A0A087YCM8_POEFO Loading...

Serine/threonine-protein kinase STK11

AlphaFold DB , UniProt , Accession A0A087YCM8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 439 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	38	Very low	234 Å²	234	169.6 Å²	169.6	100%	1.153	85%	0.852	S	S	*	*				0	85.5	0	-70.8	169.3	79.8	0	0	104.4
2	S	32.7	Very low	37.7	Very low	105 Å²	105	168.3 Å²	168.3	73%	0.734	85%	0.848	S	S	*	*				99.3	102.4	100.3	51.9	0	0	0	0	107.3
3	D	37	Very low	37.6	Very low	156 Å²	156	165 Å²	165	83%	0.834	83%	0.834	S	S	*	*				69.4	131.4	86.8	-88.5	-27.8	0	0	0	112.9
4	D	42.9	Very low	38	Very low	145 Å²	145	165.9 Å²	165.9	78%	0.775	83%	0.834	S	S	*	*			trans	75	102	173.3	-64.4	-37.3	0	0	0	118.3
5	D	38.1	Very low	38.3	Very low	160 Å²	160	163.9 Å²	163.9	86%	0.856	83%	0.827	S	S	*	*				179.4	94	117.4	-89.3	-27.3	0	0	0	111.6
6	L	41.5	Very low	38.3	Very low	166 Å²	166	164 Å²	164	87%	0.869	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-100.5	119.5	160.3	-136	107.6	0	0	0	106.9	R8	L6-R8 PolarHBondContact O-N 3.36Å
7	P	40.7	Very low	38.4	Very low	123 Å²	123	163.8 Å²	163.8	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-77.6	119.2	165.7	-13.3	29.1	0	0	0	109.6
8	R	37.3	Very low	38.5	Very low	230 Å²	230	164.2 Å²	164.2	87%	0.868	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-51	143	171.1	-82.2	169.4	161	172.8	-5.3	111.7	L6 E10	L6-R8 PolarHBondContact O-N 3.36Å; R8-E10 PolarHBondContact O-N 3.34Å
9	L	38.7	Very low	38.7	Very low	151 Å²	151	165.2 Å²	165.2	79%	0.791	83%	0.827	S	S	*	*			trans	-53.8	108.6	153.7	-94	90.5	0	0	0	108.5	Y11	L9-Y11 PolarHBondContact O-N 3.42Å
10	E	37.1	Very low	38.5	Very low	183 Å²	183	165.5 Å²	165.5	86%	0.855	83%	0.828	S	S	*	*			trans	-78.5	109.9	157.8	-77.3	-176.8	167.9	0	0	107.4	R8 L12	R8-E10 PolarHBondContact O-N 3.34Å; E10-L12 PolarHBondContact O-N 3.24Å
11	Y	37	Very low	38.6	Very low	213 Å²	213	163.6 Å²	163.6	84%	0.835	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-57.2	116.2	161.2	-78.1	-96.7	0	0	0	107.1	L9 N13	L9-Y11 PolarHBondContact O-N 3.42Å; Y11-N13 PolarHBondContact O-N 3.08Å; Y11-N13 VanDerWaalsContact O-N 3.1Å
12	L	35.3	Very low	39	Very low	153 Å²	153	158.5 Å²	158.5	80%	0.801	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-54	119.1	166.7	-74.1	166.6	0	0	0	107.6	E10 E14	E10-L12 PolarHBondContact O-N 3.24Å; L12-E14 PolarHBondContact O-N 3.02Å
13	N	35.8	Very low	39.4	Very low	126 Å²	126	160.6 Å²	160.6	67%	0.674	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-62.3	128.2	176.3	-133.9	-2.6	0	0	0	107.5	Y11 N15 E16	Y11-N13 PolarHBondContact O-N 3.08Å; Y11-N13 VanDerWaalsContact O-N 3.1Å; N13-N15 PolarHBondContact O-N 3.27Å; N13-E16 PolarHBondContact O-N 3.07Å
14	E	43.7	Very low	39.9	Very low	178 Å²	178	160.2 Å²	160.2	83%	0.832	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	1.5	179.3	-76.1	-176.8	146.9	0	0	114.1	L12	L12-E14 PolarHBondContact O-N 3.02Å
15	N	41.7	Very low	40.4	Very low	135 Å²	135	160.8 Å²	160.8	72%	0.722	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-4.9	178.8	-86.5	7.6	0	0	0	115.4	N13	N13-N15 PolarHBondContact O-N 3.27Å
16	E	39	Very low	40.9	Very low	166 Å²	166	164.5 Å²	164.5	78%	0.776	80%	0.795	S	S	*	*	S	Bend	trans	-95.4	4.5	176.1	-84.7	-176.3	164.2	0	0	114.3	N13	N13-E16 PolarHBondContact O-N 3.07Å
17	L	39	Very low	41.5	Very low	161 Å²	161	161.6 Å²	161.6	84%	0.843	78%	0.779	S	S	*	*	S	Bend	trans	-101.6	9.2	174.1	-93.5	149.8	0	0	0	113.6
18	M	41.2	Very low	42.1	Very low	170 Å²	170	159.7 Å²	159.7	84%	0.837	76%	0.762	S	S	*	*	S	Bend	trans	-118.7	26	178.4	-73.6	-157.5	-174.9	0	0	114.6
19	E	41.4	Very low	43	Very low	184 Å²	184	153.8 Å²	153.8	86%	0.86	76%	0.756	S	S	*	*			trans	-126.9	28.1	169.6	-83	-170.5	169.9	0	0	113.2	D21	E19-D21 VanDerWaalsContact C-N 3.26Å; E19-D21 PolarHBondContact O-N 3.15Å
20	M	35.5	Very low	43.9	Very low	171 Å²	171	152.1 Å²	152.1	84%	0.842	75%	0.752	S	S	*	*	S	Bend	trans	-81.8	89.6	150	-70.6	-143.8	82.2	0	0	107.1	T22	M20-T22 VanDerWaalsContact C-N 3.27Å; M20-T22 PolarHBondContact O-N 2.75Å
21	D	39.6	Very low	44.7	Very low	126 Å²	126	149.7 Å²	149.7	67%	0.674	74%	0.741	S	S	*	*			trans	-49.4	94	169.6	-119.1	-25.3	0	0	0	108.9	E19 F23	E19-D21 VanDerWaalsContact C-N 3.26Å; E19-D21 PolarHBondContact O-N 3.15Å; D21-F23 HydrophobicContact CB-CD2 3.69Å; D21-F23 HydrophobicContact CB-CE2 4.03Å; D21-F23 VanDerWaalsContact CG-CD2 3.43Å; D21-F23 PolarHBondContact O-N 3.4Å; D21-F23 WeakPolarHBondContact OD1-CE2 3.47Å; D21-F23 WeakPolarHBondContact OD2-CE2 3.24Å
22	T	44.6	Very low	45.5	Very low	126 Å²	126	143.5 Å²	143.5	77%	0.773	73%	0.725	S	S	*	*			trans	-77.2	66.5	167.2	41.6	0	0	0	0	106.6	M20 I24	M20-T22 VanDerWaalsContact C-N 3.27Å; M20-T22 PolarHBondContact O-N 2.75Å; T22-I24 PolarHBondContact O-N 2.91Å
23	F	40	Very low	46.5	Very low	150 Å²	150	142.8 Å²	142.8	66%	0.658	72%	0.721	S	S	*	*			trans	-63.5	88.2	165.2	-90.9	-75.2	0	0	0	107.5	D21 H25	D21-F23 HydrophobicContact CB-CD2 3.69Å; D21-F23 HydrophobicContact CB-CE2 4.03Å; D21-F23 VanDerWaalsContact CG-CD2 3.43Å; D21-F23 PolarHBondContact O-N 3.4Å; D21-F23 WeakPolarHBondContact OD1-CE2 3.47Å; D21-F23 WeakPolarHBondContact OD2-CE2 3.24Å; F23-H25 PolarHBondContact O-N 3.34Å
24	I	48.8	Very low	47.1	Very low	148 Å²	148	146.5 Å²	146.5	76%	0.759	73%	0.727	S	S	*	*			trans	-65.9	93.5	156.6	-59.9	178.5	0	0	0	104.7	T22 R26	T22-I24 PolarHBondContact O-N 2.91Å; I24-R26 PolarHBondContact O-N 2.85Å
25	H	53.2	Low	47.4	Very low	157 Å²	157	145.5 Å²	145.5	73%	0.727	72%	0.722	S	S	*	*			trans	-55.6	108.3	167.7	-97.7	-70.6	0	0	0	107.5	F23 I27	F23-H25 PolarHBondContact O-N 3.34Å; H25-I27 PolarHBondContact O-N 2.84Å
26	R	48.6	Very low	48.2	Very low	238 Å²	238	144.1 Å²	144.1	90%	0.898	72%	0.721	S	S	*	*			trans	-70.5	90	164.2	-77.5	-175.3	169.2	145.4	-0.9	106.6	I24 D28	I24-R26 PolarHBondContact O-N 2.85Å; R26-D28 PolarHBondContact O-N 3.01Å
27	I	53.3	Low	49.3	Very low	105 Å²	105	147.7 Å²	147.7	54%	0.538	73%	0.727	S	S	.	*			trans	-65.1	122.7	166	-56.7	173.2	0	0	0	105.6	H25 S29 E31 V32	H25-I27 PolarHBondContact O-N 2.84Å; I27-S29 PolarHBondContact O-N 3.06Å; I27-E31 HydrophobicContact CG2-CB 3.71Å; I27-V32 HydrophobicContact CB-CG2 4.48Å; I27-V32 HydrophobicContact CG2-CG2 3.7Å
28	D	52.9	Low	50.8	Low	82 Å²	82	148.9 Å²	148.9	44%	0.439	72%	0.72	S	S	.	*			trans	-59.7	137.2	172.2	-169.1	-54.2	0	0	0	107.5	R26 T30 E31 V32	R26-D28 PolarHBondContact O-N 3.01Å; D28-T30 PolarHBondContact O-N 2.64Å; D28-T30 WeakPolarHBondContact OD1-CB 3.5Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.35Å; D28-T30 PolarHBondContact OD1-N 2.67Å; D28-T30 PolarHBondContact OD1-OG1 3.33Å; D28-E31 HydrophobicContact CB-CG 4.09Å; D28-E31 WeakPolarHBondContact O-CA 3.43Å; D28-E31 WeakPolarHBondContact O-CB 3.36Å; D28-E31 PolarHBondContact O-N 3.04Å; D28-V32 PolarHBondContact O-N 2.72Å
29	S	56.8	Low	52.7	Low	106 Å²	106	144.6 Å²	144.6	74%	0.741	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-21.5	176.1	39.6	0	0	0	0	113.6	I27	I27-S29 PolarHBondContact O-N 3.06Å
30	T	58.3	Low	54.9	Low	117 Å²	117	144.6 Å²	144.6	72%	0.718	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-19.1	173.2	58.3	0	0	0	0	114.4	D28	D28-T30 PolarHBondContact O-N 2.64Å; D28-T30 WeakPolarHBondContact OD1-CB 3.5Å; D28-T30 WeakPolarHBondContact OD1-CG2 3.35Å; D28-T30 PolarHBondContact OD1-N 2.67Å; D28-T30 PolarHBondContact OD1-OG1 3.33Å
31	E	53.3	Low	57.5	Low	132 Å²	132	137.8 Å²	137.8	62%	0.617	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-13	177	-68	176.4	170.8	0	0	112.9	I27 D28 I33	I27-E31 HydrophobicContact CG2-CB 3.71Å; D28-E31 HydrophobicContact CB-CG 4.09Å; D28-E31 WeakPolarHBondContact O-CA 3.43Å; D28-E31 WeakPolarHBondContact O-CB 3.36Å; D28-E31 PolarHBondContact O-N 3.04Å; E31-I33 VanDerWaalsContact C-N 3.3Å; E31-I33 PolarHBondContact O-N 3.4Å
32	V	54.3	Low	60	Low	82 Å²	82	135.1 Å²	135.1	50%	0.497	64%	0.642	S	S	.	*			trans	-73.5	88.4	169.4	-175.5	0	0	0	0	108.3	I27 D28 Y34	I27-V32 HydrophobicContact CB-CG2 4.48Å; I27-V32 HydrophobicContact CG2-CG2 3.7Å; D28-V32 PolarHBondContact O-N 2.72Å; V32-Y34 VanDerWaalsContact C-N 3.31Å; V32-Y34 PolarHBondContact O-N 3.39Å
33	I	54.6	Low	62.3	Low	139 Å²	139	132.8 Å²	132.8	71%	0.713	62%	0.624	S	S	*	*			trans	-66.1	97.6	165.7	-54.6	177.2	0	0	0	106.6	E31 Q35	E31-I33 VanDerWaalsContact C-N 3.3Å; E31-I33 PolarHBondContact O-N 3.4Å; I33-Q35 HydrophobicContact CG2-CG 3.87Å; I33-Q35 PolarHBondContact O-N 3.41Å
34	Y	48.6	Very low	64.8	Low	203 Å²	203	125.7 Å²	125.7	80%	0.796	59%	0.594	S	S	*	*			trans	-70.6	80.8	171.2	-152	-88.6	0	0	0	107.8	V32 P36	V32-Y34 VanDerWaalsContact C-N 3.31Å; V32-Y34 PolarHBondContact O-N 3.39Å; Y34-P36 WeakPolarHBondContact O-CD 3.41Å
35	Q	51.1	Low	66.9	Low	157 Å²	157	120.9 Å²	120.9	73%	0.734	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-65.5	117.1	167.5	-71.2	-171.2	-0.3	0	0	106.8	I33 R37	I33-Q35 HydrophobicContact CG2-CG 3.87Å; I33-Q35 PolarHBondContact O-N 3.41Å; Q35-R37 PolarHBondContact O-N 3.32Å
36	P	59	Low	68.8	Low	107 Å²	107	116.6 Å²	116.6	70%	0.695	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.8	173.4	-18.8	31.1	0	0	0	107.7	Y34 R38	Y34-P36 WeakPolarHBondContact O-CD 3.41Å; P36-R38 PolarHBondContact O-N 3.05Å
37	R	62.1	Low	71.1	Confident	240 Å²	240	105.4 Å²	105.4	91%	0.906	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-54	120.1	174.8	-69.9	-176.3	107.1	143.6	4.6	107.9	Q35 K39	Q35-R37 PolarHBondContact O-N 3.32Å; R37-K39 PolarHBondContact O-N 3.43Å
38	R	69.1	Low	73.2	Confident	187 Å²	187	100.6 Å²	100.6	71%	0.706	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-51.3	128.4	177	-78	-176	165.9	174.3	-2.9	109.2	P36 R40	P36-R38 PolarHBondContact O-N 3.05Å; R38-R40 PolarHBondContact O-N 2.91Å
39	K	81.4	Confident	75.2	Confident	79 Å²	79	97.3 Å²	97.3	34%	0.343	48%	0.475	S	S	.	.			trans	-81.3	100.7	177.5	-75.6	-171	174.5	-169.3	0	108.2	R37 A41 D51 P337 Y338	R37-K39 PolarHBondContact O-N 3.43Å; K39-A41 PolarHBondContact O-N 3.26Å; K39-D51 IonicContact NZ-OD1 3.99Å; K39-D51 PolarHBondContact NZ-OD1 3.26Å; K39-D51 IonicContact NZ-OD2 3.34Å; K39-D51 PolarHBondContact NZ-OD2 3.26Å; K39-P337 HydrophobicContact CB-CB 4.27Å; K39-P337 HydrophobicContact CD-CB 4.17Å; K39-P337 HydrophobicContact CD-CG 4.45Å; K39-Y338 HydrophobicContact CB-CD1 4.08Å; K39-Y338 HydrophobicContact CB-CE1 3.78Å; K39-Y338 HydrophobicContact CB-CE2 4.5Å; K39-Y338 HydrophobicContact CD-CE1 4.34Å; K39-Y338 HydrophobicContact CD-CE2 3.82Å; K39-Y338 HydrophobicContact CG-CE1 4.49Å
40	R	87.2	Confident	77.1	Confident	185 Å²	185	92.2 Å²	92.2	70%	0.698	44%	0.44	S	S	*	.			trans	-62.6	128.7	178	-72	-171.6	172.1	-172.6	-4.9	112	R38 Y338 D341	R38-R40 PolarHBondContact O-N 2.91Å; R40-Y338 VanDerWaalsContact O-CD1 3.29Å; R40-Y338 WeakPolarHBondContact O-CD1 3.41Å; R40-Y338 WeakPolarHBondContact O-CE1 3.34Å; R40-D341 WeakPolarHBondContact CA-OD2 3.49Å
41	A	90.4	Very high	78.7	Confident	27 Å²	27	88.2 Å²	88.2	22%	0.223	41%	0.414	C	S	.	.			trans	-57.5	140.7	173.3	0	0	0	0	0	110	K39 L48 Y338 D341 L342	K39-A41 PolarHBondContact O-N 3.26Å; A41-L48 HydrophobicContact CB-CD1 4.16Å; A41-Y338 WeakPolarHBondContact CB-O 3.39Å; A41-D341 HydrophobicContact CB-CB 4.2Å; A41-D341 WeakPolarHBondContact CB-OD2 3.35Å; A41-D341 PolarHBondContact N-OD2 3.41Å; A41-L342 HydrophobicContact CB-CB 4.15Å; A41-L342 HydrophobicContact CB-CD1 4.44Å
42	K	92.3	Very high	80.6	Confident	70 Å²	70	84.4 Å²	84.4	30%	0.304	40%	0.397	S	S	.	.			trans	-138.4	121.7	171.3	-175.2	171.5	-169.3	175.9	0	110.9	I44 M49 D359	K42-I44 HydrophobicContact CD-CD1 4.33Å; K42-M49 HydrophobicContact CB-CB 4.28Å; K42-M49 HydrophobicContact CB-CG 4.42Å; K42-M49 HydrophobicContact CG-CG 4.42Å; K42-M49 WeakPolarHBondContact O-CB 3.5Å; K42-M49 WeakPolarHBondContact O-CG 3.36Å; K42-M49 PolarHBondContact O-N 3.32Å; K42-D359 VanDerWaalsContact CE-OD2 3.22Å; K42-D359 WeakPolarHBondContact CE-OD2 3.17Å; K42-D359 IonicContact NZ-OD2 2.7Å; K42-D359 PolarHBondContact NZ-OD2 3.1Å
43	L	92.5	Very high	82.4	Confident	77 Å²	77	83.8 Å²	83.8	40%	0.403	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	143.9	170.4	-68	166.9	0	0	0	111.1	Y47 L48	L43-Y47 CarbonylContact C-O 3.59Å; L43-Y47 WeakPolarHBondContact CA-O 3.31Å; L43-L48 HydrophobicContact CD2-CB 4.07Å; L43-L48 HydrophobicContact CD2-CD1 4.3Å
44	I	93.3	Very high	84	Confident	2 Å²	2	78.5 Å²	78.5	1%	0.01	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	99.5	169.9	-63.1	-65.4	0	0	0	105.5	K42 K46 Y47 M49 L115 Y124 I361	K42-I44 HydrophobicContact CD-CD1 4.33Å; I44-K46 PolarHBondContact O-N 2.92Å; I44-Y47 PolarHBondContact N-O 2.89Å; I44-Y47 PolarHBondContact O-N 2.89Å; I44-Y47 VanDerWaalsContact O-N 3.15Å; I44-M49 HydrophobicContact CB-SD 4.34Å; I44-M49 HydrophobicContact CG1-CG 3.72Å; I44-M49 HydrophobicContact CG1-SD 3.82Å; I44-L115 HydrophobicContact CG2-CD1 3.79Å; I44-Y124 HydrophobicContact CD1-CE1 4.22Å; I44-Y124 HydrophobicContact CG1-CE1 4.16Å; I44-Y124 HydrophobicContact CG2-CD1 4.08Å; I44-Y124 HydrophobicContact CG2-CD2 4.23Å; I44-Y124 HydrophobicContact CG2-CE1 4.09Å; I44-Y124 HydrophobicContact CG2-CE2 4.28Å; I44-Y124 HydrophobicContact CG2-CG 4.14Å; I44-I361 HydrophobicContact CB-CD1 4.27Å; I44-I361 HydrophobicContact CD1-CD1 4.4Å; I44-I361 HydrophobicContact CG2-CD1 3.51Å
45	G	92	Very high	85.8	Confident	47 Å²	47	74.8 Å²	74.8	49%	0.485	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	-131.7	-163.6	0	0	0	0	0	109.8	Y47	G45-Y47 VanDerWaalsContact C-N 3.25Å; G45-Y47 PolarHBondContact O-N 3.42Å
46	K	93.6	Very high	87	Confident	66 Å²	66	69.3 Å²	69.3	29%	0.287	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	9.3	177.1	68.9	174.8	-174.7	-179.8	0	115.7	I44 D66 S67 E68	I44-K46 PolarHBondContact O-N 2.92Å; K46-D66 WeakPolarHBondContact CE-OD2 3.13Å; K46-D66 IonicContact NZ-OD2 3.63Å; K46-S67 VanDerWaalsContact O-CB 3.31Å; K46-S67 WeakPolarHBondContact O-CB 3.37Å; K46-S67 PolarHBondContact O-N 2.97Å; K46-S67 PolarHBondContact O-OG 3.38Å; K46-E68 HydrophobicContact CD-CG 4.08Å; K46-E68 VanDerWaalsContact CD-OE2 3.24Å; K46-E68 WeakPolarHBondContact CD-OE2 3.39Å; K46-E68 IonicContact NZ-OE2 2.75Å; K46-E68 PolarHBondContact NZ-OE2 2.86Å
47	Y	97	Very high	87.7	Confident	3 Å²	3	68.6 Å²	68.6	1%	0.012	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.8	-173	-55.3	-85.8	0	0	0	112.3	L43 I44 G45 M64 L65 D66 D113 L115 V126	L43-Y47 CarbonylContact C-O 3.59Å; L43-Y47 WeakPolarHBondContact CA-O 3.31Å; I44-Y47 PolarHBondContact N-O 2.89Å; I44-Y47 PolarHBondContact O-N 2.89Å; I44-Y47 VanDerWaalsContact O-N 3.15Å; G45-Y47 VanDerWaalsContact C-N 3.25Å; G45-Y47 PolarHBondContact O-N 3.42Å; Y47-M64 HydrophobicContact CD1-CE 3.69Å; Y47-M64 HydrophobicContact CD1-CG 4.43Å; Y47-M64 HydrophobicContact CD1-SD 4.46Å; Y47-M64 HydrophobicContact CD2-CE 3.77Å; Y47-M64 HydrophobicContact CE1-CE 4.46Å; Y47-M64 HydrophobicContact CG-CE 3.29Å; Y47-L65 CarbonylContact C-O 3.56Å; Y47-L65 VanDerWaalsContact CA-O 3.31Å; Y47-L65 WeakPolarHBondContact CA-O 3.24Å; Y47-D66 HydrophobicContact CD1-CB 3.89Å; Y47-D66 HydrophobicContact CE1-CB 3.84Å; Y47-D113 HydrophobicContact CE2-CB 4.42Å; Y47-D113 WeakPolarHBondContact CE2-OD2 3.36Å; Y47-D113 WeakPolarHBondContact OH-CB 3.27Å; Y47-D113 PolarHBondContact OH-OD2 3.03Å; Y47-L115 HydrophobicContact CD2-CD1 3.76Å; Y47-L115 HydrophobicContact CE2-CD1 3.9Å; Y47-V126 HydrophobicContact CD2-CG2 4.42Å; Y47-V126 HydrophobicContact CE1-CG1 4.02Å; Y47-V126 HydrophobicContact CE2-CG2 4.09Å
48	L	96.8	Very high	88.5	Confident	4 Å²	4	59 Å²	59	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.4	171.5	-179.3	64.6	0	0	0	110	A41 L43 M64 L65 V335 L339	A41-L48 HydrophobicContact CB-CD1 4.16Å; L43-L48 HydrophobicContact CD2-CB 4.07Å; L43-L48 HydrophobicContact CD2-CD1 4.3Å; L48-M64 CarbonylContact O-C 3.55Å; L48-M64 WeakPolarHBondContact O-CA 3.24Å; L48-M64 WeakPolarHBondContact O-CB 3.42Å; L48-L65 HydrophobicContact CB-CB 4.38Å; L48-L65 PolarHBondContact N-O 3.43Å; L48-L65 PolarHBondContact O-N 3.19Å; L48-V335 HydrophobicContact CD2-CB 4.14Å; L48-L339 HydrophobicContact CD2-CD2 3.45Å; L48-L339 VanDerWaalsContact CD2-CD2 3.45Å; L48-L339 HydrophobicContact CD2-CG 3.61Å
49	M	96.4	Very high	89.4	Confident	13 Å²	13	50.5 Å²	50.5	6%	0.064	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	133.6	-178.5	-66.1	-64.2	-51.9	0	0	111.9	K42 I44 K62 V75 I77	K42-M49 HydrophobicContact CB-CB 4.28Å; K42-M49 HydrophobicContact CB-CG 4.42Å; K42-M49 HydrophobicContact CG-CG 4.42Å; K42-M49 WeakPolarHBondContact O-CB 3.5Å; K42-M49 WeakPolarHBondContact O-CG 3.36Å; K42-M49 PolarHBondContact O-N 3.32Å; I44-M49 HydrophobicContact CB-SD 4.34Å; I44-M49 HydrophobicContact CG1-CG 3.72Å; I44-M49 HydrophobicContact CG1-SD 3.82Å; M49-K62 HydrophobicContact CE-CB 3.84Å; M49-K62 HydrophobicContact CE-CD 3.61Å; M49-K62 HydrophobicContact CE-CG 4.3Å; M49-V75 HydrophobicContact CE-CG1 3.68Å; M49-V75 HydrophobicContact SD-CG1 4.07Å; M49-I77 HydrophobicContact CE-CD1 3.85Å
50	G	95	Very high	90	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-154.3	172.8	0	0	0	0	0	114.3	K62 E63	G50-K62 PolarHBondContact O-NZ 3.21Å; G50-K62 VanDerWaalsContact O-NZ 3.13Å; G50-E63 WeakPolarHBondContact CA-O 3.38Å; G50-E63 PolarHBondContact N-O 3.31Å
51	D	93.4	Very high	90.4	Very high	32 Å²	32	44.7 Å²	44.7	17%	0.171	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	170.6	-176.9	-73.3	-26.7	0	0	0	113.1	K39 K62 E63 T334 Y338	K39-D51 IonicContact NZ-OD1 3.99Å; K39-D51 PolarHBondContact NZ-OD1 3.26Å; K39-D51 IonicContact NZ-OD2 3.34Å; K39-D51 PolarHBondContact NZ-OD2 3.26Å; D51-K62 CarbonylContact O-C 3.37Å; D51-K62 VanDerWaalsContact O-CA 3.23Å; D51-K62 WeakPolarHBondContact O-CA 3.32Å; D51-K62 WeakPolarHBondContact O-CB 3.45Å; D51-E63 PolarHBondContact O-N 3.15Å; D51-T334 HydrophobicContact CB-CG2 3.88Å; D51-T334 PolarHBondContact N-OG1 3.01Å; D51-T334 VanDerWaalsContact N-OG1 3.12Å; D51-Y338 PolarHBondContact OD1-OH 2.95Å
52	L	92.9	Very high	90.6	Very high	52 Å²	52	46.1 Å²	46.1	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	130.3	175	-171.8	71.1	0	0	0	110	G54 K60 V61 K62	L52-G54 WeakPolarHBondContact CD1-O 3.42Å; L52-K60 HydrophobicContact CD1-CB 3.89Å; L52-K60 HydrophobicContact CD1-CD 4.11Å; L52-K60 HydrophobicContact CD1-CG 4.27Å; L52-V61 WeakPolarHBondContact CD1-O 3.38Å; L52-K62 HydrophobicContact CD1-CG 4.29Å
53	L	91.2	Very high	90.8	Very high	70 Å²	70	42.8 Å²	42.8	37%	0.366	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-31.7	171.5	-62.8	176.6	0	0	0	111.5	V61 E63 A74 Y129	L53-V61 HydrophobicContact CB-CG1 4.29Å; L53-V61 HydrophobicContact CD1-CG1 4.44Å; L53-V61 PolarHBondContact N-O 3.43Å; L53-E63 HydrophobicContact CD1-CB 4.04Å; L53-E63 HydrophobicContact CD2-CB 4.13Å; L53-E63 HydrophobicContact CG-CB 4.08Å; L53-A74 HydrophobicContact CD1-CB 4Å; L53-Y129 HydrophobicContact CD1-CD2 4.02Å; L53-Y129 HydrophobicContact CD1-CE2 3.78Å; L53-Y129 HydrophobicContact CD2-CE2 4.05Å
54	G	88.3	Confident	91	Very high	27 Å²	27	39.2 Å²	39.2	28%	0.278	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-176	171.1	178.3	0	0	0	0	0	113.7	L52 V61	L52-G54 WeakPolarHBondContact CD1-O 3.42Å; G54-V61 PolarHBondContact N-O 2.82Å; G54-V61 VanDerWaalsContact N-O 3.13Å; G54-V61 PolarHBondContact O-N 3.34Å
55	E	87.1	Confident	91.2	Very high	126 Å²	126	39.4 Å²	39.4	59%	0.589	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.9	175.2	-177.6	160.9	-172.5	0	0	109.9	K60	E55-K60 HydrophobicContact CG-CG 4.15Å; E55-K60 WeakPolarHBondContact OE2-CE 3.38Å; E55-K60 IonicContact OE2-NZ 3.03Å
56	G	76.7	Confident	91.5	Very high	41 Å²	41	37.4 Å²	37.4	42%	0.423	21%	0.209	S	C	.	.			trans	-126.4	-178.5	-179.2	0	0	0	0	0	113	Y58 G59	G56-Y58 PolarHBondContact O-N 3.15Å; G56-G59 PolarHBondContact N-O 3.23Å; G56-G59 PolarHBondContact O-N 2.96Å
57	S	73.8	Confident	91.5	Very high	93 Å²	93	37.3 Å²	37.3	65%	0.65	22%	0.217	S	C	*	.	S	Bend	trans	-54.6	-40.5	-177.2	-56.1	0	0	0	0	112.6	K82	S57-K82 WeakPolarHBondContact O-CE 3.5Å; S57-K82 PolarHBondContact O-NZ 3.03Å
58	Y	78.7	Confident	91.4	Very high	37 Å²	37	43.6 Å²	43.6	15%	0.145	25%	0.246	C	C	.	.	S	Bend	trans	-91.3	-21.5	-174.7	-62.9	-82.3	0	0	0	114.3	G56 L83 I86	G56-Y58 PolarHBondContact O-N 3.15Å; Y58-L83 HydrophobicContact CD1-CD2 3.8Å; Y58-I86 HydrophobicContact CD1-CD1 3.74Å; Y58-I86 HydrophobicContact CE1-CD1 3.94Å; Y58-I86 HydrophobicContact CE1-CG2 4.17Å
59	G	87.1	Confident	91.4	Very high	9 Å²	9	47 Å²	47	9%	0.093	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.3	-169.5	-169.1	0	0	0	0	0	114.9	G56 I77	G56-G59 PolarHBondContact N-O 3.23Å; G56-G59 PolarHBondContact O-N 2.96Å; G59-I77 VanDerWaalsContact CA-O 3.26Å; G59-I77 WeakPolarHBondContact CA-O 3.32Å
60	K	93.8	Very high	91.3	Very high	95 Å²	95	52.3 Å²	52.3	41%	0.413	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143.4	177.6	-65	-171.5	175.8	-157.2	0	109.5	L52 E55 I77	L52-K60 HydrophobicContact CD1-CB 3.89Å; L52-K60 HydrophobicContact CD1-CD 4.11Å; L52-K60 HydrophobicContact CD1-CG 4.27Å; E55-K60 HydrophobicContact CG-CG 4.15Å; E55-K60 WeakPolarHBondContact OE2-CE 3.38Å; E55-K60 IonicContact OE2-NZ 3.03Å; K60-I77 PolarHBondContact N-O 2.78Å; K60-I77 PolarHBondContact O-N 3.39Å
61	V	95.2	Very high	91.4	Very high	47 Å²	47	54.6 Å²	54.6	29%	0.285	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	125.9	172.4	-174.6	0	0	0	0	108	L52 L53 G54 A74 V75 K76	L52-V61 WeakPolarHBondContact CD1-O 3.38Å; L53-V61 HydrophobicContact CB-CG1 4.29Å; L53-V61 HydrophobicContact CD1-CG1 4.44Å; L53-V61 PolarHBondContact N-O 3.43Å; G54-V61 PolarHBondContact N-O 2.82Å; G54-V61 VanDerWaalsContact N-O 3.13Å; G54-V61 PolarHBondContact O-N 3.34Å; V61-A74 HydrophobicContact CG1-CB 4.25Å; V61-V75 CarbonylContact C-O 3.6Å; V61-V75 VanDerWaalsContact CA-O 3.25Å; V61-V75 WeakPolarHBondContact CA-O 3.47Å; V61-K76 HydrophobicContact CG2-CB 4.4Å; V61-K76 HydrophobicContact CG2-CG 4.35Å
62	K	96	Very high	91.5	Very high	58 Å²	58	55.7 Å²	55.7	25%	0.252	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.6	177	-72.4	-166.5	150	-137.2	0	111.1	M49 G50 D51 L52 A74 V75 I77	M49-K62 HydrophobicContact CE-CB 3.84Å; M49-K62 HydrophobicContact CE-CD 3.61Å; M49-K62 HydrophobicContact CE-CG 4.3Å; G50-K62 PolarHBondContact O-NZ 3.21Å; G50-K62 VanDerWaalsContact O-NZ 3.13Å; D51-K62 CarbonylContact O-C 3.37Å; D51-K62 VanDerWaalsContact O-CA 3.23Å; D51-K62 WeakPolarHBondContact O-CA 3.32Å; D51-K62 WeakPolarHBondContact O-CB 3.45Å; L52-K62 HydrophobicContact CD1-CG 4.29Å; K62-A74 CarbonylContact O-C 3.55Å; K62-A74 WeakPolarHBondContact O-CA 3.42Å; K62-V75 HydrophobicContact CB-CG1 4.1Å; K62-V75 PolarHBondContact N-O 3Å; K62-V75 PolarHBondContact O-N 2.85Å; K62-I77 HydrophobicContact CB-CD1 4.42Å; K62-I77 HydrophobicContact CD-CD1 3.91Å; K62-I77 HydrophobicContact CG-CD1 4.05Å
63	E	96.3	Very high	91.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	151.9	164.1	-171.8	174.3	160.1	0	0	109.7	G50 D51 L53 R72 Y129 M333 T334	G50-E63 WeakPolarHBondContact CA-O 3.38Å; G50-E63 PolarHBondContact N-O 3.31Å; D51-E63 PolarHBondContact O-N 3.15Å; L53-E63 HydrophobicContact CD1-CB 4.04Å; L53-E63 HydrophobicContact CD2-CB 4.13Å; L53-E63 HydrophobicContact CG-CB 4.08Å; E63-R72 HydrophobicContact CG-CG 4.32Å; E63-R72 IonicContact OE1-CZ 3.05Å; E63-R72 VanDerWaalsContact OE1-CZ 3.31Å; E63-R72 IonicContact OE1-NE 3.53Å; E63-R72 PolarHBondContact OE1-NE 2.91Å; E63-R72 IonicContact OE1-NH2 3.7Å; E63-R72 PolarHBondContact OE1-NH2 3.37Å; E63-R72 VanDerWaalsContact OE1-NH2 3.16Å; E63-R72 IonicContact OE2-CZ 3.16Å; E63-R72 IonicContact OE2-NE 3.67Å; E63-R72 IonicContact OE2-NH2 2.73Å; E63-R72 PolarHBondContact OE2-NH2 2.86Å; E63-Y129 HydrophobicContact CG-CE2 4.43Å; E63-M333 WeakPolarHBondContact OE1-CA 3.45Å; E63-M333 WeakPolarHBondContact OE1-CG 3.22Å; E63-T334 WeakPolarHBondContact CB-OG1 3.33Å; E63-T334 PolarHBondContact OE1-N 2.94Å; E63-T334 WeakPolarHBondContact OE2-CB 3.38Å; E63-T334 WeakPolarHBondContact OE2-CG2 3.29Å; E63-T334 PolarHBondContact OE2-N 3.43Å; E63-T334 PolarHBondContact OE2-OG1 3.02Å
64	M	96.8	Very high	92.1	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	161.5	167.8	72.9	-153.6	-60.1	0	0	110.6	Y47 L48 R73 V75 V126	Y47-M64 HydrophobicContact CD1-CE 3.69Å; Y47-M64 HydrophobicContact CD1-CG 4.43Å; Y47-M64 HydrophobicContact CD1-SD 4.46Å; Y47-M64 HydrophobicContact CD2-CE 3.77Å; Y47-M64 HydrophobicContact CE1-CE 4.46Å; Y47-M64 HydrophobicContact CG-CE 3.29Å; L48-M64 CarbonylContact O-C 3.55Å; L48-M64 WeakPolarHBondContact O-CA 3.24Å; L48-M64 WeakPolarHBondContact O-CB 3.42Å; M64-R73 HydrophobicContact CG-CB 3.44Å; M64-R73 VanDerWaalsContact CG-CB 3.44Å; M64-R73 HydrophobicContact CG-CG 4.45Å; M64-R73 PolarHBondContact N-O 3.38Å; M64-R73 PolarHBondContact O-N 2.92Å; M64-R73 VanDerWaalsContact O-O 3.14Å; M64-R73 HydrophobicContact SD-CB 3.86Å; M64-V75 HydrophobicContact CB-CG1 4.38Å; M64-V75 HydrophobicContact CE-CB 3.98Å; M64-V75 HydrophobicContact CE-CG1 4.12Å; M64-V75 HydrophobicContact SD-CB 3.41Å; M64-V75 WeakPolarHBondContact SD-CB 3.4Å; M64-V75 HydrophobicContact SD-CG1 3.67Å; M64-V75 HydrophobicContact SD-CG2 4.46Å; M64-V126 HydrophobicContact CE-CB 4.41Å; M64-V126 HydrophobicContact CE-CG1 4.06Å; M64-V126 HydrophobicContact CE-CG2 3.57Å; M64-V126 HydrophobicContact SD-CB 4.21Å; M64-V126 HydrophobicContact SD-CG1 3.58Å; M64-V126 VanDerWaalsContact SD-CG1 3.58Å; M64-V126 HydrophobicContact SD-CG2 3.96Å
65	L	97.5	Very high	92.5	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.2	173.6	-175.3	67.1	0	0	0	109.2	Y47 L48 S67 L70 M333 V335 L339	Y47-L65 CarbonylContact C-O 3.56Å; Y47-L65 VanDerWaalsContact CA-O 3.31Å; Y47-L65 WeakPolarHBondContact CA-O 3.24Å; L48-L65 HydrophobicContact CB-CB 4.38Å; L48-L65 PolarHBondContact N-O 3.43Å; L48-L65 PolarHBondContact O-N 3.19Å; L65-S67 PolarHBondContact O-N 3.39Å; L65-L70 VanDerWaalsContact CD1-C 3.46Å; L65-L70 VanDerWaalsContact CD1-O 3.25Å; L65-L70 WeakPolarHBondContact CD1-O 3.48Å; L65-L70 HydrophobicContact CD2-CD2 4.28Å; L65-M333 HydrophobicContact CD1-SD 3.66Å; L65-M333 HydrophobicContact CD2-CE 4.28Å; L65-M333 HydrophobicContact CD2-SD 4.26Å; L65-M333 HydrophobicContact CG-SD 4.45Å; L65-V335 HydrophobicContact CB-CB 4.37Å; L65-V335 HydrophobicContact CB-CG1 3.99Å; L65-V335 HydrophobicContact CB-CG2 4Å; L65-V335 HydrophobicContact CD2-CG2 3.8Å; L65-V335 HydrophobicContact CG-CG2 4.42Å; L65-L339 HydrophobicContact CD2-CD1 4.16Å
66	D	97.1	Very high	93	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.5	168.4	-177.4	-53	0	0	0	108.9	K46 Y47 E68 T69 L70 C71	K46-D66 WeakPolarHBondContact CE-OD2 3.13Å; K46-D66 IonicContact NZ-OD2 3.63Å; Y47-D66 HydrophobicContact CD1-CB 3.89Å; Y47-D66 HydrophobicContact CE1-CB 3.84Å; D66-E68 VanDerWaalsContact C-N 3.27Å; D66-E68 PolarHBondContact O-N 2.89Å; D66-E68 WeakPolarHBondContact OD1-CB 3.49Å; D66-E68 PolarHBondContact OD1-N 2.83Å; D66-T69 WeakPolarHBondContact CB-OG1 3.47Å; D66-T69 PolarHBondContact OD1-N 2.93Å; D66-T69 PolarHBondContact OD1-OG1 3.28Å; D66-T69 VanDerWaalsContact OD1-OG1 3.05Å; D66-T69 PolarHBondContact OD2-OG1 3.46Å; D66-L70 WeakPolarHBondContact O-CA 3.11Å; D66-L70 PolarHBondContact O-N 2.87Å; D66-C71 HydrophobicContact CB-CB 4.39Å; D66-C71 PolarHBondContact N-O 2.74Å
67	S	94.3	Very high	93.9	Very high	65 Å²	65	45.8 Å²	45.8	46%	0.455	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.5	-173.9	67	0	0	0	0	113.8	K46 L65	K46-S67 VanDerWaalsContact O-CB 3.31Å; K46-S67 WeakPolarHBondContact O-CB 3.37Å; K46-S67 PolarHBondContact O-N 2.97Å; K46-S67 PolarHBondContact O-OG 3.38Å; L65-S67 PolarHBondContact O-N 3.39Å
68	E	94.7	Very high	94.9	Very high	134 Å²	134	41.3 Å²	41.3	63%	0.626	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-42.6	-179.4	-62.5	171.5	172	0	0	111.1	K46 D66	K46-E68 HydrophobicContact CD-CG 4.08Å; K46-E68 VanDerWaalsContact CD-OE2 3.24Å; K46-E68 WeakPolarHBondContact CD-OE2 3.39Å; K46-E68 IonicContact NZ-OE2 2.75Å; K46-E68 PolarHBondContact NZ-OE2 2.86Å; D66-E68 VanDerWaalsContact C-N 3.27Å; D66-E68 PolarHBondContact O-N 2.89Å; D66-E68 WeakPolarHBondContact OD1-CB 3.49Å; D66-E68 PolarHBondContact OD1-N 2.83Å
69	T	96.6	Very high	95.5	Very high	75 Å²	75	45.3 Å²	45.3	46%	0.46	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-9.4	-173.6	62.3	0	0	0	0	113.6	D66 C71	D66-T69 WeakPolarHBondContact CB-OG1 3.47Å; D66-T69 PolarHBondContact OD1-N 2.93Å; D66-T69 PolarHBondContact OD1-OG1 3.28Å; D66-T69 VanDerWaalsContact OD1-OG1 3.05Å; D66-T69 PolarHBondContact OD2-OG1 3.46Å; T69-C71 PolarHBondContact O-N 2.78Å; T69-C71 WeakPolarHBondContact OG1-CB 3.25Å; T69-C71 PolarHBondContact OG1-N 3.32Å; T69-C71 PolarHBondContact OG1-SG 3.04Å
70	L	95.4	Very high	95.6	Very high	125 Å²	125	46.6 Å²	46.6	65%	0.654	23%	0.234	S	C	*	.			trans	54.5	22	-171.5	-52.6	180	0	0	0	113.2	L65 D66 R72	L65-L70 VanDerWaalsContact CD1-C 3.46Å; L65-L70 VanDerWaalsContact CD1-O 3.25Å; L65-L70 WeakPolarHBondContact CD1-O 3.48Å; L65-L70 HydrophobicContact CD2-CD2 4.28Å; D66-L70 WeakPolarHBondContact O-CA 3.11Å; D66-L70 PolarHBondContact O-N 2.87Å; L70-R72 PolarHBondContact O-N 2.89Å
71	C	96.4	Very high	95.5	Very high	48 Å²	48	48.9 Å²	48.9	32%	0.324	24%	0.244	S	C	.	.			trans	-75.7	127.2	176.4	-72.7	0	0	0	0	110.2	D66 T69	D66-C71 HydrophobicContact CB-CB 4.39Å; D66-C71 PolarHBondContact N-O 2.74Å; T69-C71 PolarHBondContact O-N 2.78Å; T69-C71 WeakPolarHBondContact OG1-CB 3.25Å; T69-C71 PolarHBondContact OG1-N 3.32Å; T69-C71 PolarHBondContact OG1-SG 3.04Å
72	R	96.6	Very high	95.2	Very high	56 Å²	56	50.1 Å²	50.1	21%	0.211	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.8	170.8	-165	-179.8	-169.6	-177.2	3.2	109.9	E63 L70 Y129 R331 S332 M333	E63-R72 HydrophobicContact CG-CG 4.32Å; E63-R72 IonicContact OE1-CZ 3.05Å; E63-R72 VanDerWaalsContact OE1-CZ 3.31Å; E63-R72 IonicContact OE1-NE 3.53Å; E63-R72 PolarHBondContact OE1-NE 2.91Å; E63-R72 IonicContact OE1-NH2 3.7Å; E63-R72 PolarHBondContact OE1-NH2 3.37Å; E63-R72 VanDerWaalsContact OE1-NH2 3.16Å; E63-R72 IonicContact OE2-CZ 3.16Å; E63-R72 IonicContact OE2-NE 3.67Å; E63-R72 IonicContact OE2-NH2 2.73Å; E63-R72 PolarHBondContact OE2-NH2 2.86Å; L70-R72 PolarHBondContact O-N 2.89Å; R72-Y129 HydrophobicContact CG-CD1 4.15Å; R72-Y129 HydrophobicContact CG-CD2 4.07Å; R72-Y129 HydrophobicContact CG-CG 3.83Å; R72-Y129 PolarHBondContact NH1-OH 3.16Å; R72-Y129 PolarHBondContact NH2-OH 2.73Å; R72-Y129 VanDerWaalsContact NH2-OH 3.15Å; R72-Y129 WeakPolarHBondContact O-CB 3.41Å; R72-R331 PolarHBondContact NH1-O 2.57Å; R72-R331 PolarHBondContact NH2-O 2.81Å; R72-S332 PolarHBondContact NH2-O 3.05Å; R72-M333 HydrophobicContact CG-CG 4.41Å
73	R	97.7	Very high	94.8	Very high	49 Å²	49	47.5 Å²	47.5	19%	0.185	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	169.5	-177.8	-57.9	-63	-178.7	-174.2	-2	110.7	M64 V126 M127	M64-R73 HydrophobicContact CG-CB 3.44Å; M64-R73 VanDerWaalsContact CG-CB 3.44Å; M64-R73 HydrophobicContact CG-CG 4.45Å; M64-R73 PolarHBondContact N-O 3.38Å; M64-R73 PolarHBondContact O-N 2.92Å; M64-R73 VanDerWaalsContact O-O 3.14Å; M64-R73 HydrophobicContact SD-CB 3.86Å; R73-V126 HydrophobicContact CB-CG1 4.03Å; R73-V126 HydrophobicContact CG-CG1 4.2Å; R73-M127 WeakPolarHBondContact CB-O 3.41Å
74	A	97.7	Very high	94.5	Very high	10 Å²	10	54.4 Å²	54.4	8%	0.083	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	148.9	168.3	0	0	0	0	0	109.8	L53 V61 K62 V126 M127	L53-A74 HydrophobicContact CD1-CB 4Å; V61-A74 HydrophobicContact CG1-CB 4.25Å; K62-A74 CarbonylContact O-C 3.55Å; K62-A74 WeakPolarHBondContact O-CA 3.42Å; A74-V126 CarbonylContact O-C 3.51Å; A74-V126 WeakPolarHBondContact O-CA 3.4Å; A74-M127 PolarHBondContact N-O 3.43Å; A74-M127 PolarHBondContact O-N 2.81Å
75	V	97.5	Very high	94.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.2	175.1	51.7	0	0	0	0	112.2	M49 V61 K62 M64 I77 Y124 M125	M49-V75 HydrophobicContact CE-CG1 3.68Å; M49-V75 HydrophobicContact SD-CG1 4.07Å; V61-V75 CarbonylContact C-O 3.6Å; V61-V75 VanDerWaalsContact CA-O 3.25Å; V61-V75 WeakPolarHBondContact CA-O 3.47Å; K62-V75 HydrophobicContact CB-CG1 4.1Å; K62-V75 PolarHBondContact N-O 3Å; K62-V75 PolarHBondContact O-N 2.85Å; M64-V75 HydrophobicContact CB-CG1 4.38Å; M64-V75 HydrophobicContact CE-CB 3.98Å; M64-V75 HydrophobicContact CE-CG1 4.12Å; M64-V75 HydrophobicContact SD-CB 3.41Å; M64-V75 WeakPolarHBondContact SD-CB 3.4Å; M64-V75 HydrophobicContact SD-CG1 3.67Å; M64-V75 HydrophobicContact SD-CG2 4.46Å; V75-I77 HydrophobicContact CG1-CG1 4.26Å; V75-I77 HydrophobicContact CG2-CG1 3.99Å; V75-Y124 HydrophobicContact CG2-CD1 3.86Å; V75-Y124 HydrophobicContact CG2-CG 4.29Å; V75-M125 WeakPolarHBondContact CA-O 3.28Å
76	K	96.2	Very high	93.5	Very high	23 Å²	23	66.8 Å²	66.8	10%	0.1	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	110	167.9	-168.7	-178.2	-171.6	-178	0	108.1	V61 L78 E96 M125 M127 D192	V61-K76 HydrophobicContact CG2-CB 4.4Å; V61-K76 HydrophobicContact CG2-CG 4.35Å; K76-L78 HydrophobicContact CG-CD2 4.22Å; K76-L78 HydrophobicContact CG-CG 4.42Å; K76-E96 IonicContact NZ-OE1 2.87Å; K76-E96 PolarHBondContact NZ-OE1 3.14Å; K76-E96 IonicContact NZ-OE2 2.71Å; K76-E96 PolarHBondContact NZ-OE2 2.7Å; K76-M125 HydrophobicContact CB-CB 4.27Å; K76-M125 HydrophobicContact CD-SD 4.38Å; K76-M125 PolarHBondContact N-O 2.96Å; K76-M125 PolarHBondContact O-N 3.2Å; K76-M127 HydrophobicContact CB-CE 4.25Å; K76-M127 HydrophobicContact CD-CE 4.1Å; K76-D192 IonicContact NZ-OD1 3.61Å
77	I	96.1	Very high	92.9	Very high	25 Å²	25	71.7 Å²	71.7	13%	0.128	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.4	-178.3	-49.9	172.5	0	0	0	109.4	M49 G59 K60 K62 V75 K122 Y124	M49-I77 HydrophobicContact CE-CD1 3.85Å; G59-I77 VanDerWaalsContact CA-O 3.26Å; G59-I77 WeakPolarHBondContact CA-O 3.32Å; K60-I77 PolarHBondContact N-O 2.78Å; K60-I77 PolarHBondContact O-N 3.39Å; K62-I77 HydrophobicContact CB-CD1 4.42Å; K62-I77 HydrophobicContact CD-CD1 3.91Å; K62-I77 HydrophobicContact CG-CD1 4.05Å; V75-I77 HydrophobicContact CG1-CG1 4.26Å; V75-I77 HydrophobicContact CG2-CG1 3.99Å; I77-K122 HydrophobicContact CG2-CD 4.3Å; I77-Y124 HydrophobicContact CD1-CE1 4.35Å; I77-Y124 HydrophobicContact CG1-CD1 3.95Å; I77-Y124 HydrophobicContact CG1-CE1 4.14Å; I77-Y124 HydrophobicContact CG2-CD1 4.18Å; I77-Y124 HydrophobicContact CG2-CE1 3.93Å
78	L	94.4	Very high	92.5	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.6	-175.5	-59.5	168.1	0	0	0	109.6	K76 L83 V93 K122 M123 M125	K76-L78 HydrophobicContact CG-CD2 4.22Å; K76-L78 HydrophobicContact CG-CG 4.42Å; L78-L83 HydrophobicContact CB-CD1 4.28Å; L78-V93 HydrophobicContact CD1-CB 4.41Å; L78-V93 HydrophobicContact CD1-CG1 3.52Å; L78-V93 HydrophobicContact CD1-CG2 3.93Å; L78-K122 CarbonylContact O-C 3.47Å; L78-K122 VanDerWaalsContact O-CA 3.29Å; L78-K122 WeakPolarHBondContact O-CA 3.5Å; L78-M123 HydrophobicContact CB-CB 4.32Å; L78-M123 HydrophobicContact CD1-SD 3.94Å; L78-M123 PolarHBondContact N-O 2.93Å; L78-M123 PolarHBondContact O-N 3.38Å; L78-M125 HydrophobicContact CD1-CG 4.28Å; L78-M125 HydrophobicContact CD1-SD 3.63Å
79	K	92.9	Very high	92.1	Very high	121 Å²	121	68 Å²	68	53%	0.526	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.4	175.2	-66	-177.3	-179.6	-178.2	0	109.3	K81 K82 L83 K122	K79-K81 VanDerWaalsContact C-N 3.26Å; K79-K81 PolarHBondContact O-N 2.64Å; K79-K82 HydrophobicContact CB-CB 4.09Å; K79-K82 WeakPolarHBondContact O-CA 3.27Å; K79-K82 WeakPolarHBondContact O-CB 3.24Å; K79-K82 PolarHBondContact O-N 3.45Å; K79-L83 PolarHBondContact O-N 3.07Å; K79-K122 HydrophobicContact CG-CG 4.33Å
80	K	89.3	Confident	91.7	Very high	36 Å²	36	67.8 Å²	67.8	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-53.9	-42.8	178.4	-64.9	-173.9	177.5	-175	0	111.8	K82 L83 R84 E118 Q121	K80-K82 VanDerWaalsContact C-N 3.26Å; K80-K82 PolarHBondContact O-N 2.84Å; K80-L83 PolarHBondContact O-N 3.38Å; K80-L83 VanDerWaalsContact O-N 3.11Å; K80-R84 WeakPolarHBondContact O-CG 3.31Å; K80-R84 PolarHBondContact O-N 3.02Å; K80-E118 IonicContact NZ-OE1 2.72Å; K80-E118 PolarHBondContact NZ-OE1 3.09Å; K80-E118 IonicContact NZ-OE2 2.64Å; K80-E118 PolarHBondContact NZ-OE2 3.49Å; K80-Q121 HydrophobicContact CB-CB 4.24Å; K80-Q121 PolarHBondContact N-O 2.79Å
81	K	90.1	Very high	91.4	Very high	143 Å²	143	64 Å²	64	62%	0.622	30%	0.302	S	S	*	.	H	α-helix	trans	-56.7	-34.4	174.4	-71.6	-175.3	-180	179.1	0	113.8	K79	K79-K81 VanDerWaalsContact C-N 3.26Å; K79-K81 PolarHBondContact O-N 2.64Å
82	K	89.1	Confident	91	Very high	73 Å²	73	62.7 Å²	62.7	32%	0.317	29%	0.292	S	S	.	.	H	α-helix	trans	-75.7	-42.2	176.7	-170.8	177.5	179.1	-171.9	0	110.4	S57 K79 K80 R84 R85	S57-K82 WeakPolarHBondContact O-CE 3.5Å; S57-K82 PolarHBondContact O-NZ 3.03Å; K79-K82 HydrophobicContact CB-CB 4.09Å; K79-K82 WeakPolarHBondContact O-CA 3.27Å; K79-K82 WeakPolarHBondContact O-CB 3.24Å; K79-K82 PolarHBondContact O-N 3.45Å; K80-K82 VanDerWaalsContact C-N 3.26Å; K80-K82 PolarHBondContact O-N 2.84Å; K82-R84 PolarHBondContact O-N 3.14Å; K82-R85 WeakPolarHBondContact O-CB 3.47Å; K82-R85 PolarHBondContact O-N 2.9Å; K82-R85 VanDerWaalsContact O-N 3.16Å
83	L	88.7	Confident	90.8	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-39.5	177.5	-63.8	179.3	0	0	0	112.8	Y58 L78 K79 K80 R85 I86 E90 V93	Y58-L83 HydrophobicContact CD1-CD2 3.8Å; L78-L83 HydrophobicContact CB-CD1 4.28Å; K79-L83 PolarHBondContact O-N 3.07Å; K80-L83 PolarHBondContact O-N 3.38Å; K80-L83 VanDerWaalsContact O-N 3.11Å; L83-R85 PolarHBondContact O-N 3.01Å; L83-I86 PolarHBondContact O-N 3.25Å; L83-E90 HydrophobicContact CB-CG 3.75Å; L83-E90 HydrophobicContact CD1-CG 4.25Å; L83-V93 HydrophobicContact CD1-CB 4.45Å; L83-V93 HydrophobicContact CD1-CG2 4.01Å; L83-V93 HydrophobicContact CD2-CG2 3.77Å
84	R	88.9	Confident	90.5	Very high	145 Å²	145	63 Å²	63	55%	0.547	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.2	175.9	-70.7	-165.8	-71.3	-116.3	7.3	114.4	K80 K82 E90	K80-R84 WeakPolarHBondContact O-CG 3.31Å; K80-R84 PolarHBondContact O-N 3.02Å; K82-R84 PolarHBondContact O-N 3.14Å; R84-E90 WeakPolarHBondContact CG-OE1 3.12Å
85	R	89.4	Confident	90.3	Very high	220 Å²	220	68.4 Å²	68.4	83%	0.83	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.9	175.8	-65.6	178.2	178	174.6	-2.2	112.7	K82 L83	K82-R85 WeakPolarHBondContact O-CB 3.47Å; K82-R85 PolarHBondContact O-N 2.9Å; K82-R85 VanDerWaalsContact O-N 3.16Å; L83-R85 PolarHBondContact O-N 3.01Å
86	I	85.1	Confident	90.1	Very high	47 Å²	47	68.6 Å²	68.6	24%	0.241	32%	0.319	C	S	.	.	S	Bend	trans	-97.2	126.8	179.3	-59.8	169.2	0	0	0	106.8	Y58 L83 N88 G89	Y58-I86 HydrophobicContact CD1-CD1 3.74Å; Y58-I86 HydrophobicContact CE1-CD1 3.94Å; Y58-I86 HydrophobicContact CE1-CG2 4.17Å; L83-I86 PolarHBondContact O-N 3.25Å; I86-N88 PolarHBondContact O-N 2.77Å; I86-G89 PolarHBondContact O-N 3.06Å
87	P	84.3	Confident	90.1	Very high	108 Å²	108	67.7 Å²	67.7	70%	0.701	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	124.9	175	-27	35.1	0	0	0	111	G89	P87-G89 PolarHBondContact O-N 2.84Å; P87-G89 VanDerWaalsContact O-N 3.08Å
88	N	85.5	Confident	90	Very high	121 Å²	121	72.2 Å²	72.2	65%	0.647	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	17.9	-175.7	-56.9	-41	0	0	0	115.3	I86 E90 A91 N92	I86-N88 PolarHBondContact O-N 2.77Å; N88-E90 PolarHBondContact O-N 3.01Å; N88-A91 PolarHBondContact O-N 2.86Å; N88-N92 PolarHBondContact O-N 2.91Å; N88-N92 PolarHBondContact O-OD1 3.18Å
89	G	86.4	Confident	90.1	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-56.9	-44.9	-171	0	0	0	0	0	114.5	I86 P87 V93	I86-G89 PolarHBondContact O-N 3.06Å; P87-G89 PolarHBondContact O-N 2.84Å; P87-G89 VanDerWaalsContact O-N 3.08Å; G89-V93 WeakPolarHBondContact O-CG2 3.48Å; G89-V93 PolarHBondContact O-N 3.47Å; G89-V93 VanDerWaalsContact O-N 3.14Å
90	E	88.6	Confident	90.2	Very high	69 Å²	69	67.2 Å²	67.2	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-37.3	176.6	-67.2	-171.5	-167	0	0	112.5	L83 R84 N88 K94	L83-E90 HydrophobicContact CB-CG 3.75Å; L83-E90 HydrophobicContact CD1-CG 4.25Å; R84-E90 WeakPolarHBondContact CG-OE1 3.12Å; N88-E90 PolarHBondContact O-N 3.01Å; E90-K94 WeakPolarHBondContact O-CG 3.47Å; E90-K94 PolarHBondContact O-N 3.41Å
91	A	89.1	Confident	90.5	Very high	45 Å²	45	70.6 Å²	70.6	37%	0.372	33%	0.327	S	S	.	.	H	α-helix	trans	-68.8	-40.3	177.8	0	0	0	0	0	111.4	N88 K94 K95	N88-A91 PolarHBondContact O-N 2.86Å; A91-K94 PolarHBondContact O-N 2.78Å; A91-K95 WeakPolarHBondContact O-CG 3.45Å; A91-K95 PolarHBondContact O-N 2.76Å
92	N	88.3	Confident	90.7	Very high	22 Å²	22	69.4 Å²	69.4	12%	0.118	32%	0.318	C	S	.	.	H	α-helix	trans	-63.1	-44.4	177	-65.9	-7.6	0	0	0	111	N88 K95 E96	N88-N92 PolarHBondContact O-N 2.91Å; N88-N92 PolarHBondContact O-OD1 3.18Å; N92-K95 PolarHBondContact O-N 2.95Å; N92-E96 WeakPolarHBondContact O-CB 3.39Å; N92-E96 PolarHBondContact O-N 3.24Å
93	V	91.6	Very high	91.1	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.012	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-42.8	175.3	168.7	0	0	0	0	111.7	L78 L83 G89 K95 E96 I97 M123 M125	L78-V93 HydrophobicContact CD1-CB 4.41Å; L78-V93 HydrophobicContact CD1-CG1 3.52Å; L78-V93 HydrophobicContact CD1-CG2 3.93Å; L83-V93 HydrophobicContact CD1-CB 4.45Å; L83-V93 HydrophobicContact CD1-CG2 4.01Å; L83-V93 HydrophobicContact CD2-CG2 3.77Å; G89-V93 WeakPolarHBondContact O-CG2 3.48Å; G89-V93 PolarHBondContact O-N 3.47Å; G89-V93 VanDerWaalsContact O-N 3.14Å; V93-K95 VanDerWaalsContact C-N 3.33Å; V93-K95 PolarHBondContact O-N 2.75Å; V93-E96 WeakPolarHBondContact O-CB 3.4Å; V93-E96 PolarHBondContact O-N 3.24Å; V93-I97 HydrophobicContact CG1-CD1 3.96Å; V93-I97 WeakPolarHBondContact O-CG1 3.47Å; V93-I97 PolarHBondContact O-N 3.12Å; V93-M123 HydrophobicContact CG1-CE 3.95Å; V93-M123 HydrophobicContact CG1-SD 3.45Å; V93-M123 WeakPolarHBondContact CG1-SD 3.12Å; V93-M125 HydrophobicContact CG1-SD 4.27Å
94	K	92.1	Very high	91.5	Very high	109 Å²	109	73.6 Å²	73.6	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-60.4	-42.7	175.5	-77.8	176.8	178.8	-179.8	0	111.8	E90 A91 I97 Q98	E90-K94 WeakPolarHBondContact O-CG 3.47Å; E90-K94 PolarHBondContact O-N 3.41Å; A91-K94 PolarHBondContact O-N 2.78Å; K94-I97 PolarHBondContact O-N 3.49Å; K94-Q98 WeakPolarHBondContact O-CG 3.41Å; K94-Q98 PolarHBondContact O-N 3.41Å
95	K	91.8	Very high	92	Very high	124 Å²	124	69 Å²	69	54%	0.539	32%	0.323	S	S	.	.	H	α-helix	trans	-62.5	-45.1	174.4	-72.4	175.2	-178.7	-178	0	111.7	A91 N92 V93 I97 Q98 L99	A91-K95 WeakPolarHBondContact O-CG 3.45Å; A91-K95 PolarHBondContact O-N 2.76Å; N92-K95 PolarHBondContact O-N 2.95Å; V93-K95 VanDerWaalsContact C-N 3.33Å; V93-K95 PolarHBondContact O-N 2.75Å; K95-I97 VanDerWaalsContact C-N 3.33Å; K95-I97 PolarHBondContact O-N 2.85Å; K95-Q98 PolarHBondContact O-N 2.97Å; K95-L99 WeakPolarHBondContact O-CG 3.36Å; K95-L99 PolarHBondContact O-N 2.94Å
96	E	94.3	Very high	92.4	Very high	3 Å²	3	64.9 Å²	64.9	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-56.1	-47.3	176.5	-170.9	-176.4	-179.9	0	0	110.8	K76 N92 V93 L99 L100 M125 L193	K76-E96 IonicContact NZ-OE1 2.87Å; K76-E96 PolarHBondContact NZ-OE1 3.14Å; K76-E96 IonicContact NZ-OE2 2.71Å; K76-E96 PolarHBondContact NZ-OE2 2.7Å; N92-E96 WeakPolarHBondContact O-CB 3.39Å; N92-E96 PolarHBondContact O-N 3.24Å; V93-E96 WeakPolarHBondContact O-CB 3.4Å; V93-E96 PolarHBondContact O-N 3.24Å; E96-L99 PolarHBondContact O-N 2.97Å; E96-L100 HydrophobicContact CG-CD1 3.98Å; E96-L100 WeakPolarHBondContact O-CB 3.13Å; E96-L100 WeakPolarHBondContact O-CG 3.33Å; E96-L100 PolarHBondContact O-N 3.41Å; E96-M125 HydrophobicContact CG-CE 4.22Å; E96-L193 HydrophobicContact CG-CB 4.15Å
97	I	95.3	Very high	93	Very high	5 Å²	5	62.7 Å²	62.7	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-46.5	176.3	-69.7	163.3	0	0	0	111.5	V93 K94 K95 L99 L100 R101 L111 V114 M123 M125	V93-I97 HydrophobicContact CG1-CD1 3.96Å; V93-I97 WeakPolarHBondContact O-CG1 3.47Å; V93-I97 PolarHBondContact O-N 3.12Å; K94-I97 PolarHBondContact O-N 3.49Å; K95-I97 VanDerWaalsContact C-N 3.33Å; K95-I97 PolarHBondContact O-N 2.85Å; I97-L99 VanDerWaalsContact C-N 3.32Å; I97-L99 PolarHBondContact O-N 2.86Å; I97-L100 PolarHBondContact O-N 3.27Å; I97-R101 HydrophobicContact CG2-CG 4.35Å; I97-R101 WeakPolarHBondContact O-CB 3.36Å; I97-R101 WeakPolarHBondContact O-CG 3.41Å; I97-R101 PolarHBondContact O-N 2.73Å; I97-L111 HydrophobicContact CG2-CD2 4.19Å; I97-V114 HydrophobicContact CD1-CG1 4.08Å; I97-V114 HydrophobicContact CD1-CG2 4.44Å; I97-V114 HydrophobicContact CG1-CG2 4.35Å; I97-V114 HydrophobicContact CG2-CG2 4Å; I97-M123 HydrophobicContact CD1-CE 4.14Å; I97-M123 HydrophobicContact CD1-SD 3.6Å; I97-M123 VanDerWaalsContact CD1-SD 3.6Å; I97-M125 HydrophobicContact CD1-CG 4.25Å; I97-M125 HydrophobicContact CD1-SD 4.24Å; I97-M125 HydrophobicContact CG1-CE 3.64Å; I97-M125 HydrophobicContact CG1-CG 4.17Å; I97-M125 HydrophobicContact CG1-SD 3.93Å
98	Q	95.1	Very high	93.7	Very high	120 Å²	120	57.7 Å²	57.7	56%	0.561	27%	0.268	S	S	*	.	H	α-helix	trans	-62.1	-39	179.9	-75	173.8	-8.7	0	0	112.4	K94 K95	K94-Q98 WeakPolarHBondContact O-CG 3.41Å; K94-Q98 PolarHBondContact O-N 3.41Å; K95-Q98 PolarHBondContact O-N 2.97Å
99	L	95.4	Very high	94.3	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.063	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-54.1	174.1	-68.9	172.9	0	0	0	110.5	K95 E96 I97 R101 R102 L103 I170 A196 A198	K95-L99 WeakPolarHBondContact O-CG 3.36Å; K95-L99 PolarHBondContact O-N 2.94Å; E96-L99 PolarHBondContact O-N 2.97Å; I97-L99 VanDerWaalsContact C-N 3.32Å; I97-L99 PolarHBondContact O-N 2.86Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.14Å; L99-R102 VanDerWaalsContact O-CG 3.24Å; L99-R102 WeakPolarHBondContact O-CG 3.32Å; L99-R102 PolarHBondContact O-N 2.83Å; L99-R102 VanDerWaalsContact O-N 3.15Å; L99-L103 HydrophobicContact CB-CD1 4.44Å; L99-L103 VanDerWaalsContact O-CG 3.27Å; L99-L103 WeakPolarHBondContact O-CG 3.16Å; L99-L103 PolarHBondContact O-N 3.08Å; L99-I170 HydrophobicContact CD2-CD1 3.66Å; L99-I170 HydrophobicContact CD2-CG1 4.08Å; L99-A196 HydrophobicContact CD1-CB 4.08Å; L99-A198 HydrophobicContact CD2-CB 3.81Å
100	L	96.6	Very high	94.9	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-35.1	-176.4	-78.8	169.4	0	0	0	113.5	E96 I97 R102 L103 I109 L111 M125 M127 L193	E96-L100 HydrophobicContact CG-CD1 3.98Å; E96-L100 WeakPolarHBondContact O-CB 3.13Å; E96-L100 WeakPolarHBondContact O-CG 3.33Å; E96-L100 PolarHBondContact O-N 3.41Å; I97-L100 PolarHBondContact O-N 3.27Å; L100-R102 PolarHBondContact O-N 3.33Å; L100-L103 PolarHBondContact O-N 2.88Å; L100-I109 HydrophobicContact CD2-CG2 3.79Å; L100-I109 WeakPolarHBondContact CD2-O 3.34Å; L100-L111 HydrophobicContact CB-CB 3.69Å; L100-L111 HydrophobicContact CB-CD2 3.91Å; L100-L111 HydrophobicContact CB-CG 4.41Å; L100-L111 HydrophobicContact CD1-CB 4.31Å; L100-L111 HydrophobicContact CG-CB 4.44Å; L100-M125 HydrophobicContact CD1-CE 3.77Å; L100-M127 HydrophobicContact CD1-CE 4.22Å; L100-L193 HydrophobicContact CD2-CD1 3.39Å; L100-L193 HydrophobicContact CG-CD1 3.73Å
101	R	95.7	Very high	95.3	Very high	107 Å²	107	53.8 Å²	53.8	40%	0.404	25%	0.246	S	C	.	.	H	α-helix	trans	-60.7	-28.5	178.7	-81.9	-177.3	173.9	-175	-3.3	114.2	I97 L99 L111 Q365	I97-R101 HydrophobicContact CG2-CG 4.35Å; I97-R101 WeakPolarHBondContact O-CB 3.36Å; I97-R101 WeakPolarHBondContact O-CG 3.41Å; I97-R101 PolarHBondContact O-N 2.73Å; L99-R101 VanDerWaalsContact C-N 3.27Å; L99-R101 PolarHBondContact O-N 3.14Å; R101-L111 HydrophobicContact CG-CD2 3.94Å; R101-Q365 PolarHBondContact NH1-O 3.42Å; R101-Q365 PolarHBondContact NH2-O 3.12Å
102	R	94.1	Very high	95.7	Very high	117 Å²	117	54.1 Å²	54.1	44%	0.442	24%	0.244	S	C	.	.	H	α-helix	trans	-102	-1.6	-179.3	65.6	173.7	179	115.3	-3.2	113.8	L99 L100 Q168	L99-R102 VanDerWaalsContact O-CG 3.24Å; L99-R102 WeakPolarHBondContact O-CG 3.32Å; L99-R102 PolarHBondContact O-N 2.83Å; L99-R102 VanDerWaalsContact O-N 3.15Å; L100-R102 PolarHBondContact O-N 3.33Å; R102-Q168 PolarHBondContact NH1-O 2.83Å
103	L	96.9	Very high	96.2	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.047	25%	0.247	C	C	.	.			trans	-97.9	126.5	-177.5	-66.8	171.3	0	0	0	110.8	L99 L100 V108 Y164 L165 Q168 I170 L193	L99-L103 HydrophobicContact CB-CD1 4.44Å; L99-L103 VanDerWaalsContact O-CG 3.27Å; L99-L103 WeakPolarHBondContact O-CG 3.16Å; L99-L103 PolarHBondContact O-N 3.08Å; L100-L103 PolarHBondContact O-N 2.88Å; L103-V108 HydrophobicContact CB-CG1 4.44Å; L103-V108 HydrophobicContact CD1-CG1 4.39Å; L103-Y164 WeakPolarHBondContact CA-OH 3.23Å; L103-Y164 HydrophobicContact CB-CE1 4.27Å; L103-Y164 HydrophobicContact CD2-CE1 3.58Å; L103-L165 HydrophobicContact CD1-CD2 3.85Å; L103-L165 HydrophobicContact CD2-CD2 4.11Å; L103-Q168 HydrophobicContact CD2-CB 4.16Å; L103-Q168 HydrophobicContact CD2-CG 4.01Å; L103-I170 HydrophobicContact CD1-CD1 3.73Å; L103-I170 HydrophobicContact CD2-CD1 3.58Å; L103-I170 HydrophobicContact CG-CD1 4.02Å; L103-L193 HydrophobicContact CD1-CD1 3.97Å
104	Q	97.5	Very high	96.4	Very high	155 Å²	155	54.9 Å²	54.9	72%	0.724	25%	0.248	S	C	*	.			trans	-142.2	100.4	177.1	-169.4	176.7	21.6	0	0	109.3	Y164	Q104-Y164 PolarHBondContact N-OH 2.98Å; Q104-Y164 PolarHBondContact O-OH 3.28Å
105	H	98.6	Very high	96.6	Very high	48 Å²	48	50.2 Å²	50.2	22%	0.222	23%	0.228	C	C	.	.			trans	-152	144.8	176.5	-177.6	-104	0	0	0	110.4	N107 V108 N160 Y164	H105-N107 PolarHBondContact ND1-N 3.17Å; H105-N107 PolarHBondContact O-N 3.22Å; H105-V108 HydrophobicContact CB-CB 4.31Å; H105-V108 HydrophobicContact CB-CG2 4.15Å; H105-V108 PolarHBondContact O-N 3.05Å; H105-V108 VanDerWaalsContact O-N 3.08Å; H105-V108 VanDerWaalsContact O-O 3.09Å; H105-N160 PolarHBondContact CE1-O 2.87Å; H105-Y164 HydrophobicContact CB-CD1 3.33Å; H105-Y164 HydrophobicContact CB-CD2 4.01Å; H105-Y164 HydrophobicContact CB-CE1 3.52Å; H105-Y164 HydrophobicContact CB-CE2 4.2Å; H105-Y164 HydrophobicContact CB-CG 3.58Å; H105-Y164 AromaticContact CD2-CG 3.85Å; H105-Y164 AromaticContact CG-CD1 3.82Å; H105-Y164 AromaticContact CG-CG 3.63Å
106	K	98.2	Very high	96.7	Very high	135 Å²	135	45.6 Å²	45.6	59%	0.587	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.8	-178.3	67.8	-179.3	-178.3	179.5	0	113.7	K189	K106-K189 VanDerWaalsContact O-CD 3.28Å; K106-K189 WeakPolarHBondContact O-CD 3.29Å; K106-K189 WeakPolarHBondContact O-CE 3.5Å; K106-K189 PolarHBondContact O-NZ 3.19Å; K106-K189 VanDerWaalsContact O-NZ 3.1Å
107	N	98.8	Very high	96.6	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	17.5	-179.1	-57.3	120.9	0	0	0	115.2	H105 Q157 L188 I190	H105-N107 PolarHBondContact ND1-N 3.17Å; H105-N107 PolarHBondContact O-N 3.22Å; N107-Q157 WeakPolarHBondContact CB-O 3.43Å; N107-Q157 PolarHBondContact ND2-OE1 3.17Å; N107-Q157 PolarHBondContact OD1-O 3.5Å; N107-L188 WeakPolarHBondContact CA-O 3.42Å; N107-L188 WeakPolarHBondContact CB-O 3.48Å; N107-L188 PolarHBondContact ND2-O 3.16Å; N107-I190 WeakPolarHBondContact O-CG1 3.19Å; N107-I190 PolarHBondContact O-N 3.05Å
108	V	98.7	Very high	96.3	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-124.9	139.1	172.3	178.9	0	0	0	0	108.1	L103 H105 Q110 Y164 L165	L103-V108 HydrophobicContact CB-CG1 4.44Å; L103-V108 HydrophobicContact CD1-CG1 4.39Å; H105-V108 HydrophobicContact CB-CB 4.31Å; H105-V108 HydrophobicContact CB-CG2 4.15Å; H105-V108 PolarHBondContact O-N 3.05Å; H105-V108 VanDerWaalsContact O-N 3.08Å; H105-V108 VanDerWaalsContact O-O 3.09Å; V108-Q110 PolarHBondContact O-N 2.95Å; V108-Y164 HydrophobicContact CG2-CD1 3.93Å; V108-Y164 HydrophobicContact CG2-CE1 4.42Å; V108-L165 HydrophobicContact CG1-CD2 4.29Å; V108-L165 HydrophobicContact CG2-CD1 4.43Å; V108-L165 HydrophobicContact CG2-CD2 3.99Å; V108-L165 HydrophobicContact CG2-CG 4.03Å
109	I	98.1	Very high	96	Very high	5 Å²	5	52 Å²	52	3%	0.026	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-60.8	131.9	-179.8	-165.2	73.5	0	0	0	110.8	L100 M127 E128 L181 K189 I190	L100-I109 HydrophobicContact CD2-CG2 3.79Å; L100-I109 WeakPolarHBondContact CD2-O 3.34Å; I109-M127 HydrophobicContact CG1-CB 4.37Å; I109-M127 HydrophobicContact CG1-SD 4.34Å; I109-E128 WeakPolarHBondContact CA-OE1 3.42Å; I109-E128 HydrophobicContact CD1-CG 3.44Å; I109-E128 VanDerWaalsContact CD1-CG 3.44Å; I109-E128 HydrophobicContact CG1-CG 4.2Å; I109-L181 HydrophobicContact CD1-CD1 4.34Å; I109-K189 HydrophobicContact CD1-CB 4.22Å; I109-K189 HydrophobicContact CD1-CG 4.49Å; I109-I190 WeakPolarHBondContact CB-O 3.49Å; I109-I190 WeakPolarHBondContact CG2-O 3.47Å; I109-I190 PolarHBondContact N-O 3.46Å
110	Q	98	Very high	95.7	Very high	84 Å²	84	55.3 Å²	55.3	39%	0.393	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-88.7	126.7	177.1	-171.8	176.1	24.7	0	0	111.2	V108 M127 E128	V108-Q110 PolarHBondContact O-N 2.95Å; Q110-M127 CarbonylContact O-C 3.37Å; Q110-M127 VanDerWaalsContact O-CA 3.24Å; Q110-M127 WeakPolarHBondContact O-CA 3.38Å; Q110-E128 HydrophobicContact CB-CB 4.37Å; Q110-E128 HydrophobicContact CB-CG 4.16Å; Q110-E128 PolarHBondContact N-OE1 2.84Å; Q110-E128 PolarHBondContact O-N 2.85Å
111	L	98.2	Very high	95.5	Very high	20 Å²	20	57.4 Å²	57.4	11%	0.105	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.3	162	-179.2	75.5	0	0	0	108.7	I97 L100 R101 V114 M125 V126 M127	I97-L111 HydrophobicContact CG2-CD2 4.19Å; L100-L111 HydrophobicContact CB-CB 3.69Å; L100-L111 HydrophobicContact CB-CD2 3.91Å; L100-L111 HydrophobicContact CB-CG 4.41Å; L100-L111 HydrophobicContact CD1-CB 4.31Å; L100-L111 HydrophobicContact CG-CB 4.44Å; R101-L111 HydrophobicContact CG-CD2 3.94Å; L111-V114 HydrophobicContact CD1-CG2 4.07Å; L111-V114 HydrophobicContact CD2-CG2 3.82Å; L111-V114 HydrophobicContact CG-CG2 4.29Å; L111-M125 HydrophobicContact CD1-CB 3.92Å; L111-M125 HydrophobicContact CD1-CE 4.24Å; L111-V126 WeakPolarHBondContact CD1-O 3.37Å; L111-M127 HydrophobicContact CD1-CG 4.35Å
112	V	97.6	Very high	95.4	Very high	52 Å²	52	54.9 Å²	54.9	32%	0.315	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-44.4	-178.1	178.6	0	0	0	0	110.3	V126	V112-V126 HydrophobicContact CB-CB 4.49Å; V112-V126 HydrophobicContact CB-CG1 4.1Å; V112-V126 HydrophobicContact CG1-CG1 4.43Å; V112-V126 PolarHBondContact N-O 2.99Å
113	D	96.9	Very high	95.5	Very high	37 Å²	37	49.9 Å²	49.9	20%	0.198	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	160.1	-173	-156.6	-8.6	0	0	0	111.6	Y47 V126	Y47-D113 HydrophobicContact CE2-CB 4.42Å; Y47-D113 WeakPolarHBondContact CE2-OD2 3.36Å; Y47-D113 WeakPolarHBondContact OH-CB 3.27Å; Y47-D113 PolarHBondContact OH-OD2 3.03Å; D113-V126 HydrophobicContact CB-CB 3.8Å; D113-V126 HydrophobicContact CB-CG1 4.47Å; D113-V126 HydrophobicContact CB-CG2 3.98Å; D113-V126 PolarHBondContact N-O 3.11Å; D113-V126 PolarHBondContact O-N 3.22Å
114	V	96.9	Very high	95.4	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	116.9	173.1	-173.6	0	0	0	0	109.8	I97 L111 Y116 M123 Y124	I97-V114 HydrophobicContact CD1-CG1 4.08Å; I97-V114 HydrophobicContact CD1-CG2 4.44Å; I97-V114 HydrophobicContact CG1-CG2 4.35Å; I97-V114 HydrophobicContact CG2-CG2 4Å; L111-V114 HydrophobicContact CD1-CG2 4.07Å; L111-V114 HydrophobicContact CD2-CG2 3.82Å; L111-V114 HydrophobicContact CG-CG2 4.29Å; V114-Y116 HydrophobicContact CB-CE2 4.4Å; V114-Y116 HydrophobicContact CG1-CD2 4.46Å; V114-Y116 HydrophobicContact CG1-CE2 3.63Å; V114-M123 HydrophobicContact CG1-CG 4.13Å; V114-Y124 CarbonylContact C-O 3.59Å; V114-Y124 WeakPolarHBondContact CA-O 3.3Å
115	L	95.9	Very high	95.4	Very high	11 Å²	11	42.4 Å²	42.4	6%	0.058	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.2	179.8	-47.1	171.8	0	0	0	111.1	I44 Y47 M123 Y124	I44-L115 HydrophobicContact CG2-CD1 3.79Å; Y47-L115 HydrophobicContact CD2-CD1 3.76Å; Y47-L115 HydrophobicContact CE2-CD1 3.9Å; L115-M123 CarbonylContact O-C 3.6Å; L115-M123 WeakPolarHBondContact O-CA 3.39Å; L115-Y124 HydrophobicContact CB-CD2 4.44Å; L115-Y124 PolarHBondContact N-O 3.45Å; L115-Y124 PolarHBondContact O-N 3Å
116	Y	93.4	Very high	95.4	Very high	26 Å²	26	40.1 Å²	40.1	10%	0.102	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.7	-179.1	-62.5	-93.4	0	0	0	109.9	V114 M123 I361 Q365	V114-Y116 HydrophobicContact CB-CE2 4.4Å; V114-Y116 HydrophobicContact CG1-CD2 4.46Å; V114-Y116 HydrophobicContact CG1-CE2 3.63Å; Y116-M123 HydrophobicContact CD1-CB 4.36Å; Y116-M123 HydrophobicContact CD1-CE 4.33Å; Y116-M123 HydrophobicContact CD1-CG 4.13Å; Y116-M123 HydrophobicContact CE1-CB 4.46Å; Y116-M123 HydrophobicContact CE1-CE 3.44Å; Y116-M123 VanDerWaalsContact CE1-CE 3.44Å; Y116-M123 HydrophobicContact CE1-CG 3.85Å; Y116-M123 HydrophobicContact CE1-SD 4.32Å; Y116-I361 WeakPolarHBondContact O-CG2 3.1Å; Y116-Q365 HydrophobicContact CE2-CB 4.43Å
117	N	92.2	Very high	95.3	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	102	167.5	-176.4	-57.1	0	0	0	107.5	E119 K120 Q121 K122 Y124 I361	N117-E119 PolarHBondContact OD1-N 3.41Å; N117-K120 VanDerWaalsContact OD1-CB 3.24Å; N117-K120 WeakPolarHBondContact OD1-CB 3.39Å; N117-K120 WeakPolarHBondContact OD1-CG 3.4Å; N117-K120 PolarHBondContact OD1-N 3.08Å; N117-Q121 WeakPolarHBondContact O-CA 3.44Å; N117-Q121 PolarHBondContact O-N 3.1Å; N117-K122 PolarHBondContact N-O 2.84Å; N117-K122 PolarHBondContact O-N 3.41Å; N117-Y124 HydrophobicContact CB-CE2 3.99Å; N117-I361 HydrophobicContact CB-CG1 4.35Å
118	E	88.6	Confident	95.3	Very high	103 Å²	103	36 Å²	36	48%	0.481	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-42	-176.4	-72.7	-59.7	154.4	0	0	111.7	K80 K120 Q121	K80-E118 IonicContact NZ-OE1 2.72Å; K80-E118 PolarHBondContact NZ-OE1 3.09Å; K80-E118 IonicContact NZ-OE2 2.64Å; K80-E118 PolarHBondContact NZ-OE2 3.49Å; E118-K120 PolarHBondContact O-N 3.13Å; E118-Q121 WeakPolarHBondContact O-CG 3.38Å; E118-Q121 PolarHBondContact O-N 3.36Å; E118-Q121 PolarHBondContact O-NE2 3.37Å; E118-Q121 PolarHBondContact OE2-NE2 3.02Å
119	E	89.9	Confident	95.2	Very high	156 Å²	156	37 Å²	37	73%	0.729	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-48.5	179.9	-57.8	-173.2	155.7	0	0	112.2	N117 Q121	N117-E119 PolarHBondContact OD1-N 3.41Å; E119-Q121 PolarHBondContact O-N 2.8Å
120	K	89.6	Confident	95.1	Very high	83 Å²	83	37.5 Å²	37.5	36%	0.361	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.1	179.3	-58.9	-176.7	-176.8	178	0	112.1	N117 E118 K122 D359	N117-K120 VanDerWaalsContact OD1-CB 3.24Å; N117-K120 WeakPolarHBondContact OD1-CB 3.39Å; N117-K120 WeakPolarHBondContact OD1-CG 3.4Å; N117-K120 PolarHBondContact OD1-N 3.08Å; E118-K120 PolarHBondContact O-N 3.13Å; K120-K122 VanDerWaalsContact C-N 3.3Å; K120-K122 HydrophobicContact CB-CD 4.16Å; K120-K122 HydrophobicContact CB-CG 4.39Å; K120-K122 PolarHBondContact O-N 3.15Å; K120-D359 WeakPolarHBondContact CE-OD1 3.5Å; K120-D359 IonicContact NZ-OD1 3.67Å; K120-D359 PolarHBondContact NZ-OD1 3Å; K120-D359 IonicContact NZ-OD2 3.74Å; K120-D359 PolarHBondContact NZ-OD2 2.92Å
121	Q	92.5	Very high	95	Very high	48 Å²	48	34 Å²	34	22%	0.224	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	47.7	-179	-67.9	-75.8	-70.2	0	0	111.7	K80 N117 E118 E119	K80-Q121 HydrophobicContact CB-CB 4.24Å; K80-Q121 PolarHBondContact N-O 2.79Å; N117-Q121 WeakPolarHBondContact O-CA 3.44Å; N117-Q121 PolarHBondContact O-N 3.1Å; E118-Q121 WeakPolarHBondContact O-CG 3.38Å; E118-Q121 PolarHBondContact O-N 3.36Å; E118-Q121 PolarHBondContact O-NE2 3.37Å; E118-Q121 PolarHBondContact OE2-NE2 3.02Å; E119-Q121 PolarHBondContact O-N 2.8Å
122	K	93.6	Very high	94.8	Very high	53 Å²	53	33.3 Å²	33.3	23%	0.23	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.6	-178	-73.5	173.2	-172.4	172.7	0	111.7	I77 L78 K79 N117 K120 Y124	I77-K122 HydrophobicContact CG2-CD 4.3Å; L78-K122 CarbonylContact O-C 3.47Å; L78-K122 VanDerWaalsContact O-CA 3.29Å; L78-K122 WeakPolarHBondContact O-CA 3.5Å; K79-K122 HydrophobicContact CG-CG 4.33Å; N117-K122 PolarHBondContact N-O 2.84Å; N117-K122 PolarHBondContact O-N 3.41Å; K120-K122 VanDerWaalsContact C-N 3.3Å; K120-K122 HydrophobicContact CB-CD 4.16Å; K120-K122 HydrophobicContact CB-CG 4.39Å; K120-K122 PolarHBondContact O-N 3.15Å; K122-Y124 HydrophobicContact CB-CD2 4.42Å; K122-Y124 HydrophobicContact CB-CE2 3.64Å; K122-Y124 HydrophobicContact CD-CE2 4.5Å; K122-Y124 WeakPolarHBondContact CD-OH 3.12Å
123	M	94.5	Very high	94.7	Very high	13 Å²	13	31.6 Å²	31.6	6%	0.064	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.8	168.4	179.6	-160.9	-75.1	0	0	108	L78 V93 I97 V114 L115 Y116 M125	L78-M123 HydrophobicContact CB-CB 4.32Å; L78-M123 HydrophobicContact CD1-SD 3.94Å; L78-M123 PolarHBondContact N-O 2.93Å; L78-M123 PolarHBondContact O-N 3.38Å; V93-M123 HydrophobicContact CG1-CE 3.95Å; V93-M123 HydrophobicContact CG1-SD 3.45Å; V93-M123 WeakPolarHBondContact CG1-SD 3.12Å; I97-M123 HydrophobicContact CD1-CE 4.14Å; I97-M123 HydrophobicContact CD1-SD 3.6Å; I97-M123 VanDerWaalsContact CD1-SD 3.6Å; V114-M123 HydrophobicContact CG1-CG 4.13Å; L115-M123 CarbonylContact O-C 3.6Å; L115-M123 WeakPolarHBondContact O-CA 3.39Å; Y116-M123 HydrophobicContact CD1-CB 4.36Å; Y116-M123 HydrophobicContact CD1-CE 4.33Å; Y116-M123 HydrophobicContact CD1-CG 4.13Å; Y116-M123 HydrophobicContact CE1-CB 4.46Å; Y116-M123 HydrophobicContact CE1-CE 3.44Å; Y116-M123 VanDerWaalsContact CE1-CE 3.44Å; Y116-M123 HydrophobicContact CE1-CG 3.85Å; Y116-M123 HydrophobicContact CE1-SD 4.32Å; M123-M125 HydrophobicContact SD-CG 4.46Å
124	Y	96.3	Very high	94.7	Very high	6 Å²	6	29.9 Å²	29.9	2%	0.024	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	112.7	-176.3	-60.5	-99.4	0	0	0	107.8	I44 V75 I77 V114 L115 N117 K122	I44-Y124 HydrophobicContact CD1-CE1 4.22Å; I44-Y124 HydrophobicContact CG1-CE1 4.16Å; I44-Y124 HydrophobicContact CG2-CD1 4.08Å; I44-Y124 HydrophobicContact CG2-CD2 4.23Å; I44-Y124 HydrophobicContact CG2-CE1 4.09Å; I44-Y124 HydrophobicContact CG2-CE2 4.28Å; I44-Y124 HydrophobicContact CG2-CG 4.14Å; V75-Y124 HydrophobicContact CG2-CD1 3.86Å; V75-Y124 HydrophobicContact CG2-CG 4.29Å; I77-Y124 HydrophobicContact CD1-CE1 4.35Å; I77-Y124 HydrophobicContact CG1-CD1 3.95Å; I77-Y124 HydrophobicContact CG1-CE1 4.14Å; I77-Y124 HydrophobicContact CG2-CD1 4.18Å; I77-Y124 HydrophobicContact CG2-CE1 3.93Å; V114-Y124 CarbonylContact C-O 3.59Å; V114-Y124 WeakPolarHBondContact CA-O 3.3Å; L115-Y124 HydrophobicContact CB-CD2 4.44Å; L115-Y124 PolarHBondContact N-O 3.45Å; L115-Y124 PolarHBondContact O-N 3Å; N117-Y124 HydrophobicContact CB-CE2 3.99Å; K122-Y124 HydrophobicContact CB-CD2 4.42Å; K122-Y124 HydrophobicContact CB-CE2 3.64Å; K122-Y124 HydrophobicContact CD-CE2 4.5Å; K122-Y124 WeakPolarHBondContact CD-OH 3.12Å
125	M	97	Very high	94.7	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	107	172.5	-63.1	169.7	65.5	0	0	108.2	V75 K76 L78 V93 E96 I97 L100 L111 M123 M127	V75-M125 WeakPolarHBondContact CA-O 3.28Å; K76-M125 HydrophobicContact CB-CB 4.27Å; K76-M125 HydrophobicContact CD-SD 4.38Å; K76-M125 PolarHBondContact N-O 2.96Å; K76-M125 PolarHBondContact O-N 3.2Å; L78-M125 HydrophobicContact CD1-CG 4.28Å; L78-M125 HydrophobicContact CD1-SD 3.63Å; V93-M125 HydrophobicContact CG1-SD 4.27Å; E96-M125 HydrophobicContact CG-CE 4.22Å; I97-M125 HydrophobicContact CD1-CG 4.25Å; I97-M125 HydrophobicContact CD1-SD 4.24Å; I97-M125 HydrophobicContact CG1-CE 3.64Å; I97-M125 HydrophobicContact CG1-CG 4.17Å; I97-M125 HydrophobicContact CG1-SD 3.93Å; L100-M125 HydrophobicContact CD1-CE 3.77Å; L111-M125 HydrophobicContact CD1-CB 3.92Å; L111-M125 HydrophobicContact CD1-CE 4.24Å; M123-M125 HydrophobicContact SD-CG 4.46Å; M125-M127 HydrophobicContact CB-CE 3.98Å; M125-M127 HydrophobicContact CE-CE 3.7Å
126	V	98	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.9	178.9	-176.6	0	0	0	0	108.7	Y47 M64 R73 A74 L111 V112 D113	Y47-V126 HydrophobicContact CD2-CG2 4.42Å; Y47-V126 HydrophobicContact CE1-CG1 4.02Å; Y47-V126 HydrophobicContact CE2-CG2 4.09Å; M64-V126 HydrophobicContact CE-CB 4.41Å; M64-V126 HydrophobicContact CE-CG1 4.06Å; M64-V126 HydrophobicContact CE-CG2 3.57Å; M64-V126 HydrophobicContact SD-CB 4.21Å; M64-V126 HydrophobicContact SD-CG1 3.58Å; M64-V126 VanDerWaalsContact SD-CG1 3.58Å; M64-V126 HydrophobicContact SD-CG2 3.96Å; R73-V126 HydrophobicContact CB-CG1 4.03Å; R73-V126 HydrophobicContact CG-CG1 4.2Å; A74-V126 CarbonylContact O-C 3.51Å; A74-V126 WeakPolarHBondContact O-CA 3.4Å; L111-V126 WeakPolarHBondContact CD1-O 3.37Å; V112-V126 HydrophobicContact CB-CB 4.49Å; V112-V126 HydrophobicContact CB-CG1 4.1Å; V112-V126 HydrophobicContact CG1-CG1 4.43Å; V112-V126 PolarHBondContact N-O 2.99Å; D113-V126 HydrophobicContact CB-CB 3.8Å; D113-V126 HydrophobicContact CB-CG1 4.47Å; D113-V126 HydrophobicContact CB-CG2 3.98Å; D113-V126 PolarHBondContact N-O 3.11Å; D113-V126 PolarHBondContact O-N 3.22Å
127	M	97.7	Very high	94.8	Very high	25 Å²	25	33.8 Å²	33.8	12%	0.123	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	163.2	-174.8	-61.1	177.7	-178.4	0	0	110.2	R73 A74 K76 L100 I109 Q110 L111 M125	R73-M127 WeakPolarHBondContact CB-O 3.41Å; A74-M127 PolarHBondContact N-O 3.43Å; A74-M127 PolarHBondContact O-N 2.81Å; K76-M127 HydrophobicContact CB-CE 4.25Å; K76-M127 HydrophobicContact CD-CE 4.1Å; L100-M127 HydrophobicContact CD1-CE 4.22Å; I109-M127 HydrophobicContact CG1-CB 4.37Å; I109-M127 HydrophobicContact CG1-SD 4.34Å; Q110-M127 CarbonylContact O-C 3.37Å; Q110-M127 VanDerWaalsContact O-CA 3.24Å; Q110-M127 WeakPolarHBondContact O-CA 3.38Å; L111-M127 HydrophobicContact CD1-CG 4.35Å; M125-M127 HydrophobicContact CB-CE 3.98Å; M125-M127 HydrophobicContact CE-CE 3.7Å
128	E	97.3	Very high	95.1	Very high	25 Å²	25	33.7 Å²	33.7	12%	0.117	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	145.4	165.7	68.2	179.6	136	0	0	111.2	I109 Q110 K189	I109-E128 WeakPolarHBondContact CA-OE1 3.42Å; I109-E128 HydrophobicContact CD1-CG 3.44Å; I109-E128 VanDerWaalsContact CD1-CG 3.44Å; I109-E128 HydrophobicContact CG1-CG 4.2Å; Q110-E128 HydrophobicContact CB-CB 4.37Å; Q110-E128 HydrophobicContact CB-CG 4.16Å; Q110-E128 PolarHBondContact N-OE1 2.84Å; Q110-E128 PolarHBondContact O-N 2.85Å; E128-K189 WeakPolarHBondContact OE1-CD 3.16Å; E128-K189 VanDerWaalsContact OE1-CE 3.3Å; E128-K189 WeakPolarHBondContact OE1-CE 3.48Å; E128-K189 IonicContact OE1-NZ 2.67Å; E128-K189 PolarHBondContact OE1-NZ 3.18Å; E128-K189 WeakPolarHBondContact OE2-CE 3.45Å; E128-K189 IonicContact OE2-NZ 2.78Å; E128-K189 PolarHBondContact OE2-NZ 2.89Å
129	Y	97.3	Very high	95.4	Very high	24 Å²	24	33 Å²	33	9%	0.094	16%	0.161	C	C	.	.			trans	-78.6	129.8	179.6	175.1	-96.3	0	0	0	111	L53 E63 R72 V131	L53-Y129 HydrophobicContact CD1-CD2 4.02Å; L53-Y129 HydrophobicContact CD1-CE2 3.78Å; L53-Y129 HydrophobicContact CD2-CE2 4.05Å; E63-Y129 HydrophobicContact CG-CE2 4.43Å; R72-Y129 HydrophobicContact CG-CD1 4.15Å; R72-Y129 HydrophobicContact CG-CD2 4.07Å; R72-Y129 HydrophobicContact CG-CG 3.83Å; R72-Y129 PolarHBondContact NH1-OH 3.16Å; R72-Y129 PolarHBondContact NH2-OH 2.73Å; R72-Y129 VanDerWaalsContact NH2-OH 3.15Å; R72-Y129 WeakPolarHBondContact O-CB 3.41Å; Y129-V131 HydrophobicContact CE1-CB 4.06Å; Y129-V131 HydrophobicContact CE1-CG2 4.49Å
130	C	96.6	Very high	95.7	Very high	16 Å²	16	28.1 Å²	28.1	11%	0.108	14%	0.144	C	C	.	.			trans	-112.4	137.5	167.4	-68.6	0	0	0	0	109.3	L181 L182	C130-L181 HydrophobicContact CB-CB 3.64Å; C130-L181 HydrophobicContact CB-CD1 4.08Å; C130-L181 HydrophobicContact CB-CG 4.44Å; C130-L182 CarbonylContact C-O 3.54Å; C130-L182 WeakPolarHBondContact CA-O 3.45Å; C130-L182 VanDerWaalsContact CB-O 3.29Å; C130-L182 WeakPolarHBondContact CB-O 3.44Å
131	V	94.7	Very high	96	Very high	10 Å²	10	25.3 Å²	25.3	6%	0.061	13%	0.134	C	C	.	.	S	Bend	trans	-75.8	-29.9	-173.6	68.8	0	0	0	0	112.9	Y129 L182 T184 I320 R331	Y129-V131 HydrophobicContact CE1-CB 4.06Å; Y129-V131 HydrophobicContact CE1-CG2 4.49Å; V131-L182 WeakPolarHBondContact CG1-O 3.37Å; V131-L182 PolarHBondContact N-O 3.29Å; V131-T184 HydrophobicContact CB-CG2 3.94Å; V131-T184 HydrophobicContact CG1-CG2 4.46Å; V131-T184 HydrophobicContact CG2-CG2 4.19Å; V131-I320 HydrophobicContact CG1-CD1 3.6Å; V131-I320 HydrophobicContact CG1-CG1 4.41Å; V131-I320 HydrophobicContact CG2-CG2 4.37Å; V131-R331 HydrophobicContact CG2-CB 3.77Å; V131-R331 HydrophobicContact CG2-CG 3.9Å; V131-R331 PolarHBondContact O-NH1 3.04Å
132	C	93.8	Very high	96.2	Very high	6 Å²	6	28.7 Å²	28.7	4%	0.041	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	151.4	-174.7	-167.3	0	0	0	0	111.5	E136 L182 I320	C132-E136 VanDerWaalsContact SG-CD 3.52Å; C132-E136 PolarHBondContact SG-OE2 3.05Å; C132-L182 PolarHBondContact N-O 3.31Å; C132-L182 PolarHBondContact O-N 2.73Å; C132-I320 HydrophobicContact CB-CG2 3.94Å
133	G	95.7	Very high	96.3	Very high	15 Å²	15	31.4 Å²	31.4	16%	0.155	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	146.2	165.4	0	0	0	0	0	111.3	Q135 E136 M137	G133-Q135 VanDerWaalsContact C-N 3.28Å; G133-Q135 PolarHBondContact O-N 3.26Å; G133-E136 WeakPolarHBondContact O-CB 3.07Å; G133-E136 PolarHBondContact O-N 3.31Å; G133-E136 VanDerWaalsContact O-N 3.12Å; G133-M137 PolarHBondContact O-N 2.82Å
134	M	97.7	Very high	96.5	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-38	178.3	-179	-177.8	-71.1	0	0	111.9	E136 M137 L138 F146 Y154 P177 L180 L188 I246	M134-E136 VanDerWaalsContact C-N 3.29Å; M134-E136 PolarHBondContact O-N 3.15Å; M134-M137 WeakPolarHBondContact O-CB 3.41Å; M134-M137 PolarHBondContact O-N 3.06Å; M134-L138 HydrophobicContact CG-CD1 4.36Å; M134-L138 WeakPolarHBondContact O-CG 3.37Å; M134-L138 PolarHBondContact O-N 3.45Å; M134-F146 HydrophobicContact CG-CE2 3.68Å; M134-F146 HydrophobicContact CG-CZ 3.91Å; M134-F146 HydrophobicContact SD-CE2 4.12Å; M134-Y154 HydrophobicContact CE-CD2 3.94Å; M134-Y154 HydrophobicContact CE-CG 3.97Å; M134-P177 HydrophobicContact CB-CB 4.42Å; M134-P177 WeakPolarHBondContact CB-O 3.46Å; M134-P177 HydrophobicContact CG-CB 4.2Å; M134-P177 HydrophobicContact SD-CB 4.24Å; M134-L180 HydrophobicContact CB-CB 4.12Å; M134-L180 VanDerWaalsContact CB-O 3.28Å; M134-L180 WeakPolarHBondContact CB-O 3.46Å; M134-L180 HydrophobicContact CE-CB 4.1Å; M134-L180 HydrophobicContact CE-CD1 4.05Å; M134-L180 PolarHBondContact N-O 3.12Å; M134-L180 HydrophobicContact SD-CB 4.29Å; M134-L180 HydrophobicContact SD-CD1 3.95Å; M134-L188 HydrophobicContact CE-CD1 3.44Å; M134-L188 VanDerWaalsContact CE-CD1 3.44Å; M134-I246 HydrophobicContact SD-CG2 3.79Å
135	Q	96.6	Very high	96.5	Very high	53 Å²	53	38 Å²	38	25%	0.248	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-40	175	-174.4	60.6	57.9	0	0	112.6	G133 M137 L138 D139 P177	G133-Q135 VanDerWaalsContact C-N 3.28Å; G133-Q135 PolarHBondContact O-N 3.26Å; Q135-M137 VanDerWaalsContact C-N 3.34Å; Q135-M137 PolarHBondContact O-N 2.9Å; Q135-L138 PolarHBondContact O-N 2.88Å; Q135-D139 PolarHBondContact NE2-OD2 2.86Å; Q135-D139 PolarHBondContact O-N 3.39Å; Q135-P177 HydrophobicContact CB-CB 4.26Å; Q135-P177 PolarHBondContact N-O 3.42Å
136	E	95.2	Very high	96.6	Very high	68 Å²	68	38 Å²	38	32%	0.318	20%	0.2	S	C	.	.	H	α-helix	trans	-64.4	-39.6	177.2	-177.3	-172.5	169.9	0	0	111.2	C132 G133 M134 D139 S140 P321 R331	C132-E136 VanDerWaalsContact SG-CD 3.52Å; C132-E136 PolarHBondContact SG-OE2 3.05Å; G133-E136 WeakPolarHBondContact O-CB 3.07Å; G133-E136 PolarHBondContact O-N 3.31Å; G133-E136 VanDerWaalsContact O-N 3.12Å; M134-E136 VanDerWaalsContact C-N 3.29Å; M134-E136 PolarHBondContact O-N 3.15Å; E136-D139 PolarHBondContact O-N 2.81Å; E136-S140 WeakPolarHBondContact O-CB 3.4Å; E136-S140 PolarHBondContact O-N 2.96Å; E136-S140 VanDerWaalsContact O-N 3.1Å; E136-P321 HydrophobicContact CG-CG 4.02Å; E136-R331 IonicContact OE1-CZ 3.87Å; E136-R331 IonicContact OE1-NH1 3Å; E136-R331 PolarHBondContact OE1-NH1 2.91Å; E136-R331 IonicContact OE1-NH2 3.61Å; E136-R331 PolarHBondContact OE1-NH2 3.43Å; E136-R331 IonicContact OE2-NH1 3.58Å
137	M	96.3	Very high	96.5	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-43.2	174.1	-67.3	-170.5	63.4	0	0	112.4	G133 M134 Q135 S140 F146 L182 V318 I320	G133-M137 PolarHBondContact O-N 2.82Å; M134-M137 WeakPolarHBondContact O-CB 3.41Å; M134-M137 PolarHBondContact O-N 3.06Å; Q135-M137 VanDerWaalsContact C-N 3.34Å; Q135-M137 PolarHBondContact O-N 2.9Å; M137-S140 WeakPolarHBondContact O-CB 3.33Å; M137-S140 PolarHBondContact O-N 2.95Å; M137-S140 PolarHBondContact O-OG 3.02Å; M137-F146 HydrophobicContact CB-CE1 3.88Å; M137-F146 HydrophobicContact CB-CZ 3.85Å; M137-F146 HydrophobicContact CE-CE1 4.07Å; M137-L182 HydrophobicContact SD-CD1 3.19Å; M137-L182 WeakPolarHBondContact SD-CD1 3.29Å; M137-V318 HydrophobicContact CE-CB 4.43Å; M137-V318 HydrophobicContact CE-CG1 4.16Å; M137-V318 WeakPolarHBondContact CE-O 3.43Å; M137-I320 HydrophobicContact CE-CG1 4.35Å; M137-I320 HydrophobicContact SD-CG1 4.19Å
138	L	97.7	Very high	96.5	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-46.3	176.9	-64.8	166.9	0	0	0	110.8	M134 Q135 S140 V141 K144 F146 P177 I246	M134-L138 HydrophobicContact CG-CD1 4.36Å; M134-L138 WeakPolarHBondContact O-CG 3.37Å; M134-L138 PolarHBondContact O-N 3.45Å; Q135-L138 PolarHBondContact O-N 2.88Å; L138-S140 PolarHBondContact O-N 2.91Å; L138-V141 WeakPolarHBondContact O-CG2 3.34Å; L138-V141 PolarHBondContact O-N 3.14Å; L138-K144 WeakPolarHBondContact CD2-O 3.48Å; L138-K144 WeakPolarHBondContact O-CA 3.47Å; L138-F146 HydrophobicContact CD2-CD1 4.36Å; L138-F146 HydrophobicContact CD2-CD2 3.86Å; L138-F146 HydrophobicContact CD2-CE1 4.07Å; L138-F146 HydrophobicContact CD2-CE2 3.51Å; L138-F146 HydrophobicContact CD2-CG 4.25Å; L138-F146 HydrophobicContact CD2-CZ 3.62Å; L138-F146 HydrophobicContact CG-CE2 4.02Å; L138-F146 HydrophobicContact CG-CZ 3.88Å; L138-P177 HydrophobicContact CD1-CB 3.75Å; L138-P177 HydrophobicContact CD1-CG 3.98Å; L138-I246 HydrophobicContact CD1-CG2 3.94Å; L138-I246 HydrophobicContact CD2-CB 4.4Å; L138-I246 HydrophobicContact CD2-CG2 4.35Å
139	D	96.4	Very high	96.6	Very high	87 Å²	87	40.2 Å²	40.2	47%	0.465	21%	0.213	S	C	.	.	H	α-helix	trans	-68.9	-14.2	180	-73.6	-41.9	0	0	0	113.5	Q135 E136 V141 K144	Q135-D139 PolarHBondContact NE2-OD2 2.86Å; Q135-D139 PolarHBondContact O-N 3.39Å; E136-D139 PolarHBondContact O-N 2.81Å; D139-V141 VanDerWaalsContact C-N 3.31Å; D139-K144 IonicContact OD1-NZ 3.94Å; D139-K144 PolarHBondContact OD1-NZ 2.69Å
140	S	95.6	Very high	96.6	Very high	54 Å²	54	40 Å²	40	38%	0.378	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.2	177.4	78.7	0	0	0	0	114.3	E136 M137 L138	E136-S140 WeakPolarHBondContact O-CB 3.4Å; E136-S140 PolarHBondContact O-N 2.96Å; E136-S140 VanDerWaalsContact O-N 3.1Å; M137-S140 WeakPolarHBondContact O-CB 3.33Å; M137-S140 PolarHBondContact O-N 2.95Å; M137-S140 PolarHBondContact O-OG 3.02Å; L138-S140 PolarHBondContact O-N 2.91Å
141	V	96.5	Very high	96.7	Very high	25 Å²	25	39.2 Å²	39.2	15%	0.152	21%	0.208	C	C	.	.	S	Bend	trans	-117.9	143.2	-179.3	-67.1	0	0	0	0	111.3	L138 D139 E143 K144 V318	L138-V141 WeakPolarHBondContact O-CG2 3.34Å; L138-V141 PolarHBondContact O-N 3.14Å; D139-V141 VanDerWaalsContact C-N 3.31Å; V141-E143 VanDerWaalsContact C-N 3.28Å; V141-E143 PolarHBondContact O-N 3.21Å; V141-K144 PolarHBondContact O-N 3.3Å; V141-K144 VanDerWaalsContact O-N 3.12Å; V141-V318 HydrophobicContact CG1-CB 4.46Å; V141-V318 HydrophobicContact CG1-CG1 3.68Å; V141-V318 HydrophobicContact CG1-CG2 4.07Å; V141-V318 HydrophobicContact CG2-CG1 4.36Å; V141-V318 HydrophobicContact CG2-CG2 4.2Å
142	P	96.4	Very high	96.8	Very high	118 Å²	118	40 Å²	40	77%	0.766	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-38.6	-176.7	-26.4	35.1	0	0	0	114.2	K144	P142-K144 VanDerWaalsContact C-N 3.26Å; P142-K144 PolarHBondContact O-N 2.86Å
143	E	95.4	Very high	97.1	Very high	111 Å²	111	41.1 Å²	41.1	52%	0.519	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.6	-176.2	-58.5	76.9	-170.7	0	0	113	V141 R145	V141-E143 VanDerWaalsContact C-N 3.28Å; V141-E143 PolarHBondContact O-N 3.21Å; E143-R145 HydrophobicContact CB-CG 3.85Å; E143-R145 PolarHBondContact O-N 2.84Å; E143-R145 VanDerWaalsContact O-N 3.1Å
144	K	97.6	Very high	97.2	Very high	74 Å²	74	41.7 Å²	41.7	32%	0.322	22%	0.221	S	C	.	.			trans	50.9	32.6	-178.8	-56.7	-171.2	176.8	-160	0	115.1	L138 D139 V141 P142 G249	L138-K144 WeakPolarHBondContact CD2-O 3.48Å; L138-K144 WeakPolarHBondContact O-CA 3.47Å; D139-K144 IonicContact OD1-NZ 3.94Å; D139-K144 PolarHBondContact OD1-NZ 2.69Å; V141-K144 PolarHBondContact O-N 3.3Å; V141-K144 VanDerWaalsContact O-N 3.12Å; P142-K144 VanDerWaalsContact C-N 3.26Å; P142-K144 PolarHBondContact O-N 2.86Å; K144-G249 VanDerWaalsContact O-CA 3.28Å; K144-G249 WeakPolarHBondContact O-CA 3.42Å
145	R	97.6	Very high	97.3	Very high	82 Å²	82	41.6 Å²	41.6	31%	0.309	22%	0.221	S	C	.	.			trans	-140.9	160.4	-179.8	68.7	-179.4	-178.4	76.4	3.1	110.6	E143 T247 E315	E143-R145 HydrophobicContact CB-CG 3.85Å; E143-R145 PolarHBondContact O-N 2.84Å; E143-R145 VanDerWaalsContact O-N 3.1Å; R145-T247 WeakPolarHBondContact CD-O 3.22Å; R145-E315 IonicContact NH1-OE2 2.7Å
146	F	98.1	Very high	97.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.219	C	C	.	.			trans	-94	154.8	168.5	-59.5	-55.2	0	0	0	111.1	M134 M137 L138 Q150 A151 Y154 I246 V318	M134-F146 HydrophobicContact CG-CE2 3.68Å; M134-F146 HydrophobicContact CG-CZ 3.91Å; M134-F146 HydrophobicContact SD-CE2 4.12Å; M137-F146 HydrophobicContact CB-CE1 3.88Å; M137-F146 HydrophobicContact CB-CZ 3.85Å; M137-F146 HydrophobicContact CE-CE1 4.07Å; L138-F146 HydrophobicContact CD2-CD1 4.36Å; L138-F146 HydrophobicContact CD2-CD2 3.86Å; L138-F146 HydrophobicContact CD2-CE1 4.07Å; L138-F146 HydrophobicContact CD2-CE2 3.51Å; L138-F146 HydrophobicContact CD2-CG 4.25Å; L138-F146 HydrophobicContact CD2-CZ 3.62Å; L138-F146 HydrophobicContact CG-CE2 4.02Å; L138-F146 HydrophobicContact CG-CZ 3.88Å; F146-Q150 HydrophobicContact CB-CB 4.23Å; F146-Q150 HydrophobicContact CB-CG 4.33Å; F146-Q150 HydrophobicContact CD1-CG 4.41Å; F146-Q150 HydrophobicContact CG-CG 4.35Å; F146-A151 HydrophobicContact CB-CB 4.12Å; F146-Y154 HydrophobicContact CD2-CD2 4.08Å; F146-Y154 HydrophobicContact CD2-CE2 4.29Å; F146-Y154 HydrophobicContact CE1-CE2 4.48Å; F146-Y154 AromaticContact CE2-CD2 3.99Å; F146-Y154 HydrophobicContact CE2-CD2 3.99Å; F146-Y154 HydrophobicContact CE2-CE2 4.08Å; F146-Y154 HydrophobicContact CZ-CE2 4.19Å; F146-I246 HydrophobicContact CD2-CB 3.91Å; F146-I246 HydrophobicContact CD2-CG2 4.46Å; F146-I246 HydrophobicContact CE2-CB 4.28Å; F146-I246 HydrophobicContact CE2-CG2 4.33Å; F146-I246 PolarHBondContact N-O 3.06Å; F146-V318 HydrophobicContact CD1-CB 3.65Å; F146-V318 HydrophobicContact CD1-CG1 4.26Å; F146-V318 HydrophobicContact CD1-CG2 3.62Å; F146-V318 HydrophobicContact CE1-CB 3.84Å; F146-V318 HydrophobicContact CE1-CG1 3.99Å; F146-V318 HydrophobicContact CE1-CG2 4.2Å
147	P	97.3	Very high	97.5	Very high	7 Å²	7	39.3 Å²	39.3	5%	0.045	21%	0.213	C	C	.	.			trans	-51.9	147.4	156.8	-27.7	35.5	0	0	0	112	F149 Q150 A151 E315 R316	P147-F149 VanDerWaalsContact C-N 3.28Å; P147-F149 HydrophobicContact CB-CD1 3.59Å; P147-F149 HydrophobicContact CB-CE1 3.38Å; P147-F149 HydrophobicContact CB-CZ 4.38Å; P147-F149 HydrophobicContact CG-CE1 3.99Å; P147-F149 PolarHBondContact O-N 2.87Å; P147-Q150 PolarHBondContact O-N 3.09Å; P147-A151 PolarHBondContact O-N 3.15Å; P147-E315 HydrophobicContact CB-CB 4Å; P147-E315 HydrophobicContact CG-CB 3.95Å; P147-R316 VanDerWaalsContact CG-O 3.24Å; P147-R316 WeakPolarHBondContact CG-O 3.41Å
148	V	97.4	Very high	97.7	Very high	50 Å²	50	39.4 Å²	39.4	30%	0.303	21%	0.214	S	C	.	.	H	α-helix	trans	-53.9	-42.1	-175.3	173.9	0	0	0	0	112.8	Q150 H152 W306	V148-Q150 VanDerWaalsContact C-N 3.34Å; V148-Q150 PolarHBondContact O-N 3.26Å; V148-H152 WeakPolarHBondContact O-CB 3.36Å; V148-H152 PolarHBondContact O-N 3Å; V148-W306 HydrophobicContact CG1-CZ2 4.07Å
149	F	97.7	Very high	97.7	Very high	40 Å²	40	39.6 Å²	39.6	18%	0.175	21%	0.214	C	C	.	.	H	α-helix	trans	-65.6	-36.1	-179.5	77.9	-85.1	0	0	0	112.9	P147 G153 H311 P313 E315 P317	P147-F149 VanDerWaalsContact C-N 3.28Å; P147-F149 HydrophobicContact CB-CD1 3.59Å; P147-F149 HydrophobicContact CB-CE1 3.38Å; P147-F149 HydrophobicContact CB-CZ 4.38Å; P147-F149 HydrophobicContact CG-CE1 3.99Å; P147-F149 PolarHBondContact O-N 2.87Å; F149-G153 PolarHBondContact O-N 3.13Å; F149-H311 HydrophobicContact CB-CB 3.92Å; F149-P313 HydrophobicContact CD1-CB 4.21Å; F149-P313 HydrophobicContact CD2-CB 3.97Å; F149-P313 HydrophobicContact CE1-CB 4.11Å; F149-P313 HydrophobicContact CE2-CB 3.88Å; F149-P313 HydrophobicContact CG-CB 4.13Å; F149-P313 HydrophobicContact CZ-CB 3.93Å; F149-E315 WeakPolarHBondContact CE1-O 3.42Å; F149-P317 HydrophobicContact CE2-CB 4.39Å; F149-P317 HydrophobicContact CZ-CB 3.85Å; F149-P317 HydrophobicContact CZ-CG 4.43Å
150	Q	97.9	Very high	97.8	Very high	19 Å²	19	37.1 Å²	37.1	9%	0.089	20%	0.201	C	C	.	.	H	α-helix	trans	-75.7	-44.8	179.4	-177	177.7	26.1	0	0	110.3	F146 P147 V148 H152 G153 Y154 V318	F146-Q150 HydrophobicContact CB-CB 4.23Å; F146-Q150 HydrophobicContact CB-CG 4.33Å; F146-Q150 HydrophobicContact CD1-CG 4.41Å; F146-Q150 HydrophobicContact CG-CG 4.35Å; P147-Q150 PolarHBondContact O-N 3.09Å; V148-Q150 VanDerWaalsContact C-N 3.34Å; V148-Q150 PolarHBondContact O-N 3.26Å; Q150-H152 VanDerWaalsContact C-N 3.32Å; Q150-H152 PolarHBondContact O-N 2.88Å; Q150-G153 PolarHBondContact O-N 3.27Å; Q150-Y154 HydrophobicContact CG-CD2 4.13Å; Q150-Y154 HydrophobicContact CG-CE2 3.54Å; Q150-Y154 PolarHBondContact NE2-OH 2.72Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.36Å; Q150-Y154 PolarHBondContact O-N 3.28Å; Q150-Y154 VanDerWaalsContact O-N 3.09Å; Q150-V318 PolarHBondContact NE2-O 3.44Å
151	A	98.4	Very high	98	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.6	-45.3	172.2	0	0	0	0	0	111.8	F146 P147 Y154 F155 I246 T247	F146-A151 HydrophobicContact CB-CB 4.12Å; P147-A151 PolarHBondContact O-N 3.15Å; A151-Y154 PolarHBondContact O-N 3.19Å; A151-F155 WeakPolarHBondContact O-CB 3.47Å; A151-F155 PolarHBondContact O-N 2.62Å; A151-I246 HydrophobicContact CB-CD1 4.07Å; A151-I246 HydrophobicContact CB-CG1 4.04Å; A151-T247 HydrophobicContact CB-CG2 3.69Å
152	H	98.6	Very high	98.1	Very high	27 Å²	27	33.3 Å²	33.3	13%	0.125	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-48	176.1	172.1	-93.6	0	0	0	111.9	V148 Q150 Y154 F155 C156 W306 V307 H311	V148-H152 WeakPolarHBondContact O-CB 3.36Å; V148-H152 PolarHBondContact O-N 3Å; Q150-H152 VanDerWaalsContact C-N 3.32Å; Q150-H152 PolarHBondContact O-N 2.88Å; H152-Y154 PolarHBondContact O-N 2.82Å; H152-F155 PolarHBondContact O-N 2.86Å; H152-C156 PolarHBondContact O-N 2.77Å; H152-C156 PolarHBondContact O-SG 2.79Å; H152-C156 VanDerWaalsContact O-SG 3.41Å; H152-W306 HydrophobicContact CB-CH2 3.74Å; H152-W306 HydrophobicContact CB-CZ2 4.12Å; H152-W306 HydrophobicContact CB-CZ3 4.27Å; H152-W306 AromaticContact CD2-CE3 3.98Å; H152-W306 AromaticContact CD2-CZ3 3.76Å; H152-W306 PolarHBondContact CD2-O 2.96Å; H152-V307 PolarHBondContact NE2-O 2.91Å; H152-H311 AromaticContact CD2-CD2 3.44Å; H152-H311 PolarHBondContact CD2-CD2 3Å; H152-H311 VanDerWaalsContact CD2-CD2 3.44Å; H152-H311 AromaticContact CD2-NE2 3.67Å; H152-H311 AromaticContact CG-CD2 3.45Å; H152-H311 VanDerWaalsContact CG-CD2 3.45Å; H152-H311 AromaticContact ND1-CD2 3.87Å; H152-H311 AromaticContact NE2-CD2 3.84Å
153	G	98.3	Very high	98.2	Very high	29 Å²	29	30.4 Å²	30.4	30%	0.299	15%	0.152	S	C	.	.	H	α-helix	trans	-57.6	-45.4	177.9	0	0	0	0	0	113	F149 Q150 Q157	F149-G153 PolarHBondContact O-N 3.13Å; Q150-G153 PolarHBondContact O-N 3.27Å; G153-Q157 WeakPolarHBondContact O-CG 3.37Å; G153-Q157 PolarHBondContact O-N 3.12Å
154	Y	98.8	Very high	98.4	Very high	27 Å²	27	27 Å²	27	11%	0.106	14%	0.135	C	C	.	.	H	α-helix	trans	-69.4	-40.6	175.5	-63.1	-34.1	0	0	0	112.5	M134 F146 Q150 A151 H152 C156 Q157 L158 L182	M134-Y154 HydrophobicContact CE-CD2 3.94Å; M134-Y154 HydrophobicContact CE-CG 3.97Å; F146-Y154 HydrophobicContact CD2-CD2 4.08Å; F146-Y154 HydrophobicContact CD2-CE2 4.29Å; F146-Y154 HydrophobicContact CE1-CE2 4.48Å; F146-Y154 AromaticContact CE2-CD2 3.99Å; F146-Y154 HydrophobicContact CE2-CD2 3.99Å; F146-Y154 HydrophobicContact CE2-CE2 4.08Å; F146-Y154 HydrophobicContact CZ-CE2 4.19Å; Q150-Y154 HydrophobicContact CG-CD2 4.13Å; Q150-Y154 HydrophobicContact CG-CE2 3.54Å; Q150-Y154 PolarHBondContact NE2-OH 2.72Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.36Å; Q150-Y154 PolarHBondContact O-N 3.28Å; Q150-Y154 VanDerWaalsContact O-N 3.09Å; A151-Y154 PolarHBondContact O-N 3.19Å; H152-Y154 PolarHBondContact O-N 2.82Å; Y154-C156 PolarHBondContact O-N 2.77Å; Y154-Q157 WeakPolarHBondContact O-CB 3.45Å; Y154-Q157 PolarHBondContact O-N 2.87Å; Y154-Q157 VanDerWaalsContact O-N 3.13Å; Y154-L158 PolarHBondContact O-N 3.38Å; Y154-L182 HydrophobicContact CD1-CD2 3.8Å; Y154-L182 HydrophobicContact CE1-CD1 4.19Å; Y154-L182 HydrophobicContact CE1-CD2 3.43Å; Y154-L182 VanDerWaalsContact CE1-CD2 3.43Å; Y154-L182 HydrophobicContact CE1-CG 4.49Å; Y154-L182 HydrophobicContact CE2-CD1 4.25Å
155	F	98.9	Very high	98.4	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-41.8	179.6	-176	-102.7	0	0	0	112.1	A151 H152 Q157 L158 I159 L243 L283 M287 I301 W306 V307	A151-F155 WeakPolarHBondContact O-CB 3.47Å; A151-F155 PolarHBondContact O-N 2.62Å; H152-F155 PolarHBondContact O-N 2.86Å; F155-Q157 VanDerWaalsContact C-N 3.26Å; F155-Q157 PolarHBondContact O-N 3.31Å; F155-L158 HydrophobicContact CD2-CD2 4.32Å; F155-L158 WeakPolarHBondContact O-CB 3.08Å; F155-L158 PolarHBondContact O-N 3.23Å; F155-I159 HydrophobicContact CD1-CG1 4.11Å; F155-I159 HydrophobicContact CE1-CD1 4.14Å; F155-I159 HydrophobicContact CE1-CG1 3.66Å; F155-I159 HydrophobicContact CE2-CD1 4.04Å; F155-I159 HydrophobicContact CE2-CG1 4.19Å; F155-I159 HydrophobicContact CZ-CD1 3.65Å; F155-I159 HydrophobicContact CZ-CG1 3.69Å; F155-I159 WeakPolarHBondContact O-CG1 3.24Å; F155-I159 PolarHBondContact O-N 2.47Å; F155-L243 HydrophobicContact CB-CD1 4.12Å; F155-L243 HydrophobicContact CD1-CD1 4.43Å; F155-L243 HydrophobicContact CD1-CD2 4.29Å; F155-L243 HydrophobicContact CD2-CB 3.83Å; F155-L243 HydrophobicContact CD2-CD1 3.85Å; F155-L243 HydrophobicContact CD2-CD2 4.13Å; F155-L243 HydrophobicContact CD2-CG 4.14Å; F155-L243 HydrophobicContact CE1-CD2 4.02Å; F155-L243 HydrophobicContact CE2-CB 3.74Å; F155-L243 HydrophobicContact CE2-CD1 4.4Å; F155-L243 HydrophobicContact CE2-CD2 3.87Å; F155-L243 HydrophobicContact CE2-CG 4.21Å; F155-L243 HydrophobicContact CG-CD1 3.87Å; F155-L243 HydrophobicContact CG-CD2 4.33Å; F155-L243 HydrophobicContact CZ-CB 4.49Å; F155-L243 HydrophobicContact CZ-CD2 3.8Å; F155-L283 HydrophobicContact CE1-CD2 4.18Å; F155-M287 HydrophobicContact CE2-CE 3.94Å; F155-M287 HydrophobicContact CE2-SD 4.28Å; F155-M287 HydrophobicContact CZ-CE 3.65Å; F155-M287 HydrophobicContact CZ-SD 3.61Å; F155-I301 HydrophobicContact CE1-CG2 3.83Å; F155-I301 HydrophobicContact CZ-CG2 4.08Å; F155-W306 AromaticContact CD1-CZ3 3.86Å; F155-W306 HydrophobicContact CD1-CZ3 3.86Å; F155-W306 HydrophobicContact CG-CZ3 4.41Å; F155-V307 HydrophobicContact CD1-CG2 4.47Å; F155-V307 HydrophobicContact CE1-CG2 4.13Å
156	C	98.8	Very high	98.5	Very high	32 Å²	32	20.5 Å²	20.5	22%	0.216	11%	0.109	C	C	.	.	H	α-helix	trans	-58.7	-39.4	173.3	-73	0	0	0	0	112.2	H152 Y154 N160	H152-C156 PolarHBondContact O-N 2.77Å; H152-C156 PolarHBondContact O-SG 2.79Å; H152-C156 VanDerWaalsContact O-SG 3.41Å; Y154-C156 PolarHBondContact O-N 2.77Å; C156-N160 PolarHBondContact O-N 3.38Å; C156-N160 VanDerWaalsContact O-N 3.08Å; C156-N160 PolarHBondContact O-ND2 3.13Å; C156-N160 VanDerWaalsContact O-ND2 3.12Å
157	Q	98.9	Very high	98.4	Very high	41 Å²	41	24.4 Å²	24.4	19%	0.192	14%	0.136	C	C	.	.	H	α-helix	trans	-68.2	-40.9	176	-70.9	-173.3	71.5	0	0	112.5	N107 G153 Y154 F155 N160 G161 G186 L188	N107-Q157 WeakPolarHBondContact CB-O 3.43Å; N107-Q157 PolarHBondContact ND2-OE1 3.17Å; N107-Q157 PolarHBondContact OD1-O 3.5Å; G153-Q157 WeakPolarHBondContact O-CG 3.37Å; G153-Q157 PolarHBondContact O-N 3.12Å; Y154-Q157 WeakPolarHBondContact O-CB 3.45Å; Y154-Q157 PolarHBondContact O-N 2.87Å; Y154-Q157 VanDerWaalsContact O-N 3.13Å; F155-Q157 VanDerWaalsContact C-N 3.26Å; F155-Q157 PolarHBondContact O-N 3.31Å; Q157-N160 PolarHBondContact O-N 3.26Å; Q157-G161 PolarHBondContact O-N 2.98Å; Q157-G186 PolarHBondContact NE2-O 3.13Å; Q157-L188 HydrophobicContact CB-CB 3.89Å
158	L	98.9	Very high	98.4	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-57.8	-47.9	172.8	172.3	60.5	0	0	0	111.2	Y154 F155 N160 G161 L162 I175 L180 L188 I190 A239 T242	Y154-L158 PolarHBondContact O-N 3.38Å; F155-L158 HydrophobicContact CD2-CD2 4.32Å; F155-L158 WeakPolarHBondContact O-CB 3.08Å; F155-L158 PolarHBondContact O-N 3.23Å; L158-N160 VanDerWaalsContact C-N 3.34Å; L158-N160 PolarHBondContact O-N 3.48Å; L158-G161 PolarHBondContact O-N 3.08Å; L158-G161 VanDerWaalsContact O-N 3.13Å; L158-L162 HydrophobicContact CD1-CD1 4.1Å; L158-L162 HydrophobicContact CD1-CG 4.15Å; L158-L162 HydrophobicContact CG-CD1 4.22Å; L158-L162 PolarHBondContact O-N 3.31Å; L158-I175 HydrophobicContact CD1-CD1 4.32Å; L158-I175 HydrophobicContact CD1-CG2 4.12Å; L158-I175 HydrophobicContact CD2-CG2 4.22Å; L158-L180 HydrophobicContact CD1-CD1 4.29Å; L158-L180 HydrophobicContact CD1-CD2 3.8Å; L158-L180 HydrophobicContact CD2-CD1 4.09Å; L158-L188 HydrophobicContact CB-CD2 4.4Å; L158-I190 HydrophobicContact CD1-CD1 3.88Å; L158-I190 HydrophobicContact CD1-CG1 3.96Å; L158-A239 HydrophobicContact CD2-CB 4.14Å; L158-T242 HydrophobicContact CD2-CG2 4.35Å
159	I	98.9	Very high	98.4	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-38.9	179.1	-63.9	-57.3	0	0	0	111.7	F155 G161 L162 E163 I298 I301 R302	F155-I159 HydrophobicContact CD1-CG1 4.11Å; F155-I159 HydrophobicContact CE1-CD1 4.14Å; F155-I159 HydrophobicContact CE1-CG1 3.66Å; F155-I159 HydrophobicContact CE2-CD1 4.04Å; F155-I159 HydrophobicContact CE2-CG1 4.19Å; F155-I159 HydrophobicContact CZ-CD1 3.65Å; F155-I159 HydrophobicContact CZ-CG1 3.69Å; F155-I159 WeakPolarHBondContact O-CG1 3.24Å; F155-I159 PolarHBondContact O-N 2.47Å; I159-G161 VanDerWaalsContact C-N 3.33Å; I159-G161 PolarHBondContact O-N 3.44Å; I159-L162 PolarHBondContact O-N 3.3Å; I159-E163 VanDerWaalsContact O-CB 3.3Å; I159-E163 WeakPolarHBondContact O-CB 3.25Å; I159-E163 PolarHBondContact O-N 3Å; I159-I298 HydrophobicContact CG2-CG2 4.02Å; I159-I301 HydrophobicContact CD1-CD1 4.28Å; I159-I301 HydrophobicContact CD1-CG2 4.04Å; I159-I301 HydrophobicContact CG1-CG2 3.99Å; I159-I301 HydrophobicContact CG2-CG2 4.47Å; I159-R302 HydrophobicContact CG2-CG 4.07Å
160	N	98.9	Very high	98.4	Very high	35 Å²	35	24.2 Å²	24.2	19%	0.187	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-40.8	173.1	-65	-33.8	0	0	0	111.9	H105 C156 Q157 L158 Y164 R302	H105-N160 PolarHBondContact CE1-O 2.87Å; C156-N160 PolarHBondContact O-N 3.38Å; C156-N160 VanDerWaalsContact O-N 3.08Å; C156-N160 PolarHBondContact O-ND2 3.13Å; C156-N160 VanDerWaalsContact O-ND2 3.12Å; Q157-N160 PolarHBondContact O-N 3.26Å; L158-N160 VanDerWaalsContact C-N 3.34Å; L158-N160 PolarHBondContact O-N 3.48Å; N160-Y164 PolarHBondContact O-N 2.86Å; N160-Y164 VanDerWaalsContact O-N 3.13Å; N160-R302 PolarHBondContact OD1-NH1 2.95Å
161	G	98.9	Very high	98.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.8	-43.4	177.1	0	0	0	0	0	112.8	Q157 L158 I159 Y164 L165	Q157-G161 PolarHBondContact O-N 2.98Å; L158-G161 PolarHBondContact O-N 3.08Å; L158-G161 VanDerWaalsContact O-N 3.13Å; I159-G161 VanDerWaalsContact C-N 3.33Å; I159-G161 PolarHBondContact O-N 3.44Å; G161-Y164 WeakPolarHBondContact O-CB 3.36Å; G161-Y164 PolarHBondContact O-N 3.04Å; G161-L165 WeakPolarHBondContact O-CG 3.46Å; G161-L165 PolarHBondContact O-N 3.18Å
162	L	98.9	Very high	98.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.3	-41.5	175.7	-76.2	177	0	0	0	112.3	L158 I159 Y164 L165 H166 I175 I190 D235 A239 I298	L158-L162 HydrophobicContact CD1-CD1 4.1Å; L158-L162 HydrophobicContact CD1-CG 4.15Å; L158-L162 HydrophobicContact CG-CD1 4.22Å; L158-L162 PolarHBondContact O-N 3.31Å; I159-L162 PolarHBondContact O-N 3.3Å; L162-Y164 VanDerWaalsContact C-N 3.27Å; L162-Y164 PolarHBondContact O-N 3Å; L162-L165 PolarHBondContact O-N 3.43Å; L162-H166 WeakPolarHBondContact O-CB 3.29Å; L162-H166 PolarHBondContact O-CD2 2.89Å; L162-H166 VanDerWaalsContact O-CG 3.24Å; L162-H166 PolarHBondContact O-N 2.9Å; L162-I175 HydrophobicContact CD2-CD1 3.79Å; L162-I175 HydrophobicContact CD2-CG1 3.96Å; L162-I190 HydrophobicContact CD2-CD1 4.42Å; L162-I190 HydrophobicContact CG-CD1 4.25Å; L162-D235 HydrophobicContact CD2-CB 4.08Å; L162-A239 HydrophobicContact CD1-CB 3.93Å; L162-I298 HydrophobicContact CB-CD1 4.16Å
163	E	98.8	Very high	98.3	Very high	57 Å²	57	22.1 Å²	22.1	27%	0.266	13%	0.127	S	C	.	.	H	α-helix	trans	-57.4	-43.8	175.3	-173.9	166.9	-140.9	0	0	111.1	I159 S167 I298 Q299 R302	I159-E163 VanDerWaalsContact O-CB 3.3Å; I159-E163 WeakPolarHBondContact O-CB 3.25Å; I159-E163 PolarHBondContact O-N 3Å; E163-S167 WeakPolarHBondContact O-CB 3.46Å; E163-S167 PolarHBondContact O-N 3.39Å; E163-I298 VanDerWaalsContact CA-CD1 3.46Å; E163-I298 HydrophobicContact CB-CD1 3.97Å; E163-I298 HydrophobicContact CB-CG2 3.98Å; E163-I298 HydrophobicContact CG-CG2 4.04Å; E163-Q299 PolarHBondContact OE1-NE2 2.9Å; E163-R302 IonicContact OE2-CZ 2.57Å; E163-R302 IonicContact OE2-NE 2.79Å; E163-R302 IonicContact OE2-NH1 2.8Å; E163-R302 PolarHBondContact OE2-NH1 2.83Å
164	Y	98.8	Very high	98.3	Very high	39 Å²	39	21.3 Å²	21.3	15%	0.153	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-51.6	173.6	173.3	-101.9	0	0	0	112.2	L103 Q104 H105 V108 N160 G161 L162 H166 S167 Q168	L103-Y164 WeakPolarHBondContact CA-OH 3.23Å; L103-Y164 HydrophobicContact CB-CE1 4.27Å; L103-Y164 HydrophobicContact CD2-CE1 3.58Å; Q104-Y164 PolarHBondContact N-OH 2.98Å; Q104-Y164 PolarHBondContact O-OH 3.28Å; H105-Y164 HydrophobicContact CB-CD1 3.33Å; H105-Y164 HydrophobicContact CB-CD2 4.01Å; H105-Y164 HydrophobicContact CB-CE1 3.52Å; H105-Y164 HydrophobicContact CB-CE2 4.2Å; H105-Y164 HydrophobicContact CB-CG 3.58Å; H105-Y164 AromaticContact CD2-CG 3.85Å; H105-Y164 AromaticContact CG-CD1 3.82Å; H105-Y164 AromaticContact CG-CG 3.63Å; V108-Y164 HydrophobicContact CG2-CD1 3.93Å; V108-Y164 HydrophobicContact CG2-CE1 4.42Å; N160-Y164 PolarHBondContact O-N 2.86Å; N160-Y164 VanDerWaalsContact O-N 3.13Å; G161-Y164 WeakPolarHBondContact O-CB 3.36Å; G161-Y164 PolarHBondContact O-N 3.04Å; L162-Y164 VanDerWaalsContact C-N 3.27Å; L162-Y164 PolarHBondContact O-N 3Å; Y164-H166 VanDerWaalsContact C-N 3.33Å; Y164-H166 PolarHBondContact O-N 2.87Å; Y164-S167 WeakPolarHBondContact O-CB 3.46Å; Y164-S167 PolarHBondContact O-N 2.81Å; Y164-S167 VanDerWaalsContact O-N 3.15Å; Y164-S167 PolarHBondContact O-OG 2.76Å; Y164-Q168 HydrophobicContact CD2-CG 4.42Å; Y164-Q168 HydrophobicContact CE1-CG 4.21Å; Y164-Q168 HydrophobicContact CE2-CG 3.95Å; Y164-Q168 WeakPolarHBondContact O-CG 3.26Å; Y164-Q168 PolarHBondContact O-N 3.15Å; Y164-Q168 VanDerWaalsContact O-N 3.14Å
165	L	98.7	Very high	98.3	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58	-45.7	180	-70.1	176.9	0	0	0	111.9	L103 V108 G161 L162 S167 Q168 G169 I170 H172 I190 L193	L103-L165 HydrophobicContact CD1-CD2 3.85Å; L103-L165 HydrophobicContact CD2-CD2 4.11Å; V108-L165 HydrophobicContact CG1-CD2 4.29Å; V108-L165 HydrophobicContact CG2-CD1 4.43Å; V108-L165 HydrophobicContact CG2-CD2 3.99Å; V108-L165 HydrophobicContact CG2-CG 4.03Å; G161-L165 WeakPolarHBondContact O-CG 3.46Å; G161-L165 PolarHBondContact O-N 3.18Å; L162-L165 PolarHBondContact O-N 3.43Å; L165-S167 VanDerWaalsContact C-N 3.31Å; L165-S167 PolarHBondContact O-N 3.4Å; L165-Q168 CarbonylContact O-C 3.59Å; L165-Q168 WeakPolarHBondContact O-CA 3.41Å; L165-Q168 PolarHBondContact O-N 3.36Å; L165-G169 PolarHBondContact O-N 2.79Å; L165-I170 CarbonylContact C-O 3.58Å; L165-I170 HydrophobicContact CB-CB 4.39Å; L165-I170 HydrophobicContact CD2-CB 4.49Å; L165-I170 HydrophobicContact CD2-CG2 4.36Å; L165-I170 PolarHBondContact O-N 2.87Å; L165-H172 HydrophobicContact CD1-CB 4.42Å; L165-I190 HydrophobicContact CD1-CD1 4.22Å; L165-I190 HydrophobicContact CD1-CG2 4.2Å; L165-L193 HydrophobicContact CD2-CD2 4.46Å
166	H	98.3	Very high	98.3	Very high	20 Å²	20	22 Å²	22	9%	0.093	12%	0.12	C	C	.	.	H	α-helix	trans	-62.6	-39.1	178	-67.2	-176.2	0	0	0	111.3	L162 Y164 Q168 G169 I170 F232 D235 I298	L162-H166 WeakPolarHBondContact O-CB 3.29Å; L162-H166 PolarHBondContact O-CD2 2.89Å; L162-H166 VanDerWaalsContact O-CG 3.24Å; L162-H166 PolarHBondContact O-N 2.9Å; Y164-H166 VanDerWaalsContact C-N 3.33Å; Y164-H166 PolarHBondContact O-N 2.87Å; H166-Q168 PolarHBondContact O-N 3.21Å; H166-G169 PolarHBondContact O-N 3.03Å; H166-I170 PolarHBondContact CD2-O 3.29Å; H166-F232 HydrophobicContact CB-CD1 3.83Å; H166-F232 HydrophobicContact CB-CE1 3.67Å; H166-F232 HydrophobicContact CB-CG 4.35Å; H166-F232 HydrophobicContact CB-CZ 4.04Å; H166-F232 AromaticContact CD2-CD1 3.41Å; H166-F232 VanDerWaalsContact CD2-CD1 3.41Å; H166-F232 WeakPolarHBondContact CD2-CD1 3.39Å; H166-F232 AromaticContact CD2-CE1 3.79Å; H166-F232 AromaticContact CE1-CD1 3.77Å; H166-F232 AromaticContact CG-CD1 3.34Å; H166-F232 AromaticContact CG-CE1 3.69Å; H166-F232 AromaticContact CG-CG 3.9Å; H166-F232 AromaticContact ND1-CD1 3.6Å; H166-F232 AromaticContact ND1-CG 3.71Å; H166-F232 AromaticContact NE2-CD1 3.67Å; H166-D235 IonicContact CD2-OD2 2.74Å; H166-D235 IonicContact CE1-OD2 3.31Å; H166-D235 IonicContact NE2-OD2 3.4Å; H166-D235 PolarHBondContact NE2-OD2 2.84Å; H166-I298 WeakPolarHBondContact ND1-CD1 3.45Å
167	S	97.3	Very high	98.3	Very high	82 Å²	82	20.5 Å²	20.5	57%	0.573	11%	0.109	S	C	*	.	H	α-helix	trans	-63.5	-23.7	173.8	81.6	0	0	0	0	114	E163 Y164 L165 G169	E163-S167 WeakPolarHBondContact O-CB 3.46Å; E163-S167 PolarHBondContact O-N 3.39Å; Y164-S167 WeakPolarHBondContact O-CB 3.46Å; Y164-S167 PolarHBondContact O-N 2.81Å; Y164-S167 VanDerWaalsContact O-N 3.15Å; Y164-S167 PolarHBondContact O-OG 2.76Å; L165-S167 VanDerWaalsContact C-N 3.31Å; L165-S167 PolarHBondContact O-N 3.4Å; S167-G169 VanDerWaalsContact C-N 3.31Å
168	Q	97.3	Very high	98.1	Very high	75 Å²	75	20.2 Å²	20.2	35%	0.35	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	7.6	176.3	-61.5	-55.7	-61.4	0	0	112.8	R102 L103 Y164 L165 H166 I170	R102-Q168 PolarHBondContact NH1-O 2.83Å; L103-Q168 HydrophobicContact CD2-CB 4.16Å; L103-Q168 HydrophobicContact CD2-CG 4.01Å; Y164-Q168 HydrophobicContact CD2-CG 4.42Å; Y164-Q168 HydrophobicContact CE1-CG 4.21Å; Y164-Q168 HydrophobicContact CE2-CG 3.95Å; Y164-Q168 WeakPolarHBondContact O-CG 3.26Å; Y164-Q168 PolarHBondContact O-N 3.15Å; Y164-Q168 VanDerWaalsContact O-N 3.14Å; L165-Q168 CarbonylContact O-C 3.59Å; L165-Q168 WeakPolarHBondContact O-CA 3.41Å; L165-Q168 PolarHBondContact O-N 3.36Å; H166-Q168 PolarHBondContact O-N 3.21Å; Q168-I170 VanDerWaalsContact C-N 3.34Å; Q168-I170 HydrophobicContact CB-CD1 4.28Å; Q168-I170 HydrophobicContact CB-CG1 4.27Å
169	G	96.9	Very high	98.1	Very high	18 Å²	18	20.7 Å²	20.7	19%	0.186	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	34.2	-175.4	0	0	0	0	0	112.5	L165 H166 S167 A198 L199	L165-G169 PolarHBondContact O-N 2.79Å; H166-G169 PolarHBondContact O-N 3.03Å; S167-G169 VanDerWaalsContact C-N 3.31Å; G169-A198 CarbonylContact O-C 3.56Å; G169-A198 WeakPolarHBondContact O-CA 3Å; G169-L199 WeakPolarHBondContact O-CB 3.45Å; G169-L199 PolarHBondContact O-N 2.84Å
170	I	97.8	Very high	98.1	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.3	-179.1	-59.2	179.5	0	0	0	109.8	L99 L103 L165 H166 Q168 L193 A196 E197	L99-I170 HydrophobicContact CD2-CD1 3.66Å; L99-I170 HydrophobicContact CD2-CG1 4.08Å; L103-I170 HydrophobicContact CD1-CD1 3.73Å; L103-I170 HydrophobicContact CD2-CD1 3.58Å; L103-I170 HydrophobicContact CG-CD1 4.02Å; L165-I170 CarbonylContact C-O 3.58Å; L165-I170 HydrophobicContact CB-CB 4.39Å; L165-I170 HydrophobicContact CD2-CB 4.49Å; L165-I170 HydrophobicContact CD2-CG2 4.36Å; L165-I170 PolarHBondContact O-N 2.87Å; H166-I170 PolarHBondContact CD2-O 3.29Å; Q168-I170 VanDerWaalsContact C-N 3.34Å; Q168-I170 HydrophobicContact CB-CD1 4.28Å; Q168-I170 HydrophobicContact CB-CG1 4.27Å; I170-L193 HydrophobicContact CG2-CD2 4.11Å; I170-A196 HydrophobicContact CG2-CB 4.24Å; I170-E197 WeakPolarHBondContact CA-O 3.49Å
171	V	98.2	Very high	98	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.6	171.9	-174.1	0	0	0	0	108.3	K173 A196 E197 L199 G231 F232	V171-K173 HydrophobicContact CB-CG 4.43Å; V171-K173 HydrophobicContact CG1-CG 3.73Å; V171-A196 CarbonylContact O-C 3.58Å; V171-A196 VanDerWaalsContact O-CA 3.24Å; V171-A196 WeakPolarHBondContact O-CA 3.39Å; V171-A196 WeakPolarHBondContact O-CB 3.44Å; V171-E197 PolarHBondContact N-O 3.25Å; V171-E197 PolarHBondContact O-N 2.97Å; V171-L199 HydrophobicContact CG2-CD1 4.19Å; V171-L199 HydrophobicContact CG2-CD2 4.27Å; V171-L199 HydrophobicContact CG2-CG 4.2Å; V171-G231 VanDerWaalsContact CG1-C 3.49Å; V171-G231 WeakPolarHBondContact CG1-O 3.43Å; V171-F232 HydrophobicContact CG2-CD1 3.92Å; V171-F232 HydrophobicContact CG2-CE1 3.96Å
172	H	98.1	Very high	98	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.			trans	-76.3	-41.3	-172.2	-172.1	-79	0	0	0	113.1	L165 D174 I175 I190 S191 D192 D235	L165-H172 HydrophobicContact CD1-CB 4.42Å; H172-D174 PolarHBondContact CE1-O 2.82Å; H172-D174 VanDerWaalsContact ND1-C 3.32Å; H172-D174 PolarHBondContact ND1-N 3.28Å; H172-D174 PolarHBondContact O-N 2.79Å; H172-I175 HydrophobicContact CB-CD1 3.85Å; H172-I175 HydrophobicContact CB-CG1 4.02Å; H172-I175 VanDerWaalsContact CG-CD1 3.48Å; H172-I175 WeakPolarHBondContact ND1-CD1 3.41Å; H172-I175 PolarHBondContact ND1-N 3.31Å; H172-I190 VanDerWaalsContact CD2-CG2 3.45Å; H172-I190 WeakPolarHBondContact CD2-CG2 3.37Å; H172-I190 WeakPolarHBondContact NE2-CG2 3.46Å; H172-S191 PolarHBondContact NE2-O 3.07Å; H172-D192 PolarHBondContact CE1-O 3.49Å; H172-D192 PolarHBondContact NE2-O 2.57Å; H172-D235 PolarHBondContact N-OD1 3.33Å; H172-D235 PolarHBondContact N-OD2 3.47Å
173	K	97.1	Very high	97.8	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	13%	0.125	C	C	.	.	S	Bend	trans	65.3	-14.3	178.8	-57.5	-167.3	176.1	-170	0	118.1	V171 V195 E197 T210 Q218 D235	V171-K173 HydrophobicContact CB-CG 4.43Å; V171-K173 HydrophobicContact CG1-CG 3.73Å; K173-V195 HydrophobicContact CB-CG2 4.42Å; K173-E197 IonicContact NZ-OE2 3.46Å; K173-E197 PolarHBondContact NZ-OE2 2.71Å; K173-T210 PolarHBondContact NZ-O 2.82Å; K173-T210 PolarHBondContact NZ-OG1 3.45Å; K173-Q218 PolarHBondContact O-NE2 3.14Å; K173-D235 PolarHBondContact N-OD1 2.63Å
174	D	97.3	Very high	97.4	Very high	13 Å²	13	24 Å²	24	7%	0.07	14%	0.143	C	C	.	.			trans	-128.6	46.3	177.5	-158.7	36.3	0	0	0	113.4	H172 K176 N179 V195 S214	H172-D174 PolarHBondContact CE1-O 2.82Å; H172-D174 VanDerWaalsContact ND1-C 3.32Å; H172-D174 PolarHBondContact ND1-N 3.28Å; H172-D174 PolarHBondContact O-N 2.79Å; D174-K176 PolarHBondContact O-N 3.45Å; D174-K176 IonicContact OD1-NZ 3.73Å; D174-K176 PolarHBondContact OD1-NZ 3.06Å; D174-K176 IonicContact OD2-NZ 2.68Å; D174-K176 PolarHBondContact OD2-NZ 3.06Å; D174-N179 PolarHBondContact O-ND2 2.76Å; D174-N179 PolarHBondContact OD2-ND2 2.92Å; D174-V195 HydrophobicContact CB-CG2 3.71Å; D174-S214 VanDerWaalsContact OD1-CB 3.29Å; D174-S214 WeakPolarHBondContact OD1-CB 3.22Å; D174-S214 PolarHBondContact OD1-N 3.31Å; D174-S214 PolarHBondContact OD1-OG 3.32Å
175	I	98.8	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.166	C	C	.	.			trans	-72.5	119.8	174.1	-62.1	-65	0	0	0	109.9	L158 L162 H172 I190 F217 S238 A239	L158-I175 HydrophobicContact CD1-CD1 4.32Å; L158-I175 HydrophobicContact CD1-CG2 4.12Å; L158-I175 HydrophobicContact CD2-CG2 4.22Å; L162-I175 HydrophobicContact CD2-CD1 3.79Å; L162-I175 HydrophobicContact CD2-CG1 3.96Å; H172-I175 HydrophobicContact CB-CD1 3.85Å; H172-I175 HydrophobicContact CB-CG1 4.02Å; H172-I175 VanDerWaalsContact CG-CD1 3.48Å; H172-I175 WeakPolarHBondContact ND1-CD1 3.41Å; H172-I175 PolarHBondContact ND1-N 3.31Å; I175-I190 HydrophobicContact CD1-CG2 3.94Å; I175-F217 WeakPolarHBondContact O-CD1 3.3Å; I175-S238 WeakPolarHBondContact O-CB 3.33Å; I175-A239 HydrophobicContact CG2-CB 4.41Å
176	K	98.4	Very high	96.7	Very high	43 Å²	43	29 Å²	29	19%	0.187	18%	0.18	C	C	.	.	S	Bend	trans	-164.2	159.6	178.3	67.5	-162	-171.7	-154	0	109.9	D174 G178 N179 L180 S214 F217	D174-K176 PolarHBondContact O-N 3.45Å; D174-K176 IonicContact OD1-NZ 3.73Å; D174-K176 PolarHBondContact OD1-NZ 3.06Å; D174-K176 IonicContact OD2-NZ 2.68Å; D174-K176 PolarHBondContact OD2-NZ 3.06Å; K176-G178 PolarHBondContact O-N 3.1Å; K176-N179 WeakPolarHBondContact CE-ND2 3.36Å; K176-N179 WeakPolarHBondContact CE-OD1 3.39Å; K176-N179 HydrophobicContact CG-CB 4.24Å; K176-N179 PolarHBondContact O-N 3.49Å; K176-L180 WeakPolarHBondContact O-CG 3.23Å; K176-L180 PolarHBondContact O-N 3.26Å; K176-S214 WeakPolarHBondContact CD-OG 3.48Å; K176-S214 WeakPolarHBondContact CE-OG 3.19Å; K176-S214 PolarHBondContact NZ-OG 3.44Å; K176-F217 HydrophobicContact CB-CD1 3.81Å; K176-F217 HydrophobicContact CB-CD2 3.88Å; K176-F217 HydrophobicContact CB-CE1 3.6Å; K176-F217 HydrophobicContact CB-CE2 3.68Å; K176-F217 HydrophobicContact CB-CG 3.95Å; K176-F217 HydrophobicContact CB-CZ 3.53Å
177	P	98.4	Very high	96.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-52.6	-31.5	177.8	-26.1	33.1	0	0	0	114.5	M134 Q135 L138 N179 L180 T242 I246	M134-P177 HydrophobicContact CB-CB 4.42Å; M134-P177 WeakPolarHBondContact CB-O 3.46Å; M134-P177 HydrophobicContact CG-CB 4.2Å; M134-P177 HydrophobicContact SD-CB 4.24Å; Q135-P177 HydrophobicContact CB-CB 4.26Å; Q135-P177 PolarHBondContact N-O 3.42Å; L138-P177 HydrophobicContact CD1-CB 3.75Å; L138-P177 HydrophobicContact CD1-CG 3.98Å; P177-N179 VanDerWaalsContact C-N 3.25Å; P177-N179 PolarHBondContact O-N 3.47Å; P177-L180 PolarHBondContact O-N 2.67Å; P177-T242 HydrophobicContact CG-CG2 4.15Å; P177-I246 HydrophobicContact CG-CG2 4.17Å
178	G	96.3	Very high	96.7	Very high	35 Å²	35	25.7 Å²	25.7	36%	0.361	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-65.3	-22.7	177.1	0	0	0	0	0	115.2	K176	K176-G178 PolarHBondContact O-N 3.1Å
179	N	97.8	Very high	96.8	Very high	13 Å²	13	23 Å²	23	7%	0.07	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-106.5	6.2	179.6	-68.5	-4.5	0	0	0	112.3	D174 K176 P177 S191	D174-N179 PolarHBondContact O-ND2 2.76Å; D174-N179 PolarHBondContact OD2-ND2 2.92Å; K176-N179 WeakPolarHBondContact CE-ND2 3.36Å; K176-N179 WeakPolarHBondContact CE-OD1 3.39Å; K176-N179 HydrophobicContact CG-CB 4.24Å; K176-N179 PolarHBondContact O-N 3.49Å; P177-N179 VanDerWaalsContact C-N 3.25Å; P177-N179 PolarHBondContact O-N 3.47Å; N179-S191 PolarHBondContact O-N 3.38Å; N179-S191 PolarHBondContact O-OG 3.36Å
180	L	98.6	Very high	96.9	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.2	174.7	-56.3	-179.4	0	0	0	108.6	M134 L158 K176 P177 L188 I190 T242	M134-L180 HydrophobicContact CB-CB 4.12Å; M134-L180 VanDerWaalsContact CB-O 3.28Å; M134-L180 WeakPolarHBondContact CB-O 3.46Å; M134-L180 HydrophobicContact CE-CB 4.1Å; M134-L180 HydrophobicContact CE-CD1 4.05Å; M134-L180 PolarHBondContact N-O 3.12Å; M134-L180 HydrophobicContact SD-CB 4.29Å; M134-L180 HydrophobicContact SD-CD1 3.95Å; L158-L180 HydrophobicContact CD1-CD1 4.29Å; L158-L180 HydrophobicContact CD1-CD2 3.8Å; L158-L180 HydrophobicContact CD2-CD1 4.09Å; K176-L180 WeakPolarHBondContact O-CG 3.23Å; K176-L180 PolarHBondContact O-N 3.26Å; P177-L180 PolarHBondContact O-N 2.67Å; L180-L188 HydrophobicContact CB-CD1 4.28Å; L180-L188 HydrophobicContact CB-CG 4.49Å; L180-L188 HydrophobicContact CD1-CD1 4.3Å; L180-L188 HydrophobicContact CD2-CD2 4.33Å; L180-I190 HydrophobicContact CD2-CG1 4Å; L180-T242 HydrophobicContact CD1-CG2 3.93Å
181	L	98.2	Very high	96.8	Very high	43 Å²	43	22.9 Å²	22.9	23%	0.225	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	160	-179.3	-52.5	-179.4	0	0	0	110.3	I109 C130 L188 K189 S191	I109-L181 HydrophobicContact CD1-CD1 4.34Å; C130-L181 HydrophobicContact CB-CB 3.64Å; C130-L181 HydrophobicContact CB-CD1 4.08Å; C130-L181 HydrophobicContact CB-CG 4.44Å; L181-L188 CarbonylContact O-C 3.48Å; L181-L188 WeakPolarHBondContact O-CA 3.47Å; L181-K189 HydrophobicContact CB-CB 4.37Å; L181-K189 PolarHBondContact N-O 2.86Å; L181-K189 PolarHBondContact O-N 3.4Å; L181-S191 WeakPolarHBondContact CG-OG 3.48Å
182	L	97.6	Very high	96.6	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.1	176.7	-68.5	165.8	0	0	0	110	C130 V131 C132 M137 Y154 S187 L188	C130-L182 CarbonylContact C-O 3.54Å; C130-L182 WeakPolarHBondContact CA-O 3.45Å; C130-L182 VanDerWaalsContact CB-O 3.29Å; C130-L182 WeakPolarHBondContact CB-O 3.44Å; V131-L182 WeakPolarHBondContact CG1-O 3.37Å; V131-L182 PolarHBondContact N-O 3.29Å; C132-L182 PolarHBondContact N-O 3.31Å; C132-L182 PolarHBondContact O-N 2.73Å; M137-L182 HydrophobicContact SD-CD1 3.19Å; M137-L182 WeakPolarHBondContact SD-CD1 3.29Å; Y154-L182 HydrophobicContact CD1-CD2 3.8Å; Y154-L182 HydrophobicContact CE1-CD1 4.19Å; Y154-L182 HydrophobicContact CE1-CD2 3.43Å; Y154-L182 VanDerWaalsContact CE1-CD2 3.43Å; Y154-L182 HydrophobicContact CE1-CG 4.49Å; Y154-L182 HydrophobicContact CE2-CD1 4.25Å; L182-S187 WeakPolarHBondContact CA-O 3.12Å; L182-L188 HydrophobicContact CD2-CB 4.04Å
183	T	95.3	Very high	96.4	Very high	13 Å²	13	25.4 Å²	25.4	8%	0.08	16%	0.155	C	C	.	.			trans	-86.3	170.7	170.3	49.9	0	0	0	0	110.7	D185 G186 S187 K189	T183-D185 VanDerWaalsContact CB-OD1 3.22Å; T183-D185 WeakPolarHBondContact CB-OD1 3.35Å; T183-D185 PolarHBondContact O-N 3.31Å; T183-D185 PolarHBondContact OG1-OD1 2.84Å; T183-G186 PolarHBondContact O-N 2.72Å; T183-S187 PolarHBondContact N-O 2.82Å; T183-S187 WeakPolarHBondContact OG1-CA 3.39Å; T183-S187 VanDerWaalsContact OG1-CB 3.23Å; T183-S187 WeakPolarHBondContact OG1-CB 3.29Å; T183-S187 PolarHBondContact OG1-N 2.98Å; T183-S187 PolarHBondContact OG1-O 2.79Å; T183-K189 HydrophobicContact CG2-CG 4.01Å
184	T	89.6	Confident	96.1	Very high	106 Å²	106	25.7 Å²	25.7	65%	0.65	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.7	-177.4	47.9	0	0	0	0	113.8	V131 G186	V131-T184 HydrophobicContact CB-CG2 3.94Å; V131-T184 HydrophobicContact CG1-CG2 4.46Å; V131-T184 HydrophobicContact CG2-CG2 4.19Å; T184-G186 VanDerWaalsContact C-N 3.3Å
185	D	90.6	Very high	95.8	Very high	117 Å²	117	26.5 Å²	26.5	63%	0.626	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	2.2	175.3	69.6	-32.8	0	0	0	113.4	T183 S187	T183-D185 VanDerWaalsContact CB-OD1 3.22Å; T183-D185 WeakPolarHBondContact CB-OD1 3.35Å; T183-D185 PolarHBondContact O-N 3.31Å; T183-D185 PolarHBondContact OG1-OD1 2.84Å; D185-S187 PolarHBondContact OD1-N 2.8Å; D185-S187 PolarHBondContact OD1-OG 2.7Å; D185-S187 PolarHBondContact OD2-OG 3.02Å
186	G	92.4	Very high	95.6	Very high	28 Å²	28	27.4 Å²	27.4	29%	0.289	17%	0.172	S	C	.	.	S	Bend	trans	81.4	13.4	180	0	0	0	0	0	114.7	Q157 T183 T184	Q157-G186 PolarHBondContact NE2-O 3.13Å; T183-G186 PolarHBondContact O-N 2.72Å; T184-G186 VanDerWaalsContact C-N 3.3Å
187	S	97.4	Very high	95.4	Very high	32 Å²	32	27.5 Å²	27.5	22%	0.224	17%	0.173	C	C	.	.			trans	-75.3	133.1	172.2	-62.5	0	0	0	0	110.9	L182 T183 D185	L182-S187 WeakPolarHBondContact CA-O 3.12Å; T183-S187 PolarHBondContact N-O 2.82Å; T183-S187 WeakPolarHBondContact OG1-CA 3.39Å; T183-S187 VanDerWaalsContact OG1-CB 3.23Å; T183-S187 WeakPolarHBondContact OG1-CB 3.29Å; T183-S187 PolarHBondContact OG1-N 2.98Å; T183-S187 PolarHBondContact OG1-O 2.79Å; D185-S187 PolarHBondContact OD1-N 2.8Å; D185-S187 PolarHBondContact OD1-OG 2.7Å; D185-S187 PolarHBondContact OD2-OG 3.02Å
188	L	98.7	Very high	95.3	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.6	176.6	178.1	151.6	0	0	0	110.8	N107 M134 Q157 L158 L180 L181 L182 I190	N107-L188 WeakPolarHBondContact CA-O 3.42Å; N107-L188 WeakPolarHBondContact CB-O 3.48Å; N107-L188 PolarHBondContact ND2-O 3.16Å; M134-L188 HydrophobicContact CE-CD1 3.44Å; M134-L188 VanDerWaalsContact CE-CD1 3.44Å; Q157-L188 HydrophobicContact CB-CB 3.89Å; L158-L188 HydrophobicContact CB-CD2 4.4Å; L180-L188 HydrophobicContact CB-CD1 4.28Å; L180-L188 HydrophobicContact CB-CG 4.49Å; L180-L188 HydrophobicContact CD1-CD1 4.3Å; L180-L188 HydrophobicContact CD2-CD2 4.33Å; L181-L188 CarbonylContact O-C 3.48Å; L181-L188 WeakPolarHBondContact O-CA 3.47Å; L182-L188 HydrophobicContact CD2-CB 4.04Å; L188-I190 HydrophobicContact CD2-CG1 4.19Å
189	K	98.8	Very high	95.2	Very high	20 Å²	20	29.6 Å²	29.6	9%	0.087	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.3	176.1	-59.9	-66.1	-175.8	149.3	0	110.4	K106 I109 E128 L181 T183	K106-K189 VanDerWaalsContact O-CD 3.28Å; K106-K189 WeakPolarHBondContact O-CD 3.29Å; K106-K189 WeakPolarHBondContact O-CE 3.5Å; K106-K189 PolarHBondContact O-NZ 3.19Å; K106-K189 VanDerWaalsContact O-NZ 3.1Å; I109-K189 HydrophobicContact CD1-CB 4.22Å; I109-K189 HydrophobicContact CD1-CG 4.49Å; E128-K189 WeakPolarHBondContact OE1-CD 3.16Å; E128-K189 VanDerWaalsContact OE1-CE 3.3Å; E128-K189 WeakPolarHBondContact OE1-CE 3.48Å; E128-K189 IonicContact OE1-NZ 2.67Å; E128-K189 PolarHBondContact OE1-NZ 3.18Å; E128-K189 WeakPolarHBondContact OE2-CE 3.45Å; E128-K189 IonicContact OE2-NZ 2.78Å; E128-K189 PolarHBondContact OE2-NZ 2.89Å; L181-K189 HydrophobicContact CB-CB 4.37Å; L181-K189 PolarHBondContact N-O 2.86Å; L181-K189 PolarHBondContact O-N 3.4Å; T183-K189 HydrophobicContact CG2-CG 4.01Å
190	I	98.8	Very high	94.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.1	166.7	-59.4	170.1	0	0	0	107.9	N107 I109 L158 L162 L165 H172 I175 L180 L188	N107-I190 WeakPolarHBondContact O-CG1 3.19Å; N107-I190 PolarHBondContact O-N 3.05Å; I109-I190 WeakPolarHBondContact CB-O 3.49Å; I109-I190 WeakPolarHBondContact CG2-O 3.47Å; I109-I190 PolarHBondContact N-O 3.46Å; L158-I190 HydrophobicContact CD1-CD1 3.88Å; L158-I190 HydrophobicContact CD1-CG1 3.96Å; L162-I190 HydrophobicContact CD2-CD1 4.42Å; L162-I190 HydrophobicContact CG-CD1 4.25Å; L165-I190 HydrophobicContact CD1-CD1 4.22Å; L165-I190 HydrophobicContact CD1-CG2 4.2Å; H172-I190 VanDerWaalsContact CD2-CG2 3.45Å; H172-I190 WeakPolarHBondContact CD2-CG2 3.37Å; H172-I190 WeakPolarHBondContact NE2-CG2 3.46Å; I175-I190 HydrophobicContact CD1-CG2 3.94Å; L180-I190 HydrophobicContact CD2-CG1 4Å; L188-I190 HydrophobicContact CD2-CG1 4.19Å
191	S	96.9	Very high	94.4	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.091	24%	0.243	C	C	.	.			trans	-131.9	170.9	-175.8	72.1	0	0	0	0	112.1	H172 N179 L181	H172-S191 PolarHBondContact NE2-O 3.07Å; N179-S191 PolarHBondContact O-N 3.38Å; N179-S191 PolarHBondContact O-OG 3.36Å; L181-S191 WeakPolarHBondContact CG-OG 3.48Å
192	D	93	Very high	94.1	Very high	49 Å²	49	47 Å²	47	26%	0.262	27%	0.27	S	S	.	.			trans	61.6	74.9	179	-158.5	7.7	0	0	0	114.6	K76 H172 G194	K76-D192 IonicContact NZ-OD1 3.61Å; H172-D192 PolarHBondContact CE1-O 3.49Å; H172-D192 PolarHBondContact NE2-O 2.57Å; D192-G194 PolarHBondContact O-N 3.47Å; D192-G194 PolarHBondContact OD1-N 3.42Å
193	L	94.1	Very high	93.7	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.021	29%	0.288	C	S	.	.			trans	-83.5	19.1	174.1	-68.5	142.5	0	0	0	112.3	E96 L100 L103 L165 I170 V195 A196	E96-L193 HydrophobicContact CG-CB 4.15Å; L100-L193 HydrophobicContact CD2-CD1 3.39Å; L100-L193 HydrophobicContact CG-CD1 3.73Å; L103-L193 HydrophobicContact CD1-CD1 3.97Å; L165-L193 HydrophobicContact CD2-CD2 4.46Å; I170-L193 HydrophobicContact CG2-CD2 4.11Å; L193-V195 PolarHBondContact O-N 3.32Å; L193-V195 VanDerWaalsContact O-N 3.15Å; L193-A196 HydrophobicContact CB-CB 3.94Å; L193-A196 HydrophobicContact CD2-CB 3.7Å; L193-A196 HydrophobicContact CG-CB 4.42Å; L193-A196 WeakPolarHBondContact O-CB 3.39Å; L193-A196 PolarHBondContact O-N 3.05Å; L193-A196 VanDerWaalsContact O-N 3.09Å
194	G	90.6	Very high	93.4	Very high	8 Å²	8	58 Å²	58	8%	0.082	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.2	-172.9	0	0	0	0	0	115.2	D192	D192-G194 PolarHBondContact O-N 3.47Å; D192-G194 PolarHBondContact OD1-N 3.42Å
195	V	92	Very high	93.6	Very high	29 Å²	29	57.4 Å²	57.4	18%	0.176	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	9.4	174.5	-59.4	0	0	0	0	112.8	K173 D174 L193 Q212	K173-V195 HydrophobicContact CB-CG2 4.42Å; D174-V195 HydrophobicContact CB-CG2 3.71Å; L193-V195 PolarHBondContact O-N 3.32Å; L193-V195 VanDerWaalsContact O-N 3.15Å; V195-Q212 HydrophobicContact CB-CB 3.96Å; V195-Q212 HydrophobicContact CG1-CB 4.02Å
196	A	94.8	Very high	93.9	Very high	20 Å²	20	53.1 Å²	53.1	17%	0.165	30%	0.298	C	S	.	.			trans	-67.2	148.1	-179.7	0	0	0	0	0	111.1	L99 I170 V171 L193	L99-A196 HydrophobicContact CD1-CB 4.08Å; I170-A196 HydrophobicContact CG2-CB 4.24Å; V171-A196 CarbonylContact O-C 3.58Å; V171-A196 VanDerWaalsContact O-CA 3.24Å; V171-A196 WeakPolarHBondContact O-CA 3.39Å; V171-A196 WeakPolarHBondContact O-CB 3.44Å; L193-A196 HydrophobicContact CB-CB 3.94Å; L193-A196 HydrophobicContact CD2-CB 3.7Å; L193-A196 HydrophobicContact CG-CB 4.42Å; L193-A196 WeakPolarHBondContact O-CB 3.39Å; L193-A196 PolarHBondContact O-N 3.05Å; L193-A196 VanDerWaalsContact O-N 3.09Å
197	E	94.4	Very high	94	Very high	45 Å²	45	54.3 Å²	54.3	21%	0.21	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.5	178.9	-167.6	167	132.4	0	0	109.6	I170 V171 K173 C208 T210	I170-E197 WeakPolarHBondContact CA-O 3.49Å; V171-E197 PolarHBondContact N-O 3.25Å; V171-E197 PolarHBondContact O-N 2.97Å; K173-E197 IonicContact NZ-OE2 3.46Å; K173-E197 PolarHBondContact NZ-OE2 2.71Å; E197-C208 VanDerWaalsContact CD-SG 3.5Å; E197-C208 PolarHBondContact OE1-SG 3.41Å; E197-T210 PolarHBondContact OE2-OG1 3.27Å
198	A	94.6	Very high	93.9	Very high	52 Å²	52	52.8 Å²	52.8	43%	0.43	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.3	169.7	0	0	0	0	0	108.8	L99 G169	L99-A198 HydrophobicContact CD2-CB 3.81Å; G169-A198 CarbonylContact O-C 3.56Å; G169-A198 WeakPolarHBondContact O-CA 3Å
199	L	94.4	Very high	93.6	Very high	27 Å²	27	61.8 Å²	61.8	14%	0.141	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-66.7	145.6	173	-58.4	173.5	0	0	0	109.5	G169 V171 D206 F232	G169-L199 WeakPolarHBondContact O-CB 3.45Å; G169-L199 PolarHBondContact O-N 2.84Å; V171-L199 HydrophobicContact CG2-CD1 4.19Å; V171-L199 HydrophobicContact CG2-CD2 4.27Å; V171-L199 HydrophobicContact CG2-CG 4.2Å; L199-D206 HydrophobicContact CD1-CB 3.79Å; L199-F232 HydrophobicContact CD1-CE1 3.76Å; L199-F232 HydrophobicContact CD1-CE2 4.5Å; L199-F232 HydrophobicContact CD1-CZ 3.62Å
200	H	91.6	Very high	93.1	Very high	126 Å²	126	63.8 Å²	63.8	58%	0.583	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-65.8	135.4	176	-170.8	-101.7	0	0	0	109.4	F202 A203	H200-F202 AromaticContact CE1-CD2 3.5Å; H200-F202 VanDerWaalsContact CE1-CD2 3.5Å; H200-F202 WeakPolarHBondContact CE1-CD2 3.27Å; H200-F202 AromaticContact ND1-CD2 3.97Å; H200-F202 PolarHBondContact ND1-N 3.04Å; H200-F202 PolarHBondContact O-N 3.17Å; H200-A203 HydrophobicContact CB-CB 4.17Å; H200-A203 VanDerWaalsContact O-CB 3.27Å; H200-A203 WeakPolarHBondContact O-CB 3.36Å; H200-A203 PolarHBondContact O-N 3.44Å
201	P	88.6	Confident	92.5	Very high	116 Å²	116	67.6 Å²	67.6	75%	0.753	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.9	-177.2	-26.4	34.8	0	0	0	114.5
202	F	90.9	Very high	92.1	Very high	180 Å²	180	71.4 Å²	71.4	79%	0.789	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	12.9	177.8	-52.2	-78.1	0	0	0	113	H200	H200-F202 AromaticContact CE1-CD2 3.5Å; H200-F202 VanDerWaalsContact CE1-CD2 3.5Å; H200-F202 WeakPolarHBondContact CE1-CD2 3.27Å; H200-F202 AromaticContact ND1-CD2 3.97Å; H200-F202 PolarHBondContact ND1-N 3.04Å; H200-F202 PolarHBondContact O-N 3.17Å
203	A	91.1	Very high	91.9	Very high	46 Å²	46	70.6 Å²	70.6	38%	0.38	38%	0.383	S	S	.	.			trans	-65.1	138.8	169.9	0	0	0	0	0	109.3	H200 D205	H200-A203 HydrophobicContact CB-CB 4.17Å; H200-A203 VanDerWaalsContact O-CB 3.27Å; H200-A203 WeakPolarHBondContact O-CB 3.36Å; H200-A203 PolarHBondContact O-N 3.44Å; A203-D205 WeakPolarHBondContact CB-O 3.43Å; A203-D205 PolarHBondContact O-N 3.17Å
204	E	88.4	Confident	92	Very high	200 Å²	200	71.5 Å²	71.5	94%	0.935	39%	0.39	S	S	*	.	S	Bend	trans	-71.4	-25	177.8	-63.3	-175.1	168.5	0	0	112.1
205	D	93.3	Very high	92.3	Very high	92 Å²	92	73.3 Å²	73.3	49%	0.492	40%	0.4	S	S	.	.	S	Bend	trans	-144.7	-175.1	-175.4	65	32.9	0	0	0	112.4	A203 T207	A203-D205 WeakPolarHBondContact CB-O 3.43Å; A203-D205 PolarHBondContact O-N 3.17Å; D205-T207 WeakPolarHBondContact OD1-CB 3.49Å; D205-T207 PolarHBondContact OD1-N 2.9Å; D205-T207 PolarHBondContact OD1-OG1 3.46Å; D205-T207 PolarHBondContact OD2-OG1 3.21Å; D205-T207 VanDerWaalsContact OD2-OG1 3.14Å
206	D	96.1	Very high	92.6	Very high	27 Å²	27	73.1 Å²	73.1	14%	0.144	40%	0.402	C	S	.	.			trans	-97.8	27.6	-179.9	72.5	-44.8	0	0	0	113.4	L199 C208 S230 G231 F232	L199-D206 HydrophobicContact CD1-CB 3.79Å; D206-C208 PolarHBondContact O-N 3.34Å; D206-S230 VanDerWaalsContact CG-OG 3.29Å; D206-S230 PolarHBondContact OD1-OG 2.87Å; D206-S230 WeakPolarHBondContact OD2-CB 3.33Å; D206-S230 PolarHBondContact OD2-OG 3.45Å; D206-G231 PolarHBondContact O-N 3.11Å; D206-G231 PolarHBondContact OD2-N 2.93Å; D206-G231 VanDerWaalsContact OD2-N 3.14Å; D206-F232 HydrophobicContact CB-CD1 4.34Å; D206-F232 HydrophobicContact CB-CD2 3.58Å; D206-F232 HydrophobicContact CB-CE1 4.32Å; D206-F232 HydrophobicContact CB-CE2 3.58Å; D206-F232 HydrophobicContact CB-CG 3.99Å; D206-F232 HydrophobicContact CB-CZ 3.96Å; D206-F232 VanDerWaalsContact OD2-CB 3.29Å; D206-F232 WeakPolarHBondContact OD2-CB 3.35Å; D206-F232 WeakPolarHBondContact OD2-CD2 3.26Å; D206-F232 WeakPolarHBondContact OD2-CG 3.28Å; D206-F232 PolarHBondContact OD2-N 3.37Å
207	T	96.4	Very high	92.7	Very high	53 Å²	53	72.8 Å²	72.8	33%	0.325	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	124.4	-176.9	-63.9	0	0	0	0	112	D205 T228 F229	D205-T207 WeakPolarHBondContact OD1-CB 3.49Å; D205-T207 PolarHBondContact OD1-N 2.9Å; D205-T207 PolarHBondContact OD1-OG1 3.46Å; D205-T207 PolarHBondContact OD2-OG1 3.21Å; D205-T207 VanDerWaalsContact OD2-OG1 3.14Å; T207-T228 HydrophobicContact CG2-CG2 3.85Å; T207-F229 WeakPolarHBondContact CA-O 3.48Å
208	C	95.1	Very high	92.9	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	159	172.3	-78	0	0	0	0	111.3	E197 D206 T228 F229	E197-C208 VanDerWaalsContact CD-SG 3.5Å; E197-C208 PolarHBondContact OE1-SG 3.41Å; D206-C208 PolarHBondContact O-N 3.34Å; C208-T228 WeakPolarHBondContact O-CA 3.43Å; C208-F229 HydrophobicContact CB-CD2 4Å; C208-F229 HydrophobicContact CB-CE2 3.56Å; C208-F229 HydrophobicContact CB-CZ 4.3Å; C208-F229 PolarHBondContact N-O 2.88Å; C208-F229 PolarHBondContact O-N 3.13Å
209	R	91.3	Very high	93.1	Very high	190 Å²	190	68.3 Å²	68.3	72%	0.717	37%	0.367	S	S	*	.			trans	-125.6	-17.4	178.3	-60.1	-174	-177.8	168.2	1.2	115	D227 T228	R209-D227 WeakPolarHBondContact CA-O 3.38Å; R209-D227 WeakPolarHBondContact CG-O 3.45Å; R209-T228 HydrophobicContact CG-CG2 3.98Å
210	T	88.4	Confident	93.3	Very high	62 Å²	62	67 Å²	67	38%	0.38	36%	0.36	S	S	.	.			trans	-93.1	129.8	-174.9	62.9	0	0	0	0	111.7	K173 E197 F229	K173-T210 PolarHBondContact NZ-O 2.82Å; K173-T210 PolarHBondContact NZ-OG1 3.45Å; E197-T210 PolarHBondContact OE2-OG1 3.27Å; T210-F229 WeakPolarHBondContact O-CZ 3.19Å
211	S	85.9	Confident	93.6	Very high	81 Å²	81	61.4 Å²	61.4	57%	0.566	33%	0.334	S	S	*	.			trans	-95.2	25.8	-174.2	54.7	0	0	0	0	114.6
212	Q	88.1	Confident	94	Very high	93 Å²	93	56.7 Å²	56.7	44%	0.435	30%	0.302	S	S	.	.			trans	-75	144.4	-178.6	-65.4	-175.3	-24.4	0	0	111.8	V195	V195-Q212 HydrophobicContact CB-CB 3.96Å; V195-Q212 HydrophobicContact CG1-CB 4.02Å
213	G	90.2	Very high	94.3	Very high	31 Å²	31	49 Å²	49	32%	0.32	27%	0.272	S	S	.	.	S	Bend	trans	142.8	-177.6	176.2	0	0	0	0	0	112.2
214	S	95.2	Very high	94.5	Very high	24 Å²	24	50.8 Å²	50.8	17%	0.168	28%	0.275	C	S	.	.			trans	-79.5	122.4	-176.8	-59.5	0	0	0	0	111.8	D174 K176 A216 F217 Q218	D174-S214 VanDerWaalsContact OD1-CB 3.29Å; D174-S214 WeakPolarHBondContact OD1-CB 3.22Å; D174-S214 PolarHBondContact OD1-N 3.31Å; D174-S214 PolarHBondContact OD1-OG 3.32Å; K176-S214 WeakPolarHBondContact CD-OG 3.48Å; K176-S214 WeakPolarHBondContact CE-OG 3.19Å; K176-S214 PolarHBondContact NZ-OG 3.44Å; S214-A216 PolarHBondContact O-N 2.7Å; S214-A216 VanDerWaalsContact O-N 3.15Å; S214-F217 PolarHBondContact O-N 3.2Å; S214-Q218 PolarHBondContact O-N 2.63Å
215	P	97	Very high	94.8	Very high	46 Å²	46	43.8 Å²	43.8	30%	0.299	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-52.5	-42.6	-169.5	-32.2	36.6	0	0	0	116	F217 Q218 I258 L261 F262 I265	P215-F217 PolarHBondContact O-N 2.84Å; P215-F217 VanDerWaalsContact O-N 3.15Å; P215-Q218 PolarHBondContact O-N 3.42Å; P215-I258 HydrophobicContact CB-CD1 4.09Å; P215-I258 HydrophobicContact CB-CG1 4.1Å; P215-I258 HydrophobicContact CG-CD1 3.56Å; P215-I258 HydrophobicContact CG-CG1 4.12Å; P215-L261 HydrophobicContact CB-CD2 3.86Å; P215-F262 HydrophobicContact CB-CE1 3.8Å; P215-F262 HydrophobicContact CB-CZ 3.9Å; P215-F262 HydrophobicContact CG-CZ 4.33Å; P215-I265 WeakPolarHBondContact O-CD1 3.36Å
216	A	97.8	Very high	94.9	Very high	25 Å²	25	44 Å²	44	21%	0.207	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-67.5	-13.8	-179	0	0	0	0	0	114.1	S214 Y251 L261	S214-A216 PolarHBondContact O-N 2.7Å; S214-A216 VanDerWaalsContact O-N 3.15Å; A216-Y251 HydrophobicContact CB-CD1 4.27Å; A216-Y251 HydrophobicContact CB-CE1 4.42Å; A216-L261 HydrophobicContact CB-CD2 4.18Å
217	F	98.5	Very high	94.8	Very high	13 Å²	13	49.3 Å²	49.3	6%	0.057	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-107.7	2.6	-179.8	-64.2	-95.9	0	0	0	112.4	I175 K176 S214 P215 S238 V241 Y251	I175-F217 WeakPolarHBondContact O-CD1 3.3Å; K176-F217 HydrophobicContact CB-CD1 3.81Å; K176-F217 HydrophobicContact CB-CD2 3.88Å; K176-F217 HydrophobicContact CB-CE1 3.6Å; K176-F217 HydrophobicContact CB-CE2 3.68Å; K176-F217 HydrophobicContact CB-CG 3.95Å; K176-F217 HydrophobicContact CB-CZ 3.53Å; S214-F217 PolarHBondContact O-N 3.2Å; P215-F217 PolarHBondContact O-N 2.84Å; P215-F217 VanDerWaalsContact O-N 3.15Å; F217-S238 PolarHBondContact O-OG 2.86Å; F217-V241 HydrophobicContact CD1-CB 3.84Å; F217-V241 HydrophobicContact CD1-CG1 3.52Å; F217-V241 HydrophobicContact CE1-CB 4.3Å; F217-V241 HydrophobicContact CE1-CG1 3.69Å; F217-V241 HydrophobicContact CG-CG1 4.12Å; F217-V241 HydrophobicContact CZ-CG1 4.42Å; F217-Y251 HydrophobicContact CE1-CE1 4.38Å; F217-Y251 AromaticContact CE2-CE1 3.76Å; F217-Y251 HydrophobicContact CE2-CE1 3.76Å; F217-Y251 AromaticContact CZ-CE1 3.55Å; F217-Y251 HydrophobicContact CZ-CE1 3.55Å
218	Q	98.2	Very high	94.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.009	29%	0.292	C	S	.	.			trans	-83.2	145.4	179.5	-68.6	-63.9	-51.7	0	0	111.4	K173 S214 P215 I222 W237 F262	K173-Q218 PolarHBondContact O-NE2 3.14Å; S214-Q218 PolarHBondContact O-N 2.63Å; P215-Q218 PolarHBondContact O-N 3.42Å; Q218-I222 HydrophobicContact CB-CG2 4.4Å; Q218-I222 HydrophobicContact CG-CG2 4.46Å; Q218-W237 PolarHBondContact O-NE1 3.48Å; Q218-F262 HydrophobicContact CB-CE1 4.36Å
219	P	98.4	Very high	94.8	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.295	C	S	.	.			trans	-82.6	167.8	179.8	36.4	-39.4	0	0	0	113.7	E221 I222 A223 V234 W237	P219-E221 VanDerWaalsContact C-N 3.33Å; P219-E221 VanDerWaalsContact CB-CD 3.49Å; P219-E221 HydrophobicContact CB-CG 4.25Å; P219-E221 WeakPolarHBondContact CB-OE2 3.42Å; P219-E221 HydrophobicContact CG-CG 3.87Å; P219-E221 PolarHBondContact O-N 2.73Å; P219-I222 HydrophobicContact CG-CB 4.32Å; P219-I222 HydrophobicContact CG-CD1 4.01Å; P219-I222 HydrophobicContact CG-CG1 4.11Å; P219-I222 PolarHBondContact O-N 3.09Å; P219-I222 VanDerWaalsContact O-N 3.12Å; P219-A223 PolarHBondContact O-N 3.16Å; P219-V234 HydrophobicContact CG-CB 4.35Å; P219-V234 HydrophobicContact CG-CG1 4.16Å; P219-V234 HydrophobicContact CG-CG2 4.04Å; P219-W237 HydrophobicContact CB-CB 3.84Å; P219-W237 HydrophobicContact CB-CD2 3.81Å; P219-W237 HydrophobicContact CB-CE3 4.35Å; P219-W237 HydrophobicContact CB-CG 3.55Å
220	P	98.3	Very high	95.1	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-37.9	-178.1	-24.4	35.6	0	0	0	113.8	I222 A223 N224 W237 I265 Y290	P220-I222 PolarHBondContact O-N 3.42Å; P220-A223 PolarHBondContact O-N 2.91Å; P220-N224 VanDerWaalsContact O-CB 3.24Å; P220-N224 WeakPolarHBondContact O-CB 3.42Å; P220-N224 PolarHBondContact O-N 3.45Å; P220-N224 PolarHBondContact O-ND2 3.36Å; P220-N224 VanDerWaalsContact O-ND2 3.16Å; P220-W237 VanDerWaalsContact CD-CH2 3.46Å; P220-W237 HydrophobicContact CG-CE3 4.5Å; P220-W237 HydrophobicContact CG-CH2 3.49Å; P220-W237 VanDerWaalsContact CG-CH2 3.49Å; P220-W237 HydrophobicContact CG-CZ2 4.04Å; P220-W237 HydrophobicContact CG-CZ3 3.76Å; P220-I265 HydrophobicContact CG-CG2 4.32Å; P220-Y290 HydrophobicContact CB-CD2 3.89Å; P220-Y290 HydrophobicContact CB-CE2 3.6Å; P220-Y290 HydrophobicContact CG-CD2 3.82Å; P220-Y290 HydrophobicContact CG-CE2 4.03Å
221	E	97.7	Very high	95.6	Very high	7 Å²	7	40.4 Å²	40.4	3%	0.033	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-35.9	176.7	53.6	-92.2	-149.6	0	0	112.9	P219 G225 L226 F229 R295	P219-E221 VanDerWaalsContact C-N 3.33Å; P219-E221 VanDerWaalsContact CB-CD 3.49Å; P219-E221 HydrophobicContact CB-CG 4.25Å; P219-E221 WeakPolarHBondContact CB-OE2 3.42Å; P219-E221 HydrophobicContact CG-CG 3.87Å; P219-E221 PolarHBondContact O-N 2.73Å; E221-G225 PolarHBondContact O-N 2.97Å; E221-L226 HydrophobicContact CB-CB 4.49Å; E221-L226 HydrophobicContact CB-CD1 3.74Å; E221-L226 HydrophobicContact CB-CG 4.28Å; E221-L226 VanDerWaalsContact O-CB 3.3Å; E221-L226 WeakPolarHBondContact O-CB 3.4Å; E221-L226 WeakPolarHBondContact O-CG 3.3Å; E221-L226 PolarHBondContact O-N 3.08Å; E221-F229 HydrophobicContact CB-CB 4.22Å; E221-F229 HydrophobicContact CG-CB 3.78Å; E221-F229 HydrophobicContact CG-CG 4.25Å; E221-R295 IonicContact OE1-CZ 2.62Å; E221-R295 IonicContact OE1-NH1 2.77Å; E221-R295 PolarHBondContact OE1-NH1 3.17Å; E221-R295 IonicContact OE1-NH2 3.48Å; E221-R295 PolarHBondContact OE1-NH2 2.97Å; E221-R295 IonicContact OE2-CZ 2.88Å; E221-R295 IonicContact OE2-NH1 3.48Å; E221-R295 IonicContact OE2-NH2 3.91Å; E221-R295 PolarHBondContact OE2-NH2 2.95Å
222	I	97.1	Very high	96.2	Very high	17 Å²	17	39.3 Å²	39.3	9%	0.087	24%	0.238	C	C	.	.	H	α-helix	trans	-81	-41.4	177.2	-67.8	177	0	0	0	110.4	Q218 P219 P220 N224 G225 F229 V234	Q218-I222 HydrophobicContact CB-CG2 4.4Å; Q218-I222 HydrophobicContact CG-CG2 4.46Å; P219-I222 HydrophobicContact CG-CB 4.32Å; P219-I222 HydrophobicContact CG-CD1 4.01Å; P219-I222 HydrophobicContact CG-CG1 4.11Å; P219-I222 PolarHBondContact O-N 3.09Å; P219-I222 VanDerWaalsContact O-N 3.12Å; P220-I222 PolarHBondContact O-N 3.42Å; I222-N224 PolarHBondContact O-N 2.99Å; I222-G225 PolarHBondContact O-N 3.35Å; I222-F229 HydrophobicContact CD1-CD2 4.26Å; I222-F229 HydrophobicContact CD1-CE1 4.16Å; I222-F229 HydrophobicContact CD1-CE2 3.71Å; I222-F229 HydrophobicContact CD1-CZ 3.65Å; I222-F229 HydrophobicContact CG1-CD1 4.01Å; I222-F229 HydrophobicContact CG1-CD2 4.39Å; I222-F229 HydrophobicContact CG1-CE1 3.7Å; I222-F229 HydrophobicContact CG1-CE2 4.1Å; I222-F229 HydrophobicContact CG1-CG 4.35Å; I222-F229 HydrophobicContact CG1-CZ 3.74Å; I222-V234 HydrophobicContact CD1-CG1 4.02Å; I222-V234 HydrophobicContact CD1-CG2 3.9Å
223	A	96.9	Very high	96.7	Very high	19 Å²	19	36.7 Å²	36.7	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-33.6	176.8	0	0	0	0	0	112.7	P219 P220 G225 F262 I265	P219-A223 PolarHBondContact O-N 3.16Å; P220-A223 PolarHBondContact O-N 2.91Å; A223-G225 VanDerWaalsContact C-N 3.28Å; A223-F262 HydrophobicContact CB-CB 4.12Å; A223-F262 HydrophobicContact CB-CD1 3.95Å; A223-F262 HydrophobicContact CB-CG 4.26Å; A223-I265 HydrophobicContact CB-CB 4Å; A223-I265 HydrophobicContact CB-CG2 3.66Å
224	N	96.2	Very high	97.1	Very high	83 Å²	83	35.2 Å²	35.2	44%	0.444	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.8	176.2	-68.1	-29.7	0	0	0	113.4	P220 I222 G266 Y290	P220-N224 VanDerWaalsContact O-CB 3.24Å; P220-N224 WeakPolarHBondContact O-CB 3.42Å; P220-N224 PolarHBondContact O-N 3.45Å; P220-N224 PolarHBondContact O-ND2 3.36Å; P220-N224 VanDerWaalsContact O-ND2 3.16Å; I222-N224 PolarHBondContact O-N 2.99Å; N224-G266 VanDerWaalsContact OD1-CA 3.31Å; N224-G266 WeakPolarHBondContact OD1-CA 3.47Å; N224-Y290 PolarHBondContact ND2-OH 3.27Å; N224-Y290 VanDerWaalsContact ND2-OH 3.11Å
225	G	94.4	Very high	97.2	Very high	54 Å²	54	34 Å²	34	56%	0.557	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.9	33	176.3	0	0	0	0	0	114.4	E221 I222 A223	E221-G225 PolarHBondContact O-N 2.97Å; I222-G225 PolarHBondContact O-N 3.35Å; A223-G225 VanDerWaalsContact C-N 3.28Å
226	L	96	Very high	97.3	Very high	97 Å²	97	32 Å²	32	51%	0.508	19%	0.188	S	C	.	.			trans	-65.9	134.9	172.5	-59.9	-170.3	0	0	0	110.4	E221 T228	E221-L226 HydrophobicContact CB-CB 4.49Å; E221-L226 HydrophobicContact CB-CD1 3.74Å; E221-L226 HydrophobicContact CB-CG 4.28Å; E221-L226 VanDerWaalsContact O-CB 3.3Å; E221-L226 WeakPolarHBondContact O-CB 3.4Å; E221-L226 WeakPolarHBondContact O-CG 3.3Å; E221-L226 PolarHBondContact O-N 3.08Å; L226-T228 VanDerWaalsContact C-N 3.28Å; L226-T228 PolarHBondContact O-N 2.86Å
227	D	92.8	Very high	97.4	Very high	138 Å²	138	30.9 Å²	30.9	74%	0.738	18%	0.179	S	C	*	.	S	Bend	trans	-70.4	-24.9	-178.7	-68.7	-36.2	0	0	0	113.4	R209	R209-D227 WeakPolarHBondContact CA-O 3.38Å; R209-D227 WeakPolarHBondContact CG-O 3.45Å
228	T	95.7	Very high	97.4	Very high	72 Å²	72	30.3 Å²	30.3	44%	0.442	18%	0.176	S	C	.	.			trans	-140.4	143.5	-178.3	52.3	0	0	0	0	110.6	T207 C208 R209 L226	T207-T228 HydrophobicContact CG2-CG2 3.85Å; C208-T228 WeakPolarHBondContact O-CA 3.43Å; R209-T228 HydrophobicContact CG-CG2 3.98Å; L226-T228 VanDerWaalsContact C-N 3.28Å; L226-T228 PolarHBondContact O-N 2.86Å
229	F	96.8	Very high	97.4	Very high	16 Å²	16	30.2 Å²	30.2	7%	0.07	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	158.5	-179.5	42.6	-95.3	0	0	0	110.8	T207 C208 T210 E221 I222 G231 V234	T207-F229 WeakPolarHBondContact CA-O 3.48Å; C208-F229 HydrophobicContact CB-CD2 4Å; C208-F229 HydrophobicContact CB-CE2 3.56Å; C208-F229 HydrophobicContact CB-CZ 4.3Å; C208-F229 PolarHBondContact N-O 2.88Å; C208-F229 PolarHBondContact O-N 3.13Å; T210-F229 WeakPolarHBondContact O-CZ 3.19Å; E221-F229 HydrophobicContact CB-CB 4.22Å; E221-F229 HydrophobicContact CG-CB 3.78Å; E221-F229 HydrophobicContact CG-CG 4.25Å; I222-F229 HydrophobicContact CD1-CD2 4.26Å; I222-F229 HydrophobicContact CD1-CE1 4.16Å; I222-F229 HydrophobicContact CD1-CE2 3.71Å; I222-F229 HydrophobicContact CD1-CZ 3.65Å; I222-F229 HydrophobicContact CG1-CD1 4.01Å; I222-F229 HydrophobicContact CG1-CD2 4.39Å; I222-F229 HydrophobicContact CG1-CE1 3.7Å; I222-F229 HydrophobicContact CG1-CE2 4.1Å; I222-F229 HydrophobicContact CG1-CG 4.35Å; I222-F229 HydrophobicContact CG1-CZ 3.74Å; F229-G231 PolarHBondContact O-N 2.91Å; F229-V234 HydrophobicContact CD2-CG2 3.53Å; F229-V234 HydrophobicContact CE2-CG2 3.82Å
230	S	97.8	Very high	97.5	Very high	29 Å²	29	30.2 Å²	30.2	20%	0.203	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	115.2	173.8	160.4	0	0	0	0	110.3	D206 F232 K233 V234	D206-S230 VanDerWaalsContact CG-OG 3.29Å; D206-S230 PolarHBondContact OD1-OG 2.87Å; D206-S230 WeakPolarHBondContact OD2-CB 3.33Å; D206-S230 PolarHBondContact OD2-OG 3.45Å; S230-F232 PolarHBondContact O-N 2.82Å; S230-K233 PolarHBondContact O-N 3.26Å; S230-K233 WeakPolarHBondContact OG-CG 3.04Å; S230-K233 PolarHBondContact OG-N 3.05Å; S230-V234 PolarHBondContact O-N 3.33Å
231	G	97.7	Very high	97.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.2	-40.2	-178.3	0	0	0	0	0	113.1	V171 D206 F229 K233 V234 D235	V171-G231 VanDerWaalsContact CG1-C 3.49Å; V171-G231 WeakPolarHBondContact CG1-O 3.43Å; D206-G231 PolarHBondContact O-N 3.11Å; D206-G231 PolarHBondContact OD2-N 2.93Å; D206-G231 VanDerWaalsContact OD2-N 3.14Å; F229-G231 PolarHBondContact O-N 2.91Å; G231-K233 VanDerWaalsContact C-N 3.26Å; G231-K233 PolarHBondContact O-N 3.36Å; G231-V234 VanDerWaalsContact O-CB 3.29Å; G231-V234 WeakPolarHBondContact O-CB 3.28Å; G231-V234 PolarHBondContact O-N 3.02Å; G231-V234 VanDerWaalsContact O-N 3.1Å; G231-D235 PolarHBondContact O-N 2.72Å
232	F	98.5	Very high	97.5	Very high	58 Å²	58	29.8 Å²	29.8	25%	0.254	17%	0.174	S	C	.	.	H	α-helix	trans	-63.3	-35.3	178.4	-60	-28.3	0	0	0	111.7	H166 V171 L199 D206 S230 V234 D235 I236	H166-F232 HydrophobicContact CB-CD1 3.83Å; H166-F232 HydrophobicContact CB-CE1 3.67Å; H166-F232 HydrophobicContact CB-CG 4.35Å; H166-F232 HydrophobicContact CB-CZ 4.04Å; H166-F232 AromaticContact CD2-CD1 3.41Å; H166-F232 VanDerWaalsContact CD2-CD1 3.41Å; H166-F232 WeakPolarHBondContact CD2-CD1 3.39Å; H166-F232 AromaticContact CD2-CE1 3.79Å; H166-F232 AromaticContact CE1-CD1 3.77Å; H166-F232 AromaticContact CG-CD1 3.34Å; H166-F232 AromaticContact CG-CE1 3.69Å; H166-F232 AromaticContact CG-CG 3.9Å; H166-F232 AromaticContact ND1-CD1 3.6Å; H166-F232 AromaticContact ND1-CG 3.71Å; H166-F232 AromaticContact NE2-CD1 3.67Å; V171-F232 HydrophobicContact CG2-CD1 3.92Å; V171-F232 HydrophobicContact CG2-CE1 3.96Å; L199-F232 HydrophobicContact CD1-CE1 3.76Å; L199-F232 HydrophobicContact CD1-CE2 4.5Å; L199-F232 HydrophobicContact CD1-CZ 3.62Å; D206-F232 HydrophobicContact CB-CD1 4.34Å; D206-F232 HydrophobicContact CB-CD2 3.58Å; D206-F232 HydrophobicContact CB-CE1 4.32Å; D206-F232 HydrophobicContact CB-CE2 3.58Å; D206-F232 HydrophobicContact CB-CG 3.99Å; D206-F232 HydrophobicContact CB-CZ 3.96Å; D206-F232 VanDerWaalsContact OD2-CB 3.29Å; D206-F232 WeakPolarHBondContact OD2-CB 3.35Å; D206-F232 WeakPolarHBondContact OD2-CD2 3.26Å; D206-F232 WeakPolarHBondContact OD2-CG 3.28Å; D206-F232 PolarHBondContact OD2-N 3.37Å; S230-F232 PolarHBondContact O-N 2.82Å; F232-V234 VanDerWaalsContact C-N 3.3Å; F232-V234 PolarHBondContact O-N 3.31Å; F232-D235 PolarHBondContact O-N 3.4Å; F232-I236 WeakPolarHBondContact O-CG1 3.45Å; F232-I236 PolarHBondContact O-N 3.32Å
233	K	98.6	Very high	97.6	Very high	38 Å²	38	29 Å²	29	17%	0.165	17%	0.17	C	C	.	.	H	α-helix	trans	-70.7	-24.5	177	-62.3	-69	-177.3	172.3	0	113.1	S230 G231 W237 P292 R295 F296	S230-K233 PolarHBondContact O-N 3.26Å; S230-K233 WeakPolarHBondContact OG-CG 3.04Å; S230-K233 PolarHBondContact OG-N 3.05Å; G231-K233 VanDerWaalsContact C-N 3.26Å; G231-K233 PolarHBondContact O-N 3.36Å; K233-W237 PolarHBondContact O-N 2.71Å; K233-W237 VanDerWaalsContact O-N 3.09Å; K233-P292 HydrophobicContact CB-CB 4.26Å; K233-P292 WeakPolarHBondContact CD-O 3.46Å; K233-P292 VanDerWaalsContact CE-O 3.28Å; K233-P292 WeakPolarHBondContact CE-O 3.38Å; K233-P292 HydrophobicContact CG-CB 4.32Å; K233-R295 HydrophobicContact CD-CB 4.26Å; K233-R295 PolarHBondContact NZ-O 3.11Å; K233-R295 PolarHBondContact O-NH1 2.87Å; K233-F296 PolarHBondContact NZ-O 3.46Å
234	V	98.6	Very high	97.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-51.9	169.7	178	0	0	0	0	109.7	P219 I222 F229 S230 G231 F232 I236 W237 S238	P219-V234 HydrophobicContact CG-CB 4.35Å; P219-V234 HydrophobicContact CG-CG1 4.16Å; P219-V234 HydrophobicContact CG-CG2 4.04Å; I222-V234 HydrophobicContact CD1-CG1 4.02Å; I222-V234 HydrophobicContact CD1-CG2 3.9Å; F229-V234 HydrophobicContact CD2-CG2 3.53Å; F229-V234 HydrophobicContact CE2-CG2 3.82Å; S230-V234 PolarHBondContact O-N 3.33Å; G231-V234 VanDerWaalsContact O-CB 3.29Å; G231-V234 WeakPolarHBondContact O-CB 3.28Å; G231-V234 PolarHBondContact O-N 3.02Å; G231-V234 VanDerWaalsContact O-N 3.1Å; F232-V234 VanDerWaalsContact C-N 3.3Å; F232-V234 PolarHBondContact O-N 3.31Å; V234-I236 VanDerWaalsContact C-N 3.3Å; V234-I236 PolarHBondContact O-N 2.81Å; V234-W237 WeakPolarHBondContact O-CB 3.28Å; V234-W237 PolarHBondContact O-N 3.29Å; V234-W237 VanDerWaalsContact O-N 3.16Å; V234-S238 PolarHBondContact O-N 2.95Å; V234-S238 PolarHBondContact O-OG 3.17Å
235	D	98.8	Very high	97.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-37.2	179.2	-76.3	-18.9	0	0	0	112.2	L162 H166 H172 K173 G231 F232 S238 A239	L162-D235 HydrophobicContact CD2-CB 4.08Å; H166-D235 IonicContact CD2-OD2 2.74Å; H166-D235 IonicContact CE1-OD2 3.31Å; H166-D235 IonicContact NE2-OD2 3.4Å; H166-D235 PolarHBondContact NE2-OD2 2.84Å; H172-D235 PolarHBondContact N-OD1 3.33Å; H172-D235 PolarHBondContact N-OD2 3.47Å; K173-D235 PolarHBondContact N-OD1 2.63Å; G231-D235 PolarHBondContact O-N 2.72Å; F232-D235 PolarHBondContact O-N 3.4Å; D235-S238 PolarHBondContact O-N 3.33Å; D235-A239 VanDerWaalsContact O-CB 3.3Å; D235-A239 WeakPolarHBondContact O-CB 3.46Å; D235-A239 PolarHBondContact O-N 2.75Å
236	I	98.9	Very high	98	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-44.8	174.5	-68.4	-49.2	0	0	0	111.7	F232 V234 A239 G240 M287 R295 I298 I301	F232-I236 WeakPolarHBondContact O-CG1 3.45Å; F232-I236 PolarHBondContact O-N 3.32Å; V234-I236 VanDerWaalsContact C-N 3.3Å; V234-I236 PolarHBondContact O-N 2.81Å; I236-A239 PolarHBondContact O-N 3.25Å; I236-G240 PolarHBondContact O-N 3.03Å; I236-M287 HydrophobicContact CG2-CB 4.36Å; I236-M287 HydrophobicContact CG2-CE 4.32Å; I236-M287 HydrophobicContact CG2-CG 4.36Å; I236-M287 WeakPolarHBondContact O-CE 3.41Å; I236-R295 HydrophobicContact CG2-CG 4.14Å; I236-I298 HydrophobicContact CD1-CG1 3.68Å; I236-I301 HydrophobicContact CD1-CD1 3.58Å; I236-I301 HydrophobicContact CG1-CD1 4.41Å; I236-I301 HydrophobicContact CG2-CD1 4Å
237	W	98.9	Very high	98.1	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-49.5	176.4	176.3	-83.7	0	0	0	111.1	Q218 P219 P220 K233 V234 A239 G240 V241 F253 I265 L288	Q218-W237 PolarHBondContact O-NE1 3.48Å; P219-W237 HydrophobicContact CB-CB 3.84Å; P219-W237 HydrophobicContact CB-CD2 3.81Å; P219-W237 HydrophobicContact CB-CE3 4.35Å; P219-W237 HydrophobicContact CB-CG 3.55Å; P220-W237 VanDerWaalsContact CD-CH2 3.46Å; P220-W237 HydrophobicContact CG-CE3 4.5Å; P220-W237 HydrophobicContact CG-CH2 3.49Å; P220-W237 VanDerWaalsContact CG-CH2 3.49Å; P220-W237 HydrophobicContact CG-CZ2 4.04Å; P220-W237 HydrophobicContact CG-CZ3 3.76Å; K233-W237 PolarHBondContact O-N 2.71Å; K233-W237 VanDerWaalsContact O-N 3.09Å; V234-W237 WeakPolarHBondContact O-CB 3.28Å; V234-W237 PolarHBondContact O-N 3.29Å; V234-W237 VanDerWaalsContact O-N 3.16Å; W237-A239 VanDerWaalsContact C-N 3.28Å; W237-A239 PolarHBondContact O-N 3.15Å; W237-G240 CarbonylContact O-C 3.57Å; W237-G240 WeakPolarHBondContact O-CA 3.45Å; W237-G240 PolarHBondContact O-N 3.02Å; W237-V241 PolarHBondContact O-N 3.12Å; W237-F253 AromaticContact CH2-CE2 3.7Å; W237-F253 HydrophobicContact CH2-CE2 3.7Å; W237-F253 AromaticContact CH2-CZ 3.83Å; W237-F253 HydrophobicContact CH2-CZ 3.83Å; W237-F253 HydrophobicContact CZ2-CD2 4.08Å; W237-F253 AromaticContact CZ2-CE2 3.31Å; W237-F253 HydrophobicContact CZ2-CE2 3.31Å; W237-F253 AromaticContact CZ2-CZ 3.89Å; W237-F253 HydrophobicContact CZ2-CZ 3.89Å; W237-I265 HydrophobicContact CZ2-CG2 4.27Å; W237-L288 HydrophobicContact CD2-CD2 3.82Å; W237-L288 HydrophobicContact CE3-CB 4.4Å; W237-L288 HydrophobicContact CE3-CD2 4.03Å; W237-L288 HydrophobicContact CG-CD2 4.27Å; W237-L288 HydrophobicContact CZ2-CD2 4.35Å; W237-L288 HydrophobicContact CZ3-CB 4.16Å; W237-L288 HydrophobicContact CZ3-CD2 4.37Å; W237-L288 WeakPolarHBondContact CZ3-O 3.3Å
238	S	98.9	Very high	98.4	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.9	-36.9	178.9	-56.4	0	0	0	0	112.4	I175 F217 V234 D235 G240 V241 T242	I175-S238 WeakPolarHBondContact O-CB 3.33Å; F217-S238 PolarHBondContact O-OG 2.86Å; V234-S238 PolarHBondContact O-N 2.95Å; V234-S238 PolarHBondContact O-OG 3.17Å; D235-S238 PolarHBondContact O-N 3.33Å; S238-G240 VanDerWaalsContact C-N 3.34Å; S238-V241 PolarHBondContact O-N 3.33Å; S238-T242 WeakPolarHBondContact O-CB 3.13Å; S238-T242 PolarHBondContact O-N 3.38Å; S238-T242 PolarHBondContact O-OG1 2.93Å
239	A	98.9	Very high	98.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-66.3	-34.1	171.5	0	0	0	0	0	112.4	L158 L162 I175 D235 I236 W237 T242 L243 M287	L158-A239 HydrophobicContact CD2-CB 4.14Å; L162-A239 HydrophobicContact CD1-CB 3.93Å; I175-A239 HydrophobicContact CG2-CB 4.41Å; D235-A239 VanDerWaalsContact O-CB 3.3Å; D235-A239 WeakPolarHBondContact O-CB 3.46Å; D235-A239 PolarHBondContact O-N 2.75Å; I236-A239 PolarHBondContact O-N 3.25Å; W237-A239 VanDerWaalsContact C-N 3.28Å; W237-A239 PolarHBondContact O-N 3.15Å; A239-T242 PolarHBondContact O-N 3.45Å; A239-L243 WeakPolarHBondContact O-CB 3.29Å; A239-L243 PolarHBondContact O-N 3.07Å; A239-M287 HydrophobicContact CB-CE 3.78Å
240	G	98.9	Very high	98.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.9	-45.7	174.3	0	0	0	0	0	112.2	I236 W237 S238 T242 L243 Y244 M287	I236-G240 PolarHBondContact O-N 3.03Å; W237-G240 CarbonylContact O-C 3.57Å; W237-G240 WeakPolarHBondContact O-CA 3.45Å; W237-G240 PolarHBondContact O-N 3.02Å; S238-G240 VanDerWaalsContact C-N 3.34Å; G240-T242 VanDerWaalsContact C-N 3.29Å; G240-T242 PolarHBondContact O-N 3.19Å; G240-L243 PolarHBondContact O-N 3.1Å; G240-Y244 WeakPolarHBondContact O-CB 3.35Å; G240-Y244 PolarHBondContact O-N 3.01Å; G240-M287 VanDerWaalsContact N-CE 3.3Å
241	V	98.9	Very high	98.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.9	-41.7	173	177.1	0	0	0	0	110.4	F217 W237 S238 Y244 N245 Y251 P252 L288	F217-V241 HydrophobicContact CD1-CB 3.84Å; F217-V241 HydrophobicContact CD1-CG1 3.52Å; F217-V241 HydrophobicContact CE1-CB 4.3Å; F217-V241 HydrophobicContact CE1-CG1 3.69Å; F217-V241 HydrophobicContact CG-CG1 4.12Å; F217-V241 HydrophobicContact CZ-CG1 4.42Å; W237-V241 PolarHBondContact O-N 3.12Å; S238-V241 PolarHBondContact O-N 3.33Å; V241-Y244 WeakPolarHBondContact O-CB 3.3Å; V241-Y244 PolarHBondContact O-N 3.43Å; V241-N245 WeakPolarHBondContact O-CB 3.48Å; V241-N245 PolarHBondContact O-N 3.41Å; V241-Y251 HydrophobicContact CG1-CD1 4.22Å; V241-P252 HydrophobicContact CB-CG 4.45Å; V241-P252 HydrophobicContact CG1-CG 4.18Å; V241-P252 HydrophobicContact CG2-CG 4.03Å; V241-L288 HydrophobicContact CG2-CD2 3.74Å
242	T	98.9	Very high	98.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.3	-48.3	175	-62.6	0	0	0	0	111.3	L158 P177 L180 S238 A239 G240 Y244 N245 I246	L158-T242 HydrophobicContact CD2-CG2 4.35Å; P177-T242 HydrophobicContact CG-CG2 4.15Å; L180-T242 HydrophobicContact CD1-CG2 3.93Å; S238-T242 WeakPolarHBondContact O-CB 3.13Å; S238-T242 PolarHBondContact O-N 3.38Å; S238-T242 PolarHBondContact O-OG1 2.93Å; A239-T242 PolarHBondContact O-N 3.45Å; G240-T242 VanDerWaalsContact C-N 3.29Å; G240-T242 PolarHBondContact O-N 3.19Å; T242-Y244 VanDerWaalsContact C-N 3.33Å; T242-Y244 PolarHBondContact O-N 3.23Å; T242-N245 PolarHBondContact O-N 3.42Å; T242-N245 VanDerWaalsContact O-N 3.15Å; T242-I246 HydrophobicContact CG2-CG2 4.29Å; T242-I246 WeakPolarHBondContact O-CG1 3.16Å; T242-I246 WeakPolarHBondContact O-CG2 3.26Å; T242-I246 PolarHBondContact O-N 3.47Å
243	L	98.9	Very high	98.5	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.3	-43.7	177.9	179.3	59	0	0	0	111.6	F155 A239 G240 N245 I246 T247 L280 L283 L284 M287 W306	F155-L243 HydrophobicContact CB-CD1 4.12Å; F155-L243 HydrophobicContact CD1-CD1 4.43Å; F155-L243 HydrophobicContact CD1-CD2 4.29Å; F155-L243 HydrophobicContact CD2-CB 3.83Å; F155-L243 HydrophobicContact CD2-CD1 3.85Å; F155-L243 HydrophobicContact CD2-CD2 4.13Å; F155-L243 HydrophobicContact CD2-CG 4.14Å; F155-L243 HydrophobicContact CE1-CD2 4.02Å; F155-L243 HydrophobicContact CE2-CB 3.74Å; F155-L243 HydrophobicContact CE2-CD1 4.4Å; F155-L243 HydrophobicContact CE2-CD2 3.87Å; F155-L243 HydrophobicContact CE2-CG 4.21Å; F155-L243 HydrophobicContact CG-CD1 3.87Å; F155-L243 HydrophobicContact CG-CD2 4.33Å; F155-L243 HydrophobicContact CZ-CB 4.49Å; F155-L243 HydrophobicContact CZ-CD2 3.8Å; A239-L243 WeakPolarHBondContact O-CB 3.29Å; A239-L243 PolarHBondContact O-N 3.07Å; G240-L243 PolarHBondContact O-N 3.1Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 3.04Å; L243-I246 HydrophobicContact CD1-CD1 4.43Å; L243-I246 HydrophobicContact CD1-CG1 4.45Å; L243-T247 HydrophobicContact CD1-CG2 3.87Å; L243-T247 WeakPolarHBondContact O-CB 3.21Å; L243-T247 WeakPolarHBondContact O-CG2 3.37Å; L243-T247 PolarHBondContact O-N 3.49Å; L243-T247 PolarHBondContact O-OG1 2.83Å; L243-L280 HydrophobicContact CD1-CD1 4.29Å; L243-L280 HydrophobicContact CD2-CD1 3.8Å; L243-L280 HydrophobicContact CG-CD1 4.01Å; L243-L283 HydrophobicContact CD2-CD2 3.66Å; L243-L283 HydrophobicContact CD2-CG 4.16Å; L243-L284 HydrophobicContact CB-CD2 4.09Å; L243-L284 HydrophobicContact CD2-CD2 4.04Å; L243-L284 HydrophobicContact CG-CD2 3.97Å; L243-M287 HydrophobicContact CD2-SD 4.34Å; L243-W306 HydrophobicContact CD1-CH2 3.68Å; L243-W306 HydrophobicContact CD1-CZ2 4.49Å; L243-W306 HydrophobicContact CD1-CZ3 4.02Å; L243-W306 HydrophobicContact CD2-CZ3 4.28Å
244	Y	98.8	Very high	98.4	Very high	7 Å²	7	18 Å²	18	3%	0.027	9%	0.092	C	C	.	.	H	α-helix	trans	-55.5	-50.7	173.8	-172	-75.1	0	0	0	110	G240 V241 T242 T247 T248 L250 Y251 P252 Y270 T271 V272 P273 L284	G240-Y244 WeakPolarHBondContact O-CB 3.35Å; G240-Y244 PolarHBondContact O-N 3.01Å; V241-Y244 WeakPolarHBondContact O-CB 3.3Å; V241-Y244 PolarHBondContact O-N 3.43Å; T242-Y244 VanDerWaalsContact C-N 3.33Å; T242-Y244 PolarHBondContact O-N 3.23Å; Y244-T247 PolarHBondContact O-N 3.26Å; Y244-T247 PolarHBondContact O-OG1 3.4Å; Y244-T248 HydrophobicContact CD1-CG2 4.4Å; Y244-T248 WeakPolarHBondContact CD1-OG1 3.42Å; Y244-T248 HydrophobicContact CE1-CG2 4.32Å; Y244-T248 WeakPolarHBondContact CE1-OG1 3.37Å; Y244-T248 WeakPolarHBondContact O-CB 3.23Å; Y244-T248 WeakPolarHBondContact O-CG2 3.44Å; Y244-T248 PolarHBondContact O-N 3.41Å; Y244-T248 PolarHBondContact O-OG1 2.83Å; Y244-L250 WeakPolarHBondContact CD1-O 3.42Å; Y244-L250 HydrophobicContact CE1-CB 3.81Å; Y244-Y251 VanDerWaalsContact CE1-C 3.47Å; Y244-P252 HydrophobicContact CD1-CB 4.45Å; Y244-P252 HydrophobicContact CD1-CG 4.45Å; Y244-P252 HydrophobicContact CD2-CB 4.09Å; Y244-P252 HydrophobicContact CE1-CB 4.46Å; Y244-P252 HydrophobicContact CE2-CB 4.13Å; Y244-P252 HydrophobicContact CG-CB 4.28Å; Y244-P252 HydrophobicContact CG-CG 4.3Å; Y244-Y270 HydrophobicContact CE2-CD2 4.44Å; Y244-T271 WeakPolarHBondContact CE2-O 3.5Å; Y244-T271 PolarHBondContact OH-O 3.23Å; Y244-V272 HydrophobicContact CE2-CG2 4.36Å; Y244-P273 WeakPolarHBondContact OH-CD 3.33Å; Y244-L284 HydrophobicContact CD2-CD1 3.99Å; Y244-L284 HydrophobicContact CD2-CD2 4.5Å
245	N	98.6	Very high	98.3	Very high	6 Å²	6	18.8 Å²	18.8	3%	0.032	10%	0.101	C	C	.	.	H	α-helix	trans	-63.4	-49	-177.2	-178.8	-109.7	0	0	0	112.9	V241 T242 L243 T247 T248 G249 L250 Y251	V241-N245 WeakPolarHBondContact O-CB 3.48Å; V241-N245 PolarHBondContact O-N 3.41Å; T242-N245 PolarHBondContact O-N 3.42Å; T242-N245 VanDerWaalsContact O-N 3.15Å; L243-N245 VanDerWaalsContact C-N 3.32Å; L243-N245 PolarHBondContact O-N 3.04Å; N245-T247 PolarHBondContact O-N 3.21Å; N245-T248 PolarHBondContact O-N 3.09Å; N245-G249 WeakPolarHBondContact O-CA 3.17Å; N245-G249 PolarHBondContact O-N 3.44Å; N245-L250 WeakPolarHBondContact CA-O 3.37Å; N245-L250 PolarHBondContact ND2-O 3.25Å; N245-Y251 WeakPolarHBondContact ND2-CE2 3.45Å
246	I	98.6	Very high	98.1	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.015	14%	0.14	C	C	.	.	H	α-helix	trans	-71.2	-15.9	-176	70.8	179.5	0	0	0	113.7	M134 L138 F146 A151 P177 T242 L243	M134-I246 HydrophobicContact SD-CG2 3.79Å; L138-I246 HydrophobicContact CD1-CG2 3.94Å; L138-I246 HydrophobicContact CD2-CB 4.4Å; L138-I246 HydrophobicContact CD2-CG2 4.35Å; F146-I246 HydrophobicContact CD2-CB 3.91Å; F146-I246 HydrophobicContact CD2-CG2 4.46Å; F146-I246 HydrophobicContact CE2-CB 4.28Å; F146-I246 HydrophobicContact CE2-CG2 4.33Å; F146-I246 PolarHBondContact N-O 3.06Å; A151-I246 HydrophobicContact CB-CD1 4.07Å; A151-I246 HydrophobicContact CB-CG1 4.04Å; P177-I246 HydrophobicContact CG-CG2 4.17Å; T242-I246 HydrophobicContact CG2-CG2 4.29Å; T242-I246 WeakPolarHBondContact O-CG1 3.16Å; T242-I246 WeakPolarHBondContact O-CG2 3.26Å; T242-I246 PolarHBondContact O-N 3.47Å; L243-I246 HydrophobicContact CD1-CD1 4.43Å; L243-I246 HydrophobicContact CD1-CG1 4.45Å
247	T	98.4	Very high	98	Very high	14 Å²	14	29.7 Å²	29.7	9%	0.086	16%	0.159	C	C	.	.	H	α-helix	trans	-99.5	-24.5	178	54	0	0	0	0	113.5	R145 A151 L243 Y244 N245 L280	R145-T247 WeakPolarHBondContact CD-O 3.22Å; A151-T247 HydrophobicContact CB-CG2 3.69Å; L243-T247 HydrophobicContact CD1-CG2 3.87Å; L243-T247 WeakPolarHBondContact O-CB 3.21Å; L243-T247 WeakPolarHBondContact O-CG2 3.37Å; L243-T247 PolarHBondContact O-N 3.49Å; L243-T247 PolarHBondContact O-OG1 2.83Å; Y244-T247 PolarHBondContact O-N 3.26Å; Y244-T247 PolarHBondContact O-OG1 3.4Å; N245-T247 PolarHBondContact O-N 3.21Å; T247-L280 HydrophobicContact CG2-CD2 3.85Å
248	T	98	Very high	97.8	Very high	22 Å²	22	32.8 Å²	32.8	14%	0.135	18%	0.175	C	C	.	.	H	α-helix	trans	-114.8	-23.9	-175.2	66.5	0	0	0	0	114.1	Y244 N245 L250 P273 C276	Y244-T248 HydrophobicContact CD1-CG2 4.4Å; Y244-T248 WeakPolarHBondContact CD1-OG1 3.42Å; Y244-T248 HydrophobicContact CE1-CG2 4.32Å; Y244-T248 WeakPolarHBondContact CE1-OG1 3.37Å; Y244-T248 WeakPolarHBondContact O-CB 3.23Å; Y244-T248 WeakPolarHBondContact O-CG2 3.44Å; Y244-T248 PolarHBondContact O-N 3.41Å; Y244-T248 PolarHBondContact O-OG1 2.83Å; N245-T248 PolarHBondContact O-N 3.09Å; T248-L250 PolarHBondContact O-N 2.85Å; T248-L250 WeakPolarHBondContact OG1-CB 3.36Å; T248-L250 PolarHBondContact OG1-N 3.43Å; T248-P273 HydrophobicContact CG2-CG 3.95Å; T248-C276 VanDerWaalsContact CG2-SG 3.59Å
249	G	97.8	Very high	97.7	Very high	17 Å²	17	41.8 Å²	41.8	18%	0.175	21%	0.21	C	C	.	.	S	Bend	trans	75.8	4.9	-169.1	0	0	0	0	0	113.9	K144 N245	K144-G249 VanDerWaalsContact O-CA 3.28Å; K144-G249 WeakPolarHBondContact O-CA 3.42Å; N245-G249 WeakPolarHBondContact O-CA 3.17Å; N245-G249 PolarHBondContact O-N 3.44Å
250	L	97.5	Very high	97.7	Very high	89 Å²	89	45.4 Å²	45.4	47%	0.466	23%	0.226	S	C	.	.	S	Bend	trans	-113.4	176.1	-176.1	-58.7	176.6	0	0	0	111	Y244 N245 T248 P273	Y244-L250 WeakPolarHBondContact CD1-O 3.42Å; Y244-L250 HydrophobicContact CE1-CB 3.81Å; N245-L250 WeakPolarHBondContact CA-O 3.37Å; N245-L250 PolarHBondContact ND2-O 3.25Å; T248-L250 PolarHBondContact O-N 2.85Å; T248-L250 WeakPolarHBondContact OG1-CB 3.36Å; T248-L250 PolarHBondContact OG1-N 3.43Å; L250-P273 HydrophobicContact CD1-CG 4.31Å
251	Y	97.9	Very high	97.6	Very high	70 Å²	70	46.3 Å²	46.3	28%	0.275	23%	0.231	S	C	.	.			trans	-115.1	146	168.2	-72.7	-93.5	0	0	0	109.7	A216 F217 V241 Y244 N245 F253	A216-Y251 HydrophobicContact CB-CD1 4.27Å; A216-Y251 HydrophobicContact CB-CE1 4.42Å; F217-Y251 HydrophobicContact CE1-CE1 4.38Å; F217-Y251 AromaticContact CE2-CE1 3.76Å; F217-Y251 HydrophobicContact CE2-CE1 3.76Å; F217-Y251 AromaticContact CZ-CE1 3.55Å; F217-Y251 HydrophobicContact CZ-CE1 3.55Å; V241-Y251 HydrophobicContact CG1-CD1 4.22Å; Y244-Y251 VanDerWaalsContact CE1-C 3.47Å; N245-Y251 WeakPolarHBondContact ND2-CE2 3.45Å; Y251-F253 VanDerWaalsContact C-N 3.26Å; Y251-F253 PolarHBondContact O-N 2.94Å
252	P	98.3	Very high	97.6	Very high	13 Å²	13	49 Å²	49	8%	0.084	24%	0.242	C	C	.	.	S	Bend	trans	-69.7	-27	177	26.3	-30.9	0	0	0	112	V241 Y244 Y270 L288	V241-P252 HydrophobicContact CB-CG 4.45Å; V241-P252 HydrophobicContact CG1-CG 4.18Å; V241-P252 HydrophobicContact CG2-CG 4.03Å; Y244-P252 HydrophobicContact CD1-CB 4.45Å; Y244-P252 HydrophobicContact CD1-CG 4.45Å; Y244-P252 HydrophobicContact CD2-CB 4.09Å; Y244-P252 HydrophobicContact CE1-CB 4.46Å; Y244-P252 HydrophobicContact CE2-CB 4.13Å; Y244-P252 HydrophobicContact CG-CB 4.28Å; Y244-P252 HydrophobicContact CG-CG 4.3Å; P252-Y270 HydrophobicContact CB-CD2 4.02Å; P252-Y270 HydrophobicContact CB-CG 4.12Å; P252-Y270 VanDerWaalsContact O-CB 3.24Å; P252-Y270 WeakPolarHBondContact O-CB 3.41Å; P252-L288 HydrophobicContact CB-CD1 4.14Å; P252-L288 HydrophobicContact CG-CD1 4.16Å
253	F	98.3	Very high	97.6	Very high	6 Å²	6	53 Å²	53	3%	0.026	26%	0.261	C	S	.	.			trans	-132.1	135.4	178.6	-52.7	-81.5	0	0	0	110.3	W237 Y251 L261 I265 Y270	W237-F253 AromaticContact CH2-CE2 3.7Å; W237-F253 HydrophobicContact CH2-CE2 3.7Å; W237-F253 AromaticContact CH2-CZ 3.83Å; W237-F253 HydrophobicContact CH2-CZ 3.83Å; W237-F253 HydrophobicContact CZ2-CD2 4.08Å; W237-F253 AromaticContact CZ2-CE2 3.31Å; W237-F253 HydrophobicContact CZ2-CE2 3.31Å; W237-F253 AromaticContact CZ2-CZ 3.89Å; W237-F253 HydrophobicContact CZ2-CZ 3.89Å; Y251-F253 VanDerWaalsContact C-N 3.26Å; Y251-F253 PolarHBondContact O-N 2.94Å; F253-L261 HydrophobicContact CB-CD1 4.13Å; F253-I265 HydrophobicContact CB-CD1 4.44Å; F253-I265 HydrophobicContact CB-CG1 3.61Å; F253-I265 HydrophobicContact CD1-CG1 4.25Å; F253-I265 HydrophobicContact CD2-CG1 4Å; F253-I265 HydrophobicContact CG-CG1 3.68Å; F253-Y270 HydrophobicContact CE1-CD1 4.19Å; F253-Y270 HydrophobicContact CE1-CG 4.45Å; F253-Y270 HydrophobicContact CE2-CD1 4.37Å; F253-Y270 AromaticContact CZ-CD1 3.61Å; F253-Y270 HydrophobicContact CZ-CD1 3.61Å; F253-Y270 HydrophobicContact CZ-CE1 4.48Å; F253-Y270 HydrophobicContact CZ-CG 4.04Å
254	E	96.2	Very high	97.5	Very high	125 Å²	125	55.1 Å²	55.1	58%	0.584	27%	0.272	S	S	*	.			trans	-135.1	162.6	177.1	-64	-168.9	155.9	0	0	110.2	N264	E254-N264 PolarHBondContact O-ND2 2.9Å
255	G	95.8	Very high	97.5	Very high	18 Å²	18	54.8 Å²	54.8	19%	0.186	27%	0.271	C	S	.	.			trans	-169.2	145.6	173.6	0	0	0	0	0	111.1	N257	G255-N257 PolarHBondContact O-N 2.86Å; G255-N257 VanDerWaalsContact O-N 3.12Å
256	D	94.8	Very high	97.4	Very high	154 Å²	154	55 Å²	55	82%	0.824	27%	0.274	S	S	*	.	S	Bend	trans	-61.1	-23.9	-177.7	-63.3	-31.9	0	0	0	113.1
257	N	96.6	Very high	97.4	Very high	78 Å²	78	60 Å²	60	42%	0.417	30%	0.297	S	S	.	.	S	Bend	trans	-146.6	171.1	174.2	63	60.7	0	0	0	110.1	G255 Y259 K260 L261	G255-N257 PolarHBondContact O-N 2.86Å; G255-N257 VanDerWaalsContact O-N 3.12Å; N257-Y259 VanDerWaalsContact C-N 3.28Å; N257-Y259 PolarHBondContact O-N 3.5Å; N257-Y259 WeakPolarHBondContact OD1-CB 3.28Å; N257-Y259 PolarHBondContact OD1-N 2.99Å; N257-K260 PolarHBondContact O-N 3.31Å; N257-K260 PolarHBondContact OD1-N 2.84Å; N257-L261 WeakPolarHBondContact O-CB 3.48Å; N257-L261 PolarHBondContact O-N 3.44Å
258	I	95.7	Very high	97.2	Very high	66 Å²	66	60.2 Å²	60.2	34%	0.338	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-36	-176.1	-166.4	167.3	0	0	0	113.3	P215 L261 F262	P215-I258 HydrophobicContact CB-CD1 4.09Å; P215-I258 HydrophobicContact CB-CG1 4.1Å; P215-I258 HydrophobicContact CG-CD1 3.56Å; P215-I258 HydrophobicContact CG-CG1 4.12Å; I258-L261 PolarHBondContact O-N 2.68Å; I258-F262 HydrophobicContact CD1-CE2 3.93Å; I258-F262 HydrophobicContact CD1-CZ 4.15Å; I258-F262 HydrophobicContact CG1-CD2 4.03Å; I258-F262 HydrophobicContact CG1-CE2 3.7Å; I258-F262 HydrophobicContact CG1-CZ 4.06Å; I258-F262 PolarHBondContact O-N 3.32Å
259	Y	96.6	Very high	97	Very high	189 Å²	189	65.5 Å²	65.5	74%	0.741	33%	0.328	S	S	*	.	H	α-helix	trans	-67.4	-43.6	178.8	-56.8	-76.4	0	0	0	111	N257 L261 F262 E263	N257-Y259 VanDerWaalsContact C-N 3.28Å; N257-Y259 PolarHBondContact O-N 3.5Å; N257-Y259 WeakPolarHBondContact OD1-CB 3.28Å; N257-Y259 PolarHBondContact OD1-N 2.99Å; Y259-L261 VanDerWaalsContact C-N 3.34Å; Y259-F262 PolarHBondContact O-N 2.68Å; Y259-E263 WeakPolarHBondContact O-CB 3.48Å; Y259-E263 PolarHBondContact O-N 3.03Å
260	K	97.8	Very high	97	Very high	77 Å²	77	66.6 Å²	66.6	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-67.6	-37.4	177.6	-170.1	59	179	-178.3	0	112.1	N257 E263 N264	N257-K260 PolarHBondContact O-N 3.31Å; N257-K260 PolarHBondContact OD1-N 2.84Å; K260-E263 WeakPolarHBondContact CD-OE2 3.41Å; K260-E263 WeakPolarHBondContact CE-OE2 3.46Å; K260-E263 VanDerWaalsContact NZ-CD 3.26Å; K260-E263 IonicContact NZ-OE1 3.11Å; K260-E263 PolarHBondContact NZ-OE1 3.35Å; K260-E263 VanDerWaalsContact NZ-OE1 3.11Å; K260-E263 IonicContact NZ-OE2 2.74Å; K260-E263 PolarHBondContact NZ-OE2 2.97Å; K260-E263 PolarHBondContact O-N 3.32Å; K260-N264 VanDerWaalsContact O-CG 3.27Å; K260-N264 PolarHBondContact O-N 2.9Å; K260-N264 PolarHBondContact O-ND2 3.26Å
261	L	98.2	Very high	97	Very high	19 Å²	19	67.7 Å²	67.7	10%	0.099	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-49.6	174	175.9	62	0	0	0	111	P215 A216 F253 N257 I258 Y259 E263 N264 I265	P215-L261 HydrophobicContact CB-CD2 3.86Å; A216-L261 HydrophobicContact CB-CD2 4.18Å; F253-L261 HydrophobicContact CB-CD1 4.13Å; N257-L261 WeakPolarHBondContact O-CB 3.48Å; N257-L261 PolarHBondContact O-N 3.44Å; I258-L261 PolarHBondContact O-N 2.68Å; Y259-L261 VanDerWaalsContact C-N 3.34Å; L261-E263 PolarHBondContact O-N 3.08Å; L261-N264 PolarHBondContact O-N 3.14Å; L261-I265 HydrophobicContact CD1-CD1 3.93Å; L261-I265 HydrophobicContact CD1-CG1 4.31Å; L261-I265 HydrophobicContact CG-CD1 3.89Å; L261-I265 WeakPolarHBondContact O-CG1 3.23Å; L261-I265 PolarHBondContact O-N 2.94Å
262	F	98	Very high	96.9	Very high	55 Å²	55	65.3 Å²	65.3	24%	0.241	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-35.3	176.6	-72.2	-27	0	0	0	113	P215 Q218 A223 I258 Y259 N264 I265 G266	P215-F262 HydrophobicContact CB-CE1 3.8Å; P215-F262 HydrophobicContact CB-CZ 3.9Å; P215-F262 HydrophobicContact CG-CZ 4.33Å; Q218-F262 HydrophobicContact CB-CE1 4.36Å; A223-F262 HydrophobicContact CB-CB 4.12Å; A223-F262 HydrophobicContact CB-CD1 3.95Å; A223-F262 HydrophobicContact CB-CG 4.26Å; I258-F262 HydrophobicContact CD1-CE2 3.93Å; I258-F262 HydrophobicContact CD1-CZ 4.15Å; I258-F262 HydrophobicContact CG1-CD2 4.03Å; I258-F262 HydrophobicContact CG1-CE2 3.7Å; I258-F262 HydrophobicContact CG1-CZ 4.06Å; I258-F262 PolarHBondContact O-N 3.32Å; Y259-F262 PolarHBondContact O-N 2.68Å; F262-N264 VanDerWaalsContact C-N 3.31Å; F262-N264 PolarHBondContact O-N 3.3Å; F262-I265 HydrophobicContact CD1-CD1 4.18Å; F262-I265 PolarHBondContact O-N 2.89Å; F262-G266 PolarHBondContact O-N 2.84Å
263	E	98.1	Very high	96.8	Very high	84 Å²	84	66 Å²	66	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-43.7	171.4	-170.1	-160.4	147.9	0	0	111.4	Y259 K260 L261 G266 K267	Y259-E263 WeakPolarHBondContact O-CB 3.48Å; Y259-E263 PolarHBondContact O-N 3.03Å; K260-E263 WeakPolarHBondContact CD-OE2 3.41Å; K260-E263 WeakPolarHBondContact CE-OE2 3.46Å; K260-E263 VanDerWaalsContact NZ-CD 3.26Å; K260-E263 IonicContact NZ-OE1 3.11Å; K260-E263 PolarHBondContact NZ-OE1 3.35Å; K260-E263 VanDerWaalsContact NZ-OE1 3.11Å; K260-E263 IonicContact NZ-OE2 2.74Å; K260-E263 PolarHBondContact NZ-OE2 2.97Å; K260-E263 PolarHBondContact O-N 3.32Å; L261-E263 PolarHBondContact O-N 3.08Å; E263-G266 PolarHBondContact O-N 3.45Å; E263-K267 WeakPolarHBondContact O-CG 3.35Å; E263-K267 PolarHBondContact O-N 2.92Å; E263-K267 VanDerWaalsContact O-N 3.12Å; E263-K267 WeakPolarHBondContact OE1-CE 3.37Å; E263-K267 IonicContact OE1-NZ 2.73Å; E263-K267 PolarHBondContact OE1-NZ 3.34Å
264	N	98.3	Very high	96.5	Very high	45 Å²	45	74.5 Å²	74.5	24%	0.241	38%	0.375	C	S	.	.	H	α-helix	trans	-71.3	-40.5	-179.7	-69.5	-15.5	0	0	0	112	E254 K260 L261 F262 K267 G268	E254-N264 PolarHBondContact O-ND2 2.9Å; K260-N264 VanDerWaalsContact O-CG 3.27Å; K260-N264 PolarHBondContact O-N 2.9Å; K260-N264 PolarHBondContact O-ND2 3.26Å; L261-N264 PolarHBondContact O-N 3.14Å; F262-N264 VanDerWaalsContact C-N 3.31Å; F262-N264 PolarHBondContact O-N 3.3Å; N264-K267 PolarHBondContact O-N 3.5Å; N264-G268 PolarHBondContact O-N 3.01Å; N264-G268 VanDerWaalsContact O-N 3.16Å
265	I	98.5	Very high	96.3	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-44.1	172.9	-67.6	167.4	0	0	0	110.5	P215 P220 A223 W237 F253 L261 F262 K267 G268	P215-I265 WeakPolarHBondContact O-CD1 3.36Å; P220-I265 HydrophobicContact CG-CG2 4.32Å; A223-I265 HydrophobicContact CB-CB 4Å; A223-I265 HydrophobicContact CB-CG2 3.66Å; W237-I265 HydrophobicContact CZ2-CG2 4.27Å; F253-I265 HydrophobicContact CB-CD1 4.44Å; F253-I265 HydrophobicContact CB-CG1 3.61Å; F253-I265 HydrophobicContact CD1-CG1 4.25Å; F253-I265 HydrophobicContact CD2-CG1 4Å; F253-I265 HydrophobicContact CG-CG1 3.68Å; L261-I265 HydrophobicContact CD1-CD1 3.93Å; L261-I265 HydrophobicContact CD1-CG1 4.31Å; L261-I265 HydrophobicContact CG-CD1 3.89Å; L261-I265 WeakPolarHBondContact O-CG1 3.23Å; L261-I265 PolarHBondContact O-N 2.94Å; F262-I265 HydrophobicContact CD1-CD1 4.18Å; F262-I265 PolarHBondContact O-N 2.89Å; I265-K267 VanDerWaalsContact C-N 3.25Å; I265-K267 PolarHBondContact O-N 3.15Å; I265-G268 WeakPolarHBondContact O-CA 3.42Å; I265-G268 PolarHBondContact O-N 3.18Å
266	G	97.4	Very high	96.2	Very high	10 Å²	10	76.7 Å²	76.7	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-25	179.6	0	0	0	0	0	114.1	N224 F262 E263 Y290	N224-G266 VanDerWaalsContact OD1-CA 3.31Å; N224-G266 WeakPolarHBondContact OD1-CA 3.47Å; F262-G266 PolarHBondContact O-N 2.84Å; E263-G266 PolarHBondContact O-N 3.45Å; G266-Y290 WeakPolarHBondContact O-CE2 3.27Å; G266-Y290 PolarHBondContact O-OH 3.4Å
267	K	97.1	Very high	96.2	Very high	110 Å²	110	70.6 Å²	70.6	48%	0.478	36%	0.356	S	S	.	.	H	α-helix	trans	-76.1	-34.9	168.5	-72.9	173.9	-171.5	167.8	0	112.6	E263 N264 I265 D269	E263-K267 WeakPolarHBondContact O-CG 3.35Å; E263-K267 PolarHBondContact O-N 2.92Å; E263-K267 VanDerWaalsContact O-N 3.12Å; E263-K267 WeakPolarHBondContact OE1-CE 3.37Å; E263-K267 IonicContact OE1-NZ 2.73Å; E263-K267 PolarHBondContact OE1-NZ 3.34Å; N264-K267 PolarHBondContact O-N 3.5Å; I265-K267 VanDerWaalsContact C-N 3.25Å; I265-K267 PolarHBondContact O-N 3.15Å; K267-D269 VanDerWaalsContact C-N 3.28Å; K267-D269 PolarHBondContact O-N 3.49Å
268	G	94.6	Very high	96.3	Very high	17 Å²	17	72.1 Å²	72.1	18%	0.175	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	7.3	177.8	0	0	0	0	0	115	N264 I265 Y270	N264-G268 PolarHBondContact O-N 3.01Å; N264-G268 VanDerWaalsContact O-N 3.16Å; I265-G268 WeakPolarHBondContact O-CA 3.42Å; I265-G268 PolarHBondContact O-N 3.18Å; G268-Y270 PolarHBondContact O-N 3.38Å
269	D	94.8	Very high	96.4	Very high	133 Å²	133	71.9 Å²	71.9	71%	0.711	37%	0.369	S	S	*	.			trans	-80.8	114.7	178.1	-66.2	-40.5	0	0	0	110.7	K267	K267-D269 VanDerWaalsContact C-N 3.28Å; K267-D269 PolarHBondContact O-N 3.49Å
270	Y	97.6	Very high	96.5	Very high	41 Å²	41	63 Å²	63	16%	0.161	34%	0.335	C	S	.	.			trans	-142.1	162.5	171.4	71.8	-78.7	0	0	0	110.8	Y244 P252 F253 G268 V272 R285 L288	Y244-Y270 HydrophobicContact CE2-CD2 4.44Å; P252-Y270 HydrophobicContact CB-CD2 4.02Å; P252-Y270 HydrophobicContact CB-CG 4.12Å; P252-Y270 VanDerWaalsContact O-CB 3.24Å; P252-Y270 WeakPolarHBondContact O-CB 3.41Å; F253-Y270 HydrophobicContact CE1-CD1 4.19Å; F253-Y270 HydrophobicContact CE1-CG 4.45Å; F253-Y270 HydrophobicContact CE2-CD1 4.37Å; F253-Y270 AromaticContact CZ-CD1 3.61Å; F253-Y270 HydrophobicContact CZ-CD1 3.61Å; F253-Y270 HydrophobicContact CZ-CE1 4.48Å; F253-Y270 HydrophobicContact CZ-CG 4.04Å; G268-Y270 PolarHBondContact O-N 3.38Å; Y270-V272 HydrophobicContact CD2-CG2 4.2Å; Y270-V272 HydrophobicContact CE2-CG2 3.65Å; Y270-R285 VanDerWaalsContact OH-CA 3.3Å; Y270-R285 WeakPolarHBondContact OH-CA 3.17Å; Y270-L288 HydrophobicContact CD2-CD1 4.38Å; Y270-L288 HydrophobicContact CE1-CB 3.93Å; Y270-L288 HydrophobicContact CE2-CB 4.46Å; Y270-L288 HydrophobicContact CE2-CD1 3.88Å; Y270-L288 WeakPolarHBondContact OH-CB 3.45Å
271	T	96.6	Very high	96.5	Very high	112 Å²	112	60.3 Å²	60.3	69%	0.687	33%	0.325	S	S	*	.			trans	-115	150.7	174.9	56.1	0	0	0	0	109.9	Y244	Y244-T271 WeakPolarHBondContact CE2-O 3.5Å; Y244-T271 PolarHBondContact OH-O 3.23Å
272	V	96.3	Very high	96.6	Very high	19 Å²	19	63.7 Å²	63.7	12%	0.115	34%	0.344	C	S	.	.			trans	-108.6	127.3	170	-175.8	0	0	0	0	107.3	Y244 Y270 C276 S281 L284	Y244-V272 HydrophobicContact CE2-CG2 4.36Å; Y270-V272 HydrophobicContact CD2-CG2 4.2Å; Y270-V272 HydrophobicContact CE2-CG2 3.65Å; V272-C276 HydrophobicContact CG1-CB 3.76Å; V272-S281 WeakPolarHBondContact CG1-OG 3.44Å; V272-L284 HydrophobicContact CG1-CD1 3.87Å; V272-L284 HydrophobicContact CG2-CB 4.42Å; V272-L284 HydrophobicContact CG2-CD1 4.45Å
273	P	95.3	Very high	96.6	Very high	29 Å²	29	61.1 Å²	61.1	19%	0.188	33%	0.332	C	S	.	.			trans	-58	141.9	177.7	-24.1	33.6	0	0	0	111.9	Y244 T248 L250 E275 C276	Y244-P273 WeakPolarHBondContact OH-CD 3.33Å; T248-P273 HydrophobicContact CG2-CG 3.95Å; L250-P273 HydrophobicContact CD1-CG 4.31Å; P273-E275 WeakPolarHBondContact CB-OE2 3.4Å; P273-E275 PolarHBondContact O-N 3.1Å; P273-E275 VanDerWaalsContact O-N 3.16Å; P273-C276 WeakPolarHBondContact O-CB 3.22Å; P273-C276 PolarHBondContact O-N 3.12Å
274	E	92.7	Very high	96.6	Very high	183 Å²	183	57.1 Å²	57.1	86%	0.855	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-60.4	-28.7	-177	-67.6	-173.8	176.9	0	0	112.1	C276 G277	E274-C276 PolarHBondContact O-N 3.46Å; E274-C276 VanDerWaalsContact O-N 3.17Å; E274-G277 PolarHBondContact O-N 2.95Å
275	E	91.8	Very high	96.7	Very high	169 Å²	169	61 Å²	61	79%	0.79	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-61.4	-21.9	178.1	-59.4	81.1	-178.9	0	0	113.1	P273 G277	P273-E275 WeakPolarHBondContact CB-OE2 3.4Å; P273-E275 PolarHBondContact O-N 3.1Å; P273-E275 VanDerWaalsContact O-N 3.16Å; E275-G277 PolarHBondContact O-N 3.3Å
276	C	93.5	Very high	96.7	Very high	20 Å²	20	61.3 Å²	61.3	14%	0.135	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-64.5	-24.5	174.5	-67.6	0	0	0	0	112	T248 V272 P273 E274 L280	T248-C276 VanDerWaalsContact CG2-SG 3.59Å; V272-C276 HydrophobicContact CG1-CB 3.76Å; P273-C276 WeakPolarHBondContact O-CB 3.22Å; P273-C276 PolarHBondContact O-N 3.12Å; E274-C276 PolarHBondContact O-N 3.46Å; E274-C276 VanDerWaalsContact O-N 3.17Å; C276-L280 HydrophobicContact CB-CB 4.12Å; C276-L280 HydrophobicContact CB-CD2 3.9Å; C276-L280 HydrophobicContact CB-CG 4.09Å; C276-L280 VanDerWaalsContact O-CB 3.29Å; C276-L280 WeakPolarHBondContact O-CB 3.43Å
277	G	96.1	Very high	96.7	Very high	26 Å²	26	60.8 Å²	60.8	27%	0.268	32%	0.323	S	S	.	.	H	α-helix	trans	67.7	175.2	-172.7	0	0	0	0	0	113	E274 E275 L279 S281	E274-G277 PolarHBondContact O-N 2.95Å; E275-G277 PolarHBondContact O-N 3.3Å; G277-L279 PolarHBondContact O-N 3.29Å; G277-S281 VanDerWaalsContact O-CB 3.23Å; G277-S281 WeakPolarHBondContact O-CB 3.24Å; G277-S281 PolarHBondContact O-N 2.93Å; G277-S281 VanDerWaalsContact O-N 3.17Å; G277-S281 PolarHBondContact O-OG 3.35Å
278	P	97.5	Very high	96.8	Very high	111 Å²	111	55.8 Å²	55.8	72%	0.721	30%	0.301	S	S	*	.	H	α-helix	trans	-67.9	-39.3	-169.6	23.3	-33	0	0	0	113.2	D282	P278-D282 WeakPolarHBondContact O-CB 3.12Å; P278-D282 PolarHBondContact O-N 3.15Å
279	L	98.1	Very high	97	Very high	61 Å²	61	58.7 Å²	58.7	32%	0.319	31%	0.31	S	S	.	.	H	α-helix	trans	-70.3	-43.2	-175.3	-65.5	-179.5	0	0	0	112.8	G277 L283 H304 N305 W306 K309	G277-L279 PolarHBondContact O-N 3.29Å; L279-L283 PolarHBondContact O-N 2.93Å; L279-H304 PolarHBondContact O-CE1 3.47Å; L279-N305 HydrophobicContact CD2-CB 3.99Å; L279-W306 HydrophobicContact CB-CB 4.03Å; L279-W306 HydrophobicContact CB-CG 4.42Å; L279-K309 HydrophobicContact CD1-CD 4.09Å
280	L	98.5	Very high	97.2	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-70.5	-40.4	177.7	179.5	53.8	0	0	0	110.4	L243 T247 C276 D282 L283 L284 W306	L243-L280 HydrophobicContact CD1-CD1 4.29Å; L243-L280 HydrophobicContact CD2-CD1 3.8Å; L243-L280 HydrophobicContact CG-CD1 4.01Å; T247-L280 HydrophobicContact CG2-CD2 3.85Å; C276-L280 HydrophobicContact CB-CB 4.12Å; C276-L280 HydrophobicContact CB-CD2 3.9Å; C276-L280 HydrophobicContact CB-CG 4.09Å; C276-L280 VanDerWaalsContact O-CB 3.29Å; C276-L280 WeakPolarHBondContact O-CB 3.43Å; L280-D282 VanDerWaalsContact C-N 3.33Å; L280-D282 PolarHBondContact O-N 2.9Å; L280-L283 PolarHBondContact O-N 3.11Å; L280-L284 HydrophobicContact CD1-CD1 4.14Å; L280-L284 HydrophobicContact CD1-CG 4.05Å; L280-L284 HydrophobicContact CG-CD1 3.92Å; L280-L284 HydrophobicContact CG-CG 4.32Å; L280-L284 WeakPolarHBondContact O-CB 3.41Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.26Å; L280-W306 HydrophobicContact CB-CG 4.4Å; L280-W306 HydrophobicContact CD1-CD2 4.09Å; L280-W306 HydrophobicContact CD1-CH2 4.35Å; L280-W306 HydrophobicContact CD1-CZ2 3.91Å; L280-W306 HydrophobicContact CD2-CZ2 4.48Å
281	S	98.5	Very high	97.2	Very high	20 Å²	20	58.1 Å²	58.1	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-57.6	-43.8	175.8	-62.5	0	0	0	0	112.6	V272 G277 L284 R285	V272-S281 WeakPolarHBondContact CG1-OG 3.44Å; G277-S281 VanDerWaalsContact O-CB 3.23Å; G277-S281 WeakPolarHBondContact O-CB 3.24Å; G277-S281 PolarHBondContact O-N 2.93Å; G277-S281 VanDerWaalsContact O-N 3.17Å; G277-S281 PolarHBondContact O-OG 3.35Å; S281-L284 PolarHBondContact O-N 2.91Å; S281-R285 WeakPolarHBondContact O-CB 3.36Å; S281-R285 VanDerWaalsContact O-CG 3.25Å; S281-R285 WeakPolarHBondContact O-CG 3.48Å; S281-R285 PolarHBondContact O-N 2.83Å
282	D	98.6	Very high	97.2	Very high	91 Å²	91	54.6 Å²	54.6	49%	0.487	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-43.7	177.5	-168.9	56.2	0	0	0	112	P278 L280 R285 G286 H304	P278-D282 WeakPolarHBondContact O-CB 3.12Å; P278-D282 PolarHBondContact O-N 3.15Å; L280-D282 VanDerWaalsContact C-N 3.33Å; L280-D282 PolarHBondContact O-N 2.9Å; D282-R285 PolarHBondContact O-N 3.18Å; D282-G286 PolarHBondContact O-N 3.42Å; D282-H304 IonicContact OD2-CD2 2.82Å; D282-H304 IonicContact OD2-NE2 3.59Å; D282-H304 PolarHBondContact OD2-NE2 3.2Å
283	L	98.9	Very high	97.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-48.4	175.4	179.5	57.6	0	0	0	112	F155 L243 L279 L280 R285 G286 M287 F296 I301 H304 W306 V307	F155-L283 HydrophobicContact CE1-CD2 4.18Å; L243-L283 HydrophobicContact CD2-CD2 3.66Å; L243-L283 HydrophobicContact CD2-CG 4.16Å; L279-L283 PolarHBondContact O-N 2.93Å; L280-L283 PolarHBondContact O-N 3.11Å; L283-R285 VanDerWaalsContact C-N 3.29Å; L283-R285 PolarHBondContact O-N 2.89Å; L283-G286 PolarHBondContact O-N 3.09Å; L283-M287 HydrophobicContact CD1-CG 4.11Å; L283-M287 HydrophobicContact CD1-SD 3.92Å; L283-M287 HydrophobicContact CG-SD 4.01Å; L283-M287 WeakPolarHBondContact O-CG 3.34Å; L283-M287 PolarHBondContact O-N 2.9Å; L283-F296 HydrophobicContact CD1-CD2 4.15Å; L283-F296 HydrophobicContact CD1-CE2 4.17Å; L283-I301 HydrophobicContact CD1-CG1 4.27Å; L283-I301 HydrophobicContact CD1-CG2 4.22Å; L283-H304 HydrophobicContact CD1-CB 4.02Å; L283-W306 HydrophobicContact CD2-CB 4.25Å; L283-W306 HydrophobicContact CD2-CD2 4.12Å; L283-W306 HydrophobicContact CD2-CE3 3.48Å; L283-W306 VanDerWaalsContact CD2-CE3 3.48Å; L283-W306 HydrophobicContact CD2-CG 4.46Å; L283-W306 HydrophobicContact CD2-CZ3 4.14Å; L283-V307 HydrophobicContact CD2-CG2 3.81Å
284	L	98.8	Very high	97.5	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-41.5	178.5	-72.6	171.6	0	0	0	110.9	L243 Y244 V272 L280 S281 M287 L288	L243-L284 HydrophobicContact CB-CD2 4.09Å; L243-L284 HydrophobicContact CD2-CD2 4.04Å; L243-L284 HydrophobicContact CG-CD2 3.97Å; Y244-L284 HydrophobicContact CD2-CD1 3.99Å; Y244-L284 HydrophobicContact CD2-CD2 4.5Å; V272-L284 HydrophobicContact CG1-CD1 3.87Å; V272-L284 HydrophobicContact CG2-CB 4.42Å; V272-L284 HydrophobicContact CG2-CD1 4.45Å; L280-L284 HydrophobicContact CD1-CD1 4.14Å; L280-L284 HydrophobicContact CD1-CG 4.05Å; L280-L284 HydrophobicContact CG-CD1 3.92Å; L280-L284 HydrophobicContact CG-CG 4.32Å; L280-L284 WeakPolarHBondContact O-CB 3.41Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.26Å; S281-L284 PolarHBondContact O-N 2.91Å; L284-M287 PolarHBondContact O-N 2.78Å; L284-L288 VanDerWaalsContact O-CB 3.27Å; L284-L288 WeakPolarHBondContact O-CB 3.14Å; L284-L288 WeakPolarHBondContact O-CG 3.45Å; L284-L288 PolarHBondContact O-N 3.16Å
285	R	98.6	Very high	97.8	Very high	127 Å²	127	54.5 Å²	54.5	48%	0.479	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-46.4	175.4	-74.3	176.2	-169	-71.7	-1.3	112.7	Y270 S281 D282 L283 M287 L288 E289	Y270-R285 VanDerWaalsContact OH-CA 3.3Å; Y270-R285 WeakPolarHBondContact OH-CA 3.17Å; S281-R285 WeakPolarHBondContact O-CB 3.36Å; S281-R285 VanDerWaalsContact O-CG 3.25Å; S281-R285 WeakPolarHBondContact O-CG 3.48Å; S281-R285 PolarHBondContact O-N 2.83Å; D282-R285 PolarHBondContact O-N 3.18Å; L283-R285 VanDerWaalsContact C-N 3.29Å; L283-R285 PolarHBondContact O-N 2.89Å; R285-M287 PolarHBondContact O-N 2.88Å; R285-L288 CarbonylContact O-C 3.57Å; R285-E289 WeakPolarHBondContact O-CG 3.33Å; R285-E289 PolarHBondContact O-N 2.92Å; R285-E289 VanDerWaalsContact O-N 3.15Å
286	G	98.8	Very high	98.1	Very high	6 Å²	6	48.6 Å²	48.6	6%	0.062	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-31.8	177.6	0	0	0	0	0	114.4	D282 L283 R295 F296	D282-G286 PolarHBondContact O-N 3.42Å; L283-G286 PolarHBondContact O-N 3.09Å; G286-R295 WeakPolarHBondContact O-CA 3.18Å; G286-F296 PolarHBondContact O-N 3.44Å
287	M	98.9	Very high	98.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-79.9	-34.3	177.4	-68.7	-177.3	73.2	0	0	113.3	F155 I236 A239 G240 L243 L283 L284 R285 E289 R295 F296 I301	F155-M287 HydrophobicContact CE2-CE 3.94Å; F155-M287 HydrophobicContact CE2-SD 4.28Å; F155-M287 HydrophobicContact CZ-CE 3.65Å; F155-M287 HydrophobicContact CZ-SD 3.61Å; I236-M287 HydrophobicContact CG2-CB 4.36Å; I236-M287 HydrophobicContact CG2-CE 4.32Å; I236-M287 HydrophobicContact CG2-CG 4.36Å; I236-M287 WeakPolarHBondContact O-CE 3.41Å; A239-M287 HydrophobicContact CB-CE 3.78Å; G240-M287 VanDerWaalsContact N-CE 3.3Å; L243-M287 HydrophobicContact CD2-SD 4.34Å; L283-M287 HydrophobicContact CD1-CG 4.11Å; L283-M287 HydrophobicContact CD1-SD 3.92Å; L283-M287 HydrophobicContact CG-SD 4.01Å; L283-M287 WeakPolarHBondContact O-CG 3.34Å; L283-M287 PolarHBondContact O-N 2.9Å; L284-M287 PolarHBondContact O-N 2.78Å; R285-M287 PolarHBondContact O-N 2.88Å; M287-E289 VanDerWaalsContact C-N 3.3Å; M287-R295 VanDerWaalsContact O-CD 3.26Å; M287-R295 WeakPolarHBondContact O-CD 3.44Å; M287-R295 VanDerWaalsContact O-CG 3.23Å; M287-R295 WeakPolarHBondContact O-CG 3.46Å; M287-F296 HydrophobicContact CG-CD2 4.35Å; M287-I301 HydrophobicContact CE-CD1 3.81Å; M287-I301 HydrophobicContact CG-CD1 3.98Å; M287-I301 HydrophobicContact CG-CG1 3.98Å; M287-I301 HydrophobicContact SD-CD1 4.09Å; M287-I301 HydrophobicContact SD-CG1 4.18Å
288	L	98.8	Very high	98.5	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	31.8	177.6	-59.2	176.4	0	0	0	111.2	W237 V241 P252 Y270 L284 R285	W237-L288 HydrophobicContact CD2-CD2 3.82Å; W237-L288 HydrophobicContact CE3-CB 4.4Å; W237-L288 HydrophobicContact CE3-CD2 4.03Å; W237-L288 HydrophobicContact CG-CD2 4.27Å; W237-L288 HydrophobicContact CZ2-CD2 4.35Å; W237-L288 HydrophobicContact CZ3-CB 4.16Å; W237-L288 HydrophobicContact CZ3-CD2 4.37Å; W237-L288 WeakPolarHBondContact CZ3-O 3.3Å; V241-L288 HydrophobicContact CG2-CD2 3.74Å; P252-L288 HydrophobicContact CB-CD1 4.14Å; P252-L288 HydrophobicContact CG-CD1 4.16Å; Y270-L288 HydrophobicContact CD2-CD1 4.38Å; Y270-L288 HydrophobicContact CE1-CB 3.93Å; Y270-L288 HydrophobicContact CE2-CB 4.46Å; Y270-L288 HydrophobicContact CE2-CD1 3.88Å; Y270-L288 WeakPolarHBondContact OH-CB 3.45Å; L284-L288 VanDerWaalsContact O-CB 3.27Å; L284-L288 WeakPolarHBondContact O-CB 3.14Å; L284-L288 WeakPolarHBondContact O-CG 3.45Å; L284-L288 PolarHBondContact O-N 3.16Å; R285-L288 CarbonylContact O-C 3.57Å
289	E	98.6	Very high	98.5	Very high	78 Å²	78	48.4 Å²	48.4	36%	0.364	25%	0.248	S	C	.	.			trans	-71.2	137.5	173.4	-103.7	-51.7	176.6	0	0	110.5	R285 M287 K294 R295	R285-E289 WeakPolarHBondContact O-CG 3.33Å; R285-E289 PolarHBondContact O-N 2.92Å; R285-E289 VanDerWaalsContact O-N 3.15Å; M287-E289 VanDerWaalsContact C-N 3.3Å; E289-K294 HydrophobicContact CG-CB 4.43Å; E289-R295 HydrophobicContact CB-CB 3.97Å; E289-R295 HydrophobicContact CB-CG 4.34Å; E289-R295 PolarHBondContact O-NE 2.94Å; E289-R295 PolarHBondContact O-NH2 2.76Å; E289-R295 VanDerWaalsContact O-NH2 3.14Å
290	Y	98.4	Very high	98.5	Very high	102 Å²	102	48.9 Å²	48.9	40%	0.4	25%	0.251	S	S	.	.	S	Bend	trans	-65.2	-50.7	-174.1	-173.9	-90.6	0	0	0	111.3	P220 N224 G266 P292 R295	P220-Y290 HydrophobicContact CB-CD2 3.89Å; P220-Y290 HydrophobicContact CB-CE2 3.6Å; P220-Y290 HydrophobicContact CG-CD2 3.82Å; P220-Y290 HydrophobicContact CG-CE2 4.03Å; N224-Y290 PolarHBondContact ND2-OH 3.27Å; N224-Y290 VanDerWaalsContact ND2-OH 3.11Å; G266-Y290 WeakPolarHBondContact O-CE2 3.27Å; G266-Y290 PolarHBondContact O-OH 3.4Å; Y290-P292 WeakPolarHBondContact O-CD 3.44Å; Y290-R295 PolarHBondContact O-NH2 3.2Å
291	D	97.9	Very high	98.5	Very high	61 Å²	61	48.8 Å²	48.8	33%	0.326	25%	0.25	S	S	.	.	S	Bend	trans	-77.1	114.8	178.3	178.6	-5.3	0	0	0	110	A293 K294 R295	D291-A293 PolarHBondContact O-N 2.82Å; D291-A293 VanDerWaalsContact O-N 3.08Å; D291-A293 WeakPolarHBondContact OD1-CB 3.45Å; D291-A293 PolarHBondContact OD1-N 3.1Å; D291-K294 HydrophobicContact CB-CB 4.34Å; D291-K294 HydrophobicContact CB-CD 4.18Å; D291-K294 HydrophobicContact CB-CG 4.25Å; D291-K294 PolarHBondContact O-N 3.47Å; D291-K294 WeakPolarHBondContact OD2-CE 3.44Å; D291-K294 IonicContact OD2-NZ 2.79Å; D291-R295 PolarHBondContact O-N 3.24Å
292	P	97.6	Very high	98.5	Very high	38 Å²	38	52.2 Å²	52.2	25%	0.247	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.9	-179.4	-25.2	35.2	0	0	0	114	K233 Y290 K294	K233-P292 HydrophobicContact CB-CB 4.26Å; K233-P292 WeakPolarHBondContact CD-O 3.46Å; K233-P292 VanDerWaalsContact CE-O 3.28Å; K233-P292 WeakPolarHBondContact CE-O 3.38Å; K233-P292 HydrophobicContact CG-CB 4.32Å; Y290-P292 WeakPolarHBondContact O-CD 3.44Å; P292-K294 VanDerWaalsContact C-N 3.34Å
293	A	97.7	Very high	98.5	Very high	87 Å²	87	53.7 Å²	53.7	72%	0.719	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.8	178.1	0	0	0	0	0	112.6	D291	D291-A293 PolarHBondContact O-N 2.82Å; D291-A293 VanDerWaalsContact O-N 3.08Å; D291-A293 WeakPolarHBondContact OD1-CB 3.45Å; D291-A293 PolarHBondContact OD1-N 3.1Å
294	K	98.4	Very high	98.5	Very high	140 Å²	140	54.5 Å²	54.5	61%	0.609	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-24.1	176.1	-63.1	178.7	-169.9	167.8	0	112.7	E289 D291 P292	E289-K294 HydrophobicContact CG-CB 4.43Å; D291-K294 HydrophobicContact CB-CB 4.34Å; D291-K294 HydrophobicContact CB-CD 4.18Å; D291-K294 HydrophobicContact CB-CG 4.25Å; D291-K294 PolarHBondContact O-N 3.47Å; D291-K294 WeakPolarHBondContact OD2-CE 3.44Å; D291-K294 IonicContact OD2-NZ 2.79Å; P292-K294 VanDerWaalsContact C-N 3.34Å
295	R	98.8	Very high	98.5	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.008	29%	0.294	C	S	.	.	S	Bend	trans	-55	140.8	175.1	-166.6	-178.4	-57.1	148.6	6.7	110.4	E221 K233 I236 G286 M287 E289 Y290 D291	E221-R295 IonicContact OE1-CZ 2.62Å; E221-R295 IonicContact OE1-NH1 2.77Å; E221-R295 PolarHBondContact OE1-NH1 3.17Å; E221-R295 IonicContact OE1-NH2 3.48Å; E221-R295 PolarHBondContact OE1-NH2 2.97Å; E221-R295 IonicContact OE2-CZ 2.88Å; E221-R295 IonicContact OE2-NH1 3.48Å; E221-R295 IonicContact OE2-NH2 3.91Å; E221-R295 PolarHBondContact OE2-NH2 2.95Å; K233-R295 HydrophobicContact CD-CB 4.26Å; K233-R295 PolarHBondContact NZ-O 3.11Å; K233-R295 PolarHBondContact O-NH1 2.87Å; I236-R295 HydrophobicContact CG2-CG 4.14Å; G286-R295 WeakPolarHBondContact O-CA 3.18Å; M287-R295 VanDerWaalsContact O-CD 3.26Å; M287-R295 WeakPolarHBondContact O-CD 3.44Å; M287-R295 VanDerWaalsContact O-CG 3.23Å; M287-R295 WeakPolarHBondContact O-CG 3.46Å; E289-R295 HydrophobicContact CB-CB 3.97Å; E289-R295 HydrophobicContact CB-CG 4.34Å; E289-R295 PolarHBondContact O-NE 2.94Å; E289-R295 PolarHBondContact O-NH2 2.76Å; E289-R295 VanDerWaalsContact O-NH2 3.14Å; Y290-R295 PolarHBondContact O-NH2 3.2Å; D291-R295 PolarHBondContact O-N 3.24Å
296	F	98.8	Very high	98.5	Very high	45 Å²	45	53.6 Å²	53.6	20%	0.197	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-57.7	148.3	-177.2	-76.5	-6.7	0	0	0	112.8	K233 L283 G286 M287 N300 I301 H304	K233-F296 PolarHBondContact NZ-O 3.46Å; L283-F296 HydrophobicContact CD1-CD2 4.15Å; L283-F296 HydrophobicContact CD1-CE2 4.17Å; G286-F296 PolarHBondContact O-N 3.44Å; M287-F296 HydrophobicContact CG-CD2 4.35Å; F296-N300 HydrophobicContact CB-CB 3.87Å; F296-N300 HydrophobicContact CD1-CB 3.92Å; F296-N300 HydrophobicContact CD2-CB 4.35Å; F296-N300 HydrophobicContact CG-CB 3.8Å; F296-I301 HydrophobicContact CB-CD1 4.4Å; F296-I301 HydrophobicContact CB-CG1 3.94Å; F296-I301 HydrophobicContact CD2-CG1 4.16Å; F296-H304 AromaticContact CE2-CD2 3.96Å
297	S	98.8	Very high	98.5	Very high	41 Å²	41	54.3 Å²	54.3	29%	0.287	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-86.2	168.3	159.6	66.9	0	0	0	0	110.2	Q299 N300 I301	S297-Q299 PolarHBondContact O-N 3.03Å; S297-Q299 PolarHBondContact OG-N 3.13Å; S297-N300 WeakPolarHBondContact CB-OD1 3.41Å; S297-N300 PolarHBondContact N-OD1 3.03Å; S297-N300 PolarHBondContact O-N 3.41Å; S297-N300 VanDerWaalsContact O-N 3.11Å; S297-N300 PolarHBondContact OG-N 2.95Å; S297-N300 VanDerWaalsContact OG-N 3.17Å; S297-N300 PolarHBondContact OG-OD1 3.15Å; S297-I301 WeakPolarHBondContact O-CG1 3.48Å; S297-I301 PolarHBondContact O-N 3.43Å
298	I	98.6	Very high	98.4	Very high	18 Å²	18	63 Å²	63	9%	0.092	31%	0.308	C	S	.	.	H	α-helix	trans	-52.1	-42.1	168.7	-70.6	-175.5	0	0	0	111	I159 L162 E163 H166 I236 N300 I301 R302	I159-I298 HydrophobicContact CG2-CG2 4.02Å; L162-I298 HydrophobicContact CB-CD1 4.16Å; E163-I298 VanDerWaalsContact CA-CD1 3.46Å; E163-I298 HydrophobicContact CB-CD1 3.97Å; E163-I298 HydrophobicContact CB-CG2 3.98Å; E163-I298 HydrophobicContact CG-CG2 4.04Å; H166-I298 WeakPolarHBondContact ND1-CD1 3.45Å; I236-I298 HydrophobicContact CD1-CG1 3.68Å; I298-N300 PolarHBondContact O-N 3.26Å; I298-I301 WeakPolarHBondContact O-CB 3.38Å; I298-I301 PolarHBondContact O-N 3.3Å; I298-R302 HydrophobicContact CG2-CG 4.16Å; I298-R302 WeakPolarHBondContact O-CG 3.22Å; I298-R302 PolarHBondContact O-N 3.01Å
299	Q	98.4	Very high	98.2	Very high	93 Å²	93	67.9 Å²	67.9	44%	0.435	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-40.1	179.4	-64.6	-54.9	-33.7	0	0	112.4	E163 S297 I301 R302 Q303	E163-Q299 PolarHBondContact OE1-NE2 2.9Å; S297-Q299 PolarHBondContact O-N 3.03Å; S297-Q299 PolarHBondContact OG-N 3.13Å; Q299-I301 VanDerWaalsContact C-N 3.33Å; Q299-I301 PolarHBondContact O-N 3.26Å; Q299-R302 PolarHBondContact O-N 3.24Å; Q299-Q303 WeakPolarHBondContact O-CB 3.48Å; Q299-Q303 VanDerWaalsContact O-CG 3.27Å; Q299-Q303 WeakPolarHBondContact O-CG 3.48Å; Q299-Q303 PolarHBondContact O-N 3.45Å
300	N	98.7	Very high	98	Very high	71 Å²	71	73.3 Å²	73.3	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-61.9	-43	173.9	-59.5	119.5	0	0	0	111.2	F296 S297 I298 Q303 H304	F296-N300 HydrophobicContact CB-CB 3.87Å; F296-N300 HydrophobicContact CD1-CB 3.92Å; F296-N300 HydrophobicContact CD2-CB 4.35Å; F296-N300 HydrophobicContact CG-CB 3.8Å; S297-N300 WeakPolarHBondContact CB-OD1 3.41Å; S297-N300 PolarHBondContact N-OD1 3.03Å; S297-N300 PolarHBondContact O-N 3.41Å; S297-N300 VanDerWaalsContact O-N 3.11Å; S297-N300 PolarHBondContact OG-N 2.95Å; S297-N300 VanDerWaalsContact OG-N 3.17Å; S297-N300 PolarHBondContact OG-OD1 3.15Å; I298-N300 PolarHBondContact O-N 3.26Å; N300-Q303 PolarHBondContact O-N 2.68Å; N300-H304 PolarHBondContact O-N 3.41Å
301	I	98.8	Very high	97.8	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-47.4	178	-65.7	159.9	0	0	0	111	F155 I159 I236 L283 M287 F296 S297 I298 Q299 Q303 H304 V307	F155-I301 HydrophobicContact CE1-CG2 3.83Å; F155-I301 HydrophobicContact CZ-CG2 4.08Å; I159-I301 HydrophobicContact CD1-CD1 4.28Å; I159-I301 HydrophobicContact CD1-CG2 4.04Å; I159-I301 HydrophobicContact CG1-CG2 3.99Å; I159-I301 HydrophobicContact CG2-CG2 4.47Å; I236-I301 HydrophobicContact CD1-CD1 3.58Å; I236-I301 HydrophobicContact CG1-CD1 4.41Å; I236-I301 HydrophobicContact CG2-CD1 4Å; L283-I301 HydrophobicContact CD1-CG1 4.27Å; L283-I301 HydrophobicContact CD1-CG2 4.22Å; M287-I301 HydrophobicContact CE-CD1 3.81Å; M287-I301 HydrophobicContact CG-CD1 3.98Å; M287-I301 HydrophobicContact CG-CG1 3.98Å; M287-I301 HydrophobicContact SD-CD1 4.09Å; M287-I301 HydrophobicContact SD-CG1 4.18Å; F296-I301 HydrophobicContact CB-CD1 4.4Å; F296-I301 HydrophobicContact CB-CG1 3.94Å; F296-I301 HydrophobicContact CD2-CG1 4.16Å; S297-I301 WeakPolarHBondContact O-CG1 3.48Å; S297-I301 PolarHBondContact O-N 3.43Å; I298-I301 WeakPolarHBondContact O-CB 3.38Å; I298-I301 PolarHBondContact O-N 3.3Å; Q299-I301 VanDerWaalsContact C-N 3.33Å; Q299-I301 PolarHBondContact O-N 3.26Å; I301-Q303 VanDerWaalsContact C-N 3.26Å; I301-Q303 PolarHBondContact O-N 3.19Å; I301-H304 WeakPolarHBondContact O-CB 3.33Å; I301-H304 PolarHBondContact O-N 2.88Å; I301-H304 VanDerWaalsContact O-N 3.1Å; I301-V307 HydrophobicContact CG2-CG2 4.07Å; I301-V307 WeakPolarHBondContact O-CB 3.34Å; I301-V307 VanDerWaalsContact O-CG2 3.26Å; I301-V307 WeakPolarHBondContact O-CG2 3.49Å
302	R	98.3	Very high	97.6	Very high	93 Å²	93	71 Å²	71	35%	0.351	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-35.9	179.4	-69.7	-174.3	75.6	84	13.9	112.6	I159 N160 E163 I298 Q299 H304 R308	I159-R302 HydrophobicContact CG2-CG 4.07Å; N160-R302 PolarHBondContact OD1-NH1 2.95Å; E163-R302 IonicContact OE2-CZ 2.57Å; E163-R302 IonicContact OE2-NE 2.79Å; E163-R302 IonicContact OE2-NH1 2.8Å; E163-R302 PolarHBondContact OE2-NH1 2.83Å; I298-R302 HydrophobicContact CG2-CG 4.16Å; I298-R302 WeakPolarHBondContact O-CG 3.22Å; I298-R302 PolarHBondContact O-N 3.01Å; Q299-R302 PolarHBondContact O-N 3.24Å; R302-H304 VanDerWaalsContact C-N 3.31Å; R302-R308 WeakPolarHBondContact O-CG 3.48Å
303	Q	98.4	Very high	97.3	Very high	121 Å²	121	74 Å²	74	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-80.3	-15.1	179.3	-68.3	174.6	11.1	0	0	112.9	Q299 N300 I301 R308	Q299-Q303 WeakPolarHBondContact O-CB 3.48Å; Q299-Q303 VanDerWaalsContact O-CG 3.27Å; Q299-Q303 WeakPolarHBondContact O-CG 3.48Å; Q299-Q303 PolarHBondContact O-N 3.45Å; N300-Q303 PolarHBondContact O-N 2.68Å; I301-Q303 VanDerWaalsContact C-N 3.26Å; I301-Q303 PolarHBondContact O-N 3.19Å; Q303-R308 VanDerWaalsContact O-CD 3.23Å; Q303-R308 WeakPolarHBondContact O-CD 3.21Å
304	H	98.8	Very high	96.8	Very high	17 Å²	17	74.1 Å²	74.1	8%	0.079	37%	0.365	C	S	.	.	S	Bend	trans	-62.1	138.3	-177.1	-167.2	-86.6	0	0	0	112.3	L279 D282 L283 F296 N300 I301 R302 W306 V307 R308	L279-H304 PolarHBondContact O-CE1 3.47Å; D282-H304 IonicContact OD2-CD2 2.82Å; D282-H304 IonicContact OD2-NE2 3.59Å; D282-H304 PolarHBondContact OD2-NE2 3.2Å; L283-H304 HydrophobicContact CD1-CB 4.02Å; F296-H304 AromaticContact CE2-CD2 3.96Å; N300-H304 PolarHBondContact O-N 3.41Å; I301-H304 WeakPolarHBondContact O-CB 3.33Å; I301-H304 PolarHBondContact O-N 2.88Å; I301-H304 VanDerWaalsContact O-N 3.1Å; R302-H304 VanDerWaalsContact C-N 3.31Å; H304-W306 VanDerWaalsContact C-N 3.29Å; H304-W306 WeakPolarHBondContact ND1-CB 3.28Å; H304-W306 PolarHBondContact ND1-N 3.2Å; H304-W306 VanDerWaalsContact ND1-N 3.11Å; H304-W306 PolarHBondContact O-N 3.43Å; H304-V307 HydrophobicContact CB-CG2 4.44Å; H304-V307 PolarHBondContact O-N 3.4Å; H304-R308 PolarHBondContact O-N 3.25Å
305	N	98.4	Very high	96.6	Very high	102 Å²	102	71.8 Å²	71.8	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-60.2	-35.7	-174.3	-74.5	-31	0	0	0	113.2	L279 V307 R308 K309	L279-N305 HydrophobicContact CD2-CB 3.99Å; N305-V307 VanDerWaalsContact C-N 3.31Å; N305-V307 PolarHBondContact O-N 2.83Å; N305-R308 PolarHBondContact O-N 2.64Å; N305-K309 WeakPolarHBondContact O-CB 3.31Å; N305-K309 PolarHBondContact O-N 2.91Å
306	W	98.6	Very high	96.4	Very high	7 Å²	7	82.7 Å²	82.7	3%	0.027	40%	0.397	C	S	.	.	H	α-helix	trans	-62	-37.4	175.5	-170.6	88.5	0	0	0	112.8	V148 H152 F155 L243 L279 L280 L283 H304 H311	V148-W306 HydrophobicContact CG1-CZ2 4.07Å; H152-W306 HydrophobicContact CB-CH2 3.74Å; H152-W306 HydrophobicContact CB-CZ2 4.12Å; H152-W306 HydrophobicContact CB-CZ3 4.27Å; H152-W306 AromaticContact CD2-CE3 3.98Å; H152-W306 AromaticContact CD2-CZ3 3.76Å; H152-W306 PolarHBondContact CD2-O 2.96Å; F155-W306 AromaticContact CD1-CZ3 3.86Å; F155-W306 HydrophobicContact CD1-CZ3 3.86Å; F155-W306 HydrophobicContact CG-CZ3 4.41Å; L243-W306 HydrophobicContact CD1-CH2 3.68Å; L243-W306 HydrophobicContact CD1-CZ2 4.49Å; L243-W306 HydrophobicContact CD1-CZ3 4.02Å; L243-W306 HydrophobicContact CD2-CZ3 4.28Å; L279-W306 HydrophobicContact CB-CB 4.03Å; L279-W306 HydrophobicContact CB-CG 4.42Å; L280-W306 HydrophobicContact CB-CG 4.4Å; L280-W306 HydrophobicContact CD1-CD2 4.09Å; L280-W306 HydrophobicContact CD1-CH2 4.35Å; L280-W306 HydrophobicContact CD1-CZ2 3.91Å; L280-W306 HydrophobicContact CD2-CZ2 4.48Å; L283-W306 HydrophobicContact CD2-CB 4.25Å; L283-W306 HydrophobicContact CD2-CD2 4.12Å; L283-W306 HydrophobicContact CD2-CE3 3.48Å; L283-W306 VanDerWaalsContact CD2-CE3 3.48Å; L283-W306 HydrophobicContact CD2-CG 4.46Å; L283-W306 HydrophobicContact CD2-CZ3 4.14Å; H304-W306 VanDerWaalsContact C-N 3.29Å; H304-W306 WeakPolarHBondContact ND1-CB 3.28Å; H304-W306 PolarHBondContact ND1-N 3.2Å; H304-W306 VanDerWaalsContact ND1-N 3.11Å; H304-W306 PolarHBondContact O-N 3.43Å; W306-H311 AromaticContact CD1-CE1 3.79Å; W306-H311 AromaticContact CE2-NE2 3.9Å; W306-H311 AromaticContact NE1-CE1 3.54Å; W306-H311 AromaticContact NE1-NE2 3.85Å; W306-H311 PolarHBondContact O-NE2 2.8Å
307	V	98.3	Very high	96.3	Very high	20 Å²	20	84.1 Å²	84.1	12%	0.121	41%	0.411	C	S	.	.	H	α-helix	trans	-76.7	-40.1	-179.6	177.7	0	0	0	0	110.9	H152 F155 L283 I301 H304 N305	H152-V307 PolarHBondContact NE2-O 2.91Å; F155-V307 HydrophobicContact CD1-CG2 4.47Å; F155-V307 HydrophobicContact CE1-CG2 4.13Å; L283-V307 HydrophobicContact CD2-CG2 3.81Å; I301-V307 HydrophobicContact CG2-CG2 4.07Å; I301-V307 WeakPolarHBondContact O-CB 3.34Å; I301-V307 VanDerWaalsContact O-CG2 3.26Å; I301-V307 WeakPolarHBondContact O-CG2 3.49Å; H304-V307 HydrophobicContact CB-CG2 4.44Å; H304-V307 PolarHBondContact O-N 3.4Å; N305-V307 VanDerWaalsContact C-N 3.31Å; N305-V307 PolarHBondContact O-N 2.83Å
308	R	97.9	Very high	96.1	Very high	182 Å²	182	82.7 Å²	82.7	69%	0.687	40%	0.401	S	S	*	.	H	α-helix	trans	-75.4	-23.9	178.9	-65.9	177.7	64.1	-167.1	0.8	113.7	R302 Q303 H304 N305	R302-R308 WeakPolarHBondContact O-CG 3.48Å; Q303-R308 VanDerWaalsContact O-CD 3.23Å; Q303-R308 WeakPolarHBondContact O-CD 3.21Å; H304-R308 PolarHBondContact O-N 3.25Å; N305-R308 PolarHBondContact O-N 2.64Å
309	K	94.9	Very high	95.9	Very high	108 Å²	108	86.2 Å²	86.2	47%	0.47	43%	0.425	S	S	.	.	S	Bend	trans	-66.9	134.1	179	-179.9	176.5	179.3	-174.6	0	110.2	L279 N305 H311	L279-K309 HydrophobicContact CD1-CD 4.09Å; N305-K309 WeakPolarHBondContact O-CB 3.31Å; N305-K309 PolarHBondContact O-N 2.91Å; K309-H311 PolarHBondContact O-CD2 2.66Å; K309-H311 VanDerWaalsContact O-CD2 3.24Å; K309-H311 PolarHBondContact O-N 3Å
310	K	93.7	Very high	95.7	Very high	191 Å²	191	84.8 Å²	84.8	83%	0.83	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-76.4	118.9	166	-171.2	176.6	-176.8	179.1	0	109
311	H	94.8	Very high	95.3	Very high	29 Å²	29	82.5 Å²	82.5	13%	0.134	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-95	117	175.6	-64.2	-88	0	0	0	109.3	F149 H152 W306 K309	F149-H311 HydrophobicContact CB-CB 3.92Å; H152-H311 AromaticContact CD2-CD2 3.44Å; H152-H311 PolarHBondContact CD2-CD2 3Å; H152-H311 VanDerWaalsContact CD2-CD2 3.44Å; H152-H311 AromaticContact CD2-NE2 3.67Å; H152-H311 AromaticContact CG-CD2 3.45Å; H152-H311 VanDerWaalsContact CG-CD2 3.45Å; H152-H311 AromaticContact ND1-CD2 3.87Å; H152-H311 AromaticContact NE2-CD2 3.84Å; W306-H311 AromaticContact CD1-CE1 3.79Å; W306-H311 AromaticContact CE2-NE2 3.9Å; W306-H311 AromaticContact NE1-CE1 3.54Å; W306-H311 AromaticContact NE1-NE2 3.85Å; W306-H311 PolarHBondContact O-NE2 2.8Å; K309-H311 PolarHBondContact O-CD2 2.66Å; K309-H311 VanDerWaalsContact O-CD2 3.24Å; K309-H311 PolarHBondContact O-N 3Å
312	P	92.8	Very high	94.9	Very high	86 Å²	86	84.4 Å²	84.4	56%	0.558	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-69.2	150.3	177	29.7	-33.8	0	0	0	110.5	S314	P312-S314 VanDerWaalsContact C-N 3.28Å; P312-S314 PolarHBondContact O-N 3.19Å
313	P	92.3	Very high	94	Very high	100 Å²	100	81.4 Å²	81.4	65%	0.649	42%	0.417	S	S	*	.			trans	-71.5	84.4	174.5	30.4	-33.7	0	0	0	110.3	F149	F149-P313 HydrophobicContact CD1-CB 4.21Å; F149-P313 HydrophobicContact CD2-CB 3.97Å; F149-P313 HydrophobicContact CE1-CB 4.11Å; F149-P313 HydrophobicContact CE2-CB 3.88Å; F149-P313 HydrophobicContact CG-CB 4.13Å; F149-P313 HydrophobicContact CZ-CB 3.93Å
314	S	86.8	Confident	92.8	Very high	91 Å²	91	80 Å²	80	64%	0.636	43%	0.426	S	S	*	.			trans	-82.1	-21.4	-178.1	54	0	0	0	0	113.8	P312	P312-S314 VanDerWaalsContact C-N 3.28Å; P312-S314 PolarHBondContact O-N 3.19Å
315	E	92.8	Very high	91.5	Very high	91 Å²	91	85.3 Å²	85.3	43%	0.425	45%	0.451	S	S	.	.	S	Bend	trans	-126.9	163.3	-179.4	-69.8	167.3	-120	0	0	109.6	R145 P147 F149	R145-E315 IonicContact NH1-OE2 2.7Å; P147-E315 HydrophobicContact CB-CB 4Å; P147-E315 HydrophobicContact CG-CB 3.95Å; F149-E315 WeakPolarHBondContact CE1-O 3.42Å
316	R	95.1	Very high	90.4	Very high	230 Å²	230	84 Å²	84	87%	0.868	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-67.3	132.8	174.7	-67.8	-176.4	-177.7	179.6	0.9	109.4	P147	P147-R316 VanDerWaalsContact CG-O 3.24Å; P147-R316 WeakPolarHBondContact CG-O 3.41Å
317	P	96.3	Very high	89.5	Confident	75 Å²	75	93.8 Å²	93.8	49%	0.487	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-62.7	148.1	175	26.8	-32.7	0	0	0	110.1	F149 P319	F149-P317 HydrophobicContact CE2-CB 4.39Å; F149-P317 HydrophobicContact CZ-CB 3.85Å; F149-P317 HydrophobicContact CZ-CG 4.43Å; P317-P319 WeakPolarHBondContact O-CD 3.35Å
318	V	96.4	Very high	88.9	Confident	12 Å²	12	94.6 Å²	94.6	7%	0.073	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-67.9	118.6	167	177.8	0	0	0	0	107.5	M137 V141 F146 Q150	M137-V318 HydrophobicContact CE-CB 4.43Å; M137-V318 HydrophobicContact CE-CG1 4.16Å; M137-V318 WeakPolarHBondContact CE-O 3.43Å; V141-V318 HydrophobicContact CG1-CB 4.46Å; V141-V318 HydrophobicContact CG1-CG1 3.68Å; V141-V318 HydrophobicContact CG1-CG2 4.07Å; V141-V318 HydrophobicContact CG2-CG1 4.36Å; V141-V318 HydrophobicContact CG2-CG2 4.2Å; F146-V318 HydrophobicContact CD1-CB 3.65Å; F146-V318 HydrophobicContact CD1-CG1 4.26Å; F146-V318 HydrophobicContact CD1-CG2 3.62Å; F146-V318 HydrophobicContact CE1-CB 3.84Å; F146-V318 HydrophobicContact CE1-CG1 3.99Å; F146-V318 HydrophobicContact CE1-CG2 4.2Å; Q150-V318 PolarHBondContact NE2-O 3.44Å
319	P	93.8	Very high	88.1	Confident	92 Å²	92	93.1 Å²	93.1	60%	0.597	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-74.5	160.6	178.8	32.8	-34.9	0	0	0	110.3	P317 P321	P317-P319 WeakPolarHBondContact O-CD 3.35Å; P319-P321 WeakPolarHBondContact O-CD 3.4Å
320	I	92.9	Very high	87.5	Confident	62 Å²	62	98.2 Å²	98.2	32%	0.318	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-62.4	126.2	166	-67.7	159.2	0	0	0	107.3	V131 C132 M137 R331	V131-I320 HydrophobicContact CG1-CD1 3.6Å; V131-I320 HydrophobicContact CG1-CG1 4.41Å; V131-I320 HydrophobicContact CG2-CG2 4.37Å; C132-I320 HydrophobicContact CB-CG2 3.94Å; M137-I320 HydrophobicContact CE-CG1 4.35Å; M137-I320 HydrophobicContact SD-CG1 4.19Å; I320-R331 HydrophobicContact CG2-CG 4.43Å
321	P	92.3	Very high	87.2	Confident	23 Å²	23	90.5 Å²	90.5	15%	0.149	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-64.6	163.3	-179.6	18.5	-24.3	0	0	0	111.4	E136 P319 R331	E136-P321 HydrophobicContact CG-CG 4.02Å; P319-P321 WeakPolarHBondContact O-CD 3.4Å; P321-R331 PolarHBondContact O-NE 2.81Å; P321-R331 PolarHBondContact O-NH2 2.78Å
322	A	89.4	Confident	86.9	Confident	40 Å²	40	92.1 Å²	92.1	33%	0.331	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-64.6	155.4	166.7	0	0	0	0	0	110.5	A324 D328 Q329 R331	A322-A324 PolarHBondContact O-N 2.95Å; A322-D328 WeakPolarHBondContact CA-O 3.29Å; A322-Q329 HydrophobicContact CB-CG 4.27Å; A322-R331 PolarHBondContact O-NH2 2.94Å
323	S	80	Confident	86.8	Confident	31 Å²	31	91 Å²	91	22%	0.217	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-57.1	131.5	173.7	172.6	0	0	0	0	110.6	E325 S326 R327 D328	S323-E325 PolarHBondContact O-N 3.29Å; S323-S326 VanDerWaalsContact CB-OG 3.28Å; S323-S326 WeakPolarHBondContact CB-OG 3.47Å; S323-S326 PolarHBondContact OG-OG 3.47Å; S323-R327 WeakPolarHBondContact O-CA 3.48Å; S323-R327 PolarHBondContact O-N 3.44Å; S323-D328 PolarHBondContact N-O 3.16Å
324	A	72.5	Confident	86.8	Confident	91 Å²	91	87.6 Å²	87.6	75%	0.752	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.3	-179.4	0	0	0	0	0	112.7	A322	A322-A324 PolarHBondContact O-N 2.95Å
325	E	72.5	Confident	87	Confident	128 Å²	128	83.2 Å²	83.2	60%	0.598	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-51.2	-177.3	-64.9	-171.5	174.9	0	0	112.1	S323	S323-E325 PolarHBondContact O-N 3.29Å
326	S	74.2	Confident	86.9	Confident	74 Å²	74	82.1 Å²	82.1	52%	0.517	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-11.7	-173.2	63.2	0	0	0	0	114.3	S323 D328	S323-S326 VanDerWaalsContact CB-OG 3.28Å; S323-S326 WeakPolarHBondContact CB-OG 3.47Å; S323-S326 PolarHBondContact OG-OG 3.47Å; S326-D328 PolarHBondContact O-N 3.48Å; S326-D328 VanDerWaalsContact O-N 3.08Å; S326-D328 VanDerWaalsContact OG-CB 3.28Å; S326-D328 WeakPolarHBondContact OG-CB 3.38Å; S326-D328 PolarHBondContact OG-N 3.01Å
327	R	80.7	Confident	86.6	Confident	213 Å²	213	73.6 Å²	73.6	80%	0.804	40%	0.397	S	S	*	.			trans	54.7	18	-168.1	-57.6	-176.2	176.6	-174.2	-0.4	113.8	S323 Q329	S323-R327 WeakPolarHBondContact O-CA 3.48Å; S323-R327 PolarHBondContact O-N 3.44Å; R327-Q329 PolarHBondContact O-N 3.31Å
328	D	84.1	Confident	86.3	Confident	37 Å²	37	71.1 Å²	71.1	20%	0.198	38%	0.378	C	S	.	.			trans	-71.9	119.2	177.2	-178.9	11.9	0	0	0	110.1	A322 S323 S326 W330 R331 S332	A322-D328 WeakPolarHBondContact CA-O 3.29Å; S323-D328 PolarHBondContact N-O 3.16Å; S326-D328 PolarHBondContact O-N 3.48Å; S326-D328 VanDerWaalsContact O-N 3.08Å; S326-D328 VanDerWaalsContact OG-CB 3.28Å; S326-D328 WeakPolarHBondContact OG-CB 3.38Å; S326-D328 PolarHBondContact OG-N 3.01Å; D328-W330 VanDerWaalsContact C-N 3.31Å; D328-W330 PolarHBondContact OD1-N 3.35Å; D328-R331 PolarHBondContact OD2-N 3.48Å; D328-S332 WeakPolarHBondContact OD2-CA 3.23Å; D328-S332 WeakPolarHBondContact OD2-CB 3.24Å; D328-S332 PolarHBondContact OD2-N 2.9Å; D328-S332 PolarHBondContact OD2-OG 3.44Å
329	Q	83	Confident	86	Confident	152 Å²	152	73 Å²	73	71%	0.71	39%	0.388	S	S	*	.	S	Bend	trans	-73.3	-25.5	179.7	-63.6	178.7	20.1	0	0	112.2	A322 R327	A322-Q329 HydrophobicContact CB-CG 4.27Å; R327-Q329 PolarHBondContact O-N 3.31Å
330	W	82.3	Confident	85.7	Confident	215 Å²	215	74.7 Å²	74.7	81%	0.814	39%	0.387	S	S	*	.	S	Bend	trans	-91.7	-7	-175.2	-52.8	98.5	0	0	0	112.6	D328 S332	D328-W330 VanDerWaalsContact C-N 3.31Å; D328-W330 PolarHBondContact OD1-N 3.35Å; W330-S332 PolarHBondContact O-N 3.12Å
331	R	86.3	Confident	85.4	Confident	28 Å²	28	75.1 Å²	75.1	11%	0.106	39%	0.39	C	S	.	.			trans	48.4	46.6	-174.4	-58.9	-122.3	-176.4	-161.7	-5.2	111.2	R72 V131 E136 I320 P321 A322 D328	R72-R331 PolarHBondContact NH1-O 2.57Å; R72-R331 PolarHBondContact NH2-O 2.81Å; V131-R331 HydrophobicContact CG2-CB 3.77Å; V131-R331 HydrophobicContact CG2-CG 3.9Å; V131-R331 PolarHBondContact O-NH1 3.04Å; E136-R331 IonicContact OE1-CZ 3.87Å; E136-R331 IonicContact OE1-NH1 3Å; E136-R331 PolarHBondContact OE1-NH1 2.91Å; E136-R331 IonicContact OE1-NH2 3.61Å; E136-R331 PolarHBondContact OE1-NH2 3.43Å; E136-R331 IonicContact OE2-NH1 3.58Å; I320-R331 HydrophobicContact CG2-CG 4.43Å; P321-R331 PolarHBondContact O-NE 2.81Å; P321-R331 PolarHBondContact O-NH2 2.78Å; A322-R331 PolarHBondContact O-NH2 2.94Å; D328-R331 PolarHBondContact OD2-N 3.48Å
332	S	89.3	Confident	85.1	Confident	64 Å²	64	77.7 Å²	77.7	45%	0.448	40%	0.402	S	S	.	.			trans	-54.8	157.3	-179.6	-49.7	0	0	0	0	110.8	R72 D328 W330 T334	R72-S332 PolarHBondContact NH2-O 3.05Å; D328-S332 WeakPolarHBondContact OD2-CA 3.23Å; D328-S332 WeakPolarHBondContact OD2-CB 3.24Å; D328-S332 PolarHBondContact OD2-N 2.9Å; D328-S332 PolarHBondContact OD2-OG 3.44Å; W330-S332 PolarHBondContact O-N 3.12Å; S332-T334 PolarHBondContact O-N 3.19Å
333	M	90.1	Very high	84.7	Confident	62 Å²	62	82.1 Å²	82.1	31%	0.305	42%	0.416	S	S	.	.			trans	-62.3	125.6	179.9	-155.6	178.3	45.9	0	0	109.9	E63 L65 R72 V335 V336 L339	E63-M333 WeakPolarHBondContact OE1-CA 3.45Å; E63-M333 WeakPolarHBondContact OE1-CG 3.22Å; L65-M333 HydrophobicContact CD1-SD 3.66Å; L65-M333 HydrophobicContact CD2-CE 4.28Å; L65-M333 HydrophobicContact CD2-SD 4.26Å; L65-M333 HydrophobicContact CG-SD 4.45Å; R72-M333 HydrophobicContact CG-CG 4.41Å; M333-V335 HydrophobicContact CB-CG2 4.47Å; M333-V335 HydrophobicContact CE-CG2 3.34Å; M333-V335 HydrophobicContact CG-CG2 3.59Å; M333-V335 PolarHBondContact O-N 2.69Å; M333-V335 HydrophobicContact SD-CG2 3.51Å; M333-V335 VanDerWaalsContact SD-CG2 3.51Å; M333-V336 HydrophobicContact CE-CG2 4.44Å; M333-L339 HydrophobicContact CE-CD1 4.47Å
334	T	92	Very high	84.3	Confident	28 Å²	28	82.7 Å²	82.7	17%	0.172	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.4	-173.8	59.4	0	0	0	0	113	D51 E63 S332 V336 P337 Y338	D51-T334 HydrophobicContact CB-CG2 3.88Å; D51-T334 PolarHBondContact N-OG1 3.01Å; D51-T334 VanDerWaalsContact N-OG1 3.12Å; E63-T334 WeakPolarHBondContact CB-OG1 3.33Å; E63-T334 PolarHBondContact OE1-N 2.94Å; E63-T334 WeakPolarHBondContact OE2-CB 3.38Å; E63-T334 WeakPolarHBondContact OE2-CG2 3.29Å; E63-T334 PolarHBondContact OE2-N 3.43Å; E63-T334 PolarHBondContact OE2-OG1 3.02Å; S332-T334 PolarHBondContact O-N 3.19Å; T334-V336 VanDerWaalsContact C-N 3.32Å; T334-V336 PolarHBondContact O-N 3.48Å; T334-P337 WeakPolarHBondContact O-CD 3.25Å; T334-Y338 WeakPolarHBondContact O-CD2 3.37Å; T334-Y338 WeakPolarHBondContact O-CE2 3.35Å
335	V	91.1	Very high	83.5	Confident	0 Å²	0	89.3 Å²	89.3	0%	0	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.4	-177	-53.1	0	0	0	0	114	L48 L65 M333 Y338 L339	L48-V335 HydrophobicContact CD2-CB 4.14Å; L65-V335 HydrophobicContact CB-CB 4.37Å; L65-V335 HydrophobicContact CB-CG1 3.99Å; L65-V335 HydrophobicContact CB-CG2 4Å; L65-V335 HydrophobicContact CD2-CG2 3.8Å; L65-V335 HydrophobicContact CG-CG2 4.42Å; M333-V335 HydrophobicContact CB-CG2 4.47Å; M333-V335 HydrophobicContact CE-CG2 3.34Å; M333-V335 HydrophobicContact CG-CG2 3.59Å; M333-V335 PolarHBondContact O-N 2.69Å; M333-V335 HydrophobicContact SD-CG2 3.51Å; M333-V335 VanDerWaalsContact SD-CG2 3.51Å; V335-Y338 CarbonylContact O-C 3.54Å; V335-Y338 WeakPolarHBondContact O-CA 3.43Å; V335-Y338 WeakPolarHBondContact O-CB 3.32Å; V335-Y338 PolarHBondContact O-N 2.95Å; V335-L339 HydrophobicContact CG2-CD1 4.07Å; V335-L339 PolarHBondContact O-N 3.46Å
336	V	89.9	Confident	82.7	Confident	68 Å²	68	86.3 Å²	86.3	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-55.8	-50.9	-175.5	175.3	0	0	0	0	112.8	M333 T334 Y338 L339 E340	M333-V336 HydrophobicContact CE-CG2 4.44Å; T334-V336 VanDerWaalsContact C-N 3.32Å; T334-V336 PolarHBondContact O-N 3.48Å; V336-Y338 PolarHBondContact O-N 3.4Å; V336-Y338 VanDerWaalsContact O-N 3.15Å; V336-L339 WeakPolarHBondContact O-CB 3.36Å; V336-L339 PolarHBondContact O-N 2.9Å; V336-E340 PolarHBondContact O-N 3.4Å
337	P	89.5	Confident	81.6	Confident	50 Å²	50	91.9 Å²	91.9	33%	0.325	44%	0.442	S	S	.	.	H	α-helix	trans	-63.6	-23.9	178.2	-22	35.1	0	0	0	113.7	K39 T334 D341	K39-P337 HydrophobicContact CB-CB 4.27Å; K39-P337 HydrophobicContact CD-CB 4.17Å; K39-P337 HydrophobicContact CD-CG 4.45Å; T334-P337 WeakPolarHBondContact O-CD 3.25Å; P337-D341 PolarHBondContact O-N 3.15Å
338	Y	91.1	Very high	80.4	Confident	24 Å²	24	88.8 Å²	88.8	9%	0.094	44%	0.442	C	S	.	.	H	α-helix	trans	-81.4	-27.3	177.6	-58.3	-87.5	0	0	0	111.9	K39 R40 A41 D51 T334 V335 V336 L342	K39-Y338 HydrophobicContact CB-CD1 4.08Å; K39-Y338 HydrophobicContact CB-CE1 3.78Å; K39-Y338 HydrophobicContact CB-CE2 4.5Å; K39-Y338 HydrophobicContact CD-CE1 4.34Å; K39-Y338 HydrophobicContact CD-CE2 3.82Å; K39-Y338 HydrophobicContact CG-CE1 4.49Å; R40-Y338 VanDerWaalsContact O-CD1 3.29Å; R40-Y338 WeakPolarHBondContact O-CD1 3.41Å; R40-Y338 WeakPolarHBondContact O-CE1 3.34Å; A41-Y338 WeakPolarHBondContact CB-O 3.39Å; D51-Y338 PolarHBondContact OD1-OH 2.95Å; T334-Y338 WeakPolarHBondContact O-CD2 3.37Å; T334-Y338 WeakPolarHBondContact O-CE2 3.35Å; V335-Y338 CarbonylContact O-C 3.54Å; V335-Y338 WeakPolarHBondContact O-CA 3.43Å; V335-Y338 WeakPolarHBondContact O-CB 3.32Å; V335-Y338 PolarHBondContact O-N 2.95Å; V336-Y338 PolarHBondContact O-N 3.4Å; V336-Y338 VanDerWaalsContact O-N 3.15Å; Y338-L342 PolarHBondContact O-N 3.45Å
339	L	88.6	Confident	78.8	Confident	52 Å²	52	92 Å²	92	27%	0.272	46%	0.459	S	S	.	.	H	α-helix	trans	-72.8	-38.4	170.5	-73	168.7	0	0	0	111	L48 L65 M333 V335 V336 D341 L342 H343	L48-L339 HydrophobicContact CD2-CD2 3.45Å; L48-L339 VanDerWaalsContact CD2-CD2 3.45Å; L48-L339 HydrophobicContact CD2-CG 3.61Å; L65-L339 HydrophobicContact CD2-CD1 4.16Å; M333-L339 HydrophobicContact CE-CD1 4.47Å; V335-L339 HydrophobicContact CG2-CD1 4.07Å; V335-L339 PolarHBondContact O-N 3.46Å; V336-L339 WeakPolarHBondContact O-CB 3.36Å; V336-L339 PolarHBondContact O-N 2.9Å; L339-D341 VanDerWaalsContact C-N 3.28Å; L339-D341 PolarHBondContact O-N 3.29Å; L339-L342 PolarHBondContact O-N 3.2Å; L339-H343 PolarHBondContact O-N 3.39Å
340	E	88.3	Confident	77.2	Confident	127 Å²	127	92.3 Å²	92.3	59%	0.593	47%	0.466	S	S	*	.	H	α-helix	trans	-61.2	-37.6	173.2	-69.2	171.5	172.7	0	0	111.7	V336 G344	V336-E340 PolarHBondContact O-N 3.4Å; E340-G344 WeakPolarHBondContact O-CA 3.47Å; E340-G344 PolarHBondContact O-N 2.94Å
341	D	86.8	Confident	75.7	Confident	71 Å²	71	89.1 Å²	89.1	38%	0.38	46%	0.464	S	S	.	.	H	α-helix	trans	-68.6	-33.3	173.9	-172.4	85.5	0	0	0	112.6	R40 A41 P337 L339	R40-D341 WeakPolarHBondContact CA-OD2 3.49Å; A41-D341 HydrophobicContact CB-CB 4.2Å; A41-D341 WeakPolarHBondContact CB-OD2 3.35Å; A41-D341 PolarHBondContact N-OD2 3.41Å; P337-D341 PolarHBondContact O-N 3.15Å; L339-D341 VanDerWaalsContact C-N 3.28Å; L339-D341 PolarHBondContact O-N 3.29Å
342	L	84.8	Confident	73.8	Confident	77 Å²	77	94.9 Å²	94.9	40%	0.403	50%	0.497	S	S	.	.	H	α-helix	trans	-81.8	-29.6	-178.8	-168.1	66.5	0	0	0	113.9	A41 Y338 L339	A41-L342 HydrophobicContact CB-CB 4.15Å; A41-L342 HydrophobicContact CB-CD1 4.44Å; Y338-L342 PolarHBondContact O-N 3.45Å; L339-L342 PolarHBondContact O-N 3.2Å
343	H	82.7	Confident	71.8	Confident	133 Å²	133	99.8 Å²	99.8	62%	0.616	51%	0.513	S	S	*	.	H	α-helix	trans	-132.7	-1.5	-169.6	-60.1	-51.7	0	0	0	114.4	L339 Y345	L339-H343 PolarHBondContact O-N 3.39Å; H343-Y345 PolarHBondContact O-N 3.05Å
344	G	71.3	Confident	69.8	Low	43 Å²	43	103.8 Å²	103.8	44%	0.443	54%	0.535	S	S	.	.			trans	-64.4	130.4	177.1	0	0	0	0	0	110.3	E340 T346	E340-G344 WeakPolarHBondContact O-CA 3.47Å; E340-G344 PolarHBondContact O-N 2.94Å; G344-T346 PolarHBondContact O-N 2.93Å; G344-T346 VanDerWaalsContact O-N 3.14Å
345	Y	54.8	Low	67.4	Low	229 Å²	229	111.3 Å²	111.3	90%	0.898	56%	0.562	S	S	*	*			trans	-68.2	105.3	164.4	-76.3	-88.9	0	0	0	107.7	H343	H343-Y345 PolarHBondContact O-N 3.05Å
346	T	56.3	Low	65.1	Low	65 Å²	65	117.7 Å²	117.7	40%	0.399	60%	0.596	S	S	.	*			trans	-83.2	109	159	44.3	0	0	0	0	106.7	G344 D348 D349	G344-T346 PolarHBondContact O-N 2.93Å; G344-T346 VanDerWaalsContact O-N 3.14Å; T346-D348 PolarHBondContact O-N 2.93Å; T346-D348 VanDerWaalsContact O-N 3.12Å; T346-D349 WeakPolarHBondContact CB-OD2 3.24Å; T346-D349 WeakPolarHBondContact CG2-OD2 3.42Å; T346-D349 PolarHBondContact OG1-OD2 2.85Å
347	E	51.6	Low	62.8	Low	191 Å²	191	117 Å²	117	89%	0.893	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	1.7	171.1	-69.8	-175	156.5	0	0	112.1
348	D	54.6	Low	60.6	Low	149 Å²	149	123.2 Å²	123.2	80%	0.797	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	7.2	-168.6	-71.4	-39.9	0	0	0	116.2	T346 D350	T346-D348 PolarHBondContact O-N 2.93Å; T346-D348 VanDerWaalsContact O-N 3.12Å; D348-D350 PolarHBondContact O-N 2.96Å
349	D	50.8	Low	58.5	Low	105 Å²	105	124.1 Å²	124.1	56%	0.561	63%	0.634	S	S	*	*			trans	-100.5	65.4	-179.2	-67.3	-32.9	0	0	0	112.8	T346 D351	T346-D349 WeakPolarHBondContact CB-OD2 3.24Å; T346-D349 WeakPolarHBondContact CG2-OD2 3.42Å; T346-D349 PolarHBondContact OG1-OD2 2.85Å; D349-D351 VanDerWaalsContact C-N 3.32Å
350	D	49.5	Very low	56.4	Low	158 Å²	158	128.8 Å²	128.8	85%	0.845	65%	0.654	S	S	*	*			trans	-84.8	81.4	141.8	-87.3	-34.1	0	0	0	106.1	D348	D348-D350 PolarHBondContact O-N 2.96Å
351	D	50.2	Low	54.6	Low	148 Å²	148	124.7 Å²	124.7	79%	0.791	64%	0.636	S	S	*	*	S	Bend	trans	167.9	133.8	147.3	-86.8	-28.1	0	0	0	111.3	D349	D349-D351 VanDerWaalsContact C-N 3.32Å
352	D	46.6	Very low	53.3	Low	148 Å²	148	125.8 Å²	125.8	79%	0.791	64%	0.641	S	S	*	*			trans	72	70.4	171.6	-62.3	-27.5	0	0	0	118.2	L354	D352-L354 PolarHBondContact O-N 3.17Å
353	E	48.3	Very low	51.7	Low	168 Å²	168	130.5 Å²	130.5	79%	0.785	65%	0.654	S	S	*	*			trans	-56.9	85.1	145.7	-83.6	-172.1	150.8	0	0	110.2	Y355	E353-Y355 HydrophobicContact CB-CD2 4.4Å; E353-Y355 HydrophobicContact CG-CD2 4.36Å; E353-Y355 HydrophobicContact CG-CE2 4.22Å
354	L	46.3	Very low	49.8	Very low	146 Å²	146	128.4 Å²	128.4	76%	0.764	65%	0.651	S	S	*	*			trans	-102.1	80.8	155.2	-132.5	106.1	0	0	0	107.6	D352 D356	D352-L354 PolarHBondContact O-N 3.17Å; L354-D356 VanDerWaalsContact C-N 3.29Å; L354-D356 PolarHBondContact O-N 3.46Å
355	Y	42.4	Very low	48.3	Very low	186 Å²	186	131 Å²	131	73%	0.729	65%	0.651	S	S	*	*			trans	-56.7	94.5	162.9	-90.8	-95	0	0	0	108.2	E353 G357	E353-Y355 HydrophobicContact CB-CD2 4.4Å; E353-Y355 HydrophobicContact CG-CD2 4.36Å; E353-Y355 HydrophobicContact CG-CE2 4.22Å; Y355-G357 PolarHBondContact O-N 2.74Å
356	D	43.2	Very low	47.6	Very low	134 Å²	134	126.4 Å²	126.4	72%	0.717	64%	0.643	S	S	*	*			trans	-66.2	106.8	163	-117.1	-12.6	0	0	0	105.7	L354	L354-D356 VanDerWaalsContact C-N 3.29Å; L354-D356 PolarHBondContact O-N 3.46Å
357	G	40.7	Very low	46.6	Very low	54 Å²	54	128.1 Å²	128.1	56%	0.557	64%	0.644	S	S	*	*			trans	-47.4	150	-159.2	0	0	0	0	0	116.4	Y355 D359	Y355-G357 PolarHBondContact O-N 2.74Å; G357-D359 PolarHBondContact O-N 3.4Å
358	E	44.3	Very low	45.9	Very low	180 Å²	180	124.8 Å²	124.8	84%	0.841	64%	0.637	S	S	*	*			trans	-46.5	113.3	163.5	-66.5	-176	162.4	0	0	108.8	E360	E358-E360 VanDerWaalsContact C-N 3.25Å; E358-E360 PolarHBondContact O-N 3.06Å
359	D	46.7	Very low	44.9	Very low	43 Å²	43	123.6 Å²	123.6	23%	0.23	64%	0.635	C	S	.	*			trans	-67.7	88.7	173	-84.9	-26.3	0	0	0	106.7	K42 K120 G357 I361	K42-D359 VanDerWaalsContact CE-OD2 3.22Å; K42-D359 WeakPolarHBondContact CE-OD2 3.17Å; K42-D359 IonicContact NZ-OD2 2.7Å; K42-D359 PolarHBondContact NZ-OD2 3.1Å; K120-D359 WeakPolarHBondContact CE-OD1 3.5Å; K120-D359 IonicContact NZ-OD1 3.67Å; K120-D359 PolarHBondContact NZ-OD1 3Å; K120-D359 IonicContact NZ-OD2 3.74Å; K120-D359 PolarHBondContact NZ-OD2 2.92Å; G357-D359 PolarHBondContact O-N 3.4Å; D359-I361 PolarHBondContact O-N 3.46Å
360	E	45.3	Very low	43.9	Very low	150 Å²	150	124.9 Å²	124.9	70%	0.701	65%	0.649	S	S	*	*			trans	-53.9	101.3	174.7	-83.3	-171.7	159.6	0	0	109.5	E358	E358-E360 VanDerWaalsContact C-N 3.25Å; E358-E360 PolarHBondContact O-N 3.06Å
361	I	49.7	Very low	43.4	Very low	40 Å²	40	120.3 Å²	120.3	21%	0.205	64%	0.64	C	S	.	*			trans	-94.3	119.9	170.2	-75.8	167.5	0	0	0	106.9	I44 Y116 N117 D359	I44-I361 HydrophobicContact CB-CD1 4.27Å; I44-I361 HydrophobicContact CD1-CD1 4.4Å; I44-I361 HydrophobicContact CG2-CD1 3.51Å; Y116-I361 WeakPolarHBondContact O-CG2 3.1Å; N117-I361 HydrophobicContact CB-CG1 4.35Å; D359-I361 PolarHBondContact O-N 3.46Å
362	I	59.3	Low	42.4	Very low	95 Å²	95	122.4 Å²	122.4	49%	0.487	65%	0.645	S	S	.	*			trans	-108.7	126	178	-36.4	-177.9	0	0	0	108.6
363	Y	51.3	Low	41.5	Very low	176 Å²	176	121.9 Å²	121.9	69%	0.69	65%	0.647	S	S	*	*			trans	85	116	168.2	-43.2	-71	0	0	0	118.7
364	T	42.1	Very low	40.6	Very low	88 Å²	88	118.3 Å²	118.3	54%	0.54	65%	0.646	S	S	.	*			trans	-75.5	107.8	144.5	48	0	0	0	0	107.3	D366	T364-D366 PolarHBondContact O-N 3.25Å; T364-D366 VanDerWaalsContact O-N 3.15Å
365	Q	40.6	Very low	39.8	Very low	97 Å²	97	118.9 Å²	118.9	45%	0.453	65%	0.645	S	S	.	*			trans	-81.2	101.8	179.9	-145.8	171.1	22.8	0	0	110	R101 Y116 F367	R101-Q365 PolarHBondContact NH1-O 3.42Å; R101-Q365 PolarHBondContact NH2-O 3.12Å; Y116-Q365 HydrophobicContact CE2-CB 4.43Å; Q365-F367 HydrophobicContact CB-CD2 4.23Å; Q365-F367 HydrophobicContact CB-CE2 3.9Å; Q365-F367 HydrophobicContact CG-CD2 4.38Å; Q365-F367 HydrophobicContact CG-CE2 4Å; Q365-F367 HydrophobicContact CG-CZ 4.19Å; Q365-F367 PolarHBondContact O-N 3.43Å; Q365-F367 VanDerWaalsContact O-N 3.07Å; Q365-F367 VanDerWaalsContact OE1-CE2 3.27Å
366	D	39.7	Very low	39.3	Very low	134 Å²	134	118.7 Å²	118.7	72%	0.717	65%	0.651	S	S	*	*			trans	-67.4	98.1	162	-73.6	-30.9	0	0	0	107.8	T364 T368	T364-D366 PolarHBondContact O-N 3.25Å; T364-D366 VanDerWaalsContact O-N 3.15Å; D366-T368 PolarHBondContact O-N 2.76Å
367	F	36.2	Very low	38.7	Very low	100 Å²	100	120.3 Å²	120.3	44%	0.439	65%	0.653	S	S	.	*			trans	-79.4	79.3	165	-73.8	-84.1	0	0	0	106.3	Q365 V369	Q365-F367 HydrophobicContact CB-CD2 4.23Å; Q365-F367 HydrophobicContact CB-CE2 3.9Å; Q365-F367 HydrophobicContact CG-CD2 4.38Å; Q365-F367 HydrophobicContact CG-CE2 4Å; Q365-F367 HydrophobicContact CG-CZ 4.19Å; Q365-F367 PolarHBondContact O-N 3.43Å; Q365-F367 VanDerWaalsContact O-N 3.07Å; Q365-F367 VanDerWaalsContact OE1-CE2 3.27Å; F367-V369 PolarHBondContact O-N 2.7Å
368	T	36.8	Very low	38.2	Very low	121 Å²	121	126.6 Å²	126.6	74%	0.742	67%	0.668	S	S	*	*			trans	-58.8	123.3	166.6	44.9	0	0	0	0	108.2	D366	D366-T368 PolarHBondContact O-N 2.76Å
369	V	32.5	Very low	37.4	Very low	125 Å²	125	125.1 Å²	125.1	76%	0.758	67%	0.666	S	S	*	*			trans	-59.6	127.1	169.4	-178.2	0	0	0	0	107.5	F367 G371	F367-V369 PolarHBondContact O-N 2.7Å; V369-G371 PolarHBondContact O-N 3.11Å; V369-G371 VanDerWaalsContact O-N 3.08Å
370	P	30.8	Very low	36.6	Very low	131 Å²	131	132.4 Å²	132.4	85%	0.851	70%	0.699	S	S	*	*	S	Bend	trans	-70.6	107.8	168.8	3.9	9.3	0	0	0	107.4
371	G	37.9	Very low	35.7	Very low	63 Å²	63	128.5 Å²	128.5	65%	0.649	70%	0.699	S	S	*	*			trans	151.3	62.6	174.5	0	0	0	0	0	114	V369	V369-G371 PolarHBondContact O-N 3.11Å; V369-G371 VanDerWaalsContact O-N 3.08Å
372	Q	29.1	Very low	34.7	Very low	192 Å²	192	134.5 Å²	134.5	90%	0.897	73%	0.732	S	S	*	*			trans	-164.4	96.5	146.8	-105.9	164	20.8	0	0	107.1	A374	Q372-A374 PolarHBondContact O-N 3.12Å
373	V	28.5	Very low	33.3	Very low	137 Å²	137	134 Å²	134	83%	0.83	74%	0.741	S	S	*	*			trans	-66.7	112.9	166.2	-178.6	0	0	0	0	105.7	E375	V373-E375 PolarHBondContact O-N 3.24Å
374	A	29.2	Very low	32.2	Very low	93 Å²	93	132.3 Å²	132.3	77%	0.769	74%	0.744	S	S	*	*			trans	-76.3	109.4	160.8	0	0	0	0	0	106.3	Q372 E376	Q372-A374 PolarHBondContact O-N 3.12Å; A374-E376 PolarHBondContact O-N 2.74Å
375	E	30.5	Very low	31.7	Very low	158 Å²	158	136 Å²	136	74%	0.738	76%	0.755	S	S	*	*			trans	-67.8	119.2	165.8	-76.9	-174.4	154.7	0	0	108.4	V373 H377	V373-E375 PolarHBondContact O-N 3.24Å; E375-H377 PolarHBondContact O-N 3Å
376	E	31.7	Very low	30.9	Very low	182 Å²	182	136.6 Å²	136.6	85%	0.85	77%	0.77	S	S	*	*			trans	-63.4	117.5	164.5	-68.8	178.5	155.9	0	0	108.7	A374	A374-E376 PolarHBondContact O-N 2.74Å
377	H	30.3	Very low	30.9	Very low	168 Å²	168	136 Å²	136	78%	0.778	77%	0.773	S	S	*	*			trans	-109.2	106.1	160.6	-86.4	-63.8	0	0	0	109.7	E375	E375-H377 PolarHBondContact O-N 3Å
378	Q	29.4	Very low	30.4	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	79%	0.785	S	S	*	*			trans	-64.9	141.1	157.4	-75.6	177.5	5	0	0	109.9
379	D	29.1	Very low	29.9	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	79%	0.79	S	S	*	*			trans	-62.5	135.5	-178.6	-164.5	9.1	0	0	0	113.2
380	Q	29.5	Very low	29.7	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	79%	0.79	S	S	*	*			trans	-170.7	102.5	149.4	-108.6	166.8	69.1	0	0	111.5
381	G	26.4	Very low	29.6	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	79%	0.789	S	S	*	*				67.2	128.7	124.7	0	0	0	0	0	121.2
382	N	28.3	Very low	29.2	Very low	166 Å²	166	140.5 Å²	140.5	89%	0.888	80%	0.798	S	S	*	*			trans	94.1	107.6	150.4	-96.1	2.8	0	0	0	121.1
383	A	29.7	Very low	29.1	Very low	83 Å²	83	136.4 Å²	136.4	69%	0.686	79%	0.786	S	S	*	*				62.4	120.9	120.3	0	0	0	0	0	121.7
384	D	27.9	Very low	28.9	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	79%	0.787	S	S	*	*			trans	82.7	132.8	135.8	-98.4	-15.9	0	0	0	123.2
385	H	31.1	Very low	28.7	Very low	167 Å²	167	136.6 Å²	136.6	77%	0.773	78%	0.782	S	S	*	*			trans	66	110.6	149.8	-74.9	-50.3	0	0	0	121.9
386	S	25.4	Very low	28.6	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	79%	0.787	S	S	*	*			trans	-46	159	141.4	-44	0	0	0	0	111.5
387	P	38.6	Very low	28.3	Very low	120 Å²	120	131 Å²	131	78%	0.779	78%	0.779	S	S	*	*			cis	-153.6	179.6	37.2	40.4	-17.2	0	0	0	118.6
388	A	26.4	Very low	28.2	Very low	83 Å²	83	129.4 Å²	129.4	69%	0.686	78%	0.781	S	S	*	*			trans	76.2	123.7	139.7	0	0	0	0	0	123.1
389	V	25.9	Very low	28.1	Very low	141 Å²	141	129.3 Å²	129.3	86%	0.855	78%	0.78	S	S	*	*			trans	70	119	131.7	-177.8	0	0	0	0	119.4
390	A	27.6	Very low	27.9	Very low	92 Å²	92	127.1 Å²	127.1	76%	0.76	78%	0.783	S	S	*	*				-178.2	128.8	118.5	0	0	0	0	0	112.3
391	K	29.2	Very low	27.8	Very low	189 Å²	189	121.6 Å²	121.6	82%	0.822	78%	0.778	S	S	*	*			trans	-73	163.5	154.7	-69.8	178.2	175.3	178.1	0	109.1
392	P	30.3	Very low	27.8	Very low	131 Å²	131	123.6 Å²	123.6	85%	0.851	78%	0.781	S	S	*	*				-129.3	146.2	124.1	28.6	-14.4	0	0	0	113.7
393	V	26.4	Very low	27.7	Very low	106 Å²	106	124 Å²	124	64%	0.642	78%	0.783	S	S	*	*			trans	-95.5	146.5	165.8	165.7	0	0	0	0	107.3	V395	V393-V395 HydrophobicContact CG1-CG2 3.75Å
394	C	25	Very low	27.5	Very low	126 Å²	126	127.3 Å²	127.3	85%	0.851	79%	0.789	S	S	*	*			trans	171.2	123.2	139.3	-91	0	0	0	0	107.5
395	V	25.5	Very low	27.5	Very low	107 Å²	107	125.7 Å²	125.7	65%	0.648	79%	0.788	S	S	*	*			cis	101.3	130.1	31.3	175.6	0	0	0	0	112.9	V393	V393-V395 HydrophobicContact CG1-CG2 3.75Å
396	N	27.4	Very low	27.4	Very low	158 Å²	158	126.8 Å²	126.8	85%	0.845	79%	0.791	S	S	*	*			trans	85.6	128.4	169.6	-60.9	-22.1	0	0	0	116.5
397	G	24.4	Very low	27.4	Very low	66 Å²	66	128 Å²	128	68%	0.68	79%	0.794	S	S	*	*			cis	120.7	140.4	41.8	0	0	0	0	0	105.2
398	T	28.3	Very low	26.8	Very low	134 Å²	134	131.9 Å²	131.9	82%	0.822	80%	0.798	S	S	*	*			cis	-179.1	149.5	42	15.3	0	0	0	0	109.7
399	E	27.9	Very low	26.8	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	80%	0.801	S	S	*	*			trans	73.8	119.1	137.3	-67	-171.6	166.5	0	0	126.7
400	A	26.2	Very low	26.9	Very low	103 Å²	103	133 Å²	133	85%	0.851	80%	0.796	S	S	*	*				23.3	133.8	127	0	0	0	0	0	123.9
401	G	26.9	Very low	26.9	Very low	80 Å²	80	139.5 Å²	139.5	83%	0.825	80%	0.801	S	S	*	*			trans	-150.7	113.8	153.7	0	0	0	0	0	111.2
402	S	24.8	Very low	26.8	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	81%	0.806	S	S	*	*			trans	-89.8	148.4	173.1	-179.2	0	0	0	0	110.3
403	L	27.9	Very low	26.6	Very low	176 Å²	176	142.1 Å²	142.1	92%	0.921	81%	0.808	S	S	*	*			trans	-161.5	130.4	147	-101.7	159.4	0	0	0	111.6
404	N	24.9	Very low	26.6	Very low	151 Å²	151	142.5 Å²	142.5	81%	0.807	82%	0.815	S	S	*	*			trans	-72.7	154.3	178	-92.5	-30.3	0	0	0	113.7
405	S	28.3	Very low	26.8	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	81%	0.811	S	S	*	*				176	127.7	107.1	63.9	0	0	0	0	116.2
406	K	28.2	Very low	26.9	Very low	191 Å²	191	141.7 Å²	141.7	83%	0.83	82%	0.815	S	S	*	*			trans	65.6	103.8	130.4	-69	-177	178.3	177.5	0	123.1
407	T	26.3	Very low	26.9	Very low	133 Å²	133	139.7 Å²	139.7	82%	0.816	81%	0.814	S	S	*	*				39.1	127.6	118.8	54.2	0	0	0	0	122
408	K	25.7	Very low	27.1	Very low	202 Å²	202	144 Å²	144	88%	0.878	82%	0.822	S	S	*	*				-160	138.5	118.8	-133	179.2	-178.7	-173.4	0	112.4
409	A	26.1	Very low	27.6	Very low	90 Å²	90	142.9 Å²	142.9	74%	0.744	82%	0.816	S	S	*	*			trans	-112.4	150.1	174.2	0	0	0	0	0	109.9
410	E	27.9	Very low	27.6	Very low	159 Å²	159	139 Å²	139	74%	0.743	81%	0.809	S	S	*	*			trans	175.6	151.9	158.5	-101.7	170.8	169	0	0	107.2
411	R	27.4	Very low	27.7	Very low	228 Å²	228	145.6 Å²	145.6	86%	0.86	81%	0.812	S	S	*	*			cis	-164.8	156.7	-22.6	-121.4	179.1	-172.1	-174.6	1	105.3
412	R	26.3	Very low	27.8	Very low	248 Å²	248	151.9 Å²	151.9	94%	0.936	82%	0.817	S	S	*	*			trans	-65.3	154.9	178.3	-66.7	165.3	169.8	177.5	-4.1	113.4
413	S	27	Very low	27.9	Very low	127 Å²	127	150.1 Å²	150.1	89%	0.888	82%	0.816	S	S	*	*			trans	-152.3	138.1	136.6	57.8	0	0	0	0	111.9
414	S	26.9	Very low	27.9	Very low	114 Å²	114	148.2 Å²	148.2	80%	0.797	81%	0.811	S	S	*	*			trans	-114.2	144.8	-175.7	49.5	0	0	0	0	111
415	S	27.9	Very low	28	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	81%	0.809	S	S	*	*			trans	-178.9	105.4	149.9	51	0	0	0	0	109.1
416	S	27.3	Very low	28	Very low	107 Å²	107	146.9 Å²	146.9	75%	0.748	81%	0.809	S	S	*	*				53.1	113.6	99	70.4	0	0	0	0	115
417	S	28.4	Very low	28.1	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	81%	0.811	S	S	*	*				160.6	131.9	91	52.9	0	0	0	0	111.4
418	N	27.6	Very low	28.2	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	81%	0.807	S	S	*	*			trans	-71	165.3	160.3	-112.2	-14.8	0	0	0	109.9
419	P	39.8	Very low	28.3	Very low	109 Å²	109	141.8 Å²	141.8	71%	0.708	81%	0.808	S	S	*	*				-154	175.3	52.2	38.3	-15	0	0	0	119.7
420	S	28.6	Very low	28.6	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	81%	0.807	S	S	*	*			trans	87	106.1	140.8	48.7	0	0	0	0	122.6
421	R	28.3	Very low	28.6	Very low	242 Å²	242	147.6 Å²	147.6	91%	0.913	81%	0.813	S	S	*	*				22.7	126.6	129.7	-76.3	-179.2	171.8	178.8	-2.8	119.4
422	K	28.8	Very low	28.8	Very low	212 Å²	212	145.7 Å²	145.7	92%	0.922	81%	0.811	S	S	*	*				-167.1	134	115.7	-102.7	172.5	-173.6	-178.7	0	109.9
423	G	25.9	Very low	29.1	Very low	72 Å²	72	141 Å²	141	74%	0.742	80%	0.804	S	S	*	*			trans	-80.9	152.7	177.4	0	0	0	0	0	112.5
424	V	27.6	Very low	29.2	Very low	137 Å²	137	138.9 Å²	138.9	83%	0.83	79%	0.789	S	S	*	*			trans	-146.2	127.1	153.4	176.7	0	0	0	0	107.7
425	S	27.3	Very low	29.6	Very low	109 Å²	109	139.7 Å²	139.7	76%	0.762	79%	0.789	S	S	*	*			trans	-69.5	129.8	168.7	128.8	0	0	0	0	109.8
426	T	27.9	Very low	29.6	Very low	121 Å²	121	140.3 Å²	140.3	74%	0.742	79%	0.792	S	S	*	*			trans	-151.2	115.5	149.3	36.2	0	0	0	0	110.8	S428	T426-S428 PolarHBondContact O-N 3.28Å
427	A	31.7	Very low	29.7	Very low	105 Å²	105	144.6 Å²	144.6	87%	0.868	80%	0.797	S	S	*	*			trans	-55.9	127.6	164.2	0	0	0	0	0	110
428	S	28.4	Very low	30.1	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	80%	0.798	S	S	*	*			trans	-128.3	124.1	168.9	-74.3	0	0	0	0	110.4	T426 I430	T426-S428 PolarHBondContact O-N 3.28Å; S428-I430 PolarHBondContact O-N 3.17Å
429	K	28.1	Very low	30.1	Very low	206 Å²	206	152.8 Å²	152.8	90%	0.896	82%	0.818	S	S	*	*			trans	-59.9	123.9	-177.1	-75.5	167	172.7	171.8	0	111.1	R431	K429-R431 PolarHBondContact O-N 3.07Å
430	I	30.7	Very low	29.6	Very low	139 Å²	139	155 Å²	155	71%	0.713	82%	0.823	S	S	*	*			trans	-63.5	113.8	169.4	-62.4	169.5	0	0	0	108.8	S428	S428-I430 PolarHBondContact O-N 3.17Å
431	R	29.2	Very low	29.6	Very low	232 Å²	232	157.7 Å²	157.7	88%	0.875	83%	0.829	S	S	*	*			trans	-81.9	126.8	162.5	-82.5	-176.5	179.9	173	0.8	108.3	K429 L433	K429-R431 PolarHBondContact O-N 3.07Å; R431-L433 PolarHBondContact O-N 3.16Å; R431-L433 VanDerWaalsContact O-N 3.15Å
432	K	32	Very low	29.7	Very low	189 Å²	189	153.1 Å²	153.1	82%	0.822	82%	0.824	S	S	*	*			trans	-56	113.1	171.4	-68.7	-179.6	174.8	-177	0	109.5	S434	K432-S434 PolarHBondContact O-N 3.45Å; K432-S434 VanDerWaalsContact O-N 3.09Å
433	L	31.4	Very low	29.8	Very low	150 Å²	150	149.6 Å²	149.6	79%	0.785	82%	0.818	S	S	*	*			trans	-80.4	70.8	159.4	-77.7	165.1	0	0	0	108.1	R431	R431-L433 PolarHBondContact O-N 3.16Å; R431-L433 VanDerWaalsContact O-N 3.15Å
434	S	30.2	Very low	30	Very low	81 Å²	81	154.4 Å²	154.4	57%	0.566	82%	0.823	S	S	*	*			trans	-96.5	127.6	167.8	53.2	0	0	0	0	109.5	K432	K432-S434 PolarHBondContact O-N 3.45Å; K432-S434 VanDerWaalsContact O-N 3.09Å
435	T	35.6	Very low	30.2	Very low	131 Å²	131	155.6 Å²	155.6	80%	0.804	82%	0.823	S	S	*	*			trans	63.8	89.1	163.5	57.1	0	0	0	0	116.8
436	C	26	Very low	30.4	Very low	121 Å²	121	158.9 Å²	158.9	82%	0.818	83%	0.827	S	S	*	*			trans	-87	109.9	154.8	-153.9	0	0	0	0	108.4	Q438	C436-Q438 PolarHBondContact O-N 3.42Å
437	K	30.6	Very low	30.6	Very low	197 Å²	197	161.8 Å²	161.8	86%	0.857	83%	0.833	S	S	*	*			trans	-63	118.6	162.3	-72.4	173.3	175.6	173.9	0	107
438	Q	36.4	Very low	30.5	Very low	179 Å²	179	166.6 Å²	166.6	84%	0.836	83%	0.831	S	S	*	*			trans	-80.9	128.3	166.1	-76	179	-15.6	0	0	108.6	C436	C436-Q438 PolarHBondContact O-N 3.42Å
439	Q	27.3	Very low	30.7	Very low	267 Å²	267	172 Å²	172	100%	1.248	84%	0.838	S	S	*	*			trans	-70.6	0	159.8	-80.6	178.4	-23.2	0	0	109.9

Retrieved 439 of 439 residues in 97.7 ms (Link to these results)

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