A0A3Q0KHD3_SCHMA Loading...

Large ribosomal subunit protein mL45

AlphaFold DB , UniProt , Accession A0A3Q0KHD3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 289 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	53.3	Low	66.5	Low	240 Å²	240	130.3 Å²	130.3	100%	1.182	69%	0.693	S	S	*	*				0	126.9	0	-74.7	159.3	86.3	0	0	106.7
2	Q	67.2	Low	66.2	Low	190 Å²	190	131.3 Å²	131.3	89%	0.888	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.2	138	169	-82.8	-177.2	-61.1	0	0	108.4	W4	Q2-W4 PolarHBondContact O-N 2.7Å
3	P	64.2	Low	65.8	Low	112 Å²	112	124.2 Å²	124.2	73%	0.727	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56.8	138.9	171.6	-18.2	30.6	0	0	0	109.4	D5	P3-D5 PolarHBondContact O-N 3.23Å
4	W	72.5	Confident	65.8	Low	204 Å²	204	127.1 Å²	127.1	77%	0.773	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-70.8	117.3	171.8	177.5	86.8	0	0	0	108.4	Q2 P6	Q2-W4 PolarHBondContact O-N 2.7Å; W4-P6 HydrophobicContact CE3-CB 4.4Å; W4-P6 VanDerWaalsContact CH2-CA 3.48Å; W4-P6 HydrophobicContact CH2-CB 3.58Å; W4-P6 HydrophobicContact CZ2-CB 4.42Å; W4-P6 HydrophobicContact CZ3-CB 3.56Å; W4-P6 HydrophobicContact CZ3-CG 4.25Å
5	D	69.5	Low	65.7	Low	137 Å²	137	123.6 Å²	123.6	73%	0.733	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-88.6	129.7	168.3	-77.5	-31.1	0	0	0	109	P3	P3-D5 PolarHBondContact O-N 3.23Å
6	P	66.5	Low	65.9	Low	83 Å²	83	123.3 Å²	123.3	54%	0.539	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-62.8	152.4	175.2	24	-30.8	0	0	0	111.3	W4	W4-P6 HydrophobicContact CE3-CB 4.4Å; W4-P6 VanDerWaalsContact CH2-CA 3.48Å; W4-P6 HydrophobicContact CH2-CB 3.58Å; W4-P6 HydrophobicContact CZ2-CB 4.42Å; W4-P6 HydrophobicContact CZ3-CB 3.56Å; W4-P6 HydrophobicContact CZ3-CG 4.25Å
7	P	69.8	Low	66.1	Low	109 Å²	109	127.8 Å²	127.8	71%	0.708	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57	143.2	174.2	23.2	-31.5	0	0	0	110.7	D9	P7-D9 PolarHBondContact O-N 3.35Å; P7-D9 VanDerWaalsContact O-N 3.13Å
8	V	68.2	Low	66.7	Low	78 Å²	78	129.7 Å²	129.7	47%	0.473	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-54.3	118.3	179	178.4	0	0	0	0	109.3	L10 N31	V8-L10 PolarHBondContact O-N 3.21Å; V8-L10 VanDerWaalsContact O-N 3.12Å; V8-N31 HydrophobicContact CG1-CB 4.28Å
9	D	64.4	Low	67.2	Low	114 Å²	114	125.7 Å²	125.7	61%	0.61	66%	0.664	S	S	*	*			trans	-72.7	103.9	178.8	-176.1	3.6	0	0	0	110.2	P7 S11	P7-D9 PolarHBondContact O-N 3.35Å; P7-D9 VanDerWaalsContact O-N 3.13Å; D9-S11 VanDerWaalsContact C-N 3.3Å; D9-S11 VanDerWaalsContact CG-OG 3.22Å; D9-S11 WeakPolarHBondContact OD1-CB 3.5Å; D9-S11 PolarHBondContact OD1-N 3.09Å; D9-S11 PolarHBondContact OD1-OG 3.04Å; D9-S11 PolarHBondContact OD2-OG 3.46Å
10	L	67.2	Low	68.2	Low	95 Å²	95	122.2 Å²	122.2	50%	0.497	65%	0.65	S	S	.	*	G	3₁₀ helix	trans	-83.6	-1.2	-177.5	-69.7	165.8	0	0	0	113.7	V8 N12 D13 M33	V8-L10 PolarHBondContact O-N 3.21Å; V8-L10 VanDerWaalsContact O-N 3.12Å; L10-N12 PolarHBondContact O-N 3.03Å; L10-D13 HydrophobicContact CD2-CB 4.07Å; L10-D13 WeakPolarHBondContact CD2-OD2 3.08Å; L10-D13 PolarHBondContact O-N 2.86Å; L10-D13 VanDerWaalsContact O-N 3.12Å; L10-M33 HydrophobicContact CD1-CE 3.91Å; L10-M33 HydrophobicContact CD2-CE 3.21Å; L10-M33 HydrophobicContact CD2-SD 3.7Å; L10-M33 HydrophobicContact CG-CE 3.99Å
11	S	68.7	Low	69	Low	71 Å²	71	121.2 Å²	121.2	50%	0.497	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-61.7	-31.1	-176	61.6	0	0	0	0	113.1	D9	D9-S11 VanDerWaalsContact C-N 3.3Å; D9-S11 VanDerWaalsContact CG-OG 3.22Å; D9-S11 WeakPolarHBondContact OD1-CB 3.5Å; D9-S11 PolarHBondContact OD1-N 3.09Å; D9-S11 PolarHBondContact OD1-OG 3.04Å; D9-S11 PolarHBondContact OD2-OG 3.46Å
12	N	62.7	Low	70.5	Confident	142 Å²	142	113 Å²	113	76%	0.759	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-96	-0.4	178.7	-73	-33.9	0	0	0	114.1	L10 K14	L10-N12 PolarHBondContact O-N 3.03Å; N12-K14 PolarHBondContact O-N 3.44Å
13	D	61.2	Low	71.4	Confident	39 Å²	39	107.7 Å²	107.7	21%	0.209	59%	0.593	C	S	.	*			trans	-84.5	42.4	-175.7	-105.5	-11.1	0	0	0	113.1	L10 A15 R27 N31	L10-D13 HydrophobicContact CD2-CB 4.07Å; L10-D13 WeakPolarHBondContact CD2-OD2 3.08Å; L10-D13 PolarHBondContact O-N 2.86Å; L10-D13 VanDerWaalsContact O-N 3.12Å; D13-A15 PolarHBondContact O-N 2.99Å; D13-R27 VanDerWaalsContact CG-NH1 3.31Å; D13-R27 IonicContact OD1-CZ 3.06Å; D13-R27 IonicContact OD1-NH1 3.88Å; D13-R27 PolarHBondContact OD1-NH1 2.81Å; D13-R27 IonicContact OD2-NH1 2.73Å; D13-N31 PolarHBondContact OD1-ND2 3.14Å; D13-N31 PolarHBondContact OD2-ND2 3.08Å
14	K	66.1	Low	72.3	Confident	165 Å²	165	105.3 Å²	105.3	72%	0.717	57%	0.573	S	S	*	*			trans	-75.2	127	172.8	-65.8	-175.9	-177.3	176.3	0	108.8	N12 N16	N12-K14 PolarHBondContact O-N 3.44Å; K14-N16 PolarHBondContact O-N 3.41Å; K14-N16 VanDerWaalsContact O-N 3.08Å
15	A	63.8	Low	72.9	Confident	75 Å²	75	103.6 Å²	103.6	62%	0.62	57%	0.567	S	S	*	*			trans	-60.5	114.3	171.1	0	0	0	0	0	108.5	D13 E17	D13-A15 PolarHBondContact O-N 2.99Å; A15-E17 PolarHBondContact O-N 2.94Å
16	N	68.9	Low	73.6	Confident	118 Å²	118	106.2 Å²	106.2	63%	0.631	57%	0.567	S	S	*	*			trans	-73.7	123.4	167.5	-76.7	-23.2	0	0	0	107.2	K14 N18 E19	K14-N16 PolarHBondContact O-N 3.41Å; K14-N16 VanDerWaalsContact O-N 3.08Å; N16-N18 PolarHBondContact O-N 3.21Å; N16-E19 HydrophobicContact CB-CB 4.26Å; N16-E19 WeakPolarHBondContact O-CB 3.43Å; N16-E19 PolarHBondContact O-N 3.31Å
17	E	70.1	Confident	74.3	Confident	201 Å²	201	104.7 Å²	104.7	94%	0.939	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-18	-179.7	-65.1	-178.9	167.1	0	0	113	A15	A15-E17 PolarHBondContact O-N 2.94Å
18	N	75.5	Confident	75.1	Confident	161 Å²	161	101.3 Å²	101.3	86%	0.861	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	5.8	179.6	-61.4	-26.9	0	0	0	114.5	N16 S20	N16-N18 PolarHBondContact O-N 3.21Å; N18-S20 PolarHBondContact O-N 3Å
19	E	77.1	Confident	75.9	Confident	55 Å²	55	107.3 Å²	107.3	26%	0.257	54%	0.54	S	S	.	.			trans	-69.9	126.5	179.9	-167.4	173.9	-158.4	0	0	110.5	N16 D23 L24 R27	N16-E19 HydrophobicContact CB-CB 4.26Å; N16-E19 WeakPolarHBondContact O-CB 3.43Å; N16-E19 PolarHBondContact O-N 3.31Å; E19-D23 HydrophobicContact CG-CB 3.7Å; E19-D23 VanDerWaalsContact OE1-C 3.28Å; E19-L24 HydrophobicContact CG-CB 4.22Å; E19-L24 PolarHBondContact OE1-N 3.44Å; E19-R27 IonicContact OE1-NE 3.97Å; E19-R27 PolarHBondContact OE1-NE 3.34Å; E19-R27 IonicContact OE2-CZ 2.81Å; E19-R27 IonicContact OE2-NE 2.86Å; E19-R27 PolarHBondContact OE2-NE 2.75Å; E19-R27 IonicContact OE2-NH2 2.91Å; E19-R27 PolarHBondContact OE2-NH2 3.44Å
20	S	86.7	Confident	76.7	Confident	55 Å²	55	112.4 Å²	112.4	39%	0.385	55%	0.551	S	S	.	*			trans	-60.2	146.4	173.1	173.6	0	0	0	0	110.2	N18 S22 D23 L24	N18-S20 PolarHBondContact O-N 3Å; S20-S22 PolarHBondContact O-N 2.8Å; S20-S22 PolarHBondContact OG-N 3.02Å; S20-S22 PolarHBondContact OG-OG 2.96Å; S20-D23 WeakPolarHBondContact CB-OD2 3.24Å; S20-D23 PolarHBondContact O-N 2.85Å; S20-L24 PolarHBondContact O-N 3.33Å
21	T	84.9	Confident	77.4	Confident	102 Å²	102	109.4 Å²	109.4	63%	0.626	54%	0.535	S	S	*	.	H	α-helix	trans	-54.3	-30.1	176.9	61.1	0	0	0	0	113.2	R25	T21-R25 WeakPolarHBondContact O-CG 3.21Å; T21-R25 PolarHBondContact O-N 2.9Å; T21-R25 VanDerWaalsContact O-N 3.11Å
22	S	85.3	Confident	78	Confident	66 Å²	66	109.3 Å²	109.3	46%	0.462	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-42.2	174.4	56.3	0	0	0	0	112.7	S20 R25 R26	S20-S22 PolarHBondContact O-N 2.8Å; S20-S22 PolarHBondContact OG-N 3.02Å; S20-S22 PolarHBondContact OG-OG 2.96Å; S22-R25 PolarHBondContact O-N 3.35Å; S22-R26 WeakPolarHBondContact O-CB 3.4Å; S22-R26 PolarHBondContact O-N 3.07Å
23	D	85.9	Confident	78.9	Confident	79 Å²	79	106.3 Å²	106.3	42%	0.422	53%	0.528	S	S	.	.	H	α-helix	trans	-72	-41.1	-178.1	-63.9	-28.5	0	0	0	109.9	E19 S20 R25 R26 R27	E19-D23 HydrophobicContact CG-CB 3.7Å; E19-D23 VanDerWaalsContact OE1-C 3.28Å; S20-D23 WeakPolarHBondContact CB-OD2 3.24Å; S20-D23 PolarHBondContact O-N 2.85Å; D23-R25 PolarHBondContact O-N 2.7Å; D23-R26 CarbonylContact O-C 3.47Å; D23-R26 WeakPolarHBondContact O-CA 3.46Å; D23-R26 WeakPolarHBondContact O-CB 3.29Å; D23-R26 PolarHBondContact O-N 3.04Å; D23-R27 WeakPolarHBondContact O-CB 3.43Å; D23-R27 PolarHBondContact O-N 2.83Å
24	L	84.3	Confident	79.9	Confident	62 Å²	62	109.5 Å²	109.5	33%	0.325	54%	0.544	S	S	.	.	H	α-helix	trans	-56.1	-48.9	170.7	178	63.4	0	0	0	111.2	E19 S20 R26 R27 L28	E19-L24 HydrophobicContact CG-CB 4.22Å; E19-L24 PolarHBondContact OE1-N 3.44Å; S20-L24 PolarHBondContact O-N 3.33Å; L24-R26 VanDerWaalsContact C-N 3.31Å; L24-R26 PolarHBondContact O-N 3.03Å; L24-R27 PolarHBondContact O-N 3.18Å; L24-L28 HydrophobicContact CD1-CD1 4.23Å; L24-L28 HydrophobicContact CD1-CG 4.29Å; L24-L28 HydrophobicContact CG-CD1 4.1Å; L24-L28 WeakPolarHBondContact O-CB 3.21Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 2.55Å
25	R	84.1	Confident	80.7	Confident	168 Å²	168	105.5 Å²	105.5	63%	0.634	54%	0.535	S	S	*	.	H	α-helix	trans	-61.6	-38.5	175.9	-78.6	178.7	-174.4	149.2	2	112.2	T21 S22 D23 R29	T21-R25 WeakPolarHBondContact O-CG 3.21Å; T21-R25 PolarHBondContact O-N 2.9Å; T21-R25 VanDerWaalsContact O-N 3.11Å; S22-R25 PolarHBondContact O-N 3.35Å; D23-R25 PolarHBondContact O-N 2.7Å; R25-R29 VanDerWaalsContact O-CB 3.25Å; R25-R29 WeakPolarHBondContact O-CB 3.2Å; R25-R29 PolarHBondContact O-N 3.33Å
26	R	83.8	Confident	81.6	Confident	193 Å²	193	106.8 Å²	106.8	73%	0.728	54%	0.537	S	S	*	.	H	α-helix	trans	-66.7	-41.4	177.9	-171.2	179.8	-178.5	-164	0.5	111.3	S22 D23 L24 R29 R30	S22-R26 WeakPolarHBondContact O-CB 3.4Å; S22-R26 PolarHBondContact O-N 3.07Å; D23-R26 CarbonylContact O-C 3.47Å; D23-R26 WeakPolarHBondContact O-CA 3.46Å; D23-R26 WeakPolarHBondContact O-CB 3.29Å; D23-R26 PolarHBondContact O-N 3.04Å; L24-R26 VanDerWaalsContact C-N 3.31Å; L24-R26 PolarHBondContact O-N 3.03Å; R26-R29 PolarHBondContact O-N 3.5Å; R26-R30 WeakPolarHBondContact O-CB 3.4Å; R26-R30 PolarHBondContact O-N 3.35Å
27	R	82.3	Confident	82.1	Confident	50 Å²	50	108.2 Å²	108.2	19%	0.189	54%	0.544	C	S	.	.	H	α-helix	trans	-63.3	-50.9	174.3	-176.7	173.5	66.4	88.8	-3.5	111.2	D13 E19 D23 L24 R29 R30 N31	D13-R27 VanDerWaalsContact CG-NH1 3.31Å; D13-R27 IonicContact OD1-CZ 3.06Å; D13-R27 IonicContact OD1-NH1 3.88Å; D13-R27 PolarHBondContact OD1-NH1 2.81Å; D13-R27 IonicContact OD2-NH1 2.73Å; E19-R27 IonicContact OE1-NE 3.97Å; E19-R27 PolarHBondContact OE1-NE 3.34Å; E19-R27 IonicContact OE2-CZ 2.81Å; E19-R27 IonicContact OE2-NE 2.86Å; E19-R27 PolarHBondContact OE2-NE 2.75Å; E19-R27 IonicContact OE2-NH2 2.91Å; E19-R27 PolarHBondContact OE2-NH2 3.44Å; D23-R27 WeakPolarHBondContact O-CB 3.43Å; D23-R27 PolarHBondContact O-N 2.83Å; L24-R27 PolarHBondContact O-N 3.18Å; R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 3.21Å; R27-R30 WeakPolarHBondContact O-CB 3.48Å; R27-R30 PolarHBondContact O-N 2.93Å; R27-N31 VanDerWaalsContact O-CG 3.29Å; R27-N31 PolarHBondContact O-N 2.94Å; R27-N31 PolarHBondContact O-OD1 3.5Å
28	L	85.3	Confident	82.5	Confident	39 Å²	39	103.9 Å²	103.9	20%	0.204	53%	0.527	C	S	.	.	H	α-helix	trans	-58.8	-40.7	176.2	-69.4	173.6	0	0	0	111.8	L24 N31 G32 M33	L24-L28 HydrophobicContact CD1-CD1 4.23Å; L24-L28 HydrophobicContact CD1-CG 4.29Å; L24-L28 HydrophobicContact CG-CD1 4.1Å; L24-L28 WeakPolarHBondContact O-CB 3.21Å; L24-L28 VanDerWaalsContact O-CG 3.27Å; L24-L28 WeakPolarHBondContact O-CG 3.38Å; L24-L28 PolarHBondContact O-N 2.55Å; L28-N31 PolarHBondContact O-N 2.91Å; L28-G32 PolarHBondContact O-N 3.04Å; L28-M33 HydrophobicContact CD2-CB 3.89Å; L28-M33 PolarHBondContact O-N 3.21Å
29	R	84.7	Confident	82.4	Confident	203 Å²	203	104.5 Å²	104.5	77%	0.766	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-40.6	174.7	-172.8	176.2	177.8	176.5	0	112.3	R25 R26 R27 N31 G32 L34	R25-R29 VanDerWaalsContact O-CB 3.25Å; R25-R29 WeakPolarHBondContact O-CB 3.2Å; R25-R29 PolarHBondContact O-N 3.33Å; R26-R29 PolarHBondContact O-N 3.5Å; R27-R29 VanDerWaalsContact C-N 3.29Å; R27-R29 PolarHBondContact O-N 3.21Å; R29-N31 VanDerWaalsContact C-N 3.29Å; R29-N31 PolarHBondContact O-N 2.82Å; R29-G32 PolarHBondContact O-N 2.93Å; R29-L34 HydrophobicContact CB-CD1 4.14Å
30	R	81.2	Confident	82.2	Confident	221 Å²	221	109 Å²	109	83%	0.834	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-38.6	175.4	179.9	-178.6	177.8	164.1	0.1	111.4	R26 R27 G32	R26-R30 WeakPolarHBondContact O-CB 3.4Å; R26-R30 PolarHBondContact O-N 3.35Å; R27-R30 WeakPolarHBondContact O-CB 3.48Å; R27-R30 PolarHBondContact O-N 2.93Å; R30-G32 VanDerWaalsContact C-N 3.33Å
31	N	82.5	Confident	82	Confident	32 Å²	32	113.8 Å²	113.8	17%	0.171	56%	0.559	C	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	1.3	-176.7	-59.3	-5.4	0	0	0	112.8	V8 D13 R27 L28 R29 M33	V8-N31 HydrophobicContact CG1-CB 4.28Å; D13-N31 PolarHBondContact OD1-ND2 3.14Å; D13-N31 PolarHBondContact OD2-ND2 3.08Å; R27-N31 VanDerWaalsContact O-CG 3.29Å; R27-N31 PolarHBondContact O-N 2.94Å; R27-N31 PolarHBondContact O-OD1 3.5Å; L28-N31 PolarHBondContact O-N 2.91Å; R29-N31 VanDerWaalsContact C-N 3.29Å; R29-N31 PolarHBondContact O-N 2.82Å; N31-M33 HydrophobicContact CB-CG 4.28Å; N31-M33 PolarHBondContact O-N 2.93Å
32	G	81.2	Confident	82	Confident	69 Å²	69	119.4 Å²	119.4	71%	0.711	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.3	17.8	-177.9	0	0	0	0	0	114.4	L28 R29 R30	L28-G32 PolarHBondContact O-N 3.04Å; R29-G32 PolarHBondContact O-N 2.93Å; R30-G32 VanDerWaalsContact C-N 3.33Å
33	M	82.5	Confident	81.9	Confident	79 Å²	79	120.8 Å²	120.8	39%	0.389	58%	0.576	S	S	.	*			trans	-106.1	26.9	-175.8	-61.8	-165.3	167.2	0	0	113.1	L10 L28 N31 P35	L10-M33 HydrophobicContact CD1-CE 3.91Å; L10-M33 HydrophobicContact CD2-CE 3.21Å; L10-M33 HydrophobicContact CD2-SD 3.7Å; L10-M33 HydrophobicContact CG-CE 3.99Å; L28-M33 HydrophobicContact CD2-CB 3.89Å; L28-M33 PolarHBondContact O-N 3.21Å; N31-M33 HydrophobicContact CB-CG 4.28Å; N31-M33 PolarHBondContact O-N 2.93Å; M33-P35 WeakPolarHBondContact O-CD 3.39Å
34	L	82.6	Confident	82	Confident	106 Å²	106	123.3 Å²	123.3	56%	0.555	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.3	124.2	174.6	-154	94.4	0	0	0	108	R29	R29-L34 HydrophobicContact CB-CD1 4.14Å
35	P	81.2	Confident	82.1	Confident	82 Å²	82	127.5 Å²	127.5	53%	0.532	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-58.6	141.8	177.2	23.7	-33.7	0	0	0	109.2	M33	M33-P35 WeakPolarHBondContact O-CD 3.39Å
36	P	82.9	Confident	82.3	Confident	102 Å²	102	122.9 Å²	122.9	66%	0.662	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-58.9	153.8	173.5	27.1	-34.3	0	0	0	109.7	L38	P36-L38 PolarHBondContact O-N 3.21Å
37	L	80.3	Confident	82.5	Confident	147 Å²	147	115 Å²	115	77%	0.77	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-59	117.3	168.1	-69.3	174.4	0	0	0	108	F39	L37-F39 HydrophobicContact CB-CD2 4.48Å; L37-F39 HydrophobicContact CB-CE2 3.91Å; L37-F39 HydrophobicContact CB-CZ 4.26Å; L37-F39 HydrophobicContact CD1-CZ 4.43Å; L37-F39 WeakPolarHBondContact O-CD2 3.21Å; L37-F39 PolarHBondContact O-N 3.08Å; L37-F39 VanDerWaalsContact O-N 3.15Å
38	L	78.7	Confident	83	Confident	111 Å²	111	114 Å²	114	58%	0.581	58%	0.575	S	S	*	*			trans	-79.9	98.4	-180	-61.5	172.9	0	0	0	108.2	P36 Y40	P36-L38 PolarHBondContact O-N 3.21Å; L38-Y40 HydrophobicContact CB-CD2 4.13Å; L38-Y40 HydrophobicContact CB-CE1 4.36Å; L38-Y40 HydrophobicContact CB-CE2 3.52Å; L38-Y40 HydrophobicContact CD1-CE2 4.25Å; L38-Y40 WeakPolarHBondContact CD1-OH 3.4Å; L38-Y40 HydrophobicContact CG-CE2 4.5Å; L38-Y40 PolarHBondContact O-N 2.96Å
39	F	73.5	Confident	83.3	Confident	173 Å²	173	113 Å²	113	76%	0.759	57%	0.569	S	S	*	*			trans	-81.7	105.3	165.4	-62.6	-80.1	0	0	0	107.8	L37 D41	L37-F39 HydrophobicContact CB-CD2 4.48Å; L37-F39 HydrophobicContact CB-CE2 3.91Å; L37-F39 HydrophobicContact CB-CZ 4.26Å; L37-F39 HydrophobicContact CD1-CZ 4.43Å; L37-F39 WeakPolarHBondContact O-CD2 3.21Å; L37-F39 PolarHBondContact O-N 3.08Å; L37-F39 VanDerWaalsContact O-N 3.15Å; F39-D41 PolarHBondContact O-N 3.46Å
40	Y	72	Confident	83.6	Confident	149 Å²	149	104.6 Å²	104.6	58%	0.584	55%	0.546	S	S	*	.			trans	-90.3	88.2	176.6	-63.6	-77.5	0	0	0	109.8	L38 R42	L38-Y40 HydrophobicContact CB-CD2 4.13Å; L38-Y40 HydrophobicContact CB-CE1 4.36Å; L38-Y40 HydrophobicContact CB-CE2 3.52Å; L38-Y40 HydrophobicContact CD1-CE2 4.25Å; L38-Y40 WeakPolarHBondContact CD1-OH 3.4Å; L38-Y40 HydrophobicContact CG-CE2 4.5Å; L38-Y40 PolarHBondContact O-N 2.96Å; Y40-R42 PolarHBondContact O-N 3.47Å
41	D	82.4	Confident	84.1	Confident	156 Å²	156	98.1 Å²	98.1	83%	0.834	53%	0.532	S	S	*	.	S	Bend	trans	-64.8	-22.8	166.3	-70.4	-12.9	0	0	0	111.2	F39	F39-D41 PolarHBondContact O-N 3.46Å
42	R	84.9	Confident	84.6	Confident	221 Å²	221	98.6 Å²	98.6	83%	0.834	53%	0.534	S	S	*	.	S	Bend	trans	-125.3	104.2	178.4	-62.5	-178.7	-175	173.4	1.4	109.2	Y40	Y40-R42 PolarHBondContact O-N 3.47Å
43	P	84.4	Confident	85.1	Confident	95 Å²	95	96.5 Å²	96.5	62%	0.617	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-64.8	155.8	175.2	28.3	-33.9	0	0	0	110.4	N45	P43-N45 PolarHBondContact O-N 3.25Å
44	I	86.3	Confident	85.4	Confident	132 Å²	132	96.4 Å²	96.4	68%	0.677	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-70.8	121.1	173.3	-60.4	172.9	0	0	0	107.9	I46	I44-I46 HydrophobicContact CG2-CG1 4.4Å; I44-I46 PolarHBondContact O-N 3.45Å
45	N	86.4	Confident	85.8	Confident	149 Å²	149	95 Å²	95	80%	0.797	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-79.4	116.9	173.9	-67.7	-15.6	0	0	0	108.9	P43	P43-N45 PolarHBondContact O-N 3.25Å
46	I	88.6	Confident	86.1	Confident	72 Å²	72	92.8 Å²	92.8	37%	0.369	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-101.4	126.8	177.1	-45.3	-172.1	0	0	0	107.2	I44 H48 L173 Y179	I44-I46 HydrophobicContact CG2-CG1 4.4Å; I44-I46 PolarHBondContact O-N 3.45Å; I46-H48 WeakPolarHBondContact CG2-O 3.2Å; I46-L173 HydrophobicContact CB-CD1 4.41Å; I46-L173 HydrophobicContact CD1-CD1 3.95Å; I46-L173 HydrophobicContact CG1-CD1 4.15Å; I46-Y179 PolarHBondContact O-OH 2.86Å
47	G	88	Confident	86.3	Confident	27 Å²	27	94 Å²	94	28%	0.278	48%	0.484	S	S	.	.	S	Bend	trans	-91.5	-4	-179.6	0	0	0	0	0	114.8	R230	G47-R230 PolarHBondContact O-NH2 3.36Å
48	H	92.7	Very high	86.5	Confident	30 Å²	30	87.4 Å²	87.4	14%	0.139	45%	0.45	C	S	.	.	S	Bend	trans	-147.8	166.2	-176.7	73	-76.8	0	0	0	111.4	I46 G50 T135 E136 E219	I46-H48 WeakPolarHBondContact CG2-O 3.2Å; H48-G50 PolarHBondContact CD2-N 2.97Å; H48-G50 VanDerWaalsContact CD2-N 3.31Å; H48-T135 HydrophobicContact CB-CG2 4.06Å; H48-E136 IonicContact CE1-OE2 3.61Å; H48-E136 PolarHBondContact CE1-OE2 2.8Å; H48-E136 IonicContact CG-OE2 3.87Å; H48-E136 IonicContact ND1-OE2 2.73Å; H48-E136 PolarHBondContact ND1-OE2 3.16Å; H48-E219 WeakPolarHBondContact CA-OE1 3.49Å; H48-E219 WeakPolarHBondContact CB-OE1 3.43Å
49	T	92.1	Very high	86.5	Confident	16 Å²	16	84.6 Å²	84.6	10%	0.098	44%	0.439	C	S	.	.			trans	-88.8	-17.3	-171.5	64.3	0	0	0	0	115.1	T51 F53 L172 Y179 Q181 E219 H232	T49-T51 PolarHBondContact O-N 3.49Å; T49-T51 VanDerWaalsContact O-N 3.15Å; T49-T51 PolarHBondContact OG1-N 3.41Å; T49-T51 PolarHBondContact OG1-O 2.81Å; T49-F53 HydrophobicContact CG2-CE1 4.48Å; T49-F53 HydrophobicContact CG2-CE2 3.56Å; T49-F53 HydrophobicContact CG2-CZ 3.39Å; T49-L172 HydrophobicContact CG2-CD2 4.24Å; T49-Y179 HydrophobicContact CG2-CD1 3.75Å; T49-Y179 HydrophobicContact CG2-CD2 3.82Å; T49-Y179 HydrophobicContact CG2-CE1 4.49Å; T49-Y179 HydrophobicContact CG2-CG 3.35Å; T49-Q181 PolarHBondContact OG1-NE2 3.37Å; T49-E219 WeakPolarHBondContact CB-OE2 3.43Å; T49-E219 WeakPolarHBondContact CG2-OE2 3.41Å; T49-E219 PolarHBondContact N-OE1 3.07Å; T49-E219 PolarHBondContact OG1-OE2 3.31Å; T49-H232 PolarHBondContact OG1-CE1 2.97Å
50	G	90.2	Very high	86.3	Confident	27 Å²	27	81 Å²	81	28%	0.278	43%	0.427	S	S	.	.	S	Bend	trans	70.5	-9	-174.6	0	0	0	0	0	115.9	H48 K137	H48-G50 PolarHBondContact CD2-N 2.97Å; H48-G50 VanDerWaalsContact CD2-N 3.31Å; G50-K137 WeakPolarHBondContact O-CD 3.35Å; G50-K137 WeakPolarHBondContact O-CE 3.49Å
51	T	92.5	Very high	86.3	Confident	86 Å²	86	75.4 Å²	75.4	53%	0.528	42%	0.415	S	S	.	.	S	Bend	trans	-143.5	147.1	-179.7	58.2	0	0	0	0	111.5	T49 F53 Q181	T49-T51 PolarHBondContact O-N 3.49Å; T49-T51 VanDerWaalsContact O-N 3.15Å; T49-T51 PolarHBondContact OG1-N 3.41Å; T49-T51 PolarHBondContact OG1-O 2.81Å; T51-F53 PolarHBondContact O-N 3.44Å; T51-Q181 PolarHBondContact O-NE2 3.21Å
52	I	92.7	Very high	85.5	Confident	41 Å²	41	70 Å²	70	21%	0.21	39%	0.386	C	S	.	.			trans	-78.8	123.5	175	-60.7	166	0	0	0	108.9	P55 V217 V235	I52-P55 HydrophobicContact CG2-CB 4.33Å; I52-V217 HydrophobicContact CD1-CB 4.48Å; I52-V217 HydrophobicContact CD1-CG2 3.86Å; I52-V217 HydrophobicContact CG1-CB 4.49Å; I52-V217 HydrophobicContact CG1-CG2 4.2Å; I52-V217 HydrophobicContact CG2-CG1 4.44Å; I52-V217 HydrophobicContact CG2-CG2 4.08Å; I52-V235 HydrophobicContact CD1-CG2 4.46Å
53	F	91.3	Very high	84.3	Confident	25 Å²	25	62.4 Å²	62.4	11%	0.11	38%	0.377	C	S	.	.	S	Bend	trans	-75.4	132.1	175.5	-57.6	-47.4	0	0	0	111.2	T49 T51 R168 N170 Q181	T49-F53 HydrophobicContact CG2-CE1 4.48Å; T49-F53 HydrophobicContact CG2-CE2 3.56Å; T49-F53 HydrophobicContact CG2-CZ 3.39Å; T51-F53 PolarHBondContact O-N 3.44Å; F53-R168 HydrophobicContact CB-CB 4.14Å; F53-N170 HydrophobicContact CD1-CB 4.48Å; F53-N170 WeakPolarHBondContact CD1-ND2 3.32Å; F53-N170 HydrophobicContact CD2-CB 3.91Å; F53-N170 HydrophobicContact CE1-CB 4.22Å; F53-N170 HydrophobicContact CE2-CB 3.61Å; F53-N170 HydrophobicContact CG-CB 4.34Å; F53-N170 WeakPolarHBondContact CG-ND2 3.49Å; F53-N170 HydrophobicContact CZ-CB 3.77Å; F53-Q181 HydrophobicContact CD2-CG 4.06Å; F53-Q181 HydrophobicContact CE2-CG 4.49Å
54	D	89.9	Confident	83.1	Confident	78 Å²	78	66 Å²	66	42%	0.417	39%	0.385	S	S	.	.	S	Bend	trans	41.6	65.9	178.2	-78.7	4.6	0	0	0	112	Y56 K85 Q166 R168	D54-Y56 PolarHBondContact O-N 2.84Å; D54-K85 IonicContact OD2-NZ 2.75Å; D54-K85 PolarHBondContact OD2-NZ 3.25Å; D54-Q166 PolarHBondContact O-NE2 2.9Å; D54-R168 HydrophobicContact CB-CG 4.3Å; D54-R168 IonicContact OD2-NE 3.5Å
55	P	89.9	Confident	80.9	Confident	77 Å²	77	64.5 Å²	64.5	50%	0.5	39%	0.387	S	S	.	.			trans	-54.6	129.2	-172.4	23	-34.1	0	0	0	111.7	I52 I57 V235	I52-P55 HydrophobicContact CG2-CB 4.33Å; P55-I57 PolarHBondContact O-N 3.02Å; P55-V235 HydrophobicContact CB-CG1 4.24Å
56	Y	88.7	Confident	78.9	Confident	35 Å²	35	61 Å²	61	14%	0.137	37%	0.374	C	S	.	.			trans	-65.2	123.4	-177.5	176.5	-106.2	0	0	0	111.1	D54 P58 P59 V165 Q166 Y215 V235	D54-Y56 PolarHBondContact O-N 2.84Å; Y56-P58 HydrophobicContact CD1-CB 4.35Å; Y56-P58 VanDerWaalsContact CE1-CA 3.46Å; Y56-P58 HydrophobicContact CE1-CB 3.87Å; Y56-P58 VanDerWaalsContact O-CD 3.25Å; Y56-P58 WeakPolarHBondContact O-CD 3.46Å; Y56-P59 WeakPolarHBondContact OH-CD 3.48Å; Y56-V165 HydrophobicContact CD1-CG1 3.8Å; Y56-V165 HydrophobicContact CD2-CG1 3.57Å; Y56-V165 HydrophobicContact CE1-CG1 3.53Å; Y56-V165 HydrophobicContact CE2-CG1 3.3Å; Y56-V165 HydrophobicContact CG-CG1 3.8Å; Y56-Q166 HydrophobicContact CD2-CB 4.48Å; Y56-Y215 AromaticContact CD1-CD1 3.76Å; Y56-Y215 HydrophobicContact CD1-CD1 3.76Å; Y56-Y215 AromaticContact CD1-CE1 3.7Å; Y56-Y215 HydrophobicContact CD1-CE1 3.7Å; Y56-Y215 HydrophobicContact CD1-CG 4.42Å; Y56-Y215 AromaticContact CE1-CD1 3.96Å; Y56-Y215 HydrophobicContact CE1-CD1 3.96Å; Y56-Y215 AromaticContact CE1-CE1 3.39Å; Y56-Y215 HydrophobicContact CE1-CE1 3.39Å; Y56-Y215 AromaticContact CE1-CZ 3.84Å; Y56-V235 WeakPolarHBondContact O-CG1 3.25Å
57	I	86.3	Confident	77.2	Confident	126 Å²	126	62.8 Å²	62.8	65%	0.646	38%	0.384	S	S	*	.			trans	-91.2	109	174.8	-57.9	170.3	0	0	0	107.5	P55	P55-I57 PolarHBondContact O-N 3.02Å
58	P	83.9	Confident	75.6	Confident	9 Å²	9	69.7 Å²	69.7	6%	0.058	41%	0.413	C	S	.	.			trans	-68.6	145.5	179.5	28.7	-34	0	0	0	111.1	Y56 Y215 R237	Y56-P58 HydrophobicContact CD1-CB 4.35Å; Y56-P58 VanDerWaalsContact CE1-CA 3.46Å; Y56-P58 HydrophobicContact CE1-CB 3.87Å; Y56-P58 VanDerWaalsContact O-CD 3.25Å; Y56-P58 WeakPolarHBondContact O-CD 3.46Å; P58-Y215 HydrophobicContact CB-CD2 4.27Å; P58-Y215 HydrophobicContact CB-CE1 4.41Å; P58-Y215 HydrophobicContact CB-CE2 3.46Å; P58-Y215 VanDerWaalsContact CB-CE2 3.46Å; P58-Y215 WeakPolarHBondContact CB-OH 3.16Å; P58-Y215 HydrophobicContact CG-CD2 4.4Å; P58-Y215 HydrophobicContact CG-CE2 3.97Å; P58-R237 HydrophobicContact CG-CG 3.55Å
59	P	79.8	Confident	74.1	Confident	52 Å²	52	70.8 Å²	70.8	34%	0.338	42%	0.424	S	S	.	.			trans	-66.6	139	-177.5	23.9	-29.8	0	0	0	111.3	Y56 G61 D62	Y56-P59 WeakPolarHBondContact OH-CD 3.48Å; P59-G61 PolarHBondContact O-N 3.08Å; P59-D62 HydrophobicContact CG-CB 4.19Å; P59-D62 PolarHBondContact O-N 3Å; P59-D62 VanDerWaalsContact O-N 3.07Å
60	D	69.9	Low	72.6	Confident	98 Å²	98	76.6 Å²	76.6	52%	0.524	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	110.6	172.6	-70.2	-17.8	0	0	0	109	K71	D60-K71 IonicContact OD2-NZ 3.67Å; D60-K71 PolarHBondContact OD2-NZ 3.31Å
61	G	70.3	Confident	71.5	Confident	32 Å²	32	80.8 Å²	80.8	33%	0.33	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	103	10.2	-179.1	0	0	0	0	0	115.9	P59 G63 Q64	P59-G61 PolarHBondContact O-N 3.08Å; G61-G63 PolarHBondContact O-N 2.94Å; G61-Q64 CarbonylContact C-O 3.5Å; G61-Q64 WeakPolarHBondContact CA-O 3.27Å; G61-Q64 CarbonylContact O-C 3.47Å; G61-Q64 PolarHBondContact O-N 3.02Å; G61-Q64 VanDerWaalsContact O-O 3.05Å
62	D	66.3	Low	70.1	Confident	41 Å²	41	82.5 Å²	82.5	22%	0.219	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	99.9	163.1	-167.9	31.5	0	0	0	109.7	P59 R185 Y215	P59-D62 HydrophobicContact CG-CB 4.19Å; P59-D62 PolarHBondContact O-N 3Å; P59-D62 VanDerWaalsContact O-N 3.07Å; D62-R185 IonicContact OD1-CZ 3.51Å; D62-R185 IonicContact OD1-NE 3.41Å; D62-R185 PolarHBondContact OD1-NE 3.02Å; D62-R185 IonicContact OD1-NH2 2.7Å; D62-R185 PolarHBondContact OD1-NH2 3.39Å; D62-R185 IonicContact OD2-CZ 2.83Å; D62-R185 IonicContact OD2-NE 3.56Å; D62-R185 PolarHBondContact OD2-NE 3.06Å; D62-R185 IonicContact OD2-NH2 3.44Å; D62-R185 PolarHBondContact OD2-NH2 3.42Å; D62-Y215 PolarHBondContact OD2-OH 2.95Å
63	G	59.8	Low	68.7	Low	62 Å²	62	87.1 Å²	87.1	64%	0.639	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.9	-18	-171.5	0	0	0	0	0	115.4	G61	G61-G63 PolarHBondContact O-N 2.94Å
64	Q	59	Low	67.8	Low	170 Å²	170	88.7 Å²	88.7	79%	0.794	51%	0.509	S	S	*	.	S	Bend	trans	-146.1	94.4	175.6	-64.5	-169	17.1	0	0	108.5	G61 S66	G61-Q64 CarbonylContact C-O 3.5Å; G61-Q64 WeakPolarHBondContact CA-O 3.27Å; G61-Q64 CarbonylContact O-C 3.47Å; G61-Q64 PolarHBondContact O-N 3.02Å; G61-Q64 VanDerWaalsContact O-O 3.05Å; Q64-S66 PolarHBondContact O-N 3.07Å
65	S	41.2	Very low	66.9	Low	102 Å²	102	88 Å²	88	71%	0.713	51%	0.505	S	S	*	.			trans	-57.3	97.4	-171.4	56.5	0	0	0	0	112.9	L67	S65-L67 PolarHBondContact O-N 3.07Å
66	S	44.1	Very low	65.9	Low	76 Å²	76	89.7 Å²	89.7	53%	0.531	51%	0.509	S	S	.	.			trans	-93.7	92.3	165.8	65	0	0	0	0	109.1	Q64 L68	Q64-S66 PolarHBondContact O-N 3.07Å; S66-L68 PolarHBondContact O-N 2.83Å
67	L	53.6	Low	65.3	Low	109 Å²	109	94.8 Å²	94.8	57%	0.571	53%	0.532	S	S	*	.			trans	-79.7	12.4	-171.1	-70.8	166	0	0	0	114.5	S65 R72	S65-L67 PolarHBondContact O-N 3.07Å; L67-R72 PolarHBondContact O-NH1 3.33Å; L67-R72 PolarHBondContact O-NH2 2.88Å
68	L	54.3	Low	64.9	Low	172 Å²	172	92.6 Å²	92.6	90%	0.901	52%	0.522	S	S	*	.			trans	-140.1	28.8	-160.6	-68.9	173.1	0	0	0	116.9	S66	S66-L68 PolarHBondContact O-N 2.83Å
69	S	59.4	Low	64.7	Low	53 Å²	53	95.4 Å²	95.4	37%	0.371	54%	0.537	S	S	.	.			trans	-103	137.2	177.1	-166.9	0	0	0	0	114.1	K71 R72	S69-K71 PolarHBondContact O-N 2.9Å; S69-K71 WeakPolarHBondContact OG-CG 3.41Å; S69-K71 PolarHBondContact OG-N 3.46Å; S69-R72 WeakPolarHBondContact O-CG 3.5Å; S69-R72 PolarHBondContact O-N 3.24Å
70	T	62.2	Low	64.5	Low	138 Å²	138	98.9 Å²	98.9	85%	0.847	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-20.1	168.6	48.6	0	0	0	0	113.2	R72	T70-R72 PolarHBondContact O-N 2.95Å; T70-R72 VanDerWaalsContact O-N 3.09Å
71	K	66.2	Low	65.1	Low	114 Å²	114	99 Å²	99	50%	0.496	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.2	-16.6	171.2	-65.2	-175.8	-175.5	-173.7	0	114.1	D60 S69 L73 A74 L75	D60-K71 IonicContact OD2-NZ 3.67Å; D60-K71 PolarHBondContact OD2-NZ 3.31Å; S69-K71 PolarHBondContact O-N 2.9Å; S69-K71 WeakPolarHBondContact OG-CG 3.41Å; S69-K71 PolarHBondContact OG-N 3.46Å; K71-L73 PolarHBondContact O-N 2.84Å; K71-A74 PolarHBondContact O-N 3.17Å; K71-L75 HydrophobicContact CB-CD1 4.39Å; K71-L75 VanDerWaalsContact O-CG 3.29Å; K71-L75 WeakPolarHBondContact O-CG 3.35Å; K71-L75 PolarHBondContact O-N 3.06Å
72	R	64.1	Low	65.8	Low	122 Å²	122	99.5 Å²	99.5	46%	0.46	55%	0.547	S	S	.	.	H	α-helix	trans	-58.3	-39.3	-178.8	-84.7	-175.7	165.1	164	-1.5	114.9	L67 S69 T70 L75 L76	L67-R72 PolarHBondContact O-NH1 3.33Å; L67-R72 PolarHBondContact O-NH2 2.88Å; S69-R72 WeakPolarHBondContact O-CG 3.5Å; S69-R72 PolarHBondContact O-N 3.24Å; T70-R72 PolarHBondContact O-N 2.95Å; T70-R72 VanDerWaalsContact O-N 3.09Å; R72-L75 PolarHBondContact O-N 2.82Å; R72-L76 WeakPolarHBondContact O-CB 3.37Å; R72-L76 VanDerWaalsContact O-CG 3.24Å; R72-L76 WeakPolarHBondContact O-CG 3.37Å; R72-L76 PolarHBondContact O-N 3.11Å
73	L	63.1	Low	66.7	Low	139 Å²	139	104.4 Å²	104.4	73%	0.728	57%	0.566	S	S	*	*	H	α-helix	trans	-66.5	-42.4	-178.9	-83.9	162.2	0	0	0	111.8	K71 L76 K77	K71-L73 PolarHBondContact O-N 2.84Å; L73-L76 PolarHBondContact O-N 3.12Å; L73-K77 PolarHBondContact O-N 2.88Å
74	A	72.2	Confident	68.1	Low	57 Å²	57	103.6 Å²	103.6	47%	0.471	56%	0.558	S	S	.	*	H	α-helix	trans	-60.7	-48.8	173.1	0	0	0	0	0	110.4	K71 L76 K77 D78	K71-A74 PolarHBondContact O-N 3.17Å; A74-L76 VanDerWaalsContact C-N 3.32Å; A74-L76 PolarHBondContact O-N 3.5Å; A74-K77 PolarHBondContact O-N 2.83Å; A74-D78 WeakPolarHBondContact O-CB 3.11Å; A74-D78 VanDerWaalsContact O-CG 3.24Å; A74-D78 PolarHBondContact O-N 2.73Å
75	L	71.2	Confident	69.7	Low	63 Å²	63	99.9 Å²	99.9	33%	0.33	54%	0.539	S	S	.	.	H	α-helix	trans	-58.6	-39.8	176.5	-68.5	169.6	0	0	0	112.6	K71 R72 N79	K71-L75 HydrophobicContact CB-CD1 4.39Å; K71-L75 VanDerWaalsContact O-CG 3.29Å; K71-L75 WeakPolarHBondContact O-CG 3.35Å; K71-L75 PolarHBondContact O-N 3.06Å; R72-L75 PolarHBondContact O-N 2.82Å; L75-N79 WeakPolarHBondContact O-CB 3.43Å; L75-N79 PolarHBondContact O-N 3.43Å; L75-N79 PolarHBondContact O-ND2 2.91Å
76	L	69	Low	72.1	Confident	113 Å²	113	96.5 Å²	96.5	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-67.3	-43.2	177.8	-74.9	174.4	0	0	0	112.1	R72 L73 A74 N79 L80	R72-L76 WeakPolarHBondContact O-CB 3.37Å; R72-L76 VanDerWaalsContact O-CG 3.24Å; R72-L76 WeakPolarHBondContact O-CG 3.37Å; R72-L76 PolarHBondContact O-N 3.11Å; L73-L76 PolarHBondContact O-N 3.12Å; A74-L76 VanDerWaalsContact C-N 3.32Å; A74-L76 PolarHBondContact O-N 3.5Å; L76-N79 PolarHBondContact O-N 3.3Å; L76-L80 PolarHBondContact O-N 2.71Å
77	K	76.1	Confident	74.4	Confident	143 Å²	143	101 Å²	101	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-61.6	-46.2	175.4	-176	-178.1	176.5	-175.7	0	110.6	L73 A74 N79 L80 L81	L73-K77 PolarHBondContact O-N 2.88Å; A74-K77 PolarHBondContact O-N 2.83Å; K77-N79 PolarHBondContact O-N 2.91Å; K77-L80 PolarHBondContact O-N 2.83Å; K77-L81 HydrophobicContact CG-CD1 4.44Å; K77-L81 WeakPolarHBondContact O-CG 3.45Å; K77-L81 PolarHBondContact O-N 3.01Å
78	D	78.1	Confident	76.3	Confident	80 Å²	80	103.2 Å²	103.2	43%	0.428	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-41.8	179.1	-66.7	-15.5	0	0	0	111	A74 L80 L81 N82	A74-D78 WeakPolarHBondContact O-CB 3.11Å; A74-D78 VanDerWaalsContact O-CG 3.24Å; A74-D78 PolarHBondContact O-N 2.73Å; D78-L80 VanDerWaalsContact C-N 3.29Å; D78-L80 PolarHBondContact O-N 2.86Å; D78-L81 PolarHBondContact O-N 2.96Å; D78-N82 WeakPolarHBondContact O-CB 3.27Å; D78-N82 PolarHBondContact O-N 2.89Å; D78-N82 PolarHBondContact O-ND2 2.99Å
79	N	78.1	Confident	78.2	Confident	68 Å²	68	95.7 Å²	95.7	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-60.1	-37.9	174	-77.1	-33.4	0	0	0	112.5	L75 L76 K77 K83	L75-N79 WeakPolarHBondContact O-CB 3.43Å; L75-N79 PolarHBondContact O-N 3.43Å; L75-N79 PolarHBondContact O-ND2 2.91Å; L76-N79 PolarHBondContact O-N 3.3Å; K77-N79 PolarHBondContact O-N 2.91Å; N79-K83 WeakPolarHBondContact O-CB 3.45Å; N79-K83 WeakPolarHBondContact O-CG 3.38Å; N79-K83 PolarHBondContact O-N 2.85Å
80	L	76.9	Confident	79.8	Confident	125 Å²	125	94.9 Å²	94.9	65%	0.654	48%	0.477	S	S	*	.	H	α-helix	trans	-69.2	-46	177.8	-172.7	68.1	0	0	0	111.5	L76 K77 D78 N82 K83 G84	L76-L80 PolarHBondContact O-N 2.71Å; K77-L80 PolarHBondContact O-N 2.83Å; D78-L80 VanDerWaalsContact C-N 3.29Å; D78-L80 PolarHBondContact O-N 2.86Å; L80-N82 VanDerWaalsContact C-N 3.32Å; L80-N82 PolarHBondContact O-N 2.83Å; L80-K83 PolarHBondContact O-N 3.01Å; L80-G84 PolarHBondContact O-N 3.27Å; L80-G84 VanDerWaalsContact O-N 3.08Å
81	L	82.4	Confident	81.3	Confident	99 Å²	99	91.6 Å²	91.6	52%	0.518	46%	0.459	S	S	.	.	H	α-helix	trans	-60.9	-43.4	175.5	-68.4	174.3	0	0	0	111.1	K77 D78 K83 G84 K85	K77-L81 HydrophobicContact CG-CD1 4.44Å; K77-L81 WeakPolarHBondContact O-CG 3.45Å; K77-L81 PolarHBondContact O-N 3.01Å; D78-L81 PolarHBondContact O-N 2.96Å; L81-K83 VanDerWaalsContact C-N 3.34Å; L81-K83 PolarHBondContact O-N 2.7Å; L81-G84 PolarHBondContact O-N 3.09Å; L81-K85 PolarHBondContact O-N 2.82Å
82	N	84.9	Confident	82.6	Confident	44 Å²	44	88.8 Å²	88.8	24%	0.235	45%	0.449	C	S	.	.	H	α-helix	trans	-64.8	-36.3	177.3	-72.7	-23.1	0	0	0	112	D78 L80 K85 N86	D78-N82 WeakPolarHBondContact O-CB 3.27Å; D78-N82 PolarHBondContact O-N 2.89Å; D78-N82 PolarHBondContact O-ND2 2.99Å; L80-N82 VanDerWaalsContact C-N 3.32Å; L80-N82 PolarHBondContact O-N 2.83Å; N82-K85 PolarHBondContact O-N 2.68Å; N82-N86 WeakPolarHBondContact O-CB 3.28Å; N82-N86 PolarHBondContact O-N 2.49Å; N82-N86 PolarHBondContact O-ND2 3.29Å; N82-N86 PolarHBondContact O-OD1 3.06Å
83	K	85.7	Confident	84	Confident	143 Å²	143	83 Å²	83	62%	0.622	43%	0.427	S	S	*	.	H	α-helix	trans	-63.3	-42.3	172.4	-78.5	171.9	-177.2	-176.3	0	112.2	N79 L80 L81 N86 Y87	N79-K83 WeakPolarHBondContact O-CB 3.45Å; N79-K83 WeakPolarHBondContact O-CG 3.38Å; N79-K83 PolarHBondContact O-N 2.85Å; L80-K83 PolarHBondContact O-N 3.01Å; L81-K83 VanDerWaalsContact C-N 3.34Å; L81-K83 PolarHBondContact O-N 2.7Å; K83-N86 PolarHBondContact O-N 2.98Å; K83-Y87 WeakPolarHBondContact O-CB 3.44Å; K83-Y87 PolarHBondContact O-N 3.04Å
84	G	89.5	Confident	85.4	Confident	46 Å²	46	81.2 Å²	81.2	47%	0.474	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-47.2	176	0	0	0	0	0	112.3	L80 L81 Y87 K88	L80-G84 PolarHBondContact O-N 3.27Å; L80-G84 VanDerWaalsContact O-N 3.08Å; L81-G84 PolarHBondContact O-N 3.09Å; G84-Y87 PolarHBondContact O-N 3.4Å; G84-K88 PolarHBondContact O-N 3.1Å; G84-K88 VanDerWaalsContact O-N 3.11Å
85	K	91.2	Very high	86.4	Confident	91 Å²	91	82.4 Å²	82.4	40%	0.396	42%	0.419	S	S	.	.	H	α-helix	trans	-59.3	-50.1	173.3	-70.3	-178.6	171.2	-170.2	0	111.6	D54 L81 N82 Y87 K88 D89	D54-K85 IonicContact OD2-NZ 2.75Å; D54-K85 PolarHBondContact OD2-NZ 3.25Å; L81-K85 PolarHBondContact O-N 2.82Å; N82-K85 PolarHBondContact O-N 2.68Å; K85-Y87 VanDerWaalsContact C-N 3.26Å; K85-Y87 PolarHBondContact O-N 2.81Å; K85-K88 WeakPolarHBondContact O-CB 3.33Å; K85-K88 PolarHBondContact O-N 3.08Å; K85-K88 VanDerWaalsContact O-N 3.12Å; K85-D89 PolarHBondContact O-N 3.03Å
86	N	91.4	Very high	87.3	Confident	32 Å²	32	83.7 Å²	83.7	17%	0.171	42%	0.423	C	S	.	.	H	α-helix	trans	-55.8	-39.9	178	-72.4	-5.8	0	0	0	112	N82 K83 L90 V165 I167 R168	N82-N86 WeakPolarHBondContact O-CB 3.28Å; N82-N86 PolarHBondContact O-N 2.49Å; N82-N86 PolarHBondContact O-ND2 3.29Å; N82-N86 PolarHBondContact O-OD1 3.06Å; K83-N86 PolarHBondContact O-N 2.98Å; N86-L90 WeakPolarHBondContact O-CB 3.45Å; N86-L90 PolarHBondContact O-N 3.47Å; N86-V165 PolarHBondContact ND2-O 3.01Å; N86-I167 PolarHBondContact OD1-O 3.31Å; N86-R168 PolarHBondContact OD1-NH1 3.44Å; N86-R168 PolarHBondContact OD1-NH2 3.33Å
87	Y	92.4	Very high	88.3	Confident	171 Å²	171	79.8 Å²	79.8	67%	0.671	40%	0.402	S	S	*	.	H	α-helix	trans	-67.9	-43.2	178.2	-178.3	-97.4	0	0	0	112.1	K83 G84 K85 L90 S91	K83-Y87 WeakPolarHBondContact O-CB 3.44Å; K83-Y87 PolarHBondContact O-N 3.04Å; G84-Y87 PolarHBondContact O-N 3.4Å; K85-Y87 VanDerWaalsContact C-N 3.26Å; K85-Y87 PolarHBondContact O-N 2.81Å; Y87-L90 PolarHBondContact O-N 2.97Å; Y87-S91 WeakPolarHBondContact O-CB 3.44Å; Y87-S91 PolarHBondContact O-N 3.38Å
88	K	93.7	Very high	88.9	Confident	154 Å²	154	78.3 Å²	78.3	67%	0.67	41%	0.407	S	S	*	.	H	α-helix	trans	-59.3	-48.5	174.5	-176.3	-168.9	174.6	-167.7	0	111	G84 K85 S91 L92	G84-K88 PolarHBondContact O-N 3.1Å; G84-K88 VanDerWaalsContact O-N 3.11Å; K85-K88 WeakPolarHBondContact O-CB 3.33Å; K85-K88 PolarHBondContact O-N 3.08Å; K85-K88 VanDerWaalsContact O-N 3.12Å; K88-S91 WeakPolarHBondContact O-CB 3.33Å; K88-S91 PolarHBondContact O-N 3.02Å; K88-L92 PolarHBondContact O-N 3.01Å
89	D	93.9	Very high	89.5	Confident	15 Å²	15	78.6 Å²	78.6	8%	0.08	42%	0.415	C	S	.	.	H	α-helix	trans	-68.8	-37.9	-177.8	-60.5	-23.6	0	0	0	111.2	K85 S91 L92 L93 I167 R168 C169	K85-D89 PolarHBondContact O-N 3.03Å; D89-S91 VanDerWaalsContact C-N 3.3Å; D89-S91 PolarHBondContact O-N 3.03Å; D89-L92 PolarHBondContact O-N 2.99Å; D89-L93 WeakPolarHBondContact O-CB 3.48Å; D89-L93 PolarHBondContact O-N 3.24Å; D89-I167 HydrophobicContact CB-CG2 4.31Å; D89-I167 WeakPolarHBondContact CB-O 3.39Å; D89-I167 VanDerWaalsContact OD2-O 3.04Å; D89-R168 WeakPolarHBondContact OD2-CA 3.41Å; D89-R168 WeakPolarHBondContact OD2-CD 3.18Å; D89-R168 IonicContact OD2-CZ 3.7Å; D89-R168 IonicContact OD2-NH1 3.24Å; D89-R168 PolarHBondContact OD2-NH1 3.24Å; D89-R168 VanDerWaalsContact OD2-NH1 3.11Å; D89-C169 HydrophobicContact CB-CB 4.26Å; D89-C169 PolarHBondContact O-SG 3.05Å
90	L	93.9	Very high	90.1	Very high	36 Å²	36	75.8 Å²	75.8	19%	0.188	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-37.8	171.7	179.3	65	0	0	0	111.7	N86 Y87 L93 K94 F100 I167	N86-L90 WeakPolarHBondContact O-CB 3.45Å; N86-L90 PolarHBondContact O-N 3.47Å; Y87-L90 PolarHBondContact O-N 2.97Å; L90-L93 PolarHBondContact O-N 2.88Å; L90-K94 HydrophobicContact CD1-CD 4.39Å; L90-K94 HydrophobicContact CD1-CG 4.34Å; L90-K94 HydrophobicContact CG-CD 4.31Å; L90-K94 WeakPolarHBondContact O-CB 3.36Å; L90-K94 VanDerWaalsContact O-CG 3.32Å; L90-K94 WeakPolarHBondContact O-CG 3.49Å; L90-K94 PolarHBondContact O-N 2.86Å; L90-F100 HydrophobicContact CD1-CD1 3.87Å; L90-F100 HydrophobicContact CD1-CE1 3.82Å; L90-I167 HydrophobicContact CB-CD1 4.39Å; L90-I167 HydrophobicContact CD1-CD1 3.8Å
91	S	93.4	Very high	90.9	Very high	68 Å²	68	73.3 Å²	73.3	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-65.3	-41	175.9	-169.9	0	0	0	0	111.4	Y87 K88 D89 K94 S95	Y87-S91 WeakPolarHBondContact O-CB 3.44Å; Y87-S91 PolarHBondContact O-N 3.38Å; K88-S91 WeakPolarHBondContact O-CB 3.33Å; K88-S91 PolarHBondContact O-N 3.02Å; D89-S91 VanDerWaalsContact C-N 3.3Å; D89-S91 PolarHBondContact O-N 3.03Å; S91-K94 PolarHBondContact O-N 3.2Å; S91-S95 PolarHBondContact O-N 2.91Å
92	L	92.8	Very high	91.3	Very high	55 Å²	55	70.6 Å²	70.6	29%	0.288	38%	0.377	S	S	.	.	H	α-helix	trans	-67.6	-42.1	175.7	-175.8	61.6	0	0	0	111.5	K88 D89 K94 S95 H96 C169 V178	K88-L92 PolarHBondContact O-N 3.01Å; D89-L92 PolarHBondContact O-N 2.99Å; L92-K94 VanDerWaalsContact C-N 3.33Å; L92-K94 PolarHBondContact O-N 3.17Å; L92-S95 PolarHBondContact O-N 3.31Å; L92-S95 PolarHBondContact O-OG 3.3Å; L92-H96 PolarHBondContact O-CD2 3.11Å; L92-C169 HydrophobicContact CB-CB 4.49Å; L92-C169 HydrophobicContact CD2-CB 3.79Å; L92-C169 HydrophobicContact CG-CB 4.36Å; L92-V178 HydrophobicContact CD2-CG1 4.23Å
93	L	93.8	Very high	91.7	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-59.1	-46.2	173.8	177.9	62	0	0	0	111	D89 L90 S95 H96 E97 F100 I167 A180 I222 W229	D89-L93 WeakPolarHBondContact O-CB 3.48Å; D89-L93 PolarHBondContact O-N 3.24Å; L90-L93 PolarHBondContact O-N 2.88Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 2.99Å; L93-H96 PolarHBondContact O-N 3.08Å; L93-E97 PolarHBondContact O-N 3.3Å; L93-F100 HydrophobicContact CD2-CD1 3.5Å; L93-F100 VanDerWaalsContact CD2-CD1 3.5Å; L93-F100 HydrophobicContact CD2-CD2 3.93Å; L93-F100 HydrophobicContact CD2-CE1 3.47Å; L93-F100 VanDerWaalsContact CD2-CE1 3.47Å; L93-F100 HydrophobicContact CD2-CE2 3.91Å; L93-F100 HydrophobicContact CD2-CG 3.73Å; L93-F100 HydrophobicContact CD2-CZ 3.69Å; L93-F100 HydrophobicContact CG-CD1 4.22Å; L93-F100 HydrophobicContact CG-CG 4.18Å; L93-I167 HydrophobicContact CD2-CG2 4.26Å; L93-A180 HydrophobicContact CD1-CB 3.86Å; L93-I222 HydrophobicContact CD1-CD1 3.8Å; L93-I222 HydrophobicContact CD1-CG1 4.07Å; L93-W229 HydrophobicContact CD1-CH2 4.19Å; L93-W229 HydrophobicContact CD1-CZ2 4.1Å; L93-W229 HydrophobicContact CD2-CH2 4.23Å; L93-W229 HydrophobicContact CD2-CZ2 4.26Å
94	K	93.7	Very high	92.1	Very high	102 Å²	102	78.4 Å²	78.4	44%	0.443	40%	0.403	S	S	.	.	H	α-helix	trans	-69.2	-24.1	179.5	-76.9	-176.7	174	-172.5	0	114.3	L90 S91 L92 H96 E97	L90-K94 HydrophobicContact CD1-CD 4.39Å; L90-K94 HydrophobicContact CD1-CG 4.34Å; L90-K94 HydrophobicContact CG-CD 4.31Å; L90-K94 WeakPolarHBondContact O-CB 3.36Å; L90-K94 VanDerWaalsContact O-CG 3.32Å; L90-K94 WeakPolarHBondContact O-CG 3.49Å; L90-K94 PolarHBondContact O-N 2.86Å; S91-K94 PolarHBondContact O-N 3.2Å; L92-K94 VanDerWaalsContact C-N 3.33Å; L92-K94 PolarHBondContact O-N 3.17Å; K94-H96 VanDerWaalsContact C-N 3.28Å; K94-E97 CarbonylContact O-C 3.49Å
95	S	92.2	Very high	92.4	Very high	83 Å²	83	76.4 Å²	76.4	58%	0.58	38%	0.382	S	S	*	.	H	α-helix	trans	-69.7	-29.6	175.6	59.7	0	0	0	0	112.2	S91 L92 L93	S91-S95 PolarHBondContact O-N 2.91Å; L92-S95 PolarHBondContact O-N 3.31Å; L92-S95 PolarHBondContact O-OG 3.3Å; L93-S95 VanDerWaalsContact C-N 3.31Å; L93-S95 PolarHBondContact O-N 2.99Å
96	H	90	Very high	92.6	Very high	89 Å²	89	73 Å²	73	41%	0.412	37%	0.368	S	S	.	.	H	α-helix	trans	-91.1	-41.5	173.3	-70.8	-90.5	0	0	0	112.5	L92 L93 K94 P98 I222	L92-H96 PolarHBondContact O-CD2 3.11Å; L93-H96 PolarHBondContact O-N 3.08Å; K94-H96 VanDerWaalsContact C-N 3.28Å; H96-P98 WeakPolarHBondContact O-CD 3.18Å; H96-I222 HydrophobicContact CB-CG2 3.14Å
97	E	89.6	Confident	92.9	Very high	31 Å²	31	76.2 Å²	76.2	15%	0.145	39%	0.385	C	S	.	.			trans	-119.9	87.6	-178.8	-170	-173.6	-177.5	0	0	111.3	L93 K94 S99 F100 R220	L93-E97 PolarHBondContact O-N 3.3Å; K94-E97 CarbonylContact O-C 3.49Å; E97-S99 WeakPolarHBondContact CG-OG 3.15Å; E97-S99 PolarHBondContact O-N 2.92Å; E97-S99 PolarHBondContact OE1-OG 3.49Å; E97-F100 HydrophobicContact CB-CB 4.46Å; E97-F100 HydrophobicContact CG-CB 4.23Å; E97-F100 WeakPolarHBondContact O-CB 3.3Å; E97-F100 PolarHBondContact O-N 2.81Å; E97-R220 IonicContact OE1-NH1 3.44Å; E97-R220 PolarHBondContact OE1-NH1 3.47Å; E97-R220 IonicContact OE2-CZ 2.71Å; E97-R220 IonicContact OE2-NH1 3.93Å; E97-R220 PolarHBondContact OE2-NH1 3.17Å
98	P	89.8	Confident	93	Very high	113 Å²	113	72.2 Å²	72.2	73%	0.734	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-20.9	-178.4	25.9	-34.3	0	0	0	113.4	H96 F100	H96-P98 WeakPolarHBondContact O-CD 3.18Å; P98-F100 PolarHBondContact O-N 3.49Å
99	S	90	Very high	93.2	Very high	86 Å²	86	64.9 Å²	64.9	60%	0.601	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.1	177.3	46	0	0	0	0	114	E97 N101	E97-S99 WeakPolarHBondContact CG-OG 3.15Å; E97-S99 PolarHBondContact O-N 2.92Å; E97-S99 PolarHBondContact OE1-OG 3.49Å; S99-N101 PolarHBondContact O-N 3.21Å
100	F	91.6	Very high	93.3	Very high	9 Å²	9	65.9 Å²	65.9	4%	0.039	34%	0.344	C	S	.	.			trans	-65.3	118.8	-172.4	-175.9	-98.5	0	0	0	112.3	L90 L93 E97 P98 F105 I167 V182 W229	L90-F100 HydrophobicContact CD1-CD1 3.87Å; L90-F100 HydrophobicContact CD1-CE1 3.82Å; L93-F100 HydrophobicContact CD2-CD1 3.5Å; L93-F100 VanDerWaalsContact CD2-CD1 3.5Å; L93-F100 HydrophobicContact CD2-CD2 3.93Å; L93-F100 HydrophobicContact CD2-CE1 3.47Å; L93-F100 VanDerWaalsContact CD2-CE1 3.47Å; L93-F100 HydrophobicContact CD2-CE2 3.91Å; L93-F100 HydrophobicContact CD2-CG 3.73Å; L93-F100 HydrophobicContact CD2-CZ 3.69Å; L93-F100 HydrophobicContact CG-CD1 4.22Å; L93-F100 HydrophobicContact CG-CG 4.18Å; E97-F100 HydrophobicContact CB-CB 4.46Å; E97-F100 HydrophobicContact CG-CB 4.23Å; E97-F100 WeakPolarHBondContact O-CB 3.3Å; E97-F100 PolarHBondContact O-N 2.81Å; P98-F100 PolarHBondContact O-N 3.49Å; F100-F105 HydrophobicContact CE2-CB 3.89Å; F100-F105 HydrophobicContact CE2-CD1 4.4Å; F100-F105 AromaticContact CE2-CD2 3.82Å; F100-F105 HydrophobicContact CE2-CD2 3.82Å; F100-F105 AromaticContact CE2-CG 3.74Å; F100-F105 HydrophobicContact CE2-CG 3.74Å; F100-F105 HydrophobicContact CZ-CB 4.16Å; F100-F105 HydrophobicContact CZ-CD1 4.36Å; F100-F105 HydrophobicContact CZ-CG 4.07Å; F100-I167 HydrophobicContact CE1-CD1 4.16Å; F100-V182 HydrophobicContact CZ-CG2 4.35Å; F100-W229 AromaticContact CD2-CZ2 3.85Å; F100-W229 HydrophobicContact CD2-CZ2 3.85Å; F100-W229 HydrophobicContact CE2-CH2 4.28Å; F100-W229 AromaticContact CE2-CZ2 3.55Å; F100-W229 HydrophobicContact CE2-CZ2 3.55Å; F100-W229 HydrophobicContact CZ-CZ2 4.46Å
101	N	93	Very high	93.5	Very high	73 Å²	73	68.8 Å²	68.8	39%	0.39	36%	0.36	S	S	.	.			trans	-128	119.5	174.9	-176.5	-25.9	0	0	0	110.1	S99 K103 R104 F105	S99-N101 PolarHBondContact O-N 3.21Å; N101-K103 PolarHBondContact O-N 3.19Å; N101-K103 VanDerWaalsContact O-N 3.11Å; N101-K103 PolarHBondContact OD1-N 2.9Å; N101-R104 HydrophobicContact CB-CB 4.27Å; N101-R104 HydrophobicContact CB-CG 4.23Å; N101-R104 PolarHBondContact O-N 3.33Å; N101-F105 WeakPolarHBondContact O-CB 3.33Å; N101-F105 PolarHBondContact O-N 3.11Å
102	S	91.7	Very high	93.7	Very high	42 Å²	42	66.3 Å²	66.3	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-54.9	-33.6	-177.8	-49.3	0	0	0	0	113.9	T106	S102-T106 WeakPolarHBondContact O-CG2 3.49Å; S102-T106 PolarHBondContact O-N 3.47Å
103	K	92.8	Very high	93.8	Very high	166 Å²	166	63.7 Å²	63.7	72%	0.722	33%	0.328	S	S	*	.	H	α-helix	trans	-76.2	-30.5	178.6	-66.2	-174.8	179.7	-177.6	0	113.4	N101 T106	N101-K103 PolarHBondContact O-N 3.19Å; N101-K103 VanDerWaalsContact O-N 3.11Å; N101-K103 PolarHBondContact OD1-N 2.9Å; K103-T106 PolarHBondContact O-OG1 2.85Å
104	R	94.8	Very high	94	Very high	185 Å²	185	65.1 Å²	65.1	70%	0.698	34%	0.336	S	S	*	.	H	α-helix	trans	-76.7	-40.7	174.9	-69.2	-175.1	175.6	175.8	-3	109.8	N101 T106 I107 E108	N101-R104 HydrophobicContact CB-CB 4.27Å; N101-R104 HydrophobicContact CB-CG 4.23Å; N101-R104 PolarHBondContact O-N 3.33Å; R104-T106 VanDerWaalsContact C-N 3.28Å; R104-T106 PolarHBondContact O-N 3.43Å; R104-I107 WeakPolarHBondContact O-CB 3.44Å; R104-I107 PolarHBondContact O-N 2.86Å; R104-I107 VanDerWaalsContact O-N 3.08Å; R104-E108 PolarHBondContact O-N 3.07Å
105	F	95.7	Very high	94.2	Very high	3 Å²	3	63.2 Å²	63.2	1%	0.013	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-36.7	177.2	-178.8	-103.1	0	0	0	113	F100 N101 I107 E108 A109 V164 V182 V184 F218 W229	F100-F105 HydrophobicContact CE2-CB 3.89Å; F100-F105 HydrophobicContact CE2-CD1 4.4Å; F100-F105 AromaticContact CE2-CD2 3.82Å; F100-F105 HydrophobicContact CE2-CD2 3.82Å; F100-F105 AromaticContact CE2-CG 3.74Å; F100-F105 HydrophobicContact CE2-CG 3.74Å; F100-F105 HydrophobicContact CZ-CB 4.16Å; F100-F105 HydrophobicContact CZ-CD1 4.36Å; F100-F105 HydrophobicContact CZ-CG 4.07Å; N101-F105 WeakPolarHBondContact O-CB 3.33Å; N101-F105 PolarHBondContact O-N 3.11Å; F105-I107 PolarHBondContact O-N 2.82Å; F105-E108 PolarHBondContact O-N 2.76Å; F105-A109 HydrophobicContact CE1-CB 4.21Å; F105-A109 HydrophobicContact CZ-CB 4.29Å; F105-A109 WeakPolarHBondContact O-CB 3.48Å; F105-A109 PolarHBondContact O-N 2.81Å; F105-V164 HydrophobicContact CD1-CG2 3.97Å; F105-V182 HydrophobicContact CD1-CG1 3.9Å; F105-V182 HydrophobicContact CE1-CB 3.7Å; F105-V182 HydrophobicContact CE1-CG1 3.34Å; F105-V182 HydrophobicContact CE1-CG2 4.33Å; F105-V182 HydrophobicContact CZ-CB 3.99Å; F105-V182 HydrophobicContact CZ-CG1 4.15Å; F105-V182 HydrophobicContact CZ-CG2 4.45Å; F105-V184 HydrophobicContact CD1-CG2 4.39Å; F105-V184 HydrophobicContact CE1-CG2 3.72Å; F105-F218 HydrophobicContact CZ-CB 3.9Å; F105-F218 HydrophobicContact CZ-CD2 4.24Å; F105-F218 HydrophobicContact CZ-CG 4.09Å; F105-W229 HydrophobicContact CD2-CD2 4.19Å; F105-W229 HydrophobicContact CD2-CG 4.22Å; F105-W229 AromaticContact CD2-NE1 3.98Å; F105-W229 HydrophobicContact CE2-CB 4.03Å; F105-W229 AromaticContact CE2-CD1 3.77Å; F105-W229 AromaticContact CE2-CD2 3.37Å; F105-W229 HydrophobicContact CE2-CD2 3.37Å; F105-W229 AromaticContact CE2-CE2 3.69Å; F105-W229 AromaticContact CE2-CE3 3.81Å; F105-W229 HydrophobicContact CE2-CE3 3.81Å; F105-W229 AromaticContact CE2-CG 3.47Å; F105-W229 HydrophobicContact CE2-CG 3.47Å; F105-W229 VanDerWaalsContact CE2-CG 3.47Å; F105-W229 HydrophobicContact CE2-CZ2 4.37Å; F105-W229 HydrophobicContact CE2-CZ3 4.47Å; F105-W229 AromaticContact CE2-NE1 3.9Å; F105-W229 HydrophobicContact CZ-CD2 4.03Å; F105-W229 AromaticContact CZ-CE3 3.97Å; F105-W229 HydrophobicContact CZ-CE3 3.97Å; F105-W229 HydrophobicContact CZ-CG 4.4Å; F105-W229 HydrophobicContact CZ-CZ3 4.43Å
106	T	95.4	Very high	94.4	Very high	19 Å²	19	59.2 Å²	59.2	12%	0.117	30%	0.301	C	S	.	.	H	α-helix	trans	-61.3	-33.3	176.6	46.1	0	0	0	0	113.3	S102 K103 R104 E110 P162 V164	S102-T106 WeakPolarHBondContact O-CG2 3.49Å; S102-T106 PolarHBondContact O-N 3.47Å; K103-T106 PolarHBondContact O-OG1 2.85Å; R104-T106 VanDerWaalsContact C-N 3.28Å; R104-T106 PolarHBondContact O-N 3.43Å; T106-E110 PolarHBondContact O-N 3.32Å; T106-P162 WeakPolarHBondContact CG2-O 3.17Å; T106-V164 HydrophobicContact CG2-CG2 3.79Å
107	I	96	Very high	94.7	Very high	101 Å²	101	55.8 Å²	55.8	52%	0.518	29%	0.285	S	S	.	.	H	α-helix	trans	-74.8	-44.2	177.7	-59	169.3	0	0	0	109.7	R104 F105 A109 E110 N111	R104-I107 WeakPolarHBondContact O-CB 3.44Å; R104-I107 PolarHBondContact O-N 2.86Å; R104-I107 VanDerWaalsContact O-N 3.08Å; F105-I107 PolarHBondContact O-N 2.82Å; I107-A109 VanDerWaalsContact C-N 3.34Å; I107-A109 PolarHBondContact O-N 2.82Å; I107-E110 PolarHBondContact O-N 2.92Å; I107-N111 PolarHBondContact O-N 2.95Å
108	E	96	Very high	94.9	Very high	86 Å²	86	57.9 Å²	57.9	40%	0.402	30%	0.297	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.5	-174.6	-177.8	176.5	0	0	111.7	R104 F105 E110 N111 I112	R104-E108 PolarHBondContact O-N 3.07Å; F105-E108 PolarHBondContact O-N 2.76Å; E108-E110 VanDerWaalsContact C-N 3.34Å; E108-E110 PolarHBondContact O-N 2.89Å; E108-N111 PolarHBondContact O-N 2.87Å; E108-I112 HydrophobicContact CG-CD1 3.95Å; E108-I112 WeakPolarHBondContact O-CG1 3.45Å; E108-I112 PolarHBondContact O-N 3.33Å
109	A	97	Very high	95.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-40.8	177.4	0	0	0	0	0	112.5	F105 I107 Y113 V184 F186 F218	F105-A109 HydrophobicContact CE1-CB 4.21Å; F105-A109 HydrophobicContact CZ-CB 4.29Å; F105-A109 WeakPolarHBondContact O-CB 3.48Å; F105-A109 PolarHBondContact O-N 2.81Å; I107-A109 VanDerWaalsContact C-N 3.34Å; I107-A109 PolarHBondContact O-N 2.82Å; A109-Y113 VanDerWaalsContact O-CB 3.24Å; A109-Y113 WeakPolarHBondContact O-CB 3.44Å; A109-Y113 PolarHBondContact O-N 3.3Å; A109-V184 HydrophobicContact CB-CG2 4.27Å; A109-F186 HydrophobicContact CB-CZ 4.29Å; A109-F218 HydrophobicContact CB-CD2 4.16Å; A109-F218 HydrophobicContact CB-CE1 4.26Å; A109-F218 HydrophobicContact CB-CE2 3.63Å; A109-F218 HydrophobicContact CB-CZ 3.69Å; A109-F218 VanDerWaalsContact O-CZ 3.31Å; A109-F218 WeakPolarHBondContact O-CZ 3.36Å
110	E	96.3	Very high	95.4	Very high	36 Å²	36	50.2 Å²	50.2	17%	0.168	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-46.1	174.7	-175.5	179.2	167	0	0	111.4	T106 I107 E108 I112 Y113 V114 N158 P162 F186	T106-E110 PolarHBondContact O-N 3.32Å; I107-E110 PolarHBondContact O-N 2.92Å; E108-E110 VanDerWaalsContact C-N 3.34Å; E108-E110 PolarHBondContact O-N 2.89Å; E110-I112 PolarHBondContact O-N 3.5Å; E110-Y113 WeakPolarHBondContact O-CB 3.35Å; E110-Y113 PolarHBondContact O-N 3.49Å; E110-V114 HydrophobicContact CG-CG2 4.46Å; E110-V114 WeakPolarHBondContact O-CG2 3.21Å; E110-V114 PolarHBondContact O-N 2.92Å; E110-N158 PolarHBondContact OE1-ND2 3.11Å; E110-N158 PolarHBondContact OE2-ND2 2.86Å; E110-P162 HydrophobicContact CB-CG 4.47Å; E110-F186 HydrophobicContact CB-CE1 4.08Å; E110-F186 HydrophobicContact CG-CE1 4.4Å
111	N	97.1	Very high	95.5	Very high	98 Å²	98	52.5 Å²	52.5	52%	0.524	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-46.8	178.2	-68.1	-17.7	0	0	0	111.7	I107 E108 Y113 V114 E115	I107-N111 PolarHBondContact O-N 2.95Å; E108-N111 PolarHBondContact O-N 2.87Å; N111-Y113 VanDerWaalsContact C-N 3.3Å; N111-Y113 PolarHBondContact O-N 2.89Å; N111-V114 PolarHBondContact O-N 3.43Å; N111-E115 VanDerWaalsContact O-CB 3.25Å; N111-E115 WeakPolarHBondContact O-CB 3.45Å; N111-E115 PolarHBondContact O-N 2.95Å
112	I	97.5	Very high	95.4	Very high	15 Å²	15	53.6 Å²	53.6	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-43.3	176.1	-67.2	163.7	0	0	0	110.4	E108 E110 A116 L133 F218 W229	E108-I112 HydrophobicContact CG-CD1 3.95Å; E108-I112 WeakPolarHBondContact O-CG1 3.45Å; E108-I112 PolarHBondContact O-N 3.33Å; E110-I112 PolarHBondContact O-N 3.5Å; I112-A116 WeakPolarHBondContact O-CB 3.36Å; I112-A116 PolarHBondContact O-N 2.95Å; I112-L133 HydrophobicContact CG1-CD2 4.28Å; I112-L133 HydrophobicContact CG2-CB 4.29Å; I112-L133 HydrophobicContact CG2-CD2 4.22Å; I112-F218 HydrophobicContact CB-CE1 4.09Å; I112-F218 HydrophobicContact CG2-CD1 4.43Å; I112-F218 HydrophobicContact CG2-CE1 3.84Å; I112-W229 HydrophobicContact CD1-CB 4.13Å; I112-W229 WeakPolarHBondContact CD1-O 3.46Å
113	Y	96.9	Very high	95.3	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-49	179.7	179.2	-88.7	0	0	0	111.7	A109 E110 N111 H117 W153 Q190 E214 V216 L231	A109-Y113 VanDerWaalsContact O-CB 3.24Å; A109-Y113 WeakPolarHBondContact O-CB 3.44Å; A109-Y113 PolarHBondContact O-N 3.3Å; E110-Y113 WeakPolarHBondContact O-CB 3.35Å; E110-Y113 PolarHBondContact O-N 3.49Å; N111-Y113 VanDerWaalsContact C-N 3.3Å; N111-Y113 PolarHBondContact O-N 2.89Å; Y113-H117 AromaticContact CD2-CE1 3.6Å; Y113-H117 AromaticContact CD2-ND1 3.97Å; Y113-H117 AromaticContact CE1-CE1 3.96Å; Y113-H117 AromaticContact CE1-ND1 3.9Å; Y113-H117 AromaticContact CE2-CE1 3.18Å; Y113-H117 WeakPolarHBondContact CE2-CE1 3.39Å; Y113-H117 AromaticContact CE2-ND1 3.84Å; Y113-H117 AromaticContact CE2-NE2 3.93Å; Y113-H117 AromaticContact CZ-CE1 3.35Å; Y113-H117 AromaticContact CZ-ND1 3.76Å; Y113-H117 AromaticContact CZ-NE2 3.84Å; Y113-H117 PolarHBondContact O-N 3.34Å; Y113-H117 PolarHBondContact O-ND1 3.49Å; Y113-W153 HydrophobicContact CE1-CH2 4.41Å; Y113-W153 AromaticContact CE1-CZ2 3.88Å; Y113-W153 HydrophobicContact CE1-CZ2 3.88Å; Y113-Q190 PolarHBondContact OH-NE2 3.13Å; Y113-E214 WeakPolarHBondContact CE2-OE1 3.39Å; Y113-E214 PolarHBondContact OH-OE1 3.08Å; Y113-V216 HydrophobicContact CD2-CG1 4.43Å; Y113-V216 HydrophobicContact CD2-CG2 4.04Å; Y113-V216 HydrophobicContact CE2-CG2 3.86Å; Y113-L231 HydrophobicContact CD2-CD1 4.2Å
114	V	96.9	Very high	95.1	Very high	29 Å²	29	53.8 Å²	53.8	18%	0.176	25%	0.25	C	S	.	.	H	α-helix	trans	-65.2	-49.3	-179.8	174.9	0	0	0	0	110.7	E110 N111 A116 H117 D118 W153 F155	E110-V114 HydrophobicContact CG-CG2 4.46Å; E110-V114 WeakPolarHBondContact O-CG2 3.21Å; E110-V114 PolarHBondContact O-N 2.92Å; N111-V114 PolarHBondContact O-N 3.43Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.27Å; V114-H117 PolarHBondContact O-N 3.21Å; V114-D118 PolarHBondContact O-N 2.96Å; V114-W153 HydrophobicContact CB-CH2 4.33Å; V114-W153 HydrophobicContact CG1-CH2 4.19Å; V114-W153 HydrophobicContact CG1-CZ3 4.27Å; V114-W153 HydrophobicContact CG2-CH2 4.29Å; V114-F155 HydrophobicContact CG1-CB 4.36Å; V114-F155 HydrophobicContact CG2-CB 4.39Å; V114-F155 HydrophobicContact CG2-CD1 4.09Å; V114-F155 HydrophobicContact CG2-CD2 4.01Å; V114-F155 HydrophobicContact CG2-CE1 4.32Å; V114-F155 HydrophobicContact CG2-CE2 4.26Å; V114-F155 HydrophobicContact CG2-CG 3.91Å; V114-F155 HydrophobicContact CG2-CZ 4.39Å
115	E	96.9	Very high	94.9	Very high	62 Å²	62	52.6 Å²	52.6	29%	0.29	25%	0.252	S	S	.	.	H	α-helix	trans	-59.7	-43.7	-180	-169.5	-177.1	172.6	0	0	111.5	N111 H117 D118 L119 R129 L133	N111-E115 VanDerWaalsContact O-CB 3.25Å; N111-E115 WeakPolarHBondContact O-CB 3.45Å; N111-E115 PolarHBondContact O-N 2.95Å; E115-H117 PolarHBondContact O-N 3.4Å; E115-D118 PolarHBondContact O-N 3.45Å; E115-L119 HydrophobicContact CG-CD1 4.04Å; E115-L119 HydrophobicContact CG-CG 4.49Å; E115-L119 VanDerWaalsContact O-CG 3.23Å; E115-L119 WeakPolarHBondContact O-CG 3.49Å; E115-L119 PolarHBondContact O-N 3.21Å; E115-R129 IonicContact OE1-CZ 3.29Å; E115-R129 VanDerWaalsContact OE1-CZ 3.24Å; E115-R129 IonicContact OE1-NE 3.41Å; E115-R129 PolarHBondContact OE1-NE 3.22Å; E115-R129 IonicContact OE1-NH2 3.03Å; E115-R129 PolarHBondContact OE1-NH2 3.23Å; E115-R129 IonicContact OE2-NH2 3.99Å; E115-R129 PolarHBondContact OE2-NH2 2.78Å; E115-L133 HydrophobicContact CB-CD1 3.98Å; E115-L133 HydrophobicContact CG-CD1 3.62Å
116	A	96.7	Very high	94.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-42.2	178.8	0	0	0	0	0	112.6	I112 V114 L120 L130 L133 V134	I112-A116 WeakPolarHBondContact O-CB 3.36Å; I112-A116 PolarHBondContact O-N 2.95Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.27Å; A116-L120 VanDerWaalsContact O-CB 3.26Å; A116-L120 WeakPolarHBondContact O-CB 3.31Å; A116-L120 PolarHBondContact O-N 2.74Å; A116-L120 VanDerWaalsContact O-N 3.07Å; A116-L130 HydrophobicContact CB-CD1 4.32Å; A116-L133 HydrophobicContact CB-CB 4.43Å; A116-L133 HydrophobicContact CB-CD1 4.49Å; A116-V134 HydrophobicContact CB-CG2 3.88Å
117	H	96	Very high	94.5	Very high	17 Å²	17	58.9 Å²	58.9	8%	0.079	28%	0.282	C	S	.	.	H	α-helix	trans	-74.3	-31.9	-179.9	-71.5	78.9	0	0	0	112.5	Y113 V114 E115 L120 W153	Y113-H117 AromaticContact CD2-CE1 3.6Å; Y113-H117 AromaticContact CD2-ND1 3.97Å; Y113-H117 AromaticContact CE1-CE1 3.96Å; Y113-H117 AromaticContact CE1-ND1 3.9Å; Y113-H117 AromaticContact CE2-CE1 3.18Å; Y113-H117 WeakPolarHBondContact CE2-CE1 3.39Å; Y113-H117 AromaticContact CE2-ND1 3.84Å; Y113-H117 AromaticContact CE2-NE2 3.93Å; Y113-H117 AromaticContact CZ-CE1 3.35Å; Y113-H117 AromaticContact CZ-ND1 3.76Å; Y113-H117 AromaticContact CZ-NE2 3.84Å; Y113-H117 PolarHBondContact O-N 3.34Å; Y113-H117 PolarHBondContact O-ND1 3.49Å; V114-H117 PolarHBondContact O-N 3.21Å; E115-H117 PolarHBondContact O-N 3.4Å; H117-L120 PolarHBondContact O-N 3Å; H117-W153 HydrophobicContact CB-CD2 3.55Å; H117-W153 HydrophobicContact CB-CE3 3.39Å; H117-W153 HydrophobicContact CB-CG 4.28Å; H117-W153 HydrophobicContact CB-CH2 3.75Å; H117-W153 HydrophobicContact CB-CZ2 3.93Å; H117-W153 HydrophobicContact CB-CZ3 3.48Å; H117-W153 VanDerWaalsContact CB-CZ3 3.48Å
118	D	95.6	Very high	94.4	Very high	74 Å²	74	58.6 Å²	58.6	40%	0.396	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-45	172.7	-77.7	-23.8	0	0	0	111.6	V114 E115 L120 Q121 W153	V114-D118 PolarHBondContact O-N 2.96Å; E115-D118 PolarHBondContact O-N 3.45Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 3.28Å; D118-Q121 PolarHBondContact O-N 3.43Å; D118-W153 WeakPolarHBondContact OD1-CZ3 3.41Å
119	L	95.4	Very high	94.4	Very high	30 Å²	30	59.2 Å²	59.2	16%	0.157	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-31.4	178.3	-65.2	172.2	0	0	0	112.6	E115 Q121 N122 Y123 N126 R129 L130 L133	E115-L119 HydrophobicContact CG-CD1 4.04Å; E115-L119 HydrophobicContact CG-CG 4.49Å; E115-L119 VanDerWaalsContact O-CG 3.23Å; E115-L119 WeakPolarHBondContact O-CG 3.49Å; E115-L119 PolarHBondContact O-N 3.21Å; L119-Q121 PolarHBondContact O-N 2.83Å; L119-N122 CarbonylContact O-C 3.54Å; L119-N122 VanDerWaalsContact O-C 3.29Å; L119-N122 PolarHBondContact O-N 3.29Å; L119-N122 VanDerWaalsContact O-N 3.13Å; L119-Y123 PolarHBondContact O-N 3.4Å; L119-N126 HydrophobicContact CB-CB 4.13Å; L119-N126 HydrophobicContact CD2-CB 3.88Å; L119-R129 HydrophobicContact CD1-CB 3.96Å; L119-R129 HydrophobicContact CD1-CG 3.44Å; L119-R129 VanDerWaalsContact CD1-CG 3.44Å; L119-L130 HydrophobicContact CB-CD1 4.46Å; L119-L133 HydrophobicContact CD1-CD1 3.78Å
120	L	94.2	Very high	94.3	Very high	8 Å²	8	59.3 Å²	59.3	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-25.8	-179.5	-179.1	155.4	0	0	0	113.1	A116 H117 D118 N122 Y123 M142 L146 L151	A116-L120 VanDerWaalsContact O-CB 3.26Å; A116-L120 WeakPolarHBondContact O-CB 3.31Å; A116-L120 PolarHBondContact O-N 2.74Å; A116-L120 VanDerWaalsContact O-N 3.07Å; H117-L120 PolarHBondContact O-N 3Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 3.28Å; L120-N122 PolarHBondContact O-N 2.85Å; L120-Y123 PolarHBondContact O-N 2.94Å; L120-M142 HydrophobicContact CD1-CB 3.83Å; L120-M142 HydrophobicContact CD1-CG 4.07Å; L120-M142 HydrophobicContact CD1-SD 3.87Å; L120-L146 HydrophobicContact CD1-CD1 4.4Å; L120-L146 HydrophobicContact CD2-CD1 3.39Å; L120-L146 HydrophobicContact CG-CD1 3.92Å; L120-L151 HydrophobicContact CD2-CB 4.41Å; L120-L151 HydrophobicContact CD2-CD1 3.64Å; L120-L151 HydrophobicContact CD2-CD2 3.63Å; L120-L151 HydrophobicContact CD2-CG 4.09Å
121	Q	93.4	Very high	94.1	Very high	58 Å²	58	61.3 Å²	61.3	27%	0.271	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.5	173.2	-60.1	-172.5	64.9	0	0	112.1	D118 L119 L151 W153	D118-Q121 PolarHBondContact O-N 3.43Å; L119-Q121 PolarHBondContact O-N 2.83Å; Q121-L151 HydrophobicContact CG-CD2 3.88Å; Q121-W153 PolarHBondContact NE2-O 3.33Å
122	N	91.5	Very high	94	Very high	96 Å²	96	61.7 Å²	61.7	51%	0.513	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	47.7	178	-69.4	-42.3	0	0	0	111.6	L119 L120 R124 Q125 N126	L119-N122 CarbonylContact O-C 3.54Å; L119-N122 VanDerWaalsContact O-C 3.29Å; L119-N122 PolarHBondContact O-N 3.29Å; L119-N122 VanDerWaalsContact O-N 3.13Å; L120-N122 PolarHBondContact O-N 2.85Å; N122-R124 PolarHBondContact O-N 3.39Å; N122-Q125 PolarHBondContact O-N 2.73Å; N122-N126 PolarHBondContact O-N 3.4Å
123	Y	88.5	Confident	94	Very high	42 Å²	42	61.5 Å²	61.5	17%	0.165	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-28	-170	77.2	-90.1	0	0	0	114.9	L119 L120 Q125 E127 T143 L146	L119-Y123 PolarHBondContact O-N 3.4Å; L120-Y123 PolarHBondContact O-N 2.94Å; Y123-Q125 PolarHBondContact O-N 2.91Å; Y123-E127 PolarHBondContact O-N 3.43Å; Y123-T143 HydrophobicContact CD2-CG2 4.09Å; Y123-T143 HydrophobicContact CG-CG2 4.33Å; Y123-L146 HydrophobicContact CE1-CB 4.2Å
124	R	89.2	Confident	94	Very high	170 Å²	170	61.4 Å²	61.4	64%	0.642	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-30.7	178.6	-65.9	-174.4	-177.2	127	6.9	114.1	N122 K147	N122-R124 PolarHBondContact O-N 3.39Å; R124-K147 PolarHBondContact NH2-O 3.23Å
125	Q	91.4	Very high	94	Very high	159 Å²	159	60 Å²	60	74%	0.743	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-29.6	-179.2	-67.4	174.8	-1.6	0	0	111.1	N122 Y123	N122-Q125 PolarHBondContact O-N 2.73Å; Y123-Q125 PolarHBondContact O-N 2.91Å
126	N	91.3	Very high	93.8	Very high	53 Å²	53	60.6 Å²	60.6	28%	0.283	29%	0.288	S	S	.	.	S	Bend	trans	-107.3	23.1	-170.3	-64	-26	0	0	0	113.3	L119 N122 S128 R129 L130	L119-N126 HydrophobicContact CB-CB 4.13Å; L119-N126 HydrophobicContact CD2-CB 3.88Å; N122-N126 PolarHBondContact O-N 3.4Å; N126-S128 PolarHBondContact O-N 2.89Å; N126-R129 PolarHBondContact O-N 2.89Å; N126-L130 WeakPolarHBondContact O-CB 3.32Å; N126-L130 PolarHBondContact O-N 3.38Å
127	E	90.8	Very high	93.7	Very high	101 Å²	101	63.5 Å²	63.5	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-46.1	-171.3	-154.4	-170.8	158.5	0	0	112	Y123 R129 L130 F131	Y123-E127 PolarHBondContact O-N 3.43Å; E127-R129 PolarHBondContact O-N 2.92Å; E127-L130 PolarHBondContact O-N 2.99Å; E127-L130 VanDerWaalsContact O-N 3.16Å; E127-F131 HydrophobicContact CB-CE2 4.39Å; E127-F131 HydrophobicContact CG-CD2 4.03Å; E127-F131 HydrophobicContact CG-CE2 3.42Å; E127-F131 VanDerWaalsContact CG-CE2 3.42Å; E127-F131 HydrophobicContact CG-CZ 4.09Å; E127-F131 WeakPolarHBondContact O-CD2 3.24Å; E127-F131 PolarHBondContact O-N 2.79Å; E127-F131 WeakPolarHBondContact OE1-CE2 3.22Å; E127-F131 VanDerWaalsContact OE1-CZ 3.31Å; E127-F131 WeakPolarHBondContact OE1-CZ 3.18Å
128	S	94	Very high	93.6	Very high	95 Å²	95	62.9 Å²	62.9	66%	0.664	30%	0.298	S	S	*	.	H	α-helix	trans	-58.2	-47.1	-178.4	-48	0	0	0	0	112.8	N126 L130 F131 E132	N126-S128 PolarHBondContact O-N 2.89Å; S128-L130 VanDerWaalsContact C-N 3.33Å; S128-F131 PolarHBondContact O-N 3.35Å; S128-E132 PolarHBondContact O-N 2.84Å
129	R	95.2	Very high	93.5	Very high	100 Å²	100	60.1 Å²	60.1	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-70.7	-33.8	179.8	-175.9	59.1	178	164.7	5.4	111.4	E115 L119 N126 E127 F131 E132 L133	E115-R129 IonicContact OE1-CZ 3.29Å; E115-R129 VanDerWaalsContact OE1-CZ 3.24Å; E115-R129 IonicContact OE1-NE 3.41Å; E115-R129 PolarHBondContact OE1-NE 3.22Å; E115-R129 IonicContact OE1-NH2 3.03Å; E115-R129 PolarHBondContact OE1-NH2 3.23Å; E115-R129 IonicContact OE2-NH2 3.99Å; E115-R129 PolarHBondContact OE2-NH2 2.78Å; L119-R129 HydrophobicContact CD1-CB 3.96Å; L119-R129 HydrophobicContact CD1-CG 3.44Å; L119-R129 VanDerWaalsContact CD1-CG 3.44Å; N126-R129 PolarHBondContact O-N 2.89Å; E127-R129 PolarHBondContact O-N 2.92Å; R129-F131 VanDerWaalsContact C-N 3.35Å; R129-F131 PolarHBondContact O-N 3.37Å; R129-E132 WeakPolarHBondContact CD-OE2 3.48Å; R129-E132 IonicContact CZ-OE2 3.3Å; R129-E132 IonicContact NE-OE2 3.9Å; R129-E132 IonicContact NH1-OE2 3.82Å; R129-E132 PolarHBondContact NH1-OE2 2.98Å; R129-E132 PolarHBondContact O-N 3.23Å; R129-L133 HydrophobicContact CG-CD1 4.39Å; R129-L133 WeakPolarHBondContact O-CG 3.28Å; R129-L133 PolarHBondContact O-N 3.02Å
130	L	94.7	Very high	93.4	Very high	2 Å²	2	63 Å²	63	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-65.8	-37.2	177.2	-168.4	62.3	0	0	0	111.9	A116 L119 N126 E127 S128 E132 L133 V134 L139	A116-L130 HydrophobicContact CB-CD1 4.32Å; L119-L130 HydrophobicContact CB-CD1 4.46Å; N126-L130 WeakPolarHBondContact O-CB 3.32Å; N126-L130 PolarHBondContact O-N 3.38Å; E127-L130 PolarHBondContact O-N 2.99Å; E127-L130 VanDerWaalsContact O-N 3.16Å; S128-L130 VanDerWaalsContact C-N 3.33Å; L130-E132 VanDerWaalsContact C-N 3.28Å; L130-E132 PolarHBondContact O-N 2.87Å; L130-L133 PolarHBondContact O-N 2.8Å; L130-V134 HydrophobicContact CD1-CG2 3.73Å; L130-V134 HydrophobicContact CG-CG2 4.33Å; L130-V134 WeakPolarHBondContact O-CB 3.44Å; L130-V134 PolarHBondContact O-N 3.07Å; L130-L139 HydrophobicContact CD2-CD1 3.37Å; L130-L139 HydrophobicContact CG-CD1 3.76Å
131	F	94.1	Very high	93.4	Very high	77 Å²	77	67.2 Å²	67.2	34%	0.338	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-29.8	174	-77.5	-62.8	0	0	0	114.1	E127 S128 R129 L133 V134 L139	E127-F131 HydrophobicContact CB-CE2 4.39Å; E127-F131 HydrophobicContact CG-CD2 4.03Å; E127-F131 HydrophobicContact CG-CE2 3.42Å; E127-F131 VanDerWaalsContact CG-CE2 3.42Å; E127-F131 HydrophobicContact CG-CZ 4.09Å; E127-F131 WeakPolarHBondContact O-CD2 3.24Å; E127-F131 PolarHBondContact O-N 2.79Å; E127-F131 WeakPolarHBondContact OE1-CE2 3.22Å; E127-F131 VanDerWaalsContact OE1-CZ 3.31Å; E127-F131 WeakPolarHBondContact OE1-CZ 3.18Å; S128-F131 PolarHBondContact O-N 3.35Å; R129-F131 VanDerWaalsContact C-N 3.35Å; R129-F131 PolarHBondContact O-N 3.37Å; F131-L133 VanDerWaalsContact C-N 3.35Å; F131-V134 VanDerWaalsContact O-O 3.1Å; F131-L139 HydrophobicContact CD1-CD2 3.54Å; F131-L139 HydrophobicContact CE1-CD2 3.05Å; F131-L139 HydrophobicContact CG-CD2 4.44Å; F131-L139 HydrophobicContact CZ-CD2 3.62Å
132	E	95	Very high	93.3	Very high	107 Å²	107	66.1 Å²	66.1	50%	0.5	32%	0.32	S	S	.	.	H	α-helix	trans	-72.5	-31	176.3	-67.3	175.8	-178.9	0	0	112.2	S128 R129 L130 R230	S128-E132 PolarHBondContact O-N 2.84Å; R129-E132 WeakPolarHBondContact CD-OE2 3.48Å; R129-E132 IonicContact CZ-OE2 3.3Å; R129-E132 IonicContact NE-OE2 3.9Å; R129-E132 IonicContact NH1-OE2 3.82Å; R129-E132 PolarHBondContact NH1-OE2 2.98Å; R129-E132 PolarHBondContact O-N 3.23Å; L130-E132 VanDerWaalsContact C-N 3.28Å; L130-E132 PolarHBondContact O-N 2.87Å; E132-R230 WeakPolarHBondContact O-CD 3.19Å; E132-R230 VanDerWaalsContact O-CG 3.27Å; E132-R230 WeakPolarHBondContact O-CG 3.24Å
133	L	96.4	Very high	93.3	Very high	10 Å²	10	62.7 Å²	62.7	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-95	-25.1	-175.1	-63	172.8	0	0	0	113.3	I112 E115 A116 L119 R129 L130 F131 R230 L231	I112-L133 HydrophobicContact CG1-CD2 4.28Å; I112-L133 HydrophobicContact CG2-CB 4.29Å; I112-L133 HydrophobicContact CG2-CD2 4.22Å; E115-L133 HydrophobicContact CB-CD1 3.98Å; E115-L133 HydrophobicContact CG-CD1 3.62Å; A116-L133 HydrophobicContact CB-CB 4.43Å; A116-L133 HydrophobicContact CB-CD1 4.49Å; L119-L133 HydrophobicContact CD1-CD1 3.78Å; R129-L133 HydrophobicContact CG-CD1 4.39Å; R129-L133 WeakPolarHBondContact O-CG 3.28Å; R129-L133 PolarHBondContact O-N 3.02Å; L130-L133 PolarHBondContact O-N 2.8Å; F131-L133 VanDerWaalsContact C-N 3.35Å; L133-R230 CarbonylContact O-C 3.57Å; L133-R230 VanDerWaalsContact O-CA 3.23Å; L133-R230 WeakPolarHBondContact O-CA 3.31Å; L133-L231 PolarHBondContact O-N 3.35Å
134	V	96.6	Very high	93.5	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-126.5	137.1	-170.5	-173.8	0	0	0	0	109.3	A116 L130 F131 A138 L139 M142 L231	A116-V134 HydrophobicContact CB-CG2 3.88Å; L130-V134 HydrophobicContact CD1-CG2 3.73Å; L130-V134 HydrophobicContact CG-CG2 4.33Å; L130-V134 WeakPolarHBondContact O-CB 3.44Å; L130-V134 PolarHBondContact O-N 3.07Å; F131-V134 VanDerWaalsContact O-O 3.1Å; V134-A138 HydrophobicContact CG1-CB 3.38Å; V134-L139 HydrophobicContact CG1-CB 4.29Å; V134-M142 HydrophobicContact CG1-SD 4.2Å; V134-L231 HydrophobicContact CG1-CB 4.44Å; V134-L231 HydrophobicContact CG1-CD2 4.41Å; V134-L231 HydrophobicContact CG2-CB 4.27Å
135	T	96.3	Very high	93.4	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.			trans	-68.6	156.5	173.6	64.2	0	0	0	0	111	H48 K137 A138 L139 E219 R230 L231 H232	H48-T135 HydrophobicContact CB-CG2 4.06Å; T135-K137 PolarHBondContact O-N 3.46Å; T135-A138 PolarHBondContact O-N 2.74Å; T135-A138 PolarHBondContact OG1-N 2.99Å; T135-L139 PolarHBondContact O-N 3.29Å; T135-E219 HydrophobicContact CG2-CB 4.4Å; T135-R230 HydrophobicContact CG2-CB 3.79Å; T135-L231 WeakPolarHBondContact CG2-O 3.38Å; T135-L231 PolarHBondContact N-O 3.32Å; T135-L231 PolarHBondContact OG1-O 3.34Å; T135-H232 HydrophobicContact CG2-CB 4.17Å; T135-H232 WeakPolarHBondContact OG1-CA 3.1Å
136	E	93.6	Very high	93.4	Very high	73 Å²	73	53.6 Å²	53.6	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-61.7	-34.2	-175.9	-57	76.6	-175.9	0	0	111.4	H48 V140 R230	H48-E136 IonicContact CE1-OE2 3.61Å; H48-E136 PolarHBondContact CE1-OE2 2.8Å; H48-E136 IonicContact CG-OE2 3.87Å; H48-E136 IonicContact ND1-OE2 2.73Å; H48-E136 PolarHBondContact ND1-OE2 3.16Å; E136-V140 WeakPolarHBondContact O-CG2 3.38Å; E136-V140 PolarHBondContact O-N 3.42Å; E136-R230 IonicContact OE1-NH1 2.68Å; E136-R230 PolarHBondContact OE1-NH1 3.39Å; E136-R230 VanDerWaalsContact OE1-NH1 3.09Å; E136-R230 IonicContact OE2-NH1 3.88Å; E136-R230 IonicContact OE2-NH2 3.11Å
137	K	94.1	Very high	93.3	Very high	61 Å²	61	57.3 Å²	57.3	27%	0.265	30%	0.295	S	S	.	.	H	α-helix	trans	-59.1	-57.1	169.9	165.1	164.4	171.9	46	0	112.2	G50 T135 L139 V140 D141	G50-K137 WeakPolarHBondContact O-CD 3.35Å; G50-K137 WeakPolarHBondContact O-CE 3.49Å; T135-K137 PolarHBondContact O-N 3.46Å; K137-L139 PolarHBondContact O-N 3.3Å; K137-V140 PolarHBondContact O-N 2.84Å; K137-D141 IonicContact NZ-OD1 3.64Å; K137-D141 IonicContact NZ-OD2 3.09Å; K137-D141 PolarHBondContact NZ-OD2 3.06Å; K137-D141 PolarHBondContact O-N 3.07Å
138	A	94.6	Very high	93.2	Very high	4 Å²	4	57.5 Å²	57.5	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-33.2	-174.9	0	0	0	0	0	111.7	V134 T135 V140 D141 M142 L231 H232	V134-A138 HydrophobicContact CG1-CB 3.38Å; T135-A138 PolarHBondContact O-N 2.74Å; T135-A138 PolarHBondContact OG1-N 2.99Å; A138-V140 PolarHBondContact O-N 3.5Å; A138-D141 PolarHBondContact O-N 3.37Å; A138-M142 VanDerWaalsContact O-CB 3.31Å; A138-M142 WeakPolarHBondContact O-CB 3.46Å; A138-M142 VanDerWaalsContact O-CG 3.26Å; A138-M142 WeakPolarHBondContact O-CG 3.45Å; A138-M142 PolarHBondContact O-N 2.58Å; A138-L231 HydrophobicContact CB-CD2 3.8Å; A138-L231 WeakPolarHBondContact CB-O 3.32Å; A138-H232 WeakPolarHBondContact CB-O 3.31Å
139	L	93.7	Very high	93.1	Very high	16 Å²	16	57.3 Å²	57.3	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-43.7	177.1	-177.1	68.8	0	0	0	112	L130 F131 V134 T135 K137 M142 T143	L130-L139 HydrophobicContact CD2-CD1 3.37Å; L130-L139 HydrophobicContact CG-CD1 3.76Å; F131-L139 HydrophobicContact CD1-CD2 3.54Å; F131-L139 HydrophobicContact CE1-CD2 3.05Å; F131-L139 HydrophobicContact CG-CD2 4.44Å; F131-L139 HydrophobicContact CZ-CD2 3.62Å; V134-L139 HydrophobicContact CG1-CB 4.29Å; T135-L139 PolarHBondContact O-N 3.29Å; K137-L139 PolarHBondContact O-N 3.3Å; L139-M142 PolarHBondContact O-N 3.49Å; L139-T143 HydrophobicContact CD1-CG2 3.77Å; L139-T143 HydrophobicContact CG-CG2 4.28Å; L139-T143 WeakPolarHBondContact O-CB 3.39Å; L139-T143 WeakPolarHBondContact O-CG2 3.45Å; L139-T143 PolarHBondContact O-N 3.33Å; L139-T143 PolarHBondContact O-OG1 3.29Å
140	V	93.7	Very high	93	Very high	91 Å²	91	56.1 Å²	56.1	55%	0.552	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-48	176.9	174.9	0	0	0	0	109.9	E136 K137 A138 M142 T143 A144	E136-V140 WeakPolarHBondContact O-CG2 3.38Å; E136-V140 PolarHBondContact O-N 3.42Å; K137-V140 PolarHBondContact O-N 2.84Å; A138-V140 PolarHBondContact O-N 3.5Å; V140-M142 VanDerWaalsContact C-N 3.26Å; V140-M142 PolarHBondContact O-N 2.88Å; V140-T143 PolarHBondContact O-N 3.31Å; V140-A144 VanDerWaalsContact O-CB 3.26Å; V140-A144 WeakPolarHBondContact O-CB 3.19Å; V140-A144 PolarHBondContact O-N 3.42Å
141	D	92.5	Very high	93	Very high	96 Å²	96	57.1 Å²	57.1	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-60.3	-36.7	179.5	-66.9	-17.4	0	0	0	111.8	K137 A138	K137-D141 IonicContact NZ-OD1 3.64Å; K137-D141 IonicContact NZ-OD2 3.09Å; K137-D141 PolarHBondContact NZ-OD2 3.06Å; K137-D141 PolarHBondContact O-N 3.07Å; A138-D141 PolarHBondContact O-N 3.37Å
142	M	91.9	Very high	93.1	Very high	35 Å²	35	57.8 Å²	57.8	17%	0.172	30%	0.297	C	S	.	.	H	α-helix	trans	-76	-39.1	179.1	-78.4	180	154	0	0	113.7	L120 V134 A138 L139 V140 L146 L231	L120-M142 HydrophobicContact CD1-CB 3.83Å; L120-M142 HydrophobicContact CD1-CG 4.07Å; L120-M142 HydrophobicContact CD1-SD 3.87Å; V134-M142 HydrophobicContact CG1-SD 4.2Å; A138-M142 VanDerWaalsContact O-CB 3.31Å; A138-M142 WeakPolarHBondContact O-CB 3.46Å; A138-M142 VanDerWaalsContact O-CG 3.26Å; A138-M142 WeakPolarHBondContact O-CG 3.45Å; A138-M142 PolarHBondContact O-N 2.58Å; L139-M142 PolarHBondContact O-N 3.49Å; V140-M142 VanDerWaalsContact C-N 3.26Å; V140-M142 PolarHBondContact O-N 2.88Å; M142-L146 WeakPolarHBondContact O-CD1 3.27Å; M142-L146 WeakPolarHBondContact O-CG 3.11Å; M142-L231 HydrophobicContact CE-CD1 4.1Å; M142-L231 HydrophobicContact CE-CD2 3.81Å; M142-L231 HydrophobicContact SD-CD2 4.44Å
143	T	92.4	Very high	93.2	Very high	24 Å²	24	53.2 Å²	53.2	15%	0.147	28%	0.275	C	S	.	.	H	α-helix	trans	-96	-20.1	-169.2	59.3	0	0	0	0	114.2	Y123 L139 V140 D145 L146	Y123-T143 HydrophobicContact CD2-CG2 4.09Å; Y123-T143 HydrophobicContact CG-CG2 4.33Å; L139-T143 HydrophobicContact CD1-CG2 3.77Å; L139-T143 HydrophobicContact CG-CG2 4.28Å; L139-T143 WeakPolarHBondContact O-CB 3.39Å; L139-T143 WeakPolarHBondContact O-CG2 3.45Å; L139-T143 PolarHBondContact O-N 3.33Å; L139-T143 PolarHBondContact O-OG1 3.29Å; V140-T143 PolarHBondContact O-N 3.31Å; T143-D145 VanDerWaalsContact C-N 3.29Å; T143-D145 PolarHBondContact O-N 2.85Å; T143-L146 PolarHBondContact O-N 3.15Å; T143-L146 VanDerWaalsContact O-N 3.1Å
144	A	91.3	Very high	93.2	Very high	51 Å²	51	59 Å²	59	42%	0.421	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-52.9	-45.1	-174.8	0	0	0	0	0	112.9	V140	V140-A144 VanDerWaalsContact O-CB 3.26Å; V140-A144 WeakPolarHBondContact O-CB 3.19Å; V140-A144 PolarHBondContact O-N 3.42Å
145	D	88.2	Confident	93.2	Very high	114 Å²	114	61.4 Å²	61.4	61%	0.61	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-87.5	-8.3	-176.5	-73.4	-23.4	0	0	0	114.4	T143 R149	T143-D145 VanDerWaalsContact C-N 3.29Å; T143-D145 PolarHBondContact O-N 2.85Å; D145-R149 WeakPolarHBondContact O-CD 3.33Å
146	L	91	Very high	93.2	Very high	15 Å²	15	64.8 Å²	64.8	8%	0.079	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-92.1	-7.4	-175.2	-63.6	177.5	0	0	0	113.8	L120 Y123 M142 T143 L148 R149 L151	L120-L146 HydrophobicContact CD1-CD1 4.4Å; L120-L146 HydrophobicContact CD2-CD1 3.39Å; L120-L146 HydrophobicContact CG-CD1 3.92Å; Y123-L146 HydrophobicContact CE1-CB 4.2Å; M142-L146 WeakPolarHBondContact O-CD1 3.27Å; M142-L146 WeakPolarHBondContact O-CG 3.11Å; T143-L146 PolarHBondContact O-N 3.15Å; T143-L146 VanDerWaalsContact O-N 3.1Å; L146-L148 PolarHBondContact O-N 2.68Å; L146-R149 PolarHBondContact O-N 3.22Å; L146-R149 VanDerWaalsContact O-N 3.11Å; L146-L151 HydrophobicContact CD1-CD1 4.38Å; L146-L151 HydrophobicContact CD2-CB 3.98Å; L146-L151 HydrophobicContact CD2-CD1 4Å
147	K	88.4	Confident	93.2	Very high	132 Å²	132	62.3 Å²	62.3	57%	0.574	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-34.6	-174.3	-68.1	180	-179.4	176.3	0	114.4	R124	R124-K147 PolarHBondContact NH2-O 3.23Å
148	L	89.7	Confident	93.2	Very high	105 Å²	105	62.2 Å²	62.2	55%	0.55	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	24.5	-178.4	-60.1	176.9	0	0	0	112.3	L146 R197	L146-L148 PolarHBondContact O-N 2.68Å; L148-R197 WeakPolarHBondContact O-CA 3.32Å; L148-R197 PolarHBondContact O-N 3.21Å; L148-R197 VanDerWaalsContact O-N 3.1Å
149	R	92.3	Very high	93.2	Very high	91 Å²	91	65.3 Å²	65.3	34%	0.343	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.8	-176.4	-60.2	-178.2	-171.8	168.1	3.1	109.9	D145 L146 I194 Y195	D145-R149 WeakPolarHBondContact O-CD 3.33Å; L146-R149 PolarHBondContact O-N 3.22Å; L146-R149 VanDerWaalsContact O-N 3.11Å; R149-I194 HydrophobicContact CB-CG2 4.13Å; R149-Y195 CarbonylContact C-O 3.56Å; R149-Y195 WeakPolarHBondContact CA-O 3.23Å; R149-Y195 VanDerWaalsContact CB-O 3.3Å; R149-Y195 WeakPolarHBondContact CB-O 3.36Å
150	T	93.2	Very high	93.2	Very high	75 Å²	75	67.5 Å²	67.5	46%	0.46	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.9	173.1	-52.1	0	0	0	0	108.2	I194 Y195	T150-I194 WeakPolarHBondContact O-CA 3.43Å; T150-Y195 PolarHBondContact N-O 2.87Å; T150-Y195 PolarHBondContact O-N 3.31Å
151	L	94.8	Very high	93.2	Very high	23 Å²	23	67.1 Å²	67.1	12%	0.12	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.5	177.2	178	146.4	0	0	0	109	L120 Q121 L146 W153 L192	L120-L151 HydrophobicContact CD2-CB 4.41Å; L120-L151 HydrophobicContact CD2-CD1 3.64Å; L120-L151 HydrophobicContact CD2-CD2 3.63Å; L120-L151 HydrophobicContact CD2-CG 4.09Å; Q121-L151 HydrophobicContact CG-CD2 3.88Å; L146-L151 HydrophobicContact CD1-CD1 4.38Å; L146-L151 HydrophobicContact CD2-CB 3.98Å; L146-L151 HydrophobicContact CD2-CD1 4Å; L151-W153 HydrophobicContact CD2-CB 3.6Å; L151-L192 HydrophobicContact CD1-CD1 3.94Å; L151-L192 HydrophobicContact CG-CD1 3.96Å
152	Q	94.9	Very high	93.4	Very high	90 Å²	90	63.2 Å²	63.2	42%	0.421	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.6	167.8	-70.7	-176.7	-15.4	0	0	107.5	L192 S193 Y195	Q152-L192 WeakPolarHBondContact O-CA 3.32Å; Q152-S193 PolarHBondContact N-O 3.42Å; Q152-S193 PolarHBondContact O-N 3.36Å; Q152-Y195 HydrophobicContact CB-CE2 4.48Å; Q152-Y195 HydrophobicContact CG-CE2 4.11Å; Q152-Y195 PolarHBondContact OE1-OH 3.01Å
153	W	96.6	Very high	93.4	Very high	11 Å²	11	68 Å²	68	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.6	179.2	176.7	87.3	0	0	0	109.2	Y113 V114 H117 D118 Q121 L151 F155 I191 L192	Y113-W153 HydrophobicContact CE1-CH2 4.41Å; Y113-W153 AromaticContact CE1-CZ2 3.88Å; Y113-W153 HydrophobicContact CE1-CZ2 3.88Å; V114-W153 HydrophobicContact CB-CH2 4.33Å; V114-W153 HydrophobicContact CG1-CH2 4.19Å; V114-W153 HydrophobicContact CG1-CZ3 4.27Å; V114-W153 HydrophobicContact CG2-CH2 4.29Å; H117-W153 HydrophobicContact CB-CD2 3.55Å; H117-W153 HydrophobicContact CB-CE3 3.39Å; H117-W153 HydrophobicContact CB-CG 4.28Å; H117-W153 HydrophobicContact CB-CH2 3.75Å; H117-W153 HydrophobicContact CB-CZ2 3.93Å; H117-W153 HydrophobicContact CB-CZ3 3.48Å; H117-W153 VanDerWaalsContact CB-CZ3 3.48Å; D118-W153 WeakPolarHBondContact OD1-CZ3 3.41Å; Q121-W153 PolarHBondContact NE2-O 3.33Å; L151-W153 HydrophobicContact CD2-CB 3.6Å; W153-F155 HydrophobicContact CH2-CB 3.58Å; W153-F155 HydrophobicContact CH2-CD2 4.22Å; W153-F155 HydrophobicContact CH2-CG 4.29Å; W153-F155 HydrophobicContact CZ2-CB 4.05Å; W153-F155 HydrophobicContact CZ2-CD2 4.19Å; W153-F155 HydrophobicContact CZ3-CB 4.11Å; W153-I191 WeakPolarHBondContact CA-O 3.5Å; W153-L192 HydrophobicContact CB-CD1 4.42Å
154	K	96.5	Very high	93.6	Very high	133 Å²	133	68.7 Å²	68.7	58%	0.578	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.4	129.7	175.9	-177	179.7	178.1	-176.3	0	110	I191	K154-I191 HydrophobicContact CB-CB 4.3Å; K154-I191 PolarHBondContact N-O 3.25Å; K154-I191 PolarHBondContact O-N 2.92Å
155	F	96.7	Very high	93.6	Very high	49 Å²	49	68 Å²	68	22%	0.215	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125.1	168.7	-169.3	-112.5	0	0	0	110.5	V114 W153 N158 T188	V114-F155 HydrophobicContact CG1-CB 4.36Å; V114-F155 HydrophobicContact CG2-CB 4.39Å; V114-F155 HydrophobicContact CG2-CD1 4.09Å; V114-F155 HydrophobicContact CG2-CD2 4.01Å; V114-F155 HydrophobicContact CG2-CE1 4.32Å; V114-F155 HydrophobicContact CG2-CE2 4.26Å; V114-F155 HydrophobicContact CG2-CG 3.91Å; V114-F155 HydrophobicContact CG2-CZ 4.39Å; W153-F155 HydrophobicContact CH2-CB 3.58Å; W153-F155 HydrophobicContact CH2-CD2 4.22Å; W153-F155 HydrophobicContact CH2-CG 4.29Å; W153-F155 HydrophobicContact CZ2-CB 4.05Å; W153-F155 HydrophobicContact CZ2-CD2 4.19Å; W153-F155 HydrophobicContact CZ3-CB 4.11Å; F155-N158 WeakPolarHBondContact CZ-OD1 3.25Å; F155-T188 HydrophobicContact CE2-CG2 3.98Å
156	V	96.2	Very high	93.9	Very high	71 Å²	71	62.8 Å²	62.8	43%	0.43	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-48.7	176.6	-178.1	0	0	0	0	110.1	Q189 I191 A209	V156-Q189 HydrophobicContact CB-CB 3.87Å; V156-Q189 WeakPolarHBondContact CB-O 3.2Å; V156-Q189 HydrophobicContact CG1-CB 4.24Å; V156-Q189 PolarHBondContact N-O 2.92Å; V156-I191 HydrophobicContact CG2-CD1 3.92Å; V156-I191 HydrophobicContact CG2-CG1 3.89Å; V156-A209 HydrophobicContact CG2-CB 4.02Å
157	G	95.4	Very high	94.1	Very high	21 Å²	21	62.5 Å²	62.5	22%	0.216	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.4	176.2	177.1	0	0	0	0	0	113.6	T188 Q189	G157-T188 CarbonylContact O-C 3.2Å; G157-T188 WeakPolarHBondContact O-CA 3.33Å; G157-Q189 PolarHBondContact N-O 3.1Å; G157-Q189 PolarHBondContact O-N 2.97Å
158	N	94.3	Very high	94.4	Very high	59 Å²	59	56.6 Å²	56.6	32%	0.316	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.6	175.6	-64.7	-40	0	0	0	110.9	E110 F155 T188	E110-N158 PolarHBondContact OE1-ND2 3.11Å; E110-N158 PolarHBondContact OE2-ND2 2.86Å; F155-N158 WeakPolarHBondContact CZ-OD1 3.25Å; N158-T188 VanDerWaalsContact OD1-CG2 3.27Å; N158-T188 WeakPolarHBondContact OD1-CG2 3.41Å
159	I	94.1	Very high	94.6	Very high	69 Å²	69	51.9 Å²	51.9	35%	0.354	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-47	169.1	-55.2	167.7	0	0	0	108.6	Y187 Q189 D211	I159-Y187 HydrophobicContact CB-CD1 3.92Å; I159-Y187 HydrophobicContact CB-CE1 3.99Å; I159-Y187 HydrophobicContact CB-CG 4.28Å; I159-Y187 HydrophobicContact CD1-CD1 4.44Å; I159-Y187 HydrophobicContact CD1-CD2 3.97Å; I159-Y187 HydrophobicContact CD1-CE1 4.09Å; I159-Y187 HydrophobicContact CD1-CE2 3.56Å; I159-Y187 HydrophobicContact CD1-CG 4.37Å; I159-Y187 HydrophobicContact CG2-CD1 3.94Å; I159-Y187 HydrophobicContact CG2-CE1 3.59Å; I159-Y187 PolarHBondContact N-O 2.93Å; I159-Q189 HydrophobicContact CD1-CG 3.71Å; I159-Q189 HydrophobicContact CG1-CG 3.69Å; I159-D211 HydrophobicContact CD1-CB 3.82Å; I159-D211 WeakPolarHBondContact CD1-OD1 3.08Å
160	E	93.2	Very high	94.6	Very high	63 Å²	63	50.7 Å²	50.7	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144.2	169.5	-70.6	-177.2	173.7	0	0	109.8	R185 Y187	E160-R185 IonicContact OE2-CZ 3.37Å; E160-R185 IonicContact OE2-NH1 2.65Å; E160-R185 PolarHBondContact OE2-NH1 3.44Å; E160-R185 IonicContact OE2-NH2 3.38Å; E160-R185 PolarHBondContact OE2-NH2 2.96Å; E160-Y187 HydrophobicContact CB-CD1 4.12Å; E160-Y187 HydrophobicContact CG-CD1 3.81Å; E160-Y187 PolarHBondContact N-O 3.1Å
161	P	94.1	Very high	94.5	Very high	83 Å²	83	52.6 Å²	52.6	54%	0.539	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	143.3	177	27	-34.7	0	0	0	110.6	R163	P161-R163 WeakPolarHBondContact O-CG 3.34Å
162	P	95.4	Very high	94.1	Very high	14 Å²	14	54.2 Å²	54.2	9%	0.091	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	141.9	-180	20.9	-30.3	0	0	0	111.7	T106 E110 V184 R185 F186	T106-P162 WeakPolarHBondContact CG2-O 3.17Å; E110-P162 HydrophobicContact CB-CG 4.47Å; P162-V184 HydrophobicContact CB-CG1 3.85Å; P162-R185 WeakPolarHBondContact CA-O 3.45Å; P162-F186 HydrophobicContact CB-CD1 3.97Å; P162-F186 HydrophobicContact CB-CE1 3.77Å; P162-F186 HydrophobicContact CB-CZ 4.4Å; P162-F186 HydrophobicContact CG-CE1 4.28Å
163	R	93.6	Very high	93.3	Very high	136 Å²	136	56 Å²	56	51%	0.513	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.6	-178.4	-56.4	-176.1	-172.4	175.4	2.8	110.9	P161 V184 R185	P161-R163 WeakPolarHBondContact O-CG 3.34Å; R163-V184 WeakPolarHBondContact O-CA 3.43Å; R163-R185 PolarHBondContact N-O 3.26Å; R163-R185 PolarHBondContact O-N 3.43Å
164	V	94.8	Very high	92.5	Very high	38 Å²	38	58.9 Å²	58.9	23%	0.23	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	127.5	170.4	-179.1	0	0	0	0	109.3	F105 T106 I167 V182 V184	F105-V164 HydrophobicContact CD1-CG2 3.97Å; T106-V164 HydrophobicContact CG2-CG2 3.79Å; V164-I167 HydrophobicContact CG1-CD1 4.2Å; V164-I167 HydrophobicContact CG1-CG1 3.91Å; V164-V182 HydrophobicContact CB-CG1 4.49Å; V164-V182 HydrophobicContact CG1-CG1 3.58Å; V164-V182 HydrophobicContact CG2-CG1 4.17Å; V164-V184 HydrophobicContact CG2-CG2 4.42Å
165	V	92.2	Very high	91.6	Very high	35 Å²	35	61.9 Å²	61.9	21%	0.212	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-51.5	-176.1	177.5	0	0	0	0	110.8	Y56 N86 T183 R185 Y215	Y56-V165 HydrophobicContact CD1-CG1 3.8Å; Y56-V165 HydrophobicContact CD2-CG1 3.57Å; Y56-V165 HydrophobicContact CE1-CG1 3.53Å; Y56-V165 HydrophobicContact CE2-CG1 3.3Å; Y56-V165 HydrophobicContact CG-CG1 3.8Å; N86-V165 PolarHBondContact ND2-O 3.01Å; V165-T183 PolarHBondContact N-O 3.41Å; V165-R185 HydrophobicContact CG2-CB 3.68Å; V165-Y215 HydrophobicContact CG2-CD1 4.26Å; V165-Y215 HydrophobicContact CG2-CE1 4.02Å
166	Q	93.6	Very high	91	Very high	6 Å²	6	61.4 Å²	61.4	3%	0.028	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	142.5	-174.3	157.5	178.6	-13.2	0	0	110.6	D54 Y56 R168 T183	D54-Q166 PolarHBondContact O-NE2 2.9Å; Y56-Q166 HydrophobicContact CD2-CB 4.48Å; Q166-R168 HydrophobicContact CG-CG 4.06Å; Q166-R168 VanDerWaalsContact NE2-CG 3.3Å; Q166-R168 VanDerWaalsContact NE2-NH2 3.11Å; Q166-T183 WeakPolarHBondContact CA-OG1 3.23Å; Q166-T183 VanDerWaalsContact CB-OG1 3.28Å; Q166-T183 WeakPolarHBondContact CB-OG1 3.22Å; Q166-T183 PolarHBondContact N-OG1 3.47Å; Q166-T183 PolarHBondContact O-N 2.9Å; Q166-T183 PolarHBondContact O-OG1 3.16Å
167	I	95.3	Very high	90.7	Very high	9 Å²	9	60.7 Å²	60.7	5%	0.046	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.1	177.2	-57.8	175.1	0	0	0	106.6	N86 D89 L90 L93 F100 V164 Q181 V182	N86-I167 PolarHBondContact OD1-O 3.31Å; D89-I167 HydrophobicContact CB-CG2 4.31Å; D89-I167 WeakPolarHBondContact CB-O 3.39Å; D89-I167 VanDerWaalsContact OD2-O 3.04Å; L90-I167 HydrophobicContact CB-CD1 4.39Å; L90-I167 HydrophobicContact CD1-CD1 3.8Å; L93-I167 HydrophobicContact CD2-CG2 4.26Å; F100-I167 HydrophobicContact CE1-CD1 4.16Å; V164-I167 HydrophobicContact CG1-CD1 4.2Å; V164-I167 HydrophobicContact CG1-CG1 3.91Å; I167-Q181 CarbonylContact C-O 3.58Å; I167-Q181 WeakPolarHBondContact CA-O 3.19Å; I167-V182 HydrophobicContact CG1-CG1 4.21Å; I167-V182 HydrophobicContact CG1-CG2 4.21Å; I167-V182 HydrophobicContact CG2-CG2 4.26Å
168	R	95.2	Very high	90.6	Very high	7 Å²	7	59.9 Å²	59.9	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.5	176.6	-69	-72.8	169.3	-88.3	-13.2	109.2	F53 D54 N86 D89 Q166 A180 Q181	F53-R168 HydrophobicContact CB-CB 4.14Å; D54-R168 HydrophobicContact CB-CG 4.3Å; D54-R168 IonicContact OD2-NE 3.5Å; N86-R168 PolarHBondContact OD1-NH1 3.44Å; N86-R168 PolarHBondContact OD1-NH2 3.33Å; D89-R168 WeakPolarHBondContact OD2-CA 3.41Å; D89-R168 WeakPolarHBondContact OD2-CD 3.18Å; D89-R168 IonicContact OD2-CZ 3.7Å; D89-R168 IonicContact OD2-NH1 3.24Å; D89-R168 PolarHBondContact OD2-NH1 3.24Å; D89-R168 VanDerWaalsContact OD2-NH1 3.11Å; Q166-R168 HydrophobicContact CG-CG 4.06Å; Q166-R168 VanDerWaalsContact NE2-CG 3.3Å; Q166-R168 VanDerWaalsContact NE2-NH2 3.11Å; R168-A180 CarbonylContact O-C 3.57Å; R168-A180 WeakPolarHBondContact O-CA 3.47Å; R168-Q181 PolarHBondContact N-O 3.5Å; R168-Q181 PolarHBondContact O-N 3.42Å
169	C	94.3	Very high	90.6	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.4	175.6	-64.2	0	0	0	0	108.6	D89 L92 V178 Y179	D89-C169 HydrophobicContact CB-CB 4.26Å; D89-C169 PolarHBondContact O-SG 3.05Å; L92-C169 HydrophobicContact CB-CB 4.49Å; L92-C169 HydrophobicContact CD2-CB 3.79Å; L92-C169 HydrophobicContact CG-CB 4.36Å; C169-V178 HydrophobicContact CB-CG1 4.47Å; C169-Y179 WeakPolarHBondContact CA-O 3.39Å
170	N	93	Very high	90.7	Very high	66 Å²	66	53.8 Å²	53.8	35%	0.353	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147.7	179.3	-76.1	-11.4	0	0	0	110.9	F53 Y179	F53-N170 HydrophobicContact CD1-CB 4.48Å; F53-N170 WeakPolarHBondContact CD1-ND2 3.32Å; F53-N170 HydrophobicContact CD2-CB 3.91Å; F53-N170 HydrophobicContact CE1-CB 4.22Å; F53-N170 HydrophobicContact CE2-CB 3.61Å; F53-N170 HydrophobicContact CG-CB 4.34Å; F53-N170 WeakPolarHBondContact CG-ND2 3.49Å; F53-N170 HydrophobicContact CZ-CB 3.77Å; N170-Y179 PolarHBondContact N-O 2.54Å; N170-Y179 PolarHBondContact O-N 2.96Å
171	E	91	Very high	90.9	Very high	115 Å²	115	51 Å²	51	54%	0.537	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.2	169.1	-72.4	172.5	-148.3	0	0	109.9	N177 V178	E171-N177 CarbonylContact C-O 3.52Å; E171-N177 VanDerWaalsContact CA-O 3.3Å; E171-N177 WeakPolarHBondContact CA-O 3.2Å; E171-V178 HydrophobicContact CG-CG2 3.75Å
172	L	85.2	Confident	91	Very high	58 Å²	58	47 Å²	47	30%	0.304	25%	0.245	S	C	.	.			trans	-128.2	143.8	-180	-165.9	70.5	0	0	0	111.4	T49 S174 N177 Y179	T49-L172 HydrophobicContact CG2-CD2 4.24Å; L172-S174 PolarHBondContact O-N 3.39Å; L172-N177 PolarHBondContact N-O 2.82Å; L172-N177 VanDerWaalsContact O-CB 3.32Å; L172-N177 WeakPolarHBondContact O-CB 3.26Å; L172-Y179 HydrophobicContact CB-CD2 3.94Å; L172-Y179 HydrophobicContact CB-CE2 3.91Å
173	L	78.9	Confident	91	Very high	126 Å²	126	46.5 Å²	46.5	66%	0.66	24%	0.242	S	C	*	.	S	Bend	trans	67.3	-62	-178.8	-53.1	169.3	0	0	0	114.8	I46	I46-L173 HydrophobicContact CB-CD1 4.41Å; I46-L173 HydrophobicContact CD1-CD1 3.95Å; I46-L173 HydrophobicContact CG1-CD1 4.15Å
174	S	79.1	Confident	91.1	Very high	72 Å²	72	40 Å²	40	50%	0.503	22%	0.217	S	C	.	.	S	Bend	trans	-130.6	148.4	-176.6	-170.8	0	0	0	0	110.5	L172 G176 N177	L172-S174 PolarHBondContact O-N 3.39Å; S174-G176 PolarHBondContact O-N 2.91Å; S174-N177 PolarHBondContact O-N 2.88Å; S174-N177 VanDerWaalsContact O-N 3.12Å
175	K	78.6	Confident	91.1	Very high	196 Å²	196	39.6 Å²	39.6	85%	0.852	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	112.5	172.1	-65.3	-176.8	-179.7	-178.8	0	107.8
176	G	82.8	Confident	91.2	Very high	40 Å²	40	38 Å²	38	41%	0.412	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	120.2	-15.4	-176.4	0	0	0	0	0	115.1	S174 V178 S223	S174-G176 PolarHBondContact O-N 2.91Å; G176-V178 PolarHBondContact O-N 2.86Å; G176-S223 WeakPolarHBondContact O-CB 3.41Å; G176-S223 PolarHBondContact O-OG 3.12Å
177	N	90.5	Very high	91.3	Very high	55 Å²	55	40.2 Å²	40.2	29%	0.294	21%	0.21	S	C	.	.			trans	-93.4	90.8	173	-73	-9.2	0	0	0	109.8	E171 L172 S174 Y179	E171-N177 CarbonylContact C-O 3.52Å; E171-N177 VanDerWaalsContact CA-O 3.3Å; E171-N177 WeakPolarHBondContact CA-O 3.2Å; L172-N177 PolarHBondContact N-O 2.82Å; L172-N177 VanDerWaalsContact O-CB 3.32Å; L172-N177 WeakPolarHBondContact O-CB 3.26Å; S174-N177 PolarHBondContact O-N 2.88Å; S174-N177 VanDerWaalsContact O-N 3.12Å; N177-Y179 HydrophobicContact CB-CE2 4.11Å
178	V	93.3	Very high	91.3	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.9	-175.5	-172.2	0	0	0	0	109.2	L92 C169 E171 G176 H221 I222 S223	L92-V178 HydrophobicContact CD2-CG1 4.23Å; C169-V178 HydrophobicContact CB-CG1 4.47Å; E171-V178 HydrophobicContact CG-CG2 3.75Å; G176-V178 PolarHBondContact O-N 2.86Å; V178-H221 PolarHBondContact O-CD2 3.06Å; V178-I222 HydrophobicContact CG1-CD1 3.77Å; V178-I222 PolarHBondContact O-N 3.09Å; V178-S223 PolarHBondContact N-OG 3.09Å; V178-S223 PolarHBondContact O-N 3.5Å
179	Y	95.1	Very high	91.3	Very high	1 Å²	1	43 Å²	43	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.3	174.5	-62.5	-94.2	0	0	0	109.4	I46 T49 C169 N170 L172 N177 H221	I46-Y179 PolarHBondContact O-OH 2.86Å; T49-Y179 HydrophobicContact CG2-CD1 3.75Å; T49-Y179 HydrophobicContact CG2-CD2 3.82Å; T49-Y179 HydrophobicContact CG2-CE1 4.49Å; T49-Y179 HydrophobicContact CG2-CG 3.35Å; C169-Y179 WeakPolarHBondContact CA-O 3.39Å; N170-Y179 PolarHBondContact N-O 2.54Å; N170-Y179 PolarHBondContact O-N 2.96Å; L172-Y179 HydrophobicContact CB-CD2 3.94Å; L172-Y179 HydrophobicContact CB-CE2 3.91Å; N177-Y179 HydrophobicContact CB-CE2 4.11Å; Y179-H221 HydrophobicContact CD1-CB 3.86Å; Y179-H221 AromaticContact CD1-CD2 3.74Å; Y179-H221 HydrophobicContact CE1-CB 3.69Å; Y179-H221 AromaticContact CE1-CD2 3.38Å; Y179-H221 WeakPolarHBondContact CE1-CD2 3.36Å; Y179-H221 AromaticContact CE1-CG 3.54Å; Y179-H221 AromaticContact CE2-CD2 3.9Å; Y179-H221 AromaticContact CZ-CD2 3.46Å; Y179-H221 VanDerWaalsContact CZ-CD2 3.46Å; Y179-H221 AromaticContact CZ-CG 3.97Å; Y179-H221 AromaticContact CZ-NE2 3.76Å
180	A	95.4	Very high	91.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.3	170.4	0	0	0	0	0	110	L93 R168 E219 R220 I222 W229	L93-A180 HydrophobicContact CD1-CB 3.86Å; R168-A180 CarbonylContact O-C 3.57Å; R168-A180 WeakPolarHBondContact O-CA 3.47Å; A180-E219 CarbonylContact O-C 3.56Å; A180-E219 VanDerWaalsContact O-CA 3.23Å; A180-E219 WeakPolarHBondContact O-CA 3.26Å; A180-R220 PolarHBondContact N-O 2.71Å; A180-R220 PolarHBondContact O-N 3.23Å; A180-I222 HydrophobicContact CB-CD1 3.25Å; A180-I222 HydrophobicContact CB-CG1 3.5Å; A180-W229 HydrophobicContact CB-CH2 3.83Å; A180-W229 HydrophobicContact CB-CZ3 4.24Å
181	Q	96.6	Very high	91.6	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.5	167.6	-69.1	-178.9	-2	0	0	110	T49 T51 F53 I167 R168 V217 F218 E219	T49-Q181 PolarHBondContact OG1-NE2 3.37Å; T51-Q181 PolarHBondContact O-NE2 3.21Å; F53-Q181 HydrophobicContact CD2-CG 4.06Å; F53-Q181 HydrophobicContact CE2-CG 4.49Å; I167-Q181 CarbonylContact C-O 3.58Å; I167-Q181 WeakPolarHBondContact CA-O 3.19Å; R168-Q181 PolarHBondContact N-O 3.5Å; R168-Q181 PolarHBondContact O-N 3.42Å; Q181-V217 HydrophobicContact CB-CG1 3.96Å; Q181-V217 HydrophobicContact CG-CG1 4.26Å; Q181-F218 CarbonylContact C-O 3.57Å; Q181-F218 VanDerWaalsContact CA-O 3.22Å; Q181-F218 WeakPolarHBondContact CA-O 3.31Å; Q181-E219 HydrophobicContact CG-CB 4.16Å; Q181-E219 HydrophobicContact CG-CG 4.01Å; Q181-E219 PolarHBondContact NE2-OE2 2.87Å
182	V	96.3	Very high	91.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.8	176.4	-176.4	0	0	0	0	108.7	F100 F105 V164 I167 V184 V217 F218 W229	F100-V182 HydrophobicContact CZ-CG2 4.35Å; F105-V182 HydrophobicContact CD1-CG1 3.9Å; F105-V182 HydrophobicContact CE1-CB 3.7Å; F105-V182 HydrophobicContact CE1-CG1 3.34Å; F105-V182 HydrophobicContact CE1-CG2 4.33Å; F105-V182 HydrophobicContact CZ-CB 3.99Å; F105-V182 HydrophobicContact CZ-CG1 4.15Å; F105-V182 HydrophobicContact CZ-CG2 4.45Å; V164-V182 HydrophobicContact CB-CG1 4.49Å; V164-V182 HydrophobicContact CG1-CG1 3.58Å; V164-V182 HydrophobicContact CG2-CG1 4.17Å; I167-V182 HydrophobicContact CG1-CG1 4.21Å; I167-V182 HydrophobicContact CG1-CG2 4.21Å; I167-V182 HydrophobicContact CG2-CG2 4.26Å; V182-V184 HydrophobicContact CG1-CG2 4.25Å; V182-V217 WeakPolarHBondContact O-CA 3.48Å; V182-F218 PolarHBondContact N-O 2.89Å; V182-F218 PolarHBondContact O-N 3.49Å; V182-W229 HydrophobicContact CB-CH2 4.48Å; V182-W229 HydrophobicContact CB-CZ3 4.17Å; V182-W229 HydrophobicContact CG2-CH2 3.4Å; V182-W229 HydrophobicContact CG2-CZ2 4.35Å; V182-W229 HydrophobicContact CG2-CZ3 3.51Å
183	T	96.3	Very high	92.2	Very high	4 Å²	4	36 Å²	36	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125	176	61.7	0	0	0	0	109.8	V165 Q166 V216 V217	V165-T183 PolarHBondContact N-O 3.41Å; Q166-T183 WeakPolarHBondContact CA-OG1 3.23Å; Q166-T183 VanDerWaalsContact CB-OG1 3.28Å; Q166-T183 WeakPolarHBondContact CB-OG1 3.22Å; Q166-T183 PolarHBondContact N-OG1 3.47Å; Q166-T183 PolarHBondContact O-N 2.9Å; Q166-T183 PolarHBondContact O-OG1 3.16Å; T183-V216 WeakPolarHBondContact CA-O 2.97Å; T183-V217 HydrophobicContact CG2-CB 4.49Å; T183-V217 HydrophobicContact CG2-CG1 4.3Å; T183-V217 HydrophobicContact CG2-CG2 3.79Å
184	V	96.1	Very high	92.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.5	-179.2	-175.5	0	0	0	0	108.8	F105 A109 P162 R163 V164 V182 F186 Y215 V216 F218	F105-V184 HydrophobicContact CD1-CG2 4.39Å; F105-V184 HydrophobicContact CE1-CG2 3.72Å; A109-V184 HydrophobicContact CB-CG2 4.27Å; P162-V184 HydrophobicContact CB-CG1 3.85Å; R163-V184 WeakPolarHBondContact O-CA 3.43Å; V164-V184 HydrophobicContact CG2-CG2 4.42Å; V182-V184 HydrophobicContact CG1-CG2 4.25Å; V184-F186 HydrophobicContact CB-CD2 4.38Å; V184-F186 HydrophobicContact CB-CE2 3.89Å; V184-F186 HydrophobicContact CB-CZ 4.48Å; V184-F186 HydrophobicContact CG1-CD2 4.15Å; V184-F186 HydrophobicContact CG1-CE2 3.72Å; V184-F186 HydrophobicContact CG1-CZ 3.95Å; V184-Y215 CarbonylContact O-C 3.59Å; V184-Y215 WeakPolarHBondContact O-CA 3.26Å; V184-V216 PolarHBondContact N-O 3.23Å; V184-V216 PolarHBondContact O-N 2.73Å; V184-F218 HydrophobicContact CB-CE2 4.29Å; V184-F218 HydrophobicContact CG2-CD2 4.01Å; V184-F218 HydrophobicContact CG2-CE2 4.1Å
185	R	94.6	Very high	93.6	Very high	29 Å²	29	29.9 Å²	29.9	11%	0.109	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119.6	171.6	179.1	174.9	176	-95.9	8.3	108.6	D62 E160 P162 R163 V165 Y215	D62-R185 IonicContact OD1-CZ 3.51Å; D62-R185 IonicContact OD1-NE 3.41Å; D62-R185 PolarHBondContact OD1-NE 3.02Å; D62-R185 IonicContact OD1-NH2 2.7Å; D62-R185 PolarHBondContact OD1-NH2 3.39Å; D62-R185 IonicContact OD2-CZ 2.83Å; D62-R185 IonicContact OD2-NE 3.56Å; D62-R185 PolarHBondContact OD2-NE 3.06Å; D62-R185 IonicContact OD2-NH2 3.44Å; D62-R185 PolarHBondContact OD2-NH2 3.42Å; E160-R185 IonicContact OE2-CZ 3.37Å; E160-R185 IonicContact OE2-NH1 2.65Å; E160-R185 PolarHBondContact OE2-NH1 3.44Å; E160-R185 IonicContact OE2-NH2 3.38Å; E160-R185 PolarHBondContact OE2-NH2 2.96Å; P162-R185 WeakPolarHBondContact CA-O 3.45Å; R163-R185 PolarHBondContact N-O 3.26Å; R163-R185 PolarHBondContact O-N 3.43Å; V165-R185 HydrophobicContact CG2-CB 3.68Å; R185-Y215 HydrophobicContact CB-CD1 4.03Å; R185-Y215 HydrophobicContact CB-CE1 3.79Å; R185-Y215 HydrophobicContact CG-CD1 4.42Å; R185-Y215 HydrophobicContact CG-CE1 3.88Å
186	F	95.1	Very high	94.3	Very high	1 Å²	1	22.2 Å²	22.2	0%	0.004	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.3	171	-74.8	-81.1	0	0	0	109.4	A109 E110 P162 V184 T188 L213 E214 V216 F218	A109-F186 HydrophobicContact CB-CZ 4.29Å; E110-F186 HydrophobicContact CB-CE1 4.08Å; E110-F186 HydrophobicContact CG-CE1 4.4Å; P162-F186 HydrophobicContact CB-CD1 3.97Å; P162-F186 HydrophobicContact CB-CE1 3.77Å; P162-F186 HydrophobicContact CB-CZ 4.4Å; P162-F186 HydrophobicContact CG-CE1 4.28Å; V184-F186 HydrophobicContact CB-CD2 4.38Å; V184-F186 HydrophobicContact CB-CE2 3.89Å; V184-F186 HydrophobicContact CB-CZ 4.48Å; V184-F186 HydrophobicContact CG1-CD2 4.15Å; V184-F186 HydrophobicContact CG1-CE2 3.72Å; V184-F186 HydrophobicContact CG1-CZ 3.95Å; F186-T188 HydrophobicContact CB-CG2 4.15Å; F186-T188 HydrophobicContact CD1-CG2 4.23Å; F186-L213 WeakPolarHBondContact O-CA 3.49Å; F186-E214 HydrophobicContact CB-CG 3.89Å; F186-E214 PolarHBondContact N-O 2.94Å; F186-E214 PolarHBondContact O-N 2.87Å; F186-V216 HydrophobicContact CD2-CB 3.91Å; F186-V216 HydrophobicContact CD2-CG2 3.63Å; F186-V216 HydrophobicContact CE2-CB 3.88Å; F186-V216 HydrophobicContact CE2-CG2 3.99Å; F186-F218 AromaticContact CE2-CE2 3.96Å; F186-F218 HydrophobicContact CE2-CE2 3.96Å; F186-F218 HydrophobicContact CE2-CZ 4.27Å; F186-F218 HydrophobicContact CZ-CE2 4.36Å; F186-F218 HydrophobicContact CZ-CZ 4.4Å
187	Y	94.1	Very high	94.7	Very high	53 Å²	53	28 Å²	28	21%	0.208	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	99.1	168.7	-174.7	-146.8	0	0	0	109.2	I159 E160 D211 V212 L213	I159-Y187 HydrophobicContact CB-CD1 3.92Å; I159-Y187 HydrophobicContact CB-CE1 3.99Å; I159-Y187 HydrophobicContact CB-CG 4.28Å; I159-Y187 HydrophobicContact CD1-CD1 4.44Å; I159-Y187 HydrophobicContact CD1-CD2 3.97Å; I159-Y187 HydrophobicContact CD1-CE1 4.09Å; I159-Y187 HydrophobicContact CD1-CE2 3.56Å; I159-Y187 HydrophobicContact CD1-CG 4.37Å; I159-Y187 HydrophobicContact CG2-CD1 3.94Å; I159-Y187 HydrophobicContact CG2-CE1 3.59Å; I159-Y187 PolarHBondContact N-O 2.93Å; E160-Y187 HydrophobicContact CB-CD1 4.12Å; E160-Y187 HydrophobicContact CG-CD1 3.81Å; E160-Y187 PolarHBondContact N-O 3.1Å; Y187-D211 HydrophobicContact CE2-CB 4.08Å; Y187-V212 WeakPolarHBondContact CA-O 3.3Å; Y187-L213 HydrophobicContact CD2-CB 3.86Å; Y187-L213 HydrophobicContact CD2-CD1 4.38Å; Y187-L213 HydrophobicContact CD2-CG 4.39Å; Y187-L213 HydrophobicContact CE2-CB 4.38Å; Y187-L213 HydrophobicContact CG-CD1 4.5Å
188	T	95.4	Very high	94.8	Very high	0 Å²	0	32 Å²	32	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.2	-160.6	61.2	0	0	0	0	111.1	F155 G157 N158 F186 Q190 V212	F155-T188 HydrophobicContact CE2-CG2 3.98Å; G157-T188 CarbonylContact O-C 3.2Å; G157-T188 WeakPolarHBondContact O-CA 3.33Å; N158-T188 VanDerWaalsContact OD1-CG2 3.27Å; N158-T188 WeakPolarHBondContact OD1-CG2 3.41Å; F186-T188 HydrophobicContact CB-CG2 4.15Å; F186-T188 HydrophobicContact CD1-CG2 4.23Å; T188-Q190 PolarHBondContact OG1-NE2 2.86Å; T188-V212 PolarHBondContact N-O 2.99Å; T188-V212 PolarHBondContact O-N 3.37Å
189	Q	96.2	Very high	94.6	Very high	73 Å²	73	34.3 Å²	34.3	34%	0.341	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.5	166.8	-74.5	-176	-13.4	0	0	109.9	V156 G157 I159 D211	V156-Q189 HydrophobicContact CB-CB 3.87Å; V156-Q189 WeakPolarHBondContact CB-O 3.2Å; V156-Q189 HydrophobicContact CG1-CB 4.24Å; V156-Q189 PolarHBondContact N-O 2.92Å; G157-Q189 PolarHBondContact N-O 3.1Å; G157-Q189 PolarHBondContact O-N 2.97Å; I159-Q189 HydrophobicContact CD1-CG 3.71Å; I159-Q189 HydrophobicContact CG1-CG 3.69Å; Q189-D211 WeakPolarHBondContact CG-OD1 2.98Å; Q189-D211 PolarHBondContact NE2-OD1 2.91Å
190	Q	96.7	Very high	94.5	Very high	16 Å²	16	42.3 Å²	42.3	8%	0.075	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.1	-177	-55.6	-177.5	14.1	0	0	110.4	Y113 T188 A209 V210 V212 E214	Y113-Q190 PolarHBondContact OH-NE2 3.13Å; T188-Q190 PolarHBondContact OG1-NE2 2.86Å; Q190-A209 WeakPolarHBondContact O-CA 3.38Å; Q190-V210 PolarHBondContact N-O 3.39Å; Q190-V210 PolarHBondContact O-N 2.92Å; Q190-V212 HydrophobicContact CB-CG2 4.35Å; Q190-V212 HydrophobicContact CG-CG2 4.46Å; Q190-E214 PolarHBondContact NE2-OE1 3.46Å
191	I	96.6	Very high	94.4	Very high	26 Å²	26	44.9 Å²	44.9	13%	0.133	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.8	169.5	-64.3	169.6	0	0	0	107	W153 K154 V156 P206 A209	W153-I191 WeakPolarHBondContact CA-O 3.5Å; K154-I191 HydrophobicContact CB-CB 4.3Å; K154-I191 PolarHBondContact N-O 3.25Å; K154-I191 PolarHBondContact O-N 2.92Å; V156-I191 HydrophobicContact CG2-CD1 3.92Å; V156-I191 HydrophobicContact CG2-CG1 3.89Å; I191-P206 WeakPolarHBondContact CG2-O 3.48Å; I191-A209 HydrophobicContact CG1-CB 4.01Å
192	L	94.9	Very high	94.1	Very high	58 Å²	58	45.5 Å²	45.5	30%	0.304	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.5	177.9	177.1	64.6	0	0	0	109.7	L151 Q152 W153 I194 Y203 G204 N205	L151-L192 HydrophobicContact CD1-CD1 3.94Å; L151-L192 HydrophobicContact CG-CD1 3.96Å; Q152-L192 WeakPolarHBondContact O-CA 3.32Å; W153-L192 HydrophobicContact CB-CD1 4.42Å; L192-I194 HydrophobicContact CD1-CG1 4.33Å; L192-Y203 HydrophobicContact CD2-CD1 4.32Å; L192-Y203 HydrophobicContact CD2-CE1 3.96Å; L192-G204 VanDerWaalsContact O-CA 3.3Å; L192-G204 WeakPolarHBondContact O-CA 3.23Å; L192-N205 PolarHBondContact O-N 3.23Å
193	S	94.3	Very high	93.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.1	172.8	-69.1	0	0	0	0	110.4	Q152 Y203 P206	Q152-S193 PolarHBondContact N-O 3.42Å; Q152-S193 PolarHBondContact O-N 3.36Å; S193-Y203 WeakPolarHBondContact CA-O 3.3Å; S193-P206 WeakPolarHBondContact OG-CA 3.3Å; S193-P206 WeakPolarHBondContact OG-CD 3.34Å
194	I	94.1	Very high	93.6	Very high	25 Å²	25	50 Å²	50	13%	0.128	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.2	177.9	-57.4	176.2	0	0	0	108.6	R149 T150 L192 L202 Y203	R149-I194 HydrophobicContact CB-CG2 4.13Å; T150-I194 WeakPolarHBondContact O-CA 3.43Å; L192-I194 HydrophobicContact CD1-CG1 4.33Å; I194-L202 HydrophobicContact CG2-CD2 4.38Å; I194-L202 WeakPolarHBondContact O-CB 3.43Å; I194-L202 PolarHBondContact O-N 3.31Å; I194-Y203 HydrophobicContact CD1-CD1 4.13Å; I194-Y203 HydrophobicContact CG1-CD1 4.5Å; I194-Y203 PolarHBondContact N-O 3.29Å; I194-Y203 PolarHBondContact O-N 2.7Å
195	Y	93.7	Very high	93.4	Very high	44 Å²	44	53.3 Å²	53.3	17%	0.173	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.7	177	-59	-92.3	0	0	0	110.6	R149 T150 Q152 G199 R200 L201	R149-Y195 CarbonylContact C-O 3.56Å; R149-Y195 WeakPolarHBondContact CA-O 3.23Å; R149-Y195 VanDerWaalsContact CB-O 3.3Å; R149-Y195 WeakPolarHBondContact CB-O 3.36Å; T150-Y195 PolarHBondContact N-O 2.87Å; T150-Y195 PolarHBondContact O-N 3.31Å; Q152-Y195 HydrophobicContact CB-CE2 4.48Å; Q152-Y195 HydrophobicContact CG-CE2 4.11Å; Q152-Y195 PolarHBondContact OE1-OH 3.01Å; Y195-G199 WeakPolarHBondContact CD1-O 3.27Å; Y195-R200 CarbonylContact C-O 3.59Å; Y195-R200 VanDerWaalsContact CA-O 3.28Å; Y195-R200 WeakPolarHBondContact CA-O 3.32Å; Y195-L201 HydrophobicContact CD1-CB 4.29Å; Y195-L201 HydrophobicContact CD1-CD1 4.37Å; Y195-L201 HydrophobicContact CE1-CB 4.11Å; Y195-L201 HydrophobicContact CE1-CD1 3.93Å
196	N	92.1	Very high	93.3	Very high	34 Å²	34	54.2 Å²	54.2	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	171.8	170.9	-168.1	-0.3	0	0	0	110.7	F198 G199 R200 L202	N196-F198 PolarHBondContact O-N 3.38Å; N196-G199 PolarHBondContact O-N 2.65Å; N196-R200 PolarHBondContact N-O 2.94Å; N196-L202 HydrophobicContact CB-CD1 4.42Å
197	R	91.6	Very high	93.3	Very high	161 Å²	161	60.9 Å²	60.9	61%	0.608	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-23.5	175.5	76.4	179.5	82.5	179.4	4	115	L148	L148-R197 WeakPolarHBondContact O-CA 3.32Å; L148-R197 PolarHBondContact O-N 3.21Å; L148-R197 VanDerWaalsContact O-N 3.1Å
198	F	91.6	Very high	93.4	Very high	141 Å²	141	62 Å²	62	62%	0.618	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	6.4	179.8	-55	-68.3	0	0	0	113.5	N196 R200	N196-F198 PolarHBondContact O-N 3.38Å; F198-R200 VanDerWaalsContact C-N 3.32Å; F198-R200 PolarHBondContact O-N 3.22Å
199	G	91.1	Very high	93.4	Very high	52 Å²	52	64 Å²	64	54%	0.536	33%	0.331	S	S	.	.	S	Bend	trans	76.9	10.8	-178.5	0	0	0	0	0	115.2	Y195 N196	Y195-G199 WeakPolarHBondContact CD1-O 3.27Å; N196-G199 PolarHBondContact O-N 2.65Å
200	R	92.7	Very high	93.2	Very high	169 Å²	169	64.6 Å²	64.6	64%	0.638	34%	0.34	S	S	*	.			trans	-83.6	137	175.5	-59.8	177.5	-172.8	169.5	1	110.4	Y195 N196 F198 L202	Y195-R200 CarbonylContact C-O 3.59Å; Y195-R200 VanDerWaalsContact CA-O 3.28Å; Y195-R200 WeakPolarHBondContact CA-O 3.32Å; N196-R200 PolarHBondContact N-O 2.94Å; F198-R200 VanDerWaalsContact C-N 3.32Å; F198-R200 PolarHBondContact O-N 3.22Å; R200-L202 PolarHBondContact O-N 3.34Å
201	L	91.6	Very high	93.1	Very high	53 Å²	53	67.7 Å²	67.7	28%	0.277	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	127	175.5	-173.5	67.1	0	0	0	110.2	Y195 Y203 I247	Y195-L201 HydrophobicContact CD1-CB 4.29Å; Y195-L201 HydrophobicContact CD1-CD1 4.37Å; Y195-L201 HydrophobicContact CE1-CB 4.11Å; Y195-L201 HydrophobicContact CE1-CD1 3.93Å; L201-Y203 WeakPolarHBondContact CD1-O 3.5Å; L201-I247 HydrophobicContact CB-CD1 4.42Å; L201-I247 HydrophobicContact CD2-CD1 4.07Å; L201-I247 HydrophobicContact CG-CD1 4.06Å
202	L	91.1	Very high	92.8	Very high	17 Å²	17	68.4 Å²	68.4	9%	0.089	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-37.9	-177.5	180	144.6	0	0	0	111.2	I194 N196 R200 Y246 I247	I194-L202 HydrophobicContact CG2-CD2 4.38Å; I194-L202 WeakPolarHBondContact O-CB 3.43Å; I194-L202 PolarHBondContact O-N 3.31Å; N196-L202 HydrophobicContact CB-CD1 4.42Å; R200-L202 PolarHBondContact O-N 3.34Å; L202-Y246 HydrophobicContact CD2-CD1 3.38Å; L202-Y246 HydrophobicContact CD2-CE1 3.56Å; L202-Y246 HydrophobicContact CG-CD1 4.23Å; L202-I247 PolarHBondContact O-N 3.34Å
203	Y	90.9	Very high	92.7	Very high	63 Å²	63	67.5 Å²	67.5	25%	0.247	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	148	-180	178.6	-102.2	0	0	0	111.1	L192 S193 I194 L201 Y244 Y246	L192-Y203 HydrophobicContact CD2-CD1 4.32Å; L192-Y203 HydrophobicContact CD2-CE1 3.96Å; S193-Y203 WeakPolarHBondContact CA-O 3.3Å; I194-Y203 HydrophobicContact CD1-CD1 4.13Å; I194-Y203 HydrophobicContact CG1-CD1 4.5Å; I194-Y203 PolarHBondContact N-O 3.29Å; I194-Y203 PolarHBondContact O-N 2.7Å; L201-Y203 WeakPolarHBondContact CD1-O 3.5Å; Y203-Y244 HydrophobicContact CE2-CD1 4.07Å; Y203-Y246 HydrophobicContact CD2-CD1 4.5Å
204	G	91	Very high	92.6	Very high	34 Å²	34	68.5 Å²	68.5	35%	0.351	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.9	-173.5	175.4	0	0	0	0	0	114.2	L192	L192-G204 VanDerWaalsContact O-CA 3.3Å; L192-G204 WeakPolarHBondContact O-CA 3.23Å
205	N	92.4	Very high	92.6	Very high	71 Å²	71	67.5 Å²	67.5	38%	0.38	36%	0.357	S	S	.	.			trans	-141.4	127	176.5	-178.2	-14.5	0	0	0	108.2	L192 D207 T208	L192-N205 PolarHBondContact O-N 3.23Å; N205-D207 PolarHBondContact O-N 3.04Å; N205-D207 PolarHBondContact OD1-N 2.94Å; N205-D207 VanDerWaalsContact OD1-N 3.09Å; N205-T208 PolarHBondContact ND2-OG1 3.47Å
206	P	93.2	Very high	92.7	Very high	47 Å²	47	65.4 Å²	65.4	31%	0.305	35%	0.349	S	S	.	.	S	Bend	trans	-67.3	-19.7	-176.7	25.9	-36.1	0	0	0	114.4	I191 S193	I191-P206 WeakPolarHBondContact CG2-O 3.48Å; S193-P206 WeakPolarHBondContact OG-CA 3.3Å; S193-P206 WeakPolarHBondContact OG-CD 3.34Å
207	D	94.1	Very high	93	Very high	141 Å²	141	63.8 Å²	63.8	75%	0.754	34%	0.34	S	S	*	.	S	Bend	trans	-104.4	-18.9	-174.2	-60.2	-42.7	0	0	0	113.3	N205	N205-D207 PolarHBondContact O-N 3.04Å; N205-D207 PolarHBondContact OD1-N 2.94Å; N205-D207 VanDerWaalsContact OD1-N 3.09Å
208	T	95.2	Very high	93.3	Very high	76 Å²	76	56.1 Å²	56.1	47%	0.466	31%	0.311	S	S	.	.			trans	-100.4	117.4	-173.6	-55.3	0	0	0	0	111.1	N205	N205-T208 PolarHBondContact ND2-OG1 3.47Å
209	A	95.3	Very high	93.5	Very high	42 Å²	42	49.5 Å²	49.5	35%	0.347	28%	0.282	S	S	.	.			trans	-73.6	138.3	171	0	0	0	0	0	110.9	V156 Q190 I191	V156-A209 HydrophobicContact CG2-CB 4.02Å; Q190-A209 WeakPolarHBondContact O-CA 3.38Å; I191-A209 HydrophobicContact CG1-CB 4.01Å
210	V	93.8	Very high	93.7	Very high	87 Å²	87	49.2 Å²	49.2	53%	0.527	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.8	177.6	179.6	0	0	0	0	109	Q190 V212	Q190-V210 PolarHBondContact N-O 3.39Å; Q190-V210 PolarHBondContact O-N 2.92Å; V210-V212 PolarHBondContact O-N 3.05Å
211	D	93.6	Very high	93.8	Very high	80 Å²	80	42.5 Å²	42.5	43%	0.428	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	118.9	172.1	-68.1	0.8	0	0	0	109.7	I159 Y187 Q189	I159-D211 HydrophobicContact CD1-CB 3.82Å; I159-D211 WeakPolarHBondContact CD1-OD1 3.08Å; Y187-D211 HydrophobicContact CE2-CB 4.08Å; Q189-D211 WeakPolarHBondContact CG-OD1 2.98Å; Q189-D211 PolarHBondContact NE2-OD1 2.91Å
212	V	91.6	Very high	93.9	Very high	42 Å²	42	40.7 Å²	40.7	26%	0.255	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.9	-178.5	-178.2	0	0	0	0	109.3	Y187 T188 Q190 V210 E214	Y187-V212 WeakPolarHBondContact CA-O 3.3Å; T188-V212 PolarHBondContact N-O 2.99Å; T188-V212 PolarHBondContact O-N 3.37Å; Q190-V212 HydrophobicContact CB-CG2 4.35Å; Q190-V212 HydrophobicContact CG-CG2 4.46Å; V210-V212 PolarHBondContact O-N 3.05Å; V212-E214 HydrophobicContact CG1-CB 4.46Å; V212-E214 HydrophobicContact CG1-CG 4.38Å
213	L	91.4	Very high	93.8	Very high	39 Å²	39	41.9 Å²	41.9	20%	0.204	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.8	170.6	-172.2	155.9	0	0	0	109.1	F186 Y187 Y215	F186-L213 WeakPolarHBondContact O-CA 3.49Å; Y187-L213 HydrophobicContact CD2-CB 3.86Å; Y187-L213 HydrophobicContact CD2-CD1 4.38Å; Y187-L213 HydrophobicContact CD2-CG 4.39Å; Y187-L213 HydrophobicContact CE2-CB 4.38Å; Y187-L213 HydrophobicContact CG-CD1 4.5Å; L213-Y215 HydrophobicContact CD2-CD2 4.18Å; L213-Y215 HydrophobicContact CD2-CE2 3.52Å
214	E	92.6	Very high	93.9	Very high	20 Å²	20	42 Å²	42	9%	0.093	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.2	-176.6	62.7	-175.1	152	0	0	112.6	Y113 F186 Q190 V212 V216 K234	Y113-E214 WeakPolarHBondContact CE2-OE1 3.39Å; Y113-E214 PolarHBondContact OH-OE1 3.08Å; F186-E214 HydrophobicContact CB-CG 3.89Å; F186-E214 PolarHBondContact N-O 2.94Å; F186-E214 PolarHBondContact O-N 2.87Å; Q190-E214 PolarHBondContact NE2-OE1 3.46Å; V212-E214 HydrophobicContact CG1-CB 4.46Å; V212-E214 HydrophobicContact CG1-CG 4.38Å; E214-V216 HydrophobicContact CG-CG2 3.99Å; E214-K234 WeakPolarHBondContact OE2-CD 3.44Å; E214-K234 WeakPolarHBondContact OE2-CE 3.07Å; E214-K234 IonicContact OE2-NZ 3.35Å; E214-K234 PolarHBondContact OE2-NZ 3.27Å
215	Y	94.6	Very high	93.8	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.02	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	98.6	178.7	-70.2	-90.2	0	0	0	108	Y56 P58 D62 V165 V184 R185 L213 K234 V235	Y56-Y215 AromaticContact CD1-CD1 3.76Å; Y56-Y215 HydrophobicContact CD1-CD1 3.76Å; Y56-Y215 AromaticContact CD1-CE1 3.7Å; Y56-Y215 HydrophobicContact CD1-CE1 3.7Å; Y56-Y215 HydrophobicContact CD1-CG 4.42Å; Y56-Y215 AromaticContact CE1-CD1 3.96Å; Y56-Y215 HydrophobicContact CE1-CD1 3.96Å; Y56-Y215 AromaticContact CE1-CE1 3.39Å; Y56-Y215 HydrophobicContact CE1-CE1 3.39Å; Y56-Y215 AromaticContact CE1-CZ 3.84Å; P58-Y215 HydrophobicContact CB-CD2 4.27Å; P58-Y215 HydrophobicContact CB-CE1 4.41Å; P58-Y215 HydrophobicContact CB-CE2 3.46Å; P58-Y215 VanDerWaalsContact CB-CE2 3.46Å; P58-Y215 WeakPolarHBondContact CB-OH 3.16Å; P58-Y215 HydrophobicContact CG-CD2 4.4Å; P58-Y215 HydrophobicContact CG-CE2 3.97Å; D62-Y215 PolarHBondContact OD2-OH 2.95Å; V165-Y215 HydrophobicContact CG2-CD1 4.26Å; V165-Y215 HydrophobicContact CG2-CE1 4.02Å; V184-Y215 CarbonylContact O-C 3.59Å; V184-Y215 WeakPolarHBondContact O-CA 3.26Å; R185-Y215 HydrophobicContact CB-CD1 4.03Å; R185-Y215 HydrophobicContact CB-CE1 3.79Å; R185-Y215 HydrophobicContact CG-CD1 4.42Å; R185-Y215 HydrophobicContact CG-CE1 3.88Å; L213-Y215 HydrophobicContact CD2-CD2 4.18Å; L213-Y215 HydrophobicContact CD2-CE2 3.52Å; Y215-K234 CarbonylContact O-C 3.59Å; Y215-K234 WeakPolarHBondContact O-CA 3.33Å; Y215-V235 PolarHBondContact O-N 3.04Å
216	V	96.2	Very high	93.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.1	-177	-177.5	0	0	0	0	109	Y113 T183 V184 F186 E214 F218 L231 K234	Y113-V216 HydrophobicContact CD2-CG1 4.43Å; Y113-V216 HydrophobicContact CD2-CG2 4.04Å; Y113-V216 HydrophobicContact CE2-CG2 3.86Å; T183-V216 WeakPolarHBondContact CA-O 2.97Å; V184-V216 PolarHBondContact N-O 3.23Å; V184-V216 PolarHBondContact O-N 2.73Å; F186-V216 HydrophobicContact CD2-CB 3.91Å; F186-V216 HydrophobicContact CD2-CG2 3.63Å; F186-V216 HydrophobicContact CE2-CB 3.88Å; F186-V216 HydrophobicContact CE2-CG2 3.99Å; E214-V216 HydrophobicContact CG-CG2 3.99Å; V216-F218 HydrophobicContact CB-CE2 4.12Å; V216-F218 HydrophobicContact CG1-CD2 4.31Å; V216-F218 HydrophobicContact CG1-CE2 3.71Å; V216-F218 HydrophobicContact CG1-CZ 3.92Å; V216-L231 HydrophobicContact CG1-CD1 3.96Å; V216-L231 HydrophobicContact CG1-CG 4.02Å; V216-K234 HydrophobicContact CG2-CG 4.39Å
217	V	97.1	Very high	93.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.2	176.9	-171.1	0	0	0	0	108.7	I52 Q181 V182 T183 H232 G233 V235	I52-V217 HydrophobicContact CD1-CB 4.48Å; I52-V217 HydrophobicContact CD1-CG2 3.86Å; I52-V217 HydrophobicContact CG1-CB 4.49Å; I52-V217 HydrophobicContact CG1-CG2 4.2Å; I52-V217 HydrophobicContact CG2-CG1 4.44Å; I52-V217 HydrophobicContact CG2-CG2 4.08Å; Q181-V217 HydrophobicContact CB-CG1 3.96Å; Q181-V217 HydrophobicContact CG-CG1 4.26Å; V182-V217 WeakPolarHBondContact O-CA 3.48Å; T183-V217 HydrophobicContact CG2-CB 4.49Å; T183-V217 HydrophobicContact CG2-CG1 4.3Å; T183-V217 HydrophobicContact CG2-CG2 3.79Å; V217-H232 HydrophobicContact CG1-CB 4.47Å; V217-H232 PolarHBondContact O-N 3.29Å; V217-G233 PolarHBondContact N-O 3.42Å; V217-G233 PolarHBondContact O-N 3.28Å; V217-V235 HydrophobicContact CG2-CG2 3.49Å; V217-V235 VanDerWaalsContact CG2-CG2 3.49Å
218	F	97.7	Very high	93.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	144.1	168.3	-64.4	-93.7	0	0	0	109	F105 A109 I112 Q181 V182 V184 F186 V216 W229 R230	F105-F218 HydrophobicContact CZ-CB 3.9Å; F105-F218 HydrophobicContact CZ-CD2 4.24Å; F105-F218 HydrophobicContact CZ-CG 4.09Å; A109-F218 HydrophobicContact CB-CD2 4.16Å; A109-F218 HydrophobicContact CB-CE1 4.26Å; A109-F218 HydrophobicContact CB-CE2 3.63Å; A109-F218 HydrophobicContact CB-CZ 3.69Å; A109-F218 VanDerWaalsContact O-CZ 3.31Å; A109-F218 WeakPolarHBondContact O-CZ 3.36Å; I112-F218 HydrophobicContact CB-CE1 4.09Å; I112-F218 HydrophobicContact CG2-CD1 4.43Å; I112-F218 HydrophobicContact CG2-CE1 3.84Å; Q181-F218 CarbonylContact C-O 3.57Å; Q181-F218 VanDerWaalsContact CA-O 3.22Å; Q181-F218 WeakPolarHBondContact CA-O 3.31Å; V182-F218 PolarHBondContact N-O 2.89Å; V182-F218 PolarHBondContact O-N 3.49Å; V184-F218 HydrophobicContact CB-CE2 4.29Å; V184-F218 HydrophobicContact CG2-CD2 4.01Å; V184-F218 HydrophobicContact CG2-CE2 4.1Å; F186-F218 AromaticContact CE2-CE2 3.96Å; F186-F218 HydrophobicContact CE2-CE2 3.96Å; F186-F218 HydrophobicContact CE2-CZ 4.27Å; F186-F218 HydrophobicContact CZ-CE2 4.36Å; F186-F218 HydrophobicContact CZ-CZ 4.4Å; V216-F218 HydrophobicContact CB-CE2 4.12Å; V216-F218 HydrophobicContact CG1-CD2 4.31Å; V216-F218 HydrophobicContact CG1-CE2 3.71Å; V216-F218 HydrophobicContact CG1-CZ 3.92Å; F218-W229 HydrophobicContact CB-CE3 4.13Å; F218-R230 CarbonylContact C-O 3.29Å; F218-R230 VanDerWaalsContact CA-O 3.22Å; F218-R230 WeakPolarHBondContact CA-O 3.43Å
219	E	96.5	Very high	93.7	Very high	2 Å²	2	46 Å²	46	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.6	176.4	-174.4	173.7	95.6	0	0	110.5	H48 T49 T135 A180 Q181 R230 H232	H48-E219 WeakPolarHBondContact CA-OE1 3.49Å; H48-E219 WeakPolarHBondContact CB-OE1 3.43Å; T49-E219 WeakPolarHBondContact CB-OE2 3.43Å; T49-E219 WeakPolarHBondContact CG2-OE2 3.41Å; T49-E219 PolarHBondContact N-OE1 3.07Å; T49-E219 PolarHBondContact OG1-OE2 3.31Å; T135-E219 HydrophobicContact CG2-CB 4.4Å; A180-E219 CarbonylContact O-C 3.56Å; A180-E219 VanDerWaalsContact O-CA 3.23Å; A180-E219 WeakPolarHBondContact O-CA 3.26Å; Q181-E219 HydrophobicContact CG-CB 4.16Å; Q181-E219 HydrophobicContact CG-CG 4.01Å; Q181-E219 PolarHBondContact NE2-OE2 2.87Å; E219-R230 PolarHBondContact N-O 3.45Å; E219-R230 PolarHBondContact O-N 3.45Å; E219-H232 HydrophobicContact CB-CB 3.68Å; E219-H232 IonicContact OE1-CE1 3.05Å; E219-H232 IonicContact OE1-ND1 3.68Å; E219-H232 PolarHBondContact OE1-ND1 3.32Å; E219-H232 IonicContact OE2-CE1 3.44Å; E219-H232 PolarHBondContact OE2-CE1 2.81Å; E219-H232 VanDerWaalsContact OE2-CE1 3.3Å; E219-H232 IonicContact OE2-CG 2.68Å; E219-H232 IonicContact OE2-ND1 3.58Å; E219-H232 PolarHBondContact OE2-ND1 2.97Å; E219-H232 IonicContact OE2-NE2 2.81Å
220	R	95.1	Very high	93.8	Very high	45 Å²	45	45.6 Å²	45.6	17%	0.17	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133.1	169.9	179.5	176.1	-180	164.6	11	108.9	E97 A180 I222 G227 W229	E97-R220 IonicContact OE1-NH1 3.44Å; E97-R220 PolarHBondContact OE1-NH1 3.47Å; E97-R220 IonicContact OE2-CZ 2.71Å; E97-R220 IonicContact OE2-NH1 3.93Å; E97-R220 PolarHBondContact OE2-NH1 3.17Å; A180-R220 PolarHBondContact N-O 2.71Å; A180-R220 PolarHBondContact O-N 3.23Å; R220-I222 PolarHBondContact O-N 3.23Å; R220-G227 PolarHBondContact NE-O 3.3Å; R220-G227 PolarHBondContact NH2-O 3.21Å; R220-W229 HydrophobicContact CB-CD2 3.7Å; R220-W229 HydrophobicContact CB-CE3 3.53Å; R220-W229 HydrophobicContact CB-CG 4.35Å; R220-W229 HydrophobicContact CB-CH2 4.07Å; R220-W229 HydrophobicContact CB-CZ2 4.24Å; R220-W229 HydrophobicContact CB-CZ3 3.72Å; R220-W229 HydrophobicContact CG-CD2 4.46Å
221	H	94.3	Very high	94	Very high	28 Å²	28	41.5 Å²	41.5	13%	0.13	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	103.2	165.2	-174	-151.9	0	0	0	107.4	V178 Y179 S223 D224	V178-H221 PolarHBondContact O-CD2 3.06Å; Y179-H221 HydrophobicContact CD1-CB 3.86Å; Y179-H221 AromaticContact CD1-CD2 3.74Å; Y179-H221 HydrophobicContact CE1-CB 3.69Å; Y179-H221 AromaticContact CE1-CD2 3.38Å; Y179-H221 WeakPolarHBondContact CE1-CD2 3.36Å; Y179-H221 AromaticContact CE1-CG 3.54Å; Y179-H221 AromaticContact CE2-CD2 3.9Å; Y179-H221 AromaticContact CZ-CD2 3.46Å; Y179-H221 VanDerWaalsContact CZ-CD2 3.46Å; Y179-H221 AromaticContact CZ-CG 3.97Å; Y179-H221 AromaticContact CZ-NE2 3.76Å; H221-S223 VanDerWaalsContact C-N 3.34Å; H221-D224 HydrophobicContact CB-CB 4.34Å; H221-D224 VanDerWaalsContact ND1-CB 3.31Å; H221-D224 WeakPolarHBondContact ND1-CB 3.15Å
222	I	93.3	Very high	94.1	Very high	15 Å²	15	37.7 Å²	37.7	8%	0.077	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-31.6	-170.7	-51.8	169.6	0	0	0	110.9	L93 H96 V178 A180 R220 D224	L93-I222 HydrophobicContact CD1-CD1 3.8Å; L93-I222 HydrophobicContact CD1-CG1 4.07Å; H96-I222 HydrophobicContact CB-CG2 3.14Å; V178-I222 HydrophobicContact CG1-CD1 3.77Å; V178-I222 PolarHBondContact O-N 3.09Å; A180-I222 HydrophobicContact CB-CD1 3.25Å; A180-I222 HydrophobicContact CB-CG1 3.5Å; R220-I222 PolarHBondContact O-N 3.23Å; I222-D224 PolarHBondContact O-N 3.26Å
223	S	91	Very high	94.3	Very high	42 Å²	42	36.2 Å²	36.2	29%	0.294	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.1	-179.7	-59.1	0	0	0	0	113.8	G176 V178 H221	G176-S223 WeakPolarHBondContact O-CB 3.41Å; G176-S223 PolarHBondContact O-OG 3.12Å; V178-S223 PolarHBondContact N-OG 3.09Å; V178-S223 PolarHBondContact O-N 3.5Å; H221-S223 VanDerWaalsContact C-N 3.34Å
224	D	91	Very high	94.4	Very high	67 Å²	67	38.5 Å²	38.5	36%	0.358	19%	0.186	S	C	.	.	S	Bend	trans	-90	127.8	174.9	-179.4	16.1	0	0	0	110.4	H221 I222 Y226 G227	H221-D224 HydrophobicContact CB-CB 4.34Å; H221-D224 VanDerWaalsContact ND1-CB 3.31Å; H221-D224 WeakPolarHBondContact ND1-CB 3.15Å; I222-D224 PolarHBondContact O-N 3.26Å; D224-Y226 PolarHBondContact O-N 3.42Å; D224-Y226 PolarHBondContact OD1-N 3Å; D224-G227 PolarHBondContact O-N 3.5Å; D224-G227 VanDerWaalsContact O-N 3.09Å
225	E	89.8	Confident	94.2	Very high	171 Å²	171	38.3 Å²	38.3	80%	0.799	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.9	179.6	-62.8	-178.6	170.7	0	0	111.9
226	Y	91.9	Very high	93.5	Very high	191 Å²	191	42.7 Å²	42.7	75%	0.749	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	2.5	179.4	-56.5	-78.1	0	0	0	113	D224 T228	D224-Y226 PolarHBondContact O-N 3.42Å; D224-Y226 PolarHBondContact OD1-N 3Å; Y226-T228 PolarHBondContact O-N 3.16Å
227	G	90.8	Very high	92.3	Very high	9 Å²	9	48.3 Å²	48.3	9%	0.093	24%	0.238	C	C	.	.			trans	-60.3	124	-178.6	0	0	0	0	0	110.9	R220 D224	R220-G227 PolarHBondContact NE-O 3.3Å; R220-G227 PolarHBondContact NH2-O 3.21Å; D224-G227 PolarHBondContact O-N 3.5Å; D224-G227 VanDerWaalsContact O-N 3.09Å
228	T	94.3	Very high	90.9	Very high	76 Å²	76	53.1 Å²	53.1	47%	0.466	27%	0.269	S	S	.	.			trans	-105.6	162.1	172.9	57.3	0	0	0	0	110.8	Y226 R230	Y226-T228 PolarHBondContact O-N 3.16Å; T228-R230 PolarHBondContact O-N 3.07Å
229	W	96.4	Very high	89.3	Confident	5 Å²	5	59.9 Å²	59.9	2%	0.019	31%	0.306	C	S	.	.			trans	-73.6	124.6	170.4	-70	106.7	0	0	0	110.1	L93 F100 F105 I112 A180 V182 F218 R220	L93-W229 HydrophobicContact CD1-CH2 4.19Å; L93-W229 HydrophobicContact CD1-CZ2 4.1Å; L93-W229 HydrophobicContact CD2-CH2 4.23Å; L93-W229 HydrophobicContact CD2-CZ2 4.26Å; F100-W229 AromaticContact CD2-CZ2 3.85Å; F100-W229 HydrophobicContact CD2-CZ2 3.85Å; F100-W229 HydrophobicContact CE2-CH2 4.28Å; F100-W229 AromaticContact CE2-CZ2 3.55Å; F100-W229 HydrophobicContact CE2-CZ2 3.55Å; F100-W229 HydrophobicContact CZ-CZ2 4.46Å; F105-W229 HydrophobicContact CD2-CD2 4.19Å; F105-W229 HydrophobicContact CD2-CG 4.22Å; F105-W229 AromaticContact CD2-NE1 3.98Å; F105-W229 HydrophobicContact CE2-CB 4.03Å; F105-W229 AromaticContact CE2-CD1 3.77Å; F105-W229 AromaticContact CE2-CD2 3.37Å; F105-W229 HydrophobicContact CE2-CD2 3.37Å; F105-W229 AromaticContact CE2-CE2 3.69Å; F105-W229 AromaticContact CE2-CE3 3.81Å; F105-W229 HydrophobicContact CE2-CE3 3.81Å; F105-W229 AromaticContact CE2-CG 3.47Å; F105-W229 HydrophobicContact CE2-CG 3.47Å; F105-W229 VanDerWaalsContact CE2-CG 3.47Å; F105-W229 HydrophobicContact CE2-CZ2 4.37Å; F105-W229 HydrophobicContact CE2-CZ3 4.47Å; F105-W229 AromaticContact CE2-NE1 3.9Å; F105-W229 HydrophobicContact CZ-CD2 4.03Å; F105-W229 AromaticContact CZ-CE3 3.97Å; F105-W229 HydrophobicContact CZ-CE3 3.97Å; F105-W229 HydrophobicContact CZ-CG 4.4Å; F105-W229 HydrophobicContact CZ-CZ3 4.43Å; I112-W229 HydrophobicContact CD1-CB 4.13Å; I112-W229 WeakPolarHBondContact CD1-O 3.46Å; A180-W229 HydrophobicContact CB-CH2 3.83Å; A180-W229 HydrophobicContact CB-CZ3 4.24Å; V182-W229 HydrophobicContact CB-CH2 4.48Å; V182-W229 HydrophobicContact CB-CZ3 4.17Å; V182-W229 HydrophobicContact CG2-CH2 3.4Å; V182-W229 HydrophobicContact CG2-CZ2 4.35Å; V182-W229 HydrophobicContact CG2-CZ3 3.51Å; F218-W229 HydrophobicContact CB-CE3 4.13Å; R220-W229 HydrophobicContact CB-CD2 3.7Å; R220-W229 HydrophobicContact CB-CE3 3.53Å; R220-W229 HydrophobicContact CB-CG 4.35Å; R220-W229 HydrophobicContact CB-CH2 4.07Å; R220-W229 HydrophobicContact CB-CZ2 4.24Å; R220-W229 HydrophobicContact CB-CZ3 3.72Å; R220-W229 HydrophobicContact CG-CD2 4.46Å
230	R	97.1	Very high	87.7	Confident	33 Å²	33	62 Å²	62	13%	0.125	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.6	-178.1	-61.9	-172.1	-69	162	0.1	111.3	G47 E132 L133 T135 E136 F218 E219 T228 H232	G47-R230 PolarHBondContact O-NH2 3.36Å; E132-R230 WeakPolarHBondContact O-CD 3.19Å; E132-R230 VanDerWaalsContact O-CG 3.27Å; E132-R230 WeakPolarHBondContact O-CG 3.24Å; L133-R230 CarbonylContact O-C 3.57Å; L133-R230 VanDerWaalsContact O-CA 3.23Å; L133-R230 WeakPolarHBondContact O-CA 3.31Å; T135-R230 HydrophobicContact CG2-CB 3.79Å; E136-R230 IonicContact OE1-NH1 2.68Å; E136-R230 PolarHBondContact OE1-NH1 3.39Å; E136-R230 VanDerWaalsContact OE1-NH1 3.09Å; E136-R230 IonicContact OE2-NH1 3.88Å; E136-R230 IonicContact OE2-NH2 3.11Å; F218-R230 CarbonylContact C-O 3.29Å; F218-R230 VanDerWaalsContact CA-O 3.22Å; F218-R230 WeakPolarHBondContact CA-O 3.43Å; E219-R230 PolarHBondContact N-O 3.45Å; E219-R230 PolarHBondContact O-N 3.45Å; T228-R230 PolarHBondContact O-N 3.07Å; R230-H232 PolarHBondContact O-N 3Å
231	L	97.4	Very high	85.9	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	122.8	175.4	-167.8	150.5	0	0	0	109.8	Y113 L133 V134 T135 A138 M142 V216	Y113-L231 HydrophobicContact CD2-CD1 4.2Å; L133-L231 PolarHBondContact O-N 3.35Å; V134-L231 HydrophobicContact CG1-CB 4.44Å; V134-L231 HydrophobicContact CG1-CD2 4.41Å; V134-L231 HydrophobicContact CG2-CB 4.27Å; T135-L231 WeakPolarHBondContact CG2-O 3.38Å; T135-L231 PolarHBondContact N-O 3.32Å; T135-L231 PolarHBondContact OG1-O 3.34Å; A138-L231 HydrophobicContact CB-CD2 3.8Å; A138-L231 WeakPolarHBondContact CB-O 3.32Å; M142-L231 HydrophobicContact CE-CD1 4.1Å; M142-L231 HydrophobicContact CE-CD2 3.81Å; M142-L231 HydrophobicContact SD-CD2 4.44Å; V216-L231 HydrophobicContact CG1-CD1 3.96Å; V216-L231 HydrophobicContact CG1-CG 4.02Å
232	H	96.5	Very high	84.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-33.5	-176.5	-171.2	85.6	0	0	0	113.7	T49 T135 A138 V217 E219 R230	T49-H232 PolarHBondContact OG1-CE1 2.97Å; T135-H232 HydrophobicContact CG2-CB 4.17Å; T135-H232 WeakPolarHBondContact OG1-CA 3.1Å; A138-H232 WeakPolarHBondContact CB-O 3.31Å; V217-H232 HydrophobicContact CG1-CB 4.47Å; V217-H232 PolarHBondContact O-N 3.29Å; E219-H232 HydrophobicContact CB-CB 3.68Å; E219-H232 IonicContact OE1-CE1 3.05Å; E219-H232 IonicContact OE1-ND1 3.68Å; E219-H232 PolarHBondContact OE1-ND1 3.32Å; E219-H232 IonicContact OE2-CE1 3.44Å; E219-H232 PolarHBondContact OE2-CE1 2.81Å; E219-H232 VanDerWaalsContact OE2-CE1 3.3Å; E219-H232 IonicContact OE2-CG 2.68Å; E219-H232 IonicContact OE2-ND1 3.58Å; E219-H232 PolarHBondContact OE2-ND1 2.97Å; E219-H232 IonicContact OE2-NE2 2.81Å; R230-H232 PolarHBondContact O-N 3Å
233	G	94.9	Very high	82.5	Confident	10 Å²	10	73.3 Å²	73.3	10%	0.103	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.7	-173	177.7	0	0	0	0	0	112.9	V217	V217-G233 PolarHBondContact N-O 3.42Å; V217-G233 PolarHBondContact O-N 3.28Å
234	K	93.1	Very high	81.4	Confident	88 Å²	88	77.2 Å²	77.2	38%	0.383	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.6	176.1	-60.7	-172.6	-179.9	-167.9	0	108.9	E214 Y215 V216 S236	E214-K234 WeakPolarHBondContact OE2-CD 3.44Å; E214-K234 WeakPolarHBondContact OE2-CE 3.07Å; E214-K234 IonicContact OE2-NZ 3.35Å; E214-K234 PolarHBondContact OE2-NZ 3.27Å; Y215-K234 CarbonylContact O-C 3.59Å; Y215-K234 WeakPolarHBondContact O-CA 3.33Å; V216-K234 HydrophobicContact CG2-CG 4.39Å; K234-S236 PolarHBondContact O-N 3.49Å
235	V	90.3	Very high	80.4	Confident	16 Å²	16	79.5 Å²	79.5	10%	0.097	42%	0.418	C	S	.	.			trans	-86.2	110.2	175.2	-171.5	0	0	0	0	108.8	I52 P55 Y56 Y215 V217	I52-V235 HydrophobicContact CD1-CG2 4.46Å; P55-V235 HydrophobicContact CB-CG1 4.24Å; Y56-V235 WeakPolarHBondContact O-CG1 3.25Å; Y215-V235 PolarHBondContact O-N 3.04Å; V217-V235 HydrophobicContact CG2-CG2 3.49Å; V217-V235 VanDerWaalsContact CG2-CG2 3.49Å
236	S	78.3	Confident	79.6	Confident	96 Å²	96	76.8 Å²	76.8	67%	0.671	40%	0.401	S	S	*	.			trans	-75.7	143.5	173.7	-62.4	0	0	0	0	110.7	K234	K234-S236 PolarHBondContact O-N 3.49Å
237	R	71.9	Confident	78.9	Confident	119 Å²	119	71.6 Å²	71.6	45%	0.449	39%	0.386	S	S	.	.			trans	-70.4	137.3	170.4	-65.8	-166.6	-77.1	-134.9	-4.5	109	P58 N239 S240	P58-R237 HydrophobicContact CG-CG 3.55Å; R237-N239 PolarHBondContact O-N 3.11Å; R237-S240 PolarHBondContact O-N 3.39Å; R237-S240 VanDerWaalsContact O-N 3.14Å; R237-S240 PolarHBondContact O-OG 2.8Å; R237-S240 VanDerWaalsContact O-OG 3.08Å
238	P	67	Low	77.8	Confident	101 Å²	101	76.6 Å²	76.6	66%	0.656	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.9	-179	21.2	-31.9	0	0	0	113.2
239	N	63.6	Low	76.5	Confident	142 Å²	142	76.9 Å²	76.9	76%	0.759	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	13.6	-179.1	-65.4	-17.9	0	0	0	114.1	R237 T241	R237-N239 PolarHBondContact O-N 3.11Å; N239-T241 PolarHBondContact O-N 2.93Å; N239-T241 VanDerWaalsContact O-N 3.08Å
240	S	62.9	Low	75.1	Confident	45 Å²	45	84.4 Å²	84.4	32%	0.315	45%	0.454	S	S	.	.			trans	-78.2	96.8	173.4	56.3	0	0	0	0	110.1	R237 V242	R237-S240 PolarHBondContact O-N 3.39Å; R237-S240 VanDerWaalsContact O-N 3.14Å; R237-S240 PolarHBondContact O-OG 2.8Å; R237-S240 VanDerWaalsContact O-OG 3.08Å; S240-V242 VanDerWaalsContact C-N 3.29Å; S240-V242 PolarHBondContact O-N 3.34Å
241	T	57.6	Low	73.8	Confident	116 Å²	116	92.9 Å²	92.9	71%	0.712	49%	0.485	S	S	*	.			trans	-69.9	92.5	157.1	47.4	0	0	0	0	107.3	N239 N243	N239-T241 PolarHBondContact O-N 2.93Å; N239-T241 VanDerWaalsContact O-N 3.08Å; T241-N243 VanDerWaalsContact C-N 3.27Å; T241-N243 PolarHBondContact O-N 3.42Å
242	V	60	Low	72.5	Confident	77 Å²	77	100.4 Å²	100.4	47%	0.467	53%	0.525	S	S	.	.			trans	-72.5	92.9	171.1	-168.3	0	0	0	0	106.7	S240 Y244	S240-V242 VanDerWaalsContact C-N 3.29Å; S240-V242 PolarHBondContact O-N 3.34Å; V242-Y244 VanDerWaalsContact C-N 3.25Å; V242-Y244 HydrophobicContact CB-CD2 4.37Å; V242-Y244 HydrophobicContact CB-CE1 4.44Å; V242-Y244 HydrophobicContact CB-CE2 3.85Å; V242-Y244 HydrophobicContact CG1-CD1 3.84Å; V242-Y244 HydrophobicContact CG1-CD2 4.08Å; V242-Y244 HydrophobicContact CG1-CE1 3.4Å; V242-Y244 VanDerWaalsContact CG1-CE1 3.4Å; V242-Y244 HydrophobicContact CG1-CE2 3.68Å; V242-Y244 HydrophobicContact CG1-CG 4.16Å; V242-Y244 WeakPolarHBondContact O-CD2 3.16Å; V242-Y244 PolarHBondContact O-N 3.07Å
243	N	57.9	Low	71	Confident	134 Å²	134	108.3 Å²	108.3	72%	0.717	56%	0.56	S	S	*	*			trans	-74.5	86.8	172.3	-70.3	-13.6	0	0	0	107.3	T241 T245	T241-N243 VanDerWaalsContact C-N 3.27Å; T241-N243 PolarHBondContact O-N 3.42Å; N243-T245 PolarHBondContact O-N 2.79Å
244	Y	66	Low	69.6	Low	123 Å²	123	113 Å²	113	48%	0.482	59%	0.588	S	S	.	*			trans	-66	102.5	167.4	-59.5	-73.8	0	0	0	107.9	Y203 V242 Y246	Y203-Y244 HydrophobicContact CE2-CD1 4.07Å; V242-Y244 VanDerWaalsContact C-N 3.25Å; V242-Y244 HydrophobicContact CB-CD2 4.37Å; V242-Y244 HydrophobicContact CB-CE1 4.44Å; V242-Y244 HydrophobicContact CB-CE2 3.85Å; V242-Y244 HydrophobicContact CG1-CD1 3.84Å; V242-Y244 HydrophobicContact CG1-CD2 4.08Å; V242-Y244 HydrophobicContact CG1-CE1 3.4Å; V242-Y244 VanDerWaalsContact CG1-CE1 3.4Å; V242-Y244 HydrophobicContact CG1-CE2 3.68Å; V242-Y244 HydrophobicContact CG1-CG 4.16Å; V242-Y244 WeakPolarHBondContact O-CD2 3.16Å; V242-Y244 PolarHBondContact O-N 3.07Å; Y244-Y246 VanDerWaalsContact CB-CE2 3.47Å; Y244-Y246 HydrophobicContact CG-CE2 4.29Å; Y244-Y246 WeakPolarHBondContact O-CD2 3.33Å; Y244-Y246 PolarHBondContact O-N 3.44Å
245	T	70.6	Confident	68.3	Low	115 Å²	115	115.1 Å²	115.1	71%	0.706	61%	0.608	S	S	*	*			trans	-75.6	84.3	169.3	53.2	0	0	0	0	108	N243	N243-T245 PolarHBondContact O-N 2.79Å
246	Y	74.1	Confident	66.5	Low	114 Å²	114	119 Å²	119	45%	0.447	63%	0.628	S	S	.	*			trans	-65.7	140.8	168.7	-66.8	-70.3	0	0	0	109.4	L202 Y203 Y244 P248	L202-Y246 HydrophobicContact CD2-CD1 3.38Å; L202-Y246 HydrophobicContact CD2-CE1 3.56Å; L202-Y246 HydrophobicContact CG-CD1 4.23Å; Y203-Y246 HydrophobicContact CD2-CD1 4.5Å; Y244-Y246 VanDerWaalsContact CB-CE2 3.47Å; Y244-Y246 HydrophobicContact CG-CE2 4.29Å; Y244-Y246 WeakPolarHBondContact O-CD2 3.33Å; Y244-Y246 PolarHBondContact O-N 3.44Å; Y246-P248 VanDerWaalsContact O-CD 3.27Å; Y246-P248 WeakPolarHBondContact O-CD 3.44Å; Y246-P248 VanDerWaalsContact O-N 3.12Å
247	I	76	Confident	65.5	Low	82 Å²	82	119.7 Å²	119.7	42%	0.421	63%	0.633	S	S	.	*			trans	-64.9	115.6	166.7	-60.6	173	0	0	0	105.8	L201 L202 T249	L201-I247 HydrophobicContact CB-CD1 4.42Å; L201-I247 HydrophobicContact CD2-CD1 4.07Å; L201-I247 HydrophobicContact CG-CD1 4.06Å; L202-I247 PolarHBondContact O-N 3.34Å; I247-T249 PolarHBondContact O-N 3.41Å
248	P	69.1	Low	64.6	Low	115 Å²	115	118.4 Å²	118.4	75%	0.747	64%	0.643	S	S	*	*			trans	-65.9	110.5	-171.8	25.9	-33.2	0	0	0	109	Y246	Y246-P248 VanDerWaalsContact O-CD 3.27Å; Y246-P248 WeakPolarHBondContact O-CD 3.44Å; Y246-P248 VanDerWaalsContact O-N 3.12Å
249	T	65.7	Low	63.5	Low	81 Å²	81	116.1 Å²	116.1	50%	0.497	63%	0.627	S	S	.	*			trans	-96.3	-12.3	173.9	53	0	0	0	0	112.2	I247	I247-T249 PolarHBondContact O-N 3.41Å
250	Q	67.8	Low	62.8	Low	163 Å²	163	112.8 Å²	112.8	76%	0.762	61%	0.612	S	S	*	*			trans	-142.9	144.4	-174.6	-62.3	-179.3	-9.7	0	0	110.2
251	R	69.2	Low	62.3	Low	211 Å²	211	114.6 Å²	114.6	80%	0.796	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-98.7	122.5	171.3	-174.1	176.7	-176.3	171.4	0.9	108	F253	R251-F253 PolarHBondContact O-N 3.05Å
252	L	69.6	Low	61.9	Low	160 Å²	160	115 Å²	115	84%	0.838	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-71.6	121.4	169.6	-63.1	176.2	0	0	0	108
253	F	66.5	Low	61.4	Low	167 Å²	167	113.5 Å²	113.5	73%	0.732	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-79.4	133.7	165.6	-70.4	-79.6	0	0	0	108.1	R251 V255	R251-F253 PolarHBondContact O-N 3.05Å; F253-V255 PolarHBondContact O-N 3.47Å; F253-V255 VanDerWaalsContact O-N 3.1Å
254	P	65.5	Low	61.2	Low	108 Å²	108	111.6 Å²	111.6	70%	0.701	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-62	117.7	173.6	25.3	-31.2	0	0	0	108.4	N256	P254-N256 PolarHBondContact O-N 3.33Å; P254-N256 VanDerWaalsContact O-N 3.07Å
255	V	64.7	Low	60.7	Low	132 Å²	132	112.2 Å²	112.2	80%	0.8	61%	0.606	S	S	*	*			trans	-73.3	98.7	165.7	-179.3	0	0	0	0	105.7	F253 S257	F253-V255 PolarHBondContact O-N 3.47Å; F253-V255 VanDerWaalsContact O-N 3.1Å; V255-S257 PolarHBondContact O-N 2.98Å
256	N	52.9	Low	59.8	Low	98 Å²	98	112.8 Å²	112.8	52%	0.524	60%	0.604	S	S	.	*			trans	-61.7	111.6	165.5	-76.4	-12.4	0	0	0	106.8	P254 S258 T259	P254-N256 PolarHBondContact O-N 3.33Å; P254-N256 VanDerWaalsContact O-N 3.07Å; N256-S258 PolarHBondContact O-N 3.42Å; N256-T259 PolarHBondContact O-N 3.33Å; N256-T259 PolarHBondContact O-OG1 2.87Å; N256-T259 VanDerWaalsContact O-OG1 3.05Å
257	S	56.3	Low	58.7	Low	111 Å²	111	110.9 Å²	110.9	78%	0.776	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	2.4	174.9	55.2	0	0	0	0	113.6	V255 T260	V255-S257 PolarHBondContact O-N 2.98Å; S257-T260 PolarHBondContact O-OG1 2.91Å; S257-T260 VanDerWaalsContact O-OG1 3.08Å
258	S	54.2	Low	57.5	Low	92 Å²	92	109.2 Å²	109.2	64%	0.643	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-15.2	172.2	55.8	0	0	0	0	114.3	N256	N256-S258 PolarHBondContact O-N 3.42Å
259	T	44.5	Very low	56.5	Low	52 Å²	52	108 Å²	108	32%	0.319	58%	0.584	S	S	.	*			trans	-95.1	12	179.2	52.9	0	0	0	0	113.9	N256 S261 E262 S263	N256-T259 PolarHBondContact O-N 3.33Å; N256-T259 PolarHBondContact O-OG1 2.87Å; N256-T259 VanDerWaalsContact O-OG1 3.05Å; T259-S261 PolarHBondContact O-N 3.41Å; T259-E262 PolarHBondContact O-N 2.89Å; T259-S263 PolarHBondContact O-N 3.32Å; T259-S263 PolarHBondContact O-OG 3.46Å
260	T	48.8	Very low	55.7	Low	73 Å²	73	107.4 Å²	107.4	45%	0.448	58%	0.583	S	S	.	*	H	α-helix	trans	-57.9	-21.5	177.4	-16.2	0	0	0	0	112.5	S257 N264	S257-T260 PolarHBondContact O-OG1 2.91Å; S257-T260 VanDerWaalsContact O-OG1 3.08Å; T260-N264 WeakPolarHBondContact O-CB 3.25Å; T260-N264 PolarHBondContact O-N 2.81Å; T260-N264 PolarHBondContact O-ND2 2.81Å
261	S	51.4	Low	54.6	Low	82 Å²	82	107.9 Å²	107.9	57%	0.573	58%	0.578	S	S	*	*	H	α-helix	trans	-77.8	-27.4	172.5	56.2	0	0	0	0	114	T259 K265	T259-S261 PolarHBondContact O-N 3.41Å; S261-K265 WeakPolarHBondContact O-CD 3.49Å; S261-K265 VanDerWaalsContact O-CG 3.27Å; S261-K265 WeakPolarHBondContact O-CG 3.44Å
262	E	49.1	Very low	53.4	Low	124 Å²	124	102.7 Å²	102.7	58%	0.579	57%	0.566	S	S	*	*	H	α-helix	trans	-94.3	-37.6	178.8	-74.2	-176	162.1	0	0	112.4	T259 K265 L266	T259-E262 PolarHBondContact O-N 2.89Å; E262-K265 WeakPolarHBondContact O-CB 3.44Å; E262-K265 PolarHBondContact O-N 3.12Å; E262-L266 PolarHBondContact O-N 3.07Å
263	S	50.3	Low	52.1	Low	46 Å²	46	101.6 Å²	101.6	32%	0.322	56%	0.561	S	S	.	*	H	α-helix	trans	-68	-36.4	174.2	63.7	0	0	0	0	111.6	T259 K265 L266 I267	T259-S263 PolarHBondContact O-N 3.32Å; T259-S263 PolarHBondContact O-OG 3.46Å; S263-K265 VanDerWaalsContact C-N 3.31Å; S263-K265 PolarHBondContact O-N 3.47Å; S263-L266 PolarHBondContact O-N 3.31Å; S263-I267 WeakPolarHBondContact O-CB 3.41Å; S263-I267 WeakPolarHBondContact O-CD1 3.27Å; S263-I267 WeakPolarHBondContact O-CG1 3.11Å; S263-I267 PolarHBondContact O-N 2.72Å
264	N	52.6	Low	51.2	Low	94 Å²	94	99.2 Å²	99.2	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-69.8	-27.9	173.1	-69.8	-15	0	0	0	112.3	T260 S268	T260-N264 WeakPolarHBondContact O-CB 3.25Å; T260-N264 PolarHBondContact O-N 2.81Å; T260-N264 PolarHBondContact O-ND2 2.81Å; N264-S268 VanDerWaalsContact O-CB 3.3Å; N264-S268 WeakPolarHBondContact O-CB 3.41Å; N264-S268 PolarHBondContact O-N 2.8Å; N264-S268 PolarHBondContact O-OG 3.05Å
265	K	54.9	Low	50	Low	137 Å²	137	100.1 Å²	100.1	60%	0.596	56%	0.559	S	S	*	*	H	α-helix	trans	-70.7	-38.2	171	-82.4	176.1	-179.4	-178.5	0	112.5	S261 E262 S263 S268 N269	S261-K265 WeakPolarHBondContact O-CD 3.49Å; S261-K265 VanDerWaalsContact O-CG 3.27Å; S261-K265 WeakPolarHBondContact O-CG 3.44Å; E262-K265 WeakPolarHBondContact O-CB 3.44Å; E262-K265 PolarHBondContact O-N 3.12Å; S263-K265 VanDerWaalsContact C-N 3.31Å; S263-K265 PolarHBondContact O-N 3.47Å; K265-S268 WeakPolarHBondContact CA-OG 3.21Å; K265-S268 PolarHBondContact O-OG 3.49Å; K265-N269 WeakPolarHBondContact O-CB 3.39Å; K265-N269 PolarHBondContact O-N 3.24Å; K265-N269 PolarHBondContact O-ND2 2.9Å; K265-N269 PolarHBondContact O-OD1 3.2Å
266	L	51.7	Low	48.5	Very low	126 Å²	126	100.5 Å²	100.5	66%	0.66	56%	0.556	S	S	*	*	H	α-helix	trans	-68.9	-39.5	174.8	-73.4	164.1	0	0	0	111.7	E262 S263 N269 S270	E262-L266 PolarHBondContact O-N 3.07Å; S263-L266 PolarHBondContact O-N 3.31Å; L266-N269 PolarHBondContact O-N 3.33Å; L266-S270 PolarHBondContact O-N 3.35Å; L266-S270 PolarHBondContact O-OG 3.44Å
267	I	52.8	Low	47.7	Very low	74 Å²	74	101.2 Å²	101.2	38%	0.379	57%	0.566	S	S	.	*	H	α-helix	trans	-70.8	-33.7	175.8	-64.4	163	0	0	0	111.6	S263 S270 R271	S263-I267 WeakPolarHBondContact O-CB 3.41Å; S263-I267 WeakPolarHBondContact O-CD1 3.27Å; S263-I267 WeakPolarHBondContact O-CG1 3.11Å; S263-I267 PolarHBondContact O-N 2.72Å; I267-S270 WeakPolarHBondContact CA-OG 3.35Å; I267-S270 PolarHBondContact O-OG 3.15Å; I267-S270 VanDerWaalsContact O-OG 3.04Å; I267-R271 WeakPolarHBondContact O-CG 3.46Å; I267-R271 PolarHBondContact O-N 3.07Å
268	S	49.3	Very low	46.6	Very low	48 Å²	48	103.1 Å²	103.1	34%	0.336	57%	0.566	S	S	.	*	H	α-helix	trans	-70.9	-39.1	173.6	64.8	0	0	0	0	112.2	N264 K265 R271 N272	N264-S268 VanDerWaalsContact O-CB 3.3Å; N264-S268 WeakPolarHBondContact O-CB 3.41Å; N264-S268 PolarHBondContact O-N 2.8Å; N264-S268 PolarHBondContact O-OG 3.05Å; K265-S268 WeakPolarHBondContact CA-OG 3.21Å; K265-S268 PolarHBondContact O-OG 3.49Å; S268-R271 PolarHBondContact O-N 3.13Å; S268-N272 VanDerWaalsContact O-CG 3.23Å; S268-N272 PolarHBondContact O-N 3.34Å; S268-N272 PolarHBondContact O-ND2 3.37Å; S268-N272 PolarHBondContact O-OD1 3.06Å
269	N	48.7	Very low	45.7	Very low	90 Å²	90	104.4 Å²	104.4	48%	0.481	58%	0.575	S	S	.	*	H	α-helix	trans	-68.5	-39.6	177.8	-69	-4.5	0	0	0	111.4	K265 L266 R271 N272 D273	K265-N269 WeakPolarHBondContact O-CB 3.39Å; K265-N269 PolarHBondContact O-N 3.24Å; K265-N269 PolarHBondContact O-ND2 2.9Å; K265-N269 PolarHBondContact O-OD1 3.2Å; L266-N269 PolarHBondContact O-N 3.33Å; N269-R271 PolarHBondContact O-N 3.2Å; N269-N272 PolarHBondContact O-N 2.67Å; N269-D273 PolarHBondContact O-N 3.35Å
270	S	49.3	Very low	45.1	Very low	68 Å²	68	108.6 Å²	108.6	48%	0.476	60%	0.595	S	S	.	*	H	α-helix	trans	-69.2	-18.6	175	65.2	0	0	0	0	114.4	L266 I267 V274	L266-S270 PolarHBondContact O-N 3.35Å; L266-S270 PolarHBondContact O-OG 3.44Å; I267-S270 WeakPolarHBondContact CA-OG 3.35Å; I267-S270 PolarHBondContact O-OG 3.15Å; I267-S270 VanDerWaalsContact O-OG 3.04Å; S270-V274 WeakPolarHBondContact O-CG2 3.32Å
271	R	45.5	Very low	44.5	Very low	172 Å²	172	112.3 Å²	112.3	65%	0.649	61%	0.612	S	S	*	*	H	α-helix	trans	-85.6	-35.6	174.5	-79	176.3	176.3	159.8	0.7	111.7	I267 S268 N269 D273 V274	I267-R271 WeakPolarHBondContact O-CG 3.46Å; I267-R271 PolarHBondContact O-N 3.07Å; S268-R271 PolarHBondContact O-N 3.13Å; N269-R271 PolarHBondContact O-N 3.2Å; R271-D273 VanDerWaalsContact C-N 3.28Å; R271-D273 PolarHBondContact O-N 3.46Å; R271-V274 PolarHBondContact O-N 3.12Å
272	N	43.2	Very low	43.8	Very low	102 Å²	102	113.1 Å²	113.1	55%	0.545	62%	0.618	S	S	.	*	H	α-helix	trans	-70.5	-24.2	177.1	-66.2	-12.2	0	0	0	113.1	S268 N269 V274	S268-N272 VanDerWaalsContact O-CG 3.23Å; S268-N272 PolarHBondContact O-N 3.34Å; S268-N272 PolarHBondContact O-ND2 3.37Å; S268-N272 PolarHBondContact O-OD1 3.06Å; N269-N272 PolarHBondContact O-N 2.67Å; N272-V274 VanDerWaalsContact C-N 3.34Å
273	D	43.1	Very low	43.1	Very low	137 Å²	137	114.4 Å²	114.4	73%	0.733	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10.9	176.7	-72.2	-26.2	0	0	0	113.9	N269 R271	N269-D273 PolarHBondContact O-N 3.35Å; R271-D273 VanDerWaalsContact C-N 3.28Å; R271-D273 PolarHBondContact O-N 3.46Å
274	V	46.9	Very low	42.6	Very low	117 Å²	117	118.4 Å²	118.4	71%	0.709	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-20.4	179.4	179.3	0	0	0	0	112.1	S270 R271 N272	S270-V274 WeakPolarHBondContact O-CG2 3.32Å; R271-V274 PolarHBondContact O-N 3.12Å; N272-V274 VanDerWaalsContact C-N 3.34Å
275	D	40.4	Very low	42	Very low	128 Å²	128	121.8 Å²	121.8	68%	0.684	66%	0.656	S	S	*	*	S	Bend	trans	-97	6.9	-175.6	-73.9	-20.5	0	0	0	114.9	P277	D275-P277 WeakPolarHBondContact O-CD 3.45Å
276	N	33.7	Very low	41.3	Very low	140 Å²	140	121 Å²	121	75%	0.749	66%	0.658	S	S	*	*			trans	-113	94	174.8	-87.3	-23.1	0	0	0	112.3	I278	N276-I278 PolarHBondContact O-N 3.49Å
277	P	35.4	Very low	40.7	Very low	113 Å²	113	121.9 Å²	121.9	73%	0.734	66%	0.663	S	S	*	*			trans	-72.5	110	164.3	30.5	-28.9	0	0	0	108.7	D275 S279	D275-P277 WeakPolarHBondContact O-CD 3.45Å; P277-S279 PolarHBondContact O-N 3.33Å
278	I	32.6	Very low	40.1	Very low	150 Å²	150	126.3 Å²	126.3	77%	0.769	68%	0.684	S	S	*	*			trans	21.1	103.1	141.3	-54.2	161.9	0	0	0	114.6	N276 L280	N276-I278 PolarHBondContact O-N 3.49Å; I278-L280 HydrophobicContact CG2-CD1 4.09Å
279	S	35.8	Very low	39.8	Very low	120 Å²	120	135.2 Å²	135.2	84%	0.839	73%	0.728	S	S	*	*			trans	-126	90	153.1	64.6	0	0	0	0	109.5	P277	P277-S279 PolarHBondContact O-N 3.33Å
280	L	31.9	Very low	39.4	Very low	140 Å²	140	137.5 Å²	137.5	73%	0.733	74%	0.741	S	S	*	*			trans	-66.6	155.5	157.6	-91.6	135.3	0	0	0	110.1	I278	I278-L280 HydrophobicContact CG2-CD1 4.09Å
281	N	35.8	Very low	38.9	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	76%	0.755	S	S	*	*			trans	92.1	133.4	171.3	-51.3	-23.3	0	0	0	113.9
282	S	37	Very low	38.5	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	76%	0.761	S	S	*	*			cis	-178	127	-0.4	43.7	0	0	0	0	107.2
283	L	35.3	Very low	38.2	Very low	150 Å²	150	141.6 Å²	141.6	79%	0.785	77%	0.773	S	S	*	*			trans	48.5	138	130.5	-94.7	124.9	0	0	0	121.7
284	N	39.9	Very low	37.9	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	78%	0.776	S	S	*	*			trans	86.2	137.4	156.6	-61.6	-30.7	0	0	0	116
285	K	39.1	Very low	37.3	Very low	165 Å²	165	143.5 Å²	143.5	72%	0.717	78%	0.78	S	S	*	*			cis	-178	146.1	-18.1	-126.3	-179.9	172.5	-178.2	0	103.8
286	D	40.5	Very low	37.1	Very low	119 Å²	119	144.6 Å²	144.6	64%	0.636	79%	0.787	S	S	*	*			trans	63.7	106.4	145.1	-55.4	-25.2	0	0	0	120.7
287	N	37.8	Very low	37.3	Very low	145 Å²	145	145 Å²	145	78%	0.775	79%	0.79	S	S	*	*				57.6	138.2	113.7	-79.5	-13.6	0	0	0	122.9
288	M	40.5	Very low	37.5	Very low	167 Å²	167	147.7 Å²	147.7	82%	0.823	80%	0.795	S	S	*	*			trans	77.2	88.8	151.8	-58.3	-127.6	-145	0	0	117.8
289	N	44.1	Very low	38	Very low	235 Å²	235	147.5 Å²	147.5	100%	1.257	80%	0.797	S	S	*	*				-177.2	0	94.4	-99	-15.8	0	0	0	109.4

Retrieved 289 of 289 residues in 151 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).