondContact OG1-CG 3.46Å; T170-K331 PolarHBondContact OG1-N 3.41Å
171	T	92.2	Very high	97.1	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	179.2	161.1	64	0	0	0	0	110.2	T169 V173 H175 G224 D291 K331 G332	T169-T171 PolarHBondContact OG1-N 3.17Å; T169-T171 PolarHBondContact OG1-OG1 2.83Å; T171-V173 PolarHBondContact O-N 3.1Å; T171-H175 HydrophobicContact CG2-CB 4.17Å; T171-H175 WeakPolarHBondContact OG1-CB 3.46Å; T171-G224 PolarHBondContact O-N 3.35Å; T171-D291 WeakPolarHBondContact CA-OD1 3.31Å; T171-K331 WeakPolarHBondContact CG2-O 3.45Å; T171-G332 VanDerWaalsContact CG2-N 3.26Å
172	R	95.6	Very high	97.1	Very high	35 Å²	35	5 Å²	5	13%	0.132	3%	0.03	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	133.8	153.3	61.5	-167.1	144.7	157.9	6.5	110.3	Q174 H175 Y191 Y228 D291	R172-Q174 PolarHBondContact O-N 3.37Å; R172-H175 HydrophobicContact CG-CB 3.81Å; R172-H175 WeakPolarHBondContact O-CB 3.46Å; R172-H175 PolarHBondContact O-N 3.12Å; R172-Y191 VanDerWaalsContact CZ-CE1 3.46Å; R172-Y191 VanDerWaalsContact NH2-CZ 3.26Å; R172-Y191 PolarHBondContact NH2-OH 3.03Å; R172-Y191 VanDerWaalsContact NH2-OH 3.1Å; R172-Y228 HydrophobicContact CB-CE2 4.17Å; R172-Y228 VanDerWaalsContact CD-CE2 3.47Å; R172-Y228 HydrophobicContact CG-CE2 4.38Å; R172-Y228 PolarHBondContact NH1-OH 3.27Å; R172-D291 WeakPolarHBondContact CG-OD1 3.41Å; R172-D291 PolarHBondContact N-OD1 3.5Å; R172-D291 IonicContact NE-OD1 2.81Å
173	V	98.1	Very high	97.1	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.3	-179.1	-63.4	0	0	0	0	113.2	T169 T171 P178 Y182 L212 I221 G224 L286	T169-V173 HydrophobicContact CG2-CG1 3.97Å; T171-V173 PolarHBondContact O-N 3.1Å; V173-P178 WeakPolarHBondContact O-CG 3.13Å; V173-Y182 PolarHBondContact O-OH 2.88Å; V173-L212 HydrophobicContact CG2-CD2 3.63Å; V173-I221 HydrophobicContact CB-CG2 3.99Å; V173-I221 HydrophobicContact CG1-CG2 3.75Å; V173-I221 HydrophobicContact CG2-CG2 4.1Å; V173-G224 PolarHBondContact N-O 2.86Å; V173-G224 VanDerWaalsContact N-O 3.09Å; V173-L286 HydrophobicContact CG1-CD2 4.13Å; V173-L286 HydrophobicContact CG2-CD2 3.78Å
174	Q	98.4	Very high	97.1	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.1	172.7	-50.8	85.7	-9.8	0	0	113.8	R172 Y182 Y191 I208 A209 G225 M229	R172-Q174 PolarHBondContact O-N 3.37Å; Q174-Y182 WeakPolarHBondContact CA-OH 3.16Å; Q174-Y191 HydrophobicContact CB-CD1 4.07Å; Q174-Y191 WeakPolarHBondContact O-CD1 3.29Å; Q174-I208 HydrophobicContact CB-CB 4.33Å; Q174-I208 HydrophobicContact CB-CG2 3.77Å; Q174-I208 HydrophobicContact CG-CG2 4.35Å; Q174-A209 HydrophobicContact CG-CB 3.97Å; Q174-G225 PolarHBondContact NE2-O 3.03Å; Q174-M229 PolarHBondContact NE2-SD 3.08Å; Q174-M229 VanDerWaalsContact NE2-SD 3.37Å
175	H	96.2	Very high	97.1	Very high	8 Å²	8	5 Å²	5	4%	0.037	2%	0.023	C	C	.	.	S	Bend	trans	-66.6	162.3	177.7	-161.6	-119.6	0	0	0	111.1	T171 R172 S177 P178 A179 R188	T171-H175 HydrophobicContact CG2-CB 4.17Å; T171-H175 WeakPolarHBondContact OG1-CB 3.46Å; R172-H175 HydrophobicContact CG-CB 3.81Å; R172-H175 WeakPolarHBondContact O-CB 3.46Å; R172-H175 PolarHBondContact O-N 3.12Å; H175-S177 PolarHBondContact O-N 2.92Å; H175-P178 HydrophobicContact CB-CG 4.17Å; H175-P178 WeakPolarHBondContact O-CD 3.22Å; H175-P178 VanDerWaalsContact O-CG 3.24Å; H175-P178 WeakPolarHBondContact O-CG 3.26Å; H175-A179 WeakPolarHBondContact O-CB 2.97Å; H175-A179 PolarHBondContact O-N 3.06Å; H175-R188 PolarHBondContact CE1-NH2 2.81Å; H175-R188 PolarHBondContact NE2-NH2 3.39Å; H175-R188 VanDerWaalsContact NE2-NH2 3.14Å
176	A	94.3	Very high	97.1	Very high	0 Å²	0	5 Å²	5	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-52.7	-49.1	-172	0	0	0	0	0	114.1	A115 A179 A180 R188	A115-A176 HydrophobicContact CB-CB 3.81Å; A176-A179 PolarHBondContact O-N 3.38Å; A176-A180 PolarHBondContact O-N 3.25Å; A176-R188 HydrophobicContact CB-CB 4.3Å
177	S	94.1	Very high	97.1	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-58.8	-55.7	-178.1	-49.6	0	0	0	0	113.6	D64 Y121 L122 H175 E329	D64-S177 PolarHBondContact OD2-OG 3.35Å; Y121-S177 WeakPolarHBondContact OH-CA 3.46Å; Y121-S177 VanDerWaalsContact OH-CB 3.29Å; Y121-S177 WeakPolarHBondContact OH-CB 3.33Å; L122-S177 WeakPolarHBondContact CD1-O 3.27Å; H175-S177 PolarHBondContact O-N 2.92Å; S177-E329 WeakPolarHBondContact CB-OE1 3.34Å; S177-E329 PolarHBondContact OG-OE1 2.95Å
178	P	97.4	Very high	97	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-69	-36.1	174.9	27.1	-35.3	0	0	0	111.7	I167 T169 V173 H175 A180 S181 Y182 F327 E329	I167-P178 HydrophobicContact CG2-CB 3.7Å; T169-P178 HydrophobicContact CG2-CB 4.37Å; T169-P178 HydrophobicContact CG2-CG 4.17Å; V173-P178 WeakPolarHBondContact O-CG 3.13Å; H175-P178 HydrophobicContact CB-CG 4.17Å; H175-P178 WeakPolarHBondContact O-CD 3.22Å; H175-P178 VanDerWaalsContact O-CG 3.24Å; H175-P178 WeakPolarHBondContact O-CG 3.26Å; P178-A180 PolarHBondContact O-N 3.35Å; P178-S181 WeakPolarHBondContact O-CB 3.29Å; P178-S181 PolarHBondContact O-N 3.04Å; P178-S181 PolarHBondContact O-OG 2.87Å; P178-Y182 WeakPolarHBondContact O-CD1 3.46Å; P178-Y182 VanDerWaalsContact O-CE1 3.29Å; P178-Y182 WeakPolarHBondContact O-CE1 3.49Å; P178-F327 HydrophobicContact CB-CE1 4.2Å; P178-E329 WeakPolarHBondContact CD-OE2 3.03Å
179	A	98.4	Very high	97	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61.7	-38.8	-175.7	0	0	0	0	0	113.3	L132 H175 A176 S181 Y182 A183 I208	L132-A179 HydrophobicContact CD1-CB 4Å; L132-A179 HydrophobicContact CD2-CB 3.8Å; H175-A179 WeakPolarHBondContact O-CB 2.97Å; H175-A179 PolarHBondContact O-N 3.06Å; A176-A179 PolarHBondContact O-N 3.38Å; A179-S181 PolarHBondContact O-N 3.23Å; A179-Y182 HydrophobicContact CB-CE1 4.46Å; A179-Y182 HydrophobicContact CB-CE2 4.43Å; A179-Y182 PolarHBondContact O-N 3.19Å; A179-A183 HydrophobicContact CB-CB 4.41Å; A179-A183 WeakPolarHBondContact O-CB 3.35Å; A179-A183 PolarHBondContact O-N 3.47Å; A179-I208 HydrophobicContact CB-CG2 3.57Å
180	A	98.1	Very high	97	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.008	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.5	176.1	0	0	0	0	0	113.5	A118 L122 C123 L132 A176 P178 Y182	A118-A180 HydrophobicContact CB-CB 3.47Å; A118-A180 VanDerWaalsContact CB-CB 3.47Å; L122-A180 HydrophobicContact CD1-CB 3.99Å; C123-A180 PolarHBondContact SG-O 2.89Å; L132-A180 HydrophobicContact CB-CB 4.16Å; A176-A180 PolarHBondContact O-N 3.25Å; P178-A180 PolarHBondContact O-N 3.35Å; A180-Y182 VanDerWaalsContact C-N 3.3Å
181	S	98.1	Very high	97.4	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.8	172.7	-60.6	0	0	0	0	113.2	L122 S153 P178 A179	L122-S181 VanDerWaalsContact CD1-OG 3.26Å; L122-S181 WeakPolarHBondContact CD1-OG 3.4Å; L122-S181 WeakPolarHBondContact CD2-OG 3.35Å; S153-S181 WeakPolarHBondContact CB-O 3.47Å; S153-S181 PolarHBondContact OG-O 2.86Å; P178-S181 WeakPolarHBondContact O-CB 3.29Å; P178-S181 PolarHBondContact O-N 3.04Å; P178-S181 PolarHBondContact O-OG 2.87Å; A179-S181 PolarHBondContact O-N 3.23Å
182	Y	98.7	Very high	97.7	Very high	3 Å²	3	12.9 Å²	12.9	1%	0.012	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.2	-22	-172.3	60.9	-100.5	0	0	0	115.2	I167 V173 Q174 P178 A179 A180 I208 L212 N215 I218	I167-Y182 HydrophobicContact CD1-CD1 3.5Å; I167-Y182 HydrophobicContact CD1-CE1 3.78Å; V173-Y182 PolarHBondContact O-OH 2.88Å; Q174-Y182 WeakPolarHBondContact CA-OH 3.16Å; P178-Y182 WeakPolarHBondContact O-CD1 3.46Å; P178-Y182 VanDerWaalsContact O-CE1 3.29Å; P178-Y182 WeakPolarHBondContact O-CE1 3.49Å; A179-Y182 HydrophobicContact CB-CE1 4.46Å; A179-Y182 HydrophobicContact CB-CE2 4.43Å; A179-Y182 PolarHBondContact O-N 3.19Å; A180-Y182 VanDerWaalsContact C-N 3.3Å; Y182-I208 HydrophobicContact CE2-CG2 3.85Å; Y182-I208 WeakPolarHBondContact OH-CG2 3.42Å; Y182-L212 HydrophobicContact CD1-CD1 3.82Å; Y182-L212 HydrophobicContact CD2-CB 4.05Å; Y182-L212 HydrophobicContact CD2-CD1 4.24Å; Y182-L212 HydrophobicContact CE1-CD1 3.39Å; Y182-L212 HydrophobicContact CE2-CB 3.5Å; Y182-L212 VanDerWaalsContact CE2-CB 3.5Å; Y182-L212 HydrophobicContact CE2-CD1 3.89Å; Y182-L212 HydrophobicContact CE2-CG 4.27Å; Y182-L212 HydrophobicContact CG-CD1 4.2Å; Y182-L212 VanDerWaalsContact CZ-CD1 3.42Å; Y182-N215 WeakPolarHBondContact O-CB 3.4Å; Y182-N215 PolarHBondContact O-ND2 3.25Å; Y182-I218 HydrophobicContact CD1-CD1 4.13Å; Y182-I218 HydrophobicContact CG-CD1 4.32Å
183	A	98.8	Very high	97.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.			trans	-105.6	153.9	-175.7	0	0	0	0	0	111.7	L132 G133 A179 I208 Q211	L132-A183 HydrophobicContact CD1-CB 3.62Å; G133-A183 WeakPolarHBondContact CA-O 3.4Å; A179-A183 HydrophobicContact CB-CB 4.41Å; A179-A183 WeakPolarHBondContact O-CB 3.35Å; A179-A183 PolarHBondContact O-N 3.47Å; A183-I208 HydrophobicContact CB-CG2 4.27Å; A183-Q211 VanDerWaalsContact CA-OE1 3.29Å; A183-Q211 HydrophobicContact CB-CB 3.92Å
184	H	98.8	Very high	97.8	Very high	48 Å²	48	14.4 Å²	14.4	22%	0.222	7%	0.074	C	C	.	.			trans	-123.8	108	170.6	-52.9	-65	0	0	0	106.6	L132 G133 V134 T146 E150 V151 Q211	L132-H184 WeakPolarHBondContact O-CA 3.3Å; G133-H184 PolarHBondContact O-ND1 2.9Å; V134-H184 HydrophobicContact CG1-CB 4.09Å; T146-H184 HydrophobicContact CG2-CB 4.29Å; E150-H184 HydrophobicContact CB-CB 4.29Å; E150-H184 HydrophobicContact CG-CB 3.74Å; V151-H184 PolarHBondContact O-CE1 2.89Å; V151-H184 VanDerWaalsContact O-CE1 3.28Å; H184-Q211 PolarHBondContact O-NE2 2.9Å; H184-Q211 PolarHBondContact O-OE1 3.11Å
185	S	98.6	Very high	97.8	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.014	9%	0.09	C	C	.	.	B	Isolated β-bridge	trans	-139.8	133.7	-176.7	-169.3	0	0	0	0	111.3	L132 D187	L132-S185 PolarHBondContact N-O 3.37Å; L132-S185 PolarHBondContact O-N 3.03Å; S185-D187 WeakPolarHBondContact CB-O 3.41Å; S185-D187 PolarHBondContact O-N 3.42Å; S185-D187 PolarHBondContact OG-N 3.22Å; S185-D187 PolarHBondContact OG-O 2.83Å
186	A	98.5	Very high	97.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-70.6	-9.6	170.7	0	0	0	0	0	112.7	T138 L140 G141 N142 W190	T138-A186 HydrophobicContact CG2-CB 3.66Å; L140-A186 CarbonylContact C-O 3.53Å; L140-A186 WeakPolarHBondContact CA-O 3.45Å; L140-A186 WeakPolarHBondContact CD1-O 3.23Å; G141-A186 PolarHBondContact N-O 2.92Å; N142-A186 WeakPolarHBondContact O-CB 3.09Å; A186-W190 HydrophobicContact CB-CH2 4.19Å; A186-W190 HydrophobicContact CB-CZ3 4.29Å
187	D	98.6	Very high	98	Very high	34 Å²	34	20.7 Å²	20.7	18%	0.182	11%	0.111	C	C	.	.			trans	-147.7	126	177.5	-162.4	-36.3	0	0	0	110.3	G130 L140 S185 D189 W190	G130-D187 CarbonylContact O-C 3.54Å; G130-D187 WeakPolarHBondContact O-CA 3.01Å; L140-D187 HydrophobicContact CD1-CB 4.41Å; S185-D187 WeakPolarHBondContact CB-O 3.41Å; S185-D187 PolarHBondContact O-N 3.42Å; S185-D187 PolarHBondContact OG-N 3.22Å; S185-D187 PolarHBondContact OG-O 2.83Å; D187-D189 PolarHBondContact O-N 3.49Å; D187-D189 PolarHBondContact OD1-N 3.49Å; D187-W190 HydrophobicContact CB-CD2 3.74Å; D187-W190 VanDerWaalsContact CB-CE2 3.43Å; D187-W190 HydrophobicContact CB-CE3 4.34Å; D187-W190 HydrophobicContact CB-CG 4.03Å; D187-W190 HydrophobicContact CB-CH2 4.37Å; D187-W190 HydrophobicContact CB-CZ2 3.79Å
188	R	98.1	Very high	98.1	Very high	33 Å²	33	29 Å²	29	13%	0.125	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.9	178.2	68.3	-179.4	-71.5	169.7	-4	113.3	D113 S114 A115 G130 L132 H175 A176 W190 Y191 I208	D113-R188 VanDerWaalsContact OD2-CD 3.31Å; D113-R188 WeakPolarHBondContact OD2-CD 3.34Å; D113-R188 IonicContact OD2-CZ 3.39Å; D113-R188 IonicContact OD2-NE 3.59Å; D113-R188 IonicContact OD2-NH1 2.72Å; D113-R188 PolarHBondContact OD2-NH1 3.05Å; S114-R188 PolarHBondContact OG-NH1 3.02Å; S114-R188 PolarHBondContact OG-NH2 3.47Å; A115-R188 HydrophobicContact CB-CB 3.86Å; A115-R188 HydrophobicContact CB-CG 4.39Å; G130-R188 PolarHBondContact O-N 3.12Å; L132-R188 HydrophobicContact CD2-CB 3.95Å; H175-R188 PolarHBondContact CE1-NH2 2.81Å; H175-R188 PolarHBondContact NE2-NH2 3.39Å; H175-R188 VanDerWaalsContact NE2-NH2 3.14Å; A176-R188 HydrophobicContact CB-CB 4.3Å; R188-W190 VanDerWaalsContact C-N 3.34Å; R188-Y191 VanDerWaalsContact O-CE1 3.29Å; R188-Y191 WeakPolarHBondContact O-CE1 3.29Å; R188-Y191 VanDerWaalsContact O-CZ 3.3Å; R188-I208 VanDerWaalsContact O-CD1 3.29Å; R188-I208 WeakPolarHBondContact O-CD1 3.5Å
189	D	98.3	Very high	98	Very high	86 Å²	86	35.2 Å²	35.2	46%	0.46	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.3	-176.4	-72.4	-33.6	0	0	0	114.1	D187 Y191 D195	D187-D189 PolarHBondContact O-N 3.49Å; D187-D189 PolarHBondContact OD1-N 3.49Å; D189-Y191 VanDerWaalsContact CA-CE2 3.5Å; D189-Y191 HydrophobicContact CB-CE2 4.08Å; D189-Y191 WeakPolarHBondContact O-CD2 3.31Å; D189-Y191 PolarHBondContact O-N 3.11Å; D189-Y191 WeakPolarHBondContact OD1-CE2 2.99Å; D189-Y191 PolarHBondContact OD1-OH 3.41Å; D189-D195 VanDerWaalsContact O-CB 3.24Å; D189-D195 WeakPolarHBondContact O-CB 3.25Å
190	W	98.5	Very high	98	Very high	8 Å²	8	35.3 Å²	35.3	3%	0.03	18%	0.177	C	C	.	.			trans	-80.2	58	175.9	-61.9	-8.7	0	0	0	112.4	C143 A186 D187 R188 L196 P197 A200 C205 D207 I208	C143-W190 HydrophobicContact CB-CH2 3.91Å; C143-W190 HydrophobicContact CB-CZ3 4.22Å; A186-W190 HydrophobicContact CB-CH2 4.19Å; A186-W190 HydrophobicContact CB-CZ3 4.29Å; D187-W190 HydrophobicContact CB-CD2 3.74Å; D187-W190 VanDerWaalsContact CB-CE2 3.43Å; D187-W190 HydrophobicContact CB-CE3 4.34Å; D187-W190 HydrophobicContact CB-CG 4.03Å; D187-W190 HydrophobicContact CB-CH2 4.37Å; D187-W190 HydrophobicContact CB-CZ2 3.79Å; R188-W190 VanDerWaalsContact C-N 3.34Å; W190-L196 HydrophobicContact CB-CG 4.11Å; W190-L196 HydrophobicContact CD2-CD2 3.89Å; W190-L196 HydrophobicContact CD2-CG 4.09Å; W190-L196 HydrophobicContact CE3-CD2 3.67Å; W190-L196 HydrophobicContact CE3-CG 4.35Å; W190-L196 HydrophobicContact CG-CD2 4.3Å; W190-L196 HydrophobicContact CG-CG 3.99Å; W190-L196 HydrophobicContact CZ3-CD2 4.21Å; W190-P197 HydrophobicContact CZ2-CG 3.99Å; W190-A200 HydrophobicContact CH2-CB 3.58Å; W190-A200 HydrophobicContact CZ2-CB 3.83Å; W190-A200 HydrophobicContact CZ3-CB 3.96Å; W190-C205 HydrophobicContact CE3-CB 4.32Å; W190-C205 HydrophobicContact CZ3-CB 3.85Å; W190-D207 WeakPolarHBondContact O-CA 3.38Å; W190-I208 WeakPolarHBondContact O-CG1 3.18Å; W190-I208 PolarHBondContact O-N 3.27Å
191	Y	98.5	Very high	97.9	Very high	12 Å²	12	39.3 Å²	39.3	5%	0.047	20%	0.202	C	C	.	.			trans	-66.7	-44	-174.8	-55	-74.2	0	0	0	112.7	R172 Q174 R188 D189 D195 I208 A209 Y228	R172-Y191 VanDerWaalsContact CZ-CE1 3.46Å; R172-Y191 VanDerWaalsContact NH2-CZ 3.26Å; R172-Y191 PolarHBondContact NH2-OH 3.03Å; R172-Y191 VanDerWaalsContact NH2-OH 3.1Å; Q174-Y191 HydrophobicContact CB-CD1 4.07Å; Q174-Y191 WeakPolarHBondContact O-CD1 3.29Å; R188-Y191 VanDerWaalsContact O-CE1 3.29Å; R188-Y191 WeakPolarHBondContact O-CE1 3.29Å; R188-Y191 VanDerWaalsContact O-CZ 3.3Å; D189-Y191 VanDerWaalsContact CA-CE2 3.5Å; D189-Y191 HydrophobicContact CB-CE2 4.08Å; D189-Y191 WeakPolarHBondContact O-CD2 3.31Å; D189-Y191 PolarHBondContact O-N 3.11Å; D189-Y191 WeakPolarHBondContact OD1-CE2 2.99Å; D189-Y191 PolarHBondContact OD1-OH 3.41Å; Y191-D195 WeakPolarHBondContact CB-OD2 3.33Å; Y191-D195 PolarHBondContact N-OD2 2.88Å; Y191-I208 HydrophobicContact CD1-CD1 4.39Å; Y191-A209 VanDerWaalsContact O-CB 3.24Å; Y191-A209 WeakPolarHBondContact O-CB 3.35Å; Y191-A209 PolarHBondContact O-N 3.3Å; Y191-Y228 HydrophobicContact CD2-CE1 4.4Å; Y191-Y228 HydrophobicContact CG-CE1 4.17Å
192	S	98.4	Very high	97.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-124.6	174.5	171.6	79.3	0	0	0	0	112.2	S194 D195 D207 N245	S192-S194 PolarHBondContact O-N 2.77Å; S192-S194 PolarHBondContact OG-N 2.84Å; S192-S194 PolarHBondContact OG-OG 2.76Å; S192-D195 PolarHBondContact N-OD2 3.09Å; S192-D195 WeakPolarHBondContact O-CB 3.5Å; S192-D195 PolarHBondContact O-N 3.09Å; S192-D195 PolarHBondContact OG-OD2 2.87Å; S192-D207 WeakPolarHBondContact O-CB 3.33Å; S192-N245 WeakPolarHBondContact CB-OD1 3.34Å; S192-N245 PolarHBondContact OG-OD1 2.61Å
193	D	97.9	Very high	97.8	Very high	29 Å²	29	49.6 Å²	49.6	16%	0.155	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57.2	-27.9	174.6	59	-59.3	0	0	0	113	D195 L196 R246 E247 D248	D193-D195 VanDerWaalsContact C-N 3.27Å; D193-D195 PolarHBondContact O-N 2.94Å; D193-L196 PolarHBondContact O-N 2.73Å; D193-R246 WeakPolarHBondContact OD1-CA 3.22Å; D193-R246 VanDerWaalsContact OD1-CB 3.27Å; D193-R246 WeakPolarHBondContact OD1-CB 3.13Å; D193-R246 WeakPolarHBondContact OD1-CG 3.49Å; D193-R246 IonicContact OD1-CZ 3.77Å; D193-R246 IonicContact OD1-NE 3.45Å; D193-R246 IonicContact OD1-NH1 3.58Å; D193-R246 IonicContact OD1-NH2 3.02Å; D193-E247 WeakPolarHBondContact OD2-CA 3.45Å; D193-E247 WeakPolarHBondContact OD2-CB 3.4Å; D193-E247 PolarHBondContact OD2-N 2.76Å; D193-D248 PolarHBondContact OD2-N 3.4Å
194	S	97.3	Very high	97.7	Very high	38 Å²	38	51.2 Å²	51.2	27%	0.266	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-72.1	-20.1	178.1	78.7	0	0	0	0	113.8	S192 N245	S192-S194 PolarHBondContact O-N 2.77Å; S192-S194 PolarHBondContact OG-N 2.84Å; S192-S194 PolarHBondContact OG-OG 2.76Å; S194-N245 WeakPolarHBondContact CB-O 3.38Å; S194-N245 VanDerWaalsContact OG-CG 3.25Å; S194-N245 PolarHBondContact OG-ND2 3.1Å; S194-N245 PolarHBondContact OG-O 3.48Å; S194-N245 PolarHBondContact OG-OD1 3.24Å
195	D	97.8	Very high	97.6	Very high	61 Å²	61	49.7 Å²	49.7	33%	0.326	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-87.1	-16.5	-179.8	-60.3	-53.3	0	0	0	112.2	D189 Y191 S192 D193	D189-D195 VanDerWaalsContact O-CB 3.24Å; D189-D195 WeakPolarHBondContact O-CB 3.25Å; Y191-D195 WeakPolarHBondContact CB-OD2 3.33Å; Y191-D195 PolarHBondContact N-OD2 2.88Å; S192-D195 PolarHBondContact N-OD2 3.09Å; S192-D195 WeakPolarHBondContact O-CB 3.5Å; S192-D195 PolarHBondContact O-N 3.09Å; S192-D195 PolarHBondContact OG-OD2 2.87Å; D193-D195 VanDerWaalsContact C-N 3.27Å; D193-D195 PolarHBondContact O-N 2.94Å
196	L	97.6	Very high	97.6	Very high	18 Å²	18	54 Å²	54	9%	0.094	28%	0.282	C	S	.	.	S	Bend	trans	-74.6	132.1	-179.6	-77.2	119	0	0	0	111.7	W190 D193 A200 V201 C205 D207	W190-L196 HydrophobicContact CB-CG 4.11Å; W190-L196 HydrophobicContact CD2-CD2 3.89Å; W190-L196 HydrophobicContact CD2-CG 4.09Å; W190-L196 HydrophobicContact CE3-CD2 3.67Å; W190-L196 HydrophobicContact CE3-CG 4.35Å; W190-L196 HydrophobicContact CG-CD2 4.3Å; W190-L196 HydrophobicContact CG-CG 3.99Å; W190-L196 HydrophobicContact CZ3-CD2 4.21Å; D193-L196 PolarHBondContact O-N 2.73Å; L196-A200 HydrophobicContact CD2-CB 3.71Å; L196-V201 HydrophobicContact CB-CG2 3.69Å; L196-C205 HydrophobicContact CD2-CB 3.85Å; L196-D207 HydrophobicContact CD1-CB 3.59Å
197	P	97.5	Very high	97.6	Very high	61 Å²	61	54.2 Å²	54.2	40%	0.396	28%	0.284	S	S	.	.			trans	-65	150	167.3	27.8	-32.4	0	0	0	109.9	W190 E199 A200 V201	W190-P197 HydrophobicContact CZ2-CG 3.99Å; P197-E199 PolarHBondContact O-N 3.05Å; P197-A200 HydrophobicContact CG-CB 3.74Å; P197-A200 WeakPolarHBondContact O-CB 3.36Å; P197-A200 PolarHBondContact O-N 2.88Å; P197-V201 PolarHBondContact O-N 2.93Å; P197-V201 VanDerWaalsContact O-N 3.17Å
198	K	96.2	Very high	97.6	Very high	176 Å²	176	52.6 Å²	52.6	77%	0.765	28%	0.275	S	S	*	.	H	α-helix	trans	-51.7	-36.3	179.7	-68.1	-178.3	179.5	177.6	0	113.3	V201 Q202	K198-V201 PolarHBondContact O-N 3.2Å; K198-Q202 WeakPolarHBondContact O-CB 3.48Å; K198-Q202 VanDerWaalsContact O-CG 3.23Å; K198-Q202 WeakPolarHBondContact O-CG 3.47Å; K198-Q202 PolarHBondContact O-N 2.93Å
199	E	96.6	Very high	97.7	Very high	130 Å²	130	51 Å²	51	61%	0.607	27%	0.269	S	S	*	.	H	α-helix	trans	-62	-44.1	175.8	179.7	179.9	177.6	0	0	111.9	P197 Q202 N203	P197-E199 PolarHBondContact O-N 3.05Å; E199-Q202 PolarHBondContact O-N 3.34Å; E199-N203 WeakPolarHBondContact CG-ND2 3.23Å; E199-N203 VanDerWaalsContact O-CB 3.32Å; E199-N203 WeakPolarHBondContact O-CB 3.35Å; E199-N203 VanDerWaalsContact O-CG 3.3Å; E199-N203 PolarHBondContact O-N 2.91Å; E199-N203 PolarHBondContact O-ND2 3.12Å
200	A	97.6	Very high	97.7	Very high	2 Å²	2	50.2 Å²	50.2	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-40.4	178.9	0	0	0	0	0	111.8	C143 W190 L196 P197 N203 G204 C205	C143-A200 HydrophobicContact CB-CB 3.77Å; C143-A200 PolarHBondContact SG-O 3.06Å; C143-A200 VanDerWaalsContact SG-O 3.37Å; W190-A200 HydrophobicContact CH2-CB 3.58Å; W190-A200 HydrophobicContact CZ2-CB 3.83Å; W190-A200 HydrophobicContact CZ3-CB 3.96Å; L196-A200 HydrophobicContact CD2-CB 3.71Å; P197-A200 HydrophobicContact CG-CB 3.74Å; P197-A200 WeakPolarHBondContact O-CB 3.36Å; P197-A200 PolarHBondContact O-N 2.88Å; A200-N203 CarbonylContact O-C 3.53Å; A200-N203 PolarHBondContact O-N 2.96Å; A200-G204 PolarHBondContact O-N 2.75Å; A200-G204 VanDerWaalsContact O-N 3.14Å; A200-C205 HydrophobicContact CB-CB 4.26Å; A200-C205 PolarHBondContact O-N 2.83Å
201	V	95.9	Very high	97.7	Very high	85 Å²	85	50.5 Å²	50.5	52%	0.515	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-45.7	173.3	-179.2	0	0	0	0	111.1	L196 P197 K198 N203 G204	L196-V201 HydrophobicContact CB-CG2 3.69Å; P197-V201 PolarHBondContact O-N 2.93Å; P197-V201 VanDerWaalsContact O-N 3.17Å; K198-V201 PolarHBondContact O-N 3.2Å; V201-N203 VanDerWaalsContact C-N 3.28Å; V201-N203 PolarHBondContact O-N 2.99Å; V201-G204 PolarHBondContact O-N 2.83Å; V201-G204 VanDerWaalsContact O-N 3.14Å
202	Q	96.7	Very high	97.7	Very high	160 Å²	160	50 Å²	50	75%	0.748	26%	0.26	S	S	*	.	H	α-helix	trans	-64	-33.7	178.1	-75	171.4	2.7	0	0	112.8	K198 E199 G204	K198-Q202 WeakPolarHBondContact O-CB 3.48Å; K198-Q202 VanDerWaalsContact O-CG 3.23Å; K198-Q202 WeakPolarHBondContact O-CG 3.47Å; K198-Q202 PolarHBondContact O-N 2.93Å; E199-Q202 PolarHBondContact O-N 3.34Å; Q202-G204 VanDerWaalsContact C-N 3.26Å; Q202-G204 PolarHBondContact O-N 2.97Å
203	N	97	Very high	97.7	Very high	59 Å²	59	51 Å²	51	32%	0.316	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	2.4	177.7	-71.9	-32.5	0	0	0	113.3	C143 S144 F147 E199 A200 V201	C143-N203 HydrophobicContact CB-CB 4.12Å; C143-N203 VanDerWaalsContact SG-CB 3.51Å; S144-N203 VanDerWaalsContact OG-CG 3.22Å; S144-N203 PolarHBondContact OG-ND2 3.13Å; F147-N203 WeakPolarHBondContact CE2-O 3.33Å; F147-N203 WeakPolarHBondContact CZ-O 3.18Å; E199-N203 WeakPolarHBondContact CG-ND2 3.23Å; E199-N203 VanDerWaalsContact O-CB 3.32Å; E199-N203 WeakPolarHBondContact O-CB 3.35Å; E199-N203 VanDerWaalsContact O-CG 3.3Å; E199-N203 PolarHBondContact O-N 2.91Å; E199-N203 PolarHBondContact O-ND2 3.12Å; A200-N203 CarbonylContact O-C 3.53Å; A200-N203 PolarHBondContact O-N 2.96Å; V201-N203 VanDerWaalsContact C-N 3.28Å; V201-N203 PolarHBondContact O-N 2.99Å
204	G	97	Very high	97.6	Very high	34 Å²	34	53.2 Å²	53.2	35%	0.351	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	14.9	171.9	0	0	0	0	0	115.3	A200 V201 Q202	A200-G204 PolarHBondContact O-N 2.75Å; A200-G204 VanDerWaalsContact O-N 3.14Å; V201-G204 PolarHBondContact O-N 2.83Å; V201-G204 VanDerWaalsContact O-N 3.14Å; Q202-G204 VanDerWaalsContact C-N 3.26Å; Q202-G204 PolarHBondContact O-N 2.97Å
205	C	98.1	Very high	97.7	Very high	15 Å²	15	54.1 Å²	54.1	10%	0.101	28%	0.276	C	S	.	.			trans	-71.4	143.1	170	-72.2	0	0	0	0	110.8	C143 W190 L196 A200	C143-C205 WeakPolarHBondContact CA-SG 3.36Å; C143-C205 HydrophobicContact CB-CB 4.02Å; C143-C205 WeakPolarHBondContact CB-SG 3.4Å; C143-C205 WeakPolarHBondContact SG-CB 3.42Å; C143-C205 PolarHBondContact SG-N 3.37Å; C143-C205 VanDerWaalsContact SG-N 3.39Å; C143-C205 CovalentContact SG-SG 2.02Å; C143-C205 PolarHBondContact SG-SG 3.26Å; W190-C205 HydrophobicContact CE3-CB 4.32Å; W190-C205 HydrophobicContact CZ3-CB 3.85Å; L196-C205 HydrophobicContact CD2-CB 3.85Å; A200-C205 HydrophobicContact CB-CB 4.26Å; A200-C205 PolarHBondContact O-N 2.83Å
206	H	98.2	Very high	97.6	Very high	93 Å²	93	51.6 Å²	51.6	43%	0.431	26%	0.263	S	S	.	.			trans	-111.5	148.4	175.9	-68.2	-69.1	0	0	0	110.6	Y210 Q211	H206-Y210 HydrophobicContact CB-CD1 3.57Å; H206-Y210 HydrophobicContact CB-CE1 4.18Å; H206-Y210 HydrophobicContact CB-CG 4.19Å; H206-Y210 AromaticContact CG-CD1 3.69Å; H206-Y210 AromaticContact CG-CE1 3.8Å; H206-Y210 AromaticContact ND1-CD1 3.94Å; H206-Y210 AromaticContact ND1-CE1 3.91Å; H206-Q211 HydrophobicContact CB-CG 4.18Å; H206-Q211 PolarHBondContact O-NE2 2.87Å
207	D	98.6	Very high	97.6	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.027	28%	0.28	C	S	.	.			trans	-66.1	156.8	177.2	61.8	98.2	0	0	0	112.5	W190 S192 L196 A209 Y210 Q211 R246	W190-D207 WeakPolarHBondContact O-CA 3.38Å; S192-D207 WeakPolarHBondContact O-CB 3.33Å; L196-D207 HydrophobicContact CD1-CB 3.59Å; D207-A209 VanDerWaalsContact C-N 3.29Å; D207-A209 PolarHBondContact O-N 2.79Å; D207-A209 WeakPolarHBondContact OD1-CB 3.32Å; D207-A209 PolarHBondContact OD1-N 3.49Å; D207-Y210 WeakPolarHBondContact O-CB 3.48Å; D207-Y210 PolarHBondContact O-N 2.73Å; D207-Y210 VanDerWaalsContact O-N 3.16Å; D207-Y210 PolarHBondContact OD1-N 3.31Å; D207-Y210 WeakPolarHBondContact OD2-CB 3.5Å; D207-Q211 WeakPolarHBondContact O-CG 3.48Å; D207-Q211 PolarHBondContact O-N 2.61Å; D207-R246 IonicContact OD1-CZ 2.72Å; D207-R246 IonicContact OD1-NH1 2.71Å; D207-R246 PolarHBondContact OD1-NH1 2.83Å; D207-R246 IonicContact OD1-NH2 3.63Å; D207-R246 IonicContact OD2-CZ 2.79Å; D207-R246 IonicContact OD2-NH1 3.51Å; D207-R246 IonicContact OD2-NH2 2.99Å; D207-R246 PolarHBondContact OD2-NH2 3.11Å
208	I	98.9	Very high	97.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-38.8	-177.1	-63.2	163.8	0	0	0	110.8	L132 Q174 A179 Y182 A183 R188 W190 Y191 Y210 Q211 L212	L132-I208 HydrophobicContact CD2-CD1 4.02Å; Q174-I208 HydrophobicContact CB-CB 4.33Å; Q174-I208 HydrophobicContact CB-CG2 3.77Å; Q174-I208 HydrophobicContact CG-CG2 4.35Å; A179-I208 HydrophobicContact CB-CG2 3.57Å; Y182-I208 HydrophobicContact CE2-CG2 3.85Å; Y182-I208 WeakPolarHBondContact OH-CG2 3.42Å; A183-I208 HydrophobicContact CB-CG2 4.27Å; R188-I208 VanDerWaalsContact O-CD1 3.29Å; R188-I208 WeakPolarHBondContact O-CD1 3.5Å; W190-I208 WeakPolarHBondContact O-CG1 3.18Å; W190-I208 PolarHBondContact O-N 3.27Å; Y191-I208 HydrophobicContact CD1-CD1 4.39Å; I208-Y210 PolarHBondContact O-N 3.2Å; I208-Q211 PolarHBondContact O-N 2.93Å; I208-L212 PolarHBondContact O-N 3.15Å
209	A	98.8	Very high	97.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-40.5	176.4	0	0	0	0	0	112.3	Q174 Y191 D207 L212 Y228 M229 L252	Q174-A209 HydrophobicContact CG-CB 3.97Å; Y191-A209 VanDerWaalsContact O-CB 3.24Å; Y191-A209 WeakPolarHBondContact O-CB 3.35Å; Y191-A209 PolarHBondContact O-N 3.3Å; D207-A209 VanDerWaalsContact C-N 3.29Å; D207-A209 PolarHBondContact O-N 2.79Å; D207-A209 WeakPolarHBondContact OD1-CB 3.32Å; D207-A209 PolarHBondContact OD1-N 3.49Å; A209-L212 WeakPolarHBondContact O-CB 3.46Å; A209-L212 PolarHBondContact O-N 3.37Å; A209-Y228 WeakPolarHBondContact CB-O 3.5Å; A209-M229 HydrophobicContact CB-SD 3.76Å; A209-L252 VanDerWaalsContact C-CD1 3.49Å; A209-L252 HydrophobicContact CB-CD1 3.72Å; A209-L252 WeakPolarHBondContact O-CD1 3.47Å
210	Y	98.6	Very high	97.9	Very high	68 Å²	68	38.6 Å²	38.6	27%	0.267	20%	0.2	S	C	.	.	H	α-helix	trans	-60.9	-48.2	172.4	-180	-86.3	0	0	0	111	H206 D207 I208 L212 I213 H214	H206-Y210 HydrophobicContact CB-CD1 3.57Å; H206-Y210 HydrophobicContact CB-CE1 4.18Å; H206-Y210 HydrophobicContact CB-CG 4.19Å; H206-Y210 AromaticContact CG-CD1 3.69Å; H206-Y210 AromaticContact CG-CE1 3.8Å; H206-Y210 AromaticContact ND1-CD1 3.94Å; H206-Y210 AromaticContact ND1-CE1 3.91Å; D207-Y210 WeakPolarHBondContact O-CB 3.48Å; D207-Y210 PolarHBondContact O-N 2.73Å; D207-Y210 VanDerWaalsContact O-N 3.16Å; D207-Y210 PolarHBondContact OD1-N 3.31Å; D207-Y210 WeakPolarHBondContact OD2-CB 3.5Å; I208-Y210 PolarHBondContact O-N 3.2Å; Y210-L212 VanDerWaalsContact C-N 3.31Å; Y210-L212 PolarHBondContact O-N 2.84Å; Y210-I213 PolarHBondContact O-N 2.87Å; Y210-I213 VanDerWaalsContact O-N 3.15Å; Y210-H214 HydrophobicContact CD1-CB 4.3Å; Y210-H214 AromaticContact CD1-ND1 3.77Å; Y210-H214 AromaticContact CD2-CE1 3.64Å; Y210-H214 AromaticContact CD2-ND1 3.63Å; Y210-H214 HydrophobicContact CE1-CB 3.88Å; Y210-H214 AromaticContact CE1-CG 3.7Å; Y210-H214 AromaticContact CE1-ND1 3.68Å; Y210-H214 AromaticContact CE2-CE1 3.33Å; Y210-H214 WeakPolarHBondContact CE2-CE1 3.3Å; Y210-H214 AromaticContact CE2-ND1 3.52Å; Y210-H214 AromaticContact CE2-NE2 3.81Å; Y210-H214 AromaticContact CG-ND1 3.75Å; Y210-H214 AromaticContact CZ-CD2 3.86Å; Y210-H214 AromaticContact CZ-CE1 3.69Å; Y210-H214 AromaticContact CZ-CG 3.64Å; Y210-H214 AromaticContact CZ-ND1 3.54Å; Y210-H214 AromaticContact CZ-NE2 3.9Å; Y210-H214 PolarHBondContact O-N 3.38Å; Y210-H214 PolarHBondContact O-ND1 2.91Å
211	Q	98.8	Very high	98	Very high	14 Å²	14	38.6 Å²	38.6	7%	0.065	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-34.5	-179.1	-69.9	-167.2	59.1	0	0	113	A183 H184 H206 D207 I208 I213 H214 N215	A183-Q211 VanDerWaalsContact CA-OE1 3.29Å; A183-Q211 HydrophobicContact CB-CB 3.92Å; H184-Q211 PolarHBondContact O-NE2 2.9Å; H184-Q211 PolarHBondContact O-OE1 3.11Å; H206-Q211 HydrophobicContact CB-CG 4.18Å; H206-Q211 PolarHBondContact O-NE2 2.87Å; D207-Q211 WeakPolarHBondContact O-CG 3.48Å; D207-Q211 PolarHBondContact O-N 2.61Å; I208-Q211 PolarHBondContact O-N 2.93Å; Q211-I213 PolarHBondContact O-N 2.87Å; Q211-I213 VanDerWaalsContact O-N 3.15Å; Q211-H214 PolarHBondContact O-N 2.83Å; Q211-N215 WeakPolarHBondContact O-CB 3.38Å; Q211-N215 PolarHBondContact O-N 3.18Å; Q211-N215 PolarHBondContact OE1-ND2 3.36Å
212	L	98.7	Very high	98.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-53.4	-34.7	174.9	178	66.1	0	0	0	112.7	V173 Y182 I208 A209 Y210 I218 I221 M229	V173-L212 HydrophobicContact CG2-CD2 3.63Å; Y182-L212 HydrophobicContact CD1-CD1 3.82Å; Y182-L212 HydrophobicContact CD2-CB 4.05Å; Y182-L212 HydrophobicContact CD2-CD1 4.24Å; Y182-L212 HydrophobicContact CE1-CD1 3.39Å; Y182-L212 HydrophobicContact CE2-CB 3.5Å; Y182-L212 VanDerWaalsContact CE2-CB 3.5Å; Y182-L212 HydrophobicContact CE2-CD1 3.89Å; Y182-L212 HydrophobicContact CE2-CG 4.27Å; Y182-L212 HydrophobicContact CG-CD1 4.2Å; Y182-L212 VanDerWaalsContact CZ-CD1 3.42Å; I208-L212 PolarHBondContact O-N 3.15Å; A209-L212 WeakPolarHBondContact O-CB 3.46Å; A209-L212 PolarHBondContact O-N 3.37Å; Y210-L212 VanDerWaalsContact C-N 3.31Å; Y210-L212 PolarHBondContact O-N 2.84Å; L212-I218 HydrophobicContact CD1-CD1 3.83Å; L212-I221 HydrophobicContact CD1-CD1 3.93Å; L212-I221 HydrophobicContact CD1-CG1 4.42Å; L212-I221 HydrophobicContact CD1-CG2 4.48Å; L212-I221 HydrophobicContact CD2-CD1 4.47Å; L212-I221 HydrophobicContact CD2-CG2 4.48Å; L212-I221 HydrophobicContact CG-CD1 4.15Å; L212-M229 HydrophobicContact CD2-CE 4.34Å; L212-M229 HydrophobicContact CD2-SD 4.41Å
213	I	97.4	Very high	98.2	Very high	21 Å²	21	26.9 Å²	26.9	11%	0.108	14%	0.139	C	C	.	.	H	α-helix	trans	-96.3	-27.2	-173.7	-50.4	-48	0	0	0	112.1	Y210 Q211 M229 L252 W256	Y210-I213 PolarHBondContact O-N 2.87Å; Y210-I213 VanDerWaalsContact O-N 3.15Å; Q211-I213 PolarHBondContact O-N 2.87Å; Q211-I213 VanDerWaalsContact O-N 3.15Å; I213-M229 HydrophobicContact CD1-CE 3.65Å; I213-M229 HydrophobicContact CG1-CE 3.81Å; I213-L252 HydrophobicContact CG1-CB 4.36Å; I213-W256 HydrophobicContact CD1-CB 3.88Å; I213-W256 HydrophobicContact CD1-CG 4.03Å; I213-W256 HydrophobicContact CG1-CB 4.3Å; I213-W256 HydrophobicContact CG2-CB 3.69Å; I213-W256 HydrophobicContact CG2-CG 4.39Å
214	H	97.4	Very high	98.2	Very high	75 Å²	75	24.1 Å²	24.1	35%	0.347	12%	0.124	S	C	.	.	H	α-helix	trans	-105.1	-29.7	-169.2	-66.4	90.3	0	0	0	114.5	Y210 Q211 E255	Y210-H214 HydrophobicContact CD1-CB 4.3Å; Y210-H214 AromaticContact CD1-ND1 3.77Å; Y210-H214 AromaticContact CD2-CE1 3.64Å; Y210-H214 AromaticContact CD2-ND1 3.63Å; Y210-H214 HydrophobicContact CE1-CB 3.88Å; Y210-H214 AromaticContact CE1-CG 3.7Å; Y210-H214 AromaticContact CE1-ND1 3.68Å; Y210-H214 AromaticContact CE2-CE1 3.33Å; Y210-H214 WeakPolarHBondContact CE2-CE1 3.3Å; Y210-H214 AromaticContact CE2-ND1 3.52Å; Y210-H214 AromaticContact CE2-NE2 3.81Å; Y210-H214 AromaticContact CG-ND1 3.75Å; Y210-H214 AromaticContact CZ-CD2 3.86Å; Y210-H214 AromaticContact CZ-CE1 3.69Å; Y210-H214 AromaticContact CZ-CG 3.64Å; Y210-H214 AromaticContact CZ-ND1 3.54Å; Y210-H214 AromaticContact CZ-NE2 3.9Å; Y210-H214 PolarHBondContact O-N 3.38Å; Y210-H214 PolarHBondContact O-ND1 2.91Å; Q211-H214 PolarHBondContact O-N 2.83Å; H214-E255 IonicContact CE1-OE1 3.93Å; H214-E255 IonicContact CE1-OE2 3.65Å; H214-E255 IonicContact NE2-OE1 3.45Å; H214-E255 PolarHBondContact NE2-OE1 3.22Å; H214-E255 IonicContact NE2-OE2 3.96Å
215	N	97.9	Very high	98.2	Very high	57 Å²	57	22.5 Å²	22.5	31%	0.305	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-45.2	-172	-70.8	8.3	0	0	0	112.8	Y182 Q211	Y182-N215 WeakPolarHBondContact O-CB 3.4Å; Y182-N215 PolarHBondContact O-ND2 3.25Å; Q211-N215 WeakPolarHBondContact O-CB 3.38Å; Q211-N215 PolarHBondContact O-N 3.18Å; Q211-N215 PolarHBondContact OE1-ND2 3.36Å
216	T	97.2	Very high	98.2	Very high	9 Å²	9	21.8 Å²	21.8	6%	0.055	10%	0.103	C	C	.	.	S	Bend	trans	-139.1	133.2	-178.3	-53.6	0	0	0	0	110.2	L155 H156 K159 I218	L155-T216 HydrophobicContact CD2-CG2 3.78Å; H156-T216 PolarHBondContact ND1-OG1 3.42Å; K159-T216 HydrophobicContact CB-CG2 3.98Å; K159-T216 HydrophobicContact CG-CG2 4.01Å; T216-I218 PolarHBondContact O-N 3.48Å
217	E	97.1	Very high	98.2	Very high	94 Å²	94	18.5 Å²	18.5	44%	0.439	9%	0.088	S	C	.	.			trans	-75.7	97.8	175.9	-171.9	-165.2	-117.6	0	0	110.6	K159 F282	K159-E217 WeakPolarHBondContact CD-O 3.49Å; K159-E217 WeakPolarHBondContact CE-O 3.33Å; K159-E217 WeakPolarHBondContact CE-OE2 3.43Å; K159-E217 PolarHBondContact NZ-O 3.46Å; K159-E217 IonicContact NZ-OE2 3.79Å; K159-E217 PolarHBondContact NZ-OE2 3.32Å; E217-F282 HydrophobicContact CG-CE1 3.71Å; E217-F282 HydrophobicContact CG-CZ 4.14Å
218	I	98.6	Very high	98.2	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.01	9%	0.088	C	C	.	.			trans	-88.7	128.6	179.6	-57.4	159.3	0	0	0	110.4	L155 V165 I167 Y182 L212 T216 V220 I221	L155-I218 HydrophobicContact CD2-CG1 4.13Å; V165-I218 HydrophobicContact CG2-CB 4.29Å; V165-I218 HydrophobicContact CG2-CG1 4.22Å; V165-I218 HydrophobicContact CG2-CG2 4.24Å; V165-I218 WeakPolarHBondContact O-CG2 3.26Å; I167-I218 HydrophobicContact CD1-CD1 3.84Å; Y182-I218 HydrophobicContact CD1-CD1 4.13Å; Y182-I218 HydrophobicContact CG-CD1 4.32Å; L212-I218 HydrophobicContact CD1-CD1 3.83Å; T216-I218 PolarHBondContact O-N 3.48Å; I218-V220 VanDerWaalsContact CG2-O 3.31Å; I218-V220 WeakPolarHBondContact CG2-O 3.21Å; I218-I221 HydrophobicContact CB-CD1 4.05Å; I218-I221 HydrophobicContact CB-CG1 3.88Å; I218-I221 HydrophobicContact CD1-CD1 4.33Å; I218-I221 HydrophobicContact CD1-CG1 4.35Å; I218-I221 HydrophobicContact CG2-CD1 4.25Å; I218-I221 HydrophobicContact CG2-CG1 3.52Å
219	D	98.8	Very high	98.2	Very high	16 Å²	16	18.6 Å²	18.6	9%	0.086	9%	0.088	C	C	.	.	S	Bend	trans	-72.7	-42.6	-178.1	-55.7	-125.8	0	0	0	111.3	K159 S164 V165 F282 L283 L317	K159-D219 IonicContact NZ-OD2 3.24Å; K159-D219 PolarHBondContact NZ-OD2 3.29Å; S164-D219 WeakPolarHBondContact CA-OD2 3.5Å; S164-D219 VanDerWaalsContact CB-OD1 3.27Å; S164-D219 WeakPolarHBondContact CB-OD1 3.29Å; S164-D219 PolarHBondContact OG-OD1 3.22Å; V165-D219 PolarHBondContact N-OD2 3.05Å; V165-D219 WeakPolarHBondContact O-CB 3.38Å; V165-D219 PolarHBondContact O-N 2.7Å; D219-F282 CarbonylContact O-C 3.54Å; D219-F282 WeakPolarHBondContact O-CA 3.22Å; D219-L283 PolarHBondContact O-N 3.21Å; D219-L317 HydrophobicContact CB-CD2 3.77Å
220	V	98.9	Very high	98.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.5	-179.8	-179.3	0	0	0	0	111.1	V165 G166 I167 I218 L222 L283 A313 I316 L317	V165-V220 PolarHBondContact O-N 3.38Å; G166-V220 CarbonylContact C-O 3.49Å; G166-V220 WeakPolarHBondContact CA-O 3.49Å; I167-V220 PolarHBondContact N-O 2.64Å; I218-V220 VanDerWaalsContact CG2-O 3.31Å; I218-V220 WeakPolarHBondContact CG2-O 3.21Å; V220-L222 HydrophobicContact CG1-CD1 3.86Å; V220-L222 HydrophobicContact CG1-CG 3.74Å; V220-L283 CarbonylContact C-O 3.48Å; V220-L283 WeakPolarHBondContact CA-O 3.49Å; V220-L283 HydrophobicContact CG1-CB 4.47Å; V220-A313 HydrophobicContact CB-CB 4.45Å; V220-A313 HydrophobicContact CG1-CB 3.79Å; V220-I316 HydrophobicContact CG2-CB 3.87Å; V220-I316 HydrophobicContact CG2-CD1 4.2Å; V220-I316 HydrophobicContact CG2-CG2 3.59Å; V220-L317 HydrophobicContact CB-CD2 4.46Å; V220-L317 HydrophobicContact CG2-CD2 3.99Å; V220-L317 HydrophobicContact CG2-CG 4.08Å
221	I	98.9	Very high	98.2	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	113.5	174.4	-59.1	162.4	0	0	0	107.2	I167 V173 L212 I218 L283 L284 G285	I167-I221 CarbonylContact O-C 3.48Å; I167-I221 WeakPolarHBondContact O-CA 3.25Å; V173-I221 HydrophobicContact CB-CG2 3.99Å; V173-I221 HydrophobicContact CG1-CG2 3.75Å; V173-I221 HydrophobicContact CG2-CG2 4.1Å; L212-I221 HydrophobicContact CD1-CD1 3.93Å; L212-I221 HydrophobicContact CD1-CG1 4.42Å; L212-I221 HydrophobicContact CD1-CG2 4.48Å; L212-I221 HydrophobicContact CD2-CD1 4.47Å; L212-I221 HydrophobicContact CD2-CG2 4.48Å; L212-I221 HydrophobicContact CG-CD1 4.15Å; I218-I221 HydrophobicContact CB-CD1 4.05Å; I218-I221 HydrophobicContact CB-CG1 3.88Å; I218-I221 HydrophobicContact CD1-CD1 4.33Å; I218-I221 HydrophobicContact CD1-CG1 4.35Å; I218-I221 HydrophobicContact CG2-CD1 4.25Å; I218-I221 HydrophobicContact CG2-CG1 3.52Å; I221-L283 PolarHBondContact N-O 3.04Å; I221-L284 HydrophobicContact CB-CD1 3.68Å; I221-L284 HydrophobicContact CD1-CD1 4.14Å; I221-L284 HydrophobicContact CG2-CD1 3.63Å; I221-L284 CarbonylContact O-C 3.54Å; I221-L284 WeakPolarHBondContact O-CA 3.23Å; I221-G285 PolarHBondContact O-N 2.98Å
222	L	98.9	Very high	98.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.1	179.9	-61.4	176.8	0	0	0	110	I167 V168 T169 V220 F272 L283 G285 F287 M309 A313	I167-L222 PolarHBondContact O-N 2.99Å; V168-L222 WeakPolarHBondContact CA-O 3.26Å; V168-L222 HydrophobicContact CG2-CB 4.22Å; V168-L222 HydrophobicContact CG2-CD1 4.15Å; T169-L222 PolarHBondContact N-O 2.87Å; T169-L222 VanDerWaalsContact O-O 3.07Å; V220-L222 HydrophobicContact CG1-CD1 3.86Å; V220-L222 HydrophobicContact CG1-CG 3.74Å; L222-F272 HydrophobicContact CD1-CE2 4.1Å; L222-F272 HydrophobicContact CD2-CE2 4.35Å; L222-L283 HydrophobicContact CD1-CD2 4.48Å; L222-L283 HydrophobicContact CD2-CD2 3.81Å; L222-L283 HydrophobicContact CD2-CG 3.95Å; L222-G285 WeakPolarHBondContact CA-O 3.48Å; L222-F287 HydrophobicContact CB-CE2 4.31Å; L222-F287 HydrophobicContact CD2-CE2 4.12Å; L222-F287 HydrophobicContact CD2-CZ 4.08Å; L222-M309 HydrophobicContact CB-CB 4.28Å; L222-M309 HydrophobicContact CB-CG 4.36Å; L222-M309 HydrophobicContact CB-SD 3.83Å; L222-M309 HydrophobicContact CD1-CB 3.86Å; L222-M309 HydrophobicContact CD1-CG 4.31Å; L222-M309 WeakPolarHBondContact CD1-O 3.37Å; L222-A313 HydrophobicContact CD1-CB 4.34Å
223	G	98	Very high	97.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-149.5	174.7	0	0	0	0	0	112.1	T169 G285 L286 F287	T169-G223 WeakPolarHBondContact O-CA 3.47Å; G223-G285 PolarHBondContact N-O 3.25Å; G223-L286 CarbonylContact O-C 3.29Å; G223-L286 WeakPolarHBondContact O-CA 3.32Å; G223-F287 VanDerWaalsContact O-CD2 3.26Å; G223-F287 WeakPolarHBondContact O-CD2 3.38Å; G223-F287 PolarHBondContact O-N 2.95Å
224	G	97.3	Very high	98	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-164.5	172.8	0	0	0	0	0	112.8	T171 V173 L286 E288 R290	T171-G224 PolarHBondContact O-N 3.35Å; V173-G224 PolarHBondContact N-O 2.86Å; V173-G224 VanDerWaalsContact N-O 3.09Å; G224-L286 WeakPolarHBondContact O-CD2 3.4Å; G224-E288 CarbonylContact C-O 3.47Å; G224-R290 CarbonylContact C-O 3.54Å; G224-R290 WeakPolarHBondContact CA-O 3.35Å
225	G	97.6	Very high	98	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.157	C	C	.	.			trans	99.1	29.2	170.5	0	0	0	0	0	115	Q174 E227 E288 P289 R290	Q174-G225 PolarHBondContact NE2-O 3.03Å; G225-E227 PolarHBondContact O-N 3.09Å; G225-E288 PolarHBondContact N-O 2.99Å; G225-P289 CarbonylContact C-O 3.12Å; G225-P289 WeakPolarHBondContact CA-O 3.45Å; G225-R290 PolarHBondContact N-O 3.47Å
226	R	98.4	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.			trans	-57.9	-36.3	175.6	-67.9	-169.6	-65.7	-103.2	4.9	113	Y228 M229 L230 D236 E238 Y265 W267 L286 F287 E288 P289	R226-Y228 VanDerWaalsContact C-N 3.26Å; R226-Y228 PolarHBondContact O-N 2.8Å; R226-M229 PolarHBondContact O-N 2.9Å; R226-L230 WeakPolarHBondContact O-CG 3.49Å; R226-D236 IonicContact CZ-OD1 2.73Å; R226-D236 IonicContact CZ-OD2 3.69Å; R226-D236 IonicContact NE-OD1 3.25Å; R226-D236 IonicContact NE-OD2 3.66Å; R226-D236 PolarHBondContact NE-OD2 3.25Å; R226-D236 IonicContact NH2-OD1 3.49Å; R226-D236 PolarHBondContact NH2-OD1 2.79Å; R226-D236 IonicContact NH2-OD2 2.83Å; R226-D236 PolarHBondContact NH2-OD2 3.37Å; R226-E238 IonicContact CZ-OE2 2.87Å; R226-E238 IonicContact NH1-OE2 3.82Å; R226-E238 IonicContact NH2-OE2 3.88Å; R226-E238 PolarHBondContact NH2-OE2 2.9Å; R226-Y265 WeakPolarHBondContact CD-OH 3.31Å; R226-W267 PolarHBondContact NH1-O 3.29Å; R226-L286 VanDerWaalsContact CD-O 3.23Å; R226-L286 WeakPolarHBondContact CD-O 3.47Å; R226-L286 HydrophobicContact CG-CB 3.37Å; R226-L286 HydrophobicContact CG-CD1 4.29Å; R226-L286 HydrophobicContact CG-CG 4.48Å; R226-L286 WeakPolarHBondContact CG-O 3.39Å; R226-L286 PolarHBondContact NH1-O 2.93Å; R226-F287 PolarHBondContact NH1-O 3.12Å; R226-E288 PolarHBondContact N-O 2.82Å; R226-P289 PolarHBondContact N-O 2.89Å; R226-P289 VanDerWaalsContact N-O 3.08Å
227	E	97.9	Very high	97.9	Very high	25 Å²	25	30.5 Å²	30.5	12%	0.117	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-54.2	-42.1	-174.7	177.6	175.3	162.9	0	0	111.8	G225 M229 G244 N245 P289 R290	G225-E227 PolarHBondContact O-N 3.09Å; E227-M229 VanDerWaalsContact C-N 3.27Å; E227-M229 PolarHBondContact O-N 3.06Å; E227-G244 CarbonylContact O-C 3.18Å; E227-G244 WeakPolarHBondContact O-CA 3.33Å; E227-N245 HydrophobicContact CG-CB 3.51Å; E227-N245 PolarHBondContact O-N 2.81Å; E227-P289 HydrophobicContact CB-CB 4.26Å; E227-P289 WeakPolarHBondContact CB-O 3.39Å; E227-P289 PolarHBondContact N-O 3.32Å; E227-R290 IonicContact OE1-CZ 3.36Å; E227-R290 IonicContact OE1-NE 3.72Å; E227-R290 IonicContact OE1-NH2 2.75Å; E227-R290 PolarHBondContact OE1-NH2 2.97Å; E227-R290 WeakPolarHBondContact OE2-CG 3.31Å; E227-R290 IonicContact OE2-CZ 3.55Å; E227-R290 IonicContact OE2-NE 3.55Å; E227-R290 PolarHBondContact OE2-NE 3.02Å; E227-R290 IonicContact OE2-NH2 2.56Å
228	Y	98.4	Very high	97.9	Very high	6 Å²	6	27.6 Å²	27.6	2%	0.024	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-77.3	-11.1	-176.8	-48.7	-68.4	0	0	0	114.2	R172 Y191 A209 R226 R246	R172-Y228 HydrophobicContact CB-CE2 4.17Å; R172-Y228 VanDerWaalsContact CD-CE2 3.47Å; R172-Y228 HydrophobicContact CG-CE2 4.38Å; R172-Y228 PolarHBondContact NH1-OH 3.27Å; Y191-Y228 HydrophobicContact CD2-CE1 4.4Å; Y191-Y228 HydrophobicContact CG-CE1 4.17Å; A209-Y228 WeakPolarHBondContact CB-O 3.5Å; R226-Y228 VanDerWaalsContact C-N 3.26Å; R226-Y228 PolarHBondContact O-N 2.8Å; Y228-R246 VanDerWaalsContact O-CD 3.3Å; Y228-R246 WeakPolarHBondContact O-CD 3.34Å; Y228-R246 VanDerWaalsContact O-CG 3.23Å; Y228-R246 WeakPolarHBondContact O-CG 3.47Å; Y228-R246 PolarHBondContact O-NH1 3.32Å
229	M	98.5	Very high	97.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-98	-11.4	-177.1	-55.4	-60.5	-73.4	0	0	113	Q174 A209 L212 I213 R226 E227 L252 I253 L286	Q174-M229 PolarHBondContact NE2-SD 3.08Å; Q174-M229 VanDerWaalsContact NE2-SD 3.37Å; A209-M229 HydrophobicContact CB-SD 3.76Å; L212-M229 HydrophobicContact CD2-CE 4.34Å; L212-M229 HydrophobicContact CD2-SD 4.41Å; I213-M229 HydrophobicContact CD1-CE 3.65Å; I213-M229 HydrophobicContact CG1-CE 3.81Å; R226-M229 PolarHBondContact O-N 2.9Å; E227-M229 VanDerWaalsContact C-N 3.27Å; E227-M229 PolarHBondContact O-N 3.06Å; M229-L252 HydrophobicContact CB-CB 4.35Å; M229-L252 HydrophobicContact CE-CB 3.45Å; M229-L252 VanDerWaalsContact CE-CB 3.45Å; M229-L252 HydrophobicContact CE-CD1 4.25Å; M229-L252 PolarHBondContact O-N 2.8Å; M229-L252 HydrophobicContact SD-CB 4.13Å; M229-L252 HydrophobicContact SD-CD1 4.05Å; M229-I253 HydrophobicContact CB-CD1 3.95Å; M229-I253 HydrophobicContact CB-CG1 3.9Å; M229-L286 HydrophobicContact CB-CD1 4.44Å; M229-L286 HydrophobicContact CG-CD1 3.73Å
230	L	98.4	Very high	97.5	Very high	11 Å²	11	34.2 Å²	34.2	6%	0.058	18%	0.182	C	C	.	.	S	Bend	trans	-114.6	143.1	-169.9	-66.5	175.8	0	0	0	111.4	R226 T234 G244 N245 R246 I253	R226-L230 WeakPolarHBondContact O-CG 3.49Å; L230-T234 HydrophobicContact CB-CG2 4.47Å; L230-T234 HydrophobicContact CD1-CG2 4.33Å; L230-T234 HydrophobicContact CD2-CG2 4.13Å; L230-G244 WeakPolarHBondContact O-CA 3.49Å; L230-N245 PolarHBondContact O-N 2.87Å; L230-R246 WeakPolarHBondContact O-CB 3.37Å; L230-R246 WeakPolarHBondContact O-CG 3.38Å; L230-R246 PolarHBondContact O-N 3.19Å; L230-I253 HydrophobicContact CD2-CD1 3.8Å; L230-I253 HydrophobicContact CG-CD1 4.24Å
231	P	98.3	Very high	97.3	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.123	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-56.7	147.9	169.1	-22.1	31.7	0	0	0	111.8	D233 T234 G244 T250 N251	P231-D233 PolarHBondContact O-N 3.36Å; P231-T234 WeakPolarHBondContact CD-OG1 3.32Å; P231-T234 WeakPolarHBondContact O-CB 3.28Å; P231-T234 PolarHBondContact O-N 2.78Å; P231-T234 PolarHBondContact O-OG1 3.39Å; P231-G244 WeakPolarHBondContact O-CA 3.33Å; P231-T250 VanDerWaalsContact CD-O 3.27Å; P231-T250 WeakPolarHBondContact CD-O 2.86Å; P231-T250 WeakPolarHBondContact CG-O 3.33Å; P231-N251 HydrophobicContact CG-CB 4.33Å
232	K	96.9	Very high	97.2	Very high	107 Å²	107	43.9 Å²	43.9	47%	0.465	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.8	179.7	71.7	-179.3	-176.7	-175.2	0	115.9	T243 G244 R246	K232-T243 WeakPolarHBondContact O-CB 3.35Å; K232-T243 PolarHBondContact O-OG1 2.89Å; K232-G244 WeakPolarHBondContact CA-O 3.26Å; K232-R246 PolarHBondContact N-O 2.99Å
233	D	95.8	Very high	97.2	Very high	140 Å²	140	47 Å²	47	75%	0.749	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.2	179.7	-58.7	-41.8	0	0	0	112.8	P231	P231-D233 PolarHBondContact O-N 3.36Å
234	T	97.6	Very high	97.2	Very high	49 Å²	49	47.1 Å²	47.1	30%	0.301	26%	0.26	S	S	.	.	S	Bend	trans	-92	123.9	178.4	-54.5	0	0	0	0	110.1	L230 P231 T243 G244	L230-T234 HydrophobicContact CB-CG2 4.47Å; L230-T234 HydrophobicContact CD1-CG2 4.33Å; L230-T234 HydrophobicContact CD2-CG2 4.13Å; P231-T234 WeakPolarHBondContact CD-OG1 3.32Å; P231-T234 WeakPolarHBondContact O-CB 3.28Å; P231-T234 PolarHBondContact O-N 2.78Å; P231-T234 PolarHBondContact O-OG1 3.39Å; T234-T243 CarbonylContact O-C 3.45Å; T234-T243 WeakPolarHBondContact O-CA 3.4Å; T234-G244 PolarHBondContact O-N 3.12Å
235	L	97.6	Very high	97.1	Very high	106 Å²	106	48.9 Å²	48.9	56%	0.555	27%	0.269	S	S	*	.	B	Isolated β-bridge	trans	-70.2	142.4	175.7	-61.2	175	0	0	0	111.1	T243	L235-T243 HydrophobicContact CD2-CG2 4.01Å
236	D	98.1	Very high	97.2	Very high	5 Å²	5	49 Å²	49	3%	0.027	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-67	135.8	170.4	-175.5	-89.5	0	0	0	110.3	R226 E238 Y239 K242	R226-D236 IonicContact CZ-OD1 2.73Å; R226-D236 IonicContact CZ-OD2 3.69Å; R226-D236 IonicContact NE-OD1 3.25Å; R226-D236 IonicContact NE-OD2 3.66Å; R226-D236 PolarHBondContact NE-OD2 3.25Å; R226-D236 IonicContact NH2-OD1 3.49Å; R226-D236 PolarHBondContact NH2-OD1 2.79Å; R226-D236 IonicContact NH2-OD2 2.83Å; R226-D236 PolarHBondContact NH2-OD2 3.37Å; D236-E238 PolarHBondContact O-N 2.8Å; D236-E238 WeakPolarHBondContact OD1-CB 3.2Å; D236-E238 PolarHBondContact OD1-N 2.95Å; D236-Y239 CarbonylContact O-C 3.54Å; D236-Y239 WeakPolarHBondContact OD1-CD2 3.42Å; D236-Y239 PolarHBondContact OD1-N 3.36Å; D236-K242 HydrophobicContact CB-CB 4.1Å; D236-K242 PolarHBondContact N-O 2.94Å
237	P	96.8	Very high	97.1	Very high	59 Å²	59	55.5 Å²	55.5	38%	0.383	30%	0.3	S	S	.	.	S	Bend	trans	-66.9	-22	-174.3	26.4	-36.7	0	0	0	114.3	W267	P237-W267 HydrophobicContact CB-CD2 3.9Å; P237-W267 HydrophobicContact CB-CE3 4.15Å; P237-W267 HydrophobicContact CB-CG 4.46Å; P237-W267 HydrophobicContact CB-CH2 4.26Å; P237-W267 HydrophobicContact CB-CZ2 4.02Å; P237-W267 HydrophobicContact CB-CZ3 4.32Å; P237-W267 HydrophobicContact CG-CB 4.5Å; P237-W267 HydrophobicContact CG-CD2 3.77Å; P237-W267 HydrophobicContact CG-CE3 4Å; P237-W267 HydrophobicContact CG-CG 3.98Å
238	E	97.1	Very high	97	Very high	34 Å²	34	57.9 Å²	57.9	16%	0.159	31%	0.313	C	S	.	.	S	Bend	trans	-103.7	-34.1	-177.3	-174.1	171.2	-157.4	0	0	111.9	R226 D236 P240 W267 M302	R226-E238 IonicContact CZ-OE2 2.87Å; R226-E238 IonicContact NH1-OE2 3.82Å; R226-E238 IonicContact NH2-OE2 3.88Å; R226-E238 PolarHBondContact NH2-OE2 2.9Å; D236-E238 PolarHBondContact O-N 2.8Å; D236-E238 WeakPolarHBondContact OD1-CB 3.2Å; D236-E238 PolarHBondContact OD1-N 2.95Å; E238-P240 WeakPolarHBondContact O-CD 3.04Å; E238-W267 HydrophobicContact CB-CE3 4.36Å; E238-W267 HydrophobicContact CB-CZ3 4.06Å; E238-M302 HydrophobicContact CG-CE 4.04Å; E238-M302 WeakPolarHBondContact OE1-CE 3.27Å
239	Y	96.9	Very high	96.9	Very high	59 Å²	59	60.1 Å²	60.1	23%	0.231	34%	0.338	C	S	.	.			trans	-119.4	89.2	180	-53.9	-77.6	0	0	0	110.9	D236 S241 K242 E288 P289 H293	D236-Y239 CarbonylContact O-C 3.54Å; D236-Y239 WeakPolarHBondContact OD1-CD2 3.42Å; D236-Y239 PolarHBondContact OD1-N 3.36Å; Y239-S241 PolarHBondContact O-N 3.13Å; Y239-K242 HydrophobicContact CD2-CD 4.31Å; Y239-K242 HydrophobicContact CG-CD 4.17Å; Y239-K242 PolarHBondContact O-N 3.31Å; Y239-E288 WeakPolarHBondContact CE2-OE2 3.4Å; Y239-E288 PolarHBondContact OH-OE1 3.33Å; Y239-E288 PolarHBondContact OH-OE2 2.87Å; Y239-P289 HydrophobicContact CD2-CG 3.56Å; Y239-P289 HydrophobicContact CE2-CG 3.99Å; Y239-H293 PolarHBondContact OH-CE1 3.02Å; Y239-H293 VanDerWaalsContact OH-CE1 3.31Å
240	P	91.8	Very high	96.9	Very high	98 Å²	98	62.1 Å²	62.1	64%	0.636	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-9.2	-179.4	-25.4	34.4	0	0	0	115.4	E238	E238-P240 WeakPolarHBondContact O-CD 3.04Å
241	S	94.9	Very high	96.9	Very high	114 Å²	114	64 Å²	64	80%	0.797	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.2	173	57.2	0	0	0	0	114.1	Y239	Y239-S241 PolarHBondContact O-N 3.13Å
242	K	96.8	Very high	96.9	Very high	89 Å²	89	63 Å²	63	39%	0.387	35%	0.354	S	S	.	.			trans	-110	153.8	176.7	-63.6	-179.5	-177.9	170.5	0	109.7	D236 Y239 P289	D236-K242 HydrophobicContact CB-CB 4.1Å; D236-K242 PolarHBondContact N-O 2.94Å; Y239-K242 HydrophobicContact CD2-CD 4.31Å; Y239-K242 HydrophobicContact CG-CD 4.17Å; Y239-K242 PolarHBondContact O-N 3.31Å; K242-P289 HydrophobicContact CD-CB 4.17Å; K242-P289 HydrophobicContact CD-CG 3.76Å
243	T	97.3	Very high	96.9	Very high	65 Å²	65	58.6 Å²	58.6	40%	0.399	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-128.2	170	177.9	54.7	0	0	0	0	110.7	K232 T234 L235	K232-T243 WeakPolarHBondContact O-CB 3.35Å; K232-T243 PolarHBondContact O-OG1 2.89Å; T234-T243 CarbonylContact O-C 3.45Å; T234-T243 WeakPolarHBondContact O-CA 3.4Å; L235-T243 HydrophobicContact CD2-CG2 4.01Å
244	G	97.8	Very high	97	Very high	4 Å²	4	55.9 Å²	55.9	4%	0.041	32%	0.324	C	S	.	.			trans	-59.3	173	163.2	0	0	0	0	0	112.7	E227 L230 P231 K232 T234	E227-G244 CarbonylContact O-C 3.18Å; E227-G244 WeakPolarHBondContact O-CA 3.33Å; L230-G244 WeakPolarHBondContact O-CA 3.49Å; P231-G244 WeakPolarHBondContact O-CA 3.33Å; K232-G244 WeakPolarHBondContact CA-O 3.26Å; T234-G244 PolarHBondContact O-N 3.12Å
245	N	97.3	Very high	97	Very high	37 Å²	37	56 Å²	56	20%	0.198	32%	0.321	C	S	.	.			trans	-123.2	-6.6	-175.7	173.8	-113.1	0	0	0	113.1	S192 S194 E227 L230	S192-N245 WeakPolarHBondContact CB-OD1 3.34Å; S192-N245 PolarHBondContact OG-OD1 2.61Å; S194-N245 WeakPolarHBondContact CB-O 3.38Å; S194-N245 VanDerWaalsContact OG-CG 3.25Å; S194-N245 PolarHBondContact OG-ND2 3.1Å; S194-N245 PolarHBondContact OG-O 3.48Å; S194-N245 PolarHBondContact OG-OD1 3.24Å; E227-N245 HydrophobicContact CG-CB 3.51Å; E227-N245 PolarHBondContact O-N 2.81Å; L230-N245 PolarHBondContact O-N 2.87Å
246	R	98.1	Very high	97	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.008	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-74	131.5	-179.6	-56.8	-168.3	70.4	78.3	3	113.3	D193 D207 Y228 L230 K232 D248 T250	D193-R246 WeakPolarHBondContact OD1-CA 3.22Å; D193-R246 VanDerWaalsContact OD1-CB 3.27Å; D193-R246 WeakPolarHBondContact OD1-CB 3.13Å; D193-R246 WeakPolarHBondContact OD1-CG 3.49Å; D193-R246 IonicContact OD1-CZ 3.77Å; D193-R246 IonicContact OD1-NE 3.45Å; D193-R246 IonicContact OD1-NH1 3.58Å; D193-R246 IonicContact OD1-NH2 3.02Å; D207-R246 IonicContact OD1-CZ 2.72Å; D207-R246 IonicContact OD1-NH1 2.71Å; D207-R246 PolarHBondContact OD1-NH1 2.83Å; D207-R246 IonicContact OD1-NH2 3.63Å; D207-R246 IonicContact OD2-CZ 2.79Å; D207-R246 IonicContact OD2-NH1 3.51Å; D207-R246 IonicContact OD2-NH2 2.99Å; D207-R246 PolarHBondContact OD2-NH2 3.11Å; Y228-R246 VanDerWaalsContact O-CD 3.3Å; Y228-R246 WeakPolarHBondContact O-CD 3.34Å; Y228-R246 VanDerWaalsContact O-CG 3.23Å; Y228-R246 WeakPolarHBondContact O-CG 3.47Å; Y228-R246 PolarHBondContact O-NH1 3.32Å; L230-R246 WeakPolarHBondContact O-CB 3.37Å; L230-R246 WeakPolarHBondContact O-CG 3.38Å; L230-R246 PolarHBondContact O-N 3.19Å; K232-R246 PolarHBondContact N-O 2.99Å; R246-D248 IonicContact CZ-OD1 2.95Å; R246-D248 IonicContact CZ-OD2 3.77Å; R246-D248 IonicContact NE-OD1 3.01Å; R246-D248 PolarHBondContact NE-OD1 2.93Å; R246-D248 VanDerWaalsContact NE-OD1 3.1Å; R246-D248 IonicContact NE-OD2 3.52Å; R246-D248 PolarHBondContact NE-OD2 3.45Å; R246-D248 IonicContact NH2-OD1 3.51Å; R246-D248 IonicContact NH2-OD2 3.69Å; R246-D248 PolarHBondContact NH2-OD2 3.04Å; R246-T250 WeakPolarHBondContact CD-O 3.14Å
247	E	97.3	Very high	96.9	Very high	137 Å²	137	52.9 Å²	52.9	64%	0.64	31%	0.311	S	S	*	.	S	Bend	trans	-92.1	-21.8	177	-63.8	-163.2	154.4	0	0	112.8	D193 G249	D193-E247 WeakPolarHBondContact OD2-CA 3.45Å; D193-E247 WeakPolarHBondContact OD2-CB 3.4Å; D193-E247 PolarHBondContact OD2-N 2.76Å; E247-G249 PolarHBondContact O-N 2.96Å
248	D	96.3	Very high	96.8	Very high	75 Å²	75	55.8 Å²	55.8	40%	0.401	32%	0.317	S	S	.	.	S	Bend	trans	-71.7	-7.6	178.9	70.8	2.6	0	0	0	114.9	D193 R246 T250	D193-D248 PolarHBondContact OD2-N 3.4Å; R246-D248 IonicContact CZ-OD1 2.95Å; R246-D248 IonicContact CZ-OD2 3.77Å; R246-D248 IonicContact NE-OD1 3.01Å; R246-D248 PolarHBondContact NE-OD1 2.93Å; R246-D248 VanDerWaalsContact NE-OD1 3.1Å; R246-D248 IonicContact NE-OD2 3.52Å; R246-D248 PolarHBondContact NE-OD2 3.45Å; R246-D248 IonicContact NH2-OD1 3.51Å; R246-D248 IonicContact NH2-OD2 3.69Å; R246-D248 PolarHBondContact NH2-OD2 3.04Å; D248-T250 PolarHBondContact O-N 3.05Å; D248-T250 VanDerWaalsContact OD1-CB 3.22Å; D248-T250 WeakPolarHBondContact OD1-CB 3.35Å; D248-T250 PolarHBondContact OD1-N 2.9Å; D248-T250 PolarHBondContact OD1-OG1 2.81Å; D248-T250 PolarHBondContact OD2-OG1 2.97Å
249	G	96.1	Very high	96.2	Very high	53 Å²	53	62.4 Å²	62.4	55%	0.546	35%	0.354	S	S	.	.			trans	74.1	6.8	-179.7	0	0	0	0	0	114.6	E247	E247-G249 PolarHBondContact O-N 2.96Å
250	T	97.1	Very high	96.1	Very high	42 Å²	42	61.3 Å²	61.3	26%	0.258	35%	0.35	S	S	.	.			trans	-79.4	138	-179.9	-59.6	0	0	0	0	111.5	P231 R246 D248 L252 E255	P231-T250 VanDerWaalsContact CD-O 3.27Å; P231-T250 WeakPolarHBondContact CD-O 2.86Å; P231-T250 WeakPolarHBondContact CG-O 3.33Å; R246-T250 WeakPolarHBondContact CD-O 3.14Å; D248-T250 PolarHBondContact O-N 3.05Å; D248-T250 VanDerWaalsContact OD1-CB 3.22Å; D248-T250 WeakPolarHBondContact OD1-CB 3.35Å; D248-T250 PolarHBondContact OD1-N 2.9Å; D248-T250 PolarHBondContact OD1-OG1 2.81Å; D248-T250 PolarHBondContact OD2-OG1 2.97Å; T250-L252 HydrophobicContact CG2-CD2 3.67Å; T250-L252 HydrophobicContact CG2-CG 4.11Å; T250-E255 WeakPolarHBondContact CG2-OE2 3.43Å
251	N	98.2	Very high	96.2	Very high	49 Å²	49	64.7 Å²	64.7	26%	0.262	36%	0.355	S	S	.	.			trans	-103.1	100.8	164.9	-174.4	-41.5	0	0	0	109.3	P231 I253 V254 E255	P231-N251 HydrophobicContact CG-CB 4.33Å; N251-I253 VanDerWaalsContact C-N 3.28Å; N251-I253 PolarHBondContact O-N 2.81Å; N251-I253 WeakPolarHBondContact OD1-CB 3.36Å; N251-I253 PolarHBondContact OD1-N 2.89Å; N251-I253 VanDerWaalsContact OD1-N 3.12Å; N251-V254 HydrophobicContact CB-CB 4.3Å; N251-V254 HydrophobicContact CB-CG2 4.23Å; N251-V254 PolarHBondContact O-N 2.88Å; N251-V254 PolarHBondContact OD1-N 2.91Å; N251-E255 PolarHBondContact O-N 3.35Å
252	L	98.5	Very high	96.3	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-70.6	-22.7	-175.2	-69.6	179.4	0	0	0	113	A209 I213 M229 T250 E255 W256	A209-L252 VanDerWaalsContact C-CD1 3.49Å; A209-L252 HydrophobicContact CB-CD1 3.72Å; A209-L252 WeakPolarHBondContact O-CD1 3.47Å; I213-L252 HydrophobicContact CG1-CB 4.36Å; M229-L252 HydrophobicContact CB-CB 4.35Å; M229-L252 HydrophobicContact CE-CB 3.45Å; M229-L252 VanDerWaalsContact CE-CB 3.45Å; M229-L252 HydrophobicContact CE-CD1 4.25Å; M229-L252 PolarHBondContact O-N 2.8Å; M229-L252 HydrophobicContact SD-CB 4.13Å; M229-L252 HydrophobicContact SD-CD1 4.05Å; T250-L252 HydrophobicContact CG2-CD2 3.67Å; T250-L252 HydrophobicContact CG2-CG 4.11Å; L252-E255 WeakPolarHBondContact CD2-OE2 3.13Å; L252-W256 VanDerWaalsContact O-CB 3.22Å; L252-W256 WeakPolarHBondContact O-CB 3.41Å; L252-W256 PolarHBondContact O-N 2.9Å
253	I	98.2	Very high	96.4	Very high	13 Å²	13	60.9 Å²	60.9	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-66.9	-44.8	173.1	-67.6	153.5	0	0	0	110	M229 L230 N251 A257 Y265 L284 L286	M229-I253 HydrophobicContact CB-CD1 3.95Å; M229-I253 HydrophobicContact CB-CG1 3.9Å; L230-I253 HydrophobicContact CD2-CD1 3.8Å; L230-I253 HydrophobicContact CG-CD1 4.24Å; N251-I253 VanDerWaalsContact C-N 3.28Å; N251-I253 PolarHBondContact O-N 2.81Å; N251-I253 WeakPolarHBondContact OD1-CB 3.36Å; N251-I253 PolarHBondContact OD1-N 2.89Å; N251-I253 VanDerWaalsContact OD1-N 3.12Å; I253-A257 PolarHBondContact O-N 3.33Å; I253-Y265 HydrophobicContact CD1-CE1 4.29Å; I253-Y265 HydrophobicContact CD1-CE2 3.81Å; I253-Y265 HydrophobicContact CG1-CD2 4.32Å; I253-Y265 HydrophobicContact CG1-CE2 3.98Å; I253-Y265 HydrophobicContact CG2-CD1 3.77Å; I253-Y265 HydrophobicContact CG2-CD2 3.6Å; I253-Y265 HydrophobicContact CG2-CE1 4.13Å; I253-Y265 HydrophobicContact CG2-CE2 3.97Å; I253-Y265 HydrophobicContact CG2-CG 3.48Å; I253-Y265 VanDerWaalsContact CG2-CG 3.48Å; I253-L284 HydrophobicContact CB-CD2 4.45Å; I253-L284 HydrophobicContact CG1-CD2 4.03Å; I253-L284 HydrophobicContact CG2-CD2 4.32Å; I253-L286 HydrophobicContact CD1-CD1 4.29Å; I253-L286 HydrophobicContact CG1-CD1 4.24Å
254	V	97.5	Very high	96.4	Very high	83 Å²	83	63.2 Å²	63.2	50%	0.503	34%	0.338	S	S	.	.	H	α-helix	trans	-65.5	-44	176.2	173.3	0	0	0	0	110.2	N251 A257 K258	N251-V254 HydrophobicContact CB-CB 4.3Å; N251-V254 HydrophobicContact CB-CG2 4.23Å; N251-V254 PolarHBondContact O-N 2.88Å; N251-V254 PolarHBondContact OD1-N 2.91Å; V254-A257 PolarHBondContact O-N 3.27Å; V254-K258 WeakPolarHBondContact O-CG 3.45Å; V254-K258 PolarHBondContact O-N 3.11Å
255	E	97.3	Very high	96.5	Very high	52 Å²	52	66.4 Å²	66.4	24%	0.243	35%	0.35	C	S	.	.	H	α-helix	trans	-60.4	-45.8	176.8	-179.8	153.8	-133.7	0	0	112.7	H214 T250 N251 L252 A257 K258	H214-E255 IonicContact CE1-OE1 3.93Å; H214-E255 IonicContact CE1-OE2 3.65Å; H214-E255 IonicContact NE2-OE1 3.45Å; H214-E255 PolarHBondContact NE2-OE1 3.22Å; H214-E255 IonicContact NE2-OE2 3.96Å; T250-E255 WeakPolarHBondContact CG2-OE2 3.43Å; N251-E255 PolarHBondContact O-N 3.35Å; L252-E255 WeakPolarHBondContact CD2-OE2 3.13Å; E255-A257 VanDerWaalsContact C-N 3.26Å; E255-A257 PolarHBondContact O-N 2.96Å; E255-K258 VanDerWaalsContact O-CB 3.27Å; E255-K258 WeakPolarHBondContact O-CB 3.24Å; E255-K258 PolarHBondContact O-N 2.8Å
256	W	97.7	Very high	96.5	Very high	3 Å²	3	65 Å²	65	1%	0.011	34%	0.342	C	S	.	.	H	α-helix	trans	-56.1	-42	175.3	172.3	85.6	0	0	0	112.2	I213 L252 K258 K260 A263 K264 F282 L284	I213-W256 HydrophobicContact CD1-CB 3.88Å; I213-W256 HydrophobicContact CD1-CG 4.03Å; I213-W256 HydrophobicContact CG1-CB 4.3Å; I213-W256 HydrophobicContact CG2-CB 3.69Å; I213-W256 HydrophobicContact CG2-CG 4.39Å; L252-W256 VanDerWaalsContact O-CB 3.22Å; L252-W256 WeakPolarHBondContact O-CB 3.41Å; L252-W256 PolarHBondContact O-N 2.9Å; W256-K258 PolarHBondContact O-N 3.45Å; W256-K260 HydrophobicContact CD2-CD 4.36Å; W256-K260 HydrophobicContact CZ2-CD 4.24Å; W256-K260 VanDerWaalsContact O-CD 3.25Å; W256-K260 WeakPolarHBondContact O-CD 3.28Å; W256-K260 PolarHBondContact O-NZ 2.91Å; W256-A263 HydrophobicContact CH2-CB 4.11Å; W256-A263 HydrophobicContact CZ3-CB 4.14Å; W256-K264 WeakPolarHBondContact CH2-O 3.21Å; W256-F282 HydrophobicContact CH2-CB 4.01Å; W256-F282 HydrophobicContact CZ2-CB 3.78Å; W256-L284 HydrophobicContact CD2-CB 4.04Å; W256-L284 HydrophobicContact CD2-CD2 3.93Å; W256-L284 HydrophobicContact CE3-CB 3.82Å; W256-L284 HydrophobicContact CE3-CD2 3.84Å; W256-L284 HydrophobicContact CG-CD2 4.24Å; W256-L284 HydrophobicContact CH2-CB 3.45Å; W256-L284 VanDerWaalsContact CH2-CB 3.45Å; W256-L284 VanDerWaalsContact CH2-N 3.32Å; W256-L284 HydrophobicContact CZ2-CB 3.66Å; W256-L284 HydrophobicContact CZ3-CB 3.53Å; W256-L284 HydrophobicContact CZ3-CD2 4.37Å
257	A	96.3	Very high	96.6	Very high	43 Å²	43	68 Å²	68	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-71.1	-18.4	-179.6	0	0	0	0	0	113.2	I253 V254 E255 N259 K260	I253-A257 PolarHBondContact O-N 3.33Å; V254-A257 PolarHBondContact O-N 3.27Å; E255-A257 VanDerWaalsContact C-N 3.26Å; E255-A257 PolarHBondContact O-N 2.96Å; A257-N259 PolarHBondContact O-N 3.02Å; A257-K260 PolarHBondContact O-N 3.36Å
258	K	93.5	Very high	96.6	Very high	119 Å²	119	62.2 Å²	62.2	52%	0.517	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	135.4	179.1	-67.9	173.8	-170.9	165.7	0	109.7	V254 E255 W256 K260	V254-K258 WeakPolarHBondContact O-CG 3.45Å; V254-K258 PolarHBondContact O-N 3.11Å; E255-K258 VanDerWaalsContact O-CB 3.27Å; E255-K258 WeakPolarHBondContact O-CB 3.24Å; E255-K258 PolarHBondContact O-N 2.8Å; W256-K258 PolarHBondContact O-N 3.45Å; K258-K260 PolarHBondContact O-N 2.93Å
259	N	86.5	Confident	96.7	Very high	173 Å²	173	59.5 Å²	59.5	93%	0.925	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	2.8	177.1	-52.9	-40	0	0	0	116.4	A257	A257-N259 PolarHBondContact O-N 3.02Å
260	K	94.4	Very high	96.8	Very high	37 Å²	37	61 Å²	61	16%	0.161	31%	0.314	C	S	.	.			trans	-87.6	132.6	173.3	-65.1	-168.5	170.8	88.8	0	110.9	W256 A257 K258 A263 F282	W256-K260 HydrophobicContact CD2-CD 4.36Å; W256-K260 HydrophobicContact CZ2-CD 4.24Å; W256-K260 VanDerWaalsContact O-CD 3.25Å; W256-K260 WeakPolarHBondContact O-CD 3.28Å; W256-K260 PolarHBondContact O-NZ 2.91Å; A257-K260 PolarHBondContact O-N 3.36Å; K258-K260 PolarHBondContact O-N 2.93Å; K260-A263 HydrophobicContact CB-CB 3.69Å; K260-F282 HydrophobicContact CB-CD2 4Å; K260-F282 HydrophobicContact CB-CE2 4.44Å; K260-F282 HydrophobicContact CB-CG 4.35Å; K260-F282 HydrophobicContact CD-CB 3.97Å; K260-F282 HydrophobicContact CD-CD1 3.72Å; K260-F282 HydrophobicContact CD-CD2 4.09Å; K260-F282 HydrophobicContact CD-CE1 4.23Å; K260-F282 HydrophobicContact CD-CG 3.66Å; K260-F282 HydrophobicContact CG-CD2 4.29Å; K260-F282 HydrophobicContact CG-CE2 4.49Å; K260-F282 HydrophobicContact CG-CG 4.36Å
261	K	94	Very high	96.9	Very high	168 Å²	168	62.3 Å²	62.3	73%	0.73	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	142.2	172.5	-67.5	-177.5	-178.5	176.4	0	109.3	A263	K261-A263 PolarHBondContact O-N 2.94Å; K261-A263 VanDerWaalsContact O-N 3.11Å
262	N	96.8	Very high	96.9	Very high	96 Å²	96	60.1 Å²	60.1	51%	0.513	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	35.1	178.2	-56.2	-38.1	0	0	0	113.9	K279 D281	N262-K279 VanDerWaalsContact CB-O 3.31Å; N262-K279 WeakPolarHBondContact CB-O 3.31Å; N262-D281 HydrophobicContact CB-CB 4.16Å; N262-D281 WeakPolarHBondContact CB-OD2 3.39Å; N262-D281 PolarHBondContact ND2-OD2 3.18Å; N262-D281 PolarHBondContact O-N 2.91Å; N262-D281 VanDerWaalsContact O-N 3.15Å
263	A	97.9	Very high	96.9	Very high	28 Å²	28	64.2 Å²	64.2	23%	0.231	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	141.1	176	0	0	0	0	0	111.3	W256 K260 K261 F282	W256-A263 HydrophobicContact CH2-CB 4.11Å; W256-A263 HydrophobicContact CZ3-CB 4.14Å; K260-A263 HydrophobicContact CB-CB 3.69Å; K261-A263 PolarHBondContact O-N 2.94Å; K261-A263 VanDerWaalsContact O-N 3.11Å; A263-F282 CarbonylContact C-O 3.55Å; A263-F282 VanDerWaalsContact CA-O 3.31Å; A263-F282 WeakPolarHBondContact CA-O 3.17Å; A263-F282 HydrophobicContact CB-CB 3.97Å
264	K	98.4	Very high	96.9	Very high	113 Å²	113	67.5 Å²	67.5	49%	0.491	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.3	176.3	-66.6	-65.1	-178.5	179.5	0	110.1	W256 T280 F282 L283 L284	W256-K264 WeakPolarHBondContact CH2-O 3.21Å; K264-T280 HydrophobicContact CB-CG2 4.13Å; K264-T280 HydrophobicContact CG-CG2 3.94Å; K264-F282 PolarHBondContact N-O 2.59Å; K264-L283 HydrophobicContact CB-CD1 4Å; K264-L283 WeakPolarHBondContact O-CA 3.37Å; K264-L284 PolarHBondContact O-N 2.71Å
265	Y	98.6	Very high	97	Very high	72 Å²	72	64 Å²	64	28%	0.282	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133	164.2	171.9	-111.4	0	0	0	108.9	R226 I253 W267 L284 L286	R226-Y265 WeakPolarHBondContact CD-OH 3.31Å; I253-Y265 HydrophobicContact CD1-CE1 4.29Å; I253-Y265 HydrophobicContact CD1-CE2 3.81Å; I253-Y265 HydrophobicContact CG1-CD2 4.32Å; I253-Y265 HydrophobicContact CG1-CE2 3.98Å; I253-Y265 HydrophobicContact CG2-CD1 3.77Å; I253-Y265 HydrophobicContact CG2-CD2 3.6Å; I253-Y265 HydrophobicContact CG2-CE1 4.13Å; I253-Y265 HydrophobicContact CG2-CE2 3.97Å; I253-Y265 HydrophobicContact CG2-CG 3.48Å; I253-Y265 VanDerWaalsContact CG2-CG 3.48Å; Y265-W267 HydrophobicContact CE1-CB 4.39Å; Y265-W267 AromaticContact CE1-CD1 3.91Å; Y265-L284 CarbonylContact C-O 3.58Å; Y265-L284 VanDerWaalsContact CA-O 3.24Å; Y265-L284 WeakPolarHBondContact CA-O 3.32Å; Y265-L284 HydrophobicContact CD2-CB 4.2Å; Y265-L284 HydrophobicContact CD2-CD2 3.95Å; Y265-L284 HydrophobicContact CD2-CG 3.87Å; Y265-L284 WeakPolarHBondContact CD2-O 3.47Å; Y265-L284 HydrophobicContact CE2-CD2 4.44Å; Y265-L284 HydrophobicContact CE2-CG 4.35Å; Y265-L286 HydrophobicContact CE2-CB 4.11Å; Y265-L286 HydrophobicContact CE2-CD1 4.1Å; Y265-L286 HydrophobicContact CE2-CG 4.12Å
266	V	98.8	Very high	97	Very high	7 Å²	7	63.4 Å²	63.4	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.1	175.8	-57.6	0	0	0	0	109.5	D271 F272 V275 L283 L284 G285 L286 F287	V266-D271 HydrophobicContact CB-CB 3.91Å; V266-D271 HydrophobicContact CG1-CB 3.83Å; V266-F272 HydrophobicContact CG2-CB 4.3Å; V266-V275 HydrophobicContact CG1-CG2 3.77Å; V266-L283 HydrophobicContact CG1-CD1 4.36Å; V266-L283 HydrophobicContact CG2-CD1 4.03Å; V266-L284 PolarHBondContact N-O 2.78Å; V266-G285 VanDerWaalsContact O-CA 3.28Å; V266-G285 WeakPolarHBondContact O-CA 3.32Å; V266-L286 PolarHBondContact O-N 2.79Å; V266-F287 HydrophobicContact CG2-CE1 4.08Å; V266-F287 HydrophobicContact CG2-CZ 4.19Å
267	W	98.2	Very high	97.1	Very high	65 Å²	65	64.4 Å²	64.4	25%	0.246	34%	0.342	C	S	.	.			trans	-138.1	-2.4	-179.6	59.6	-91.5	0	0	0	113.9	R226 P237 E238 Y265 L286 M302	R226-W267 PolarHBondContact NH1-O 3.29Å; P237-W267 HydrophobicContact CB-CD2 3.9Å; P237-W267 HydrophobicContact CB-CE3 4.15Å; P237-W267 HydrophobicContact CB-CG 4.46Å; P237-W267 HydrophobicContact CB-CH2 4.26Å; P237-W267 HydrophobicContact CB-CZ2 4.02Å; P237-W267 HydrophobicContact CB-CZ3 4.32Å; P237-W267 HydrophobicContact CG-CB 4.5Å; P237-W267 HydrophobicContact CG-CD2 3.77Å; P237-W267 HydrophobicContact CG-CE3 4Å; P237-W267 HydrophobicContact CG-CG 3.98Å; E238-W267 HydrophobicContact CB-CE3 4.36Å; E238-W267 HydrophobicContact CB-CZ3 4.06Å; Y265-W267 HydrophobicContact CE1-CB 4.39Å; Y265-W267 AromaticContact CE1-CD1 3.91Å; W267-L286 VanDerWaalsContact CA-O 3.26Å; W267-L286 WeakPolarHBondContact CA-O 3.19Å; W267-L286 VanDerWaalsContact CB-O 3.3Å; W267-L286 WeakPolarHBondContact CB-O 3.35Å; W267-M302 HydrophobicContact CZ3-CE 4.08Å
268	N	98.3	Very high	97.1	Very high	15 Å²	15	71.5 Å²	71.5	8%	0.08	36%	0.36	C	S	.	.	S	Bend	trans	-138.3	169.1	177.8	63.5	64.1	0	0	0	110.9	S270 D271 F272 M302	N268-S270 WeakPolarHBondContact OD1-CB 3.37Å; N268-S270 PolarHBondContact OD1-N 2.81Å; N268-S270 VanDerWaalsContact OD1-N 3.09Å; N268-D271 PolarHBondContact ND2-OD2 3.5Å; N268-D271 PolarHBondContact OD1-N 2.98Å; N268-F272 VanDerWaalsContact O-CB 3.29Å; N268-F272 WeakPolarHBondContact O-CB 3.21Å; N268-F272 PolarHBondContact O-N 2.97Å; N268-M302 CarbonylContact C-O 3.49Å; N268-M302 WeakPolarHBondContact CA-O 3.37Å; N268-M302 HydrophobicContact CB-CE 4.29Å
269	K	98.2	Very high	97.3	Very high	19 Å²	19	72.9 Å²	72.9	8%	0.083	37%	0.366	C	S	.	.	H	α-helix	trans	-61	-43.4	-178.7	-173.5	60.1	162.6	82.2	0	113.7	F272 D273 S301 M302 P304 E308	K269-F272 HydrophobicContact CD-CD1 4.38Å; K269-F272 WeakPolarHBondContact O-CB 3.06Å; K269-F272 PolarHBondContact O-N 3.3Å; K269-D273 IonicContact NZ-OD1 3.72Å; K269-D273 PolarHBondContact NZ-OD1 2.71Å; K269-D273 IonicContact NZ-OD2 3.26Å; K269-D273 PolarHBondContact NZ-OD2 2.91Å; K269-D273 WeakPolarHBondContact O-CB 3.39Å; K269-D273 VanDerWaalsContact O-CG 3.28Å; K269-D273 PolarHBondContact O-N 2.84Å; K269-S301 WeakPolarHBondContact CB-O 3.22Å; K269-M302 WeakPolarHBondContact CB-O 3.41Å; K269-M302 PolarHBondContact N-O 2.76Å; K269-P304 HydrophobicContact CD-CB 3.98Å; K269-E308 VanDerWaalsContact CE-CD 3.43Å; K269-E308 WeakPolarHBondContact CE-OE1 3.42Å; K269-E308 WeakPolarHBondContact CE-OE2 3.19Å; K269-E308 IonicContact NZ-OE1 3.93Å; K269-E308 PolarHBondContact NZ-OE1 3.01Å; K269-E308 IonicContact NZ-OE2 3.69Å
270	S	98.5	Very high	97.9	Very high	84 Å²	84	64.9 Å²	64.9	59%	0.587	32%	0.323	S	S	*	.	H	α-helix	trans	-61.7	-48.5	-178.1	-179.3	0	0	0	0	111.4	N268 D273 A274	N268-S270 WeakPolarHBondContact OD1-CB 3.37Å; N268-S270 PolarHBondContact OD1-N 2.81Å; N268-S270 VanDerWaalsContact OD1-N 3.09Å; S270-D273 PolarHBondContact O-N 3.12Å; S270-A274 WeakPolarHBondContact O-CB 3.38Å; S270-A274 PolarHBondContact O-N 2.88Å
271	D	98.6	Very high	98.1	Very high	69 Å²	69	65.8 Å²	65.8	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-66.6	-39.5	177.6	-69.9	-27.9	0	0	0	111.2	V266 N268 A274 V275	V266-D271 HydrophobicContact CB-CB 3.91Å; V266-D271 HydrophobicContact CG1-CB 3.83Å; N268-D271 PolarHBondContact ND2-OD2 3.5Å; N268-D271 PolarHBondContact OD1-N 2.98Å; D271-A274 PolarHBondContact O-N 2.89Å; D271-V275 WeakPolarHBondContact O-CG2 3.12Å; D271-V275 PolarHBondContact O-N 2.81Å
272	F	98.8	Very high	98.3	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.018	30%	0.3	C	S	.	.	H	α-helix	trans	-59.7	-44.8	174	173.3	-94.1	0	0	0	112.6	L222 V266 N268 K269 A274 V275 F287 P304 E308 M309 K312	L222-F272 HydrophobicContact CD1-CE2 4.1Å; L222-F272 HydrophobicContact CD2-CE2 4.35Å; V266-F272 HydrophobicContact CG2-CB 4.3Å; N268-F272 VanDerWaalsContact O-CB 3.29Å; N268-F272 WeakPolarHBondContact O-CB 3.21Å; N268-F272 PolarHBondContact O-N 2.97Å; K269-F272 HydrophobicContact CD-CD1 4.38Å; K269-F272 WeakPolarHBondContact O-CB 3.06Å; K269-F272 PolarHBondContact O-N 3.3Å; F272-A274 VanDerWaalsContact C-N 3.31Å; F272-A274 PolarHBondContact O-N 3.13Å; F272-V275 WeakPolarHBondContact O-CB 3.44Å; F272-V275 PolarHBondContact O-N 3.43Å; F272-F287 HydrophobicContact CB-CE1 4.06Å; F272-F287 HydrophobicContact CB-CZ 4.43Å; F272-F287 HydrophobicContact CD2-CE1 4.2Å; F272-F287 AromaticContact CD2-CZ 3.71Å; F272-F287 HydrophobicContact CD2-CZ 3.71Å; F272-F287 HydrophobicContact CE2-CZ 4.34Å; F272-F287 HydrophobicContact CG-CE1 4.38Å; F272-F287 HydrophobicContact CG-CZ 4.31Å; F272-P304 HydrophobicContact CD1-CB 3.9Å; F272-P304 HydrophobicContact CD1-CG 4.44Å; F272-P304 HydrophobicContact CD2-CG 4.48Å; F272-P304 HydrophobicContact CE1-CB 3.87Å; F272-P304 HydrophobicContact CG-CB 4.3Å; F272-P304 HydrophobicContact CG-CG 4.34Å; F272-P304 HydrophobicContact CZ-CB 4.23Å; F272-E308 HydrophobicContact CE1-CB 4.11Å; F272-E308 HydrophobicContact CZ-CB 4.45Å; F272-E308 WeakPolarHBondContact CZ-O 3.29Å; F272-M309 HydrophobicContact CE2-CG 4.34Å; F272-M309 HydrophobicContact CZ-CG 4.39Å; F272-K312 HydrophobicContact CE1-CB 4.46Å; F272-K312 HydrophobicContact CE2-CB 3.68Å; F272-K312 HydrophobicContact CE2-CG 3.81Å; F272-K312 HydrophobicContact CZ-CB 3.45Å; F272-K312 VanDerWaalsContact CZ-CB 3.45Å; F272-K312 HydrophobicContact CZ-CG 3.97Å; F272-K312 VanDerWaalsContact O-CE 3.23Å; F272-K312 WeakPolarHBondContact O-CE 3.49Å; F272-K312 PolarHBondContact O-NZ 3.23Å
273	D	98.6	Very high	98.4	Very high	85 Å²	85	54.3 Å²	54.3	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-65.5	-37.4	178.1	-74.3	-15.1	0	0	0	111.3	K269 S270 V275	K269-D273 IonicContact NZ-OD1 3.72Å; K269-D273 PolarHBondContact NZ-OD1 2.71Å; K269-D273 IonicContact NZ-OD2 3.26Å; K269-D273 PolarHBondContact NZ-OD2 2.91Å; K269-D273 WeakPolarHBondContact O-CB 3.39Å; K269-D273 VanDerWaalsContact O-CG 3.28Å; K269-D273 PolarHBondContact O-N 2.84Å; S270-D273 PolarHBondContact O-N 3.12Å; D273-V275 PolarHBondContact O-N 3.37Å
274	A	98.6	Very high	98.5	Very high	82 Å²	82	53 Å²	53	68%	0.678	27%	0.265	S	S	*	.	H	α-helix	trans	-68.3	-15.8	177.8	0	0	0	0	0	114.5	S270 D271 F272 D276	S270-A274 WeakPolarHBondContact O-CB 3.38Å; S270-A274 PolarHBondContact O-N 2.88Å; D271-A274 PolarHBondContact O-N 2.89Å; F272-A274 VanDerWaalsContact C-N 3.31Å; F272-A274 PolarHBondContact O-N 3.13Å; A274-D276 PolarHBondContact O-N 3.35Å; A274-D276 VanDerWaalsContact O-N 3.15Å
275	V	98.7	Very high	98.5	Very high	11 Å²	11	47.6 Å²	47.6	7%	0.067	24%	0.241	C	C	.	.			trans	-64.5	114.2	175.7	176.8	0	0	0	0	110.5	V266 D271 F272 D273 P277 T280 L283 K312 I316	V266-V275 HydrophobicContact CG1-CG2 3.77Å; D271-V275 WeakPolarHBondContact O-CG2 3.12Å; D271-V275 PolarHBondContact O-N 2.81Å; F272-V275 WeakPolarHBondContact O-CB 3.44Å; F272-V275 PolarHBondContact O-N 3.43Å; D273-V275 PolarHBondContact O-N 3.37Å; V275-P277 WeakPolarHBondContact O-CD 3.38Å; V275-T280 HydrophobicContact CG1-CG2 4.03Å; V275-T280 WeakPolarHBondContact CG1-OG1 3.43Å; V275-L283 HydrophobicContact CG1-CD1 4.34Å; V275-L283 HydrophobicContact CG1-CD2 4.31Å; V275-L283 HydrophobicContact CG2-CD1 3.91Å; V275-K312 HydrophobicContact CB-CD 4.37Å; V275-K312 HydrophobicContact CG1-CD 4.29Å; V275-K312 PolarHBondContact O-NZ 3.26Å; V275-I316 HydrophobicContact CG1-CD1 4.46Å
276	D	98.5	Very high	98.5	Very high	39 Å²	39	44.1 Å²	44.1	21%	0.209	23%	0.228	C	C	.	.			trans	-77.9	108.1	168.3	-173.8	-13.1	0	0	0	109.5	A274 R278 K279 T280	A274-D276 PolarHBondContact O-N 3.35Å; A274-D276 VanDerWaalsContact O-N 3.15Å; D276-R278 PolarHBondContact O-N 3.33Å; D276-R278 VanDerWaalsContact O-N 3.16Å; D276-R278 WeakPolarHBondContact OD1-CB 3.34Å; D276-R278 IonicContact OD1-CZ 3.48Å; D276-R278 PolarHBondContact OD1-N 3.1Å; D276-R278 IonicContact OD1-NE 2.75Å; D276-R278 PolarHBondContact OD1-NE 3.12Å; D276-R278 IonicContact OD1-NH2 3.34Å; D276-R278 IonicContact OD2-CZ 2.99Å; D276-R278 IonicContact OD2-NE 3.76Å; D276-R278 IonicContact OD2-NH2 3.8Å; D276-R278 PolarHBondContact OD2-NH2 3.15Å; D276-K279 HydrophobicContact CB-CB 4.44Å; D276-K279 PolarHBondContact O-N 2.81Å; D276-K279 VanDerWaalsContact O-N 3.14Å; D276-T280 WeakPolarHBondContact O-CB 3.44Å; D276-T280 PolarHBondContact O-N 2.59Å; D276-T280 PolarHBondContact O-OG1 2.9Å
277	P	98.3	Very high	98.4	Very high	23 Å²	23	43.9 Å²	43.9	15%	0.149	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.1	-176.1	27.9	-35.4	0	0	0	112.8	V275 K279 K312 K315 I316 K319	V275-P277 WeakPolarHBondContact O-CD 3.38Å; P277-K279 VanDerWaalsContact C-N 3.32Å; P277-K312 HydrophobicContact CB-CD 4.39Å; P277-K315 HydrophobicContact CB-CB 3.67Å; P277-K315 HydrophobicContact CG-CB 3.94Å; P277-K315 HydrophobicContact CG-CD 4.16Å; P277-I316 HydrophobicContact CB-CG1 3.66Å; P277-K319 WeakPolarHBondContact O-CE 3.27Å
278	R	97.7	Very high	98.4	Very high	192 Å²	192	41 Å²	41	73%	0.725	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-29	178.6	-59.5	168.6	-63.1	-178	4.5	111.9	D276	D276-R278 PolarHBondContact O-N 3.33Å; D276-R278 VanDerWaalsContact O-N 3.16Å; D276-R278 WeakPolarHBondContact OD1-CB 3.34Å; D276-R278 IonicContact OD1-CZ 3.48Å; D276-R278 PolarHBondContact OD1-N 3.1Å; D276-R278 IonicContact OD1-NE 2.75Å; D276-R278 PolarHBondContact OD1-NE 3.12Å; D276-R278 IonicContact OD1-NH2 3.34Å; D276-R278 IonicContact OD2-CZ 2.99Å; D276-R278 IonicContact OD2-NE 3.76Å; D276-R278 IonicContact OD2-NH2 3.8Å; D276-R278 PolarHBondContact OD2-NH2 3.15Å
279	K	97.8	Very high	98.4	Very high	148 Å²	148	40.4 Å²	40.4	64%	0.643	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-9.9	-174.3	-63.4	-178.4	-177.8	176.3	0	113.9	N262 D276 P277	N262-K279 VanDerWaalsContact CB-O 3.31Å; N262-K279 WeakPolarHBondContact CB-O 3.31Å; D276-K279 HydrophobicContact CB-CB 4.44Å; D276-K279 PolarHBondContact O-N 2.81Å; D276-K279 VanDerWaalsContact O-N 3.14Å; P277-K279 VanDerWaalsContact C-N 3.32Å
280	T	98.6	Very high	98.2	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.031	23%	0.232	C	C	.	.			trans	-99.3	119.4	-176	-56.1	0	0	0	0	109.1	K264 V275 D276 F282 L283 I316 K319	K264-T280 HydrophobicContact CB-CG2 4.13Å; K264-T280 HydrophobicContact CG-CG2 3.94Å; V275-T280 HydrophobicContact CG1-CG2 4.03Å; V275-T280 WeakPolarHBondContact CG1-OG1 3.43Å; D276-T280 WeakPolarHBondContact O-CB 3.44Å; D276-T280 PolarHBondContact O-N 2.59Å; D276-T280 PolarHBondContact O-OG1 2.9Å; T280-F282 VanDerWaalsContact CG2-O 3.28Å; T280-F282 WeakPolarHBondContact CG2-O 3.2Å; T280-L283 HydrophobicContact CG2-CB 4.17Å; T280-I316 HydrophobicContact CG2-CD1 4.26Å; T280-I316 WeakPolarHBondContact O-CG2 3.47Å; T280-K319 WeakPolarHBondContact O-CE 3.18Å; T280-K319 PolarHBondContact O-NZ 2.83Å
281	D	98.2	Very high	98	Very high	57 Å²	57	43 Å²	43	31%	0.305	21%	0.21	S	C	.	.	S	Bend	trans	-94.3	-32.5	179	-61.9	-34.2	0	0	0	111.3	N262 K319	N262-D281 HydrophobicContact CB-CB 4.16Å; N262-D281 WeakPolarHBondContact CB-OD2 3.39Å; N262-D281 PolarHBondContact ND2-OD2 3.18Å; N262-D281 PolarHBondContact O-N 2.91Å; N262-D281 VanDerWaalsContact O-N 3.15Å; D281-K319 IonicContact OD1-NZ 2.72Å; D281-K319 PolarHBondContact OD1-NZ 2.86Å
282	F	98.8	Very high	97.8	Very high	22 Å²	22	40.1 Å²	40.1	10%	0.096	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.2	176.7	-65.2	-87.6	0	0	0	111.2	E217 D219 W256 K260 A263 K264 T280	E217-F282 HydrophobicContact CG-CE1 3.71Å; E217-F282 HydrophobicContact CG-CZ 4.14Å; D219-F282 CarbonylContact O-C 3.54Å; D219-F282 WeakPolarHBondContact O-CA 3.22Å; W256-F282 HydrophobicContact CH2-CB 4.01Å; W256-F282 HydrophobicContact CZ2-CB 3.78Å; K260-F282 HydrophobicContact CB-CD2 4Å; K260-F282 HydrophobicContact CB-CE2 4.44Å; K260-F282 HydrophobicContact CB-CG 4.35Å; K260-F282 HydrophobicContact CD-CB 3.97Å; K260-F282 HydrophobicContact CD-CD1 3.72Å; K260-F282 HydrophobicContact CD-CD2 4.09Å; K260-F282 HydrophobicContact CD-CE1 4.23Å; K260-F282 HydrophobicContact CD-CG 3.66Å; K260-F282 HydrophobicContact CG-CD2 4.29Å; K260-F282 HydrophobicContact CG-CE2 4.49Å; K260-F282 HydrophobicContact CG-CG 4.36Å; A263-F282 CarbonylContact C-O 3.55Å; A263-F282 VanDerWaalsContact CA-O 3.31Å; A263-F282 WeakPolarHBondContact CA-O 3.17Å; A263-F282 HydrophobicContact CB-CB 3.97Å; K264-F282 PolarHBondContact N-O 2.59Å; T280-F282 VanDerWaalsContact CG2-O 3.28Å; T280-F282 WeakPolarHBondContact CG2-O 3.2Å
283	L	98.9	Very high	97.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.5	178.3	179.9	61.7	0	0	0	110.6	D219 V220 I221 L222 K264 V266 V275 T280 K312 I316	D219-L283 PolarHBondContact O-N 3.21Å; V220-L283 CarbonylContact C-O 3.48Å; V220-L283 WeakPolarHBondContact CA-O 3.49Å; V220-L283 HydrophobicContact CG1-CB 4.47Å; I221-L283 PolarHBondContact N-O 3.04Å; L222-L283 HydrophobicContact CD1-CD2 4.48Å; L222-L283 HydrophobicContact CD2-CD2 3.81Å; L222-L283 HydrophobicContact CD2-CG 3.95Å; K264-L283 HydrophobicContact CB-CD1 4Å; K264-L283 WeakPolarHBondContact O-CA 3.37Å; V266-L283 HydrophobicContact CG1-CD1 4.36Å; V266-L283 HydrophobicContact CG2-CD1 4.03Å; V275-L283 HydrophobicContact CG1-CD1 4.34Å; V275-L283 HydrophobicContact CG1-CD2 4.31Å; V275-L283 HydrophobicContact CG2-CD1 3.91Å; T280-L283 HydrophobicContact CG2-CB 4.17Å; L283-K312 HydrophobicContact CD2-CG 3.84Å; L283-I316 HydrophobicContact CB-CD1 3.87Å; L283-I316 HydrophobicContact CD2-CD1 3.58Å; L283-I316 HydrophobicContact CG-CD1 4.37Å
284	L	98.9	Very high	97.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	110.4	168.2	178.4	62.4	0	0	0	108.1	I221 I253 W256 K264 Y265 V266 L286	I221-L284 HydrophobicContact CB-CD1 3.68Å; I221-L284 HydrophobicContact CD1-CD1 4.14Å; I221-L284 HydrophobicContact CG2-CD1 3.63Å; I221-L284 CarbonylContact O-C 3.54Å; I221-L284 WeakPolarHBondContact O-CA 3.23Å; I253-L284 HydrophobicContact CB-CD2 4.45Å; I253-L284 HydrophobicContact CG1-CD2 4.03Å; I253-L284 HydrophobicContact CG2-CD2 4.32Å; W256-L284 HydrophobicContact CD2-CB 4.04Å; W256-L284 HydrophobicContact CD2-CD2 3.93Å; W256-L284 HydrophobicContact CE3-CB 3.82Å; W256-L284 HydrophobicContact CE3-CD2 3.84Å; W256-L284 HydrophobicContact CG-CD2 4.24Å; W256-L284 HydrophobicContact CH2-CB 3.45Å; W256-L284 VanDerWaalsContact CH2-CB 3.45Å; W256-L284 VanDerWaalsContact CH2-N 3.32Å; W256-L284 HydrophobicContact CZ2-CB 3.66Å; W256-L284 HydrophobicContact CZ3-CB 3.53Å; W256-L284 HydrophobicContact CZ3-CD2 4.37Å; K264-L284 PolarHBondContact O-N 2.71Å; Y265-L284 CarbonylContact C-O 3.58Å; Y265-L284 VanDerWaalsContact CA-O 3.24Å; Y265-L284 WeakPolarHBondContact CA-O 3.32Å; Y265-L284 HydrophobicContact CD2-CB 4.2Å; Y265-L284 HydrophobicContact CD2-CD2 3.95Å; Y265-L284 HydrophobicContact CD2-CG 3.87Å; Y265-L284 WeakPolarHBondContact CD2-O 3.47Å; Y265-L284 HydrophobicContact CE2-CD2 4.44Å; Y265-L284 HydrophobicContact CE2-CG 4.35Å; V266-L284 PolarHBondContact N-O 2.78Å; L284-L286 HydrophobicContact CD1-CD1 4.2Å; L284-L286 HydrophobicContact CD1-CD2 3.87Å; L284-L286 HydrophobicContact CD1-CG 3.9Å; L284-L286 HydrophobicContact CD2-CD1 4.39Å; L284-L286 HydrophobicContact CG-CD1 4.31Å; L284-L286 HydrophobicContact CG-CG 4.1Å
285	G	98.8	Very high	97.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	112.2	176.5	0	0	0	0	0	110.2	I221 L222 G223 V266	I221-G285 PolarHBondContact O-N 2.98Å; L222-G285 WeakPolarHBondContact CA-O 3.48Å; G223-G285 PolarHBondContact N-O 3.25Å; V266-G285 VanDerWaalsContact O-CA 3.28Å; V266-G285 WeakPolarHBondContact O-CA 3.32Å
286	L	98.6	Very high	96.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	100	179.5	-58.4	179.5	0	0	0	109.7	V173 G223 G224 R226 M229 I253 Y265 V266 W267 L284	V173-L286 HydrophobicContact CG1-CD2 4.13Å; V173-L286 HydrophobicContact CG2-CD2 3.78Å; G223-L286 CarbonylContact O-C 3.29Å; G223-L286 WeakPolarHBondContact O-CA 3.32Å; G224-L286 WeakPolarHBondContact O-CD2 3.4Å; R226-L286 VanDerWaalsContact CD-O 3.23Å; R226-L286 WeakPolarHBondContact CD-O 3.47Å; R226-L286 HydrophobicContact CG-CB 3.37Å; R226-L286 HydrophobicContact CG-CD1 4.29Å; R226-L286 HydrophobicContact CG-CG 4.48Å; R226-L286 WeakPolarHBondContact CG-O 3.39Å; R226-L286 PolarHBondContact NH1-O 2.93Å; M229-L286 HydrophobicContact CB-CD1 4.44Å; M229-L286 HydrophobicContact CG-CD1 3.73Å; I253-L286 HydrophobicContact CD1-CD1 4.29Å; I253-L286 HydrophobicContact CG1-CD1 4.24Å; Y265-L286 HydrophobicContact CE2-CB 4.11Å; Y265-L286 HydrophobicContact CE2-CD1 4.1Å; Y265-L286 HydrophobicContact CE2-CG 4.12Å; V266-L286 PolarHBondContact O-N 2.79Å; W267-L286 VanDerWaalsContact CA-O 3.26Å; W267-L286 WeakPolarHBondContact CA-O 3.19Å; W267-L286 VanDerWaalsContact CB-O 3.3Å; W267-L286 WeakPolarHBondContact CB-O 3.35Å; L284-L286 HydrophobicContact CD1-CD1 4.2Å; L284-L286 HydrophobicContact CD1-CD2 3.87Å; L284-L286 HydrophobicContact CD1-CG 3.9Å; L284-L286 HydrophobicContact CD2-CD1 4.39Å; L284-L286 HydrophobicContact CG-CD1 4.31Å; L284-L286 HydrophobicContact CG-CG 4.1Å
287	F	97.9	Very high	96.6	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	19%	0.186	C	C	.	.			trans	-92.8	-16.2	-164.5	-54.2	-69.5	0	0	0	114.6	L222 G223 R226 V266 F272 P304 M309	L222-F287 HydrophobicContact CB-CE2 4.31Å; L222-F287 HydrophobicContact CD2-CE2 4.12Å; L222-F287 HydrophobicContact CD2-CZ 4.08Å; G223-F287 VanDerWaalsContact O-CD2 3.26Å; G223-F287 WeakPolarHBondContact O-CD2 3.38Å; G223-F287 PolarHBondContact O-N 2.95Å; R226-F287 PolarHBondContact NH1-O 3.12Å; V266-F287 HydrophobicContact CG2-CE1 4.08Å; V266-F287 HydrophobicContact CG2-CZ 4.19Å; F272-F287 HydrophobicContact CB-CE1 4.06Å; F272-F287 HydrophobicContact CB-CZ 4.43Å; F272-F287 HydrophobicContact CD2-CE1 4.2Å; F272-F287 AromaticContact CD2-CZ 3.71Å; F272-F287 HydrophobicContact CD2-CZ 3.71Å; F272-F287 HydrophobicContact CE2-CZ 4.34Å; F272-F287 HydrophobicContact CG-CE1 4.38Å; F272-F287 HydrophobicContact CG-CZ 4.31Å; F287-P304 VanDerWaalsContact CD1-CD 3.48Å; F287-P304 HydrophobicContact CD1-CG 3.8Å; F287-P304 HydrophobicContact CD2-CG 3.82Å; F287-P304 HydrophobicContact CE1-CG 3.65Å; F287-P304 HydrophobicContact CE2-CG 3.69Å; F287-P304 HydrophobicContact CG-CG 3.89Å; F287-P304 HydrophobicContact CZ-CG 3.6Å; F287-M309 HydrophobicContact CD2-SD 3.65Å; F287-M309 HydrophobicContact CE2-CG 4.16Å; F287-M309 HydrophobicContact CE2-SD 3.35Å; F287-M309 WeakPolarHBondContact CE2-SD 3.43Å; F287-M309 HydrophobicContact CZ-SD 4.39Å
288	E	97.7	Very high	96.4	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.023	19%	0.187	C	C	.	.	S	Bend	trans	-138.4	159.6	172.6	-83	-65.3	146.3	0	0	111.7	G224 G225 R226 Y239 R290 C292 H293	G224-E288 CarbonylContact C-O 3.47Å; G225-E288 PolarHBondContact N-O 2.99Å; R226-E288 PolarHBondContact N-O 2.82Å; Y239-E288 WeakPolarHBondContact CE2-OE2 3.4Å; Y239-E288 PolarHBondContact OH-OE1 3.33Å; Y239-E288 PolarHBondContact OH-OE2 2.87Å; E288-R290 VanDerWaalsContact C-N 3.27Å; E288-R290 PolarHBondContact O-N 2.76Å; E288-C292 HydrophobicContact CG-CB 4.5Å; E288-H293 IonicContact OE1-CE1 3.48Å; E288-H293 PolarHBondContact OE1-CE1 3.46Å; E288-H293 IonicContact OE1-ND1 3.42Å; E288-H293 PolarHBondContact OE1-ND1 3.36Å; E288-H293 VanDerWaalsContact OE1-ND1 3.11Å; E288-H293 IonicContact OE2-CE1 3.1Å
289	P	97.6	Very high	96.3	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.013	17%	0.172	C	C	.	.	S	Bend	trans	-57.7	-41.1	173.9	-21.7	33	0	0	0	112.3	G225 R226 E227 Y239 K242	G225-P289 CarbonylContact C-O 3.12Å; G225-P289 WeakPolarHBondContact CA-O 3.45Å; R226-P289 PolarHBondContact N-O 2.89Å; R226-P289 VanDerWaalsContact N-O 3.08Å; E227-P289 HydrophobicContact CB-CB 4.26Å; E227-P289 WeakPolarHBondContact CB-O 3.39Å; E227-P289 PolarHBondContact N-O 3.32Å; Y239-P289 HydrophobicContact CD2-CG 3.56Å; Y239-P289 HydrophobicContact CE2-CG 3.99Å; K242-P289 HydrophobicContact CD-CB 4.17Å; K242-P289 HydrophobicContact CD-CG 3.76Å
290	R	95.4	Very high	96.2	Very high	132 Å²	132	34.9 Å²	34.9	50%	0.498	17%	0.169	S	C	.	.	S	Bend	trans	-120.3	-130.3	175	-61.1	-173.4	-179	-161.8	-9.6	108.6	G224 G225 E227 E288	G224-R290 CarbonylContact C-O 3.54Å; G224-R290 WeakPolarHBondContact CA-O 3.35Å; G225-R290 PolarHBondContact N-O 3.47Å; E227-R290 IonicContact OE1-CZ 3.36Å; E227-R290 IonicContact OE1-NE 3.72Å; E227-R290 IonicContact OE1-NH2 2.75Å; E227-R290 PolarHBondContact OE1-NH2 2.97Å; E227-R290 WeakPolarHBondContact OE2-CG 3.31Å; E227-R290 IonicContact OE2-CZ 3.55Å; E227-R290 IonicContact OE2-NE 3.55Å; E227-R290 PolarHBondContact OE2-NE 3.02Å; E227-R290 IonicContact OE2-NH2 2.56Å; E288-R290 VanDerWaalsContact C-N 3.27Å; E288-R290 PolarHBondContact O-N 2.76Å
291	D	94	Very high	96.1	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.134	19%	0.194	C	C	.	.	S	Bend	trans	-70	148.4	176.3	-48	-50.8	0	0	0	111.4	T171 R172 R333 H336	T171-D291 WeakPolarHBondContact CA-OD1 3.31Å; R172-D291 WeakPolarHBondContact CG-OD1 3.41Å; R172-D291 PolarHBondContact N-OD1 3.5Å; R172-D291 IonicContact NE-OD1 2.81Å; D291-R333 VanDerWaalsContact CB-NH2 3.28Å; D291-H336 IonicContact OD2-CE1 2.76Å
292	C	93.8	Very high	96	Very high	9 Å²	9	38 Å²	38	6%	0.061	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-59.7	173.8	176.9	-61.4	0	0	0	0	112	T170 E288 K331 R333	T170-C292 WeakPolarHBondContact O-CB 3.26Å; T170-C292 PolarHBondContact O-N 3.04Å; T170-C292 PolarHBondContact O-SG 3.27Å; E288-C292 HydrophobicContact CG-CB 4.5Å; C292-K331 HydrophobicContact CB-CD 4.42Å; C292-K331 WeakPolarHBondContact O-CE 3.39Å; C292-K331 PolarHBondContact O-NZ 2.83Å; C292-R333 PolarHBondContact O-NE 2.97Å; C292-R333 PolarHBondContact O-NH2 3.12Å
293	H	93.4	Very high	95.9	Very high	68 Å²	68	37.1 Å²	37.1	32%	0.315	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-80.5	141.8	174.2	-74.6	99.9	0	0	0	114.3	Y239 E288 D303 K331	Y239-H293 PolarHBondContact OH-CE1 3.02Å; Y239-H293 VanDerWaalsContact OH-CE1 3.31Å; E288-H293 IonicContact OE1-CE1 3.48Å; E288-H293 PolarHBondContact OE1-CE1 3.46Å; E288-H293 IonicContact OE1-ND1 3.42Å; E288-H293 PolarHBondContact OE1-ND1 3.36Å; E288-H293 VanDerWaalsContact OE1-ND1 3.11Å; E288-H293 IonicContact OE2-CE1 3.1Å; H293-D303 IonicContact ND1-OD2 3.76Å; H293-K331 WeakPolarHBondContact O-CE 3.19Å; H293-K331 PolarHBondContact O-NZ 2.94Å
294	Y	93.7	Very high	95.9	Very high	13 Å²	13	37.4 Å²	37.4	5%	0.051	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-51.8	146.6	177.9	-76.6	-85.4	0	0	0	108.7	L296 E297 R298 K331 R333 H336 G337 W342 K345 E349	Y294-L296 PolarHBondContact O-N 2.95Å; Y294-E297 WeakPolarHBondContact CD2-OE2 3.35Å; Y294-E297 CarbonylContact O-C 3.59Å; Y294-E297 VanDerWaalsContact O-C 3.29Å; Y294-E297 WeakPolarHBondContact O-CA 3.24Å; Y294-E297 PolarHBondContact O-N 2.9Å; Y294-R298 PolarHBondContact O-N 2.96Å; Y294-K331 VanDerWaalsContact CA-NZ 3.33Å; Y294-R333 HydrophobicContact CD1-CB 3.72Å; Y294-R333 HydrophobicContact CD1-CG 4.06Å; Y294-R333 HydrophobicContact CE1-CB 3.53Å; Y294-R333 HydrophobicContact CE1-CG 3.94Å; Y294-R333 VanDerWaalsContact CZ-CD 3.46Å; Y294-H336 VanDerWaalsContact OH-C 3.3Å; Y294-H336 WeakPolarHBondContact OH-CB 3.34Å; Y294-H336 PolarHBondContact OH-O 3.15Å; Y294-G337 PolarHBondContact OH-N 3.22Å; Y294-W342 HydrophobicContact CE2-CZ3 4.39Å; Y294-K345 HydrophobicContact CD1-CB 3.78Å; Y294-K345 HydrophobicContact CD1-CD 4.06Å; Y294-K345 HydrophobicContact CD1-CG 4.31Å; Y294-K345 HydrophobicContact CD2-CD 3.96Å; Y294-K345 HydrophobicContact CE1-CB 3.81Å; Y294-K345 HydrophobicContact CE1-CD 4.09Å; Y294-K345 HydrophobicContact CE2-CD 4.03Å; Y294-K345 HydrophobicContact CG-CB 4.46Å; Y294-K345 HydrophobicContact CG-CD 3.99Å; Y294-E349 WeakPolarHBondContact CA-OE1 3.46Å; Y294-E349 HydrophobicContact CD1-CG 4.07Å
295	E	93.8	Very high	95.8	Very high	43 Å²	43	37.9 Å²	37.9	20%	0.201	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-54.9	-38.6	-178.7	179.3	57.1	-157.8	0	0	111.7	E297 R298 E349 E352	E295-E297 PolarHBondContact O-N 3.38Å; E295-R298 PolarHBondContact O-N 2.99Å; E295-R298 IonicContact OE1-CZ 3.11Å; E295-R298 IonicContact OE1-NE 2.71Å; E295-R298 IonicContact OE1-NH2 2.64Å; E295-R298 PolarHBondContact OE1-NH2 2.86Å; E295-R298 IonicContact OE2-CZ 3.66Å; E295-R298 IonicContact OE2-NE 3.56Å; E295-R298 PolarHBondContact OE2-NE 3.46Å; E295-R298 IonicContact OE2-NH2 3.63Å; E295-R298 PolarHBondContact OE2-NH2 3.44Å; E295-E349 WeakPolarHBondContact CB-OE1 3.35Å; E295-E349 PolarHBondContact N-OE1 3.17Å; E295-E352 HydrophobicContact CG-CB 4.18Å; E295-E352 HydrophobicContact CG-CG 4.34Å
296	L	93.6	Very high	95.8	Very high	53 Å²	53	38 Å²	38	28%	0.277	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-65.8	-15.1	174.2	-75.3	179.6	0	0	0	114.7	Y294 K344 K345 H348	Y294-L296 PolarHBondContact O-N 2.95Å; L296-K344 HydrophobicContact CD1-CG 4Å; L296-K345 HydrophobicContact CD1-CG 4.41Å; L296-H348 HydrophobicContact CD1-CB 4Å; L296-H348 HydrophobicContact CD2-CB 4.34Å; L296-H348 WeakPolarHBondContact CD2-ND1 3.17Å; L296-H348 HydrophobicContact CG-CB 3.84Å
297	E	94.1	Very high	95.8	Very high	82 Å²	82	39.2 Å²	39.2	38%	0.383	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-121.4	0.5	-175.2	-61	179.3	154.7	0	0	112.2	Y294 E295 D299 K345	Y294-E297 WeakPolarHBondContact CD2-OE2 3.35Å; Y294-E297 CarbonylContact O-C 3.59Å; Y294-E297 VanDerWaalsContact O-C 3.29Å; Y294-E297 WeakPolarHBondContact O-CA 3.24Å; Y294-E297 PolarHBondContact O-N 2.9Å; E295-E297 PolarHBondContact O-N 3.38Å; E297-D299 PolarHBondContact O-N 3.37Å; E297-K345 VanDerWaalsContact OE1-CE 3.27Å; E297-K345 WeakPolarHBondContact OE1-CE 3.3Å; E297-K345 IonicContact OE1-NZ 3.56Å; E297-K345 PolarHBondContact OE1-NZ 3.11Å; E297-K345 IonicContact OE2-NZ 3.59Å; E297-K345 PolarHBondContact OE2-NZ 2.7Å; E297-K345 VanDerWaalsContact OE2-NZ 3.11Å
298	R	94.3	Very high	95.8	Very high	42 Å²	42	42 Å²	42	16%	0.158	21%	0.213	C	C	.	.			trans	-68.6	129.2	-174.9	-176.1	173.1	57.1	85.8	4.1	110.4	Y294 E295 T300 D303	Y294-R298 PolarHBondContact O-N 2.96Å; E295-R298 PolarHBondContact O-N 2.99Å; E295-R298 IonicContact OE1-CZ 3.11Å; E295-R298 IonicContact OE1-NE 2.71Å; E295-R298 IonicContact OE1-NH2 2.64Å; E295-R298 PolarHBondContact OE1-NH2 2.86Å; E295-R298 IonicContact OE2-CZ 3.66Å; E295-R298 IonicContact OE2-NE 3.56Å; E295-R298 PolarHBondContact OE2-NE 3.46Å; E295-R298 IonicContact OE2-NH2 3.63Å; E295-R298 PolarHBondContact OE2-NH2 3.44Å; R298-T300 PolarHBondContact O-N 3.01Å; R298-D303 HydrophobicContact CG-CB 3.58Å; R298-D303 PolarHBondContact NH1-O 3.17Å
299	D	95.6	Very high	95.9	Very high	79 Å²	79	41.8 Å²	41.8	42%	0.422	21%	0.212	S	C	.	.			trans	-78.8	100.1	167.5	-174	-19.1	0	0	0	108.9	E297 S301 M302 D303	E297-D299 PolarHBondContact O-N 3.37Å; D299-S301 PolarHBondContact O-N 3.03Å; D299-S301 WeakPolarHBondContact OD1-CB 3.39Å; D299-S301 PolarHBondContact OD1-N 3.39Å; D299-S301 PolarHBondContact OD1-OG 2.76Å; D299-S301 PolarHBondContact OD2-OG 3.46Å; D299-M302 HydrophobicContact CB-CB 4.14Å; D299-M302 HydrophobicContact CB-CG 4.35Å; D299-M302 PolarHBondContact O-N 3.46Å; D299-D303 PolarHBondContact O-N 2.78Å
300	T	95.8	Very high	95.9	Very high	94 Å²	94	41.7 Å²	41.7	58%	0.577	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-15.2	-178.9	63.1	0	0	0	0	114.6	R298	R298-T300 PolarHBondContact O-N 3.01Å
301	S	96.1	Very high	96.1	Very high	78 Å²	78	37.3 Å²	37.3	55%	0.545	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-17.7	175.5	74.5	0	0	0	0	113.5	K269 D299	K269-S301 WeakPolarHBondContact CB-O 3.22Å; D299-S301 PolarHBondContact O-N 3.03Å; D299-S301 WeakPolarHBondContact OD1-CB 3.39Å; D299-S301 PolarHBondContact OD1-N 3.39Å; D299-S301 PolarHBondContact OD1-OG 2.76Å; D299-S301 PolarHBondContact OD2-OG 3.46Å
302	M	96.3	Very high	96.3	Very high	51 Å²	51	37.3 Å²	37.3	25%	0.251	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-35.2	-177.7	-65.6	-57.7	-62.1	0	0	112.6	E238 W267 N268 K269 D299	E238-M302 HydrophobicContact CG-CE 4.04Å; E238-M302 WeakPolarHBondContact OE1-CE 3.27Å; W267-M302 HydrophobicContact CZ3-CE 4.08Å; N268-M302 CarbonylContact C-O 3.49Å; N268-M302 WeakPolarHBondContact CA-O 3.37Å; N268-M302 HydrophobicContact CB-CE 4.29Å; K269-M302 WeakPolarHBondContact CB-O 3.41Å; K269-M302 PolarHBondContact N-O 2.76Å; D299-M302 HydrophobicContact CB-CB 4.14Å; D299-M302 HydrophobicContact CB-CG 4.35Å; D299-M302 PolarHBondContact O-N 3.46Å
303	D	96.7	Very high	96.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.016	19%	0.193	C	C	.	.			trans	-119.1	129.7	-170.6	-73.3	-51.1	0	0	0	112.9	H293 R298 D299	H293-D303 IonicContact ND1-OD2 3.76Å; R298-D303 HydrophobicContact CG-CB 3.58Å; R298-D303 PolarHBondContact NH1-O 3.17Å; D299-D303 PolarHBondContact O-N 2.78Å
304	P	97.8	Very high	96.8	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.039	18%	0.178	C	C	.	.			trans	-71.2	148.5	168.4	31.5	-33.6	0	0	0	111.4	K269 F272 F287 E308 M309	K269-P304 HydrophobicContact CD-CB 3.98Å; F272-P304 HydrophobicContact CD1-CB 3.9Å; F272-P304 HydrophobicContact CD1-CG 4.44Å; F272-P304 HydrophobicContact CD2-CG 4.48Å; F272-P304 HydrophobicContact CE1-CB 3.87Å; F272-P304 HydrophobicContact CG-CB 4.3Å; F272-P304 HydrophobicContact CG-CG 4.34Å; F272-P304 HydrophobicContact CZ-CB 4.23Å; F287-P304 VanDerWaalsContact CD1-CD 3.48Å; F287-P304 HydrophobicContact CD1-CG 3.8Å; F287-P304 HydrophobicContact CD2-CG 3.82Å; F287-P304 HydrophobicContact CE1-CG 3.65Å; F287-P304 HydrophobicContact CE2-CG 3.69Å; F287-P304 HydrophobicContact CG-CG 3.89Å; F287-P304 HydrophobicContact CZ-CG 3.6Å; P304-E308 WeakPolarHBondContact CA-OE2 3.43Å; P304-E308 HydrophobicContact CB-CB 4.21Å; P304-M309 HydrophobicContact CB-CG 3.9Å; P304-M309 HydrophobicContact CG-CG 3.7Å; P304-M309 HydrophobicContact CG-SD 4.03Å
305	S	97.8	Very high	97.1	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.063	19%	0.189	C	C	.	.			trans	-74.2	164.1	170.9	97.6	0	0	0	0	111.5	T307 E308 M309 E352	S305-T307 PolarHBondContact O-N 2.85Å; S305-T307 WeakPolarHBondContact OG-CB 3.1Å; S305-T307 PolarHBondContact OG-N 2.79Å; S305-T307 VanDerWaalsContact OG-N 3.17Å; S305-E308 PolarHBondContact N-OE2 2.97Å; S305-E308 PolarHBondContact O-N 3Å; S305-E308 VanDerWaalsContact O-N 3.12Å; S305-E308 PolarHBondContact OG-N 3.41Å; S305-M309 WeakPolarHBondContact O-CG 3.19Å; S305-M309 PolarHBondContact O-N 3.26Å; S305-E352 WeakPolarHBondContact CB-OE1 3.24Å; S305-E352 PolarHBondContact OG-OE1 3.02Å
306	L	97.9	Very high	97.3	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-39.4	173.6	-177.5	64	0	0	0	111.5	V168 T170 M309 T310 V328 E329 D330 E352 F353 A356	V168-L306 HydrophobicContact CG1-CD1 3.76Å; T170-L306 HydrophobicContact CG2-CB 4.14Å; T170-L306 HydrophobicContact CG2-CD1 4.12Å; L306-M309 HydrophobicContact CD1-CE 4.26Å; L306-M309 PolarHBondContact O-N 3.31Å; L306-T310 VanDerWaalsContact O-CB 3.31Å; L306-T310 WeakPolarHBondContact O-CB 3.11Å; L306-T310 PolarHBondContact O-N 2.8Å; L306-T310 PolarHBondContact O-OG1 3.32Å; L306-V328 HydrophobicContact CD1-CG1 3.84Å; L306-V328 HydrophobicContact CD2-CG1 4.5Å; L306-V328 HydrophobicContact CG-CG1 4.27Å; L306-E329 WeakPolarHBondContact CD1-O 3.41Å; L306-D330 HydrophobicContact CD2-CB 4.36Å; L306-E352 HydrophobicContact CB-CG 4.26Å; L306-F353 HydrophobicContact CD2-CB 4.47Å; L306-F353 HydrophobicContact CD2-CD2 3.95Å; L306-A356 HydrophobicContact CD2-CB 4.13Å; L306-A356 HydrophobicContact CG-CB 3.95Å
307	T	98.6	Very high	97.6	Very high	25 Å²	25	31.8 Å²	31.8	15%	0.153	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-47.1	174.2	-59.4	0	0	0	0	111.7	S305 T310 E311 E352 A356 R359	S305-T307 PolarHBondContact O-N 2.85Å; S305-T307 WeakPolarHBondContact OG-CB 3.1Å; S305-T307 PolarHBondContact OG-N 2.79Å; S305-T307 VanDerWaalsContact OG-N 3.17Å; T307-T310 PolarHBondContact O-N 2.99Å; T307-E311 PolarHBondContact O-N 3.29Å; T307-E352 VanDerWaalsContact CB-OE1 3.25Å; T307-E352 WeakPolarHBondContact CB-OE1 3.29Å; T307-E352 PolarHBondContact N-OE1 3.32Å; T307-E352 PolarHBondContact OG1-OE1 3.23Å; T307-A356 PolarHBondContact OG1-N 2.78Å; T307-R359 HydrophobicContact CG2-CB 3.64Å; T307-R359 HydrophobicContact CG2-CG 3.83Å
308	E	98.8	Very high	97.8	Very high	59 Å²	59	32.3 Å²	32.3	28%	0.276	17%	0.17	S	C	.	.	H	α-helix	trans	-66.1	-43.4	-179.8	-66.6	178	118.7	0	0	111.9	K269 F272 P304 S305 E311 K312	K269-E308 VanDerWaalsContact CE-CD 3.43Å; K269-E308 WeakPolarHBondContact CE-OE1 3.42Å; K269-E308 WeakPolarHBondContact CE-OE2 3.19Å; K269-E308 IonicContact NZ-OE1 3.93Å; K269-E308 PolarHBondContact NZ-OE1 3.01Å; K269-E308 IonicContact NZ-OE2 3.69Å; F272-E308 HydrophobicContact CE1-CB 4.11Å; F272-E308 HydrophobicContact CZ-CB 4.45Å; F272-E308 WeakPolarHBondContact CZ-O 3.29Å; P304-E308 WeakPolarHBondContact CA-OE2 3.43Å; P304-E308 HydrophobicContact CB-CB 4.21Å; S305-E308 PolarHBondContact N-OE2 2.97Å; S305-E308 PolarHBondContact O-N 3Å; S305-E308 VanDerWaalsContact O-N 3.12Å; S305-E308 PolarHBondContact OG-N 3.41Å; E308-E311 PolarHBondContact O-N 3.13Å; E308-K312 PolarHBondContact O-N 2.9Å
309	M	98.8	Very high	98	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-44.6	176.5	-68.2	-165	-64.5	0	0	112.1	V168 T169 T170 L222 F272 F287 P304 S305 L306 E311 K312 A313	V168-M309 HydrophobicContact CG1-CB 3.6Å; V168-M309 HydrophobicContact CG1-CE 4.16Å; T169-M309 WeakPolarHBondContact O-CE 3.22Å; T170-M309 HydrophobicContact CG2-CE 3.15Å; L222-M309 HydrophobicContact CB-CB 4.28Å; L222-M309 HydrophobicContact CB-CG 4.36Å; L222-M309 HydrophobicContact CB-SD 3.83Å; L222-M309 HydrophobicContact CD1-CB 3.86Å; L222-M309 HydrophobicContact CD1-CG 4.31Å; L222-M309 WeakPolarHBondContact CD1-O 3.37Å; F272-M309 HydrophobicContact CE2-CG 4.34Å; F272-M309 HydrophobicContact CZ-CG 4.39Å; F287-M309 HydrophobicContact CD2-SD 3.65Å; F287-M309 HydrophobicContact CE2-CG 4.16Å; F287-M309 HydrophobicContact CE2-SD 3.35Å; F287-M309 WeakPolarHBondContact CE2-SD 3.43Å; F287-M309 HydrophobicContact CZ-SD 4.39Å; P304-M309 HydrophobicContact CB-CG 3.9Å; P304-M309 HydrophobicContact CG-CG 3.7Å; P304-M309 HydrophobicContact CG-SD 4.03Å; S305-M309 WeakPolarHBondContact O-CG 3.19Å; S305-M309 PolarHBondContact O-N 3.26Å; L306-M309 HydrophobicContact CD1-CE 4.26Å; L306-M309 PolarHBondContact O-N 3.31Å; M309-E311 VanDerWaalsContact C-N 3.34Å; M309-E311 PolarHBondContact O-N 3.14Å; M309-K312 PolarHBondContact O-N 3.07Å; M309-A313 WeakPolarHBondContact O-CB 3.24Å; M309-A313 PolarHBondContact O-N 3.25Å
310	T	98.9	Very high	98.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-46.2	176.4	-60.9	0	0	0	0	111.1	F61 L306 T307 K312 A313 I314 V328 A360	F61-T310 HydrophobicContact CE1-CG2 4.33Å; F61-T310 HydrophobicContact CZ-CG2 4.18Å; L306-T310 VanDerWaalsContact O-CB 3.31Å; L306-T310 WeakPolarHBondContact O-CB 3.11Å; L306-T310 PolarHBondContact O-N 2.8Å; L306-T310 PolarHBondContact O-OG1 3.32Å; T307-T310 PolarHBondContact O-N 2.99Å; T310-K312 PolarHBondContact O-N 2.83Å; T310-A313 PolarHBondContact O-N 2.87Å; T310-I314 HydrophobicContact CG2-CD1 3.93Å; T310-I314 WeakPolarHBondContact O-CG1 3.37Å; T310-I314 PolarHBondContact O-N 3.39Å; T310-V328 HydrophobicContact CG2-CG2 4.14Å; T310-V328 WeakPolarHBondContact OG1-CG1 3.5Å; T310-A360 HydrophobicContact CG2-CB 4.23Å
311	E	98.9	Very high	98.2	Very high	41 Å²	41	32.7 Å²	32.7	19%	0.192	17%	0.173	C	C	.	.	H	α-helix	trans	-59.4	-46.6	176.4	168	169.6	-179.4	0	0	112.2	T307 E308 M309 A313 I314 K315 R359 L363	T307-E311 PolarHBondContact O-N 3.29Å; E308-E311 PolarHBondContact O-N 3.13Å; M309-E311 VanDerWaalsContact C-N 3.34Å; M309-E311 PolarHBondContact O-N 3.14Å; E311-A313 VanDerWaalsContact C-N 3.35Å; E311-A313 PolarHBondContact O-N 2.72Å; E311-I314 PolarHBondContact O-N 3.47Å; E311-K315 HydrophobicContact CG-CD 4.08Å; E311-K315 WeakPolarHBondContact O-CB 3.22Å; E311-K315 VanDerWaalsContact O-CG 3.31Å; E311-K315 WeakPolarHBondContact O-CG 3.45Å; E311-K315 PolarHBondContact O-N 3.37Å; E311-K315 WeakPolarHBondContact OE1-CE 3.2Å; E311-K315 IonicContact OE1-NZ 2.98Å; E311-K315 PolarHBondContact OE1-NZ 3.44Å; E311-R359 HydrophobicContact CB-CG 4.12Å; E311-R359 IonicContact OE1-CZ 3.89Å; E311-R359 IonicContact OE1-NE 3.05Å; E311-R359 IonicContact OE1-NH2 3.58Å; E311-R359 PolarHBondContact OE1-NH2 3.21Å; E311-R359 IonicContact OE2-CZ 3.46Å; E311-R359 VanDerWaalsContact OE2-CZ 3.24Å; E311-R359 IonicContact OE2-NE 3.94Å; E311-R359 PolarHBondContact OE2-NE 3.11Å; E311-R359 IonicContact OE2-NH2 2.81Å; E311-R359 PolarHBondContact OE2-NH2 3.28Å; E311-L363 HydrophobicContact CB-CD1 3.96Å; E311-L363 HydrophobicContact CG-CD1 3.89Å
312	K	98.9	Very high	98.3	Very high	24 Å²	24	35 Å²	35	10%	0.104	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-42.8	179.5	-171.2	76.6	71.4	165.6	0	111.2	F272 V275 P277 L283 E308 M309 T310 K315 I316	F272-K312 HydrophobicContact CE1-CB 4.46Å; F272-K312 HydrophobicContact CE2-CB 3.68Å; F272-K312 HydrophobicContact CE2-CG 3.81Å; F272-K312 HydrophobicContact CZ-CB 3.45Å; F272-K312 VanDerWaalsContact CZ-CB 3.45Å; F272-K312 HydrophobicContact CZ-CG 3.97Å; F272-K312 VanDerWaalsContact O-CE 3.23Å; F272-K312 WeakPolarHBondContact O-CE 3.49Å; F272-K312 PolarHBondContact O-NZ 3.23Å; V275-K312 HydrophobicContact CB-CD 4.37Å; V275-K312 HydrophobicContact CG1-CD 4.29Å; V275-K312 PolarHBondContact O-NZ 3.26Å; P277-K312 HydrophobicContact CB-CD 4.39Å; L283-K312 HydrophobicContact CD2-CG 3.84Å; E308-K312 PolarHBondContact O-N 2.9Å; M309-K312 PolarHBondContact O-N 3.07Å; T310-K312 PolarHBondContact O-N 2.83Å; K312-K315 PolarHBondContact O-N 3.08Å; K312-I316 HydrophobicContact CG-CD1 4.15Å; K312-I316 WeakPolarHBondContact O-CG1 3.45Å; K312-I316 PolarHBondContact O-N 2.98Å; K312-I316 VanDerWaalsContact O-N 3.12Å
313	A	98.9	Very high	98.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.2	-52.2	177.7	0	0	0	0	0	111.4	V168 V220 L222 M309 T310 E311 K315 I316 L317 L326	V168-A313 HydrophobicContact CG2-CB 3.52Å; V220-A313 HydrophobicContact CB-CB 4.45Å; V220-A313 HydrophobicContact CG1-CB 3.79Å; L222-A313 HydrophobicContact CD1-CB 4.34Å; M309-A313 WeakPolarHBondContact O-CB 3.24Å; M309-A313 PolarHBondContact O-N 3.25Å; T310-A313 PolarHBondContact O-N 2.87Å; E311-A313 VanDerWaalsContact C-N 3.35Å; E311-A313 PolarHBondContact O-N 2.72Å; A313-K315 VanDerWaalsContact C-N 3.28Å; A313-K315 PolarHBondContact O-N 3.14Å; A313-I316 PolarHBondContact O-N 3.14Å; A313-I316 VanDerWaalsContact O-N 3.13Å; A313-L317 HydrophobicContact CB-CD1 4.46Å; A313-L317 WeakPolarHBondContact O-CB 3.39Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 2.83Å; A313-L326 HydrophobicContact CB-CD1 4Å; A313-L326 HydrophobicContact CB-CD2 4.45Å
314	I	98.9	Very high	98.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.6	-44.8	177.6	-68.1	170.9	0	0	0	110.6	I59 T310 E311 I316 L317 Q318 L326 A360 L363 T364	I59-I314 HydrophobicContact CD1-CD1 4.26Å; T310-I314 HydrophobicContact CG2-CD1 3.93Å; T310-I314 WeakPolarHBondContact O-CG1 3.37Å; T310-I314 PolarHBondContact O-N 3.39Å; E311-I314 PolarHBondContact O-N 3.47Å; I314-I316 VanDerWaalsContact C-N 3.27Å; I314-I316 PolarHBondContact O-N 3Å; I314-L317 PolarHBondContact O-N 2.93Å; I314-Q318 VanDerWaalsContact O-CB 3.24Å; I314-Q318 WeakPolarHBondContact O-CB 3.48Å; I314-Q318 WeakPolarHBondContact O-CG 3.28Å; I314-Q318 PolarHBondContact O-N 3.36Å; I314-L326 HydrophobicContact CD1-CD2 4.22Å; I314-L326 HydrophobicContact CG1-CD2 3.57Å; I314-A360 HydrophobicContact CD1-CB 3.53Å; I314-L363 HydrophobicContact CB-CD1 4.41Å; I314-L363 HydrophobicContact CD1-CB 4.46Å; I314-L363 HydrophobicContact CD1-CD1 4.32Å; I314-L363 HydrophobicContact CG2-CB 3.92Å; I314-L363 HydrophobicContact CG2-CD1 4.4Å; I314-T364 HydrophobicContact CG2-CG2 4.34Å
315	K	98.8	Very high	98.6	Very high	66 Å²	66	32.2 Å²	32.2	29%	0.287	16%	0.159	S	C	.	.	H	α-helix	trans	-62.6	-30.8	-179	-75.6	179.8	-179.3	176.6	0	114.2	P277 E311 K312 A313	P277-K315 HydrophobicContact CB-CB 3.67Å; P277-K315 HydrophobicContact CG-CB 3.94Å; P277-K315 HydrophobicContact CG-CD 4.16Å; E311-K315 HydrophobicContact CG-CD 4.08Å; E311-K315 WeakPolarHBondContact O-CB 3.22Å; E311-K315 VanDerWaalsContact O-CG 3.31Å; E311-K315 WeakPolarHBondContact O-CG 3.45Å; E311-K315 PolarHBondContact O-N 3.37Å; E311-K315 WeakPolarHBondContact OE1-CE 3.2Å; E311-K315 IonicContact OE1-NZ 2.98Å; E311-K315 PolarHBondContact OE1-NZ 3.44Å; K312-K315 PolarHBondContact O-N 3.08Å; A313-K315 VanDerWaalsContact C-N 3.28Å; A313-K315 PolarHBondContact O-N 3.14Å
316	I	98.9	Very high	98.6	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-79.5	-50.2	175.2	-68.8	169.7	0	0	0	110.2	V220 V275 P277 T280 L283 K312 A313 I314 Q318 K319	V220-I316 HydrophobicContact CG2-CB 3.87Å; V220-I316 HydrophobicContact CG2-CD1 4.2Å; V220-I316 HydrophobicContact CG2-CG2 3.59Å; V275-I316 HydrophobicContact CG1-CD1 4.46Å; P277-I316 HydrophobicContact CB-CG1 3.66Å; T280-I316 HydrophobicContact CG2-CD1 4.26Å; T280-I316 WeakPolarHBondContact O-CG2 3.47Å; L283-I316 HydrophobicContact CB-CD1 3.87Å; L283-I316 HydrophobicContact CD2-CD1 3.58Å; L283-I316 HydrophobicContact CG-CD1 4.37Å; K312-I316 HydrophobicContact CG-CD1 4.15Å; K312-I316 WeakPolarHBondContact O-CG1 3.45Å; K312-I316 PolarHBondContact O-N 2.98Å; K312-I316 VanDerWaalsContact O-N 3.12Å; A313-I316 PolarHBondContact O-N 3.14Å; A313-I316 VanDerWaalsContact O-N 3.13Å; I314-I316 VanDerWaalsContact C-N 3.27Å; I314-I316 PolarHBondContact O-N 3Å; I316-Q318 PolarHBondContact O-N 3.29Å; I316-K319 WeakPolarHBondContact O-CB 3.37Å; I316-K319 WeakPolarHBondContact O-CE 3.47Å; I316-K319 WeakPolarHBondContact O-CG 3.22Å; I316-K319 PolarHBondContact O-N 3.12Å
317	L	98.8	Very high	98.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.7	-35.5	-173.6	-65.9	173.3	0	0	0	113.1	D219 V220 A313 I314 K319 N320 Y324 L326	D219-L317 HydrophobicContact CB-CD2 3.77Å; V220-L317 HydrophobicContact CB-CD2 4.46Å; V220-L317 HydrophobicContact CG2-CD2 3.99Å; V220-L317 HydrophobicContact CG2-CG 4.08Å; A313-L317 HydrophobicContact CB-CD1 4.46Å; A313-L317 WeakPolarHBondContact O-CB 3.39Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 2.83Å; I314-L317 PolarHBondContact O-N 2.93Å; L317-K319 PolarHBondContact O-N 3.04Å; L317-N320 PolarHBondContact O-N 3.47Å; L317-N320 VanDerWaalsContact O-N 3.11Å; L317-Y324 HydrophobicContact CB-CD1 3.99Å; L317-Y324 HydrophobicContact CB-CD2 4.09Å; L317-Y324 HydrophobicContact CB-CG 3.68Å; L317-Y324 HydrophobicContact CD1-CD2 4.02Å; L317-Y324 HydrophobicContact CD1-CG 4.36Å; L317-L326 HydrophobicContact CD1-CB 4.1Å; L317-L326 HydrophobicContact CD1-CD1 3.91Å; L317-L326 HydrophobicContact CD1-CG 4.41Å
318	Q	98.3	Very high	98.7	Very high	93 Å²	93	30.4 Å²	30.4	44%	0.435	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.8	-178.9	71.2	-179.2	-12.9	0	0	113.9	I314 I316 N320 Y324	I314-Q318 VanDerWaalsContact O-CB 3.24Å; I314-Q318 WeakPolarHBondContact O-CB 3.48Å; I314-Q318 WeakPolarHBondContact O-CG 3.28Å; I314-Q318 PolarHBondContact O-N 3.36Å; I316-Q318 PolarHBondContact O-N 3.29Å; Q318-N320 PolarHBondContact O-N 3.36Å; Q318-Y324 HydrophobicContact CB-CE1 4.22Å
319	K	98	Very high	98.6	Very high	79 Å²	79	27.6 Å²	27.6	34%	0.343	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.6	174.9	-67.3	-171.4	-66.4	168	0	112.4	P277 T280 D281 I316 L317 P321	P277-K319 WeakPolarHBondContact O-CE 3.27Å; T280-K319 WeakPolarHBondContact O-CE 3.18Å; T280-K319 PolarHBondContact O-NZ 2.83Å; D281-K319 IonicContact OD1-NZ 2.72Å; D281-K319 PolarHBondContact OD1-NZ 2.86Å; I316-K319 WeakPolarHBondContact O-CB 3.37Å; I316-K319 WeakPolarHBondContact O-CE 3.47Å; I316-K319 WeakPolarHBondContact O-CG 3.22Å; I316-K319 PolarHBondContact O-N 3.12Å; L317-K319 PolarHBondContact O-N 3.04Å; K319-P321 WeakPolarHBondContact O-CD 3.33Å
320	N	98.4	Very high	97.7	Very high	33 Å²	33	27.6 Å²	27.6	18%	0.176	14%	0.135	C	C	.	.			trans	-75.5	117.7	-179.3	-171.8	-21.3	0	0	0	110.6	G162 S164 L317 Q318 K322 G323	G162-N320 PolarHBondContact O-ND2 3.34Å; S164-N320 PolarHBondContact N-ND2 3.14Å; S164-N320 WeakPolarHBondContact OG-CB 3.37Å; S164-N320 PolarHBondContact OG-ND2 3.43Å; S164-N320 VanDerWaalsContact OG-ND2 3.12Å; L317-N320 PolarHBondContact O-N 3.47Å; L317-N320 VanDerWaalsContact O-N 3.11Å; Q318-N320 PolarHBondContact O-N 3.36Å; N320-K322 PolarHBondContact O-N 3.02Å; N320-K322 WeakPolarHBondContact OD1-CB 3.4Å; N320-K322 PolarHBondContact OD1-N 3.46Å; N320-G323 PolarHBondContact O-N 3.35Å
321	P	97.9	Very high	96.1	Very high	110 Å²	110	27.8 Å²	27.8	71%	0.714	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-21	-179.4	27.7	-35.7	0	0	0	113.3	K56 K319 G323	K56-P321 VanDerWaalsContact CE-O 3.3Å; K56-P321 WeakPolarHBondContact CE-O 3.41Å; K319-P321 WeakPolarHBondContact O-CD 3.33Å; P321-G323 PolarHBondContact O-N 2.78Å
322	K	98.2	Very high	94.4	Very high	126 Å²	126	25.9 Å²	25.9	55%	0.548	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-6.7	173.1	-65.2	-177	169.3	-171.2	0	113.2	G162 K163 N320	G162-K322 VanDerWaalsContact O-CD 3.32Å; G162-K322 WeakPolarHBondContact O-CD 3.49Å; K163-K322 PolarHBondContact NZ-O 3.37Å; N320-K322 PolarHBondContact O-N 3.02Å; N320-K322 WeakPolarHBondContact OD1-CB 3.4Å; N320-K322 PolarHBondContact OD1-N 3.46Å
323	G	98.7	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.			trans	85.6	-166.7	-176.3	0	0	0	0	0	112.9	K56 N57 K163 S164 N320 P321	K56-G323 WeakPolarHBondContact O-CA 3.43Å; N57-G323 WeakPolarHBondContact OD1-CA 3.01Å; K163-G323 WeakPolarHBondContact CA-O 3.43Å; K163-G323 WeakPolarHBondContact CB-O 3.35Å; S164-G323 PolarHBondContact N-O 3.47Å; S164-G323 VanDerWaalsContact N-O 3.09Å; N320-G323 PolarHBondContact O-N 3.35Å; P321-G323 PolarHBondContact O-N 2.78Å
324	Y	98.9	Very high	93.2	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.5	-175	61.1	-90.7	0	0	0	113.6	N57 L58 I59 S164 L317 Q318 L326 T364	N57-Y324 CarbonylContact C-O 3.08Å; N57-Y324 WeakPolarHBondContact CA-O 3.28Å; N57-Y324 HydrophobicContact CB-CD1 4.1Å; N57-Y324 HydrophobicContact CB-CD2 4.48Å; N57-Y324 HydrophobicContact CB-CE1 3.75Å; N57-Y324 HydrophobicContact CB-CE2 4.18Å; N57-Y324 HydrophobicContact CB-CG 4.44Å; N57-Y324 VanDerWaalsContact CG-CE1 3.43Å; N57-Y324 VanDerWaalsContact OD1-CD1 3.31Å; N57-Y324 WeakPolarHBondContact OD1-CD1 3.46Å; N57-Y324 WeakPolarHBondContact OD1-CE1 3.17Å; N57-Y324 PolarHBondContact OD1-N 3.34Å; L58-Y324 PolarHBondContact N-O 3.01Å; I59-Y324 HydrophobicContact CD1-CE2 4.06Å; I59-Y324 HydrophobicContact CG1-CE2 3.91Å; S164-Y324 CarbonylContact O-C 3.57Å; S164-Y324 WeakPolarHBondContact O-CA 3.16Å; S164-Y324 WeakPolarHBondContact O-CB 3.31Å; L317-Y324 HydrophobicContact CB-CD1 3.99Å; L317-Y324 HydrophobicContact CB-CD2 4.09Å; L317-Y324 HydrophobicContact CB-CG 3.68Å; L317-Y324 HydrophobicContact CD1-CD2 4.02Å; L317-Y324 HydrophobicContact CD1-CG 4.36Å; Q318-Y324 HydrophobicContact CB-CE1 4.22Å; Y324-L326 HydrophobicContact CD2-CB 3.92Å; Y324-L326 HydrophobicContact CE2-CB 3.99Å; Y324-T364 WeakPolarHBondContact OH-CG2 3.31Å
325	F	98.9	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.4	159.7	173.4	-91.4	0	0	0	108.8	L58 L60 L122 I154 L155 A158 S164 V165 G166 F327 M481	L58-F325 HydrophobicContact CB-CB 4.43Å; L58-F325 HydrophobicContact CB-CD2 3.74Å; L58-F325 HydrophobicContact CD1-CD2 4.16Å; L58-F325 CarbonylContact O-C 3.54Å; L58-F325 WeakPolarHBondContact O-CA 3.45Å; L60-F325 HydrophobicContact CB-CE2 4.41Å; L60-F325 HydrophobicContact CB-CZ 4.38Å; L122-F325 HydrophobicContact CD2-CZ 4.18Å; I154-F325 HydrophobicContact CD1-CD2 4.42Å; I154-F325 HydrophobicContact CD1-CE2 4.28Å; I154-F325 HydrophobicContact CG1-CD2 4.31Å; I154-F325 HydrophobicContact CG1-CE2 4.33Å; I154-F325 HydrophobicContact CG2-CD2 4.16Å; I154-F325 HydrophobicContact CG2-CE1 4.28Å; I154-F325 HydrophobicContact CG2-CE2 3.47Å; I154-F325 VanDerWaalsContact CG2-CE2 3.47Å; I154-F325 HydrophobicContact CG2-CZ 3.54Å; L155-F325 HydrophobicContact CB-CD1 3.81Å; L155-F325 HydrophobicContact CB-CE1 3.78Å; L155-F325 HydrophobicContact CD1-CD1 4.14Å; L155-F325 HydrophobicContact CD1-CE1 4.15Å; L155-F325 HydrophobicContact CG-CD1 4.02Å; L155-F325 HydrophobicContact CG-CE1 4.28Å; A158-F325 HydrophobicContact CB-CB 3.59Å; A158-F325 HydrophobicContact CB-CG 4.41Å; S164-F325 PolarHBondContact O-N 3.5Å; V165-F325 CarbonylContact C-O 3.58Å; V165-F325 VanDerWaalsContact CA-O 3.28Å; V165-F325 WeakPolarHBondContact CA-O 3.42Å; V165-F325 HydrophobicContact CG1-CB 4.25Å; G166-F325 PolarHBondContact N-O 2.93Å; F325-F327 HydrophobicContact CE1-CB 3.89Å; F325-F327 HydrophobicContact CZ-CB 4.24Å; F325-M481 HydrophobicContact CD2-CE 4.2Å; F325-M481 HydrophobicContact CE2-CE 3.73Å
326	L	98.9	Very high	92.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.8	176.2	175.7	62.2	0	0	0	109.4	L58 I59 L60 V168 A313 I314 L317 Y324 V328	L58-L326 PolarHBondContact O-N 3.26Å; I59-L326 WeakPolarHBondContact CA-O 3.46Å; I59-L326 HydrophobicContact CG1-CB 4.36Å; I59-L326 HydrophobicContact CG2-CB 4.34Å; I59-L326 HydrophobicContact CG2-CD2 4.34Å; I59-L326 HydrophobicContact CG2-CG 4.39Å; L60-L326 PolarHBondContact N-O 3.01Å; V168-L326 HydrophobicContact CG2-CD1 3.93Å; A313-L326 HydrophobicContact CB-CD1 4Å; A313-L326 HydrophobicContact CB-CD2 4.45Å; I314-L326 HydrophobicContact CD1-CD2 4.22Å; I314-L326 HydrophobicContact CG1-CD2 3.57Å; L317-L326 HydrophobicContact CD1-CB 4.1Å; L317-L326 HydrophobicContact CD1-CD1 3.91Å; L317-L326 HydrophobicContact CD1-CG 4.41Å; Y324-L326 HydrophobicContact CD2-CB 3.92Å; Y324-L326 HydrophobicContact CE2-CB 3.99Å; L326-V328 HydrophobicContact CD1-CG2 4.18Å; L326-V328 HydrophobicContact CD2-CG2 3.76Å; L326-V328 HydrophobicContact CG-CG2 3.63Å
327	F	98.9	Very high	92.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.6	165.8	178.9	-108.9	0	0	0	108.7	L60 L62 Y121 L122 G166 I167 V168 P178 F325 E329	L60-F327 HydrophobicContact CB-CD2 4.36Å; L60-F327 HydrophobicContact CD2-CD2 4.1Å; L60-F327 HydrophobicContact CD2-CE2 4.29Å; L60-F327 HydrophobicContact CG-CD2 4.2Å; L60-F327 HydrophobicContact CG-CE2 4.47Å; L62-F327 HydrophobicContact CB-CE2 3.61Å; L62-F327 HydrophobicContact CB-CZ 3.86Å; L62-F327 HydrophobicContact CG-CE2 4.16Å; L62-F327 HydrophobicContact CG-CZ 4.24Å; Y121-F327 AromaticContact CE2-CE2 3.82Å; Y121-F327 HydrophobicContact CE2-CE2 3.82Å; Y121-F327 HydrophobicContact CE2-CZ 4.27Å; L122-F327 HydrophobicContact CD2-CD2 3.94Å; L122-F327 HydrophobicContact CD2-CE2 4.27Å; G166-F327 PolarHBondContact O-N 3.14Å; I167-F327 HydrophobicContact CG2-CD1 4.33Å; V168-F327 PolarHBondContact N-O 3.02Å; P178-F327 HydrophobicContact CB-CE1 4.2Å; F325-F327 HydrophobicContact CE1-CB 3.89Å; F325-F327 HydrophobicContact CZ-CB 4.24Å; F327-E329 HydrophobicContact CE1-CB 3.67Å; F327-E329 HydrophobicContact CZ-CB 3.84Å; F327-E329 HydrophobicContact CZ-CG 4.49Å
328	V	98.8	Very high	92.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120	175.1	-171.7	0	0	0	0	108.6	I59 L60 F61 L62 V168 L306 T310 L326	I59-V328 HydrophobicContact CG2-CG2 4.32Å; L60-V328 PolarHBondContact O-N 3.16Å; F61-V328 CarbonylContact C-O 3.57Å; F61-V328 VanDerWaalsContact CA-O 3.24Å; F61-V328 WeakPolarHBondContact CA-O 3.42Å; F61-V328 HydrophobicContact CD1-CB 3.55Å; F61-V328 HydrophobicContact CD1-CG1 3.76Å; F61-V328 HydrophobicContact CD1-CG2 4.18Å; F61-V328 HydrophobicContact CE1-CB 3.6Å; F61-V328 HydrophobicContact CE1-CG1 3.61Å; F61-V328 HydrophobicContact CE1-CG2 3.81Å; F61-V328 HydrophobicContact CG-CB 4.29Å; F61-V328 HydrophobicContact CZ-CB 4.38Å; F61-V328 HydrophobicContact CZ-CG2 4.14Å; L62-V328 PolarHBondContact N-O 2.95Å; V168-V328 HydrophobicContact CB-CG1 4.34Å; V168-V328 HydrophobicContact CB-CG2 4.41Å; V168-V328 HydrophobicContact CG1-CG1 4.29Å; V168-V328 CarbonylContact O-C 3.57Å; V168-V328 VanDerWaalsContact O-CA 3.22Å; V168-V328 WeakPolarHBondContact O-CA 3.45Å; L306-V328 HydrophobicContact CD1-CG1 3.84Å; L306-V328 HydrophobicContact CD2-CG1 4.5Å; L306-V328 HydrophobicContact CG-CG1 4.27Å; T310-V328 HydrophobicContact CG2-CG2 4.14Å; T310-V328 WeakPolarHBondContact OG1-CG1 3.5Å; L326-V328 HydrophobicContact CD1-CG2 4.18Å; L326-V328 HydrophobicContact CD2-CG2 3.76Å; L326-V328 HydrophobicContact CG-CG2 3.63Å
329	E	96.9	Very high	92.1	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.5	177.8	176.9	-173.7	-145.8	0	0	110.5	L62 V168 T169 S177 P178 L306 F327 K331	L62-E329 VanDerWaalsContact O-CA 3.28Å; L62-E329 WeakPolarHBondContact O-CA 3.47Å; V168-E329 PolarHBondContact O-N 2.85Å; T169-E329 WeakPolarHBondContact CB-OE2 3.36Å; T169-E329 PolarHBondContact OG1-OE2 2.93Å; S177-E329 WeakPolarHBondContact CB-OE1 3.34Å; S177-E329 PolarHBondContact OG-OE1 2.95Å; P178-E329 WeakPolarHBondContact CD-OE2 3.03Å; L306-E329 WeakPolarHBondContact CD1-O 3.41Å; F327-E329 HydrophobicContact CE1-CB 3.67Å; F327-E329 HydrophobicContact CZ-CB 3.84Å; F327-E329 HydrophobicContact CZ-CG 4.49Å; E329-K331 PolarHBondContact O-N 3.16Å; E329-K331 VanDerWaalsContact O-N 3.15Å
330	D	80.2	Confident	92	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	106.7	158.1	-179.3	80.8	0	0	0	108.9	L62 L306 G332 I334 F353	L62-D330 PolarHBondContact O-N 3.2Å; L306-D330 HydrophobicContact CD2-CB 4.36Å; D330-G332 PolarHBondContact O-N 3.46Å; D330-I334 HydrophobicContact CB-CD1 3.77Å; D330-I334 HydrophobicContact CB-CG1 4.49Å; D330-I334 WeakPolarHBondContact OD2-CD1 3.36Å; D330-I334 WeakPolarHBondContact OD2-CG1 3.26Å; D330-I334 PolarHBondContact OD2-N 3.06Å; D330-F353 HydrophobicContact CB-CB 3.86Å; D330-F353 HydrophobicContact CB-CD2 3.6Å; D330-F353 HydrophobicContact CB-CE2 4.28Å; D330-F353 HydrophobicContact CB-CG 3.84Å
331	K	64.3	Low	92	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.017	10%	0.095	C	C	.	.			trans	33.8	-4.8	155.1	-140.7	152.3	175.5	-96.7	0	123.6	T170 T171 C292 H293 Y294 E329 R333 E349	T170-K331 VanDerWaalsContact C-CG 3.48Å; T170-K331 HydrophobicContact CG2-CD 4.23Å; T170-K331 HydrophobicContact CG2-CG 4.45Å; T170-K331 VanDerWaalsContact O-CG 3.31Å; T170-K331 WeakPolarHBondContact O-CG 2.89Å; T170-K331 WeakPolarHBondContact OG1-CA 3.31Å; T170-K331 WeakPolarHBondContact OG1-CB 2.84Å; T170-K331 WeakPolarHBondContact OG1-CD 3.34Å; T170-K331 WeakPolarHBondContact OG1-CG 3.46Å; T170-K331 PolarHBondContact OG1-N 3.41Å; T171-K331 WeakPolarHBondContact CG2-O 3.45Å; C292-K331 HydrophobicContact CB-CD 4.42Å; C292-K331 WeakPolarHBondContact O-CE 3.39Å; C292-K331 PolarHBondContact O-NZ 2.83Å; H293-K331 WeakPolarHBondContact O-CE 3.19Å; H293-K331 PolarHBondContact O-NZ 2.94Å; Y294-K331 VanDerWaalsContact CA-NZ 3.33Å; E329-K331 PolarHBondContact O-N 3.16Å; E329-K331 VanDerWaalsContact O-N 3.15Å; K331-R333 HydrophobicContact CB-CB 3.6Å; K331-R333 HydrophobicContact CB-CG 3.47Å; K331-R333 VanDerWaalsContact CB-CG 3.47Å; K331-R333 HydrophobicContact CD-CB 4.19Å; K331-R333 HydrophobicContact CD-CG 3.61Å; K331-R333 HydrophobicContact CG-CB 3.84Å; K331-R333 HydrophobicContact CG-CG 3.15Å; K331-R333 VanDerWaalsContact NZ-CG 3.34Å; K331-R333 WeakPolarHBondContact O-CG 2.98Å; K331-R333 PolarHBondContact O-N 3.45Å; K331-E349 WeakPolarHBondContact CD-OE2 3.48Å
332	G	63.4	Low	92	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	50.3	14.6	-153	0	0	0	0	0	112.3	T171 D330 D335 H336	T171-G332 VanDerWaalsContact CG2-N 3.26Å; D330-G332 PolarHBondContact O-N 3.46Å; G332-D335 WeakPolarHBondContact O-CB 3.28Å; G332-H336 WeakPolarHBondContact O-CB 3.41Å; G332-H336 PolarHBondContact O-CD2 3.43Å; G332-H336 PolarHBondContact O-CE1 2.91Å; G332-H336 PolarHBondContact O-N 2.89Å; G332-H336 PolarHBondContact O-ND1 3.18Å
333	R	81.2	Confident	91.9	Very high	44 Å²	44	10 Å²	10	17%	0.166	5%	0.046	C	C	.	.	H	α-helix	trans	-106.3	-15.9	-168.4	-64.3	-90.6	-174.3	-174.1	19.8	114.2	D291 C292 Y294 K331 H336 G337 E349	D291-R333 VanDerWaalsContact CB-NH2 3.28Å; C292-R333 PolarHBondContact O-NE 2.97Å; C292-R333 PolarHBondContact O-NH2 3.12Å; Y294-R333 HydrophobicContact CD1-CB 3.72Å; Y294-R333 HydrophobicContact CD1-CG 4.06Å; Y294-R333 HydrophobicContact CE1-CB 3.53Å; Y294-R333 HydrophobicContact CE1-CG 3.94Å; Y294-R333 VanDerWaalsContact CZ-CD 3.46Å; K331-R333 HydrophobicContact CB-CB 3.6Å; K331-R333 HydrophobicContact CB-CG 3.47Å; K331-R333 VanDerWaalsContact CB-CG 3.47Å; K331-R333 HydrophobicContact CD-CB 4.19Å; K331-R333 HydrophobicContact CD-CG 3.61Å; K331-R333 HydrophobicContact CG-CB 3.84Å; K331-R333 HydrophobicContact CG-CG 3.15Å; K331-R333 VanDerWaalsContact NZ-CG 3.34Å; K331-R333 WeakPolarHBondContact O-CG 2.98Å; K331-R333 PolarHBondContact O-N 3.45Å; R333-H336 WeakPolarHBondContact CD-ND1 3.24Å; R333-G337 WeakPolarHBondContact O-CA 3.18Å; R333-G337 PolarHBondContact O-N 3.48Å; R333-E349 HydrophobicContact CB-CG 3.69Å
334	I	90.6	Very high	91.8	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-50.4	-56.9	149.2	-67.7	162	0	0	0	107.6	D64 M66 T70 D330 G337 H338 A346 E349 A350	D64-I334 VanDerWaalsContact O-CB 3.22Å; D64-I334 WeakPolarHBondContact O-CB 3.19Å; D64-I334 VanDerWaalsContact O-CG2 3.27Å; D64-I334 WeakPolarHBondContact O-CG2 3.4Å; M66-I334 HydrophobicContact CB-CD1 4.07Å; M66-I334 HydrophobicContact CB-CG2 4.17Å; M66-I334 HydrophobicContact CG-CD1 4.11Å; M66-I334 HydrophobicContact SD-CD1 4.18Å; T70-I334 HydrophobicContact CG2-CG2 3.83Å; D330-I334 HydrophobicContact CB-CD1 3.77Å; D330-I334 HydrophobicContact CB-CG1 4.49Å; D330-I334 WeakPolarHBondContact OD2-CD1 3.36Å; D330-I334 WeakPolarHBondContact OD2-CG1 3.26Å; D330-I334 PolarHBondContact OD2-N 3.06Å; I334-G337 PolarHBondContact O-N 2.79Å; I334-H338 PolarHBondContact O-CD2 3.26Å; I334-H338 PolarHBondContact O-N 3.41Å; I334-A346 WeakPolarHBondContact O-CB 3.35Å; I334-E349 HydrophobicContact CG1-CB 3.71Å; I334-A350 HydrophobicContact CD1-CB 3.85Å; I334-A350 HydrophobicContact CG1-CB 3.99Å
335	D	90.4	Very high	91.7	Very high	4 Å²	4	12.1 Å²	12.1	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-57.6	-58.6	176.4	172.2	76.7	0	0	0	114.4	D64 G332 G337 H338 H339 H377 H379 H451	D64-D335 HydrophobicContact CB-CB 4.25Å; D64-D335 PolarHBondContact O-N 3.28Å; D64-D335 VanDerWaalsContact O-N 3.1Å; D64-D335 WeakPolarHBondContact OD1-CB 3.28Å; G332-D335 WeakPolarHBondContact O-CB 3.28Å; D335-G337 PolarHBondContact O-N 3.07Å; D335-G337 VanDerWaalsContact O-N 3.12Å; D335-H338 CarbonylContact O-C 3.43Å; D335-H338 WeakPolarHBondContact O-CA 3.36Å; D335-H338 WeakPolarHBondContact O-CB 3.37Å; D335-H338 PolarHBondContact O-N 2.94Å; D335-H339 PolarHBondContact O-N 3.46Å; D335-H339 IonicContact OD1-CD2 3.62Å; D335-H339 IonicContact OD1-CE1 2.73Å; D335-H339 IonicContact OD1-NE2 3.69Å; D335-H339 PolarHBondContact OD1-NE2 3.24Å; D335-H339 IonicContact OD2-CD2 3.65Å; D335-H339 PolarHBondContact OD2-CD2 3.01Å; D335-H339 IonicContact OD2-NE2 2.77Å; D335-H339 PolarHBondContact OD2-NE2 2.73Å; D335-H377 IonicContact OD1-CE1 3.91Å; D335-H377 PolarHBondContact OD1-CE1 2.65Å; D335-H379 WeakPolarHBondContact CA-NE2 3.49Å; D335-H379 IonicContact OD1-CE1 2.93Å; D335-H379 PolarHBondContact OD1-CE1 3.33Å; D335-H379 IonicContact OD1-NE2 3.93Å; D335-H379 PolarHBondContact OD1-NE2 2.85Å; D335-H451 IonicContact OD1-CD2 2.62Å; D335-H451 PolarHBondContact OD1-CD2 3.17Å; D335-H451 IonicContact OD1-NE2 3.1Å; D335-H451 PolarHBondContact OD1-NE2 3.03Å
336	H	90.2	Very high	91.6	Very high	39 Å²	39	12.1 Å²	12.1	18%	0.181	6%	0.055	C	C	.	.	H	α-helix	trans	-58.2	-33.8	179	-60.9	147.5	0	0	0	112.5	D291 Y294 G332 R333 A340	D291-H336 IonicContact OD2-CE1 2.76Å; Y294-H336 VanDerWaalsContact OH-C 3.3Å; Y294-H336 WeakPolarHBondContact OH-CB 3.34Å; Y294-H336 PolarHBondContact OH-O 3.15Å; G332-H336 WeakPolarHBondContact O-CB 3.41Å; G332-H336 PolarHBondContact O-CD2 3.43Å; G332-H336 PolarHBondContact O-CE1 2.91Å; G332-H336 PolarHBondContact O-N 2.89Å; G332-H336 PolarHBondContact O-ND1 3.18Å; R333-H336 WeakPolarHBondContact CD-ND1 3.24Å; H336-A340 VanDerWaalsContact O-CB 3.32Å; H336-A340 WeakPolarHBondContact O-CB 3.41Å; H336-A340 PolarHBondContact O-N 2.97Å
337	G	95.2	Very high	91.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.6	-45.5	174.3	0	0	0	0	0	111	Y294 R333 I334 D335 A340 T341 W342	Y294-G337 PolarHBondContact OH-N 3.22Å; R333-G337 WeakPolarHBondContact O-CA 3.18Å; R333-G337 PolarHBondContact O-N 3.48Å; I334-G337 PolarHBondContact O-N 2.79Å; D335-G337 PolarHBondContact O-N 3.07Å; D335-G337 VanDerWaalsContact O-N 3.12Å; G337-A340 PolarHBondContact O-N 3.19Å; G337-T341 PolarHBondContact O-N 2.7Å; G337-W342 WeakPolarHBondContact O-CA 3.23Å; G337-W342 PolarHBondContact O-N 2.84Å
338	H	98	Very high	91.4	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65.9	-46.3	174.9	-72.5	-52.4	0	0	0	112.7	T70 I334 D335 A340 T341 H379 F381 Y412 E449	T70-H338 WeakPolarHBondContact CG2-NE2 3.32Å; T70-H338 PolarHBondContact OG1-CE1 3.3Å; T70-H338 PolarHBondContact OG1-NE2 3.27Å; I334-H338 PolarHBondContact O-CD2 3.26Å; I334-H338 PolarHBondContact O-N 3.41Å; D335-H338 CarbonylContact O-C 3.43Å; D335-H338 WeakPolarHBondContact O-CA 3.36Å; D335-H338 WeakPolarHBondContact O-CB 3.37Å; D335-H338 PolarHBondContact O-N 2.94Å; H338-A340 VanDerWaalsContact C-N 3.26Å; H338-A340 PolarHBondContact O-N 3.07Å; H338-T341 VanDerWaalsContact O-CA 3.28Å; H338-T341 WeakPolarHBondContact O-CA 3.34Å; H338-T341 PolarHBondContact O-N 2.65Å; H338-H379 HydrophobicContact CB-CB 4.05Å; H338-H379 VanDerWaalsContact CB-CE1 3.46Å; H338-H379 WeakPolarHBondContact CB-CE1 3.21Å; H338-H379 VanDerWaalsContact CB-ND1 3.31Å; H338-H379 WeakPolarHBondContact CB-ND1 3.39Å; H338-H379 AromaticContact CD2-CD2 3.37Å; H338-H379 PolarHBondContact CD2-CD2 2.7Å; H338-H379 AromaticContact CD2-CG 3.84Å; H338-H379 AromaticContact CD2-NE2 3.89Å; H338-H379 AromaticContact CG-CD2 3.67Å; H338-H379 AromaticContact CG-CG 3.7Å; H338-F381 AromaticContact CE1-CD1 3.83Å; H338-F381 AromaticContact CE1-CG 3.72Å; H338-Y412 HydrophobicContact CB-CE1 3.97Å; H338-Y412 AromaticContact ND1-CE1 3.43Å; H338-Y412 WeakPolarHBondContact ND1-CE1 3.49Å; H338-Y412 AromaticContact ND1-CZ 3.51Å; H338-Y412 PolarHBondContact ND1-OH 2.76Å; H338-E449 WeakPolarHBondContact O-CB 3.39Å
339	H	97.3	Very high	91.4	Very high	40 Å²	40	13.9 Å²	13.9	19%	0.185	6%	0.063	C	C	.	.	H	α-helix	trans	-51.9	-43	172.7	-85.1	-33.1	0	0	0	112.9	D335 T341 P416 S448 E449 H451	D335-H339 PolarHBondContact O-N 3.46Å; D335-H339 IonicContact OD1-CD2 3.62Å; D335-H339 IonicContact OD1-CE1 2.73Å; D335-H339 IonicContact OD1-NE2 3.69Å; D335-H339 PolarHBondContact OD1-NE2 3.24Å; D335-H339 IonicContact OD2-CD2 3.65Å; D335-H339 PolarHBondContact OD2-CD2 3.01Å; D335-H339 IonicContact OD2-NE2 2.77Å; D335-H339 PolarHBondContact OD2-NE2 2.73Å; H339-T341 PolarHBondContact O-N 3.32Å; H339-P416 WeakPolarHBondContact O-CD 3.43Å; H339-S448 WeakPolarHBondContact CB-OG 3.46Å; H339-S448 PolarHBondContact ND1-OG 3.31Å; H339-E449 PolarHBondContact CE1-O 2.75Å; H339-E449 PolarHBondContact ND1-O 3.41Å; H339-E449 IonicContact ND1-OE2 3.9Å; H339-E449 PolarHBondContact O-N 2.86Å; H339-H451 AromaticContact CE1-CD2 3.36Å; H339-H451 PolarHBondContact CE1-CD2 3.39Å; H339-H451 AromaticContact CE1-NE2 3.18Å; H339-H451 PolarHBondContact CE1-NE2 3.35Å; H339-H451 AromaticContact NE2-CD2 3.84Å; H339-H451 AromaticContact NE2-NE2 3.22Å; H339-H451 PolarHBondContact NE2-NE2 3.07Å
340	A	97.1	Very high	91.4	Very high	19 Å²	19	13.9 Å²	13.9	16%	0.157	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.9	176.3	0	0	0	0	0	113.7	H336 G337 H338 W342	H336-A340 VanDerWaalsContact O-CB 3.32Å; H336-A340 WeakPolarHBondContact O-CB 3.41Å; H336-A340 PolarHBondContact O-N 2.97Å; G337-A340 PolarHBondContact O-N 3.19Å; H338-A340 VanDerWaalsContact C-N 3.26Å; H338-A340 PolarHBondContact O-N 3.07Å; A340-W342 HydrophobicContact CB-CD2 3.55Å; A340-W342 HydrophobicContact CB-CE3 3.29Å; A340-W342 HydrophobicContact CB-CG 4.09Å; A340-W342 HydrophobicContact CB-CH2 4.32Å; A340-W342 HydrophobicContact CB-CZ3 3.71Å; A340-W342 PolarHBondContact O-N 3.3Å
341	T	97.6	Very high	92.3	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	33.3	-171.3	57.6	0	0	0	0	113	G337 H338 H339 Y412 P416 G417 K439 Q440 T442 E449	G337-T341 PolarHBondContact O-N 2.7Å; H338-T341 VanDerWaalsContact O-CA 3.28Å; H338-T341 WeakPolarHBondContact O-CA 3.34Å; H338-T341 PolarHBondContact O-N 2.65Å; H339-T341 PolarHBondContact O-N 3.32Å; T341-Y412 HydrophobicContact CG2-CD1 4.43Å; T341-Y412 HydrophobicContact CG2-CD2 3.88Å; T341-Y412 HydrophobicContact CG2-CE2 4.28Å; T341-Y412 HydrophobicContact CG2-CG 3.97Å; T341-P416 HydrophobicContact CG2-CG 4.27Å; T341-G417 PolarHBondContact OG1-N 3.09Å; T341-K439 CarbonylContact O-C 3.28Å; T341-K439 VanDerWaalsContact O-CA 3.24Å; T341-K439 WeakPolarHBondContact O-CA 3.39Å; T341-K439 WeakPolarHBondContact OG1-CB 3.15Å; T341-Q440 PolarHBondContact O-N 2.61Å; T341-Q440 PolarHBondContact O-OE1 2.75Å; T341-T442 HydrophobicContact CG2-CG2 3.71Å; T341-E449 HydrophobicContact CG2-CB 3.84Å; T341-E449 HydrophobicContact CG2-CG 4.26Å
342	W	97.1	Very high	93.9	Very high	57 Å²	57	14.1 Å²	14.1	22%	0.216	7%	0.065	C	C	.	.			trans	-98.9	70.6	175.2	-69.1	-34.2	0	0	0	110.5	Y294 G337 A340 K344 K345 A346 N437	Y294-W342 HydrophobicContact CE2-CZ3 4.39Å; G337-W342 WeakPolarHBondContact O-CA 3.23Å; G337-W342 PolarHBondContact O-N 2.84Å; A340-W342 HydrophobicContact CB-CD2 3.55Å; A340-W342 HydrophobicContact CB-CE3 3.29Å; A340-W342 HydrophobicContact CB-CG 4.09Å; A340-W342 HydrophobicContact CB-CH2 4.32Å; A340-W342 HydrophobicContact CB-CZ3 3.71Å; A340-W342 PolarHBondContact O-N 3.3Å; W342-K344 PolarHBondContact O-N 2.9Å; W342-K344 VanDerWaalsContact O-N 3.07Å; W342-K345 HydrophobicContact CB-CB 4.13Å; W342-K345 HydrophobicContact CB-CD 4.18Å; W342-K345 HydrophobicContact CB-CG 4.25Å; W342-K345 HydrophobicContact CD2-CD 4.13Å; W342-K345 HydrophobicContact CE3-CD 3.75Å; W342-K345 HydrophobicContact CG-CD 4.35Å; W342-K345 HydrophobicContact CZ3-CD 4.47Å; W342-K345 PolarHBondContact O-N 3.34Å; W342-A346 PolarHBondContact O-N 3.25Å; W342-A346 VanDerWaalsContact O-N 3.07Å; W342-N437 PolarHBondContact NE1-O 3.48Å; W342-N437 VanDerWaalsContact NE1-O 3.09Å
343	A	97.2	Very high	95.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-55.9	-31.7	-178.4	0	0	0	0	0	112.5	K345 A346 L347 F381 L394 A410 Y412 Q440	A343-K345 VanDerWaalsContact C-N 3.34Å; A343-K345 PolarHBondContact O-N 3.31Å; A343-A346 PolarHBondContact O-N 3.14Å; A343-L347 WeakPolarHBondContact O-CB 3.21Å; A343-L347 VanDerWaalsContact O-CG 3.25Å; A343-L347 WeakPolarHBondContact O-CG 3.45Å; A343-L347 PolarHBondContact O-N 3.05Å; A343-F381 HydrophobicContact CB-CE2 3.95Å; A343-L394 HydrophobicContact CB-CD2 3.69Å; A343-A410 HydrophobicContact CB-CB 4.44Å; A343-Y412 WeakPolarHBondContact CA-OH 3.45Å; A343-Y412 HydrophobicContact CB-CE2 4.18Å; A343-Y412 WeakPolarHBondContact CB-OH 3.42Å; A343-Y412 PolarHBondContact N-OH 3.27Å; A343-Q440 VanDerWaalsContact CB-CD 3.42Å; A343-Q440 HydrophobicContact CB-CG 4.19Å
344	K	96.8	Very high	96.4	Very high	41 Å²	41	12 Å²	12	18%	0.178	6%	0.057	C	C	.	.	H	α-helix	trans	-60	-44.1	175.2	-173.3	167.3	-179.6	-167.8	0	112.2	L296 W342 H348 L394 S434 N436	L296-K344 HydrophobicContact CD1-CG 4Å; W342-K344 PolarHBondContact O-N 2.9Å; W342-K344 VanDerWaalsContact O-N 3.07Å; K344-H348 WeakPolarHBondContact O-CB 3.36Å; K344-H348 PolarHBondContact O-CD2 3.01Å; K344-H348 PolarHBondContact O-N 3.09Å; K344-L394 HydrophobicContact CB-CD1 3.7Å; K344-L394 HydrophobicContact CD-CD1 4.33Å; K344-L394 HydrophobicContact CG-CD1 3.7Å; K344-S434 PolarHBondContact NZ-O 3.41Å; K344-N436 WeakPolarHBondContact CE-OD1 3.32Å; K344-N436 PolarHBondContact NZ-OD1 3.17Å
345	K	96.1	Very high	96.8	Very high	5 Å²	5	17.6 Å²	17.6	2%	0.022	8%	0.078	C	C	.	.	H	α-helix	trans	-66.8	-52.8	176.4	-68.5	-176.9	174.4	-169	0	109.8	Y294 L296 E297 W342 A343 L347 H348 E349 N437	Y294-K345 HydrophobicContact CD1-CB 3.78Å; Y294-K345 HydrophobicContact CD1-CD 4.06Å; Y294-K345 HydrophobicContact CD1-CG 4.31Å; Y294-K345 HydrophobicContact CD2-CD 3.96Å; Y294-K345 HydrophobicContact CE1-CB 3.81Å; Y294-K345 HydrophobicContact CE1-CD 4.09Å; Y294-K345 HydrophobicContact CE2-CD 4.03Å; Y294-K345 HydrophobicContact CG-CB 4.46Å; Y294-K345 HydrophobicContact CG-CD 3.99Å; L296-K345 HydrophobicContact CD1-CG 4.41Å; E297-K345 VanDerWaalsContact OE1-CE 3.27Å; E297-K345 WeakPolarHBondContact OE1-CE 3.3Å; E297-K345 IonicContact OE1-NZ 3.56Å; E297-K345 PolarHBondContact OE1-NZ 3.11Å; E297-K345 IonicContact OE2-NZ 3.59Å; E297-K345 PolarHBondContact OE2-NZ 2.7Å; E297-K345 VanDerWaalsContact OE2-NZ 3.11Å; W342-K345 HydrophobicContact CB-CB 4.13Å; W342-K345 HydrophobicContact CB-CD 4.18Å; W342-K345 HydrophobicContact CB-CG 4.25Å; W342-K345 HydrophobicContact CD2-CD 4.13Å; W342-K345 HydrophobicContact CE3-CD 3.75Å; W342-K345 HydrophobicContact CG-CD 4.35Å; W342-K345 HydrophobicContact CZ3-CD 4.47Å; W342-K345 PolarHBondContact O-N 3.34Å; A343-K345 VanDerWaalsContact C-N 3.34Å; A343-K345 PolarHBondContact O-N 3.31Å; K345-L347 VanDerWaalsContact C-N 3.31Å; K345-L347 PolarHBondContact O-N 2.88Å; K345-H348 PolarHBondContact O-N 2.95Å; K345-E349 WeakPolarHBondContact O-CG 3.43Å; K345-E349 PolarHBondContact O-N 3.46Å; K345-N437 WeakPolarHBondContact CE-OD1 3.26Å; K345-N437 PolarHBondContact NZ-OD1 3.32Å
346	A	97.3	Very high	97.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-53	-45.3	-179.1	0	0	0	0	0	113.3	I334 W342 A343 E349 A350	I334-A346 WeakPolarHBondContact O-CB 3.35Å; W342-A346 PolarHBondContact O-N 3.25Å; W342-A346 VanDerWaalsContact O-N 3.07Å; A343-A346 PolarHBondContact O-N 3.14Å; A346-E349 PolarHBondContact O-N 3.49Å; A346-A350 PolarHBondContact O-N 3.03Å
347	L	97.5	Very high	97.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-72.4	-31.8	-179.9	-62	-173.8	0	0	0	113.2	T70 A73 A74 L77 A343 K345 A350 V351 F381 V393 L394	T70-L347 HydrophobicContact CG2-CD2 4.07Å; A73-L347 HydrophobicContact CB-CD1 3.73Å; A73-L347 HydrophobicContact CB-CD2 3.62Å; A73-L347 HydrophobicContact CB-CG 4.34Å; A74-L347 HydrophobicContact CB-CD2 4.45Å; L77-L347 HydrophobicContact CD2-CB 3.47Å; L77-L347 VanDerWaalsContact CD2-CB 3.47Å; A343-L347 WeakPolarHBondContact O-CB 3.21Å; A343-L347 VanDerWaalsContact O-CG 3.25Å; A343-L347 WeakPolarHBondContact O-CG 3.45Å; A343-L347 PolarHBondContact O-N 3.05Å; K345-L347 VanDerWaalsContact C-N 3.31Å; K345-L347 PolarHBondContact O-N 2.88Å; L347-A350 PolarHBondContact O-N 3.3Å; L347-V351 WeakPolarHBondContact O-CG2 3.25Å; L347-V351 PolarHBondContact O-N 2.87Å; L347-F381 HydrophobicContact CD2-CE1 4.49Å; L347-V393 HydrophobicContact CD1-CG1 3.96Å; L347-L394 HydrophobicContact CD1-CD2 3.79Å; L347-L394 HydrophobicContact CD1-CG 4.19Å
348	H	97.3	Very high	97.7	Very high	33 Å²	33	16.3 Å²	16.3	15%	0.153	8%	0.075	C	C	.	.	H	α-helix	trans	-69.9	-34.9	174.8	-89.3	-96.7	0	0	0	112	L296 K344 K345 V351 E352	L296-H348 HydrophobicContact CD1-CB 4Å; L296-H348 HydrophobicContact CD2-CB 4.34Å; L296-H348 WeakPolarHBondContact CD2-ND1 3.17Å; L296-H348 HydrophobicContact CG-CB 3.84Å; K344-H348 WeakPolarHBondContact O-CB 3.36Å; K344-H348 PolarHBondContact O-CD2 3.01Å; K344-H348 PolarHBondContact O-N 3.09Å; K345-H348 PolarHBondContact O-N 2.95Å; H348-V351 PolarHBondContact O-N 2.92Å; H348-E352 PolarHBondContact O-N 3.42Å; H348-E352 VanDerWaalsContact O-N 3.11Å
349	E	97.1	Very high	97.8	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.019	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-49.5	168.9	-58.4	-60.3	125.8	0	0	110.6	Y294 E295 K331 R333 I334 K345 A346 V351 E352 F353	Y294-E349 WeakPolarHBondContact CA-OE1 3.46Å; Y294-E349 HydrophobicContact CD1-CG 4.07Å; E295-E349 WeakPolarHBondContact CB-OE1 3.35Å; E295-E349 PolarHBondContact N-OE1 3.17Å; K331-E349 WeakPolarHBondContact CD-OE2 3.48Å; R333-E349 HydrophobicContact CB-CG 3.69Å; I334-E349 HydrophobicContact CG1-CB 3.71Å; K345-E349 WeakPolarHBondContact O-CG 3.43Å; K345-E349 PolarHBondContact O-N 3.46Å; A346-E349 PolarHBondContact O-N 3.49Å; E349-V351 PolarHBondContact O-N 3.48Å; E349-V351 VanDerWaalsContact O-N 3.16Å; E349-E352 CarbonylContact O-C 3.49Å; E349-E352 WeakPolarHBondContact O-CA 3.21Å; E349-E352 PolarHBondContact O-N 3.29Å; E349-F353 PolarHBondContact O-N 2.94Å
350	A	98.1	Very high	97.8	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-57.6	-33.6	177.4	0	0	0	0	0	113.6	T70 A74 I334 A346 L347 D354	T70-A350 HydrophobicContact CG2-CB 4.42Å; A74-A350 HydrophobicContact CB-CB 3.62Å; I334-A350 HydrophobicContact CD1-CB 3.85Å; I334-A350 HydrophobicContact CG1-CB 3.99Å; A346-A350 PolarHBondContact O-N 3.03Å; L347-A350 PolarHBondContact O-N 3.3Å; A350-D354 PolarHBondContact O-N 3.37Å; A350-D354 VanDerWaalsContact O-N 3.08Å
351	V	98.4	Very high	97.9	Very high	2 Å²	2	18 Å²	18	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-69.9	-40.5	173.6	171.1	0	0	0	0	111.7	L77 K78 L81 L347 H348 E349 D354 R355	L77-V351 HydrophobicContact CB-CG2 4.49Å; L77-V351 HydrophobicContact CD2-CG2 4.1Å; L77-V351 HydrophobicContact CG-CG2 4.3Å; K78-V351 HydrophobicContact CB-CG2 4.08Å; K78-V351 HydrophobicContact CG-CG1 4.44Å; L81-V351 HydrophobicContact CD1-CG1 4.41Å; L347-V351 WeakPolarHBondContact O-CG2 3.25Å; L347-V351 PolarHBondContact O-N 2.87Å; H348-V351 PolarHBondContact O-N 2.92Å; E349-V351 PolarHBondContact O-N 3.48Å; E349-V351 VanDerWaalsContact O-N 3.16Å; V351-D354 PolarHBondContact O-N 2.72Å; V351-R355 WeakPolarHBondContact O-CG 3.36Å; V351-R355 PolarHBondContact O-N 3.18Å; V351-R355 VanDerWaalsContact O-N 3.13Å
352	E	98.1	Very high	97.9	Very high	8 Å²	8	24.6 Å²	24.6	4%	0.037	11%	0.113	C	C	.	.	H	α-helix	trans	-67.7	-37	174.9	180	56.7	-158.8	0	0	112	E295 S305 L306 T307 H348 E349 D354 R355 A356	E295-E352 HydrophobicContact CG-CB 4.18Å; E295-E352 HydrophobicContact CG-CG 4.34Å; S305-E352 WeakPolarHBondContact CB-OE1 3.24Å; S305-E352 PolarHBondContact OG-OE1 3.02Å; L306-E352 HydrophobicContact CB-CG 4.26Å; T307-E352 VanDerWaalsContact CB-OE1 3.25Å; T307-E352 WeakPolarHBondContact CB-OE1 3.29Å; T307-E352 PolarHBondContact N-OE1 3.32Å; T307-E352 PolarHBondContact OG1-OE1 3.23Å; H348-E352 PolarHBondContact O-N 3.42Å; H348-E352 VanDerWaalsContact O-N 3.11Å; E349-E352 CarbonylContact O-C 3.49Å; E349-E352 WeakPolarHBondContact O-CA 3.21Å; E349-E352 PolarHBondContact O-N 3.29Å; E352-D354 PolarHBondContact O-N 2.81Å; E352-R355 WeakPolarHBondContact O-CB 3.38Å; E352-R355 PolarHBondContact O-N 2.93Å; E352-R355 WeakPolarHBondContact OE2-CD 3.44Å; E352-R355 IonicContact OE2-NH1 3.88Å; E352-R355 PolarHBondContact OE2-NH1 2.65Å; E352-R355 VanDerWaalsContact OE2-NH1 3.1Å; E352-A356 PolarHBondContact O-N 2.71Å
353	F	98.6	Very high	98	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.2	-46.3	171.1	-178.4	-117.6	0	0	0	112.6	F61 L62 G63 M66 M93 L306 D330 E349 R355 A356 I357 V373	F61-F353 HydrophobicContact CB-CE2 3.91Å; F61-F353 HydrophobicContact CB-CZ 3.6Å; F61-F353 HydrophobicContact CD1-CD2 4.47Å; F61-F353 AromaticContact CD1-CE2 3.82Å; F61-F353 HydrophobicContact CD1-CE2 3.82Å; F61-F353 HydrophobicContact CD1-CZ 4.3Å; F61-F353 HydrophobicContact CG-CE2 4.37Å; F61-F353 HydrophobicContact CG-CZ 4.44Å; L62-F353 WeakPolarHBondContact O-CE2 3.16Å; G63-F353 VanDerWaalsContact N-CZ 3.29Å; M66-F353 HydrophobicContact CE-CD1 4.17Å; M66-F353 HydrophobicContact CE-CE1 3.69Å; M66-F353 HydrophobicContact SD-CD1 3.72Å; M66-F353 HydrophobicContact SD-CE1 3.87Å; M93-F353 HydrophobicContact CE-CD1 3.92Å; M93-F353 HydrophobicContact CE-CE1 4.03Å; L306-F353 HydrophobicContact CD2-CB 4.47Å; L306-F353 HydrophobicContact CD2-CD2 3.95Å; D330-F353 HydrophobicContact CB-CB 3.86Å; D330-F353 HydrophobicContact CB-CD2 3.6Å; D330-F353 HydrophobicContact CB-CE2 4.28Å; D330-F353 HydrophobicContact CB-CG 3.84Å; E349-F353 PolarHBondContact O-N 2.94Å; F353-R355 VanDerWaalsContact C-N 3.28Å; F353-R355 PolarHBondContact O-N 3.44Å; F353-A356 WeakPolarHBondContact O-CB 3.41Å; F353-A356 PolarHBondContact O-N 3.15Å; F353-A356 VanDerWaalsContact O-N 3.12Å; F353-I357 HydrophobicContact CD1-CD1 3.88Å; F353-I357 HydrophobicContact CE1-CD1 3.64Å; F353-I357 HydrophobicContact CG-CD1 4.46Å; F353-I357 HydrophobicContact CZ-CD1 4.05Å; F353-I357 WeakPolarHBondContact O-CG1 3.35Å; F353-I357 PolarHBondContact O-N 3.39Å; F353-V373 HydrophobicContact CE1-CG1 3.82Å; F353-V373 HydrophobicContact CZ-CG1 4.14Å
354	D	98.7	Very high	98.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.9	-32	176	-170.7	63.3	0	0	0	112.9	K78 L91 V92 M93 A350 V351 E352 I357 G358	K78-D354 IonicContact NZ-OD2 2.87Å; K78-D354 PolarHBondContact NZ-OD2 2.72Å; L91-D354 WeakPolarHBondContact CA-OD2 3.03Å; L91-D354 WeakPolarHBondContact CB-OD1 3.31Å; L91-D354 HydrophobicContact CD2-CB 4.06Å; V92-D354 WeakPolarHBondContact CA-OD1 3.46Å; V92-D354 WeakPolarHBondContact CB-OD1 3.43Å; V92-D354 PolarHBondContact N-OD1 3.22Å; V92-D354 PolarHBondContact N-OD2 2.89Å; M93-D354 HydrophobicContact CE-CB 4.27Å; M93-D354 PolarHBondContact N-OD1 3.01Å; A350-D354 PolarHBondContact O-N 3.37Å; A350-D354 VanDerWaalsContact O-N 3.08Å; V351-D354 PolarHBondContact O-N 2.72Å; E352-D354 PolarHBondContact O-N 2.81Å; D354-I357 PolarHBondContact O-N 3.13Å; D354-G358 PolarHBondContact O-N 3.44Å
355	R	98.6	Very high	98.1	Very high	117 Å²	117	27.4 Å²	27.4	44%	0.442	14%	0.136	S	C	.	.	H	α-helix	trans	-66.8	-39.9	171.5	-69.4	172	-174.2	155.3	-0.5	112.1	V351 E352 F353 I357 G358 R359	V351-R355 WeakPolarHBondContact O-CG 3.36Å; V351-R355 PolarHBondContact O-N 3.18Å; V351-R355 VanDerWaalsContact O-N 3.13Å; E352-R355 WeakPolarHBondContact O-CB 3.38Å; E352-R355 PolarHBondContact O-N 2.93Å; E352-R355 WeakPolarHBondContact OE2-CD 3.44Å; E352-R355 IonicContact OE2-NH1 3.88Å; E352-R355 PolarHBondContact OE2-NH1 2.65Å; E352-R355 VanDerWaalsContact OE2-NH1 3.1Å; F353-R355 VanDerWaalsContact C-N 3.28Å; F353-R355 PolarHBondContact O-N 3.44Å; R355-I357 VanDerWaalsContact C-N 3.32Å; R355-I357 PolarHBondContact O-N 3.01Å; R355-G358 PolarHBondContact O-N 3.36Å; R355-R359 WeakPolarHBondContact O-CB 3.25Å; R355-R359 PolarHBondContact O-N 3.45Å
356	A	98.7	Very high	98.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-38.8	175.2	0	0	0	0	0	111.8	F61 L306 T307 E352 F353 R359 A360	F61-A356 HydrophobicContact CE1-CB 4.23Å; L306-A356 HydrophobicContact CD2-CB 4.13Å; L306-A356 HydrophobicContact CG-CB 3.95Å; T307-A356 PolarHBondContact OG1-N 2.78Å; E352-A356 PolarHBondContact O-N 2.71Å; F353-A356 WeakPolarHBondContact O-CB 3.41Å; F353-A356 PolarHBondContact O-N 3.15Å; F353-A356 VanDerWaalsContact O-N 3.12Å; A356-R359 PolarHBondContact O-N 2.83Å; A356-A360 PolarHBondContact O-N 2.97Å
357	I	98.8	Very high	98.1	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-46.8	172.4	-64.8	164	0	0	0	110.6	F61 V92 M93 F96 F353 D354 R355 R359 A360 A361 V373	F61-I357 HydrophobicContact CB-CD1 4.34Å; F61-I357 HydrophobicContact CB-CG1 4.11Å; F61-I357 HydrophobicContact CD1-CD1 4.43Å; F61-I357 HydrophobicContact CD1-CG1 3.5Å; F61-I357 HydrophobicContact CD2-CG1 3.97Å; F61-I357 HydrophobicContact CE1-CG1 3.81Å; F61-I357 HydrophobicContact CE2-CG1 4.23Å; F61-I357 HydrophobicContact CG-CD1 4.36Å; F61-I357 HydrophobicContact CG-CG1 3.6Å; F61-I357 HydrophobicContact CZ-CG1 4.17Å; V92-I357 HydrophobicContact CB-CG2 4.24Å; V92-I357 HydrophobicContact CG1-CG2 3.85Å; M93-I357 HydrophobicContact CB-CD1 4.39Å; M93-I357 HydrophobicContact CE-CD1 3.61Å; F96-I357 HydrophobicContact CE1-CG2 4.06Å; F96-I357 HydrophobicContact CZ-CG2 3.87Å; F353-I357 HydrophobicContact CD1-CD1 3.88Å; F353-I357 HydrophobicContact CE1-CD1 3.64Å; F353-I357 HydrophobicContact CG-CD1 4.46Å; F353-I357 HydrophobicContact CZ-CD1 4.05Å; F353-I357 WeakPolarHBondContact O-CG1 3.35Å; F353-I357 PolarHBondContact O-N 3.39Å; D354-I357 PolarHBondContact O-N 3.13Å; R355-I357 VanDerWaalsContact C-N 3.32Å; R355-I357 PolarHBondContact O-N 3.01Å; I357-R359 VanDerWaalsContact C-N 3.33Å; I357-R359 PolarHBondContact O-N 3.31Å; I357-A360 PolarHBondContact O-N 3.29Å; I357-A361 PolarHBondContact O-N 3.5Å; I357-V373 HydrophobicContact CD1-CB 4.34Å; I357-V373 HydrophobicContact CD1-CG1 3.63Å; I357-V373 HydrophobicContact CD1-CG2 3.7Å; I357-V373 HydrophobicContact CG1-CG2 4.13Å; I357-V373 HydrophobicContact CG2-CG2 4.14Å
358	G	98.6	Very high	98.1	Very high	13 Å²	13	38 Å²	38	13%	0.134	19%	0.187	C	C	.	.	H	α-helix	trans	-55	-47.7	173.2	0	0	0	0	0	112.4	D354 R355 A360 A361 E362	D354-G358 PolarHBondContact O-N 3.44Å; R355-G358 PolarHBondContact O-N 3.36Å; G358-A360 PolarHBondContact O-N 3.3Å; G358-A361 WeakPolarHBondContact O-CB 3.45Å; G358-A361 PolarHBondContact O-N 2.98Å; G358-A361 VanDerWaalsContact O-N 3.13Å; G358-E362 PolarHBondContact O-N 2.96Å; G358-E362 VanDerWaalsContact O-N 3.11Å
359	R	98.8	Very high	98.2	Very high	63 Å²	63	36.5 Å²	36.5	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-39.4	-179	-173.8	53.4	174.3	159.6	-0.7	112.8	T307 E311 R355 A356 I357 A361 E362 L363	T307-R359 HydrophobicContact CG2-CB 3.64Å; T307-R359 HydrophobicContact CG2-CG 3.83Å; E311-R359 HydrophobicContact CB-CG 4.12Å; E311-R359 IonicContact OE1-CZ 3.89Å; E311-R359 IonicContact OE1-NE 3.05Å; E311-R359 IonicContact OE1-NH2 3.58Å; E311-R359 PolarHBondContact OE1-NH2 3.21Å; E311-R359 IonicContact OE2-CZ 3.46Å; E311-R359 VanDerWaalsContact OE2-CZ 3.24Å; E311-R359 IonicContact OE2-NE 3.94Å; E311-R359 PolarHBondContact OE2-NE 3.11Å; E311-R359 IonicContact OE2-NH2 2.81Å; E311-R359 PolarHBondContact OE2-NH2 3.28Å; R355-R359 WeakPolarHBondContact O-CB 3.25Å; R355-R359 PolarHBondContact O-N 3.45Å; A356-R359 PolarHBondContact O-N 2.83Å; I357-R359 VanDerWaalsContact C-N 3.33Å; I357-R359 PolarHBondContact O-N 3.31Å; R359-A361 VanDerWaalsContact C-N 3.32Å; R359-E362 WeakPolarHBondContact CD-OE2 3.26Å; R359-E362 IonicContact CZ-OE2 2.7Å; R359-E362 IonicContact NE-OE2 3.64Å; R359-E362 IonicContact NH1-OE2 3.26Å; R359-E362 PolarHBondContact NH1-OE2 2.92Å; R359-E362 PolarHBondContact O-N 3.44Å; R359-L363 HydrophobicContact CG-CD1 4.15Å; R359-L363 WeakPolarHBondContact O-CG 3.42Å; R359-L363 PolarHBondContact O-N 3.4Å
360	A	98.8	Very high	98.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-65.4	-36.7	173.6	0	0	0	0	0	112.3	I59 F61 T310 I314 A356 I357 G358 E362 L363 T364	I59-A360 HydrophobicContact CD1-CB 4.37Å; F61-A360 HydrophobicContact CE2-CB 3.86Å; F61-A360 HydrophobicContact CZ-CB 3.51Å; T310-A360 HydrophobicContact CG2-CB 4.23Å; I314-A360 HydrophobicContact CD1-CB 3.53Å; A356-A360 PolarHBondContact O-N 2.97Å; I357-A360 PolarHBondContact O-N 3.29Å; G358-A360 PolarHBondContact O-N 3.3Å; A360-E362 VanDerWaalsContact C-N 3.27Å; A360-E362 PolarHBondContact O-N 3.14Å; A360-L363 PolarHBondContact O-N 3.35Å; A360-L363 VanDerWaalsContact O-N 3.14Å; A360-T364 WeakPolarHBondContact O-CB 3.45Å; A360-T364 WeakPolarHBondContact O-CG2 3.31Å; A360-T364 PolarHBondContact O-N 3.08Å; A360-T364 VanDerWaalsContact O-N 3.14Å; A360-T364 PolarHBondContact O-OG1 3.13Å
361	A	98.1	Very high	98.3	Very high	31 Å²	31	36.5 Å²	36.5	26%	0.256	18%	0.18	S	C	.	.	H	α-helix	trans	-62.1	-34.1	175.2	0	0	0	0	0	112.5	I357 G358 R359 L363 K461	I357-A361 PolarHBondContact O-N 3.5Å; G358-A361 WeakPolarHBondContact O-CB 3.45Å; G358-A361 PolarHBondContact O-N 2.98Å; G358-A361 VanDerWaalsContact O-N 3.13Å; R359-A361 VanDerWaalsContact C-N 3.32Å; A361-L363 VanDerWaalsContact C-N 3.33Å; A361-K461 VanDerWaalsContact CB-NZ 3.26Å
362	E	98.5	Very high	98.3	Very high	139 Å²	139	36.4 Å²	36.4	65%	0.65	18%	0.18	S	C	*	.	H	α-helix	trans	-71.6	-26.6	175	-66.6	170.7	178	0	0	113.4	G358 R359 A360	G358-E362 PolarHBondContact O-N 2.96Å; G358-E362 VanDerWaalsContact O-N 3.11Å; R359-E362 WeakPolarHBondContact CD-OE2 3.26Å; R359-E362 IonicContact CZ-OE2 2.7Å; R359-E362 IonicContact NE-OE2 3.64Å; R359-E362 IonicContact NH1-OE2 3.26Å; R359-E362 PolarHBondContact NH1-OE2 2.92Å; R359-E362 PolarHBondContact O-N 3.44Å; A360-E362 VanDerWaalsContact C-N 3.27Å; A360-E362 PolarHBondContact O-N 3.14Å
363	L	98.5	Very high	98.4	Very high	41 Å²	41	36 Å²	36	22%	0.215	18%	0.178	C	C	.	.	H	α-helix	trans	-97.1	-5.1	-174.3	-66.1	171	0	0	0	113.5	E311 I314 R359 A360 A361	E311-L363 HydrophobicContact CB-CD1 3.96Å; E311-L363 HydrophobicContact CG-CD1 3.89Å; I314-L363 HydrophobicContact CB-CD1 4.41Å; I314-L363 HydrophobicContact CD1-CB 4.46Å; I314-L363 HydrophobicContact CD1-CD1 4.32Å; I314-L363 HydrophobicContact CG2-CB 3.92Å; I314-L363 HydrophobicContact CG2-CD1 4.4Å; R359-L363 HydrophobicContact CG-CD1 4.15Å; R359-L363 WeakPolarHBondContact O-CG 3.42Å; R359-L363 PolarHBondContact O-N 3.4Å; A360-L363 PolarHBondContact O-N 3.35Å; A360-L363 VanDerWaalsContact O-N 3.14Å; A361-L363 VanDerWaalsContact C-N 3.33Å
364	T	98.4	Very high	98.4	Very high	28 Å²	28	36 Å²	36	17%	0.172	18%	0.178	C	C	.	.	S	Bend	trans	-129.7	162.4	-173.4	59.4	0	0	0	0	112	I59 I314 Y324 A360 T369	I59-T364 HydrophobicContact CD1-CG2 3.96Å; I314-T364 HydrophobicContact CG2-CG2 4.34Å; Y324-T364 WeakPolarHBondContact OH-CG2 3.31Å; A360-T364 WeakPolarHBondContact O-CB 3.45Å; A360-T364 WeakPolarHBondContact O-CG2 3.31Å; A360-T364 PolarHBondContact O-N 3.08Å; A360-T364 VanDerWaalsContact O-N 3.14Å; A360-T364 PolarHBondContact O-OG1 3.13Å; T364-T369 HydrophobicContact CG2-CG2 4.2Å
365	N	97.6	Very high	98.4	Very high	88 Å²	88	36 Å²	36	47%	0.471	18%	0.178	S	C	.	.			trans	-109.3	120.3	177.3	-170.3	-27	0	0	0	109.7	M367 D368 T369	N365-M367 PolarHBondContact O-N 3.41Å; N365-M367 VanDerWaalsContact O-N 3.07Å; N365-M367 VanDerWaalsContact OD1-CB 3.25Å; N365-M367 WeakPolarHBondContact OD1-CB 3.21Å; N365-M367 WeakPolarHBondContact OD1-CG 3.48Å; N365-M367 PolarHBondContact OD1-N 3.5Å; N365-D368 PolarHBondContact O-N 3.31Å; N365-T369 VanDerWaalsContact O-CB 3.24Å; N365-T369 WeakPolarHBondContact O-CB 3.44Å; N365-T369 PolarHBondContact O-N 2.93Å; N365-T369 PolarHBondContact O-OG1 3.18Å
366	E	95.8	Very high	98.3	Very high	118 Å²	118	30.5 Å²	30.5	55%	0.551	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.4	178.1	64.9	179.9	-162	0	0	113.6	D368 G462 P463	E366-D368 VanDerWaalsContact C-N 3.31Å; E366-G462 WeakPolarHBondContact O-CA 3.33Å; E366-P463 WeakPolarHBondContact O-CD 3.47Å
367	M	96.9	Very high	98.3	Very high	76 Å²	76	30.5 Å²	30.5	37%	0.374	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.5	173.5	-65.6	-59.8	-61.8	0	0	113.1	N51 N365 P463	N51-M367 PolarHBondContact ND2-O 3.02Å; N365-M367 PolarHBondContact O-N 3.41Å; N365-M367 VanDerWaalsContact O-N 3.07Å; N365-M367 VanDerWaalsContact OD1-CB 3.25Å; N365-M367 WeakPolarHBondContact OD1-CB 3.21Å; N365-M367 WeakPolarHBondContact OD1-CG 3.48Å; N365-M367 PolarHBondContact OD1-N 3.5Å; M367-P463 WeakPolarHBondContact O-CG 3.33Å
368	D	97.8	Very high	98.3	Very high	34 Å²	34	30.4 Å²	30.4	18%	0.182	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-2.3	-176.9	77.9	-3.2	0	0	0	114.5	A55 K56 N57 N365 E366	A55-D368 CarbonylContact C-O 3.48Å; K56-D368 WeakPolarHBondContact CA-O 2.97Å; K56-D368 HydrophobicContact CB-CB 4.03Å; K56-D368 WeakPolarHBondContact CB-O 3.44Å; K56-D368 PolarHBondContact N-O 3.17Å; N57-D368 PolarHBondContact N-O 3Å; N57-D368 PolarHBondContact ND2-OD1 2.72Å; N365-D368 PolarHBondContact O-N 3.31Å; E366-D368 VanDerWaalsContact C-N 3.31Å
369	T	98.8	Very high	98.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.1	-176.8	-57.1	0	0	0	0	110.4	N57 I59 T364 N365 G462 P463	N57-T369 HydrophobicContact CB-CG2 3.88Å; N57-T369 PolarHBondContact ND2-OG1 3.46Å; N57-T369 WeakPolarHBondContact O-CA 3.4Å; I59-T369 HydrophobicContact CD1-CG2 4.1Å; I59-T369 HydrophobicContact CG1-CG2 4.17Å; T364-T369 HydrophobicContact CG2-CG2 4.2Å; N365-T369 VanDerWaalsContact O-CB 3.24Å; N365-T369 WeakPolarHBondContact O-CB 3.44Å; N365-T369 PolarHBondContact O-N 2.93Å; N365-T369 PolarHBondContact O-OG1 3.18Å; T369-G462 WeakPolarHBondContact O-CA 3.35Å; T369-P463 VanDerWaalsContact C-CD 3.42Å; T369-P463 VanDerWaalsContact O-CD 3.32Å; T369-P463 WeakPolarHBondContact O-CD 3.35Å
370	L	98.9	Very high	98.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	119.2	168.8	172.1	57.7	0	0	0	108.3	A55 N57 L58 I59 V372 K461 P463 F468 M481 A484	A55-L370 HydrophobicContact CB-CB 3.96Å; N57-L370 PolarHBondContact O-N 2.81Å; L58-L370 WeakPolarHBondContact CA-O 3.24Å; L58-L370 HydrophobicContact CD2-CB 3.92Å; L58-L370 HydrophobicContact CD2-CD2 4.04Å; L58-L370 HydrophobicContact CD2-CG 4.37Å; I59-L370 PolarHBondContact N-O 2.56Å; L370-V372 HydrophobicContact CD1-CG2 4.05Å; L370-V372 HydrophobicContact CD2-CG2 4.5Å; L370-V372 HydrophobicContact CG-CG2 4.09Å; L370-K461 WeakPolarHBondContact CD1-O 3.31Å; L370-P463 WeakPolarHBondContact CD1-O 3.27Å; L370-F468 HydrophobicContact CD1-CE2 4.5Å; L370-M481 HydrophobicContact CD2-CB 4.44Å; L370-M481 HydrophobicContact CD2-CG 4.06Å; L370-A484 HydrophobicContact CD2-CB 3.53Å
371	T	98.9	Very high	98.3	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.025	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.6	172.8	-52.5	0	0	0	0	109.2	I59 F61 F96 A460 K461	I59-T371 HydrophobicContact CB-CG2 4.32Å; I59-T371 WeakPolarHBondContact O-CA 3.47Å; F61-T371 HydrophobicContact CD2-CG2 3.69Å; F61-T371 HydrophobicContact CE2-CG2 3.81Å; F96-T371 HydrophobicContact CE2-CG2 3.8Å; F96-T371 HydrophobicContact CZ-CG2 3.85Å; T371-A460 WeakPolarHBondContact O-CA 3.35Å; T371-K461 PolarHBondContact N-O 3.46Å; T371-K461 PolarHBondContact O-N 2.63Å
372	V	98.9	Very high	98.2	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133	175.8	-176.5	0	0	0	0	108.1	I59 L60 F61 L370 I458 F459 A460 F468 I477 M481	I59-V372 PolarHBondContact O-N 2.89Å; L60-V372 WeakPolarHBondContact CA-O 3.36Å; L60-V372 HydrophobicContact CD1-CB 3.97Å; L60-V372 HydrophobicContact CD1-CG1 3.96Å; F61-V372 PolarHBondContact N-O 2.86Å; L370-V372 HydrophobicContact CD1-CG2 4.05Å; L370-V372 HydrophobicContact CD2-CG2 4.5Å; L370-V372 HydrophobicContact CG-CG2 4.09Å; V372-I458 HydrophobicContact CG1-CG2 3.61Å; V372-F459 CarbonylContact C-O 3.57Å; V372-F459 WeakPolarHBondContact CA-O 3.42Å; V372-A460 HydrophobicContact CG2-CB 4.42Å; V372-F468 HydrophobicContact CG1-CE1 4.48Å; V372-F468 HydrophobicContact CG1-CZ 4.19Å; V372-F468 HydrophobicContact CG2-CE2 3.65Å; V372-F468 HydrophobicContact CG2-CZ 3.74Å; V372-I477 HydrophobicContact CG1-CG2 4.3Å; V372-M481 HydrophobicContact CB-SD 4.39Å; V372-M481 HydrophobicContact CG2-CG 4.02Å; V372-M481 HydrophobicContact CG2-SD 4.09Å
373	V	98.9	Very high	97.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131	172.6	-175.3	0	0	0	0	107.5	F61 M66 M93 F96 F353 I357 I458 F459	F61-V373 HydrophobicContact CB-CB 4.27Å; F61-V373 HydrophobicContact CB-CG1 4.2Å; F61-V373 HydrophobicContact CB-CG2 3.95Å; F61-V373 HydrophobicContact CD2-CG2 4.4Å; F61-V373 HydrophobicContact CG-CG2 4.48Å; F61-V373 WeakPolarHBondContact O-CA 3.38Å; M66-V373 HydrophobicContact CE-CG1 4.36Å; M93-V373 HydrophobicContact CB-CB 4.41Å; M93-V373 HydrophobicContact CB-CG1 4.2Å; M93-V373 HydrophobicContact CB-CG2 4.3Å; M93-V373 HydrophobicContact CE-CG1 4.14Å; M93-V373 HydrophobicContact SD-CG1 4.2Å; F96-V373 HydrophobicContact CD2-CG2 4.49Å; F96-V373 HydrophobicContact CE2-CG2 3.78Å; F96-V373 HydrophobicContact CZ-CG2 3.99Å; F353-V373 HydrophobicContact CE1-CG1 3.82Å; F353-V373 HydrophobicContact CZ-CG1 4.14Å; I357-V373 HydrophobicContact CD1-CB 4.34Å; I357-V373 HydrophobicContact CD1-CG1 3.63Å; I357-V373 HydrophobicContact CD1-CG2 3.7Å; I357-V373 HydrophobicContact CG1-CG2 4.13Å; I357-V373 HydrophobicContact CG2-CG2 4.14Å; V373-I458 CarbonylContact O-C 3.58Å; V373-I458 WeakPolarHBondContact O-CA 3.42Å; V373-F459 HydrophobicContact CB-CB 4.2Å; V373-F459 HydrophobicContact CB-CD2 4.32Å; V373-F459 HydrophobicContact CG1-CD2 4.45Å; V373-F459 PolarHBondContact N-O 2.88Å; V373-F459 PolarHBondContact O-N 2.83Å
374	T	98.8	Very high	97.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	175.2	178.3	-169.7	0	0	0	0	110.4	L60 F61 L62 G63 A457 I477	L60-T374 HydrophobicContact CD1-CG2 4.01Å; F61-T374 PolarHBondContact O-N 3.4Å; L62-T374 WeakPolarHBondContact CA-O 3.19Å; L62-T374 HydrophobicContact CD2-CG2 3.56Å; G63-T374 PolarHBondContact N-O 3.04Å; T374-A457 WeakPolarHBondContact CA-O 3.18Å; T374-A457 PolarHBondContact OG1-O 3.11Å; T374-I477 HydrophobicContact CG2-CD1 4.05Å
375	A	98.6	Very high	96.9	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.008	17%	0.166	C	C	.	.			trans	-110.5	165.4	159.3	0	0	0	0	0	110.5	G63 M66 H377 V456	G63-A375 WeakPolarHBondContact O-CA 3.45Å; G63-A375 WeakPolarHBondContact O-CB 3.43Å; M66-A375 HydrophobicContact CB-CB 4.13Å; M66-A375 WeakPolarHBondContact O-CB 3.23Å; A375-H377 WeakPolarHBondContact CB-O 3.41Å; A375-V456 HydrophobicContact CB-CB 4Å; A375-V456 HydrophobicContact CB-CG1 4.03Å; A375-V456 HydrophobicContact CB-CG2 4.2Å; A375-V456 WeakPolarHBondContact O-CG2 3.42Å
376	D	98	Very high	96.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-85.1	-40.5	171.3	63.8	-27	0	0	0	111.6	L62 D64 G65 T104 S114 T117 Y121 Q474	L62-D376 HydrophobicContact CD1-CB 4.12Å; L62-D376 HydrophobicContact CD2-CB 4.27Å; D64-D376 WeakPolarHBondContact CA-OD1 3.34Å; G65-D376 PolarHBondContact N-OD1 3.1Å; T104-D376 WeakPolarHBondContact CB-O 3.3Å; T104-D376 VanDerWaalsContact CG2-O 3.26Å; T104-D376 WeakPolarHBondContact CG2-O 3.44Å; S114-D376 WeakPolarHBondContact CB-OD2 3.45Å; T117-D376 WeakPolarHBondContact CG2-O 3.3Å; Y121-D376 HydrophobicContact CD1-CB 4.25Å; Y121-D376 HydrophobicContact CE1-CB 3.54Å; D376-Q474 PolarHBondContact O-NE2 3.31Å
377	H	98.4	Very high	95.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.			trans	-154.8	-174.1	171.7	54.4	71.9	0	0	0	111.3	D64 G65 P112 D335 A375 H451	D64-H377 IonicContact OD1-CE1 3.92Å; D64-H377 IonicContact OD1-NE2 3.34Å; G65-H377 CarbonylContact C-O 3.55Å; G65-H377 VanDerWaalsContact C-O 3.28Å; G65-H377 WeakPolarHBondContact CA-O 3.46Å; P112-H377 HydrophobicContact CG-CB 3.74Å; D335-H377 IonicContact OD1-CE1 3.91Å; D335-H377 PolarHBondContact OD1-CE1 2.65Å; A375-H377 WeakPolarHBondContact CB-O 3.41Å; H377-H451 AromaticContact CD2-CE1 3.94Å; H377-H451 AromaticContact CD2-ND1 3.69Å; H377-H451 AromaticContact CE1-CD2 3.2Å; H377-H451 PolarHBondContact CE1-CD2 3.18Å; H377-H451 AromaticContact CE1-CE1 3.31Å; H377-H451 PolarHBondContact CE1-CE1 2.78Å; H377-H451 AromaticContact CE1-CG 3.33Å; H377-H451 AromaticContact CE1-ND1 3.4Å; H377-H451 PolarHBondContact CE1-ND1 3.26Å; H377-H451 AromaticContact CE1-NE2 3.27Å; H377-H451 PolarHBondContact CE1-NE2 3.17Å; H377-H451 VanDerWaalsContact CE1-NE2 3.27Å; H377-H451 AromaticContact CG-CG 3.99Å; H377-H451 AromaticContact CG-ND1 3.93Å; H377-H451 AromaticContact ND1-CD2 3.66Å; H377-H451 AromaticContact ND1-CG 3.43Å; H377-H451 AromaticContact ND1-ND1 3.74Å; H377-H451 AromaticContact NE2-CD2 3.84Å; H377-H451 AromaticContact NE2-CE1 3.11Å; H377-H451 PolarHBondContact NE2-CE1 3.29Å; H377-H451 AromaticContact NE2-CG 3.75Å; H377-H451 AromaticContact NE2-ND1 3.29Å; H377-H451 PolarHBondContact NE2-ND1 3.26Å; H377-H451 AromaticContact NE2-NE2 3.53Å
378	S	98.4	Very high	95.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-160.1	172.6	-162.5	0	0	0	0	111.5	G67 H451 G452 E454	G67-S378 VanDerWaalsContact CA-OG 3.29Å; G67-S378 WeakPolarHBondContact CA-OG 3.43Å; S378-H451 WeakPolarHBondContact O-CA 3.27Å; S378-G452 PolarHBondContact O-N 3.29Å; S378-E454 VanDerWaalsContact CB-CD 3.44Å; S378-E454 WeakPolarHBondContact CB-OE1 3.44Å; S378-E454 PolarHBondContact OG-OE1 2.77Å
379	H	98.6	Very high	95.1	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.6	175.3	-81.1	-84.1	0	0	0	109.3	G65 D335 H338 F381 E449 H451	G65-H379 PolarHBondContact O-CD2 3.47Å; D335-H379 WeakPolarHBondContact CA-NE2 3.49Å; D335-H379 IonicContact OD1-CE1 2.93Å; D335-H379 PolarHBondContact OD1-CE1 3.33Å; D335-H379 IonicContact OD1-NE2 3.93Å; D335-H379 PolarHBondContact OD1-NE2 2.85Å; H338-H379 HydrophobicContact CB-CB 4.05Å; H338-H379 VanDerWaalsContact CB-CE1 3.46Å; H338-H379 WeakPolarHBondContact CB-CE1 3.21Å; H338-H379 VanDerWaalsContact CB-ND1 3.31Å; H338-H379 WeakPolarHBondContact CB-ND1 3.39Å; H338-H379 AromaticContact CD2-CD2 3.37Å; H338-H379 PolarHBondContact CD2-CD2 2.7Å; H338-H379 AromaticContact CD2-CG 3.84Å; H338-H379 AromaticContact CD2-NE2 3.89Å; H338-H379 AromaticContact CG-CD2 3.67Å; H338-H379 AromaticContact CG-CG 3.7Å; H379-F381 HydrophobicContact CB-CB 4.03Å; H379-F381 PolarHBondContact O-N 3.14Å; H379-E449 WeakPolarHBondContact CB-OE1 3.35Å; H379-E449 IonicContact CE1-OE2 2.89Å; H379-E449 IonicContact CG-OE1 2.84Å; H379-E449 IonicContact CG-OE2 3.17Å; H379-E449 IonicContact ND1-OE1 3.53Å; H379-E449 IonicContact ND1-OE2 3.64Å; H379-E449 PolarHBondContact ND1-OE2 3.46Å; H379-H451 AromaticContact CE1-CD2 3.77Å
380	V	98.3	Very high	94.8	Very high	47 Å²	47	28.3 Å²	28.3	29%	0.285	17%	0.173	S	C	.	.	S	Bend	trans	-78.1	34.2	168.1	-60.9	0	0	0	0	111.7	Y412 G413 E449 T450	V380-Y412 CarbonylContact O-C 3.52Å; V380-Y412 VanDerWaalsContact O-CA 3.3Å; V380-Y412 WeakPolarHBondContact O-CA 3.47Å; V380-G413 PolarHBondContact O-N 3.44Å; V380-E449 WeakPolarHBondContact CA-OE1 3.34Å; V380-E449 HydrophobicContact CG2-CG 3.73Å; V380-E449 WeakPolarHBondContact CG2-OE1 3.29Å; V380-E449 PolarHBondContact N-OE1 2.9Å; V380-T450 PolarHBondContact N-O 3.22Å
381	F	98.4	Very high	94.5	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129.6	175	173.5	-116.1	0	0	0	110.3	P69 A73 H338 A343 L347 H379 F383 A410 Y412	P69-F381 HydrophobicContact CB-CD1 3.86Å; P69-F381 HydrophobicContact CB-CE1 4.3Å; P69-F381 WeakPolarHBondContact CB-O 3.16Å; A73-F381 HydrophobicContact CB-CE1 3.78Å; A73-F381 HydrophobicContact CB-CZ 3.96Å; H338-F381 AromaticContact CE1-CD1 3.83Å; H338-F381 AromaticContact CE1-CG 3.72Å; A343-F381 HydrophobicContact CB-CE2 3.95Å; L347-F381 HydrophobicContact CD2-CE1 4.49Å; H379-F381 HydrophobicContact CB-CB 4.03Å; H379-F381 PolarHBondContact O-N 3.14Å; F381-F383 HydrophobicContact CE1-CD1 4.07Å; F381-F383 HydrophobicContact CZ-CB 4.37Å; F381-F383 HydrophobicContact CZ-CD1 4.31Å; F381-A410 HydrophobicContact CE2-CB 3.85Å; F381-A410 HydrophobicContact CZ-CB 4.37Å; F381-Y412 HydrophobicContact CB-CD1 3.89Å; F381-Y412 HydrophobicContact CB-CE1 3.6Å; F381-Y412 HydrophobicContact CD2-CD1 4.26Å; F381-Y412 AromaticContact CD2-CE1 3.75Å; F381-Y412 HydrophobicContact CD2-CE1 3.75Å; F381-Y412 HydrophobicContact CD2-CE2 4.01Å; F381-Y412 AromaticContact CD2-CZ 3.59Å; F381-Y412 HydrophobicContact CG-CE1 4.08Å
382	A	96.8	Very high	94.3	Very high	47 Å²	47	31.7 Å²	31.7	39%	0.388	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.5	172.6	0	0	0	0	0	110.1	A410 V411	A382-A410 WeakPolarHBondContact O-CA 3.45Å; A382-V411 HydrophobicContact CB-CG2 4.27Å; A382-V411 PolarHBondContact N-O 3.23Å; A382-V411 PolarHBondContact O-N 3.02Å
383	F	92.8	Very high	94.1	Very high	64 Å²	64	31.9 Å²	31.9	28%	0.281	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.8	169	67.6	-78.6	0	0	0	109.5	P69 T72 A73 I76 F381 V393 T409	P69-F383 HydrophobicContact CB-CD1 4.45Å; P69-F383 HydrophobicContact CB-CE1 4.27Å; P69-F383 VanDerWaalsContact O-CE1 3.25Å; P69-F383 WeakPolarHBondContact O-CE1 3.45Å; T72-F383 HydrophobicContact CG2-CE1 4.37Å; T72-F383 HydrophobicContact CG2-CE2 4.29Å; T72-F383 HydrophobicContact CG2-CZ 3.52Å; A73-F383 HydrophobicContact CB-CD1 4.04Å; A73-F383 HydrophobicContact CB-CE1 4.16Å; A73-F383 HydrophobicContact CB-CG 4.49Å; I76-F383 HydrophobicContact CD1-CE2 4Å; F381-F383 HydrophobicContact CE1-CD1 4.07Å; F381-F383 HydrophobicContact CZ-CB 4.37Å; F381-F383 HydrophobicContact CZ-CD1 4.31Å; F383-V393 HydrophobicContact CD2-CG2 4.4Å; F383-T409 CarbonylContact C-O 3.59Å; F383-T409 WeakPolarHBondContact CA-O 3.49Å; F383-T409 HydrophobicContact CB-CG2 4.4Å
384	G	89.9	Confident	93.9	Very high	38 Å²	38	32.4 Å²	32.4	39%	0.392	20%	0.199	S	C	.	.			trans	-174.2	-153.6	-174.8	0	0	0	0	0	112.4	T409	G384-T409 PolarHBondContact N-O 2.84Å; G384-T409 WeakPolarHBondContact O-CA 3.41Å; G384-T409 VanDerWaalsContact O-CG2 3.28Å; G384-T409 WeakPolarHBondContact O-CG2 3.37Å
385	G	85.1	Confident	93.6	Very high	47 Å²	47	32.4 Å²	32.4	49%	0.485	20%	0.199	S	C	.	.	S	Bend	trans	96	-173.1	-175.1	0	0	0	0	0	113.2
386	Y	83.3	Confident	93.4	Very high	194 Å²	194	32.9 Å²	32.9	76%	0.761	20%	0.202	S	C	*	.	S	Bend	trans	-110	74.1	-173.1	-64.9	-80.2	0	0	0	110.7	A399	Y386-A399 HydrophobicContact CD2-CB 4.28Å; Y386-A399 HydrophobicContact CG-CB 4.5Å
387	S	86.5	Confident	93	Very high	39 Å²	39	33 Å²	33	27%	0.273	20%	0.203	S	C	.	.			trans	-112.9	147.3	176.6	-72.8	0	0	0	0	111	N391 S397	S387-N391 PolarHBondContact OG-ND2 3.04Å; S387-S397 WeakPolarHBondContact OG-CA 3.48Å
388	A	88.8	Confident	92.5	Very high	27 Å²	27	39.8 Å²	39.8	22%	0.223	23%	0.228	C	C	.	.			trans	-75.1	159.9	173.8	0	0	0	0	0	110.5	N391	A388-N391 WeakPolarHBondContact O-CB 3.24Å; A388-N391 PolarHBondContact O-N 2.83Å; A388-N391 VanDerWaalsContact O-N 3.09Å
389	R	92.2	Very high	92.1	Very high	51 Å²	51	41.3 Å²	41.3	19%	0.192	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	139.1	172.3	-169.4	176.5	-178.6	-125.8	21.2	112.3	C23 E28 S85 E87 E88 N391	C23-R389 PolarHBondContact O-NH1 3.34Å; E28-R389 IonicContact OE1-CZ 3.32Å; E28-R389 IonicContact OE1-NH1 3.25Å; E28-R389 PolarHBondContact OE1-NH1 3.45Å; E28-R389 IonicContact OE1-NH2 2.75Å; E28-R389 PolarHBondContact OE1-NH2 3.34Å; E28-R389 IonicContact OE2-CZ 3.33Å; E28-R389 IonicContact OE2-NH1 3.18Å; E28-R389 PolarHBondContact OE2-NH1 2.97Å; E28-R389 IonicContact OE2-NH2 3.47Å; E28-R389 PolarHBondContact OE2-NH2 3.01Å; S85-R389 PolarHBondContact OG-NH1 2.93Å; S85-R389 VanDerWaalsContact OG-NH1 3.08Å; S85-R389 PolarHBondContact OG-NH2 2.75Å; E87-R389 HydrophobicContact CG-CG 4.46Å; E87-R389 WeakPolarHBondContact OE1-CA 3.46Å; E87-R389 VanDerWaalsContact OE2-CG 3.26Å; E87-R389 WeakPolarHBondContact OE2-CG 3.39Å; E87-R389 IonicContact OE2-NE 3.62Å; E88-R389 VanDerWaalsContact CB-NH2 3.29Å; E88-R389 VanDerWaalsContact CD-NH2 3.33Å; E88-R389 IonicContact OE2-CZ 3.49Å; E88-R389 VanDerWaalsContact OE2-CZ 3.26Å; E88-R389 IonicContact OE2-NE 2.8Å; E88-R389 IonicContact OE2-NH2 3.31Å; E88-R389 PolarHBondContact OE2-NH2 2.83Å; R389-N391 VanDerWaalsContact C-N 3.28Å
390	G	92.4	Very high	91.8	Very high	29 Å²	29	45.8 Å²	45.8	30%	0.299	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	7.5	-175.1	0	0	0	0	0	114.1	S85 E87	S85-G390 WeakPolarHBondContact O-CA 2.87Å; E87-G390 PolarHBondContact OE1-N 2.79Å; E87-G390 PolarHBondContact OE2-N 2.75Å
391	N	93.1	Very high	91.7	Very high	23 Å²	23	45 Å²	45	12%	0.123	26%	0.264	C	S	.	.			trans	-67.2	137.3	167.3	-167.6	78.4	0	0	0	109.1	Q80 S387 A388 R389 V393 T409	Q80-N391 PolarHBondContact NE2-O 2.71Å; S387-N391 PolarHBondContact OG-ND2 3.04Å; A388-N391 WeakPolarHBondContact O-CB 3.24Å; A388-N391 PolarHBondContact O-N 2.83Å; A388-N391 VanDerWaalsContact O-N 3.09Å; R389-N391 VanDerWaalsContact C-N 3.28Å; N391-V393 PolarHBondContact O-N 3.36Å; N391-T409 PolarHBondContact ND2-OG1 2.93Å
392	S	93.9	Very high	91.6	Very high	51 Å²	51	54.2 Å²	54.2	36%	0.357	31%	0.309	S	S	.	.			trans	-52.4	129.4	175.5	179.3	0	0	0	0	110	L394 G395	S392-L394 PolarHBondContact O-N 2.84Å; S392-L394 PolarHBondContact OG-N 3.2Å; S392-G395 WeakPolarHBondContact O-CA 3.01Å; S392-G395 PolarHBondContact O-N 3.05Å; S392-G395 PolarHBondContact OG-N 3.04Å
393	V	94.7	Very high	91.5	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.024	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.5	179.6	67.2	0	0	0	0	112.2	A73 I76 L77 L347 F383 N391	A73-V393 HydrophobicContact CB-CG2 3.85Å; I76-V393 HydrophobicContact CB-CB 4.2Å; I76-V393 HydrophobicContact CB-CG2 4.31Å; I76-V393 HydrophobicContact CD1-CG2 4.36Å; I76-V393 HydrophobicContact CG2-CB 3.81Å; I76-V393 HydrophobicContact CG2-CG1 4.43Å; I76-V393 HydrophobicContact CG2-CG2 4.34Å; L77-V393 HydrophobicContact CB-CG1 3.95Å; L77-V393 HydrophobicContact CD1-CG1 4.48Å; L347-V393 HydrophobicContact CD1-CG1 3.96Å; F383-V393 HydrophobicContact CD2-CG2 4.4Å; N391-V393 PolarHBondContact O-N 3.36Å
394	L	93.8	Very high	91.7	Very high	11 Å²	11	60.4 Å²	60.4	6%	0.058	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-0.2	174.3	-61.9	167.9	0	0	0	112.8	A343 K344 L347 S392	A343-L394 HydrophobicContact CB-CD2 3.69Å; K344-L394 HydrophobicContact CB-CD1 3.7Å; K344-L394 HydrophobicContact CD-CD1 4.33Å; K344-L394 HydrophobicContact CG-CD1 3.7Å; L347-L394 HydrophobicContact CD1-CD2 3.79Å; L347-L394 HydrophobicContact CD1-CG 4.19Å; S392-L394 PolarHBondContact O-N 2.84Å; S392-L394 PolarHBondContact OG-N 3.2Å
395	G	93.4	Very high	92	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.01	32%	0.32	C	S	.	.	S	Bend	trans	-81.2	-177.6	-174.5	0	0	0	0	0	113.8	S392 T408 T409	S392-G395 WeakPolarHBondContact O-CA 3.01Å; S392-G395 PolarHBondContact O-N 3.05Å; S392-G395 PolarHBondContact OG-N 3.04Å; G395-T408 WeakPolarHBondContact O-CA 3.32Å; G395-T409 PolarHBondContact O-N 3.18Å; G395-T409 PolarHBondContact O-OG1 3Å; G395-T409 VanDerWaalsContact O-OG1 3.07Å
396	V	94.2	Very high	92.5	Very high	11 Å²	11	61.5 Å²	61.5	7%	0.067	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-86.7	139.3	-177.9	-176.4	0	0	0	0	110.8	H406 F407 T408 M428 N429 E430 S433	V396-H406 HydrophobicContact CG1-CB 3.55Å; V396-F407 WeakPolarHBondContact CG1-O 3.29Å; V396-T408 HydrophobicContact CG2-CG2 4.48Å; V396-M428 HydrophobicContact CG2-CB 4.49Å; V396-N429 VanDerWaalsContact CG2-C 3.5Å; V396-E430 WeakPolarHBondContact CB-OE1 3.17Å; V396-E430 HydrophobicContact CG2-CG 4.47Å; V396-E430 PolarHBondContact N-OE1 3.41Å; V396-S433 WeakPolarHBondContact CG2-OG 3.2Å
397	S	90.9	Very high	93	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.014	29%	0.285	C	S	.	.			trans	-62.5	137.8	172.2	167.1	0	0	0	0	110.6	S387 A399 F407	S387-S397 WeakPolarHBondContact OG-CA 3.48Å; S397-A399 VanDerWaalsContact C-N 3.28Å; S397-A399 PolarHBondContact O-N 2.75Å; S397-A399 PolarHBondContact OG-N 2.87Å; S397-A399 PolarHBondContact OG-O 3.17Å; S397-F407 VanDerWaalsContact CB-CZ 3.41Å; S397-F407 WeakPolarHBondContact CB-O 3.46Å; S397-F407 PolarHBondContact N-O 3.17Å; S397-F407 VanDerWaalsContact OG-CE1 3.31Å; S397-F407 WeakPolarHBondContact OG-CE1 3.48Å; S397-F407 WeakPolarHBondContact OG-CZ 3.33Å
398	R	87.3	Confident	93.4	Very high	142 Å²	142	52.5 Å²	52.5	54%	0.536	27%	0.272	S	S	.	.	S	Bend	trans	-70.6	-25.5	176.7	-63.3	-175.3	-179.9	-174	0.2	113.1
399	A	89.5	Confident	93.7	Very high	32 Å²	32	51.9 Å²	51.9	26%	0.264	27%	0.265	S	S	.	.	S	Bend	trans	-88.9	142.1	176	0	0	0	0	0	111	Y386 S397 F407	Y386-A399 HydrophobicContact CD2-CB 4.28Å; Y386-A399 HydrophobicContact CG-CB 4.5Å; S397-A399 VanDerWaalsContact C-N 3.28Å; S397-A399 PolarHBondContact O-N 2.75Å; S397-A399 PolarHBondContact OG-N 2.87Å; S397-A399 PolarHBondContact OG-O 3.17Å; A399-F407 VanDerWaalsContact O-CE1 3.26Å; A399-F407 WeakPolarHBondContact O-CE1 3.43Å
400	L	93.3	Very high	93.8	Very high	95 Å²	95	49.4 Å²	49.4	50%	0.497	26%	0.256	S	S	.	.			trans	-74.4	146.1	169.2	-62.1	176.2	0	0	0	110.4
401	A	95	Very high	94	Very high	32 Å²	32	50.3 Å²	50.3	26%	0.264	26%	0.255	S	S	.	.			trans	-74	175.1	167.7	0	0	0	0	0	111.3	D403 K404 K405 F407	A401-D403 WeakPolarHBondContact CB-OD1 3.47Å; A401-D403 PolarHBondContact O-N 3.04Å; A401-D403 VanDerWaalsContact O-N 3.16Å; A401-K404 WeakPolarHBondContact O-CA 3.3Å; A401-K404 PolarHBondContact O-N 3.08Å; A401-K405 PolarHBondContact N-O 2.81Å; A401-F407 HydrophobicContact CB-CD1 4.04Å; A401-F407 HydrophobicContact CB-CE1 4.47Å
402	M	96	Very high	94.3	Very high	198 Å²	198	49.5 Å²	49.5	98%	0.975	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.7	-178.2	-67	177.7	66.9	0	0	113.7	K404	M402-K404 PolarHBondContact O-N 3.2Å
403	D	95.6	Very high	94.5	Very high	69 Å²	69	48.4 Å²	48.4	37%	0.369	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	8.6	175.4	65.5	-2.2	0	0	0	113.6	A401 K405 R425	A401-D403 WeakPolarHBondContact CB-OD1 3.47Å; A401-D403 PolarHBondContact O-N 3.04Å; A401-D403 VanDerWaalsContact O-N 3.16Å; D403-K405 VanDerWaalsContact C-N 3.25Å; D403-K405 PolarHBondContact O-N 3.44Å; D403-K405 WeakPolarHBondContact OD1-CB 3.33Å; D403-K405 PolarHBondContact OD1-N 2.82Å; D403-K405 VanDerWaalsContact OD1-N 3.17Å; D403-R425 IonicContact OD1-CZ 3.57Å; D403-R425 IonicContact OD1-NE 3.61Å; D403-R425 IonicContact OD1-NH2 3.86Å; D403-R425 PolarHBondContact OD1-NH2 3.45Å; D403-R425 IonicContact OD2-CZ 2.78Å; D403-R425 IonicContact OD2-NE 2.71Å; D403-R425 PolarHBondContact OD2-NE 2.94Å; D403-R425 IonicContact OD2-NH2 3.72Å; D403-R425 PolarHBondContact OD2-NH2 2.91Å
404	K	96.6	Very high	94.6	Very high	172 Å²	172	49.4 Å²	49.4	75%	0.748	25%	0.253	S	S	*	.	S	Bend	trans	62.7	26.6	-179.1	-53	178.5	-179	177.4	0	114	A401 M402	A401-K404 WeakPolarHBondContact O-CA 3.3Å; A401-K404 PolarHBondContact O-N 3.08Å; M402-K404 PolarHBondContact O-N 3.2Å
405	K	96	Very high	94.9	Very high	41 Å²	41	48.9 Å²	48.9	18%	0.178	25%	0.25	C	S	.	.			trans	-119	150.6	176.2	-67.3	169.7	-176.4	168.2	0	110.7	A401 D403 T424 R425 D427	A401-K405 PolarHBondContact N-O 2.81Å; D403-K405 VanDerWaalsContact C-N 3.25Å; D403-K405 PolarHBondContact O-N 3.44Å; D403-K405 WeakPolarHBondContact OD1-CB 3.33Å; D403-K405 PolarHBondContact OD1-N 2.82Å; D403-K405 VanDerWaalsContact OD1-N 3.17Å; K405-T424 PolarHBondContact NZ-OG1 2.77Å; K405-R425 WeakPolarHBondContact CD-O 3.39Å; K405-R425 WeakPolarHBondContact CE-O 3.4Å; K405-R425 PolarHBondContact NZ-O 3.14Å; K405-R425 PolarHBondContact O-NH2 3.28Å; K405-D427 WeakPolarHBondContact CA-OD1 3.45Å; K405-D427 HydrophobicContact CB-CB 4.03Å; K405-D427 WeakPolarHBondContact CB-OD1 3.33Å; K405-D427 HydrophobicContact CD-CB 4.16Å; K405-D427 HydrophobicContact CG-CB 3.89Å
406	H	95.3	Very high	95.1	Very high	68 Å²	68	50.3 Å²	50.3	32%	0.315	26%	0.259	S	S	.	.			trans	-68.5	159.6	172.4	-58.3	87.5	0	0	0	111.3	V396 R425 D427 M428	V396-H406 HydrophobicContact CG1-CB 3.55Å; H406-R425 PolarHBondContact O-NH1 3.18Å; H406-R425 PolarHBondContact O-NH2 2.88Å; H406-R425 VanDerWaalsContact O-NH2 3.17Å; H406-D427 WeakPolarHBondContact CA-OD1 3.39Å; H406-D427 WeakPolarHBondContact CB-OD1 3.46Å; H406-D427 IonicContact CG-OD1 3.78Å; H406-D427 PolarHBondContact N-OD1 3.41Å; H406-D427 IonicContact ND1-OD1 3.87Å; H406-D427 PolarHBondContact ND1-OD1 3.32Å; H406-D427 IonicContact ND1-OD2 3.78Å; H406-M428 HydrophobicContact CB-CB 4.42Å; H406-M428 VanDerWaalsContact CB-O 3.25Å; H406-M428 WeakPolarHBondContact CB-O 3.39Å
407	F	94.8	Very high	95.2	Very high	43 Å²	43	49.8 Å²	49.8	19%	0.189	26%	0.256	C	S	.	.			trans	-144.3	158.8	176.8	65.4	-79.4	0	0	0	108.8	V396 S397 A399 A401	V396-F407 WeakPolarHBondContact CG1-O 3.29Å; S397-F407 VanDerWaalsContact CB-CZ 3.41Å; S397-F407 WeakPolarHBondContact CB-O 3.46Å; S397-F407 PolarHBondContact N-O 3.17Å; S397-F407 VanDerWaalsContact OG-CE1 3.31Å; S397-F407 WeakPolarHBondContact OG-CE1 3.48Å; S397-F407 WeakPolarHBondContact OG-CZ 3.33Å; A399-F407 VanDerWaalsContact O-CE1 3.26Å; A399-F407 WeakPolarHBondContact O-CE1 3.43Å; A401-F407 HydrophobicContact CB-CD1 4.04Å; A401-F407 HydrophobicContact CB-CE1 4.47Å
408	T	95.4	Very high	95.5	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-79.5	150.6	177.8	46.3	0	0	0	0	111.9	G395 V396 A410 Y438	G395-T408 WeakPolarHBondContact O-CA 3.32Å; V396-T408 HydrophobicContact CG2-CG2 4.48Å; T408-A410 VanDerWaalsContact C-N 3.28Å; T408-A410 WeakPolarHBondContact CB-O 3.46Å; T408-A410 PolarHBondContact O-N 3.47Å; T408-A410 PolarHBondContact OG1-O 2.67Å; T408-Y438 HydrophobicContact CG2-CE1 3.68Å
409	T	94.2	Very high	95.7	Very high	14 Å²	14	51.6 Å²	51.6	9%	0.086	27%	0.267	C	S	.	.	S	Bend	trans	-58.1	-45.7	174.8	-54.2	0	0	0	0	110	F383 G384 N391 G395	F383-T409 CarbonylContact C-O 3.59Å; F383-T409 WeakPolarHBondContact CA-O 3.49Å; F383-T409 HydrophobicContact CB-CG2 4.4Å; G384-T409 PolarHBondContact N-O 2.84Å; G384-T409 WeakPolarHBondContact O-CA 3.41Å; G384-T409 VanDerWaalsContact O-CG2 3.28Å; G384-T409 WeakPolarHBondContact O-CG2 3.37Å; N391-T409 PolarHBondContact ND2-OG1 2.93Å; G395-T409 PolarHBondContact O-N 3.18Å; G395-T409 PolarHBondContact O-OG1 3Å; G395-T409 VanDerWaalsContact O-OG1 3.07Å
410	A	95.3	Very high	95.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.5	172.7	0	0	0	0	0	112.2	A343 F381 A382 T408 Q440	A343-A410 HydrophobicContact CB-CB 4.44Å; F381-A410 HydrophobicContact CE2-CB 3.85Å; F381-A410 HydrophobicContact CZ-CB 4.37Å; A382-A410 WeakPolarHBondContact O-CA 3.45Å; T408-A410 VanDerWaalsContact C-N 3.28Å; T408-A410 WeakPolarHBondContact CB-O 3.46Å; T408-A410 PolarHBondContact O-N 3.47Å; T408-A410 PolarHBondContact OG1-O 2.67Å; A410-Q440 HydrophobicContact CB-CG 3.91Å; A410-Q440 WeakPolarHBondContact O-CG 3.45Å
411	V	96.1	Very high	95.9	Very high	48 Å²	48	53.2 Å²	53.2	29%	0.291	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	165.5	177.4	-67.1	0	0	0	0	110.4	A382	A382-V411 HydrophobicContact CB-CG2 4.27Å; A382-V411 PolarHBondContact N-O 3.23Å; A382-V411 PolarHBondContact O-N 3.02Å
412	Y	98.3	Very high	95.8	Very high	5 Å²	5	59.3 Å²	59.3	2%	0.02	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.9	170.6	-64.8	-101	0	0	0	111.6	H338 T341 A343 V380 F381 Q440 Q441 T442 E449	H338-Y412 HydrophobicContact CB-CE1 3.97Å; H338-Y412 AromaticContact ND1-CE1 3.43Å; H338-Y412 WeakPolarHBondContact ND1-CE1 3.49Å; H338-Y412 AromaticContact ND1-CZ 3.51Å; H338-Y412 PolarHBondContact ND1-OH 2.76Å; T341-Y412 HydrophobicContact CG2-CD1 4.43Å; T341-Y412 HydrophobicContact CG2-CD2 3.88Å; T341-Y412 HydrophobicContact CG2-CE2 4.28Å; T341-Y412 HydrophobicContact CG2-CG 3.97Å; A343-Y412 WeakPolarHBondContact CA-OH 3.45Å; A343-Y412 HydrophobicContact CB-CE2 4.18Å; A343-Y412 WeakPolarHBondContact CB-OH 3.42Å; A343-Y412 PolarHBondContact N-OH 3.27Å; V380-Y412 CarbonylContact O-C 3.52Å; V380-Y412 VanDerWaalsContact O-CA 3.3Å; V380-Y412 WeakPolarHBondContact O-CA 3.47Å; F381-Y412 HydrophobicContact CB-CD1 3.89Å; F381-Y412 HydrophobicContact CB-CE1 3.6Å; F381-Y412 HydrophobicContact CD2-CD1 4.26Å; F381-Y412 AromaticContact CD2-CE1 3.75Å; F381-Y412 HydrophobicContact CD2-CE1 3.75Å; F381-Y412 HydrophobicContact CD2-CE2 4.01Å; F381-Y412 AromaticContact CD2-CZ 3.59Å; F381-Y412 HydrophobicContact CG-CE1 4.08Å; Y412-Q440 HydrophobicContact CD2-CB 3.73Å; Y412-Q440 HydrophobicContact CE2-CB 3.79Å; Y412-Q440 HydrophobicContact CE2-CG 4.27Å; Y412-Q441 PolarHBondContact N-O 2.85Å; Y412-T442 WeakPolarHBondContact O-CA 3.5Å; Y412-E449 HydrophobicContact CD1-CG 3.73Å; Y412-E449 WeakPolarHBondContact CD1-OE1 3.46Å; Y412-E449 HydrophobicContact CE1-CG 4.44Å; Y412-E449 HydrophobicContact CG-CG 4.3Å
413	G	98.3	Very high	95.7	Very high	29 Å²	29	53.1 Å²	53.1	30%	0.299	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	-49.6	172.4	0	0	0	0	0	112	V380 T443 V444	V380-G413 PolarHBondContact O-N 3.44Å; G413-T443 WeakPolarHBondContact O-CB 3.32Å; G413-T443 PolarHBondContact O-N 3.32Å; G413-T443 PolarHBondContact O-OG1 3.16Å; G413-V444 PolarHBondContact O-N 3.3Å
414	N	98.4	Very high	95.7	Very high	24 Å²	24	53 Å²	53	13%	0.128	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	178.1	-178	62.2	53.7	0	0	0	111	T442 V444 L446 E449 T450	N414-T442 WeakPolarHBondContact O-CG2 3.35Å; N414-V444 CarbonylContact C-O 3.56Å; N414-V444 WeakPolarHBondContact CA-O 3.12Å; N414-V444 HydrophobicContact CB-CB 3.77Å; N414-V444 HydrophobicContact CB-CG1 4.43Å; N414-V444 WeakPolarHBondContact CB-O 3.44Å; N414-L446 HydrophobicContact CB-CD1 3.9Å; N414-L446 HydrophobicContact CB-CG 4.4Å; N414-E449 WeakPolarHBondContact O-CG 3.4Å; N414-E449 WeakPolarHBondContact OD1-CA 3.4Å; N414-T450 PolarHBondContact ND2-OG1 3.47Å; N414-T450 PolarHBondContact OD1-N 3.11Å; N414-T450 PolarHBondContact OD1-OG1 3.35Å
415	G	98.2	Very high	95.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.7	-174.4	175.1	0	0	0	0	0	115.4	G417 Y418 T442 V444 L446	G415-G417 PolarHBondContact O-N 2.64Å; G415-Y418 PolarHBondContact O-N 3.48Å; G415-T442 PolarHBondContact O-OG1 2.86Å; G415-V444 PolarHBondContact N-O 2.93Å; G415-L446 CarbonylContact C-O 3.51Å; G415-L446 PolarHBondContact O-N 3.32Å
416	P	97.8	Very high	95.7	Very high	31 Å²	31	46.2 Å²	46.2	20%	0.201	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-2.9	-167.9	29	-37.4	0	0	0	114.9	H339 T341 Y418 K439 L446	H339-P416 WeakPolarHBondContact O-CD 3.43Å; T341-P416 HydrophobicContact CG2-CG 4.27Å; P416-Y418 VanDerWaalsContact C-N 3.26Å; P416-Y418 PolarHBondContact O-N 3.32Å; P416-K439 HydrophobicContact CB-CD 4.36Å; P416-K439 HydrophobicContact CG-CD 4.45Å; P416-L446 WeakPolarHBondContact CA-O 3.41Å
417	G	96.8	Very high	95.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	2.1	174.4	0	0	0	0	0	114.9	T341 G415 Q419 Q440	T341-G417 PolarHBondContact OG1-N 3.09Å; G415-G417 PolarHBondContact O-N 2.64Å; G417-Q419 PolarHBondContact O-N 3.1Å; G417-Q440 WeakPolarHBondContact CA-O 3.38Å
418	Y	96.7	Very high	95.7	Very high	101 Å²	101	44.8 Å²	44.8	40%	0.396	26%	0.258	S	S	.	.			trans	-63.1	125.9	174.3	-177.7	-91	0	0	0	110.5	G415 P416 I420 T442 P445	G415-Y418 PolarHBondContact O-N 3.48Å; P416-Y418 VanDerWaalsContact C-N 3.26Å; P416-Y418 PolarHBondContact O-N 3.32Å; Y418-I420 HydrophobicContact CE1-CG1 3.79Å; Y418-I420 WeakPolarHBondContact OH-CG1 3.48Å; Y418-T442 WeakPolarHBondContact CA-OG1 3.42Å; Y418-T442 WeakPolarHBondContact CB-OG1 3.48Å; Y418-T442 PolarHBondContact N-OG1 2.93Å; Y418-P445 HydrophobicContact CD1-CB 3.85Å; Y418-P445 HydrophobicContact CD1-CG 4.25Å; Y418-P445 HydrophobicContact CD2-CB 4.43Å; Y418-P445 HydrophobicContact CG-CB 3.76Å; Y418-P445 HydrophobicContact CG-CG 4.25Å
419	Q	93	Very high	95.6	Very high	81 Å²	81	48.3 Å²	48.3	38%	0.379	28%	0.277	S	S	.	.			trans	-142.8	133.8	-178	-65.8	-179.4	14.5	0	0	111.9	G417 P426	G417-Q419 PolarHBondContact O-N 3.1Å; Q419-P426 HydrophobicContact CB-CG 3.87Å; Q419-P426 VanDerWaalsContact O-CD 3.3Å; Q419-P426 WeakPolarHBondContact O-CD 3.41Å
420	I	94	Very high	95.6	Very high	86 Å²	86	52.1 Å²	52.1	44%	0.441	29%	0.293	S	S	.	.			trans	-128.4	120.3	168.1	-64.9	-65.9	0	0	0	107.9	Y418	Y418-I420 HydrophobicContact CE1-CG1 3.79Å; Y418-I420 WeakPolarHBondContact OH-CG1 3.48Å
421	V	92.3	Very high	95.4	Very high	75 Å²	75	56.2 Å²	56.2	46%	0.455	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-117.1	123.8	177.9	-178	0	0	0	0	108	G423 T424 P426	V421-G423 PolarHBondContact O-N 3.48Å; V421-T424 PolarHBondContact N-O 3.28Å; V421-T424 PolarHBondContact O-N 3.22Å; V421-T424 VanDerWaalsContact O-N 3.1Å; V421-T424 PolarHBondContact O-OG1 3.21Å; V421-P426 HydrophobicContact CG2-CB 4.13Å; V421-P426 HydrophobicContact CG2-CG 4.42Å
422	N	92.9	Very high	95.2	Very high	161 Å²	161	56.9 Å²	56.9	86%	0.861	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	42.8	-176.2	-59.2	-26.9	0	0	0	113	T424	N422-T424 VanDerWaalsContact C-N 3.27Å; N422-T424 PolarHBondContact O-N 2.91Å
423	G	94.4	Very high	94.9	Very high	67 Å²	67	56.7 Å²	56.7	69%	0.691	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	7.6	178	0	0	0	0	0	115.4	V421	V421-G423 PolarHBondContact O-N 3.48Å
424	T	95.8	Very high	94.6	Very high	68 Å²	68	58.4 Å²	58.4	42%	0.417	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-137.7	161.3	179.9	65.8	0	0	0	0	112.4	K405 V421 N422	K405-T424 PolarHBondContact NZ-OG1 2.77Å; V421-T424 PolarHBondContact N-O 3.28Å; V421-T424 PolarHBondContact O-N 3.22Å; V421-T424 VanDerWaalsContact O-N 3.1Å; V421-T424 PolarHBondContact O-OG1 3.21Å; N422-T424 VanDerWaalsContact C-N 3.27Å; N422-T424 PolarHBondContact O-N 2.91Å
425	R	96.4	Very high	94.3	Very high	50 Å²	50	60.5 Å²	60.5	19%	0.189	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-58.1	133.9	171.9	-173.4	-177.8	68.3	87.9	-3.5	110.4	D403 K405 H406	D403-R425 IonicContact OD1-CZ 3.57Å; D403-R425 IonicContact OD1-NE 3.61Å; D403-R425 IonicContact OD1-NH2 3.86Å; D403-R425 PolarHBondContact OD1-NH2 3.45Å; D403-R425 IonicContact OD2-CZ 2.78Å; D403-R425 IonicContact OD2-NE 2.71Å; D403-R425 PolarHBondContact OD2-NE 2.94Å; D403-R425 IonicContact OD2-NH2 3.72Å; D403-R425 PolarHBondContact OD2-NH2 2.91Å; K405-R425 WeakPolarHBondContact CD-O 3.39Å; K405-R425 WeakPolarHBondContact CE-O 3.4Å; K405-R425 PolarHBondContact NZ-O 3.14Å; K405-R425 PolarHBondContact O-NH2 3.28Å; H406-R425 PolarHBondContact O-NH1 3.18Å; H406-R425 PolarHBondContact O-NH2 2.88Å; H406-R425 VanDerWaalsContact O-NH2 3.17Å
426	P	95.4	Very high	93.9	Very high	19 Å²	19	63.4 Å²	63.4	12%	0.123	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-67.2	145.3	176.4	25.9	-31.6	0	0	0	111.5	Q419 V421 M428 Q441	Q419-P426 HydrophobicContact CB-CG 3.87Å; Q419-P426 VanDerWaalsContact O-CD 3.3Å; Q419-P426 WeakPolarHBondContact O-CD 3.41Å; V421-P426 HydrophobicContact CG2-CB 4.13Å; V421-P426 HydrophobicContact CG2-CG 4.42Å; P426-M428 HydrophobicContact CB-CE 3.7Å; P426-M428 HydrophobicContact CG-CE 3.78Å; P426-Q441 PolarHBondContact O-NE2 3.19Å
427	D	95.5	Very high	93.6	Very high	76 Å²	76	66.3 Å²	66.3	41%	0.406	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-77.1	144.8	172.3	-165.1	11.1	0	0	0	110.2	K405 H406	K405-D427 WeakPolarHBondContact CA-OD1 3.45Å; K405-D427 HydrophobicContact CB-CB 4.03Å; K405-D427 WeakPolarHBondContact CB-OD1 3.33Å; K405-D427 HydrophobicContact CD-CB 4.16Å; K405-D427 HydrophobicContact CG-CB 3.89Å; H406-D427 WeakPolarHBondContact CA-OD1 3.39Å; H406-D427 WeakPolarHBondContact CB-OD1 3.46Å; H406-D427 IonicContact CG-OD1 3.78Å; H406-D427 PolarHBondContact N-OD1 3.41Å; H406-D427 IonicContact ND1-OD1 3.87Å; H406-D427 PolarHBondContact ND1-OD1 3.32Å; H406-D427 IonicContact ND1-OD2 3.78Å
428	M	94.9	Very high	93.6	Very high	6 Å²	6	67 Å²	67	3%	0.03	38%	0.376	C	S	.	.			trans	-111.3	150.8	-173.8	-65.1	-66.4	104.2	0	0	111.6	V396 H406 P426 I432 Y438	V396-M428 HydrophobicContact CG2-CB 4.49Å; H406-M428 HydrophobicContact CB-CB 4.42Å; H406-M428 VanDerWaalsContact CB-O 3.25Å; H406-M428 WeakPolarHBondContact CB-O 3.39Å; P426-M428 HydrophobicContact CB-CE 3.7Å; P426-M428 HydrophobicContact CG-CE 3.78Å; M428-I432 HydrophobicContact SD-CG2 4.17Å; M428-Y438 HydrophobicContact SD-CE2 3.68Å; M428-Y438 PolarHBondContact SD-OH 3.18Å
429	N	93.9	Very high	93.6	Very high	74 Å²	74	65.4 Å²	65.4	40%	0.396	37%	0.371	S	S	.	.			trans	-150.2	168	171.9	67	53.8	0	0	0	110	V396 S431 I432 S433	V396-N429 VanDerWaalsContact CG2-C 3.5Å; N429-S431 PolarHBondContact O-N 2.98Å; N429-S431 WeakPolarHBondContact OD1-CA 3.42Å; N429-S431 WeakPolarHBondContact OD1-CB 3.49Å; N429-S431 PolarHBondContact OD1-N 3.2Å; N429-S431 PolarHBondContact OD1-OG 3.38Å; N429-I432 WeakPolarHBondContact O-CB 3.4Å; N429-I432 PolarHBondContact O-N 2.99Å; N429-I432 PolarHBondContact OD1-N 2.71Å; N429-S433 PolarHBondContact O-N 3.37Å; N429-S433 PolarHBondContact O-OG 3.12Å
430	E	92.5	Very high	93.8	Very high	93 Å²	93	61.5 Å²	61.5	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-30.6	-175	-67.2	-60.5	162.2	0	0	113.8	V396 I432 S433 S434	V396-E430 WeakPolarHBondContact CB-OE1 3.17Å; V396-E430 HydrophobicContact CG2-CG 4.47Å; V396-E430 PolarHBondContact N-OE1 3.41Å; E430-I432 PolarHBondContact O-N 3.47Å; E430-S433 WeakPolarHBondContact CA-OG 3.25Å; E430-S433 PolarHBondContact OE2-OG 3.22Å; E430-S434 WeakPolarHBondContact O-CB 3.42Å; E430-S434 PolarHBondContact O-N 3.47Å; E430-S434 VanDerWaalsContact O-N 3.07Å; E430-S434 PolarHBondContact O-OG 2.81Å
431	S	92	Very high	93.9	Very high	87 Å²	87	58.5 Å²	58.5	61%	0.608	34%	0.337	S	S	*	.	H	α-helix	trans	-67.2	-27.2	177.1	75.7	0	0	0	0	112.5	N429 T435	N429-S431 PolarHBondContact O-N 2.98Å; N429-S431 WeakPolarHBondContact OD1-CA 3.42Å; N429-S431 WeakPolarHBondContact OD1-CB 3.49Å; N429-S431 PolarHBondContact OD1-N 3.2Å; N429-S431 PolarHBondContact OD1-OG 3.38Å; S431-T435 WeakPolarHBondContact O-CG2 3.33Å
432	I	92.3	Very high	94.2	Very high	61 Å²	61	55.6 Å²	55.6	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-84.1	-54.2	176.7	-63.2	168.8	0	0	0	109.6	M428 N429 E430 S434 T435 Y438	M428-I432 HydrophobicContact SD-CG2 4.17Å; N429-I432 WeakPolarHBondContact O-CB 3.4Å; N429-I432 PolarHBondContact O-N 2.99Å; N429-I432 PolarHBondContact OD1-N 2.71Å; E430-I432 PolarHBondContact O-N 3.47Å; I432-S434 VanDerWaalsContact C-N 3.27Å; I432-S434 PolarHBondContact O-N 3.42Å; I432-T435 PolarHBondContact O-N 3.31Å; I432-T435 PolarHBondContact O-OG1 3.26Å; I432-T435 VanDerWaalsContact O-OG1 3.09Å; I432-Y438 HydrophobicContact CG2-CD2 3.61Å; I432-Y438 HydrophobicContact CG2-CE2 3.68Å; I432-Y438 WeakPolarHBondContact O-CB 3.25Å
433	S	92.4	Very high	94.3	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.014	31%	0.308	C	S	.	.	H	α-helix	trans	-66.9	-25.4	-172.7	56.1	0	0	0	0	113.8	V396 N429 E430	V396-S433 WeakPolarHBondContact CG2-OG 3.2Å; N429-S433 PolarHBondContact O-N 3.37Å; N429-S433 PolarHBondContact O-OG 3.12Å; E430-S433 WeakPolarHBondContact CA-OG 3.25Å; E430-S433 PolarHBondContact OE2-OG 3.22Å
434	S	90.2	Very high	94.4	Very high	64 Å²	64	53.2 Å²	53.2	45%	0.448	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.1	-178.9	61.1	0	0	0	0	114.9	K344 E430 I432	K344-S434 PolarHBondContact NZ-O 3.41Å; E430-S434 WeakPolarHBondContact O-CB 3.42Å; E430-S434 PolarHBondContact O-N 3.47Å; E430-S434 VanDerWaalsContact O-N 3.07Å; E430-S434 PolarHBondContact O-OG 2.81Å; I432-S434 VanDerWaalsContact C-N 3.27Å; I432-S434 PolarHBondContact O-N 3.42Å
435	T	92.8	Very high	94.5	Very high	68 Å²	68	53.6 Å²	53.6	42%	0.417	30%	0.301	S	S	.	.	S	Bend	trans	-69.6	147.2	-178.4	68.3	0	0	0	0	112	S431 I432 N437 Y438	S431-T435 WeakPolarHBondContact O-CG2 3.33Å; I432-T435 PolarHBondContact O-N 3.31Å; I432-T435 PolarHBondContact O-OG1 3.26Å; I432-T435 VanDerWaalsContact O-OG1 3.09Å; T435-N437 PolarHBondContact O-N 2.96Å; T435-Y438 PolarHBondContact O-N 3.47Å; T435-Y438 WeakPolarHBondContact OG1-CB 3.33Å; T435-Y438 PolarHBondContact OG1-N 3.07Å
436	N	90.4	Very high	94.6	Very high	61 Å²	61	54.9 Å²	54.9	33%	0.326	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.1	-178	-70.6	2.3	0	0	0	114	K344	K344-N436 WeakPolarHBondContact CE-OD1 3.32Å; K344-N436 PolarHBondContact NZ-OD1 3.17Å
437	N	91.7	Very high	94.6	Very high	92 Å²	92	59.8 Å²	59.8	49%	0.492	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	11.1	-175.6	-63.9	-34	0	0	0	112.9	W342 K345 T435 K439	W342-N437 PolarHBondContact NE1-O 3.48Å; W342-N437 VanDerWaalsContact NE1-O 3.09Å; K345-N437 WeakPolarHBondContact CE-OD1 3.26Å; K345-N437 PolarHBondContact NZ-OD1 3.32Å; T435-N437 PolarHBondContact O-N 2.96Å; N437-K439 PolarHBondContact O-N 2.87Å
438	Y	95.9	Very high	94.7	Very high	15 Å²	15	58.5 Å²	58.5	6%	0.059	34%	0.343	C	S	.	.			trans	-62.7	123.8	174.2	174.7	-112.7	0	0	0	110.2	T408 M428 I432 T435 Q440	T408-Y438 HydrophobicContact CG2-CE1 3.68Å; M428-Y438 HydrophobicContact SD-CE2 3.68Å; M428-Y438 PolarHBondContact SD-OH 3.18Å; I432-Y438 HydrophobicContact CG2-CD2 3.61Å; I432-Y438 HydrophobicContact CG2-CE2 3.68Å; I432-Y438 WeakPolarHBondContact O-CB 3.25Å; T435-Y438 PolarHBondContact O-N 3.47Å; T435-Y438 WeakPolarHBondContact OG1-CB 3.33Å; T435-Y438 PolarHBondContact OG1-N 3.07Å; Y438-Q440 HydrophobicContact CD1-CG 4.46Å; Y438-Q440 HydrophobicContact CE1-CB 4.42Å; Y438-Q440 HydrophobicContact CE1-CG 3.98Å
439	K	96.8	Very high	94.9	Very high	67 Å²	67	58.3 Å²	58.3	29%	0.291	34%	0.342	S	S	.	.			trans	-90.5	115.5	172.9	-66.9	-172.9	176.5	-173.1	0	109.2	T341 P416 N437	T341-K439 CarbonylContact O-C 3.28Å; T341-K439 VanDerWaalsContact O-CA 3.24Å; T341-K439 WeakPolarHBondContact O-CA 3.39Å; T341-K439 WeakPolarHBondContact OG1-CB 3.15Å; P416-K439 HydrophobicContact CB-CD 4.36Å; P416-K439 HydrophobicContact CG-CD 4.45Å; N437-K439 PolarHBondContact O-N 2.87Å
440	Q	97.1	Very high	95.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	34%	0.335	C	S	.	.			trans	-58.6	144.6	177.2	-80.3	70.4	32.7	0	0	110.6	T341 A343 A410 Y412 G417 Y438 T442	T341-Q440 PolarHBondContact O-N 2.61Å; T341-Q440 PolarHBondContact O-OE1 2.75Å; A343-Q440 VanDerWaalsContact CB-CD 3.42Å; A343-Q440 HydrophobicContact CB-CG 4.19Å; A410-Q440 HydrophobicContact CB-CG 3.91Å; A410-Q440 WeakPolarHBondContact O-CG 3.45Å; Y412-Q440 HydrophobicContact CD2-CB 3.73Å; Y412-Q440 HydrophobicContact CE2-CB 3.79Å; Y412-Q440 HydrophobicContact CE2-CG 4.27Å; G417-Q440 WeakPolarHBondContact CA-O 3.38Å; Y438-Q440 HydrophobicContact CD1-CG 4.46Å; Y438-Q440 HydrophobicContact CE1-CB 4.42Å; Y438-Q440 HydrophobicContact CE1-CG 3.98Å; Q440-T442 WeakPolarHBondContact O-CG2 3.39Å
441	Q	96.8	Very high	95.4	Very high	22 Å²	22	52.9 Å²	52.9	10%	0.103	32%	0.317	C	S	.	.			trans	-59.8	140.7	180	-67.4	-177.1	-28.7	0	0	111.2	Y412 P426	Y412-Q441 PolarHBondContact N-O 2.85Å; P426-Q441 PolarHBondContact O-NE2 3.19Å
442	T	97.1	Very high	95.6	Very high	15 Å²	15	48.8 Å²	48.8	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	162.2	178.5	77.4	0	0	0	0	111.5	T341 Y412 N414 G415 Y418 Q440	T341-T442 HydrophobicContact CG2-CG2 3.71Å; Y412-T442 WeakPolarHBondContact O-CA 3.5Å; N414-T442 WeakPolarHBondContact O-CG2 3.35Å; G415-T442 PolarHBondContact O-OG1 2.86Å; Y418-T442 WeakPolarHBondContact CA-OG1 3.42Å; Y418-T442 WeakPolarHBondContact CB-OG1 3.48Å; Y418-T442 PolarHBondContact N-OG1 2.93Å; Q440-T442 WeakPolarHBondContact O-CG2 3.39Å
443	T	95.2	Very high	95.8	Very high	102 Å²	102	50.5 Å²	50.5	63%	0.626	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	-34.8	-178.5	74.1	0	0	0	0	113.6	G413	G413-T443 WeakPolarHBondContact O-CB 3.32Å; G413-T443 PolarHBondContact O-N 3.32Å; G413-T443 PolarHBondContact O-OG1 3.16Å
444	V	97.9	Very high	96.1	Very high	76 Å²	76	53.9 Å²	53.9	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.2	178.8	179.7	0	0	0	0	110	G413 N414 G415 L446	G413-V444 PolarHBondContact O-N 3.3Å; N414-V444 CarbonylContact C-O 3.56Å; N414-V444 WeakPolarHBondContact CA-O 3.12Å; N414-V444 HydrophobicContact CB-CB 3.77Å; N414-V444 HydrophobicContact CB-CG1 4.43Å; N414-V444 WeakPolarHBondContact CB-O 3.44Å; G415-V444 PolarHBondContact N-O 2.93Å; V444-L446 PolarHBondContact O-N 2.79Å
445	P	97.4	Very high	96.5	Very high	76 Å²	76	53.1 Å²	53.1	49%	0.494	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	122.8	-178.9	28	-32.8	0	0	0	111.2	Y418	Y418-P445 HydrophobicContact CD1-CB 3.85Å; Y418-P445 HydrophobicContact CD1-CG 4.25Å; Y418-P445 HydrophobicContact CD2-CB 4.43Å; Y418-P445 HydrophobicContact CG-CB 3.76Å; Y418-P445 HydrophobicContact CG-CG 4.25Å
446	L	97.8	Very high	96.8	Very high	76 Å²	76	49.9 Å²	49.9	40%	0.398	28%	0.284	S	S	.	.			trans	-137.2	158.3	169.5	-65.4	175.9	0	0	0	109.3	N414 G415 P416 V444 S448 T450	N414-L446 HydrophobicContact CB-CD1 3.9Å; N414-L446 HydrophobicContact CB-CG 4.4Å; G415-L446 CarbonylContact C-O 3.51Å; G415-L446 PolarHBondContact O-N 3.32Å; P416-L446 WeakPolarHBondContact CA-O 3.41Å; V444-L446 PolarHBondContact O-N 2.79Å; L446-S448 VanDerWaalsContact C-N 3.27Å; L446-S448 WeakPolarHBondContact CB-O 3.09Å; L446-T450 HydrophobicContact CD1-CG2 3.7Å
447	S	96.8	Very high	97.2	Very high	123 Å²	123	47.5 Å²	47.5	86%	0.86	27%	0.273	S	S	*	.	S	Bend	trans	-69.7	-28.4	173.9	50.9	0	0	0	0	112.6
448	S	97.4	Very high	97.6	Very high	49 Å²	49	43.1 Å²	43.1	34%	0.343	25%	0.249	S	C	.	.	S	Bend	trans	-133.8	137.4	173.9	-162.8	0	0	0	0	108.2	H339 L446	H339-S448 WeakPolarHBondContact CB-OG 3.46Å; H339-S448 PolarHBondContact ND1-OG 3.31Å; L446-S448 VanDerWaalsContact C-N 3.27Å; L446-S448 WeakPolarHBondContact CB-O 3.09Å
449	E	98.4	Very high	97.7	Very high	2 Å²	2	43 Å²	43	1%	0.009	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-64.4	154.4	167.5	-177.8	-88.4	-171.5	0	0	110.4	H338 H339 T341 H379 V380 Y412 N414	H338-E449 WeakPolarHBondContact O-CB 3.39Å; H339-E449 PolarHBondContact CE1-O 2.75Å; H339-E449 PolarHBondContact ND1-O 3.41Å; H339-E449 IonicContact ND1-OE2 3.9Å; H339-E449 PolarHBondContact O-N 2.86Å; T341-E449 HydrophobicContact CG2-CB 3.84Å; T341-E449 HydrophobicContact CG2-CG 4.26Å; H379-E449 WeakPolarHBondContact CB-OE1 3.35Å; H379-E449 IonicContact CE1-OE2 2.89Å; H379-E449 IonicContact CG-OE1 2.84Å; H379-E449 IonicContact CG-OE2 3.17Å; H379-E449 IonicContact ND1-OE1 3.53Å; H379-E449 IonicContact ND1-OE2 3.64Å; H379-E449 PolarHBondContact ND1-OE2 3.46Å; V380-E449 WeakPolarHBondContact CA-OE1 3.34Å; V380-E449 HydrophobicContact CG2-CG 3.73Å; V380-E449 WeakPolarHBondContact CG2-OE1 3.29Å; V380-E449 PolarHBondContact N-OE1 2.9Å; Y412-E449 HydrophobicContact CD1-CG 3.73Å; Y412-E449 WeakPolarHBondContact CD1-OE1 3.46Å; Y412-E449 HydrophobicContact CE1-CG 4.44Å; Y412-E449 HydrophobicContact CG-CG 4.3Å; N414-E449 WeakPolarHBondContact O-CG 3.4Å; N414-E449 WeakPolarHBondContact OD1-CA 3.4Å
450	T	97.9	Very high	97.8	Very high	39 Å²	39	39.9 Å²	39.9	24%	0.239	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-97.5	150.4	-177	64	0	0	0	0	112.6	M111 V380 N414 L446	M111-T450 HydrophobicContact SD-CG2 4.44Å; V380-T450 PolarHBondContact N-O 3.22Å; N414-T450 PolarHBondContact ND2-OG1 3.47Å; N414-T450 PolarHBondContact OD1-N 3.11Å; N414-T450 PolarHBondContact OD1-OG1 3.35Å; L446-T450 HydrophobicContact CD1-CG2 3.7Å
451	H	98.3	Very high	97.9	Very high	13 Å²	13	41.1 Å²	41.1	6%	0.06	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	154.3	168.4	-53.9	160.7	0	0	0	112.7	M111 P112 D335 H339 H377 S378 H379	M111-H451 HydrophobicContact CG-CB 3.88Å; M111-H451 HydrophobicContact SD-CB 4.32Å; P112-H451 PolarHBondContact O-ND1 2.69Å; D335-H451 IonicContact OD1-CD2 2.62Å; D335-H451 PolarHBondContact OD1-CD2 3.17Å; D335-H451 IonicContact OD1-NE2 3.1Å; D335-H451 PolarHBondContact OD1-NE2 3.03Å; H339-H451 AromaticContact CE1-CD2 3.36Å; H339-H451 PolarHBondContact CE1-CD2 3.39Å; H339-H451 AromaticContact CE1-NE2 3.18Å; H339-H451 PolarHBondContact CE1-NE2 3.35Å; H339-H451 AromaticContact NE2-CD2 3.84Å; H339-H451 AromaticContact NE2-NE2 3.22Å; H339-H451 PolarHBondContact NE2-NE2 3.07Å; H377-H451 AromaticContact CD2-CE1 3.94Å; H377-H451 AromaticContact CD2-ND1 3.69Å; H377-H451 AromaticContact CE1-CD2 3.2Å; H377-H451 PolarHBondContact CE1-CD2 3.18Å; H377-H451 AromaticContact CE1-CE1 3.31Å; H377-H451 PolarHBondContact CE1-CE1 2.78Å; H377-H451 AromaticContact CE1-CG 3.33Å; H377-H451 AromaticContact CE1-ND1 3.4Å; H377-H451 PolarHBondContact CE1-ND1 3.26Å; H377-H451 AromaticContact CE1-NE2 3.27Å; H377-H451 PolarHBondContact CE1-NE2 3.17Å; H377-H451 VanDerWaalsContact CE1-NE2 3.27Å; H377-H451 AromaticContact CG-CG 3.99Å; H377-H451 AromaticContact CG-ND1 3.93Å; H377-H451 AromaticContact ND1-CD2 3.66Å; H377-H451 AromaticContact ND1-CG 3.43Å; H377-H451 AromaticContact ND1-ND1 3.74Å; H377-H451 AromaticContact NE2-CD2 3.84Å; H377-H451 AromaticContact NE2-CE1 3.11Å; H377-H451 PolarHBondContact NE2-CE1 3.29Å; H377-H451 AromaticContact NE2-CG 3.75Å; H377-H451 AromaticContact NE2-ND1 3.29Å; H377-H451 PolarHBondContact NE2-ND1 3.26Å; H377-H451 AromaticContact NE2-NE2 3.53Å; S378-H451 WeakPolarHBondContact O-CA 3.27Å; H379-H451 AromaticContact CE1-CD2 3.77Å
452	G	97.4	Very high	97.9	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	145.1	170.1	0	0	0	0	0	110.4	S378 E454	S378-G452 PolarHBondContact O-N 3.29Å; G452-E454 VanDerWaalsContact C-OE2 3.31Å; G452-E454 WeakPolarHBondContact CA-OE2 3.32Å
453	I	96.6	Very high	98	Very high	97 Å²	97	39.8 Å²	39.8	50%	0.497	24%	0.236	S	C	.	.			trans	-103.5	-2.1	-172.8	71.6	174.3	0	0	0	113	M111	M111-I453 HydrophobicContact CB-CG2 3.64Å; M111-I453 HydrophobicContact CG-CG2 4.05Å
454	E	98.5	Very high	98.2	Very high	72 Å²	72	35.3 Å²	35.3	34%	0.336	21%	0.208	S	C	.	.	S	Bend	trans	-76.1	163.7	180	77.6	-80.8	-159.4	0	0	112.3	S378 G452	S378-E454 VanDerWaalsContact CB-CD 3.44Å; S378-E454 WeakPolarHBondContact CB-OE1 3.44Å; S378-E454 PolarHBondContact OG-OE1 2.77Å; G452-E454 VanDerWaalsContact C-OE2 3.31Å; G452-E454 WeakPolarHBondContact CA-OE2 3.32Å
455	D	98.8	Very high	98.2	Very high	49 Å²	49	31.9 Å²	31.9	26%	0.262	19%	0.187	S	C	.	.			trans	-62	142.1	176.5	-62.4	-1.5	0	0	0	111.3	L101 S102	L101-D455 HydrophobicContact CB-CB 4.05Å; L101-D455 HydrophobicContact CD2-CB 4.45Å; S102-D455 VanDerWaalsContact O-CA 3.25Å; S102-D455 WeakPolarHBondContact O-CA 3.39Å
456	V	98.8	Very high	98.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	160.8	173.8	-60.1	0	0	0	0	111.1	L101 S102 T104 A375	L101-V456 CarbonylContact C-O 3.58Å; L101-V456 WeakPolarHBondContact CA-O 3.41Å; S102-V456 PolarHBondContact N-O 3.12Å; S102-V456 PolarHBondContact O-N 3.17Å; T104-V456 HydrophobicContact CG2-CB 4.4Å; T104-V456 HydrophobicContact CG2-CG1 4.03Å; T104-V456 HydrophobicContact CG2-CG2 3.65Å; A375-V456 HydrophobicContact CB-CB 4Å; A375-V456 HydrophobicContact CB-CG1 4.03Å; A375-V456 HydrophobicContact CB-CG2 4.2Å; A375-V456 WeakPolarHBondContact O-CG2 3.42Å
457	A	98.8	Very high	98.3	Very high	10 Å²	10	28.9 Å²	28.9	8%	0.083	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143	-179.8	0	0	0	0	0	111.9	T374 F459	T374-A457 WeakPolarHBondContact CA-O 3.18Å; T374-A457 PolarHBondContact OG1-O 3.11Å; A457-F459 HydrophobicContact CB-CD2 4.28Å; A457-F459 HydrophobicContact CB-CE2 3.53Å; A457-F459 HydrophobicContact CB-CZ 3.71Å
458	I	98.9	Very high	98.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.7	164.6	-51.4	168.9	0	0	0	107.2	L99 A100 V372 V373 F468 I477	L99-I458 CarbonylContact C-O 3.56Å; L99-I458 VanDerWaalsContact CA-O 3.23Å; L99-I458 WeakPolarHBondContact CA-O 3.29Å; A100-I458 HydrophobicContact CB-CB 4.33Å; A100-I458 HydrophobicContact CB-CD1 4.29Å; A100-I458 PolarHBondContact N-O 3.34Å; A100-I458 PolarHBondContact O-N 3.3Å; V372-I458 HydrophobicContact CG1-CG2 3.61Å; V373-I458 CarbonylContact O-C 3.58Å; V373-I458 WeakPolarHBondContact O-CA 3.42Å; I458-F468 HydrophobicContact CB-CD1 4.46Å; I458-F468 HydrophobicContact CD1-CD1 4.2Å; I458-F468 HydrophobicContact CD1-CE1 4.49Å; I458-F468 HydrophobicContact CG2-CD1 3.62Å; I458-F468 HydrophobicContact CG2-CE1 3.91Å; I458-F468 HydrophobicContact CG2-CG 4.17Å; I458-I477 HydrophobicContact CD1-CD1 3.96Å; I458-I477 HydrophobicContact CD1-CG1 3.71Å; I458-I477 HydrophobicContact CG1-CD1 4.19Å; I458-I477 HydrophobicContact CG1-CG1 4.33Å
459	F	98.9	Very high	98.4	Very high	14 Å²	14	26.1 Å²	26.1	6%	0.061	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.3	171.5	-51.9	-95.7	0	0	0	108.8	V71 M93 F96 H98 L99 V372 V373 A457	V71-F459 HydrophobicContact CG1-CZ 4.26Å; M93-F459 HydrophobicContact CB-CD2 4.31Å; M93-F459 HydrophobicContact CB-CG 4.27Å; M93-F459 HydrophobicContact CG-CD2 4.46Å; M93-F459 HydrophobicContact CG-CE2 4.39Å; M93-F459 VanDerWaalsContact O-CD1 3.29Å; M93-F459 WeakPolarHBondContact O-CD1 3.49Å; M93-F459 HydrophobicContact SD-CD2 4.35Å; M93-F459 HydrophobicContact SD-CE2 4.02Å; F96-F459 HydrophobicContact CB-CB 4Å; F96-F459 HydrophobicContact CD2-CB 4.04Å; F96-F459 HydrophobicContact CG-CB 4.23Å; H98-F459 WeakPolarHBondContact O-CA 3.3Å; L99-F459 HydrophobicContact CD1-CD1 3.94Å; L99-F459 HydrophobicContact CD1-CE1 3.61Å; L99-F459 HydrophobicContact CD1-CZ 4.35Å; V372-F459 CarbonylContact C-O 3.57Å; V372-F459 WeakPolarHBondContact CA-O 3.42Å; V373-F459 HydrophobicContact CB-CB 4.2Å; V373-F459 HydrophobicContact CB-CD2 4.32Å; V373-F459 HydrophobicContact CG1-CD2 4.45Å; V373-F459 PolarHBondContact N-O 2.88Å; V373-F459 PolarHBondContact O-N 2.83Å; A457-F459 HydrophobicContact CB-CD2 4.28Å; A457-F459 HydrophobicContact CB-CE2 3.53Å; A457-F459 HydrophobicContact CB-CZ 3.71Å
460	A	98.8	Very high	98.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	143.1	-178.5	0	0	0	0	0	113.5	F96 P97 H98 T371 V372 F468	F96-A460 VanDerWaalsContact CD2-C 3.49Å; P97-A460 WeakPolarHBondContact CD-O 3.24Å; H98-A460 HydrophobicContact CB-CB 4.42Å; H98-A460 PolarHBondContact N-O 3.09Å; H98-A460 PolarHBondContact O-N 3.1Å; T371-A460 WeakPolarHBondContact O-CA 3.35Å; V372-A460 HydrophobicContact CG2-CB 4.42Å; A460-F468 HydrophobicContact CB-CB 4.01Å; A460-F468 HydrophobicContact CB-CD2 3.26Å; A460-F468 HydrophobicContact CB-CE2 3.89Å; A460-F468 HydrophobicContact CB-CG 3.82Å
461	K	98.4	Very high	98.5	Very high	27 Å²	27	30.1 Å²	30.1	12%	0.117	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.9	170.6	75	177.3	178.6	176.7	0	112	F96 P97 A361 L370 T371 S465	F96-K461 HydrophobicContact CB-CB 4.47Å; F96-K461 HydrophobicContact CD1-CD 3.88Å; F96-K461 HydrophobicContact CD1-CG 4.39Å; F96-K461 HydrophobicContact CD2-CB 3.89Å; F96-K461 HydrophobicContact CD2-CD 4.21Å; F96-K461 HydrophobicContact CD2-CG 3.82Å; F96-K461 HydrophobicContact CE1-CD 3.65Å; F96-K461 HydrophobicContact CE1-CG 4.26Å; F96-K461 HydrophobicContact CE2-CB 4.26Å; F96-K461 HydrophobicContact CE2-CD 3.99Å; F96-K461 HydrophobicContact CE2-CG 3.67Å; F96-K461 HydrophobicContact CG-CB 4.07Å; F96-K461 HydrophobicContact CG-CD 4.17Å; F96-K461 HydrophobicContact CG-CG 4.19Å; F96-K461 HydrophobicContact CZ-CD 3.71Å; F96-K461 HydrophobicContact CZ-CG 3.9Å; P97-K461 HydrophobicContact CG-CB 4.38Å; A361-K461 VanDerWaalsContact CB-NZ 3.26Å; L370-K461 WeakPolarHBondContact CD1-O 3.31Å; T371-K461 PolarHBondContact N-O 3.46Å; T371-K461 PolarHBondContact O-N 2.63Å; K461-S465 VanDerWaalsContact C-CB 3.45Å
462	G	98.4	Very high	98.5	Very high	9 Å²	9	31.6 Å²	31.6	9%	0.093	17%	0.174	C	C	.	.	S	Bend	trans	96.1	-160.8	179.4	0	0	0	0	0	114.2	E366 T369 M464 S465	E366-G462 WeakPolarHBondContact O-CA 3.33Å; T369-G462 WeakPolarHBondContact O-CA 3.35Å; G462-M464 PolarHBondContact O-N 3.48Å; G462-S465 PolarHBondContact N-OG 2.89Å; G462-S465 WeakPolarHBondContact O-CB 3.42Å; G462-S465 PolarHBondContact O-N 3.38Å; G462-S465 PolarHBondContact O-OG 3.43Å
463	P	98.6	Very high	98.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	133.4	-173.8	-17.4	30.4	0	0	0	111.9	H53 A55 E366 M367 T369 L370 S465	H53-P463 WeakPolarHBondContact O-CB 2.98Å; A55-P463 HydrophobicContact CB-CB 4.1Å; A55-P463 HydrophobicContact CB-CG 4.17Å; E366-P463 WeakPolarHBondContact O-CD 3.47Å; M367-P463 WeakPolarHBondContact O-CG 3.33Å; T369-P463 VanDerWaalsContact C-CD 3.42Å; T369-P463 VanDerWaalsContact O-CD 3.32Å; T369-P463 WeakPolarHBondContact O-CD 3.35Å; L370-P463 WeakPolarHBondContact CD1-O 3.27Å; P463-S465 PolarHBondContact O-N 2.93Å; P463-S465 VanDerWaalsContact O-N 3.09Å
464	M	98.5	Very high	98.7	Very high	8 Å²	8	29 Å²	29	4%	0.039	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	7.8	-176.8	-51.4	-50.3	-53.1	0	0	116.5	N51 V52 G462 H466 L467 Y483 A484 L495	N51-M464 PolarHBondContact O-N 3.47Å; V52-M464 HydrophobicContact CB-SD 4.39Å; G462-M464 PolarHBondContact O-N 3.48Å; M464-H466 PolarHBondContact O-N 3.41Å; M464-H466 VanDerWaalsContact O-N 3.13Å; M464-L467 HydrophobicContact CB-CD1 4.17Å; M464-L467 HydrophobicContact CB-CG 4.45Å; M464-L467 HydrophobicContact CE-CD1 3.64Å; M464-L467 HydrophobicContact CE-CD2 4.24Å; M464-L467 HydrophobicContact CE-CG 3.87Å; M464-L467 WeakPolarHBondContact O-CB 3.31Å; M464-L467 WeakPolarHBondContact O-CG 3.28Å; M464-L467 PolarHBondContact O-N 3.28Å; M464-Y483 HydrophobicContact CE-CD1 4.34Å; M464-Y483 HydrophobicContact CE-CE1 3.68Å; M464-Y483 HydrophobicContact CG-CD1 4.38Å; M464-Y483 HydrophobicContact CG-CE1 4.38Å; M464-Y483 HydrophobicContact SD-CE1 4.4Å; M464-A484 HydrophobicContact CB-CB 3.75Å; M464-A484 HydrophobicContact CG-CB 3.85Å; M464-L495 HydrophobicContact CE-CD2 4.11Å; M464-L495 HydrophobicContact CG-CD1 3.86Å; M464-L495 HydrophobicContact CG-CD2 4.29Å; M464-L495 HydrophobicContact SD-CD1 4.13Å; M464-L495 HydrophobicContact SD-CD2 3.48Å; M464-L495 WeakPolarHBondContact SD-CD2 3.4Å; M464-L495 HydrophobicContact SD-CG 4.46Å
465	S	98.6	Very high	98.7	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.021	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-60.3	-25.6	-179.9	53.7	0	0	0	0	114.3	H98 K461 G462 P463 L467 F468	H98-S465 VanDerWaalsContact CB-O 3.32Å; H98-S465 WeakPolarHBondContact CB-O 3.19Å; H98-S465 VanDerWaalsContact CD2-C 3.4Å; H98-S465 PolarHBondContact CD2-OG 2.87Å; K461-S465 VanDerWaalsContact C-CB 3.45Å; G462-S465 PolarHBondContact N-OG 2.89Å; G462-S465 WeakPolarHBondContact O-CB 3.42Å; G462-S465 PolarHBondContact O-N 3.38Å; G462-S465 PolarHBondContact O-OG 3.43Å; P463-S465 PolarHBondContact O-N 2.93Å; P463-S465 VanDerWaalsContact O-N 3.09Å; S465-L467 PolarHBondContact O-N 2.95Å; S465-L467 VanDerWaalsContact O-N 3.12Å; S465-F468 WeakPolarHBondContact O-CB 3.43Å; S465-F468 WeakPolarHBondContact O-CD2 3.45Å; S465-F468 PolarHBondContact O-N 2.7Å
466	H	98.6	Very high	98.7	Very high	44 Å²	44	28 Å²	28	20%	0.204	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-62.8	-13.2	173.9	62.3	-85.3	0	0	0	114.6	H98 M464 F468	H98-H466 PolarHBondContact CD2-N 2.94Å; M464-H466 PolarHBondContact O-N 3.41Å; M464-H466 VanDerWaalsContact O-N 3.13Å; H466-F468 PolarHBondContact O-N 2.91Å
467	L	98.6	Very high	98.7	Very high	45 Å²	45	28 Å²	28	24%	0.236	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-73.5	-14.6	172.3	-62.5	-174.3	0	0	0	113	M464 S465 H469 Y476 V480 Y483	M464-L467 HydrophobicContact CB-CD1 4.17Å; M464-L467 HydrophobicContact CB-CG 4.45Å; M464-L467 HydrophobicContact CE-CD1 3.64Å; M464-L467 HydrophobicContact CE-CD2 4.24Å; M464-L467 HydrophobicContact CE-CG 3.87Å; M464-L467 WeakPolarHBondContact O-CB 3.31Å; M464-L467 WeakPolarHBondContact O-CG 3.28Å; M464-L467 PolarHBondContact O-N 3.28Å; S465-L467 PolarHBondContact O-N 2.95Å; S465-L467 VanDerWaalsContact O-N 3.12Å; L467-H469 PolarHBondContact O-CD2 2.58Å; L467-H469 PolarHBondContact O-N 3.42Å; L467-Y476 WeakPolarHBondContact O-CE1 3.44Å; L467-Y476 PolarHBondContact O-OH 2.8Å; L467-V480 HydrophobicContact CB-CG1 3.92Å; L467-V480 HydrophobicContact CB-CG2 4.27Å; L467-V480 HydrophobicContact CD1-CG1 4.19Å; L467-Y483 HydrophobicContact CD1-CD1 3.9Å; L467-Y483 HydrophobicContact CD1-CE1 4.1Å
468	F	98.7	Very high	98.7	Very high	1 Å²	1	27.6 Å²	27.6	0%	0.004	15%	0.149	C	C	.	.			trans	-84.4	94	170.4	-66.7	-78.1	0	0	0	109.7	A100 L370 V372 I458 A460 S465 H466 Y476 I477 V480	A100-F468 HydrophobicContact CB-CB 4.41Å; L370-F468 HydrophobicContact CD1-CE2 4.5Å; V372-F468 HydrophobicContact CG1-CE1 4.48Å; V372-F468 HydrophobicContact CG1-CZ 4.19Å; V372-F468 HydrophobicContact CG2-CE2 3.65Å; V372-F468 HydrophobicContact CG2-CZ 3.74Å; I458-F468 HydrophobicContact CB-CD1 4.46Å; I458-F468 HydrophobicContact CD1-CD1 4.2Å; I458-F468 HydrophobicContact CD1-CE1 4.49Å; I458-F468 HydrophobicContact CG2-CD1 3.62Å; I458-F468 HydrophobicContact CG2-CE1 3.91Å; I458-F468 HydrophobicContact CG2-CG 4.17Å; A460-F468 HydrophobicContact CB-CB 4.01Å; A460-F468 HydrophobicContact CB-CD2 3.26Å; A460-F468 HydrophobicContact CB-CE2 3.89Å; A460-F468 HydrophobicContact CB-CG 3.82Å; S465-F468 WeakPolarHBondContact O-CB 3.43Å; S465-F468 WeakPolarHBondContact O-CD2 3.45Å; S465-F468 PolarHBondContact O-N 2.7Å; H466-F468 PolarHBondContact O-N 2.91Å; F468-Y476 HydrophobicContact CD1-CD1 4.46Å; F468-Y476 HydrophobicContact CD1-CE1 4.41Å; F468-I477 HydrophobicContact CE1-CG1 4.19Å; F468-V480 HydrophobicContact CD2-CG1 4.01Å; F468-V480 HydrophobicContact CE1-CB 4.15Å; F468-V480 HydrophobicContact CE1-CG1 4.41Å; F468-V480 HydrophobicContact CE1-CG2 4.24Å; F468-V480 HydrophobicContact CE2-CB 3.94Å; F468-V480 HydrophobicContact CE2-CG1 3.38Å; F468-V480 HydrophobicContact CZ-CB 3.61Å; F468-V480 HydrophobicContact CZ-CG1 3.63Å; F468-V480 HydrophobicContact CZ-CG2 4.18Å
469	H	98.3	Very high	98.7	Very high	114 Å²	114	29.9 Å²	29.9	53%	0.528	16%	0.159	S	C	.	.			trans	-146.3	157.8	175.7	70.2	88.3	0	0	0	111.5	L467 Q472	L467-H469 PolarHBondContact O-CD2 2.58Å; L467-H469 PolarHBondContact O-N 3.42Å; H469-Q472 PolarHBondContact O-NE2 3.3Å
470	G	98.6	Very high	98.7	Very high	46 Å²	46	29.4 Å²	29.4	47%	0.474	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	71.2	-143	175.7	0	0	0	0	0	113	A100 L101	A100-G470 CarbonylContact C-O 3.52Å; A100-G470 WeakPolarHBondContact CA-O 3.47Å; A100-G470 WeakPolarHBondContact CB-O 3.3Å; L101-G470 PolarHBondContact N-O 3.38Å
471	V	98.8	Very high	98.7	Very high	78 Å²	78	29.4 Å²	29.4	47%	0.473	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.5	178.1	-174.9	0	0	0	0	107.9	L101 K103	L101-V471 HydrophobicContact CB-CB 4.49Å; L101-V471 HydrophobicContact CB-CG1 4.26Å; L101-V471 HydrophobicContact CB-CG2 4.19Å; L101-V471 HydrophobicContact CD1-CG2 4.27Å; L101-V471 WeakPolarHBondContact O-CA 3.48Å; K103-V471 HydrophobicContact CD-CG1 4.01Å; K103-V471 HydrophobicContact CG-CG1 3.85Å
472	Q	98.8	Very high	98.7	Very high	44 Å²	44	28.1 Å²	28.1	21%	0.206	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	157.1	-173.1	-59.1	-64.1	-12.3	0	0	110.7	L101 S102 K103 H469 Y476	L101-Q472 PolarHBondContact O-N 3.28Å; S102-Q472 WeakPolarHBondContact CA-O 3.26Å; K103-Q472 PolarHBondContact N-O 3.31Å; H469-Q472 PolarHBondContact O-NE2 3.3Å; Q472-Y476 HydrophobicContact CB-CD1 3.84Å; Q472-Y476 HydrophobicContact CB-CG 4.2Å; Q472-Y476 HydrophobicContact CG-CD1 3.6Å; Q472-Y476 HydrophobicContact CG-CE1 3.9Å; Q472-Y476 HydrophobicContact CG-CG 4.29Å
473	E	98.9	Very high	98.7	Very high	46 Å²	46	31 Å²	31	22%	0.215	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	145	160.9	-66	-63	162	0	0	109.5	K103 Y105 K126 N475 Y476	K103-E473 WeakPolarHBondContact CE-OE1 3.5Å; K103-E473 IonicContact NZ-OE1 3.11Å; K103-E473 PolarHBondContact NZ-OE1 3.03Å; Y105-E473 WeakPolarHBondContact CE1-OE2 3.33Å; Y105-E473 PolarHBondContact OH-OE1 3.17Å; Y105-E473 VanDerWaalsContact OH-OE1 3.07Å; Y105-E473 PolarHBondContact OH-OE2 2.59Å; K126-E473 VanDerWaalsContact CE-OE2 3.3Å; K126-E473 WeakPolarHBondContact CE-OE2 3.47Å; K126-E473 IonicContact NZ-OE2 3.48Å; K126-E473 PolarHBondContact NZ-OE2 3.36Å; E473-N475 WeakPolarHBondContact CB-OD1 3.39Å; E473-N475 PolarHBondContact O-N 2.93Å; E473-N475 VanDerWaalsContact O-N 3.13Å; E473-Y476 WeakPolarHBondContact O-CB 3.46Å; E473-Y476 PolarHBondContact O-N 3.09Å
474	Q	98.8	Very high	98.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.4	178.2	-175.1	176.1	58.3	0	0	113.1	S102 K103 T117 A120 Y121 D376 Y476 I477	S102-Q474 VanDerWaalsContact OG-CA 3.26Å; S102-Q474 WeakPolarHBondContact OG-CA 3.48Å; S102-Q474 VanDerWaalsContact OG-CB 3.29Å; S102-Q474 WeakPolarHBondContact OG-CB 3.5Å; K103-Q474 WeakPolarHBondContact O-CB 3.47Å; K103-Q474 PolarHBondContact O-N 2.91Å; T117-Q474 VanDerWaalsContact CA-OE1 3.3Å; T117-Q474 VanDerWaalsContact CG2-OE1 3.28Å; T117-Q474 PolarHBondContact O-OE1 3.25Å; A120-Q474 HydrophobicContact CB-CB 4.23Å; A120-Q474 HydrophobicContact CB-CG 4.12Å; Y121-Q474 HydrophobicContact CD1-CG 4.42Å; D376-Q474 PolarHBondContact O-NE2 3.31Å; Q474-Y476 PolarHBondContact O-N 3.45Å; Q474-Y476 VanDerWaalsContact O-N 3.12Å; Q474-I477 HydrophobicContact CG-CD1 4.18Å; Q474-I477 WeakPolarHBondContact O-CD1 3.47Å; Q474-I477 PolarHBondContact O-N 3.32Å
475	N	98.9	Very high	98.7	Very high	38 Å²	38	30.6 Å²	30.6	20%	0.203	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.1	178.5	81.8	-67.9	0	0	0	113.8	A120 G124 K126 E473 I477 P478 H479	A120-N475 HydrophobicContact CB-CB 4.06Å; A120-N475 WeakPolarHBondContact O-CA 3.39Å; G124-N475 WeakPolarHBondContact CA-O 3.25Å; G124-N475 PolarHBondContact O-ND2 3.17Å; K126-N475 HydrophobicContact CG-CB 4.32Å; E473-N475 WeakPolarHBondContact CB-OD1 3.39Å; E473-N475 PolarHBondContact O-N 2.93Å; E473-N475 VanDerWaalsContact O-N 3.13Å; N475-I477 VanDerWaalsContact C-N 3.3Å; N475-I477 PolarHBondContact O-N 3.08Å; N475-P478 VanDerWaalsContact O-CD 3.31Å; N475-P478 WeakPolarHBondContact O-CD 3.39Å; N475-H479 PolarHBondContact O-CD2 3.38Å
476	Y	98.9	Very high	98.7	Very high	61 Å²	61	31 Å²	31	24%	0.239	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-29.5	174.6	-176.7	-117.2	0	0	0	113.3	L467 F468 Q472 E473 Q474 H479 V480	L467-Y476 WeakPolarHBondContact O-CE1 3.44Å; L467-Y476 PolarHBondContact O-OH 2.8Å; F468-Y476 HydrophobicContact CD1-CD1 4.46Å; F468-Y476 HydrophobicContact CD1-CE1 4.41Å; Q472-Y476 HydrophobicContact CB-CD1 3.84Å; Q472-Y476 HydrophobicContact CB-CG 4.2Å; Q472-Y476 HydrophobicContact CG-CD1 3.6Å; Q472-Y476 HydrophobicContact CG-CE1 3.9Å; Q472-Y476 HydrophobicContact CG-CG 4.29Å; E473-Y476 WeakPolarHBondContact O-CB 3.46Å; E473-Y476 PolarHBondContact O-N 3.09Å; Q474-Y476 PolarHBondContact O-N 3.45Å; Q474-Y476 VanDerWaalsContact O-N 3.12Å; Y476-H479 WeakPolarHBondContact O-CB 3.26Å; Y476-H479 PolarHBondContact O-N 3.34Å; Y476-H479 VanDerWaalsContact O-N 3.15Å; Y476-V480 HydrophobicContact CD1-CG2 3.75Å; Y476-V480 HydrophobicContact CD2-CG2 4.09Å; Y476-V480 HydrophobicContact CE1-CG2 3.26Å; Y476-V480 HydrophobicContact CE2-CG2 3.62Å; Y476-V480 HydrophobicContact CG-CG2 4.15Å; Y476-V480 PolarHBondContact O-N 3.34Å
477	I	98.9	Very high	98.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-52.5	-58.2	-176.1	-67	159.3	0	0	0	112.8	L60 V372 T374 I458 F468 Q474 N475 H479 V480 M481	L60-I477 HydrophobicContact CD1-CG2 4.11Å; V372-I477 HydrophobicContact CG1-CG2 4.3Å; T374-I477 HydrophobicContact CG2-CD1 4.05Å; I458-I477 HydrophobicContact CD1-CD1 3.96Å; I458-I477 HydrophobicContact CD1-CG1 3.71Å; I458-I477 HydrophobicContact CG1-CD1 4.19Å; I458-I477 HydrophobicContact CG1-CG1 4.33Å; F468-I477 HydrophobicContact CE1-CG1 4.19Å; Q474-I477 HydrophobicContact CG-CD1 4.18Å; Q474-I477 WeakPolarHBondContact O-CD1 3.47Å; Q474-I477 PolarHBondContact O-N 3.32Å; N475-I477 VanDerWaalsContact C-N 3.3Å; N475-I477 PolarHBondContact O-N 3.08Å; I477-H479 VanDerWaalsContact C-N 3.26Å; I477-H479 PolarHBondContact O-N 3.22Å; I477-V480 PolarHBondContact O-N 3.21Å; I477-M481 HydrophobicContact CG2-SD 4.09Å; I477-M481 WeakPolarHBondContact O-CG 3.34Å; I477-M481 PolarHBondContact O-N 2.59Å; I477-M481 VanDerWaalsContact O-N 3.1Å
478	P	98.8	Very high	98.7	Very high	2 Å²	2	31 Å²	31	1%	0.013	16%	0.16	C	C	.	.	H	α-helix	trans	-71	-23.2	-178.1	28	-35.6	0	0	0	112.1	A120 Y121 G124 I154 N475 A482	A120-P478 WeakPolarHBondContact O-CG 3.42Å; Y121-P478 VanDerWaalsContact O-CD 3.26Å; Y121-P478 WeakPolarHBondContact O-CD 3.36Å; Y121-P478 WeakPolarHBondContact O-CG 3.39Å; G124-P478 VanDerWaalsContact CA-CG 3.42Å; I154-P478 HydrophobicContact CB-CB 4.19Å; I154-P478 HydrophobicContact CD1-CB 4.43Å; I154-P478 HydrophobicContact CG2-CB 4.35Å; N475-P478 VanDerWaalsContact O-CD 3.31Å; N475-P478 WeakPolarHBondContact O-CD 3.39Å; P478-A482 WeakPolarHBondContact O-CB 3.26Å; P478-A482 PolarHBondContact O-N 2.91Å
479	H	98.9	Very high	98.6	Very high	47 Å²	47	34.3 Å²	34.3	22%	0.218	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-46.5	173.2	-75.2	-69.8	0	0	0	111.7	G124 N475 Y476 I477 M481 A482 Y483 Y490	G124-H479 PolarHBondContact O-NE2 2.62Å; G124-H479 VanDerWaalsContact O-NE2 3.12Å; N475-H479 PolarHBondContact O-CD2 3.38Å; Y476-H479 WeakPolarHBondContact O-CB 3.26Å; Y476-H479 PolarHBondContact O-N 3.34Å; Y476-H479 VanDerWaalsContact O-N 3.15Å; I477-H479 VanDerWaalsContact C-N 3.26Å; I477-H479 PolarHBondContact O-N 3.22Å; H479-M481 VanDerWaalsContact C-N 3.35Å; H479-A482 PolarHBondContact O-N 2.99Å; H479-Y483 WeakPolarHBondContact O-CB 3.44Å; H479-Y483 PolarHBondContact O-N 3Å; H479-Y490 HydrophobicContact CB-CE2 4.21Å; H479-Y490 AromaticContact ND1-CE2 3.78Å; H479-Y490 AromaticContact ND1-CZ 3.68Å; H479-Y490 PolarHBondContact ND1-OH 3.47Å; H479-Y490 WeakPolarHBondContact O-CE2 3.16Å
480	V	98.8	Very high	98.6	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-43.5	175.4	176.5	0	0	0	0	110.9	L467 F468 Y476 I477 Y483 A484	L467-V480 HydrophobicContact CB-CG1 3.92Å; L467-V480 HydrophobicContact CB-CG2 4.27Å; L467-V480 HydrophobicContact CD1-CG1 4.19Å; F468-V480 HydrophobicContact CD2-CG1 4.01Å; F468-V480 HydrophobicContact CE1-CB 4.15Å; F468-V480 HydrophobicContact CE1-CG1 4.41Å; F468-V480 HydrophobicContact CE1-CG2 4.24Å; F468-V480 HydrophobicContact CE2-CB 3.94Å; F468-V480 HydrophobicContact CE2-CG1 3.38Å; F468-V480 HydrophobicContact CZ-CB 3.61Å; F468-V480 HydrophobicContact CZ-CG1 3.63Å; F468-V480 HydrophobicContact CZ-CG2 4.18Å; Y476-V480 HydrophobicContact CD1-CG2 3.75Å; Y476-V480 HydrophobicContact CD2-CG2 4.09Å; Y476-V480 HydrophobicContact CE1-CG2 3.26Å; Y476-V480 HydrophobicContact CE2-CG2 3.62Å; Y476-V480 HydrophobicContact CG-CG2 4.15Å; Y476-V480 PolarHBondContact O-N 3.34Å; I477-V480 PolarHBondContact O-N 3.21Å; V480-Y483 PolarHBondContact O-N 3.06Å; V480-A484 VanDerWaalsContact O-CB 3.31Å; V480-A484 WeakPolarHBondContact O-CB 3.5Å; V480-A484 PolarHBondContact O-N 3.45Å
481	M	98.9	Very high	98.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-41.7	179.2	-67.4	-177.9	73.3	0	0	112.1	L58 L60 I154 F325 L370 V372 I477 H479 A484 A485	L58-M481 HydrophobicContact CB-CE 3.83Å; L58-M481 HydrophobicContact CD1-CB 4.33Å; L58-M481 HydrophobicContact CD2-CB 4.33Å; L58-M481 HydrophobicContact CD2-CE 4.43Å; L60-M481 HydrophobicContact CB-CE 3.97Å; L60-M481 HydrophobicContact CB-SD 4.15Å; L60-M481 HydrophobicContact CD1-SD 4.37Å; I154-M481 HydrophobicContact CD1-CB 3.23Å; I154-M481 HydrophobicContact CD1-CG 4.39Å; I154-M481 HydrophobicContact CD1-SD 4.45Å; F325-M481 HydrophobicContact CD2-CE 4.2Å; F325-M481 HydrophobicContact CE2-CE 3.73Å; L370-M481 HydrophobicContact CD2-CB 4.44Å; L370-M481 HydrophobicContact CD2-CG 4.06Å; V372-M481 HydrophobicContact CB-SD 4.39Å; V372-M481 HydrophobicContact CG2-CG 4.02Å; V372-M481 HydrophobicContact CG2-SD 4.09Å; I477-M481 HydrophobicContact CG2-SD 4.09Å; I477-M481 WeakPolarHBondContact O-CG 3.34Å; I477-M481 PolarHBondContact O-N 2.59Å; I477-M481 VanDerWaalsContact O-N 3.1Å; H479-M481 VanDerWaalsContact C-N 3.35Å; M481-A484 PolarHBondContact O-N 3.13Å; M481-A485 PolarHBondContact O-N 3.16Å; M481-A485 VanDerWaalsContact O-N 3.15Å
482	A	98.8	Very high	98.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-43.2	175.7	0	0	0	0	0	111.8	I154 P478 H479 A485 C486 I487 Y490	I154-A482 HydrophobicContact CD1-CB 4.37Å; P478-A482 WeakPolarHBondContact O-CB 3.26Å; P478-A482 PolarHBondContact O-N 2.91Å; H479-A482 PolarHBondContact O-N 2.99Å; A482-A485 CarbonylContact O-C 3.56Å; A482-A485 PolarHBondContact O-N 2.85Å; A482-C486 PolarHBondContact O-N 3.27Å; A482-I487 HydrophobicContact CB-CD1 4.43Å; A482-I487 HydrophobicContact CB-CG1 3.89Å; A482-I487 PolarHBondContact O-N 3.05Å; A482-I487 VanDerWaalsContact O-N 3.1Å; A482-Y490 HydrophobicContact CB-CD2 3.76Å; A482-Y490 HydrophobicContact CB-CE2 4.08Å
483	Y	98.8	Very high	97.9	Very high	70 Å²	70	37.8 Å²	37.8	28%	0.275	19%	0.186	S	C	.	.	H	α-helix	trans	-59.7	-47.1	174.1	177.9	-93.5	0	0	0	111.8	M464 L467 H479 V480 A485 C486 Y490 C493 L495	M464-Y483 HydrophobicContact CE-CD1 4.34Å; M464-Y483 HydrophobicContact CE-CE1 3.68Å; M464-Y483 HydrophobicContact CG-CD1 4.38Å; M464-Y483 HydrophobicContact CG-CE1 4.38Å; M464-Y483 HydrophobicContact SD-CE1 4.4Å; L467-Y483 HydrophobicContact CD1-CD1 3.9Å; L467-Y483 HydrophobicContact CD1-CE1 4.1Å; H479-Y483 WeakPolarHBondContact O-CB 3.44Å; H479-Y483 PolarHBondContact O-N 3Å; V480-Y483 PolarHBondContact O-N 3.06Å; Y483-A485 PolarHBondContact O-N 3.43Å; Y483-C486 PolarHBondContact O-N 3.3Å; Y483-Y490 HydrophobicContact CD2-CD1 4.09Å; Y483-Y490 HydrophobicContact CD2-CG 4.13Å; Y483-C493 HydrophobicContact CE2-CB 4.46Å; Y483-L495 HydrophobicContact CD1-CD1 4.5Å; Y483-L495 HydrophobicContact CE1-CD1 4.22Å; Y483-L495 HydrophobicContact CE1-CD2 3.8Å; Y483-L495 HydrophobicContact CE1-CG 4.31Å; Y483-L495 WeakPolarHBondContact O-CD1 3.14Å
484	A	98.6	Very high	97.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-35.4	179.2	0	0	0	0	0	112.4	K54 A55 L370 M464 V480 M481	K54-A484 CarbonylContact C-O 3.21Å; K54-A484 WeakPolarHBondContact CA-O 3.46Å; A55-A484 HydrophobicContact CB-CB 4.03Å; A55-A484 PolarHBondContact N-O 3.49Å; L370-A484 HydrophobicContact CD2-CB 3.53Å; M464-A484 HydrophobicContact CB-CB 3.75Å; M464-A484 HydrophobicContact CG-CB 3.85Å; V480-A484 VanDerWaalsContact O-CB 3.31Å; V480-A484 WeakPolarHBondContact O-CB 3.5Å; V480-A484 PolarHBondContact O-N 3.45Å; M481-A484 PolarHBondContact O-N 3.13Å
485	A	98.4	Very high	97.2	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-92.1	-1.5	178.8	0	0	0	0	0	114.5	K54 L58 M481 A482 Y483 I487	K54-A485 WeakPolarHBondContact CE-O 3.18Å; L58-A485 HydrophobicContact CD1-CB 3.69Å; L58-A485 HydrophobicContact CD2-CB 4.11Å; L58-A485 HydrophobicContact CG-CB 4.01Å; M481-A485 PolarHBondContact O-N 3.16Å; M481-A485 VanDerWaalsContact O-N 3.15Å; A482-A485 CarbonylContact O-C 3.56Å; A482-A485 PolarHBondContact O-N 2.85Å; Y483-A485 PolarHBondContact O-N 3.43Å; A485-I487 VanDerWaalsContact C-N 3.28Å; A485-I487 HydrophobicContact CB-CD1 4.38Å; A485-I487 HydrophobicContact CB-CG1 4.23Å; A485-I487 HydrophobicContact CB-CG2 4.19Å; A485-I487 PolarHBondContact O-N 3.22Å
486	C	98.2	Very high	96.4	Very high	12 Å²	12	47.9 Å²	47.9	8%	0.081	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	48.7	-174.7	-45.6	0	0	0	0	112.6	K54 A482 Y483 Y490 C493	K54-C486 HydrophobicContact CD-CB 4.25Å; A482-C486 PolarHBondContact O-N 3.27Å; Y483-C486 PolarHBondContact O-N 3.3Å; C486-Y490 WeakPolarHBondContact CA-O 3.37Å; C486-C493 HydrophobicContact CB-CB 3.69Å; C486-C493 WeakPolarHBondContact CB-SG 3.48Å; C486-C493 WeakPolarHBondContact SG-CB 3.49Å; C486-C493 CovalentContact SG-SG 1.99Å; C486-C493 PolarHBondContact SG-SG 3.08Å
487	I	98.4	Very high	95.4	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.031	26%	0.258	C	S	.	.			trans	-113.6	165.5	173.8	62.8	176.5	0	0	0	108.6	L58 I154 R157 A158 A161 A482 A485 Y490	L58-I487 HydrophobicContact CD1-CD1 4.41Å; I154-I487 HydrophobicContact CG1-CD1 4.05Å; R157-I487 HydrophobicContact CB-CD1 4.15Å; A158-I487 HydrophobicContact CB-CD1 4.16Å; A161-I487 HydrophobicContact CB-CB 4.24Å; A161-I487 HydrophobicContact CB-CG2 3.41Å; A161-I487 VanDerWaalsContact CB-CG2 3.41Å; A482-I487 HydrophobicContact CB-CD1 4.43Å; A482-I487 HydrophobicContact CB-CG1 3.89Å; A482-I487 PolarHBondContact O-N 3.05Å; A482-I487 VanDerWaalsContact O-N 3.1Å; A485-I487 VanDerWaalsContact C-N 3.28Å; A485-I487 HydrophobicContact CB-CD1 4.38Å; A485-I487 HydrophobicContact CB-CG1 4.23Å; A485-I487 HydrophobicContact CB-CG2 4.19Å; A485-I487 PolarHBondContact O-N 3.22Å; I487-Y490 WeakPolarHBondContact O-CA 3.48Å; I487-Y490 PolarHBondContact O-N 3.18Å
488	E	98	Very high	93.6	Very high	82 Å²	82	53.3 Å²	53.3	38%	0.383	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.5	134.3	-176.8	-168.6	-171.5	161.1	0	0	113.9	R157 Y490 E491	R157-E488 HydrophobicContact CB-CB 4.47Å; R157-E488 WeakPolarHBondContact CD-O 3.42Å; R157-E488 HydrophobicContact CG-CB 4.16Å; R157-E488 PolarHBondContact NH1-O 3.07Å; E488-Y490 VanDerWaalsContact C-N 3.34Å; E488-E491 VanDerWaalsContact CA-CD 3.45Å; E488-E491 WeakPolarHBondContact CA-OE1 3.43Å; E488-E491 WeakPolarHBondContact CA-OE2 3.42Å; E488-E491 VanDerWaalsContact CB-OE1 3.24Å; E488-E491 WeakPolarHBondContact CB-OE1 3.49Å; E488-E491 PolarHBondContact N-OE1 3.25Å
489	P	97.9	Very high	91.5	Very high	71 Å²	71	59 Å²	59	46%	0.461	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.4	25.6	-2.8	39.1	-40	0	0	0	113.5	E491	P489-E491 WeakPolarHBondContact CA-OE2 3.2Å
490	Y	98.2	Very high	89.1	Confident	70 Å²	70	61.3 Å²	61.3	28%	0.275	32%	0.316	S	S	.	.			trans	-114.5	34.3	-170.9	-53.6	-69.9	0	0	0	113.1	H479 A482 Y483 C486 I487 E488 D492 C493	H479-Y490 HydrophobicContact CB-CE2 4.21Å; H479-Y490 AromaticContact ND1-CE2 3.78Å; H479-Y490 AromaticContact ND1-CZ 3.68Å; H479-Y490 PolarHBondContact ND1-OH 3.47Å; H479-Y490 WeakPolarHBondContact O-CE2 3.16Å; A482-Y490 HydrophobicContact CB-CD2 3.76Å; A482-Y490 HydrophobicContact CB-CE2 4.08Å; Y483-Y490 HydrophobicContact CD2-CD1 4.09Å; Y483-Y490 HydrophobicContact CD2-CG 4.13Å; C486-Y490 WeakPolarHBondContact CA-O 3.37Å; I487-Y490 WeakPolarHBondContact O-CA 3.48Å; I487-Y490 PolarHBondContact O-N 3.18Å; E488-Y490 VanDerWaalsContact C-N 3.34Å; Y490-D492 PolarHBondContact O-N 2.75Å; Y490-C493 WeakPolarHBondContact O-CB 3.48Å; Y490-C493 PolarHBondContact O-N 2.9Å; Y490-C493 VanDerWaalsContact O-N 3.16Å
491	E	96.4	Very high	86.5	Confident	106 Å²	106	64.4 Å²	64.4	50%	0.495	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.8	179.2	-65	89.4	160	0	0	112.2	E488 P489 C493	E488-E491 VanDerWaalsContact CA-CD 3.45Å; E488-E491 WeakPolarHBondContact CA-OE1 3.43Å; E488-E491 WeakPolarHBondContact CA-OE2 3.42Å; E488-E491 VanDerWaalsContact CB-OE1 3.24Å; E488-E491 WeakPolarHBondContact CB-OE1 3.49Å; E488-E491 PolarHBondContact N-OE1 3.25Å; P489-E491 WeakPolarHBondContact CA-OE2 3.2Å; E491-C493 PolarHBondContact O-N 3.26Å; E491-C493 VanDerWaalsContact O-N 3.12Å
492	D	93.3	Very high	83.6	Confident	152 Å²	152	75.6 Å²	75.6	81%	0.813	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	22.6	178.3	-66	-25.2	0	0	0	113.4	Y490 Q494	Y490-D492 PolarHBondContact O-N 2.75Å; D492-Q494 PolarHBondContact O-NE2 2.8Å
493	C	91.4	Very high	80.9	Confident	26 Å²	26	82.5 Å²	82.5	18%	0.176	43%	0.426	C	S	.	.			trans	-51.9	142.3	176.2	81.8	0	0	0	0	110.8	Y483 C486 Y490 E491 L495	Y483-C493 HydrophobicContact CE2-CB 4.46Å; C486-C493 HydrophobicContact CB-CB 3.69Å; C486-C493 WeakPolarHBondContact CB-SG 3.48Å; C486-C493 WeakPolarHBondContact SG-CB 3.49Å; C486-C493 CovalentContact SG-SG 1.99Å; C486-C493 PolarHBondContact SG-SG 3.08Å; Y490-C493 WeakPolarHBondContact O-CB 3.48Å; Y490-C493 PolarHBondContact O-N 2.9Å; Y490-C493 VanDerWaalsContact O-N 3.16Å; E491-C493 PolarHBondContact O-N 3.26Å; E491-C493 VanDerWaalsContact O-N 3.12Å; C493-L495 HydrophobicContact CB-CD1 4.43Å; C493-L495 HydrophobicContact CB-CG 4.07Å; C493-L495 PolarHBondContact O-N 2.79Å
494	Q	89.7	Confident	78.4	Confident	172 Å²	172	87.6 Å²	87.6	80%	0.804	45%	0.452	S	S	*	.			trans	-102.9	50.5	175.8	-60.7	-65.2	-41.9	0	0	110.1	D492	D492-Q494 PolarHBondContact O-NE2 2.8Å
495	L	91.9	Very high	75.9	Confident	27 Å²	27	91.7 Å²	91.7	14%	0.141	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-96.1	151.8	-177.5	-60.5	-173.4	0	0	0	111.8	K54 M464 Y483 C493	K54-L495 HydrophobicContact CB-CB 4.36Å; M464-L495 HydrophobicContact CE-CD2 4.11Å; M464-L495 HydrophobicContact CG-CD1 3.86Å; M464-L495 HydrophobicContact CG-CD2 4.29Å; M464-L495 HydrophobicContact SD-CD1 4.13Å; M464-L495 HydrophobicContact SD-CD2 3.48Å; M464-L495 WeakPolarHBondContact SD-CD2 3.4Å; M464-L495 HydrophobicContact SD-CG 4.46Å; Y483-L495 HydrophobicContact CD1-CD1 4.5Å; Y483-L495 HydrophobicContact CE1-CD1 4.22Å; Y483-L495 HydrophobicContact CE1-CD2 3.8Å; Y483-L495 HydrophobicContact CE1-CG 4.31Å; Y483-L495 WeakPolarHBondContact O-CD1 3.14Å; C493-L495 HydrophobicContact CB-CD1 4.43Å; C493-L495 HydrophobicContact CB-CG 4.07Å; C493-L495 PolarHBondContact O-N 2.79Å
496	L	83.4	Confident	73.6	Confident	97 Å²	97	95.5 Å²	95.5	51%	0.508	51%	0.508	S	S	.	.	B	Isolated β-bridge	trans	-69.9	134.4	172.8	-61.4	177.8	0	0	0	109.6	V52 H53 K54	V52-L496 HydrophobicContact CG2-CD1 3.88Å; V52-L496 HydrophobicContact CG2-CG 4.36Å; V52-L496 PolarHBondContact O-N 3.36Å; H53-L496 CarbonylContact C-O 3.55Å; H53-L496 VanDerWaalsContact CA-O 3.23Å; H53-L496 WeakPolarHBondContact CA-O 3.41Å; H53-L496 WeakPolarHBondContact CD2-CB 3.5Å; K54-L496 PolarHBondContact N-O 3.21Å
497	E	77.4	Confident	71.2	Confident	154 Å²	154	100.9 Å²	100.9	72%	0.72	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-58.4	142.3	174.4	-78.3	-72.1	168.3	0	0	111.2	H53	H53-E497 PolarHBondContact CD2-O 3.07Å
498	G	60.8	Low	68.9	Low	21 Å²	21	106.6 Å²	106.6	22%	0.216	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-62.3	157.8	-176.1	0	0	0	0	0	113.4	S500	G498-S500 PolarHBondContact O-N 2.79Å
499	H	55.9	Low	66.8	Low	122 Å²	122	108.8 Å²	108.8	57%	0.565	58%	0.578	S	S	*	*	S	Bend	trans	-65.9	4.7	-176.8	-80.9	64.2	0	0	0	115.3	H53 G501	H53-H499 AromaticContact CD2-CE1 3.97Å; H53-H499 AromaticContact CD2-ND1 3.91Å; H53-H499 AromaticContact CE1-CE1 3.63Å; H53-H499 AromaticContact NE2-CE1 3.37Å; H53-H499 PolarHBondContact NE2-CE1 3.12Å; H53-H499 AromaticContact NE2-ND1 3.79Å; H499-G501 PolarHBondContact O-N 3.39Å; H499-G501 VanDerWaalsContact O-N 3.12Å
500	S	47.3	Very low	64.7	Low	96 Å²	96	109.9 Å²	109.9	67%	0.671	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	82.4	176.5	58.8	0	0	0	0	111.2	G498	G498-S500 PolarHBondContact O-N 2.79Å
501	G	44.2	Very low	62.7	Low	69 Å²	69	111.4 Å²	111.4	71%	0.711	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.8	20.8	161.1	0	0	0	0	0	120.2	H499	H499-G501 PolarHBondContact O-N 3.39Å; H499-G501 VanDerWaalsContact O-N 3.12Å
502	R	38.3	Very low	60.8	Low	235 Å²	235	112.1 Å²	112.1	89%	0.887	60%	0.601	S	S	*	*			trans	-143.9	54.4	166.8	-76.6	-166.5	-175.8	176.4	2.3	113.9
503	I	42.9	Very low	58.9	Low	144 Å²	144	106.8 Å²	106.8	74%	0.738	58%	0.582	S	S	*	*	S	Bend	trans	-128.2	65	157.3	-48.4	176.7	0	0	0	107.7
504	H	45.5	Very low	57.2	Low	178 Å²	178	110.5 Å²	110.5	82%	0.824	60%	0.599	S	S	*	*	S	Bend	trans	-154.8	30.8	170.5	-115.8	67.3	0	0	0	115.7
505	S	45.9	Very low	55.4	Low	85 Å²	85	107.6 Å²	107.6	59%	0.594	59%	0.589	S	S	*	*	S	Bend	trans	-147.5	-32.9	168.9	-52.7	0	0	0	0	115.3	L509	S505-L509 WeakPolarHBondContact O-CB 3.24Å; S505-L509 WeakPolarHBondContact O-CD1 3.49Å; S505-L509 PolarHBondContact O-N 2.77Å
506	S	50.1	Low	53.6	Low	81 Å²	81	112.6 Å²	112.6	57%	0.566	62%	0.615	S	S	*	*	H	α-helix	trans	-77.6	-41.3	-173.3	48.8	0	0	0	0	114	V510	S506-V510 VanDerWaalsContact O-CG2 3.29Å; S506-V510 WeakPolarHBondContact O-CG2 3.12Å; S506-V510 PolarHBondContact O-N 2.78Å; S506-V510 VanDerWaalsContact O-N 3.14Å
507	L	48.8	Very low	52.2	Low	124 Å²	124	112.5 Å²	112.5	65%	0.649	62%	0.619	S	S	*	*	H	α-helix	trans	-72.6	-34.7	-178	-115.9	88.6	0	0	0	113.3	V510 L511	L507-V510 PolarHBondContact O-N 2.77Å; L507-L511 WeakPolarHBondContact O-CB 3.35Å; L507-L511 PolarHBondContact O-N 2.92Å
508	L	49.8	Very low	51	Low	126 Å²	126	111.8 Å²	111.8	66%	0.66	62%	0.619	S	S	*	*	H	α-helix	trans	-70.2	-34.6	177.7	-130.2	94.6	0	0	0	111.8	M512	L508-M512 WeakPolarHBondContact O-CB 3.47Å; L508-M512 WeakPolarHBondContact O-CG 3.25Å; L508-M512 PolarHBondContact O-N 2.91Å
509	L	52.7	Low	50.6	Low	128 Å²	128	116 Å²	116	67%	0.67	64%	0.644	S	S	*	*	H	α-helix	trans	-69.8	-35.9	174.4	-84.8	161.8	0	0	0	112.2	S505 G513	S505-L509 WeakPolarHBondContact O-CB 3.24Å; S505-L509 WeakPolarHBondContact O-CD1 3.49Å; S505-L509 PolarHBondContact O-N 2.77Å; L509-G513 PolarHBondContact O-N 2.89Å
510	V	55.5	Low	50.3	Low	95 Å²	95	115.2 Å²	115.2	58%	0.576	65%	0.652	S	S	*	*	H	α-helix	trans	-70.8	-38.8	174.4	174.8	0	0	0	0	111.2	S506 L507 G513 L514	S506-V510 VanDerWaalsContact O-CG2 3.29Å; S506-V510 WeakPolarHBondContact O-CG2 3.12Å; S506-V510 PolarHBondContact O-N 2.78Å; S506-V510 VanDerWaalsContact O-N 3.14Å; L507-V510 PolarHBondContact O-N 2.77Å; V510-G513 PolarHBondContact O-N 2.99Å; V510-L514 HydrophobicContact CG1-CD1 4.25Å; V510-L514 PolarHBondContact O-N 3.06Å
511	L	54.8	Low	50.1	Low	101 Å²	101	118.7 Å²	118.7	53%	0.529	69%	0.686	S	S	.	*	H	α-helix	trans	-70.9	-37.4	175.7	-95.3	138.8	0	0	0	113.4	L507 L514 L515	L507-L511 WeakPolarHBondContact O-CB 3.35Å; L507-L511 PolarHBondContact O-N 2.92Å; L511-L514 PolarHBondContact O-N 3Å; L511-L515 PolarHBondContact O-N 3.32Å
512	M	56.5	Low	50.4	Low	122 Å²	122	121.2 Å²	121.2	60%	0.601	69%	0.685	S	S	*	*	H	α-helix	trans	-70.3	-31.8	173.4	-76.4	-167.5	93.3	0	0	112.7	L508 L516	L508-M512 WeakPolarHBondContact O-CB 3.47Å; L508-M512 WeakPolarHBondContact O-CG 3.25Å; L508-M512 PolarHBondContact O-N 2.91Å; M512-L516 PolarHBondContact O-N 3.39Å
513	G	54.9	Low	51	Low	40 Å²	40	115.2 Å²	115.2	41%	0.412	67%	0.674	S	S	.	*	H	α-helix	trans	-64.7	-38.3	173.6	0	0	0	0	0	113.3	L509 V510	L509-G513 PolarHBondContact O-N 2.89Å; V510-G513 PolarHBondContact O-N 2.99Å
514	L	54.6	Low	51.5	Low	104 Å²	104	113.6 Å²	113.6	55%	0.545	67%	0.671	S	S	.	*	H	α-helix	trans	-74.1	-30.7	177.9	-86.9	153	0	0	0	113.4	V510 L511 T517	V510-L514 HydrophobicContact CG1-CD1 4.25Å; V510-L514 PolarHBondContact O-N 3.06Å; L511-L514 PolarHBondContact O-N 3Å; L514-T517 PolarHBondContact O-OG1 3.23Å
515	L	52.8	Low	51.8	Low	111 Å²	111	109.8 Å²	109.8	58%	0.581	66%	0.662	S	S	*	*	H	α-helix	trans	-72.5	-31.1	175.6	-89.8	152	0	0	0	112.9	L511 L518	L511-L515 PolarHBondContact O-N 3.32Å; L515-L518 PolarHBondContact O-N 3.45Å
516	L	52.8	Low	52.2	Low	132 Å²	132	111.3 Å²	111.3	69%	0.691	67%	0.666	S	S	*	*	H	α-helix	trans	-74.1	-24.4	176.9	-75.2	164.3	0	0	0	113.2	M512	M512-L516 PolarHBondContact O-N 3.39Å
517	T	54.4	Low	52.3	Low	95 Å²	95	113.3 Å²	113.3	58%	0.583	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-14.4	175.1	47.8	0	0	0	0	114.2	L514	L514-T517 PolarHBondContact O-OG1 3.23Å
518	L	52.6	Low	52.6	Low	138 Å²	138	112.6 Å²	112.6	72%	0.723	67%	0.674	S	S	*	*	S	Bend	trans	-96.5	-5.5	-179.4	-75.8	162.6	0	0	0	113.9	L515	L515-L518 PolarHBondContact O-N 3.45Å
519	C	51.3	Low	52.8	Low	111 Å²	111	111.5 Å²	111.5	75%	0.75	68%	0.676	S	S	*	*	S	Bend	trans	-104.5	15.1	173.4	-74.4	0	0	0	0	113.4
520	S	50.4	Low	52.8	Low	105 Å²	105	110.2 Å²	110.2	73%	0.734	68%	0.676	S	S	*	*			trans	-136.1	63.6	174.3	-63.4	0	0	0	0	110.2
521	A	43.1	Very low	52.6	Low	168 Å²	168	111.5 Å²	111.5	100%	1.388	69%	0.685	S	S	*	*			trans	-150.9	0	163.2	0	0	0	0	0	109.2

Retrieved 521 of 521 residues in 202.1 ms (Link to these results)

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