G4LUU2_SCHMA Loading...

60S ribosomal protein L18, putative

AlphaFold DB , UniProt , Accession G4LUU2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 188 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	67.1	Low	89.1	Confident	243 Å²	243	146.6 Å²	146.6	100%	1.197	73%	0.732	S	S	*	*				0	118.3	0	-93.2	175.1	164.7	0	0	108.9
2	G	83.7	Confident	89.6	Confident	82 Å²	82	145.8 Å²	145.8	85%	0.845	72%	0.721	S	S	*	*			trans	-77.4	133.8	166.1	0	0	0	0	0	109.3
3	I	86	Confident	90	Very high	138 Å²	138	145.2 Å²	145.2	71%	0.708	73%	0.73	S	S	*	*			trans	-89.1	117.1	176.2	-57.1	176.4	0	0	0	107.7	I5	I3-I5 VanDerWaalsContact C-N 3.34Å; I3-I5 HydrophobicContact CB-CG1 4.49Å; I3-I5 HydrophobicContact CG2-CB 4.41Å; I3-I5 HydrophobicContact CG2-CG1 4Å; I3-I5 HydrophobicContact CG2-CG2 3.74Å; I3-I5 PolarHBondContact O-N 3.06Å
4	D	90	Very high	90.3	Very high	168 Å²	168	145.4 Å²	145.4	90%	0.898	72%	0.724	S	S	*	*			trans	-76.4	85.1	174.9	-175	18.2	0	0	0	110.4
5	I	92	Very high	90.6	Very high	97 Å²	97	143.6 Å²	143.6	50%	0.497	71%	0.705	S	S	.	*			trans	-122.5	141	174.4	47	159.9	0	0	0	111.3	I3 H7	I3-I5 VanDerWaalsContact C-N 3.34Å; I3-I5 HydrophobicContact CB-CG1 4.49Å; I3-I5 HydrophobicContact CG2-CB 4.41Å; I3-I5 HydrophobicContact CG2-CG1 4Å; I3-I5 HydrophobicContact CG2-CG2 3.74Å; I3-I5 PolarHBondContact O-N 3.06Å; I5-H7 WeakPolarHBondContact CD1-NE2 3.37Å; I5-H7 VanDerWaalsContact CG1-CE1 3.5Å; I5-H7 WeakPolarHBondContact CG1-CE1 3.49Å; I5-H7 PolarHBondContact O-CE1 2.8Å; I5-H7 PolarHBondContact O-N 3.39Å; I5-H7 PolarHBondContact O-ND1 3.48Å
6	C	91.9	Very high	90.9	Very high	98 Å²	98	144.6 Å²	144.6	66%	0.662	70%	0.704	S	S	*	*			trans	-81.7	104.3	179.8	-170.9	0	0	0	0	111.7	R8	C6-R8 VanDerWaalsContact C-N 3.27Å; C6-R8 PolarHBondContact O-N 3.17Å
7	H	93.1	Very high	91.2	Very high	121 Å²	121	141.1 Å²	141.1	56%	0.56	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-80.9	2.6	-179	-62	90.2	0	0	0	115	I5 Y9 D10	I5-H7 WeakPolarHBondContact CD1-NE2 3.37Å; I5-H7 VanDerWaalsContact CG1-CE1 3.5Å; I5-H7 WeakPolarHBondContact CG1-CE1 3.49Å; I5-H7 PolarHBondContact O-CE1 2.8Å; I5-H7 PolarHBondContact O-N 3.39Å; I5-H7 PolarHBondContact O-ND1 3.48Å; H7-Y9 PolarHBondContact O-N 2.89Å; H7-Y9 VanDerWaalsContact O-N 3.1Å; H7-D10 VanDerWaalsContact CA-OD2 3.3Å; H7-D10 WeakPolarHBondContact CA-OD2 3.43Å; H7-D10 IonicContact CD2-OD2 3.28Å; H7-D10 PolarHBondContact CD2-OD2 2.99Å; H7-D10 VanDerWaalsContact CD2-OD2 3.28Å; H7-D10 IonicContact CG-OD2 3.73Å; H7-D10 PolarHBondContact O-N 3.3Å
8	R	93.9	Very high	91.5	Very high	190 Å²	190	134.1 Å²	134.1	72%	0.717	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-58.6	-32.6	-167.2	-171.4	-179.4	-68	177.2	1.9	113.6	C6	C6-R8 VanDerWaalsContact C-N 3.27Å; C6-R8 PolarHBondContact O-N 3.17Å
9	Y	93.1	Very high	91.8	Very high	164 Å²	164	136.2 Å²	136.2	64%	0.643	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-122.6	18.6	-172.2	-57.5	-62.5	0	0	0	114.4	H7 R11 K12	H7-Y9 PolarHBondContact O-N 2.89Å; H7-Y9 VanDerWaalsContact O-N 3.1Å; Y9-R11 VanDerWaalsContact C-N 3.32Å; Y9-R11 PolarHBondContact O-N 3.44Å; Y9-K12 WeakPolarHBondContact O-CE 3.23Å; Y9-K12 PolarHBondContact O-NZ 3.36Å
10	D	94.2	Very high	92	Very high	96 Å²	96	132.3 Å²	132.3	51%	0.513	65%	0.649	S	S	.	*			trans	-64.6	-41.6	-179.9	-67.5	-13	0	0	0	111	H7 K12	H7-D10 VanDerWaalsContact CA-OD2 3.3Å; H7-D10 WeakPolarHBondContact CA-OD2 3.43Å; H7-D10 IonicContact CD2-OD2 3.28Å; H7-D10 PolarHBondContact CD2-OD2 2.99Å; H7-D10 VanDerWaalsContact CD2-OD2 3.28Å; H7-D10 IonicContact CG-OD2 3.73Å; H7-D10 PolarHBondContact O-N 3.3Å; D10-K12 PolarHBondContact O-N 3.26Å
11	R	95.1	Very high	92.2	Very high	216 Å²	216	131.8 Å²	131.8	82%	0.815	65%	0.65	S	S	*	*	S	Bend	trans	-70.7	98.5	175	-168.7	-175.1	71	168.8	-2.3	111	Y9 V13	Y9-R11 VanDerWaalsContact C-N 3.32Å; Y9-R11 PolarHBondContact O-N 3.44Å; R11-V13 PolarHBondContact O-N 3.4Å
12	K	95.4	Very high	93.6	Very high	137 Å²	137	123.8 Å²	123.8	60%	0.596	61%	0.611	S	S	*	*			trans	-73.3	118.9	175	-53.3	-52.5	178.8	-165.1	0	111.8	Y9 D10 K14	Y9-K12 WeakPolarHBondContact O-CE 3.23Å; Y9-K12 PolarHBondContact O-NZ 3.36Å; D10-K12 PolarHBondContact O-N 3.26Å; K12-K14 PolarHBondContact O-N 2.86Å
13	V	94.6	Very high	94.3	Very high	138 Å²	138	124.5 Å²	124.5	84%	0.836	60%	0.599	S	S	*	*			trans	-75.7	92.5	178	-173.9	0	0	0	0	110.4	R11	R11-V13 PolarHBondContact O-N 3.4Å
14	K	94.2	Very high	94.8	Very high	148 Å²	148	126.7 Å²	126.7	64%	0.643	60%	0.6	S	S	*	*			trans	-147.4	148	175.1	63.7	-171	175.7	-170.3	0	111.2	K12	K12-K14 PolarHBondContact O-N 2.86Å
15	R	94.9	Very high	95.2	Very high	118 Å²	118	119.6 Å²	119.6	45%	0.445	56%	0.562	S	S	.	*			trans	-78	124.1	172.6	-68.5	-171.1	176.2	-165.7	-6.6	110.2	F52	R15-F52 HydrophobicContact CB-CB 4.06Å; R15-F52 WeakPolarHBondContact CD-O 3.43Å; R15-F52 PolarHBondContact NH1-O 2.91Å; R15-F52 WeakPolarHBondContact O-CD2 3.43Å
16	K	95.3	Very high	95.4	Very high	159 Å²	159	120.6 Å²	120.6	69%	0.691	56%	0.559	S	S	*	*	S	Bend	trans	-94.3	-17.3	171.5	-62.5	-178.2	-178.2	178.1	0	112.8	F52	K16-F52 WeakPolarHBondContact O-CE2 3.21Å; K16-F52 VanDerWaalsContact O-CZ 3.22Å; K16-F52 WeakPolarHBondContact O-CZ 3.43Å
17	N	95.7	Very high	95.7	Very high	86 Å²	86	120.9 Å²	120.9	46%	0.46	55%	0.553	S	S	.	*	S	Bend	trans	-144.3	158.6	-179.4	-77.5	-34.2	0	0	0	110.2	K33	N17-K33 WeakPolarHBondContact OD1-CE 3.42Å; N17-K33 PolarHBondContact OD1-NZ 2.82Å
18	P	97.1	Very high	95.9	Very high	14 Å²	14	116.6 Å²	116.6	9%	0.091	54%	0.535	C	S	.	.			trans	-64.5	145.6	166.1	32.1	-35.1	0	0	0	109.7	S20 L25 R26 V29	P18-S20 VanDerWaalsContact C-N 3.27Å; P18-L25 HydrophobicContact CB-CD2 4.07Å; P18-R26 HydrophobicContact CG-CG 4.48Å; P18-V29 HydrophobicContact CG-CG2 4.1Å
19	K	96.7	Very high	96.1	Very high	174 Å²	174	107.9 Å²	107.9	76%	0.757	50%	0.502	S	S	*	.	S	Bend	trans	-77.9	-15.5	171.2	-171.5	174.6	179.2	-177.7	0	112.2
20	S	95.9	Very high	96.3	Very high	58 Å²	58	107.6 Å²	107.6	41%	0.406	51%	0.505	S	S	.	.			trans	-76.1	143.8	-175.3	-158.8	0	0	0	0	111.6	P18 R26	P18-S20 VanDerWaalsContact C-N 3.27Å; S20-R26 PolarHBondContact O-NE 3.41Å; S20-R26 PolarHBondContact O-NH2 2.97Å
21	D	96.4	Very high	96.4	Very high	123 Å²	123	105.1 Å²	105.1	66%	0.658	50%	0.498	S	S	*	.			trans	-91	-3.6	175.7	-59.3	-43.3	0	0	0	113.9	V23 R26	D21-V23 PolarHBondContact O-N 2.81Å; D21-V23 VanDerWaalsContact O-N 3.1Å; D21-R26 IonicContact OD1-CZ 3.65Å; D21-R26 IonicContact OD1-NH2 2.67Å; D21-R26 PolarHBondContact OD1-NH2 3.11Å
22	D	96.9	Very high	96.5	Very high	74 Å²	74	94.9 Å²	94.9	40%	0.396	46%	0.459	S	S	.	.			trans	-49.4	114.8	170.8	175.5	9.8	0	0	0	112.2	Y24 L25 R26	D22-Y24 PolarHBondContact O-N 2.72Å; D22-Y24 WeakPolarHBondContact OD1-CD2 3.33Å; D22-Y24 PolarHBondContact OD1-N 3.45Å; D22-L25 HydrophobicContact CB-CB 4.15Å; D22-L25 PolarHBondContact O-N 2.76Å; D22-R26 WeakPolarHBondContact O-CG 3.41Å; D22-R26 PolarHBondContact O-N 3.4Å; D22-R26 VanDerWaalsContact O-N 3.1Å
23	V	97.9	Very high	96.6	Very high	97 Å²	97	92.2 Å²	92.2	59%	0.588	45%	0.447	S	S	*	.	H	α-helix	trans	-63.4	-40	-176.6	-175.7	0	0	0	0	111.1	D21 L25 R26 L27	D21-V23 PolarHBondContact O-N 2.81Å; D21-V23 VanDerWaalsContact O-N 3.1Å; V23-L25 PolarHBondContact O-N 3.26Å; V23-R26 WeakPolarHBondContact O-CB 3.35Å; V23-R26 PolarHBondContact O-N 3.43Å; V23-R26 VanDerWaalsContact O-N 3.15Å; V23-L27 HydrophobicContact CG1-CD1 4.28Å; V23-L27 HydrophobicContact CG1-CG 4.48Å; V23-L27 WeakPolarHBondContact O-CG 3.35Å; V23-L27 PolarHBondContact O-N 3.47Å
24	Y	97.6	Very high	96.7	Very high	185 Å²	185	90.7 Å²	90.7	73%	0.725	43%	0.43	S	S	*	.	H	α-helix	trans	-64.6	-42.4	-179.6	-61.4	-76.3	0	0	0	111.4	D22 R26 L27 L28	D22-Y24 PolarHBondContact O-N 2.72Å; D22-Y24 WeakPolarHBondContact OD1-CD2 3.33Å; D22-Y24 PolarHBondContact OD1-N 3.45Å; Y24-R26 VanDerWaalsContact C-N 3.31Å; Y24-R26 PolarHBondContact O-N 3Å; Y24-L27 PolarHBondContact O-N 2.87Å; Y24-L28 PolarHBondContact O-N 2.91Å; Y24-L28 VanDerWaalsContact O-N 3.08Å
25	L	97.3	Very high	96.9	Very high	18 Å²	18	84.9 Å²	84.9	9%	0.094	41%	0.405	C	S	.	.	H	α-helix	trans	-63.8	-38.9	174.9	-178.2	62.7	0	0	0	111.6	P18 D22 V23 L28 V29 L51	P18-L25 HydrophobicContact CB-CD2 4.07Å; D22-L25 HydrophobicContact CB-CB 4.15Å; D22-L25 PolarHBondContact O-N 2.76Å; V23-L25 PolarHBondContact O-N 3.26Å; L25-L28 PolarHBondContact O-N 3.2Å; L25-V29 WeakPolarHBondContact O-CB 3.28Å; L25-V29 WeakPolarHBondContact O-CG2 3.25Å; L25-V29 PolarHBondContact O-N 3.44Å; L25-L51 HydrophobicContact CD1-CB 4.35Å; L25-L51 HydrophobicContact CD1-CD2 3.85Å
26	R	97.2	Very high	96.9	Very high	119 Å²	119	80.1 Å²	80.1	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-66.6	-39	178.2	-74.3	174	173.1	-117.3	9.3	111.9	P18 S20 D21 D22 V23 Y24 V29 K30	P18-R26 HydrophobicContact CG-CG 4.48Å; S20-R26 PolarHBondContact O-NE 3.41Å; S20-R26 PolarHBondContact O-NH2 2.97Å; D21-R26 IonicContact OD1-CZ 3.65Å; D21-R26 IonicContact OD1-NH2 2.67Å; D21-R26 PolarHBondContact OD1-NH2 3.11Å; D22-R26 WeakPolarHBondContact O-CG 3.41Å; D22-R26 PolarHBondContact O-N 3.4Å; D22-R26 VanDerWaalsContact O-N 3.1Å; V23-R26 WeakPolarHBondContact O-CB 3.35Å; V23-R26 PolarHBondContact O-N 3.43Å; V23-R26 VanDerWaalsContact O-N 3.15Å; Y24-R26 VanDerWaalsContact C-N 3.31Å; Y24-R26 PolarHBondContact O-N 3Å; R26-V29 WeakPolarHBondContact O-CB 3.33Å; R26-V29 PolarHBondContact O-N 3Å; R26-K30 PolarHBondContact O-N 3.11Å
27	L	97.8	Very high	97	Very high	103 Å²	103	81.9 Å²	81.9	54%	0.539	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-48.9	173.8	-73.4	171.2	0	0	0	111.7	V23 Y24 V29 K30 A31	V23-L27 HydrophobicContact CG1-CD1 4.28Å; V23-L27 HydrophobicContact CG1-CG 4.48Å; V23-L27 WeakPolarHBondContact O-CG 3.35Å; V23-L27 PolarHBondContact O-N 3.47Å; Y24-L27 PolarHBondContact O-N 2.87Å; L27-V29 VanDerWaalsContact C-N 3.27Å; L27-V29 PolarHBondContact O-N 3.47Å; L27-K30 WeakPolarHBondContact O-CB 3.14Å; L27-K30 PolarHBondContact O-N 3.39Å; L27-A31 PolarHBondContact O-N 3.38Å
28	L	97.1	Very high	97.1	Very high	31 Å²	31	86.1 Å²	86.1	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-40	174.7	-74.3	175	0	0	0	112	Y24 L25 A31 Y32 L51 L103 F123 D124	Y24-L28 PolarHBondContact O-N 2.91Å; Y24-L28 VanDerWaalsContact O-N 3.08Å; L25-L28 PolarHBondContact O-N 3.2Å; L28-A31 PolarHBondContact O-N 3.38Å; L28-Y32 WeakPolarHBondContact O-CD2 3.27Å; L28-Y32 PolarHBondContact O-N 3.25Å; L28-L51 HydrophobicContact CB-CD1 4.4Å; L28-L103 HydrophobicContact CD1-CD2 4Å; L28-F123 HydrophobicContact CD1-CB 4.21Å; L28-F123 HydrophobicContact CD2-CB 3.79Å; L28-D124 HydrophobicContact CD2-CB 4.21Å
29	V	97.4	Very high	97	Very high	7 Å²	7	87.9 Å²	87.9	4%	0.042	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-42.3	174.4	155.6	0	0	0	0	111.8	P18 L25 R26 L27 Y32 K33 L51 F52	P18-V29 HydrophobicContact CG-CG2 4.1Å; L25-V29 WeakPolarHBondContact O-CB 3.28Å; L25-V29 WeakPolarHBondContact O-CG2 3.25Å; L25-V29 PolarHBondContact O-N 3.44Å; R26-V29 WeakPolarHBondContact O-CB 3.33Å; R26-V29 PolarHBondContact O-N 3Å; L27-V29 VanDerWaalsContact C-N 3.27Å; L27-V29 PolarHBondContact O-N 3.47Å; V29-Y32 PolarHBondContact O-N 2.95Å; V29-K33 HydrophobicContact CG1-CD 4.07Å; V29-K33 HydrophobicContact CG1-CG 4.34Å; V29-K33 VanDerWaalsContact O-CB 3.31Å; V29-K33 WeakPolarHBondContact O-CB 3.38Å; V29-K33 VanDerWaalsContact O-CG 3.29Å; V29-K33 WeakPolarHBondContact O-CG 2.99Å; V29-K33 PolarHBondContact O-N 3.1Å; V29-L51 HydrophobicContact CG2-CB 3.7Å; V29-L51 HydrophobicContact CG2-CD1 4.08Å; V29-L51 HydrophobicContact CG2-CG 4.5Å; V29-F52 HydrophobicContact CB-CE1 4.31Å; V29-F52 HydrophobicContact CG1-CD1 4.49Å; V29-F52 HydrophobicContact CG1-CE1 3.58Å; V29-F52 HydrophobicContact CG1-CZ 4.38Å; V29-F52 HydrophobicContact CG2-CD1 4.02Å; V29-F52 HydrophobicContact CG2-CE1 3.8Å
30	K	97.6	Very high	96.7	Very high	159 Å²	159	82.8 Å²	82.8	69%	0.691	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-46	177.4	-169.2	178.2	179.8	-177.8	0	110.5	R26 L27 K33 F34	R26-K30 PolarHBondContact O-N 3.11Å; L27-K30 WeakPolarHBondContact O-CB 3.14Å; L27-K30 PolarHBondContact O-N 3.39Å; K30-K33 PolarHBondContact O-N 3.1Å; K30-F34 PolarHBondContact O-N 3.08Å; K30-F34 VanDerWaalsContact O-N 3.11Å
31	A	97	Very high	96.7	Very high	44 Å²	44	81.2 Å²	81.2	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-51.6	176.2	0	0	0	0	0	112.2	L27 L28 K33 F34 L35	L27-A31 PolarHBondContact O-N 3.38Å; L28-A31 PolarHBondContact O-N 3.38Å; A31-K33 VanDerWaalsContact C-N 3.33Å; A31-K33 PolarHBondContact O-N 2.9Å; A31-F34 WeakPolarHBondContact O-CB 3.46Å; A31-F34 PolarHBondContact O-N 3.45Å; A31-F34 VanDerWaalsContact O-N 3.17Å; A31-L35 WeakPolarHBondContact O-CG 3.41Å; A31-L35 PolarHBondContact O-N 3.15Å
32	Y	97.5	Very high	96.7	Very high	1 Å²	1	82.9 Å²	82.9	0%	0.004	40%	0.401	C	S	.	.	H	α-helix	trans	-71.2	-24.5	-179.3	-86.4	-79.4	0	0	0	114.1	L28 V29 L35 A36 N44 I47 L51 F123	L28-Y32 WeakPolarHBondContact O-CD2 3.27Å; L28-Y32 PolarHBondContact O-N 3.25Å; V29-Y32 PolarHBondContact O-N 2.95Å; Y32-L35 HydrophobicContact CD1-CD1 4.28Å; Y32-L35 HydrophobicContact CE1-CD1 4.3Å; Y32-A36 WeakPolarHBondContact O-CB 3.28Å; Y32-A36 PolarHBondContact O-N 3.49Å; Y32-N44 HydrophobicContact CD1-CB 4.43Å; Y32-I47 HydrophobicContact CD1-CB 3.89Å; Y32-I47 HydrophobicContact CD1-CG2 3.62Å; Y32-I47 HydrophobicContact CD2-CG2 3.93Å; Y32-I47 HydrophobicContact CE1-CB 3.91Å; Y32-I47 HydrophobicContact CE1-CD1 3.7Å; Y32-I47 HydrophobicContact CE1-CG1 4.39Å; Y32-I47 HydrophobicContact CE1-CG2 3.64Å; Y32-I47 HydrophobicContact CE2-CG2 3.93Å; Y32-I47 HydrophobicContact CG-CB 4.46Å; Y32-I47 HydrophobicContact CG-CG2 3.77Å; Y32-L51 HydrophobicContact CD2-CD1 3.93Å; Y32-L51 HydrophobicContact CG-CD1 4.26Å; Y32-F123 HydrophobicContact CE2-CB 4.06Å; Y32-F123 HydrophobicContact CE2-CD1 4Å; Y32-F123 HydrophobicContact CE2-CG 4.47Å; Y32-F123 PolarHBondContact OH-O 3.07Å
33	K	96.9	Very high	96.7	Very high	80 Å²	80	80.3 Å²	80.3	35%	0.348	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-46	168.1	-84.7	179.4	174.7	-173.2	0	111.2	N17 V29 K30 A31 R37 M48	N17-K33 WeakPolarHBondContact OD1-CE 3.42Å; N17-K33 PolarHBondContact OD1-NZ 2.82Å; V29-K33 HydrophobicContact CG1-CD 4.07Å; V29-K33 HydrophobicContact CG1-CG 4.34Å; V29-K33 VanDerWaalsContact O-CB 3.31Å; V29-K33 WeakPolarHBondContact O-CB 3.38Å; V29-K33 VanDerWaalsContact O-CG 3.29Å; V29-K33 WeakPolarHBondContact O-CG 2.99Å; V29-K33 PolarHBondContact O-N 3.1Å; K30-K33 PolarHBondContact O-N 3.1Å; A31-K33 VanDerWaalsContact C-N 3.33Å; A31-K33 PolarHBondContact O-N 2.9Å; K33-R37 WeakPolarHBondContact O-CB 3.34Å; K33-R37 PolarHBondContact O-N 3.45Å; K33-M48 HydrophobicContact CB-SD 4.34Å; K33-M48 HydrophobicContact CG-CG 4.12Å; K33-M48 HydrophobicContact CG-SD 3.65Å
34	F	97.3	Very high	96.6	Very high	107 Å²	107	75.8 Å²	75.8	47%	0.469	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-51.4	176.6	177.2	-96.1	0	0	0	110.8	K30 A31 A36 R37 R38	K30-F34 PolarHBondContact O-N 3.08Å; K30-F34 VanDerWaalsContact O-N 3.11Å; A31-F34 WeakPolarHBondContact O-CB 3.46Å; A31-F34 PolarHBondContact O-N 3.45Å; A31-F34 VanDerWaalsContact O-N 3.17Å; F34-A36 PolarHBondContact O-N 3.06Å; F34-R37 PolarHBondContact O-N 3.39Å; F34-R38 HydrophobicContact CD1-CG 4.5Å; F34-R38 HydrophobicContact CD2-CG 4.07Å; F34-R38 HydrophobicContact CE1-CG 4.17Å; F34-R38 HydrophobicContact CE2-CG 3.71Å; F34-R38 HydrophobicContact CG-CG 4.45Å; F34-R38 HydrophobicContact CZ-CG 3.77Å; F34-R38 WeakPolarHBondContact O-CB 3.47Å; F34-R38 PolarHBondContact O-N 3.03Å
35	L	97.2	Very high	96.6	Very high	25 Å²	25	72.4 Å²	72.4	13%	0.131	35%	0.348	C	S	.	.	H	α-helix	trans	-59.7	-46.3	178.7	-68.5	172.6	0	0	0	112	A31 Y32 R37 R38 T39 N44 A127	A31-L35 WeakPolarHBondContact O-CG 3.41Å; A31-L35 PolarHBondContact O-N 3.15Å; Y32-L35 HydrophobicContact CD1-CD1 4.28Å; Y32-L35 HydrophobicContact CE1-CD1 4.3Å; L35-R37 VanDerWaalsContact C-N 3.27Å; L35-R37 PolarHBondContact O-N 3.33Å; L35-R38 PolarHBondContact O-N 3.31Å; L35-T39 HydrophobicContact CD2-CG2 4.33Å; L35-T39 WeakPolarHBondContact O-CB 3.43Å; L35-T39 WeakPolarHBondContact O-CG2 3.33Å; L35-T39 PolarHBondContact O-N 2.95Å; L35-T39 PolarHBondContact O-OG1 3.45Å; L35-N44 HydrophobicContact CB-CB 4.34Å; L35-A127 HydrophobicContact CD1-CB 3.82Å
36	A	96.3	Very high	96.6	Very high	19 Å²	19	73.4 Å²	73.4	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-33	179.7	0	0	0	0	0	112.8	Y32 F34 N44 M48	Y32-A36 WeakPolarHBondContact O-CB 3.28Å; Y32-A36 PolarHBondContact O-N 3.49Å; F34-A36 PolarHBondContact O-N 3.06Å; A36-N44 HydrophobicContact CB-CB 4.11Å; A36-M48 HydrophobicContact CB-SD 4.16Å
37	R	96.7	Very high	96.6	Very high	196 Å²	196	67.7 Å²	67.7	74%	0.74	33%	0.331	S	S	*	.	H	α-helix	trans	-75.9	-45.5	176.4	-176.9	173.2	64.1	152.5	0.1	112.2	K33 F34 L35	K33-R37 WeakPolarHBondContact O-CB 3.34Å; K33-R37 PolarHBondContact O-N 3.45Å; F34-R37 PolarHBondContact O-N 3.39Å; L35-R37 VanDerWaalsContact C-N 3.27Å; L35-R37 PolarHBondContact O-N 3.33Å
38	R	97.2	Very high	96.6	Very high	175 Å²	175	64.4 Å²	64.4	66%	0.66	31%	0.314	S	S	*	.	H	α-helix	trans	-85.3	-30.8	-171.1	-67	-61.8	-62.6	-95.3	2.3	114.6	F34 L35	F34-R38 HydrophobicContact CD1-CG 4.5Å; F34-R38 HydrophobicContact CD2-CG 4.07Å; F34-R38 HydrophobicContact CE1-CG 4.17Å; F34-R38 HydrophobicContact CE2-CG 3.71Å; F34-R38 HydrophobicContact CG-CG 4.45Å; F34-R38 HydrophobicContact CZ-CG 3.77Å; F34-R38 WeakPolarHBondContact O-CB 3.47Å; F34-R38 PolarHBondContact O-N 3.03Å; L35-R38 PolarHBondContact O-N 3.31Å
39	T	95.4	Very high	96.6	Very high	50 Å²	50	68 Å²	68	31%	0.307	33%	0.325	S	S	.	.	S	Bend	trans	-92.6	-20	-176.3	63.5	0	0	0	0	114	L35 S41 N44 L132	L35-T39 HydrophobicContact CD2-CG2 4.33Å; L35-T39 WeakPolarHBondContact O-CB 3.43Å; L35-T39 WeakPolarHBondContact O-CG2 3.33Å; L35-T39 PolarHBondContact O-N 2.95Å; L35-T39 PolarHBondContact O-OG1 3.45Å; T39-S41 PolarHBondContact O-N 3.17Å; T39-S41 PolarHBondContact OG1-N 3.38Å; T39-N44 PolarHBondContact OG1-ND2 3.2Å; T39-L132 HydrophobicContact CG2-CD2 4.15Å
40	G	90.9	Very high	96.6	Very high	67 Å²	67	69.1 Å²	69.1	69%	0.691	33%	0.328	S	S	*	.			trans	66.5	-2.9	-171.8	0	0	0	0	0	115.4	K42	G40-K42 PolarHBondContact O-N 2.96Å
41	S	94.4	Very high	96.6	Very high	25 Å²	25	61.5 Å²	61.5	18%	0.175	30%	0.296	C	S	.	.			trans	-66.6	128.1	-176.2	176.2	0	0	0	0	112.5	T39 F43 N44 K45 L132	T39-S41 PolarHBondContact O-N 3.17Å; T39-S41 PolarHBondContact OG1-N 3.38Å; S41-F43 PolarHBondContact O-N 3.01Å; S41-F43 WeakPolarHBondContact OG-CB 3.4Å; S41-F43 PolarHBondContact OG-N 2.91Å; S41-N44 PolarHBondContact O-N 2.9Å; S41-K45 PolarHBondContact O-N 3.4Å; S41-L132 PolarHBondContact OG-O 3.04Å
42	K	96.5	Very high	96.6	Very high	158 Å²	158	59.9 Å²	59.9	69%	0.687	28%	0.28	S	S	*	.	H	α-helix	trans	-58.7	-32.3	175.3	-172.8	176.5	-179.4	177	0	111.8	G40 K45 I46	G40-K42 PolarHBondContact O-N 2.96Å; K42-K45 PolarHBondContact O-N 3.4Å; K42-I46 HydrophobicContact CG-CD1 4.02Å; K42-I46 HydrophobicContact CG-CG1 4.45Å; K42-I46 VanDerWaalsContact O-CG1 3.26Å; K42-I46 WeakPolarHBondContact O-CG1 3.4Å; K42-I46 PolarHBondContact O-N 2.98Å
43	F	97.2	Very high	96.6	Very high	21 Å²	21	62.2 Å²	62.2	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-52.4	177.3	173.9	-97.9	0	0	0	111.5	S41 K45 I46 I47 V81 L126 T136 L138	S41-F43 PolarHBondContact O-N 3.01Å; S41-F43 WeakPolarHBondContact OG-CB 3.4Å; S41-F43 PolarHBondContact OG-N 2.91Å; F43-K45 VanDerWaalsContact C-N 3.33Å; F43-K45 PolarHBondContact O-N 3.11Å; F43-I46 WeakPolarHBondContact O-CA 3.34Å; F43-I46 WeakPolarHBondContact O-CB 3.41Å; F43-I46 PolarHBondContact O-N 3.41Å; F43-I47 HydrophobicContact CD1-CD1 3.96Å; F43-I47 HydrophobicContact CE1-CD1 3.27Å; F43-I47 HydrophobicContact CE1-CG1 4.31Å; F43-I47 HydrophobicContact CE2-CD1 3.95Å; F43-I47 HydrophobicContact CZ-CD1 3.27Å; F43-I47 HydrophobicContact CZ-CG1 4.28Å; F43-I47 PolarHBondContact O-N 3.23Å; F43-V81 HydrophobicContact CZ-CG2 4.39Å; F43-L126 HydrophobicContact CZ-CD2 4.24Å; F43-T136 HydrophobicContact CE2-CG2 4.28Å; F43-T136 WeakPolarHBondContact CE2-OG1 3.3Å; F43-T136 HydrophobicContact CZ-CG2 4.02Å; F43-L138 HydrophobicContact CD2-CD1 3.54Å; F43-L138 HydrophobicContact CD2-CD2 4.13Å; F43-L138 HydrophobicContact CD2-CG 3.75Å; F43-L138 HydrophobicContact CE2-CD1 3.89Å; F43-L138 HydrophobicContact CE2-CD2 3.6Å; F43-L138 HydrophobicContact CE2-CG 3.57Å; F43-L138 HydrophobicContact CZ-CD2 4.38Å
44	N	97.1	Very high	96.5	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-41.4	179	-68.6	-27.9	0	0	0	111.6	Y32 L35 A36 T39 S41 I46 I47 M48 P131	Y32-N44 HydrophobicContact CD1-CB 4.43Å; L35-N44 HydrophobicContact CB-CB 4.34Å; A36-N44 HydrophobicContact CB-CB 4.11Å; T39-N44 PolarHBondContact OG1-ND2 3.2Å; S41-N44 PolarHBondContact O-N 2.9Å; N44-I46 VanDerWaalsContact C-N 3.27Å; N44-I46 PolarHBondContact O-N 3.09Å; N44-I47 PolarHBondContact O-N 2.94Å; N44-M48 WeakPolarHBondContact O-CB 3.43Å; N44-M48 PolarHBondContact O-N 2.87Å; N44-P131 PolarHBondContact ND2-O 3.48Å; N44-P131 PolarHBondContact OD1-O 3.28Å
45	K	96.9	Very high	96.4	Very high	114 Å²	114	63.7 Å²	63.7	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-35.4	174.7	-162.4	175.1	-174.4	169.9	0	111.9	S41 K42 F43 R49	S41-K45 PolarHBondContact O-N 3.4Å; K42-K45 PolarHBondContact O-N 3.4Å; F43-K45 VanDerWaalsContact C-N 3.33Å; F43-K45 PolarHBondContact O-N 3.11Å; K45-R49 WeakPolarHBondContact O-CG 3.5Å; K45-R49 PolarHBondContact O-N 3.12Å; K45-R49 PolarHBondContact O-NE 3.13Å; K45-R49 VanDerWaalsContact O-NE 3.1Å
46	I	97.5	Very high	96.4	Very high	39 Å²	39	66.6 Å²	66.6	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-70.8	-47.8	174.5	-67.4	166.1	0	0	0	111.1	K42 F43 N44 R49 R50 L138	K42-I46 HydrophobicContact CG-CD1 4.02Å; K42-I46 HydrophobicContact CG-CG1 4.45Å; K42-I46 VanDerWaalsContact O-CG1 3.26Å; K42-I46 WeakPolarHBondContact O-CG1 3.4Å; K42-I46 PolarHBondContact O-N 2.98Å; F43-I46 WeakPolarHBondContact O-CA 3.34Å; F43-I46 WeakPolarHBondContact O-CB 3.41Å; F43-I46 PolarHBondContact O-N 3.41Å; N44-I46 VanDerWaalsContact C-N 3.27Å; N44-I46 PolarHBondContact O-N 3.09Å; I46-R49 VanDerWaalsContact CG1-NH2 3.33Å; I46-R49 PolarHBondContact O-N 2.91Å; I46-R50 HydrophobicContact CG2-CG 4.21Å; I46-R50 WeakPolarHBondContact O-CB 3.43Å; I46-R50 WeakPolarHBondContact O-CG 3.34Å; I46-R50 PolarHBondContact O-N 2.87Å; I46-L138 HydrophobicContact CB-CD1 4.25Å; I46-L138 HydrophobicContact CD1-CD1 4.35Å; I46-L138 HydrophobicContact CG2-CD1 3.9Å
47	I	97.3	Very high	96.4	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.1	-49.9	178.3	-70.2	-177.8	0	0	0	110.4	Y32 F43 N44 R49 R50 L51 V81 V83 F123 L126 L138	Y32-I47 HydrophobicContact CD1-CB 3.89Å; Y32-I47 HydrophobicContact CD1-CG2 3.62Å; Y32-I47 HydrophobicContact CD2-CG2 3.93Å; Y32-I47 HydrophobicContact CE1-CB 3.91Å; Y32-I47 HydrophobicContact CE1-CD1 3.7Å; Y32-I47 HydrophobicContact CE1-CG1 4.39Å; Y32-I47 HydrophobicContact CE1-CG2 3.64Å; Y32-I47 HydrophobicContact CE2-CG2 3.93Å; Y32-I47 HydrophobicContact CG-CB 4.46Å; Y32-I47 HydrophobicContact CG-CG2 3.77Å; F43-I47 HydrophobicContact CD1-CD1 3.96Å; F43-I47 HydrophobicContact CE1-CD1 3.27Å; F43-I47 HydrophobicContact CE1-CG1 4.31Å; F43-I47 HydrophobicContact CE2-CD1 3.95Å; F43-I47 HydrophobicContact CZ-CD1 3.27Å; F43-I47 HydrophobicContact CZ-CG1 4.28Å; F43-I47 PolarHBondContact O-N 3.23Å; N44-I47 PolarHBondContact O-N 2.94Å; I47-R49 VanDerWaalsContact C-N 3.32Å; I47-R49 PolarHBondContact O-N 3.35Å; I47-R50 CarbonylContact O-C 3.24Å; I47-R50 WeakPolarHBondContact O-CA 3.5Å; I47-R50 WeakPolarHBondContact O-CB 3.13Å; I47-R50 PolarHBondContact O-N 3Å; I47-L51 HydrophobicContact CG2-CD1 3.99Å; I47-L51 HydrophobicContact CG2-CG 4.15Å; I47-L51 WeakPolarHBondContact O-CG 3.24Å; I47-L51 PolarHBondContact O-N 2.84Å; I47-V81 HydrophobicContact CD1-CG1 4.27Å; I47-V83 HydrophobicContact CG1-CG2 4.4Å; I47-V83 HydrophobicContact CG2-CG2 4.35Å; I47-F123 HydrophobicContact CD1-CD1 4.32Å; I47-F123 HydrophobicContact CD1-CE1 3.91Å; I47-F123 HydrophobicContact CG1-CE1 4.47Å; I47-F123 HydrophobicContact CG2-CD1 4.2Å; I47-F123 HydrophobicContact CG2-CE1 4.1Å; I47-L126 HydrophobicContact CD1-CD2 4.46Å; I47-L138 HydrophobicContact CD1-CD2 4.39Å; I47-L138 HydrophobicContact CG1-CD2 4.07Å
48	M	96.7	Very high	96.3	Very high	34 Å²	34	61.6 Å²	61.6	17%	0.167	30%	0.3	C	S	.	.	H	α-helix	trans	-51.7	-50.7	176.9	-177.1	-167.3	70.9	0	0	111.4	K33 A36 N44 R50 L51 F52	K33-M48 HydrophobicContact CB-SD 4.34Å; K33-M48 HydrophobicContact CG-CG 4.12Å; K33-M48 HydrophobicContact CG-SD 3.65Å; A36-M48 HydrophobicContact CB-SD 4.16Å; N44-M48 WeakPolarHBondContact O-CB 3.43Å; N44-M48 PolarHBondContact O-N 2.87Å; M48-R50 VanDerWaalsContact C-N 3.31Å; M48-R50 PolarHBondContact O-N 2.87Å; M48-L51 PolarHBondContact O-N 2.78Å; M48-F52 HydrophobicContact CE-CE2 4.18Å; M48-F52 HydrophobicContact CE-CZ 4.48Å; M48-F52 HydrophobicContact CG-CE1 4.08Å; M48-F52 HydrophobicContact CG-CE2 3.92Å; M48-F52 HydrophobicContact CG-CZ 3.46Å; M48-F52 VanDerWaalsContact CG-CZ 3.46Å; M48-F52 WeakPolarHBondContact O-CD1 3.49Å; M48-F52 WeakPolarHBondContact O-CG 3.46Å; M48-F52 PolarHBondContact O-N 2.86Å; M48-F52 HydrophobicContact SD-CE2 4.36Å; M48-F52 HydrophobicContact SD-CZ 4.06Å
49	R	96.8	Very high	96.3	Very high	107 Å²	107	54.6 Å²	54.6	40%	0.404	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-36.7	176.9	-75.5	-178.8	-64.1	-139.6	-0.8	112.9	K45 I46 I47 F52	K45-R49 WeakPolarHBondContact O-CG 3.5Å; K45-R49 PolarHBondContact O-N 3.12Å; K45-R49 PolarHBondContact O-NE 3.13Å; K45-R49 VanDerWaalsContact O-NE 3.1Å; I46-R49 VanDerWaalsContact CG1-NH2 3.33Å; I46-R49 PolarHBondContact O-N 2.91Å; I47-R49 VanDerWaalsContact C-N 3.32Å; I47-R49 PolarHBondContact O-N 3.35Å; R49-F52 PolarHBondContact O-N 3.31Å
50	R	97.5	Very high	96.4	Very high	29 Å²	29	54.5 Å²	54.5	11%	0.109	28%	0.281	C	S	.	.	H	α-helix	trans	-69.5	-36.5	177.4	-73.8	179.1	-178.3	-170.8	4.3	111.4	I46 I47 M48 F52 M53 K58 V83 I139 Q140	I46-R50 HydrophobicContact CG2-CG 4.21Å; I46-R50 WeakPolarHBondContact O-CB 3.43Å; I46-R50 WeakPolarHBondContact O-CG 3.34Å; I46-R50 PolarHBondContact O-N 2.87Å; I47-R50 CarbonylContact O-C 3.24Å; I47-R50 WeakPolarHBondContact O-CA 3.5Å; I47-R50 WeakPolarHBondContact O-CB 3.13Å; I47-R50 PolarHBondContact O-N 3Å; M48-R50 VanDerWaalsContact C-N 3.31Å; M48-R50 PolarHBondContact O-N 2.87Å; R50-F52 PolarHBondContact O-N 3.15Å; R50-M53 HydrophobicContact CB-SD 4.36Å; R50-M53 HydrophobicContact CG-CE 3.86Å; R50-M53 HydrophobicContact CG-SD 4.09Å; R50-M53 VanDerWaalsContact O-CB 3.27Å; R50-M53 WeakPolarHBondContact O-CB 3.4Å; R50-M53 PolarHBondContact O-N 3.13Å; R50-K58 WeakPolarHBondContact O-CD 3.45Å; R50-V83 HydrophobicContact CB-CB 3.8Å; R50-V83 HydrophobicContact CB-CG1 3.8Å; R50-V83 HydrophobicContact CB-CG2 3.84Å; R50-I139 PolarHBondContact NH1-O 3.1Å; R50-Q140 VanDerWaalsContact CZ-CD 3.42Å; R50-Q140 VanDerWaalsContact NH2-CD 3.26Å
51	L	97.4	Very high	96.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-36.9	174.5	-68.4	171.2	0	0	0	111.4	L25 L28 V29 Y32 I47 M48 M53 K58 V83 L103	L25-L51 HydrophobicContact CD1-CB 4.35Å; L25-L51 HydrophobicContact CD1-CD2 3.85Å; L28-L51 HydrophobicContact CB-CD1 4.4Å; V29-L51 HydrophobicContact CG2-CB 3.7Å; V29-L51 HydrophobicContact CG2-CD1 4.08Å; V29-L51 HydrophobicContact CG2-CG 4.5Å; Y32-L51 HydrophobicContact CD2-CD1 3.93Å; Y32-L51 HydrophobicContact CG-CD1 4.26Å; I47-L51 HydrophobicContact CG2-CD1 3.99Å; I47-L51 HydrophobicContact CG2-CG 4.15Å; I47-L51 WeakPolarHBondContact O-CG 3.24Å; I47-L51 PolarHBondContact O-N 2.84Å; M48-L51 PolarHBondContact O-N 2.78Å; L51-M53 VanDerWaalsContact C-N 3.27Å; L51-M53 PolarHBondContact O-N 3.49Å; L51-K58 PolarHBondContact O-NZ 3.32Å; L51-K58 VanDerWaalsContact O-NZ 3.16Å; L51-V83 HydrophobicContact CD2-CG1 3.84Å; L51-V83 HydrophobicContact CG-CG1 4.31Å; L51-L103 HydrophobicContact CD2-CD1 4.33Å; L51-L103 HydrophobicContact CD2-CD2 3.89Å
52	F	97.5	Very high	96.8	Very high	9 Å²	9	51.6 Å²	51.6	4%	0.039	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.1	176.9	-55.3	-18	0	0	0	114.6	R15 K16 V29 M48 R49 R50	R15-F52 HydrophobicContact CB-CB 4.06Å; R15-F52 WeakPolarHBondContact CD-O 3.43Å; R15-F52 PolarHBondContact NH1-O 2.91Å; R15-F52 WeakPolarHBondContact O-CD2 3.43Å; K16-F52 WeakPolarHBondContact O-CE2 3.21Å; K16-F52 VanDerWaalsContact O-CZ 3.22Å; K16-F52 WeakPolarHBondContact O-CZ 3.43Å; V29-F52 HydrophobicContact CB-CE1 4.31Å; V29-F52 HydrophobicContact CG1-CD1 4.49Å; V29-F52 HydrophobicContact CG1-CE1 3.58Å; V29-F52 HydrophobicContact CG1-CZ 4.38Å; V29-F52 HydrophobicContact CG2-CD1 4.02Å; V29-F52 HydrophobicContact CG2-CE1 3.8Å; M48-F52 HydrophobicContact CE-CE2 4.18Å; M48-F52 HydrophobicContact CE-CZ 4.48Å; M48-F52 HydrophobicContact CG-CE1 4.08Å; M48-F52 HydrophobicContact CG-CE2 3.92Å; M48-F52 HydrophobicContact CG-CZ 3.46Å; M48-F52 VanDerWaalsContact CG-CZ 3.46Å; M48-F52 WeakPolarHBondContact O-CD1 3.49Å; M48-F52 WeakPolarHBondContact O-CG 3.46Å; M48-F52 PolarHBondContact O-N 2.86Å; M48-F52 HydrophobicContact SD-CE2 4.36Å; M48-F52 HydrophobicContact SD-CZ 4.06Å; R49-F52 PolarHBondContact O-N 3.31Å; R50-F52 PolarHBondContact O-N 3.15Å
53	M	97.2	Very high	96.8	Very high	51 Å²	51	44 Å²	44	25%	0.251	22%	0.217	S	C	.	.	S	Bend	trans	-62.4	147.6	-175.5	-69.3	179	-174.9	0	0	111.6	R50 L51 N57 K58 R143	R50-M53 HydrophobicContact CB-SD 4.36Å; R50-M53 HydrophobicContact CG-CE 3.86Å; R50-M53 HydrophobicContact CG-SD 4.09Å; R50-M53 VanDerWaalsContact O-CB 3.27Å; R50-M53 WeakPolarHBondContact O-CB 3.4Å; R50-M53 PolarHBondContact O-N 3.13Å; L51-M53 VanDerWaalsContact C-N 3.27Å; L51-M53 PolarHBondContact O-N 3.49Å; M53-N57 HydrophobicContact CB-CB 4.03Å; M53-N57 HydrophobicContact CG-CB 4.4Å; M53-N57 HydrophobicContact SD-CB 4.43Å; M53-K58 HydrophobicContact CB-CD 4.19Å; M53-K58 HydrophobicContact CB-CG 3.69Å; M53-K58 WeakPolarHBondContact O-CE 3.48Å; M53-K58 PolarHBondContact O-NZ 2.93Å; M53-R143 PolarHBondContact SD-NH2 2.75Å
54	S	96	Very high	96.8	Very high	28 Å²	28	44.2 Å²	44.2	20%	0.196	22%	0.223	C	C	.	.			trans	-68	162.8	171.3	57.3	0	0	0	0	111.3	I56 N57 K58	S54-I56 VanDerWaalsContact C-N 3.26Å; S54-I56 PolarHBondContact O-N 2.59Å; S54-N57 CarbonylContact O-C 3.59Å; S54-N57 PolarHBondContact O-N 3.38Å; S54-N57 PolarHBondContact OG-ND2 2.88Å; S54-N57 VanDerWaalsContact OG-ND2 3.16Å; S54-K58 PolarHBondContact O-N 2.85Å
55	K	95.7	Very high	96.7	Very high	189 Å²	189	49.4 Å²	49.4	82%	0.822	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-52.1	-43.5	176.3	-172.7	175.2	-178.9	178.2	0	112.5	N57 K58	K55-N57 VanDerWaalsContact C-N 3.26Å; K55-N57 PolarHBondContact O-N 3.43Å; K55-K58 CarbonylContact O-C 3.6Å; K55-K58 VanDerWaalsContact O-C 3.24Å; K55-K58 PolarHBondContact O-N 3.01Å; K55-K58 VanDerWaalsContact O-N 3.11Å
56	I	96.1	Very high	96.7	Very high	86 Å²	86	44 Å²	44	44%	0.441	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-58	-38.8	177.4	-67.4	168.5	0	0	0	112.1	S54 K58	S54-I56 VanDerWaalsContact C-N 3.26Å; S54-I56 PolarHBondContact O-N 2.59Å; I56-K58 VanDerWaalsContact C-N 3.35Å
57	N	96.2	Very high	96.6	Very high	72 Å²	72	44.2 Å²	44.2	39%	0.385	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-87.2	-7	-177.8	-71.3	-37.4	0	0	0	113.5	M53 S54 K55 P59 R143	M53-N57 HydrophobicContact CB-CB 4.03Å; M53-N57 HydrophobicContact CG-CB 4.4Å; M53-N57 HydrophobicContact SD-CB 4.43Å; S54-N57 CarbonylContact O-C 3.59Å; S54-N57 PolarHBondContact O-N 3.38Å; S54-N57 PolarHBondContact OG-ND2 2.88Å; S54-N57 VanDerWaalsContact OG-ND2 3.16Å; K55-N57 VanDerWaalsContact C-N 3.26Å; K55-N57 PolarHBondContact O-N 3.43Å; N57-P59 VanDerWaalsContact O-CD 3.26Å; N57-P59 WeakPolarHBondContact O-CD 3.24Å; N57-R143 PolarHBondContact O-NE 3.39Å
58	K	95.1	Very high	96.5	Very high	39 Å²	39	53.4 Å²	53.4	17%	0.17	25%	0.254	C	S	.	.	S	Bend	trans	-112.6	62.8	169.2	-64.3	-172.2	-71.7	-156.2	0	110.3	R50 L51 M53 S54 K55 I56 V83	R50-K58 WeakPolarHBondContact O-CD 3.45Å; L51-K58 PolarHBondContact O-NZ 3.32Å; L51-K58 VanDerWaalsContact O-NZ 3.16Å; M53-K58 HydrophobicContact CB-CD 4.19Å; M53-K58 HydrophobicContact CB-CG 3.69Å; M53-K58 WeakPolarHBondContact O-CE 3.48Å; M53-K58 PolarHBondContact O-NZ 2.93Å; S54-K58 PolarHBondContact O-N 2.85Å; K55-K58 CarbonylContact O-C 3.6Å; K55-K58 VanDerWaalsContact O-C 3.24Å; K55-K58 PolarHBondContact O-N 3.01Å; K55-K58 VanDerWaalsContact O-N 3.11Å; I56-K58 VanDerWaalsContact C-N 3.35Å; K58-V83 HydrophobicContact CD-CG1 4.19Å
59	P	96.6	Very high	96.4	Very high	27 Å²	27	53.3 Å²	53.3	18%	0.175	26%	0.255	C	S	.	.			trans	-61.2	150.5	178.1	29.3	-37.4	0	0	0	110.9	N57 G141 R143	N57-P59 VanDerWaalsContact O-CD 3.26Å; N57-P59 WeakPolarHBondContact O-CD 3.24Å; P59-G141 VanDerWaalsContact CG-O 3.28Å; P59-G141 WeakPolarHBondContact CG-O 3.42Å; P59-R143 HydrophobicContact CG-CG 3.95Å
60	A	97.4	Very high	96.4	Very high	48 Å²	48	49.1 Å²	49.1	40%	0.397	24%	0.24	S	C	.	.			trans	-60.4	149.4	174.2	0	0	0	0	0	111.6	T85 T87	A60-T85 CarbonylContact C-O 3.53Å; A60-T85 VanDerWaalsContact CA-O 3.27Å; A60-T85 WeakPolarHBondContact CA-O 3.2Å; A60-T87 HydrophobicContact CB-CG2 3.77Å
61	L	97.2	Very high	96.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.8	177.6	-174.7	70.4	0	0	0	109.2	R65 L66 C82 T85 I86 T87 I139	L61-R65 HydrophobicContact CD1-CB 4.07Å; L61-R65 HydrophobicContact CD1-CG 3.86Å; L61-L66 HydrophobicContact CD2-CB 4.48Å; L61-L66 HydrophobicContact CD2-CD1 3.53Å; L61-C82 HydrophobicContact CD2-CB 4.02Å; L61-T85 PolarHBondContact N-O 2.9Å; L61-I86 WeakPolarHBondContact O-CA 3.47Å; L61-T87 PolarHBondContact O-N 3.27Å; L61-T87 PolarHBondContact O-OG1 3.4Å; L61-I139 HydrophobicContact CD1-CG2 3.9Å; L61-I139 HydrophobicContact CD2-CB 4.02Å; L61-I139 HydrophobicContact CD2-CG2 3.59Å; L61-I139 HydrophobicContact CG-CG2 4.44Å
62	S	97.2	Very high	96	Very high	31 Å²	31	62.8 Å²	62.8	22%	0.217	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	151.5	176.1	70.8	0	0	0	0	112	A64 R65 L66 T87	S62-A64 PolarHBondContact O-N 3.07Å; S62-R65 PolarHBondContact O-N 2.67Å; S62-R65 PolarHBondContact OG-N 3.05Å; S62-L66 PolarHBondContact O-N 3.02Å; S62-T87 WeakPolarHBondContact CA-O 3.37Å
63	L	97	Very high	95.8	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-54.4	-37	173.5	-69.2	-178.9	0	0	0	112.5	R65 L66 M67 I86 T87 D89 I92 F95 A109 R112 I113	L63-R65 VanDerWaalsContact C-N 3.31Å; L63-R65 PolarHBondContact O-N 2.67Å; L63-L66 HydrophobicContact CD2-CD2 4.31Å; L63-L66 VanDerWaalsContact O-CB 3.31Å; L63-L66 WeakPolarHBondContact O-CB 3.31Å; L63-L66 PolarHBondContact O-N 3.48Å; L63-L66 VanDerWaalsContact O-N 3.17Å; L63-M67 WeakPolarHBondContact O-CG 3.45Å; L63-M67 PolarHBondContact O-N 2.86Å; L63-I86 HydrophobicContact CD2-CG2 3.75Å; L63-T87 PolarHBondContact N-O 3.04Å; L63-T87 VanDerWaalsContact N-O 3.08Å; L63-D89 HydrophobicContact CB-CB 4.4Å; L63-I92 HydrophobicContact CB-CD1 3.86Å; L63-F95 HydrophobicContact CB-CD2 4.28Å; L63-F95 HydrophobicContact CB-CE2 3.99Å; L63-F95 HydrophobicContact CD1-CD2 4.39Å; L63-F95 HydrophobicContact CD1-CE2 4.44Å; L63-F95 HydrophobicContact CD2-CD2 4.45Å; L63-F95 HydrophobicContact CD2-CE2 3.72Å; L63-F95 HydrophobicContact CD2-CZ 4.01Å; L63-F95 HydrophobicContact CG-CE2 4.25Å; L63-A109 HydrophobicContact CD1-CB 4.18Å; L63-A109 HydrophobicContact CD2-CB 4.42Å; L63-A109 HydrophobicContact CG-CB 4.37Å; L63-R112 HydrophobicContact CD1-CB 4.39Å; L63-I113 HydrophobicContact CD2-CD1 3.93Å; L63-I113 HydrophobicContact CD2-CG1 4.06Å
64	A	96.1	Very high	95.5	Very high	24 Å²	24	67.8 Å²	67.8	20%	0.198	35%	0.35	C	S	.	.	H	α-helix	trans	-65.8	-39.9	-177.8	0	0	0	0	0	111.4	S62 R68 D89 I92	S62-A64 PolarHBondContact O-N 3.07Å; A64-R68 WeakPolarHBondContact O-CB 3.48Å; A64-R68 PolarHBondContact O-N 3.08Å; A64-D89 HydrophobicContact CB-CB 4.24Å; A64-D89 WeakPolarHBondContact CB-OD2 3.5Å; A64-I92 HydrophobicContact CB-CD1 3.54Å; A64-I92 HydrophobicContact CB-CG1 3.83Å
65	R	96	Very high	95.4	Very high	110 Å²	110	70 Å²	70	42%	0.415	35%	0.354	S	S	.	.	H	α-helix	trans	-70.8	-38.7	176.5	-171.3	168.9	175.5	120.2	2.5	110.7	L61 S62 L63 R68 V69	L61-R65 HydrophobicContact CD1-CB 4.07Å; L61-R65 HydrophobicContact CD1-CG 3.86Å; S62-R65 PolarHBondContact O-N 2.67Å; S62-R65 PolarHBondContact OG-N 3.05Å; L63-R65 VanDerWaalsContact C-N 3.31Å; L63-R65 PolarHBondContact O-N 2.67Å; R65-R68 PolarHBondContact O-N 2.94Å; R65-V69 HydrophobicContact CG-CG2 4.46Å; R65-V69 WeakPolarHBondContact O-CB 3.46Å; R65-V69 WeakPolarHBondContact O-CG2 3.43Å; R65-V69 PolarHBondContact O-N 2.68Å; R65-V69 VanDerWaalsContact O-N 3.07Å
66	L	96	Very high	95.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-56.5	-53.9	174.3	-166.8	79.2	0	0	0	110.7	L61 S62 L63 R68 V69 M70 A80 F95 M98 V100 I139	L61-L66 HydrophobicContact CD2-CB 4.48Å; L61-L66 HydrophobicContact CD2-CD1 3.53Å; S62-L66 PolarHBondContact O-N 3.02Å; L63-L66 HydrophobicContact CD2-CD2 4.31Å; L63-L66 VanDerWaalsContact O-CB 3.31Å; L63-L66 WeakPolarHBondContact O-CB 3.31Å; L63-L66 PolarHBondContact O-N 3.48Å; L63-L66 VanDerWaalsContact O-N 3.17Å; L66-R68 PolarHBondContact O-N 3.48Å; L66-V69 PolarHBondContact O-N 2.93Å; L66-M70 WeakPolarHBondContact O-CG 3.35Å; L66-M70 PolarHBondContact O-N 2.77Å; L66-A80 HydrophobicContact CD1-CB 3.95Å; L66-A80 HydrophobicContact CG-CB 4.47Å; L66-F95 HydrophobicContact CD2-CZ 4.14Å; L66-M98 HydrophobicContact CD2-SD 3.49Å; L66-M98 WeakPolarHBondContact CD2-SD 3.33Å; L66-M98 HydrophobicContact CG-SD 3.93Å; L66-V100 HydrophobicContact CD2-CG1 4.17Å; L66-V100 HydrophobicContact CD2-CG2 3.9Å; L66-I139 HydrophobicContact CD1-CD1 3.6Å
67	M	95	Very high	94.9	Very high	44 Å²	44	72 Å²	72	22%	0.217	37%	0.37	C	S	.	.	H	α-helix	trans	-56.3	-49.9	177.3	-74.2	176	57.7	0	0	112.5	L63 V69 M70 K71 I92 E94 F95 P96	L63-M67 WeakPolarHBondContact O-CG 3.45Å; L63-M67 PolarHBondContact O-N 2.86Å; M67-V69 PolarHBondContact O-N 3.4Å; M67-M70 PolarHBondContact O-N 3.3Å; M67-M70 VanDerWaalsContact O-N 3.13Å; M67-K71 WeakPolarHBondContact O-CB 3.37Å; M67-K71 PolarHBondContact O-N 2.92Å; M67-I92 HydrophobicContact CE-CG2 4.04Å; M67-I92 HydrophobicContact SD-CD1 3.74Å; M67-I92 HydrophobicContact SD-CG2 3.7Å; M67-E94 WeakPolarHBondContact CE-O 3.46Å; M67-F95 HydrophobicContact CG-CD2 3.66Å; M67-F95 HydrophobicContact CG-CE2 3.51Å; M67-F95 HydrophobicContact CG-CZ 4.46Å; M67-F95 HydrophobicContact SD-CD2 3.37Å; M67-F95 WeakPolarHBondContact SD-CD2 3.4Å; M67-F95 HydrophobicContact SD-CE2 3.89Å; M67-F95 HydrophobicContact SD-CG 4.27Å; M67-P96 VanDerWaalsContact CE-CD 3.47Å; M67-P96 HydrophobicContact CE-CG 4.29Å; M67-P96 HydrophobicContact CG-CG 4.23Å
68	R	95.1	Very high	94.9	Very high	193 Å²	193	72 Å²	72	73%	0.728	37%	0.366	S	S	*	.	H	α-helix	trans	-59.7	-35.3	-179.8	-168.7	-175.8	-58.1	-174.3	-0.7	112.5	A64 R65 L66	A64-R68 WeakPolarHBondContact O-CB 3.48Å; A64-R68 PolarHBondContact O-N 3.08Å; R65-R68 PolarHBondContact O-N 2.94Å; L66-R68 PolarHBondContact O-N 3.48Å
69	V	95.6	Very high	95	Very high	32 Å²	32	70.9 Å²	70.9	19%	0.194	36%	0.362	C	S	.	.	H	α-helix	trans	-76.9	-34.2	179.1	177	0	0	0	0	111.2	R65 L66 M67 R75 I139	R65-V69 HydrophobicContact CG-CG2 4.46Å; R65-V69 WeakPolarHBondContact O-CB 3.46Å; R65-V69 WeakPolarHBondContact O-CG2 3.43Å; R65-V69 PolarHBondContact O-N 2.68Å; R65-V69 VanDerWaalsContact O-N 3.07Å; L66-V69 PolarHBondContact O-N 2.93Å; M67-V69 PolarHBondContact O-N 3.4Å; V69-R75 VanDerWaalsContact O-CD 3.27Å; V69-R75 WeakPolarHBondContact O-CD 3.12Å; V69-R75 PolarHBondContact O-NH1 3.4Å; V69-I139 HydrophobicContact CB-CD1 4.3Å; V69-I139 HydrophobicContact CG1-CD1 3.94Å; V69-I139 HydrophobicContact CG1-CG1 3.89Å; V69-I139 HydrophobicContact CG1-CG2 4.3Å; V69-I139 HydrophobicContact CG2-CG2 4.43Å
70	M	95.7	Very high	95	Very high	19 Å²	19	69.6 Å²	69.6	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-77.6	-28.1	177.1	-67.1	-62.1	89.4	0	0	113.3	L66 M67 K72 A80 M98 V137 I139	L66-M70 WeakPolarHBondContact O-CG 3.35Å; L66-M70 PolarHBondContact O-N 2.77Å; M67-M70 PolarHBondContact O-N 3.3Å; M67-M70 VanDerWaalsContact O-N 3.13Å; M70-K72 PolarHBondContact O-N 2.88Å; M70-K72 VanDerWaalsContact O-N 3.16Å; M70-A80 HydrophobicContact CE-CB 4.46Å; M70-A80 HydrophobicContact CG-CB 4.13Å; M70-A80 HydrophobicContact SD-CB 3.63Å; M70-M98 HydrophobicContact CB-CE 3.49Å; M70-M98 VanDerWaalsContact CB-CE 3.49Å; M70-M98 HydrophobicContact CG-CE 3.42Å; M70-M98 VanDerWaalsContact CG-CE 3.42Å; M70-M98 HydrophobicContact CG-SD 4.25Å; M70-V137 HydrophobicContact CE-CB 3.51Å; M70-V137 HydrophobicContact CE-CG1 3.37Å; M70-V137 HydrophobicContact CE-CG2 3.95Å; M70-V137 HydrophobicContact SD-CB 4.34Å; M70-I139 HydrophobicContact CE-CD1 3.52Å; M70-I139 HydrophobicContact CE-CG1 4.17Å; M70-I139 HydrophobicContact SD-CD1 4.41Å
71	K	94.1	Very high	95.1	Very high	193 Å²	193	67.3 Å²	67.3	84%	0.839	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-11.8	176.6	-171.2	171.5	-179.5	178.1	0	114	M67	M67-K71 WeakPolarHBondContact O-CB 3.37Å; M67-K71 PolarHBondContact O-N 2.92Å
72	K	94.1	Very high	95.1	Very high	123 Å²	123	67.4 Å²	67.4	54%	0.535	34%	0.336	S	S	.	.	S	Bend	trans	-68.1	145.5	178.4	-61.1	-166.5	177.2	-162.6	0	110.6	M70 R75	M70-K72 PolarHBondContact O-N 2.88Å; M70-K72 VanDerWaalsContact O-N 3.16Å; K72-R75 WeakPolarHBondContact O-CB 3.31Å; K72-R75 PolarHBondContact O-N 2.84Å
73	S	92.5	Very high	95.1	Very high	114 Å²	114	66.4 Å²	66.4	80%	0.797	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	143.4	-179.8	51.7	0	0	0	0	112.9	R75	S73-R75 VanDerWaalsContact C-N 3.33Å; S73-R75 PolarHBondContact O-N 3.36Å
74	G	91.4	Very high	95.1	Very high	52 Å²	52	66.6 Å²	66.6	54%	0.536	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	18.1	179.6	0	0	0	0	0	115	K78	G74-K78 VanDerWaalsContact O-CE 3.28Å; G74-K78 WeakPolarHBondContact O-CE 3.29Å; G74-K78 PolarHBondContact O-NZ 3.48Å
75	R	93.8	Very high	95.2	Very high	73 Å²	73	67.7 Å²	67.7	28%	0.275	34%	0.335	S	S	.	.			trans	-119.6	6.6	178.3	-59.2	-178.8	-176.4	-175.3	-6.9	114.4	V69 K72 S73 K78 V137	V69-R75 VanDerWaalsContact O-CD 3.27Å; V69-R75 WeakPolarHBondContact O-CD 3.12Å; V69-R75 PolarHBondContact O-NH1 3.4Å; K72-R75 WeakPolarHBondContact O-CB 3.31Å; K72-R75 PolarHBondContact O-N 2.84Å; S73-R75 VanDerWaalsContact C-N 3.33Å; S73-R75 PolarHBondContact O-N 3.36Å; R75-K78 PolarHBondContact O-N 2.84Å; R75-V137 HydrophobicContact CB-CG2 4.34Å; R75-V137 HydrophobicContact CG-CG2 4.09Å
76	E	90	Very high	95.3	Very high	153 Å²	153	62.4 Å²	62.4	72%	0.715	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	141.6	170.7	-69.9	154.4	-145	0	0	110	K78	E76-K78 PolarHBondContact O-N 3.14Å
77	N	91.3	Very high	95.4	Very high	166 Å²	166	64.5 Å²	64.5	89%	0.888	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	10.4	178.3	-55.8	-35.9	0	0	0	116.2
78	K	96	Very high	95.5	Very high	70 Å²	70	64.7 Å²	64.7	30%	0.304	33%	0.33	S	S	.	.			trans	-86.8	149.6	175.3	-65.9	-172.4	-177.5	166	0	111.8	G74 R75 E76 A80 N135 V137	G74-K78 VanDerWaalsContact O-CE 3.28Å; G74-K78 WeakPolarHBondContact O-CE 3.29Å; G74-K78 PolarHBondContact O-NZ 3.48Å; R75-K78 PolarHBondContact O-N 2.84Å; E76-K78 PolarHBondContact O-N 3.14Å; K78-A80 PolarHBondContact O-N 2.99Å; K78-N135 CarbonylContact C-O 3.58Å; K78-N135 VanDerWaalsContact CA-O 3.23Å; K78-N135 WeakPolarHBondContact CA-O 3.42Å; K78-N135 VanDerWaalsContact CB-O 3.31Å; K78-N135 WeakPolarHBondContact CB-O 3.38Å; K78-N135 HydrophobicContact CG-CB 4.49Å; K78-V137 HydrophobicContact CB-CG2 3.85Å; K78-V137 HydrophobicContact CD-CG2 3.79Å; K78-V137 HydrophobicContact CG-CG2 4.44Å
79	I	97	Very high	95.6	Very high	16 Å²	16	55.9 Å²	55.9	8%	0.082	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	122.4	176.3	-53.2	172.7	0	0	0	109	V81 K99 C101 L126 N135 T136 V137	I79-V81 HydrophobicContact CG2-CG2 4.14Å; I79-V81 PolarHBondContact O-N 2.71Å; I79-K99 HydrophobicContact CG1-CB 4.21Å; I79-K99 HydrophobicContact CG2-CB 4.39Å; I79-C101 HydrophobicContact CG2-CB 4.2Å; I79-L126 HydrophobicContact CD1-CD1 4.03Å; I79-L126 HydrophobicContact CG2-CD1 4.24Å; I79-N135 PolarHBondContact N-O 3.27Å; I79-T136 HydrophobicContact CB-CG2 4.34Å; I79-T136 CarbonylContact O-C 3.52Å; I79-T136 WeakPolarHBondContact O-CA 3.05Å; I79-V137 PolarHBondContact O-N 2.88Å
80	A	97.5	Very high	95.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	111.4	175.1	0	0	0	0	0	109.9	L66 M70 K78 K99 V100 C101 I139	L66-A80 HydrophobicContact CD1-CB 3.95Å; L66-A80 HydrophobicContact CG-CB 4.47Å; M70-A80 HydrophobicContact CE-CB 4.46Å; M70-A80 HydrophobicContact CG-CB 4.13Å; M70-A80 HydrophobicContact SD-CB 3.63Å; K78-A80 PolarHBondContact O-N 2.99Å; A80-K99 PolarHBondContact N-O 3.33Å; A80-V100 CarbonylContact O-C 3.52Å; A80-V100 WeakPolarHBondContact O-CA 3.27Å; A80-C101 PolarHBondContact O-N 3.25Å; A80-I139 HydrophobicContact CB-CD1 4.07Å
81	V	98.1	Very high	95.6	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	116	-175.1	-177.5	0	0	0	0	110.7	F43 I47 I79 C101 F123 L126 T136 V137 L138 I139	F43-V81 HydrophobicContact CZ-CG2 4.39Å; I47-V81 HydrophobicContact CD1-CG1 4.27Å; I79-V81 HydrophobicContact CG2-CG2 4.14Å; I79-V81 PolarHBondContact O-N 2.71Å; V81-C101 HydrophobicContact CG1-CB 4.49Å; V81-C101 HydrophobicContact CG2-CB 4.19Å; V81-F123 HydrophobicContact CG1-CE1 3.63Å; V81-F123 HydrophobicContact CG1-CZ 3.85Å; V81-L126 HydrophobicContact CB-CD2 4.49Å; V81-L126 HydrophobicContact CG1-CD2 3.86Å; V81-L126 HydrophobicContact CG2-CD1 4.35Å; V81-L126 HydrophobicContact CG2-CD2 3.73Å; V81-T136 HydrophobicContact CG2-CG2 4.01Å; V81-V137 PolarHBondContact N-O 3.28Å; V81-L138 HydrophobicContact CB-CD2 3.96Å; V81-L138 HydrophobicContact CG1-CD2 3.73Å; V81-I139 PolarHBondContact O-N 3.18Å
82	C	97.4	Very high	95.5	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	115.6	176	-169.5	0	0	0	0	111.4	L61 G84 I86 C101 A102	L61-C82 HydrophobicContact CD2-CB 4.02Å; C82-G84 VanDerWaalsContact C-N 3.29Å; C82-G84 PolarHBondContact O-N 3.16Å; C82-I86 HydrophobicContact CB-CD1 4.25Å; C82-I86 HydrophobicContact CB-CG1 4.29Å; C82-C101 PolarHBondContact N-O 2.82Å; C82-A102 VanDerWaalsContact O-CA 3.31Å; C82-A102 WeakPolarHBondContact O-CA 3.39Å
83	V	97.6	Very high	95.4	Very high	10 Å²	10	66.2 Å²	66.2	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	80	171.8	-172.2	0	0	0	0	108.9	I47 R50 L51 K58 L103 F123	I47-V83 HydrophobicContact CG1-CG2 4.4Å; I47-V83 HydrophobicContact CG2-CG2 4.35Å; R50-V83 HydrophobicContact CB-CB 3.8Å; R50-V83 HydrophobicContact CB-CG1 3.8Å; R50-V83 HydrophobicContact CB-CG2 3.84Å; L51-V83 HydrophobicContact CD2-CG1 3.84Å; L51-V83 HydrophobicContact CG-CG1 4.31Å; K58-V83 HydrophobicContact CD-CG1 4.19Å; V83-L103 HydrophobicContact CG1-CD1 3.89Å; V83-L103 HydrophobicContact CG1-CG 4.42Å; V83-F123 HydrophobicContact CB-CZ 4.19Å; V83-F123 HydrophobicContact CG2-CE1 3.93Å; V83-F123 HydrophobicContact CG2-CE2 4.44Å; V83-F123 HydrophobicContact CG2-CZ 3.55Å
84	G	97	Very high	95.4	Very high	5 Å²	5	68.8 Å²	68.8	5%	0.052	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170	-159.1	-176.5	0	0	0	0	0	112.3	C82 L103 R104	C82-G84 VanDerWaalsContact C-N 3.29Å; C82-G84 PolarHBondContact O-N 3.16Å; G84-L103 PolarHBondContact O-N 3.38Å; G84-L103 VanDerWaalsContact O-N 3.15Å; G84-R104 PolarHBondContact O-N 2.96Å
85	T	98.1	Very high	95.5	Very high	46 Å²	46	67.3 Å²	67.3	28%	0.282	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.7	177	-51.2	0	0	0	0	110.8	A60 L61 T87 R104 T106	A60-T85 CarbonylContact C-O 3.53Å; A60-T85 VanDerWaalsContact CA-O 3.27Å; A60-T85 WeakPolarHBondContact CA-O 3.2Å; L61-T85 PolarHBondContact N-O 2.9Å; T85-T87 HydrophobicContact CG2-CG2 4.28Å; T85-R104 CarbonylContact C-O 3.59Å; T85-R104 VanDerWaalsContact CA-O 3.24Å; T85-R104 WeakPolarHBondContact CA-O 2.99Å; T85-R104 HydrophobicContact CG2-CB 4.18Å; T85-R104 HydrophobicContact CG2-CG 4.21Å; T85-T106 HydrophobicContact CG2-CG2 4.31Å
86	I	98.1	Very high	95.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.8	169.1	-62.7	-179	0	0	0	109.1	L61 L63 C82 V100 A102 R104 V105 T106	L61-I86 WeakPolarHBondContact O-CA 3.47Å; L63-I86 HydrophobicContact CD2-CG2 3.75Å; C82-I86 HydrophobicContact CB-CD1 4.25Å; C82-I86 HydrophobicContact CB-CG1 4.29Å; I86-V100 HydrophobicContact CD1-CG1 3.12Å; I86-A102 HydrophobicContact CD1-CB 3.66Å; I86-A102 HydrophobicContact CG1-CB 3.86Å; I86-R104 PolarHBondContact N-O 2.89Å; I86-V105 HydrophobicContact CB-CG1 4.44Å; I86-V105 HydrophobicContact CB-CG2 4.35Å; I86-T106 PolarHBondContact O-N 3.31Å; I86-T106 PolarHBondContact O-OG1 3.3Å
87	T	98.1	Very high	95.7	Very high	43 Å²	43	67.5 Å²	67.5	26%	0.264	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147	-176	57.4	0	0	0	0	111.5	A60 L61 S62 L63 T85 T106	A60-T87 HydrophobicContact CB-CG2 3.77Å; L61-T87 PolarHBondContact O-N 3.27Å; L61-T87 PolarHBondContact O-OG1 3.4Å; S62-T87 WeakPolarHBondContact CA-O 3.37Å; L63-T87 PolarHBondContact N-O 3.04Å; L63-T87 VanDerWaalsContact N-O 3.08Å; T85-T87 HydrophobicContact CG2-CG2 4.28Å; T87-T106 WeakPolarHBondContact CA-OG1 3.06Å; T87-T106 HydrophobicContact CG2-CG2 4.01Å
88	N	97.4	Very high	95.9	Very high	49 Å²	49	60.6 Å²	60.6	26%	0.262	29%	0.286	S	S	.	.			trans	-63.2	154.7	175.4	-171.2	22	0	0	0	110.8	T106 A108 A109 R112	N88-T106 PolarHBondContact N-OG1 3.24Å; N88-A108 HydrophobicContact CB-CB 4.03Å; N88-A109 HydrophobicContact CB-CB 4.17Å; N88-R112 WeakPolarHBondContact OD1-CD 3.27Å; N88-R112 PolarHBondContact OD1-NH1 3.41Å
89	D	96.1	Very high	95.9	Very high	8 Å²	8	62.1 Å²	62.1	4%	0.043	29%	0.293	C	S	.	.			trans	-135.5	102.2	171.6	-162.6	-32.3	0	0	0	108.6	L63 A64 R91 I92 R112	L63-D89 HydrophobicContact CB-CB 4.4Å; A64-D89 HydrophobicContact CB-CB 4.24Å; A64-D89 WeakPolarHBondContact CB-OD2 3.5Å; D89-R91 PolarHBondContact O-N 3.07Å; D89-R91 VanDerWaalsContact O-N 3.17Å; D89-R91 IonicContact OD1-CZ 3.42Å; D89-R91 PolarHBondContact OD1-N 3.03Å; D89-R91 IonicContact OD1-NE 2.79Å; D89-R91 PolarHBondContact OD1-NE 3.25Å; D89-R91 IonicContact OD1-NH2 3.19Å; D89-R91 PolarHBondContact OD1-NH2 3.24Å; D89-R91 IonicContact OD2-CZ 3.7Å; D89-R91 IonicContact OD2-NE 3.82Å; D89-R91 IonicContact OD2-NH2 2.76Å; D89-R91 PolarHBondContact OD2-NH2 3.32Å; D89-I92 HydrophobicContact CB-CD1 3.97Å; D89-I92 HydrophobicContact CB-CG1 4.23Å; D89-I92 PolarHBondContact O-N 3.3Å; D89-R112 PolarHBondContact O-NH1 3.31Å
90	T	95.2	Very high	96	Very high	123 Å²	123	61.3 Å²	61.3	76%	0.755	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	-173.3	51	0	0	0	0	113.7	I92	T90-I92 VanDerWaalsContact C-N 3.26Å; T90-I92 PolarHBondContact O-N 3.32Å
91	R	96	Very high	96	Very high	200 Å²	200	61.3 Å²	61.3	76%	0.755	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.9	-179.2	-62	169.9	-66.7	-175.4	-0.1	113.3	D89	D89-R91 PolarHBondContact O-N 3.07Å; D89-R91 VanDerWaalsContact O-N 3.17Å; D89-R91 IonicContact OD1-CZ 3.42Å; D89-R91 PolarHBondContact OD1-N 3.03Å; D89-R91 IonicContact OD1-NE 2.79Å; D89-R91 PolarHBondContact OD1-NE 3.25Å; D89-R91 IonicContact OD1-NH2 3.19Å; D89-R91 PolarHBondContact OD1-NH2 3.24Å; D89-R91 IonicContact OD2-CZ 3.7Å; D89-R91 IonicContact OD2-NE 3.82Å; D89-R91 IonicContact OD2-NH2 2.76Å; D89-R91 PolarHBondContact OD2-NH2 3.32Å
92	I	93.2	Very high	96	Very high	25 Å²	25	61.7 Å²	61.7	13%	0.128	29%	0.292	C	S	.	.			trans	-83.7	134.3	176.7	-50.1	170.7	0	0	0	107.5	L63 A64 M67 D89 T90 E94 R112	L63-I92 HydrophobicContact CB-CD1 3.86Å; A64-I92 HydrophobicContact CB-CD1 3.54Å; A64-I92 HydrophobicContact CB-CG1 3.83Å; M67-I92 HydrophobicContact CE-CG2 4.04Å; M67-I92 HydrophobicContact SD-CD1 3.74Å; M67-I92 HydrophobicContact SD-CG2 3.7Å; D89-I92 HydrophobicContact CB-CD1 3.97Å; D89-I92 HydrophobicContact CB-CG1 4.23Å; D89-I92 PolarHBondContact O-N 3.3Å; T90-I92 VanDerWaalsContact C-N 3.26Å; T90-I92 PolarHBondContact O-N 3.32Å; I92-E94 WeakPolarHBondContact CG2-O 3.49Å; I92-R112 PolarHBondContact O-NH2 2.76Å
93	R	91.8	Very high	96	Very high	236 Å²	236	64.7 Å²	64.7	89%	0.891	31%	0.307	S	S	*	.	S	Bend	trans	-85.6	-64.3	170.9	-65.4	179.1	176.7	154.7	-2.8	110	R112	R93-R112 PolarHBondContact O-NH2 3.19Å
94	E	91.7	Very high	96	Very high	167 Å²	167	72.6 Å²	72.6	78%	0.78	34%	0.336	S	S	*	.			trans	-97.1	135.4	-176.4	-65.2	173.9	-174.5	0	0	112.5	M67 I92	M67-E94 WeakPolarHBondContact CE-O 3.46Å; I92-E94 WeakPolarHBondContact CG2-O 3.49Å
95	F	93.3	Very high	96	Very high	22 Å²	22	73 Å²	73	10%	0.096	34%	0.337	C	S	.	.			trans	-116.4	124.8	174.1	-171.5	-94.7	0	0	0	108.9	L63 L66 M67 M98 I113 A116	L63-F95 HydrophobicContact CB-CD2 4.28Å; L63-F95 HydrophobicContact CB-CE2 3.99Å; L63-F95 HydrophobicContact CD1-CD2 4.39Å; L63-F95 HydrophobicContact CD1-CE2 4.44Å; L63-F95 HydrophobicContact CD2-CD2 4.45Å; L63-F95 HydrophobicContact CD2-CE2 3.72Å; L63-F95 HydrophobicContact CD2-CZ 4.01Å; L63-F95 HydrophobicContact CG-CE2 4.25Å; L66-F95 HydrophobicContact CD2-CZ 4.14Å; M67-F95 HydrophobicContact CG-CD2 3.66Å; M67-F95 HydrophobicContact CG-CE2 3.51Å; M67-F95 HydrophobicContact CG-CZ 4.46Å; M67-F95 HydrophobicContact SD-CD2 3.37Å; M67-F95 WeakPolarHBondContact SD-CD2 3.4Å; M67-F95 HydrophobicContact SD-CE2 3.89Å; M67-F95 HydrophobicContact SD-CG 4.27Å; F95-M98 HydrophobicContact CE1-CG 3.57Å; F95-M98 HydrophobicContact CE1-SD 4.04Å; F95-M98 HydrophobicContact CE2-SD 4.34Å; F95-M98 HydrophobicContact CZ-CE 4.43Å; F95-M98 HydrophobicContact CZ-CG 3.67Å; F95-M98 HydrophobicContact CZ-SD 3.47Å; F95-M98 WeakPolarHBondContact CZ-SD 3.31Å; F95-I113 HydrophobicContact CD1-CG1 4.41Å; F95-I113 HydrophobicContact CE1-CB 4.34Å; F95-I113 HydrophobicContact CE1-CG1 3.73Å; F95-I113 HydrophobicContact CE1-CG2 4.48Å; F95-I113 HydrophobicContact CZ-CG1 3.96Å; F95-A116 HydrophobicContact CB-CB 4.34Å; F95-A116 HydrophobicContact CD1-CB 3.85Å; F95-A116 WeakPolarHBondContact O-CB 3.32Å
96	P	94.3	Very high	96	Very high	64 Å²	64	72.8 Å²	72.8	42%	0.416	34%	0.336	S	S	.	.			trans	-73	152.1	179.9	30.2	-35.4	0	0	0	110.9	M67 M98	M67-P96 VanDerWaalsContact CE-CD 3.47Å; M67-P96 HydrophobicContact CE-CG 4.29Å; M67-P96 HydrophobicContact CG-CG 4.23Å; P96-M98 HydrophobicContact CG-CE 4.38Å; P96-M98 PolarHBondContact O-N 3.39Å
97	K	95.5	Very high	96	Very high	166 Å²	166	78 Å²	78	72%	0.722	37%	0.368	S	S	*	.			trans	-56.6	123.2	170.5	179.2	166.2	177.4	175.3	0	110.3	A116 G117	K97-A116 WeakPolarHBondContact CB-O 3.22Å; K97-G117 WeakPolarHBondContact CD-O 3.23Å; K97-G117 WeakPolarHBondContact CE-O 3.22Å; K97-G117 WeakPolarHBondContact CG-O 3.42Å
98	M	94.7	Very high	96	Very high	21 Å²	21	77.6 Å²	77.6	10%	0.103	37%	0.369	C	S	.	.			trans	-152.6	154.1	173.3	55.3	166.7	53.9	0	0	112.6	L66 M70 F95 P96 V100 G118 E119	L66-M98 HydrophobicContact CD2-SD 3.49Å; L66-M98 WeakPolarHBondContact CD2-SD 3.33Å; L66-M98 HydrophobicContact CG-SD 3.93Å; M70-M98 HydrophobicContact CB-CE 3.49Å; M70-M98 VanDerWaalsContact CB-CE 3.49Å; M70-M98 HydrophobicContact CG-CE 3.42Å; M70-M98 VanDerWaalsContact CG-CE 3.42Å; M70-M98 HydrophobicContact CG-SD 4.25Å; F95-M98 HydrophobicContact CE1-CG 3.57Å; F95-M98 HydrophobicContact CE1-SD 4.04Å; F95-M98 HydrophobicContact CE2-SD 4.34Å; F95-M98 HydrophobicContact CZ-CE 4.43Å; F95-M98 HydrophobicContact CZ-CG 3.67Å; F95-M98 HydrophobicContact CZ-SD 3.47Å; F95-M98 WeakPolarHBondContact CZ-SD 3.31Å; P96-M98 HydrophobicContact CG-CE 4.38Å; P96-M98 PolarHBondContact O-N 3.39Å; M98-V100 HydrophobicContact CG-CG2 3.79Å; M98-V100 HydrophobicContact SD-CG2 3.8Å; M98-G118 VanDerWaalsContact O-CA 3.25Å; M98-G118 WeakPolarHBondContact O-CA 3.43Å; M98-E119 PolarHBondContact O-N 3.16Å; M98-E119 VanDerWaalsContact O-N 3.11Å
99	K	96.7	Very high	96	Very high	101 Å²	101	75.2 Å²	75.2	44%	0.439	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.3	171.6	-58.8	-164	-179.1	-141.8	0	110.1	I79 A80 E119 I121	I79-K99 HydrophobicContact CG1-CB 4.21Å; I79-K99 HydrophobicContact CG2-CB 4.39Å; A80-K99 PolarHBondContact N-O 3.33Å; K99-E119 WeakPolarHBondContact CA-O 3.31Å; K99-E119 WeakPolarHBondContact CD-OE2 3.43Å; K99-E119 VanDerWaalsContact CE-OE2 3.28Å; K99-E119 WeakPolarHBondContact CE-OE2 3.17Å; K99-E119 HydrophobicContact CG-CB 4.13Å; K99-E119 IonicContact NZ-OE2 2.76Å; K99-E119 PolarHBondContact NZ-OE2 3.42Å; K99-I121 HydrophobicContact CB-CD1 4.47Å; K99-I121 HydrophobicContact CD-CD1 4.43Å
100	V	97.4	Very high	96	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.9	-171.8	-174.9	0	0	0	0	109.9	L66 A80 I86 M98 I113 E119 I120 I121	L66-V100 HydrophobicContact CD2-CG1 4.17Å; L66-V100 HydrophobicContact CD2-CG2 3.9Å; A80-V100 CarbonylContact O-C 3.52Å; A80-V100 WeakPolarHBondContact O-CA 3.27Å; I86-V100 HydrophobicContact CD1-CG1 3.12Å; M98-V100 HydrophobicContact CG-CG2 3.79Å; M98-V100 HydrophobicContact SD-CG2 3.8Å; V100-I113 HydrophobicContact CG2-CD1 4.39Å; V100-E119 PolarHBondContact N-O 3.47Å; V100-I120 CarbonylContact O-C 3.56Å; V100-I120 WeakPolarHBondContact O-CA 3.47Å; V100-I121 PolarHBondContact O-N 3.18Å
101	C	97.9	Very high	96.1	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.8	171.9	-179.3	0	0	0	0	110.8	I79 A80 V81 C82 I121 L126	I79-C101 HydrophobicContact CG2-CB 4.2Å; A80-C101 PolarHBondContact O-N 3.25Å; V81-C101 HydrophobicContact CG1-CB 4.49Å; V81-C101 HydrophobicContact CG2-CB 4.19Å; C82-C101 PolarHBondContact N-O 2.82Å; C101-I121 VanDerWaalsContact CA-O 3.27Å; C101-I121 WeakPolarHBondContact CA-O 3.27Å; C101-L126 HydrophobicContact CB-CD2 4.07Å; C101-L126 VanDerWaalsContact SG-CD2 3.56Å
102	A	97.9	Very high	96.1	Very high	8 Å²	8	73.4 Å²	73.4	7%	0.066	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	165	178.6	0	0	0	0	0	113.5	C82 I86 V105 I121	C82-A102 VanDerWaalsContact O-CA 3.31Å; C82-A102 WeakPolarHBondContact O-CA 3.39Å; I86-A102 HydrophobicContact CD1-CB 3.66Å; I86-A102 HydrophobicContact CG1-CB 3.86Å; A102-V105 HydrophobicContact CB-CG2 3.98Å; A102-I121 PolarHBondContact N-O 2.99Å
103	L	97.1	Very high	96.3	Very high	65 Å²	65	72.2 Å²	72.2	34%	0.34	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-38.5	171.2	-69.1	174	0	0	0	110.9	L28 L51 V83 G84 F123	L28-L103 HydrophobicContact CD1-CD2 4Å; L51-L103 HydrophobicContact CD2-CD1 4.33Å; L51-L103 HydrophobicContact CD2-CD2 3.89Å; V83-L103 HydrophobicContact CG1-CD1 3.89Å; V83-L103 HydrophobicContact CG1-CG 4.42Å; G84-L103 PolarHBondContact O-N 3.38Å; G84-L103 VanDerWaalsContact O-N 3.15Å; L103-F123 HydrophobicContact CD2-CD2 3.63Å; L103-F123 HydrophobicContact CD2-CE2 3.9Å; L103-F123 HydrophobicContact CG-CD2 4.1Å; L103-F123 HydrophobicContact CG-CE2 3.86Å
104	R	97.6	Very high	96.6	Very high	175 Å²	175	65.3 Å²	65.3	66%	0.66	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	141.8	177.3	-175.8	172.6	175.1	154.1	-2.1	109.6	G84 T85 I86	G84-R104 PolarHBondContact O-N 2.96Å; T85-R104 CarbonylContact C-O 3.59Å; T85-R104 VanDerWaalsContact CA-O 3.24Å; T85-R104 WeakPolarHBondContact CA-O 2.99Å; T85-R104 HydrophobicContact CG2-CB 4.18Å; T85-R104 HydrophobicContact CG2-CG 4.21Å; I86-R104 PolarHBondContact N-O 2.89Å
105	V	98.1	Very high	96.8	Very high	14 Å²	14	65.9 Å²	65.9	9%	0.085	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.7	169.9	-174.8	0	0	0	0	107	I86 A102 A109 R110 I113 I120	I86-V105 HydrophobicContact CB-CG1 4.44Å; I86-V105 HydrophobicContact CB-CG2 4.35Å; A102-V105 HydrophobicContact CB-CG2 3.98Å; V105-A109 HydrophobicContact CG1-CB 3.79Å; V105-R110 HydrophobicContact CG1-CB 3.99Å; V105-I113 HydrophobicContact CG1-CD1 4.29Å; V105-I120 HydrophobicContact CG1-CD1 4.36Å; V105-I120 HydrophobicContact CG2-CG2 3.8Å
106	T	98.4	Very high	96.9	Very high	42 Å²	42	66.1 Å²	66.1	26%	0.258	32%	0.323	S	S	.	.			trans	-64.8	148	174.2	53.6	0	0	0	0	110.4	T85 I86 T87 N88 A108 A109 R110	T85-T106 HydrophobicContact CG2-CG2 4.31Å; I86-T106 PolarHBondContact O-N 3.31Å; I86-T106 PolarHBondContact O-OG1 3.3Å; T87-T106 WeakPolarHBondContact CA-OG1 3.06Å; T87-T106 HydrophobicContact CG2-CG2 4.01Å; N88-T106 PolarHBondContact N-OG1 3.24Å; T106-A108 PolarHBondContact O-N 2.87Å; T106-A109 CarbonylContact O-C 3.57Å; T106-A109 WeakPolarHBondContact O-CA 3.47Å; T106-A109 WeakPolarHBondContact O-CB 3.47Å; T106-A109 PolarHBondContact O-N 3.34Å; T106-A109 WeakPolarHBondContact OG1-CB 3.44Å; T106-R110 PolarHBondContact O-N 3.1Å
107	T	98.1	Very high	97	Very high	108 Å²	108	65 Å²	65	66%	0.663	32%	0.324	S	S	*	.	H	α-helix	trans	-49.1	-55.4	-178.1	47.4	0	0	0	0	112.5	A109 R110 E111	T107-A109 PolarHBondContact O-N 2.94Å; T107-A109 VanDerWaalsContact O-N 3.12Å; T107-R110 WeakPolarHBondContact O-CA 3.39Å; T107-R110 WeakPolarHBondContact O-CB 3.48Å; T107-R110 PolarHBondContact O-N 3.38Å; T107-E111 PolarHBondContact O-N 3.43Å
108	A	97.4	Very high	97	Very high	35 Å²	35	57.6 Å²	57.6	29%	0.289	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-26	177.8	0	0	0	0	0	114.2	N88 T106 R112	N88-A108 HydrophobicContact CB-CB 4.03Å; T106-A108 PolarHBondContact O-N 2.87Å; A108-R112 WeakPolarHBondContact O-CG 3.12Å
109	A	97.4	Very high	97.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-80.4	-35.1	173.9	0	0	0	0	0	111.5	L63 N88 V105 T106 T107 I113	L63-A109 HydrophobicContact CD1-CB 4.18Å; L63-A109 HydrophobicContact CD2-CB 4.42Å; L63-A109 HydrophobicContact CG-CB 4.37Å; N88-A109 HydrophobicContact CB-CB 4.17Å; V105-A109 HydrophobicContact CG1-CB 3.79Å; T106-A109 CarbonylContact O-C 3.57Å; T106-A109 WeakPolarHBondContact O-CA 3.47Å; T106-A109 WeakPolarHBondContact O-CB 3.47Å; T106-A109 PolarHBondContact O-N 3.34Å; T106-A109 WeakPolarHBondContact OG1-CB 3.44Å; T107-A109 PolarHBondContact O-N 2.94Å; T107-A109 VanDerWaalsContact O-N 3.12Å; A109-I113 WeakPolarHBondContact O-CD1 3.47Å; A109-I113 VanDerWaalsContact O-CG1 3.24Å; A109-I113 WeakPolarHBondContact O-CG1 3.44Å; A109-I113 PolarHBondContact O-N 2.79Å; A109-I113 VanDerWaalsContact O-N 3.09Å
110	R	97.4	Very high	97.2	Very high	118 Å²	118	57 Å²	57	45%	0.445	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-50.5	177.4	173.1	-176.6	-67.1	-92.1	6.3	110	V105 T106 T107 R112 I113 L114 I120	V105-R110 HydrophobicContact CG1-CB 3.99Å; T106-R110 PolarHBondContact O-N 3.1Å; T107-R110 WeakPolarHBondContact O-CA 3.39Å; T107-R110 WeakPolarHBondContact O-CB 3.48Å; T107-R110 PolarHBondContact O-N 3.38Å; R110-R112 VanDerWaalsContact C-N 3.34Å; R110-R112 PolarHBondContact O-N 3.26Å; R110-I113 PolarHBondContact O-N 3.38Å; R110-L114 HydrophobicContact CG-CD1 3.82Å; R110-L114 HydrophobicContact CG-CG 4.45Å; R110-L114 WeakPolarHBondContact O-CG 3.38Å; R110-L114 PolarHBondContact O-N 3.25Å; R110-I120 HydrophobicContact CB-CD1 3.94Å; R110-I120 HydrophobicContact CG-CD1 3.64Å
111	E	96.8	Very high	97.2	Very high	124 Å²	124	57.2 Å²	57.2	58%	0.579	29%	0.294	S	S	*	.	H	α-helix	trans	-54.4	-48.6	177.2	-73	155.7	-155.7	0	0	111.7	T107 I113 L114 H115	T107-E111 PolarHBondContact O-N 3.43Å; E111-I113 PolarHBondContact O-N 3.17Å; E111-L114 PolarHBondContact O-N 3.04Å; E111-H115 VanDerWaalsContact O-CB 3.23Å; E111-H115 WeakPolarHBondContact O-CB 3.41Å; E111-H115 PolarHBondContact O-N 3.47Å
112	R	96.2	Very high	97.2	Very high	51 Å²	51	60.7 Å²	60.7	19%	0.192	32%	0.315	C	S	.	.	H	α-helix	trans	-65.4	-38.3	-179.7	-70.6	-174.9	73	-176.3	7.9	114	L63 N88 D89 I92 R93 A108 R110 A116	L63-R112 HydrophobicContact CD1-CB 4.39Å; N88-R112 WeakPolarHBondContact OD1-CD 3.27Å; N88-R112 PolarHBondContact OD1-NH1 3.41Å; D89-R112 PolarHBondContact O-NH1 3.31Å; I92-R112 PolarHBondContact O-NH2 2.76Å; R93-R112 PolarHBondContact O-NH2 3.19Å; A108-R112 WeakPolarHBondContact O-CG 3.12Å; R110-R112 VanDerWaalsContact C-N 3.34Å; R110-R112 PolarHBondContact O-N 3.26Å; R112-A116 WeakPolarHBondContact O-CB 3.33Å; R112-A116 PolarHBondContact O-N 2.88Å; R112-A116 VanDerWaalsContact O-N 3.13Å
113	I	96.8	Very high	97.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-44.4	176.7	-67.8	163.8	0	0	0	109.9	L63 F95 V100 V105 A109 R110 E111 A116 G118 I120	L63-I113 HydrophobicContact CD2-CD1 3.93Å; L63-I113 HydrophobicContact CD2-CG1 4.06Å; F95-I113 HydrophobicContact CD1-CG1 4.41Å; F95-I113 HydrophobicContact CE1-CB 4.34Å; F95-I113 HydrophobicContact CE1-CG1 3.73Å; F95-I113 HydrophobicContact CE1-CG2 4.48Å; F95-I113 HydrophobicContact CZ-CG1 3.96Å; V100-I113 HydrophobicContact CG2-CD1 4.39Å; V105-I113 HydrophobicContact CG1-CD1 4.29Å; A109-I113 WeakPolarHBondContact O-CD1 3.47Å; A109-I113 VanDerWaalsContact O-CG1 3.24Å; A109-I113 WeakPolarHBondContact O-CG1 3.44Å; A109-I113 PolarHBondContact O-N 2.79Å; A109-I113 VanDerWaalsContact O-N 3.09Å; R110-I113 PolarHBondContact O-N 3.38Å; E111-I113 PolarHBondContact O-N 3.17Å; I113-A116 PolarHBondContact O-N 3.17Å; I113-G118 VanDerWaalsContact O-CA 3.28Å; I113-G118 WeakPolarHBondContact O-CA 3.41Å; I113-G118 PolarHBondContact O-N 3.24Å; I113-I120 HydrophobicContact CB-CD1 4.08Å; I113-I120 HydrophobicContact CB-CG1 4.23Å; I113-I120 HydrophobicContact CD1-CD1 4.18Å; I113-I120 HydrophobicContact CD1-CG1 4.19Å; I113-I120 HydrophobicContact CG2-CD1 4.09Å; I113-I120 HydrophobicContact CG2-CG1 3.71Å
114	L	97.2	Very high	97.1	Very high	90 Å²	90	61.4 Å²	61.4	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-41.5	179.9	-66.8	174.7	0	0	0	111.9	R110 E111 A116 G117 I120	R110-L114 HydrophobicContact CG-CD1 3.82Å; R110-L114 HydrophobicContact CG-CG 4.45Å; R110-L114 WeakPolarHBondContact O-CG 3.38Å; R110-L114 PolarHBondContact O-N 3.25Å; E111-L114 PolarHBondContact O-N 3.04Å; L114-A116 VanDerWaalsContact C-N 3.27Å; L114-A116 PolarHBondContact O-N 3.44Å; L114-G117 WeakPolarHBondContact O-CA 3.17Å; L114-G117 PolarHBondContact O-N 2.85Å; L114-I120 HydrophobicContact CG-CD1 4.3Å
115	H	96.4	Very high	97.1	Very high	180 Å²	180	59.2 Å²	59.2	83%	0.833	31%	0.31	S	S	*	.	H	α-helix	trans	-60.2	-36.4	175.1	-179.2	-80.7	0	0	0	112.1	E111 G117	E111-H115 VanDerWaalsContact O-CB 3.23Å; E111-H115 WeakPolarHBondContact O-CB 3.41Å; E111-H115 PolarHBondContact O-N 3.47Å; H115-G117 PolarHBondContact O-N 3.13Å
116	A	95.9	Very high	97	Very high	26 Å²	26	58.6 Å²	58.6	22%	0.215	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	3.1	172.8	0	0	0	0	0	114.1	F95 K97 R112 I113 L114 G118	F95-A116 HydrophobicContact CB-CB 4.34Å; F95-A116 HydrophobicContact CD1-CB 3.85Å; F95-A116 WeakPolarHBondContact O-CB 3.32Å; K97-A116 WeakPolarHBondContact CB-O 3.22Å; R112-A116 WeakPolarHBondContact O-CB 3.33Å; R112-A116 PolarHBondContact O-N 2.88Å; R112-A116 VanDerWaalsContact O-N 3.13Å; I113-A116 PolarHBondContact O-N 3.17Å; L114-A116 VanDerWaalsContact C-N 3.27Å; L114-A116 PolarHBondContact O-N 3.44Å; A116-G118 PolarHBondContact O-N 3.38Å
117	G	96.1	Very high	96.9	Very high	42 Å²	42	57.4 Å²	57.4	43%	0.433	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	16.8	-174.2	0	0	0	0	0	113.9	K97 L114 H115	K97-G117 WeakPolarHBondContact CD-O 3.23Å; K97-G117 WeakPolarHBondContact CE-O 3.22Å; K97-G117 WeakPolarHBondContact CG-O 3.42Å; L114-G117 WeakPolarHBondContact O-CA 3.17Å; L114-G117 PolarHBondContact O-N 2.85Å; H115-G117 PolarHBondContact O-N 3.13Å
118	G	95.9	Very high	96.9	Very high	9 Å²	9	58 Å²	58	9%	0.093	30%	0.299	C	S	.	.			trans	-77.7	167.8	175.2	0	0	0	0	0	112.9	M98 I113 A116	M98-G118 VanDerWaalsContact O-CA 3.25Å; M98-G118 WeakPolarHBondContact O-CA 3.43Å; I113-G118 VanDerWaalsContact O-CA 3.28Å; I113-G118 WeakPolarHBondContact O-CA 3.41Å; I113-G118 PolarHBondContact O-N 3.24Å; A116-G118 PolarHBondContact O-N 3.38Å
119	E	96.9	Very high	96.8	Very high	74 Å²	74	60.1 Å²	60.1	35%	0.346	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.4	-178.4	-168.7	-173.5	162.7	0	0	109.8	M98 K99 V100 I121	M98-E119 PolarHBondContact O-N 3.16Å; M98-E119 VanDerWaalsContact O-N 3.11Å; K99-E119 WeakPolarHBondContact CA-O 3.31Å; K99-E119 WeakPolarHBondContact CD-OE2 3.43Å; K99-E119 VanDerWaalsContact CE-OE2 3.28Å; K99-E119 WeakPolarHBondContact CE-OE2 3.17Å; K99-E119 HydrophobicContact CG-CB 4.13Å; K99-E119 IonicContact NZ-OE2 2.76Å; K99-E119 PolarHBondContact NZ-OE2 3.42Å; V100-E119 PolarHBondContact N-O 3.47Å; E119-I121 HydrophobicContact CG-CD1 4.34Å; E119-I121 HydrophobicContact CG-CG1 3.92Å
120	I	97.8	Very high	96.7	Very high	36 Å²	36	61 Å²	61	19%	0.185	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.4	175.6	-60.4	163.1	0	0	0	108.7	V100 V105 R110 I113 L114	V100-I120 CarbonylContact O-C 3.56Å; V100-I120 WeakPolarHBondContact O-CA 3.47Å; V105-I120 HydrophobicContact CG1-CD1 4.36Å; V105-I120 HydrophobicContact CG2-CG2 3.8Å; R110-I120 HydrophobicContact CB-CD1 3.94Å; R110-I120 HydrophobicContact CG-CD1 3.64Å; I113-I120 HydrophobicContact CB-CD1 4.08Å; I113-I120 HydrophobicContact CB-CG1 4.23Å; I113-I120 HydrophobicContact CD1-CD1 4.18Å; I113-I120 HydrophobicContact CD1-CG1 4.19Å; I113-I120 HydrophobicContact CG2-CD1 4.09Å; I113-I120 HydrophobicContact CG2-CG1 3.71Å; L114-I120 HydrophobicContact CG-CD1 4.3Å
121	I	97.3	Very high	96.6	Very high	5 Å²	5	58 Å²	58	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	145.1	-173.2	-50.2	177.6	0	0	0	109.3	K99 V100 C101 A102 E119 R125 L129	K99-I121 HydrophobicContact CB-CD1 4.47Å; K99-I121 HydrophobicContact CD-CD1 4.43Å; V100-I121 PolarHBondContact O-N 3.18Å; C101-I121 VanDerWaalsContact CA-O 3.27Å; C101-I121 WeakPolarHBondContact CA-O 3.27Å; A102-I121 PolarHBondContact N-O 2.99Å; E119-I121 HydrophobicContact CG-CD1 4.34Å; E119-I121 HydrophobicContact CG-CG1 3.92Å; I121-R125 HydrophobicContact CG2-CB 3.56Å; I121-R125 HydrophobicContact CG2-CG 3.57Å; I121-L129 HydrophobicContact CD1-CD1 4Å; I121-L129 HydrophobicContact CG2-CD1 4.32Å
122	T	97.9	Very high	96.6	Very high	72 Å²	72	55.9 Å²	55.9	44%	0.442	30%	0.299	S	S	.	.			trans	-88.7	166.9	172.4	55.3	0	0	0	0	111.5	D124 R125 L126	T122-D124 VanDerWaalsContact C-N 3.34Å; T122-D124 WeakPolarHBondContact CB-OD1 3.26Å; T122-D124 PolarHBondContact O-N 2.97Å; T122-D124 PolarHBondContact OG1-OD1 2.78Å; T122-D124 PolarHBondContact OG1-OD2 3.42Å; T122-D124 VanDerWaalsContact OG1-OD2 3.06Å; T122-R125 PolarHBondContact O-N 3.45Å; T122-L126 WeakPolarHBondContact O-CB 3.41Å; T122-L126 PolarHBondContact O-N 3.18Å
123	F	97.7	Very high	96.5	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-70.5	-29.3	-176.1	-89.3	-78.2	0	0	0	113.8	L28 Y32 I47 V81 V83 L103 L126 A127	L28-F123 HydrophobicContact CD1-CB 4.21Å; L28-F123 HydrophobicContact CD2-CB 3.79Å; Y32-F123 HydrophobicContact CE2-CB 4.06Å; Y32-F123 HydrophobicContact CE2-CD1 4Å; Y32-F123 HydrophobicContact CE2-CG 4.47Å; Y32-F123 PolarHBondContact OH-O 3.07Å; I47-F123 HydrophobicContact CD1-CD1 4.32Å; I47-F123 HydrophobicContact CD1-CE1 3.91Å; I47-F123 HydrophobicContact CG1-CE1 4.47Å; I47-F123 HydrophobicContact CG2-CD1 4.2Å; I47-F123 HydrophobicContact CG2-CE1 4.1Å; V81-F123 HydrophobicContact CG1-CE1 3.63Å; V81-F123 HydrophobicContact CG1-CZ 3.85Å; V83-F123 HydrophobicContact CB-CZ 4.19Å; V83-F123 HydrophobicContact CG2-CE1 3.93Å; V83-F123 HydrophobicContact CG2-CE2 4.44Å; V83-F123 HydrophobicContact CG2-CZ 3.55Å; L103-F123 HydrophobicContact CD2-CD2 3.63Å; L103-F123 HydrophobicContact CD2-CE2 3.9Å; L103-F123 HydrophobicContact CG-CD2 4.1Å; L103-F123 HydrophobicContact CG-CE2 3.86Å; F123-L126 HydrophobicContact CD1-CD2 4.09Å; F123-L126 HydrophobicContact CE1-CD2 4.14Å; F123-A127 WeakPolarHBondContact O-CB 3.33Å; F123-A127 PolarHBondContact O-N 3.28Å
124	D	96.4	Very high	96.4	Very high	87 Å²	87	61 Å²	61	47%	0.465	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-49.8	170.9	51.5	-67.3	0	0	0	111.1	L28 T122 L126 A127 I128	L28-D124 HydrophobicContact CD2-CB 4.21Å; T122-D124 VanDerWaalsContact C-N 3.34Å; T122-D124 WeakPolarHBondContact CB-OD1 3.26Å; T122-D124 PolarHBondContact O-N 2.97Å; T122-D124 PolarHBondContact OG1-OD1 2.78Å; T122-D124 PolarHBondContact OG1-OD2 3.42Å; T122-D124 VanDerWaalsContact OG1-OD2 3.06Å; D124-L126 VanDerWaalsContact C-N 3.32Å; D124-L126 PolarHBondContact O-N 3.4Å; D124-A127 WeakPolarHBondContact O-CB 3.28Å; D124-A127 PolarHBondContact O-N 2.99Å; D124-A127 VanDerWaalsContact O-N 3.11Å; D124-I128 PolarHBondContact O-N 3.11Å
125	R	96.7	Very high	96.3	Very high	129 Å²	129	62.2 Å²	62.2	49%	0.487	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-38.1	175.3	-174.3	62.8	176	-174.1	1.7	112.2	I121 T122 A127 I128 L129	I121-R125 HydrophobicContact CG2-CB 3.56Å; I121-R125 HydrophobicContact CG2-CG 3.57Å; T122-R125 PolarHBondContact O-N 3.45Å; R125-A127 VanDerWaalsContact C-N 3.3Å; R125-A127 PolarHBondContact O-N 3.27Å; R125-I128 PolarHBondContact O-N 3.06Å; R125-L129 HydrophobicContact CG-CD1 4.02Å; R125-L129 HydrophobicContact CG-CG 4.42Å; R125-L129 WeakPolarHBondContact O-CG 3.26Å; R125-L129 PolarHBondContact O-N 2.74Å
126	L	97.3	Very high	96.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-39.9	172.8	179.9	67.1	0	0	0	112.1	F43 I47 I79 V81 C101 T122 F123 D124 I128 L129 S130 T136	F43-L126 HydrophobicContact CZ-CD2 4.24Å; I47-L126 HydrophobicContact CD1-CD2 4.46Å; I79-L126 HydrophobicContact CD1-CD1 4.03Å; I79-L126 HydrophobicContact CG2-CD1 4.24Å; V81-L126 HydrophobicContact CB-CD2 4.49Å; V81-L126 HydrophobicContact CG1-CD2 3.86Å; V81-L126 HydrophobicContact CG2-CD1 4.35Å; V81-L126 HydrophobicContact CG2-CD2 3.73Å; C101-L126 HydrophobicContact CB-CD2 4.07Å; C101-L126 VanDerWaalsContact SG-CD2 3.56Å; T122-L126 WeakPolarHBondContact O-CB 3.41Å; T122-L126 PolarHBondContact O-N 3.18Å; F123-L126 HydrophobicContact CD1-CD2 4.09Å; F123-L126 HydrophobicContact CE1-CD2 4.14Å; D124-L126 VanDerWaalsContact C-N 3.32Å; D124-L126 PolarHBondContact O-N 3.4Å; L126-I128 VanDerWaalsContact C-N 3.29Å; L126-I128 PolarHBondContact O-N 3.25Å; L126-L129 PolarHBondContact O-N 3.16Å; L126-S130 PolarHBondContact O-N 3.27Å; L126-T136 HydrophobicContact CD1-CG2 4.12Å
127	A	96.2	Very high	96.3	Very high	18 Å²	18	54.3 Å²	54.3	15%	0.149	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-34.7	178.6	0	0	0	0	0	112.4	L35 F123 D124 R125 P131	L35-A127 HydrophobicContact CD1-CB 3.82Å; F123-A127 WeakPolarHBondContact O-CB 3.33Å; F123-A127 PolarHBondContact O-N 3.28Å; D124-A127 WeakPolarHBondContact O-CB 3.28Å; D124-A127 PolarHBondContact O-N 2.99Å; D124-A127 VanDerWaalsContact O-N 3.11Å; R125-A127 VanDerWaalsContact C-N 3.3Å; R125-A127 PolarHBondContact O-N 3.27Å; A127-P131 WeakPolarHBondContact O-CA 3.28Å; A127-P131 WeakPolarHBondContact O-CB 3.47Å
128	I	96.7	Very high	96.4	Very high	121 Å²	121	54.6 Å²	54.6	62%	0.621	29%	0.286	S	S	*	.	H	α-helix	trans	-71.4	-49.4	174	-62.3	167.3	0	0	0	110.5	D124 R125 L126 S130	D124-I128 PolarHBondContact O-N 3.11Å; R125-I128 PolarHBondContact O-N 3.06Å; L126-I128 VanDerWaalsContact C-N 3.29Å; L126-I128 PolarHBondContact O-N 3.25Å; I128-S130 PolarHBondContact O-N 3.2Å
129	L	95.5	Very high	96.4	Very high	78 Å²	78	54.6 Å²	54.6	41%	0.408	28%	0.284	S	S	.	.	H	α-helix	trans	-68.1	-35.5	-175.8	-71.1	172.6	0	0	0	113.5	I121 R125 L126	I121-L129 HydrophobicContact CD1-CD1 4Å; I121-L129 HydrophobicContact CG2-CD1 4.32Å; R125-L129 HydrophobicContact CG-CD1 4.02Å; R125-L129 HydrophobicContact CG-CG 4.42Å; R125-L129 WeakPolarHBondContact O-CG 3.26Å; R125-L129 PolarHBondContact O-N 2.74Å; L126-L129 PolarHBondContact O-N 3.16Å
130	S	95.1	Very high	96.3	Very high	18 Å²	18	54.5 Å²	54.5	13%	0.126	28%	0.284	C	S	.	.			trans	-145.9	68.8	-172.2	-68.2	0	0	0	0	110.8	L126 I128 L132 G133 K134	L126-S130 PolarHBondContact O-N 3.27Å; I128-S130 PolarHBondContact O-N 3.2Å; S130-L132 PolarHBondContact O-N 3.03Å; S130-L132 VanDerWaalsContact O-N 3.13Å; S130-G133 PolarHBondContact O-N 3.35Å; S130-K134 PolarHBondContact OG-O 2.96Å
131	P	95.7	Very high	96.2	Very high	57 Å²	57	53 Å²	53	37%	0.37	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.2	-175	23.6	-34.3	0	0	0	113.1	N44 A127	N44-P131 PolarHBondContact ND2-O 3.48Å; N44-P131 PolarHBondContact OD1-O 3.28Å; A127-P131 WeakPolarHBondContact O-CA 3.28Å; A127-P131 WeakPolarHBondContact O-CB 3.47Å
132	L	96.1	Very high	96.2	Very high	79 Å²	79	55.5 Å²	55.5	41%	0.414	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-10.4	175.8	-62.2	177	0	0	0	113.6	T39 S41 S130 K134	T39-L132 HydrophobicContact CG2-CD2 4.15Å; S41-L132 PolarHBondContact OG-O 3.04Å; S130-L132 PolarHBondContact O-N 3.03Å; S130-L132 VanDerWaalsContact O-N 3.13Å; L132-K134 HydrophobicContact CB-CG 4.34Å
133	G	94.5	Very high	96.1	Very high	13 Å²	13	56.8 Å²	56.8	13%	0.134	29%	0.291	C	S	.	.			trans	81.1	18.8	-172.8	0	0	0	0	0	115.2	S130 T136	S130-G133 PolarHBondContact O-N 3.35Å; G133-T136 PolarHBondContact O-OG1 2.81Å
134	K	94.3	Very high	96	Very high	145 Å²	145	65.2 Å²	65.2	63%	0.63	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	145.5	174.8	-68	-176	178	-177.9	0	110.4	S130 L132 T136	S130-K134 PolarHBondContact OG-O 2.96Å; L132-K134 HydrophobicContact CB-CG 4.34Å; K134-T136 WeakPolarHBondContact O-CG2 3.46Å; K134-T136 PolarHBondContact O-N 3.49Å; K134-T136 VanDerWaalsContact O-N 3.14Å
135	N	95.1	Very high	95.8	Very high	115 Å²	115	64 Å²	64	62%	0.615	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	30.6	-180	-60.4	-24.2	0	0	0	115.1	K78 I79	K78-N135 CarbonylContact C-O 3.58Å; K78-N135 VanDerWaalsContact CA-O 3.23Å; K78-N135 WeakPolarHBondContact CA-O 3.42Å; K78-N135 VanDerWaalsContact CB-O 3.31Å; K78-N135 WeakPolarHBondContact CB-O 3.38Å; K78-N135 HydrophobicContact CG-CB 4.49Å; I79-N135 PolarHBondContact N-O 3.27Å
136	T	96.9	Very high	95.8	Very high	22 Å²	22	62.9 Å²	62.9	14%	0.135	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	152.3	174.8	68.4	0	0	0	0	111.8	F43 I79 V81 L126 G133 K134	F43-T136 HydrophobicContact CE2-CG2 4.28Å; F43-T136 WeakPolarHBondContact CE2-OG1 3.3Å; F43-T136 HydrophobicContact CZ-CG2 4.02Å; I79-T136 HydrophobicContact CB-CG2 4.34Å; I79-T136 CarbonylContact O-C 3.52Å; I79-T136 WeakPolarHBondContact O-CA 3.05Å; V81-T136 HydrophobicContact CG2-CG2 4.01Å; L126-T136 HydrophobicContact CD1-CG2 4.12Å; G133-T136 PolarHBondContact O-OG1 2.81Å; K134-T136 WeakPolarHBondContact O-CG2 3.46Å; K134-T136 PolarHBondContact O-N 3.49Å; K134-T136 VanDerWaalsContact O-N 3.14Å
137	V	97	Very high	95.7	Very high	18 Å²	18	66.4 Å²	66.4	11%	0.109	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	114	170.3	-178.7	0	0	0	0	109	M70 R75 K78 I79 V81 I139	M70-V137 HydrophobicContact CE-CB 3.51Å; M70-V137 HydrophobicContact CE-CG1 3.37Å; M70-V137 HydrophobicContact CE-CG2 3.95Å; M70-V137 HydrophobicContact SD-CB 4.34Å; R75-V137 HydrophobicContact CB-CG2 4.34Å; R75-V137 HydrophobicContact CG-CG2 4.09Å; K78-V137 HydrophobicContact CB-CG2 3.85Å; K78-V137 HydrophobicContact CD-CG2 3.79Å; K78-V137 HydrophobicContact CG-CG2 4.44Å; I79-V137 PolarHBondContact O-N 2.88Å; V81-V137 PolarHBondContact N-O 3.28Å; V137-I139 HydrophobicContact CG1-CG1 4.14Å; V137-I139 PolarHBondContact O-N 3.44Å
138	L	96.6	Very high	95.7	Very high	48 Å²	48	67 Å²	67	25%	0.251	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	119.4	177.2	-76.9	173.3	0	0	0	111.3	F43 I46 I47 V81	F43-L138 HydrophobicContact CD2-CD1 3.54Å; F43-L138 HydrophobicContact CD2-CD2 4.13Å; F43-L138 HydrophobicContact CD2-CG 3.75Å; F43-L138 HydrophobicContact CE2-CD1 3.89Å; F43-L138 HydrophobicContact CE2-CD2 3.6Å; F43-L138 HydrophobicContact CE2-CG 3.57Å; F43-L138 HydrophobicContact CZ-CD2 4.38Å; I46-L138 HydrophobicContact CB-CD1 4.25Å; I46-L138 HydrophobicContact CD1-CD1 4.35Å; I46-L138 HydrophobicContact CG2-CD1 3.9Å; I47-L138 HydrophobicContact CD1-CD2 4.39Å; I47-L138 HydrophobicContact CG1-CD2 4.07Å; V81-L138 HydrophobicContact CB-CD2 3.96Å; V81-L138 HydrophobicContact CG1-CD2 3.73Å
139	I	96.5	Very high	95.7	Very high	9 Å²	9	63.4 Å²	63.4	5%	0.046	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.1	-179	-47.3	170.1	0	0	0	109.9	R50 L61 L66 V69 M70 A80 V81 V137	R50-I139 PolarHBondContact NH1-O 3.1Å; L61-I139 HydrophobicContact CD1-CG2 3.9Å; L61-I139 HydrophobicContact CD2-CB 4.02Å; L61-I139 HydrophobicContact CD2-CG2 3.59Å; L61-I139 HydrophobicContact CG-CG2 4.44Å; L66-I139 HydrophobicContact CD1-CD1 3.6Å; V69-I139 HydrophobicContact CB-CD1 4.3Å; V69-I139 HydrophobicContact CG1-CD1 3.94Å; V69-I139 HydrophobicContact CG1-CG1 3.89Å; V69-I139 HydrophobicContact CG1-CG2 4.3Å; V69-I139 HydrophobicContact CG2-CG2 4.43Å; M70-I139 HydrophobicContact CE-CD1 3.52Å; M70-I139 HydrophobicContact CE-CG1 4.17Å; M70-I139 HydrophobicContact SD-CD1 4.41Å; A80-I139 HydrophobicContact CB-CD1 4.07Å; V81-I139 PolarHBondContact O-N 3.18Å; V137-I139 HydrophobicContact CG1-CG1 4.14Å; V137-I139 PolarHBondContact O-N 3.44Å
140	Q	96.1	Very high	95.7	Very high	72 Å²	72	65.7 Å²	65.7	34%	0.336	35%	0.348	S	S	.	.			trans	-126.6	143.6	172.9	-58.8	-171	-80.9	0	0	110.3	R50	R50-Q140 VanDerWaalsContact CZ-CD 3.42Å; R50-Q140 VanDerWaalsContact NH2-CD 3.26Å
141	G	95.6	Very high	95.8	Very high	6 Å²	6	66.2 Å²	66.2	6%	0.062	35%	0.348	C	S	.	.			trans	-67.1	162.3	168.3	0	0	0	0	0	112.1	P59 R143	P59-G141 VanDerWaalsContact CG-O 3.28Å; P59-G141 WeakPolarHBondContact CG-O 3.42Å; G141-R143 PolarHBondContact O-N 3.31Å
142	P	96.3	Very high	95.9	Very high	57 Å²	57	69.7 Å²	69.7	37%	0.37	36%	0.358	S	S	.	.			trans	-69.8	114.8	178.2	28.5	-32.9	0	0	0	111.5
143	R	95.1	Very high	95.8	Very high	98 Å²	98	68.9 Å²	68.9	37%	0.37	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-74.3	-31.9	-179.7	-68	178.2	173.9	170.3	-3.2	113.9	M53 N57 P59 G141 G145	M53-R143 PolarHBondContact SD-NH2 2.75Å; N57-R143 PolarHBondContact O-NE 3.39Å; P59-R143 HydrophobicContact CG-CG 3.95Å; G141-R143 PolarHBondContact O-N 3.31Å; R143-G145 VanDerWaalsContact C-N 3.32Å; R143-G145 PolarHBondContact O-N 3.42Å
144	K	95.4	Very high	95.9	Very high	180 Å²	180	72.4 Å²	72.4	78%	0.783	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-85.5	2.6	-177.5	-64	-172.7	178.3	-176.1	0	114	R146 V149	K144-R146 PolarHBondContact O-N 2.96Å; K144-V149 HydrophobicContact CB-CG1 4.14Å; K144-V149 HydrophobicContact CG-CG1 4.33Å
145	G	93.2	Very high	95.9	Very high	60 Å²	60	68.6 Å²	68.6	62%	0.619	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-75.1	-4.3	-176.8	0	0	0	0	0	115.5	R143	R143-G145 VanDerWaalsContact C-N 3.32Å; R143-G145 PolarHBondContact O-N 3.42Å
146	R	96	Very high	96	Very high	106 Å²	106	65 Å²	65	40%	0.4	37%	0.368	S	S	.	.	S	Bend	trans	-81.2	145.9	-175.8	-65.5	176.4	65	-141.9	0.9	111.8	K144 A148 V149	K144-R146 PolarHBondContact O-N 2.96Å; R146-A148 VanDerWaalsContact C-N 3.27Å; R146-A148 PolarHBondContact O-N 2.89Å; R146-V149 HydrophobicContact CB-CG2 4.28Å; R146-V149 WeakPolarHBondContact O-CB 3.5Å; R146-V149 PolarHBondContact O-N 3.28Å
147	T	95.8	Very high	95.8	Very high	74 Å²	74	66.6 Å²	66.6	45%	0.454	39%	0.388	S	S	.	.	H	α-helix	trans	-56.1	-39.6	174.2	-51.2	0	0	0	0	112.9	V149 K150 H151 R164	T147-V149 PolarHBondContact O-N 3.4Å; T147-K150 WeakPolarHBondContact O-CA 3.43Å; T147-K150 VanDerWaalsContact O-CB 3.28Å; T147-K150 WeakPolarHBondContact O-CB 3.28Å; T147-K150 PolarHBondContact O-N 2.91Å; T147-H151 PolarHBondContact O-CD2 3.36Å; T147-H151 VanDerWaalsContact O-CD2 3.25Å; T147-R164 VanDerWaalsContact CG2-NH1 3.27Å
148	A	96.3	Very high	95.7	Very high	31 Å²	31	67.1 Å²	67.1	26%	0.256	39%	0.394	S	S	.	.	H	α-helix	trans	-53	-38.6	176.1	0	0	0	0	0	112.7	R146 K150 H151 F152	R146-A148 VanDerWaalsContact C-N 3.27Å; R146-A148 PolarHBondContact O-N 2.89Å; A148-K150 PolarHBondContact O-N 3.31Å; A148-H151 PolarHBondContact O-N 3.25Å; A148-H151 VanDerWaalsContact O-N 3.16Å; A148-F152 HydrophobicContact CB-CZ 4.48Å
149	V	96.5	Very high	95.7	Very high	45 Å²	45	70 Å²	70	27%	0.273	42%	0.416	S	S	.	.	H	α-helix	trans	-69.1	-23.3	-180	-178.4	0	0	0	0	111.9	K144 R146 T147 H151 F152	K144-V149 HydrophobicContact CB-CG1 4.14Å; K144-V149 HydrophobicContact CG-CG1 4.33Å; R146-V149 HydrophobicContact CB-CG2 4.28Å; R146-V149 WeakPolarHBondContact O-CB 3.5Å; R146-V149 PolarHBondContact O-N 3.28Å; T147-V149 PolarHBondContact O-N 3.4Å; V149-H151 PolarHBondContact O-N 3.37Å; V149-F152 HydrophobicContact CG2-CD2 4.49Å; V149-F152 PolarHBondContact O-N 3.43Å
150	K	96.3	Very high	95.5	Very high	127 Å²	127	74.6 Å²	74.6	55%	0.552	45%	0.449	S	S	*	.	H	α-helix	trans	-72.8	-18	175.7	-57	-174.9	176.9	-176.1	0	113.1	T147 A148 R164	T147-K150 WeakPolarHBondContact O-CA 3.43Å; T147-K150 VanDerWaalsContact O-CB 3.28Å; T147-K150 WeakPolarHBondContact O-CB 3.28Å; T147-K150 PolarHBondContact O-N 2.91Å; A148-K150 PolarHBondContact O-N 3.31Å; K150-R164 HydrophobicContact CB-CB 4.23Å; K150-R164 WeakPolarHBondContact O-CB 3.5Å; K150-R164 PolarHBondContact O-N 3.17Å
151	H	97	Very high	95.5	Very high	29 Å²	29	71.6 Å²	71.6	13%	0.134	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-7.2	177.2	-63.1	-75	0	0	0	112.8	T147 A148 V149 T163 R164 P165 Y166	T147-H151 PolarHBondContact O-CD2 3.36Å; T147-H151 VanDerWaalsContact O-CD2 3.25Å; A148-H151 PolarHBondContact O-N 3.25Å; A148-H151 VanDerWaalsContact O-N 3.16Å; V149-H151 PolarHBondContact O-N 3.37Å; H151-T163 VanDerWaalsContact C-CG2 3.45Å; H151-T163 VanDerWaalsContact O-CG2 3.23Å; H151-T163 WeakPolarHBondContact O-CG2 3.21Å; H151-R164 PolarHBondContact ND1-O 2.66Å; H151-P165 PolarHBondContact CE1-O 3.16Å; H151-Y166 HydrophobicContact CB-CE1 3.86Å; H151-Y166 HydrophobicContact CB-CE2 3.84Å; H151-Y166 WeakPolarHBondContact CB-OH 3.4Å; H151-Y166 AromaticContact CD2-CE1 3.58Å; H151-Y166 AromaticContact CE1-CD1 3.71Å; H151-Y166 AromaticContact CE1-CE1 3.83Å; H151-Y166 AromaticContact CG-CE1 3.42Å; H151-Y166 VanDerWaalsContact CG-CE1 3.42Å; H151-Y166 AromaticContact CG-CZ 3.5Å; H151-Y166 AromaticContact ND1-CD1 3.69Å; H151-Y166 AromaticContact ND1-CE1 3.6Å; H151-Y166 AromaticContact ND1-CZ 3.89Å; H151-Y166 AromaticContact NE2-CE1 3.89Å
152	F	96.3	Very high	95.4	Very high	129 Å²	129	80 Å²	80	57%	0.566	47%	0.473	S	S	*	.			trans	-88.4	151.9	175.2	-58.5	-24.5	0	0	0	110.5	A148 V149	A148-F152 HydrophobicContact CB-CZ 4.48Å; V149-F152 HydrophobicContact CG2-CD2 4.49Å; V149-F152 PolarHBondContact O-N 3.43Å
153	G	95.2	Very high	95.5	Very high	62 Å²	62	77.8 Å²	77.8	64%	0.639	46%	0.459	S	S	*	.	S	Bend	trans	122.9	-166.1	-179.6	0	0	0	0	0	111.6
154	P	95.9	Very high	95.4	Very high	88 Å²	88	78.4 Å²	78.4	57%	0.571	46%	0.461	S	S	*	.	S	Bend	trans	-55.8	153.2	174.1	-22.5	33.3	0	0	0	111.2	A158 S161 T163	P154-A158 HydrophobicContact CB-CB 4.35Å; P154-S161 PolarHBondContact O-OG 2.67Å; P154-S161 VanDerWaalsContact O-OG 3.08Å; P154-T163 WeakPolarHBondContact O-CB 3.04Å; P154-T163 PolarHBondContact O-OG1 2.98Å
155	A	95.6	Very high	95.5	Very high	64 Å²	64	71.1 Å²	71.1	53%	0.529	43%	0.432	S	S	.	.			trans	-51.6	143.7	-177.8	0	0	0	0	0	111.5	G157 A158 S161	A155-G157 PolarHBondContact O-N 3.38Å; A155-A158 HydrophobicContact CB-CB 4.42Å; A155-A158 WeakPolarHBondContact O-CB 3.23Å; A155-A158 PolarHBondContact O-N 3Å; A155-S161 VanDerWaalsContact O-CB 3.26Å; A155-S161 WeakPolarHBondContact O-CB 3.11Å; A155-S161 PolarHBondContact O-OG 3.49Å
156	P	95.4	Very high	95.6	Very high	41 Å²	41	76 Å²	76	27%	0.266	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-12.6	-179.7	-26.5	34.5	0	0	0	115.4	T163 P165 R180 K188	P156-T163 HydrophobicContact CG-CG2 4.12Å; P156-P165 HydrophobicContact CB-CB 4.14Å; P156-P165 HydrophobicContact CG-CB 4.33Å; P156-R180 PolarHBondContact O-NH1 3.29Å; P156-K188 WeakPolarHBondContact O-CD 3.49Å; P156-K188 VanDerWaalsContact O-CE 3.29Å; P156-K188 WeakPolarHBondContact O-CE 3.35Å; P156-K188 PolarHBondContact O-NZ 2.77Å
157	G	94.5	Very high	95.5	Very high	55 Å²	55	73.2 Å²	73.2	57%	0.567	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-2.9	175.3	0	0	0	0	0	114.5	A155 K188	A155-G157 PolarHBondContact O-N 3.38Å; G157-K188 WeakPolarHBondContact O-CB 3.45Å
158	A	95.2	Very high	95.4	Very high	28 Å²	28	78.2 Å²	78.2	23%	0.231	45%	0.45	C	S	.	.	S	Bend	trans	-71.5	148.6	177.6	0	0	0	0	0	111.1	P154 A155 S161	P154-A158 HydrophobicContact CB-CB 4.35Å; A155-A158 HydrophobicContact CB-CB 4.42Å; A155-A158 WeakPolarHBondContact O-CB 3.23Å; A155-A158 PolarHBondContact O-N 3Å; A158-S161 WeakPolarHBondContact O-CB 3.24Å; A158-S161 PolarHBondContact O-N 3.35Å; A158-S161 VanDerWaalsContact O-N 3.16Å
159	P	94.7	Very high	95.4	Very high	109 Å²	109	79.4 Å²	79.4	71%	0.708	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	138.9	179	22.5	-31.8	0	0	0	111.4	S161 K188	P159-S161 PolarHBondContact O-N 3.17Å; P159-K188 VanDerWaalsContact CA-OXT 3.32Å; P159-K188 WeakPolarHBondContact CA-OXT 3.49Å
160	S	92.9	Very high	95.3	Very high	106 Å²	106	86.1 Å²	86.1	74%	0.741	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	4.3	-178.3	-58.6	0	0	0	0	115.8	H162	S160-H162 PolarHBondContact O-CE1 3.19Å; S160-H162 PolarHBondContact O-ND1 3.46Å
161	S	95.7	Very high	95.2	Very high	9 Å²	9	81.1 Å²	81.1	6%	0.063	47%	0.466	C	S	.	.			trans	-74.5	131.9	176.8	178.3	0	0	0	0	111.2	P154 A155 A158 P159 T163 K188	P154-S161 PolarHBondContact O-OG 2.67Å; P154-S161 VanDerWaalsContact O-OG 3.08Å; A155-S161 VanDerWaalsContact O-CB 3.26Å; A155-S161 WeakPolarHBondContact O-CB 3.11Å; A155-S161 PolarHBondContact O-OG 3.49Å; A158-S161 WeakPolarHBondContact O-CB 3.24Å; A158-S161 PolarHBondContact O-N 3.35Å; A158-S161 VanDerWaalsContact O-N 3.16Å; P159-S161 PolarHBondContact O-N 3.17Å; S161-T163 PolarHBondContact OG-N 3.39Å; S161-T163 PolarHBondContact OG-OG1 2.83Å; S161-K188 PolarHBondContact O-NZ 3.03Å
162	H	95.2	Very high	95.1	Very high	181 Å²	181	89.1 Å²	89.1	84%	0.838	50%	0.495	S	S	*	.			trans	-106.9	12.3	174.7	-64.9	80.5	0	0	0	112.5	S160 R164	S160-H162 PolarHBondContact O-CE1 3.19Å; S160-H162 PolarHBondContact O-ND1 3.46Å; H162-R164 PolarHBondContact O-N 2.73Å
163	T	96.8	Very high	95.1	Very high	12 Å²	12	91.2 Å²	91.2	7%	0.074	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-60.7	130.5	179.4	-53.7	0	0	0	0	110.5	H151 P154 P156 S161	H151-T163 VanDerWaalsContact C-CG2 3.45Å; H151-T163 VanDerWaalsContact O-CG2 3.23Å; H151-T163 WeakPolarHBondContact O-CG2 3.21Å; P154-T163 WeakPolarHBondContact O-CB 3.04Å; P154-T163 PolarHBondContact O-OG1 2.98Å; P156-T163 HydrophobicContact CG-CG2 4.12Å; S161-T163 PolarHBondContact OG-N 3.39Å; S161-T163 PolarHBondContact OG-OG1 2.83Å
164	R	94.7	Very high	95	Very high	110 Å²	110	93.2 Å²	93.2	42%	0.415	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-71.3	127.4	178.2	-175.8	-177.2	170.6	-175.9	-1.6	109.3	T147 K150 H151 H162	T147-R164 VanDerWaalsContact CG2-NH1 3.27Å; K150-R164 HydrophobicContact CB-CB 4.23Å; K150-R164 WeakPolarHBondContact O-CB 3.5Å; K150-R164 PolarHBondContact O-N 3.17Å; H151-R164 PolarHBondContact ND1-O 2.66Å; H162-R164 PolarHBondContact O-N 2.73Å
165	P	95.6	Very high	94.8	Very high	27 Å²	27	93.5 Å²	93.5	18%	0.175	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-70.8	155.3	173	32.1	-37.6	0	0	0	111.6	H151 P156 T167 E175	H151-P165 PolarHBondContact CE1-O 3.16Å; P156-P165 HydrophobicContact CB-CB 4.14Å; P156-P165 HydrophobicContact CG-CB 4.33Å; P165-T167 HydrophobicContact CB-CG2 4.49Å; P165-T167 HydrophobicContact CG-CG2 4.31Å; P165-T167 PolarHBondContact O-N 2.97Å; P165-E175 WeakPolarHBondContact CB-OE2 3.21Å; P165-E175 VanDerWaalsContact CG-OE2 3.24Å; P165-E175 WeakPolarHBondContact CG-OE2 3.27Å
166	Y	96.2	Very high	94.8	Very high	163 Å²	163	95 Å²	95	64%	0.639	48%	0.484	S	S	*	.			trans	-81	108.7	169.1	-70.1	-72.3	0	0	0	109	H151	H151-Y166 HydrophobicContact CB-CE1 3.86Å; H151-Y166 HydrophobicContact CB-CE2 3.84Å; H151-Y166 WeakPolarHBondContact CB-OH 3.4Å; H151-Y166 AromaticContact CD2-CE1 3.58Å; H151-Y166 AromaticContact CE1-CD1 3.71Å; H151-Y166 AromaticContact CE1-CE1 3.83Å; H151-Y166 AromaticContact CG-CE1 3.42Å; H151-Y166 VanDerWaalsContact CG-CE1 3.42Å; H151-Y166 AromaticContact CG-CZ 3.5Å; H151-Y166 AromaticContact ND1-CD1 3.69Å; H151-Y166 AromaticContact ND1-CE1 3.6Å; H151-Y166 AromaticContact ND1-CZ 3.89Å; H151-Y166 AromaticContact NE2-CE1 3.89Å
167	T	93.7	Very high	94.7	Very high	47 Å²	47	96 Å²	96	29%	0.288	50%	0.496	S	S	.	.			trans	-126.4	137.7	178.9	40	0	0	0	0	108.4	P165 E175	P165-T167 HydrophobicContact CB-CG2 4.49Å; P165-T167 HydrophobicContact CG-CG2 4.31Å; P165-T167 PolarHBondContact O-N 2.97Å; T167-E175 HydrophobicContact CG2-CB 4Å; T167-E175 VanDerWaalsContact CG2-CD 3.44Å; T167-E175 HydrophobicContact CG2-CG 3.72Å; T167-E175 WeakPolarHBondContact CG2-OE1 3.26Å
168	I	94.7	Very high	94.7	Very high	180 Å²	180	101.7 Å²	101.7	92%	0.923	50%	0.5	S	S	*	.	S	Bend	trans	-66.5	-47.4	177.6	-58.3	172	0	0	0	109.6
169	S	94.6	Very high	94.7	Very high	55 Å²	55	100.8 Å²	100.8	39%	0.385	49%	0.493	S	S	.	.	S	Bend	trans	-125.1	154.9	179.4	-73.8	0	0	0	0	111.5	F174	S169-F174 WeakPolarHBondContact O-CB 3.4Å; S169-F174 WeakPolarHBondContact O-CG 2.92Å
170	K	94.6	Very high	94.7	Very high	186 Å²	186	98.8 Å²	98.8	81%	0.809	47%	0.472	S	S	*	.			trans	-113.5	126	175.5	-173.1	-175.9	178.6	-170.3	0	109.3
171	G	94.7	Very high	94.7	Very high	22 Å²	22	98.9 Å²	98.9	23%	0.227	46%	0.455	C	S	.	.	S	Bend	trans	-179.4	-174.9	-177	0	0	0	0	0	112.7	K173 F174 K176	G171-K173 VanDerWaalsContact C-N 3.31Å; G171-K173 PolarHBondContact O-N 2.95Å; G171-F174 PolarHBondContact O-N 3.16Å; G171-K176 WeakPolarHBondContact O-CD 3.18Å; G171-K176 VanDerWaalsContact O-CE 3.27Å; G171-K176 WeakPolarHBondContact O-CE 3.39Å
172	R	95.2	Very high	94.7	Very high	197 Å²	197	102.1 Å²	102.1	74%	0.743	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-38.8	180	-173.9	177.9	73.4	84.7	-8.1	112.3
173	K	95.2	Very high	94.8	Very high	174 Å²	174	98 Å²	98	76%	0.757	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	4.6	-175.6	-63.1	-175.2	178.8	-178.6	0	114.3	G171	G171-K173 VanDerWaalsContact C-N 3.31Å; G171-K173 PolarHBondContact O-N 2.95Å
174	F	95	Very high	94.7	Very high	104 Å²	104	105 Å²	105	46%	0.456	50%	0.499	S	S	.	.	S	Bend	trans	-116.8	112	-177.3	-55.3	-73.2	0	0	0	111	S169 G171 K176	S169-F174 WeakPolarHBondContact O-CB 3.4Å; S169-F174 WeakPolarHBondContact O-CG 2.92Å; G171-F174 PolarHBondContact O-N 3.16Å; F174-K176 VanDerWaalsContact C-N 3.31Å; F174-K176 PolarHBondContact O-N 2.96Å
175	E	91.7	Very high	94.7	Very high	94 Å²	94	103.9 Å²	103.9	44%	0.439	51%	0.513	S	S	.	.	S	Bend	trans	47.1	43.7	176.4	-75.1	-161.1	-139.5	0	0	115.5	P165 T167 R180	P165-E175 WeakPolarHBondContact CB-OE2 3.21Å; P165-E175 VanDerWaalsContact CG-OE2 3.24Å; P165-E175 WeakPolarHBondContact CG-OE2 3.27Å; T167-E175 HydrophobicContact CG2-CB 4Å; T167-E175 VanDerWaalsContact CG2-CD 3.44Å; T167-E175 HydrophobicContact CG2-CG 3.72Å; T167-E175 WeakPolarHBondContact CG2-OE1 3.26Å; E175-R180 WeakPolarHBondContact O-CG 3.29Å; E175-R180 IonicContact OE2-NH2 2.98Å; E175-R180 PolarHBondContact OE2-NH2 2.98Å
176	K	94.2	Very high	94.7	Very high	95 Å²	95	108.2 Å²	108.2	41%	0.413	53%	0.527	S	S	.	.			trans	-122.9	5.3	176	-70.5	-168.5	-176.2	-175.1	0	114.8	G171 F174 R181	G171-K176 WeakPolarHBondContact O-CD 3.18Å; G171-K176 VanDerWaalsContact O-CE 3.27Å; G171-K176 WeakPolarHBondContact O-CE 3.39Å; F174-K176 VanDerWaalsContact C-N 3.31Å; F174-K176 PolarHBondContact O-N 2.96Å; K176-R181 VanDerWaalsContact O-CZ 3.28Å; K176-R181 PolarHBondContact O-NE 3.4Å; K176-R181 PolarHBondContact O-NH2 3.03Å
177	A	93.6	Very high	94.6	Very high	63 Å²	63	107.3 Å²	107.3	52%	0.521	53%	0.527	S	S	.	.	S	Bend	trans	-91.2	-123.1	-175.2	0	0	0	0	0	111.6	R180	A177-R180 PolarHBondContact O-N 3.08Å
178	R	95.6	Very high	94.3	Very high	174 Å²	174	108.2 Å²	108.2	66%	0.657	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	138.2	178.5	-173.8	174.6	-175.8	-143.7	-5.3	111.3	R180 R184 Y186	R178-R180 VanDerWaalsContact C-N 3.3Å; R178-R180 PolarHBondContact O-N 2.98Å; R178-R184 HydrophobicContact CB-CB 4.46Å; R178-R184 WeakPolarHBondContact CG-O 3.43Å; R178-Y186 HydrophobicContact CG-CD1 4.12Å; R178-Y186 HydrophobicContact CG-CE1 3.62Å; R178-Y186 VanDerWaalsContact NE-CE1 3.35Å
179	G	93.9	Very high	94.3	Very high	8 Å²	8	104.6 Å²	104.6	8%	0.082	51%	0.507	C	S	.	.	B	Isolated β-bridge	trans	82.3	-5.7	-179.2	0	0	0	0	0	115.4	Y186 K188	G179-Y186 VanDerWaalsContact CA-CE2 3.47Å; G179-Y186 WeakPolarHBondContact CA-O 3.35Å; G179-Y186 PolarHBondContact N-O 3Å; G179-K188 WeakPolarHBondContact O-CG 3.2Å; G179-K188 PolarHBondContact O-N 2.8Å
180	R	94.5	Very high	94.3	Very high	68 Å²	68	107.2 Å²	107.2	26%	0.257	51%	0.513	S	S	.	.	B	Isolated β-bridge	trans	-114.5	-13	176.6	-59.5	-67.6	-166.9	-158	-5	113.9	P156 E175 A177 R178 K188	P156-R180 PolarHBondContact O-NH1 3.29Å; E175-R180 WeakPolarHBondContact O-CG 3.29Å; E175-R180 IonicContact OE2-NH2 2.98Å; E175-R180 PolarHBondContact OE2-NH2 2.98Å; A177-R180 PolarHBondContact O-N 3.08Å; R178-R180 VanDerWaalsContact C-N 3.3Å; R178-R180 PolarHBondContact O-N 2.98Å; R180-K188 VanDerWaalsContact NH1-CD 3.27Å; R180-K188 VanDerWaalsContact NH1-NZ 3.12Å
181	R	94.1	Very high	94.3	Very high	107 Å²	107	102.8 Å²	102.8	40%	0.404	50%	0.497	S	S	.	.	S	Bend	trans	-147	142	-178.9	60.5	179.1	77.9	-166	1.4	110.3	K176 S183 R184 Y186	K176-R181 VanDerWaalsContact O-CZ 3.28Å; K176-R181 PolarHBondContact O-NE 3.4Å; K176-R181 PolarHBondContact O-NH2 3.03Å; R181-S183 VanDerWaalsContact C-N 3.25Å; R181-S183 WeakPolarHBondContact CD-OG 3.32Å; R181-S183 PolarHBondContact O-N 3Å; R181-R184 HydrophobicContact CG-CB 4.1Å; R181-R184 HydrophobicContact CG-CG 3.86Å; R181-R184 PolarHBondContact O-N 3.27Å; R181-Y186 VanDerWaalsContact O-O 3.05Å
182	A	95.3	Very high	94.3	Very high	77 Å²	77	107.6 Å²	107.6	64%	0.636	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.2	-177.6	0	0	0	0	0	112.4	R184	A182-R184 PolarHBondContact O-N 3.31Å
183	S	96.9	Very high	94.2	Very high	94 Å²	94	102 Å²	102	66%	0.657	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-3.3	179.2	59.1	0	0	0	0	115.7	R181	R181-S183 VanDerWaalsContact C-N 3.25Å; R181-S183 WeakPolarHBondContact CD-OG 3.32Å; R181-S183 PolarHBondContact O-N 3Å
184	R	95.1	Very high	94.1	Very high	160 Å²	160	97.2 Å²	97.2	60%	0.604	48%	0.481	S	S	*	.	S	Bend	trans	-124.5	69.4	176.3	-61	-64.4	-180	179.4	-1.7	109.2	R178 R181 A182 Y186	R178-R184 HydrophobicContact CB-CB 4.46Å; R178-R184 WeakPolarHBondContact CG-O 3.43Å; R181-R184 HydrophobicContact CG-CB 4.1Å; R181-R184 HydrophobicContact CG-CG 3.86Å; R181-R184 PolarHBondContact O-N 3.27Å; A182-R184 PolarHBondContact O-N 3.31Å; R184-Y186 PolarHBondContact O-N 2.89Å
185	A	95.1	Very high	94.1	Very high	86 Å²	86	96.7 Å²	96.7	71%	0.711	48%	0.483	S	S	*	.	S	Bend	trans	66.8	-56.2	-178.1	0	0	0	0	0	115.6
186	Y	95	Very high	94.3	Very high	119 Å²	119	96.9 Å²	96.9	47%	0.467	49%	0.486	S	S	.	.			trans	-151.3	159.8	-179.6	69.8	-85.4	0	0	0	112.5	R178 G179 R181 R184	R178-Y186 HydrophobicContact CG-CD1 4.12Å; R178-Y186 HydrophobicContact CG-CE1 3.62Å; R178-Y186 VanDerWaalsContact NE-CE1 3.35Å; G179-Y186 VanDerWaalsContact CA-CE2 3.47Å; G179-Y186 WeakPolarHBondContact CA-O 3.35Å; G179-Y186 PolarHBondContact N-O 3Å; R181-Y186 VanDerWaalsContact O-O 3.05Å; R184-Y186 PolarHBondContact O-N 2.89Å
187	K	93.7	Very high	94.3	Very high	144 Å²	144	97.1 Å²	97.1	63%	0.626	49%	0.492	S	S	*	.	B	Isolated β-bridge	trans	-119.5	130.3	171.2	-169.9	-173.8	170.5	-173.6	0	107.6
188	K	88.4	Confident	94.3	Very high	65 Å²	65	100.2 Å²	100.2	28%	0.283	49%	0.489	S	S	.	.			trans	-62.4	0	167.7	73.9	166.9	-162.1	155.5	0	111.9	P156 G157 P159 S161 G179 R180	P156-K188 WeakPolarHBondContact O-CD 3.49Å; P156-K188 VanDerWaalsContact O-CE 3.29Å; P156-K188 WeakPolarHBondContact O-CE 3.35Å; P156-K188 PolarHBondContact O-NZ 2.77Å; G157-K188 WeakPolarHBondContact O-CB 3.45Å; P159-K188 VanDerWaalsContact CA-OXT 3.32Å; P159-K188 WeakPolarHBondContact CA-OXT 3.49Å; S161-K188 PolarHBondContact O-NZ 3.03Å; G179-K188 WeakPolarHBondContact O-CG 3.2Å; G179-K188 PolarHBondContact O-N 2.8Å; R180-K188 VanDerWaalsContact NH1-CD 3.27Å; R180-K188 VanDerWaalsContact NH1-NZ 3.12Å

Retrieved 188 of 188 residues in 58.3 ms (Link to these results)

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