A0A060WPK5_ONCMY Loading...

Carbonic anhydrase-related protein

Does not have a carbonic anhydrase catalytic activity.

AlphaFold DB , UniProt , Accession A0A060WPK5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110508819, Length 281 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	36.3	Very low	251 Å²	251	155.8 Å²	155.8	100%	1.236	84%	0.839	S	S	*	*				0	101	0	-71.2	-179.3	-173.4	0	0	107.2
2	A	31.1	Very low	36.3	Very low	101 Å²	101	158.8 Å²	158.8	84%	0.835	83%	0.832	S	S	*	*			trans	-145.3	101.5	163.9	0	0	0	0	0	104.1
3	D	36	Very low	36.2	Very low	165 Å²	165	151.8 Å²	151.8	88%	0.882	80%	0.802	S	S	*	*			trans	-63.1	123.9	170.6	-102.1	-35.3	0	0	0	108.2
4	S	33.5	Very low	36.3	Very low	103 Å²	103	143.8 Å²	143.8	72%	0.72	77%	0.773	S	S	*	*			trans	-101.1	97.4	159.1	67.8	0	0	0	0	107.5	T6	S4-T6 PolarHBondContact O-N 3.48Å
5	M	38.2	Very low	36.9	Very low	177 Å²	177	146.7 Å²	146.7	87%	0.872	78%	0.776	S	S	*	*			trans	-62.4	117.3	162.7	-66.2	178.1	98	0	0	107.1
6	T	37.1	Very low	37.4	Very low	131 Å²	131	147.9 Å²	147.9	80%	0.804	78%	0.783	S	S	*	*			trans	-82.7	111.8	166.9	25.9	0	0	0	0	106.4	S4 E8	S4-T6 PolarHBondContact O-N 3.48Å; T6-E8 PolarHBondContact O-N 2.67Å
7	E	37.8	Very low	38.3	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	76%	0.764	S	S	*	*			trans	-67.4	113.7	165.7	-75.7	176.9	155.7	0	0	107.5	S9	E7-S9 PolarHBondContact O-N 2.79Å; E7-S9 VanDerWaalsContact O-N 3.11Å
8	E	37.5	Very low	40	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	74%	0.739	S	S	*	*			trans	-63.9	105.6	161.5	-80.7	179.7	151.4	0	0	107.1	T6 D10	T6-E8 PolarHBondContact O-N 2.67Å; E8-D10 PolarHBondContact O-N 3.42Å
9	S	34.7	Very low	42.2	Very low	110 Å²	110	138.1 Å²	138.1	77%	0.769	73%	0.732	S	S	*	*			trans	-72.3	114	169.6	59.8	0	0	0	0	108.2	E7 Y11	E7-S9 PolarHBondContact O-N 2.79Å; E7-S9 VanDerWaalsContact O-N 3.11Å; S9-Y11 PolarHBondContact O-N 2.96Å; S9-Y11 VanDerWaalsContact O-N 3.08Å
10	D	34.9	Very low	44.7	Very low	127 Å²	127	133.6 Å²	133.6	68%	0.679	70%	0.704	S	S	*	*			trans	-50.2	114.9	170.7	-73.7	-40.1	0	0	0	110.3	E8 Y12	E8-D10 PolarHBondContact O-N 3.42Å; D10-Y12 HydrophobicContact CB-CD2 4.33Å; D10-Y12 HydrophobicContact CB-CE2 3.77Å; D10-Y12 WeakPolarHBondContact O-CD2 3.29Å; D10-Y12 PolarHBondContact O-N 2.95Å
11	Y	38.7	Very low	46.9	Very low	175 Å²	175	128.6 Å²	128.6	69%	0.686	69%	0.685	S	S	*	*			trans	-71.9	108.2	172	-178.3	-96.7	0	0	0	108.7	S9 P13 D17	S9-Y11 PolarHBondContact O-N 2.96Å; S9-Y11 VanDerWaalsContact O-N 3.08Å; Y11-P13 HydrophobicContact CD1-CB 4.45Å; Y11-P13 HydrophobicContact CE1-CB 3.83Å; Y11-P13 WeakPolarHBondContact O-CD 3.31Å; Y11-D17 PolarHBondContact OH-OD2 3.32Å
12	Y	36.2	Very low	49.4	Very low	192 Å²	192	119.2 Å²	119.2	75%	0.753	64%	0.636	S	S	*	*			trans	-90.4	108.9	166.3	-70.5	-88.1	0	0	0	108.1	D10 G14	D10-Y12 HydrophobicContact CB-CD2 4.33Å; D10-Y12 HydrophobicContact CB-CE2 3.77Å; D10-Y12 WeakPolarHBondContact O-CD2 3.29Å; D10-Y12 PolarHBondContact O-N 2.95Å; Y12-G14 PolarHBondContact O-N 3.31Å
13	P	35.1	Very low	52.2	Low	68 Å²	68	116.9 Å²	116.9	44%	0.442	61%	0.608	S	S	.	*			trans	-57.3	139.4	176.3	17.6	-26.3	0	0	0	110.4	Y11 D17	Y11-P13 HydrophobicContact CD1-CB 4.45Å; Y11-P13 HydrophobicContact CE1-CB 3.83Å; Y11-P13 WeakPolarHBondContact O-CD 3.31Å; P13-D17 HydrophobicContact CB-CB 3.59Å
14	G	37.4	Very low	54.4	Low	39 Å²	39	116.5 Å²	116.5	40%	0.402	60%	0.601	S	S	.	*			trans	-65.3	164.2	173.3	0	0	0	0	0	111.2	Y12 D16 D17	Y12-G14 PolarHBondContact O-N 3.31Å; G14-D16 PolarHBondContact O-N 2.84Å; G14-D17 PolarHBondContact N-OD2 3.07Å; G14-D17 WeakPolarHBondContact O-CB 3.47Å; G14-D17 PolarHBondContact O-N 3.24Å
15	K	44.5	Very low	56.6	Low	188 Å²	188	114.7 Å²	114.7	82%	0.817	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-55.2	-22.6	172.8	-101.9	-175.2	174.8	-177.6	0	113.4
16	D	45.6	Very low	58.9	Low	165 Å²	165	110.2 Å²	110.2	88%	0.882	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-85	-5.5	178.3	-64.6	-30.8	0	0	0	113.9	G14	G14-D16 PolarHBondContact O-N 2.84Å
17	D	51.8	Low	61.5	Low	87 Å²	87	111.2 Å²	111.2	47%	0.465	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-99.3	-1.8	180	-76.5	-23.2	0	0	0	113.3	Y11 P13 G14 D19	Y11-D17 PolarHBondContact OH-OD2 3.32Å; P13-D17 HydrophobicContact CB-CB 3.59Å; G14-D17 PolarHBondContact N-OD2 3.07Å; G14-D17 WeakPolarHBondContact O-CB 3.47Å; G14-D17 PolarHBondContact O-N 3.24Å; D17-D19 PolarHBondContact O-N 3.03Å
18	L	69.7	Low	64.2	Low	59 Å²	59	104 Å²	104	31%	0.309	54%	0.541	S	S	.	.			trans	-85.9	96.4	179.5	-67.4	174.7	0	0	0	110.2	L31 F32	L18-L31 HydrophobicContact CD1-CB 4.37Å; L18-L31 HydrophobicContact CD2-CD2 4.1Å; L18-F32 HydrophobicContact CB-CZ 4.12Å
19	D	81.3	Confident	66.9	Low	112 Å²	112	95.9 Å²	95.9	60%	0.599	51%	0.507	S	S	*	.			trans	-66.2	135.1	177.5	-161.7	25.4	0	0	0	111.4	D17	D17-D19 PolarHBondContact O-N 3.03Å
20	W	92.2	Very high	69.7	Low	47 Å²	47	96.8 Å²	96.8	18%	0.178	50%	0.503	C	S	.	.			trans	-143.1	154.5	179.4	68	-90.5	0	0	0	110.3	Y22 W28 F32 H78 T215 P216	W20-Y22 HydrophobicContact CH2-CE2 4.4Å; W20-Y22 HydrophobicContact CZ3-CE1 4.42Å; W20-Y22 AromaticContact CZ3-CE2 3.86Å; W20-Y22 HydrophobicContact CZ3-CE2 3.86Å; W20-Y22 AromaticContact CZ3-CZ 3.8Å; W20-W28 AromaticContact CE3-CE2 3.96Å; W20-W28 HydrophobicContact CE3-CH2 4.45Å; W20-W28 AromaticContact CE3-CZ2 3.73Å; W20-W28 HydrophobicContact CE3-CZ2 3.73Å; W20-W28 HydrophobicContact CZ3-CH2 4.21Å; W20-W28 AromaticContact CZ3-CZ2 3.85Å; W20-W28 HydrophobicContact CZ3-CZ2 3.85Å; W20-F32 HydrophobicContact CB-CE2 4.02Å; W20-F32 HydrophobicContact CB-CZ 4.47Å; W20-F32 AromaticContact CD1-CZ 3.9Å; W20-F32 HydrophobicContact CG-CE2 4.22Å; W20-F32 HydrophobicContact CG-CZ 4.4Å; W20-H78 AromaticContact CD2-ND1 3.95Å; W20-H78 AromaticContact CE2-CE1 3.81Å; W20-H78 AromaticContact CE2-ND1 3.78Å; W20-H78 AromaticContact CE3-ND1 3.96Å; W20-H78 HydrophobicContact CH2-CB 3.62Å; W20-H78 AromaticContact CH2-CG 3.62Å; W20-H78 AromaticContact CH2-ND1 3.67Å; W20-H78 HydrophobicContact CZ2-CB 4.01Å; W20-H78 AromaticContact CZ2-CD2 3.95Å; W20-H78 AromaticContact CZ2-CG 3.58Å; W20-H78 AromaticContact CZ2-ND1 3.65Å; W20-H78 HydrophobicContact CZ3-CB 4.29Å; W20-H78 AromaticContact CZ3-ND1 3.83Å; W20-H78 PolarHBondContact O-CE1 3.15Å; W20-H78 PolarHBondContact O-ND1 3.36Å; W20-T215 HydrophobicContact CH2-CG2 3.77Å; W20-T215 HydrophobicContact CZ3-CG2 4.41Å; W20-P216 HydrophobicContact CB-CG 4.44Å; W20-P216 HydrophobicContact CD2-CB 4.36Å; W20-P216 HydrophobicContact CD2-CG 3.65Å; W20-P216 HydrophobicContact CE3-CG 4Å; W20-P216 HydrophobicContact CG-CB 4.39Å; W20-P216 HydrophobicContact CG-CG 3.83Å
21	G	92.2	Very high	72.5	Confident	29 Å²	29	93.1 Å²	93.1	30%	0.299	48%	0.483	S	S	.	.			trans	-160.3	-171.3	179.1	0	0	0	0	0	112.5	W28	G21-W28 PolarHBondContact O-NE1 2.78Å; G21-W28 VanDerWaalsContact O-NE1 3.09Å
22	Y	92.5	Very high	75.2	Confident	54 Å²	54	85.9 Å²	85.9	21%	0.212	46%	0.455	C	S	.	.	S	Bend	trans	-104.7	-5	179.6	-57.4	-85.4	0	0	0	113.2	W20 W28 H78 T215 N264	W20-Y22 HydrophobicContact CH2-CE2 4.4Å; W20-Y22 HydrophobicContact CZ3-CE1 4.42Å; W20-Y22 AromaticContact CZ3-CE2 3.86Å; W20-Y22 HydrophobicContact CZ3-CE2 3.86Å; W20-Y22 AromaticContact CZ3-CZ 3.8Å; Y22-W28 HydrophobicContact CD1-CH2 4.23Å; Y22-W28 HydrophobicContact CD1-CZ2 4.06Å; Y22-W28 AromaticContact CE1-CH2 3.79Å; Y22-W28 HydrophobicContact CE1-CH2 3.79Å; Y22-W28 AromaticContact CE1-CZ2 3.98Å; Y22-W28 HydrophobicContact CE1-CZ2 3.98Å; Y22-H78 HydrophobicContact CE2-CB 4.31Å; Y22-T215 WeakPolarHBondContact OH-CG2 3.24Å; Y22-N264 HydrophobicContact CD2-CB 3.67Å; Y22-N264 WeakPolarHBondContact CE1-O 3.3Å; Y22-N264 HydrophobicContact CE2-CB 3.61Å; Y22-N264 HydrophobicContact CG-CB 4.24Å; Y22-N264 VanDerWaalsContact CZ-O 3.29Å; Y22-N264 PolarHBondContact OH-O 3.2Å
23	Q	88.6	Confident	78	Confident	52 Å²	52	81.3 Å²	81.3	24%	0.243	45%	0.449	C	S	.	.	S	Bend	trans	-99.8	-164.3	173.2	-60.4	-171.7	2.8	0	0	108.7	G25 N257 D258	Q23-G25 PolarHBondContact O-N 2.77Å; Q23-N257 PolarHBondContact OE1-ND2 2.81Å; Q23-N257 PolarHBondContact OE1-OD1 3.36Å; Q23-D258 PolarHBondContact NE2-OD1 2.75Å
24	E	82.4	Confident	80.9	Confident	158 Å²	158	81.8 Å²	81.8	74%	0.738	45%	0.447	S	S	*	.	S	Bend	trans	-54.6	133.1	-179.7	-164.9	168	-171.7	0	0	111.8
25	G	80.3	Confident	83.8	Confident	65 Å²	65	80.3 Å²	80.3	67%	0.67	43%	0.432	S	S	*	.	S	Bend	trans	173.2	-179.8	-172.8	0	0	0	0	0	112	Q23	Q23-G25 PolarHBondContact O-N 2.77Å
26	V	85.9	Confident	86.3	Confident	82 Å²	82	76.8 Å²	76.8	50%	0.497	42%	0.422	S	S	.	.			trans	-69.8	138.3	177.8	-177.1	0	0	0	0	109.9	W28 L30 L31	V26-W28 PolarHBondContact O-N 3.45Å; V26-L30 HydrophobicContact CG1-CB 3.88Å; V26-L30 HydrophobicContact CG1-CD1 3.86Å; V26-L30 HydrophobicContact CG1-CG 4.46Å; V26-L31 HydrophobicContact CB-CD1 4.02Å; V26-L31 HydrophobicContact CB-CG 4.33Å; V26-L31 HydrophobicContact CG1-CD1 4.17Å; V26-L31 HydrophobicContact CG1-CD2 4.31Å; V26-L31 HydrophobicContact CG1-CG 3.91Å
27	E	91.2	Very high	88.8	Confident	153 Å²	153	70.3 Å²	70.3	72%	0.715	39%	0.394	S	S	*	.			trans	-55.7	127.7	171.6	-67.3	-174.2	172.7	0	0	110.3	G29 L30	E27-G29 PolarHBondContact O-N 2.85Å; E27-G29 VanDerWaalsContact O-N 3.08Å; E27-L30 HydrophobicContact CB-CD1 4.28Å; E27-L30 HydrophobicContact CB-CG 4.38Å; E27-L30 WeakPolarHBondContact O-CB 3.46Å; E27-L30 PolarHBondContact O-N 3.21Å
28	W	95.3	Very high	91	Very high	36 Å²	36	71.7 Å²	71.7	14%	0.136	40%	0.398	C	S	.	.	H	α-helix	trans	-57.2	-33.9	-171.1	-62	-7.2	0	0	0	113.1	W20 G21 Y22 V26 L30 L31 F32 A35 T214 P216 R266	W20-W28 AromaticContact CE3-CE2 3.96Å; W20-W28 HydrophobicContact CE3-CH2 4.45Å; W20-W28 AromaticContact CE3-CZ2 3.73Å; W20-W28 HydrophobicContact CE3-CZ2 3.73Å; W20-W28 HydrophobicContact CZ3-CH2 4.21Å; W20-W28 AromaticContact CZ3-CZ2 3.85Å; W20-W28 HydrophobicContact CZ3-CZ2 3.85Å; G21-W28 PolarHBondContact O-NE1 2.78Å; G21-W28 VanDerWaalsContact O-NE1 3.09Å; Y22-W28 HydrophobicContact CD1-CH2 4.23Å; Y22-W28 HydrophobicContact CD1-CZ2 4.06Å; Y22-W28 AromaticContact CE1-CH2 3.79Å; Y22-W28 HydrophobicContact CE1-CH2 3.79Å; Y22-W28 AromaticContact CE1-CZ2 3.98Å; Y22-W28 HydrophobicContact CE1-CZ2 3.98Å; V26-W28 PolarHBondContact O-N 3.45Å; W28-L30 PolarHBondContact O-N 2.85Å; W28-L30 VanDerWaalsContact O-N 3.17Å; W28-L31 PolarHBondContact O-N 3.25Å; W28-F32 HydrophobicContact CB-CD2 4.23Å; W28-F32 WeakPolarHBondContact O-CA 3.21Å; W28-F32 WeakPolarHBondContact O-CB 2.81Å; W28-F32 WeakPolarHBondContact O-CD2 3.35Å; W28-F32 PolarHBondContact O-N 2.79Å; W28-A35 HydrophobicContact CB-CB 4.24Å; W28-T214 VanDerWaalsContact CZ3-O 3.27Å; W28-T214 WeakPolarHBondContact CZ3-O 3.49Å; W28-P216 HydrophobicContact CD2-CG 3.95Å; W28-P216 HydrophobicContact CE3-CG 4.09Å; W28-P216 HydrophobicContact CG-CG 4.18Å; W28-R266 HydrophobicContact CE3-CG 4.38Å; W28-R266 HydrophobicContact CH2-CB 4.04Å; W28-R266 HydrophobicContact CH2-CG 4.03Å; W28-R266 HydrophobicContact CZ3-CB 4.01Å; W28-R266 HydrophobicContact CZ3-CG 3.59Å
29	G	94.2	Very high	92.4	Very high	15 Å²	15	72.8 Å²	72.8	16%	0.155	40%	0.398	C	S	.	.	H	α-helix	trans	-60.8	-21.1	177.6	0	0	0	0	0	115.2	E27 N36	E27-G29 PolarHBondContact O-N 2.85Å; E27-G29 VanDerWaalsContact O-N 3.08Å; G29-N36 WeakPolarHBondContact CA-ND2 3.46Å; G29-N36 WeakPolarHBondContact CA-OD1 3.39Å; G29-N36 PolarHBondContact O-ND2 3.12Å
30	L	93.9	Very high	93.2	Very high	130 Å²	130	67.7 Å²	67.7	68%	0.681	37%	0.371	S	S	*	.	H	α-helix	trans	-79	-28	175.7	-63.7	175.3	0	0	0	112.5	V26 E27 W28	V26-L30 HydrophobicContact CG1-CB 3.88Å; V26-L30 HydrophobicContact CG1-CD1 3.86Å; V26-L30 HydrophobicContact CG1-CG 4.46Å; E27-L30 HydrophobicContact CB-CD1 4.28Å; E27-L30 HydrophobicContact CB-CG 4.38Å; E27-L30 WeakPolarHBondContact O-CB 3.46Å; E27-L30 PolarHBondContact O-N 3.21Å; W28-L30 PolarHBondContact O-N 2.85Å; W28-L30 VanDerWaalsContact O-N 3.17Å
31	L	93.5	Very high	93.5	Very high	50 Å²	50	65.4 Å²	65.4	26%	0.262	36%	0.362	S	S	.	.	H	α-helix	trans	-101.8	-31.3	-178.5	-60.9	-176.8	0	0	0	112.5	L18 V26 W28	L18-L31 HydrophobicContact CD1-CB 4.37Å; L18-L31 HydrophobicContact CD2-CD2 4.1Å; V26-L31 HydrophobicContact CB-CD1 4.02Å; V26-L31 HydrophobicContact CB-CG 4.33Å; V26-L31 HydrophobicContact CG1-CD1 4.17Å; V26-L31 HydrophobicContact CG1-CD2 4.31Å; V26-L31 HydrophobicContact CG1-CG 3.91Å; W28-L31 PolarHBondContact O-N 3.25Å
32	F	95.3	Very high	93.9	Very high	23 Å²	23	64 Å²	64	10%	0.101	35%	0.348	C	S	.	.			trans	-126.7	90.5	-174.8	-51	-75.5	0	0	0	108.4	L18 W20 W28 D34 A35 P216	L18-F32 HydrophobicContact CB-CZ 4.12Å; W20-F32 HydrophobicContact CB-CE2 4.02Å; W20-F32 HydrophobicContact CB-CZ 4.47Å; W20-F32 AromaticContact CD1-CZ 3.9Å; W20-F32 HydrophobicContact CG-CE2 4.22Å; W20-F32 HydrophobicContact CG-CZ 4.4Å; W28-F32 HydrophobicContact CB-CD2 4.23Å; W28-F32 WeakPolarHBondContact O-CA 3.21Å; W28-F32 WeakPolarHBondContact O-CB 2.81Å; W28-F32 WeakPolarHBondContact O-CD2 3.35Å; W28-F32 PolarHBondContact O-N 2.79Å; F32-D34 PolarHBondContact O-N 3.38Å; F32-D34 VanDerWaalsContact O-N 3.13Å; F32-A35 WeakPolarHBondContact O-CB 3.19Å; F32-A35 PolarHBondContact O-N 3.18Å; F32-P216 HydrophobicContact CD1-CB 3.89Å; F32-P216 HydrophobicContact CD2-CB 3.62Å; F32-P216 HydrophobicContact CD2-CG 3.66Å; F32-P216 HydrophobicContact CE1-CB 3.89Å; F32-P216 HydrophobicContact CE2-CB 3.63Å; F32-P216 HydrophobicContact CE2-CG 3.67Å; F32-P216 HydrophobicContact CG-CB 3.75Å; F32-P216 HydrophobicContact CG-CG 4.26Å; F32-P216 HydrophobicContact CZ-CB 3.76Å; F32-P216 HydrophobicContact CZ-CG 4.26Å
33	P	95.6	Very high	94.2	Very high	96 Å²	96	61.5 Å²	61.5	62%	0.623	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-55.5	-34.6	-171.8	-30.3	36.5	0	0	0	114.9	A35 N36	P33-A35 PolarHBondContact O-N 3.36Å; P33-A35 VanDerWaalsContact O-N 3.14Å; P33-N36 WeakPolarHBondContact O-CB 3.09Å; P33-N36 PolarHBondContact O-N 3.22Å; P33-N36 PolarHBondContact O-ND2 3.21Å
34	D	96.5	Very high	94.6	Very high	77 Å²	77	60.5 Å²	60.5	41%	0.412	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-58.6	-23.6	176.5	-64.6	7	0	0	0	112.4	F32 N36 G37 Q40 P217 S219	F32-D34 PolarHBondContact O-N 3.38Å; F32-D34 VanDerWaalsContact O-N 3.13Å; D34-N36 PolarHBondContact O-N 3.41Å; D34-G37 PolarHBondContact O-N 3.14Å; D34-Q40 PolarHBondContact O-NE2 3.31Å; D34-P217 WeakPolarHBondContact CB-O 3.29Å; D34-S219 WeakPolarHBondContact OD2-CB 3.41Å; D34-S219 PolarHBondContact OD2-OG 3.03Å
35	A	97.6	Very high	95.4	Very high	9 Å²	9	53 Å²	53	7%	0.074	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-66.3	-14.2	176.1	0	0	0	0	0	113.6	W28 F32 P33 G37 C218 R266	W28-A35 HydrophobicContact CB-CB 4.24Å; F32-A35 WeakPolarHBondContact O-CB 3.19Å; F32-A35 PolarHBondContact O-N 3.18Å; P33-A35 PolarHBondContact O-N 3.36Å; P33-A35 VanDerWaalsContact O-N 3.14Å; A35-G37 VanDerWaalsContact C-N 3.34Å; A35-C218 HydrophobicContact CB-CB 3.67Å; A35-R266 PolarHBondContact O-NH2 3.18Å
36	N	97.7	Very high	96.3	Very high	113 Å²	113	52 Å²	52	60%	0.604	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-92.7	9.6	172.3	-53	-60.4	0	0	0	113	G29 P33 D34	G29-N36 WeakPolarHBondContact CA-ND2 3.46Å; G29-N36 WeakPolarHBondContact CA-OD1 3.39Å; G29-N36 PolarHBondContact O-ND2 3.12Å; P33-N36 WeakPolarHBondContact O-CB 3.09Å; P33-N36 PolarHBondContact O-N 3.22Å; P33-N36 PolarHBondContact O-ND2 3.21Å; D34-N36 PolarHBondContact O-N 3.41Å
37	G	97.5	Very high	96.8	Very high	29 Å²	29	50.3 Å²	50.3	30%	0.299	27%	0.27	S	S	.	.			trans	-61.1	163	176.7	0	0	0	0	0	113.1	D34 A35 Q40 E220	D34-G37 PolarHBondContact O-N 3.14Å; A35-G37 VanDerWaalsContact C-N 3.34Å; G37-Q40 WeakPolarHBondContact O-CG 3.28Å; G37-E220 WeakPolarHBondContact CA-OE1 3.2Å
38	E	98.1	Very high	97	Very high	117 Å²	117	54.1 Å²	54.1	55%	0.547	28%	0.278	S	S	.	.	S	Bend	trans	-82	-25.7	-177.1	-172.1	170.1	179.2	0	0	112.8	E220 S272	E38-E220 PolarHBondContact N-OE1 2.74Å; E38-S272 PolarHBondContact O-OG 3.04Å
39	Y	98.3	Very high	97.1	Very high	82 Å²	82	58.4 Å²	58.4	32%	0.322	30%	0.3	S	S	.	.	S	Bend	trans	-112.9	47.8	-171.8	-53.6	-46	0	0	0	111.6	G211 S212 E220 D273 R274	Y39-G211 CarbonylContact O-C 3.53Å; Y39-G211 VanDerWaalsContact O-C 3.26Å; Y39-G211 WeakPolarHBondContact O-CA 3.47Å; Y39-S212 PolarHBondContact O-N 2.86Å; Y39-E220 WeakPolarHBondContact CA-OE1 3.29Å; Y39-E220 PolarHBondContact N-OE1 3.28Å; Y39-D273 WeakPolarHBondContact CE1-OD1 3.23Å; Y39-D273 PolarHBondContact OH-OD1 3.07Å; Y39-R274 VanDerWaalsContact C-NH1 3.26Å; Y39-R274 HydrophobicContact CD1-CG 3.67Å; Y39-R274 HydrophobicContact CE1-CG 4.13Å; Y39-R274 HydrophobicContact CG-CG 4.44Å; Y39-R274 PolarHBondContact O-NH1 3.07Å; Y39-R274 VanDerWaalsContact O-NH1 3.15Å
40	Q	98.8	Very high	97.3	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.019	30%	0.3	C	S	.	.			trans	-78.2	158.2	-177.5	-65.4	-70.7	-64.6	0	0	113.4	D34 G37 S212 C218 E220 Q269 R274	D34-Q40 PolarHBondContact O-NE2 3.31Å; G37-Q40 WeakPolarHBondContact O-CG 3.28Å; Q40-S212 WeakPolarHBondContact CA-OG 3.14Å; Q40-S212 PolarHBondContact OE1-OG 2.87Å; Q40-C218 PolarHBondContact NE2-O 3.24Å; Q40-C218 PolarHBondContact OE1-O 2.77Å; Q40-E220 PolarHBondContact NE2-OE1 2.85Å; Q40-Q269 HydrophobicContact CB-CB 3.9Å; Q40-Q269 HydrophobicContact CB-CG 3.73Å; Q40-R274 PolarHBondContact O-NH1 3.32Å; Q40-R274 PolarHBondContact O-NH2 3Å
41	S	98.9	Very high	97.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-121.4	156.3	175.5	-65.9	0	0	0	0	110.4	Y209 G211 S212 W224 R266	S41-Y209 VanDerWaalsContact CB-OH 3.27Å; S41-Y209 WeakPolarHBondContact CB-OH 3.45Å; S41-Y209 PolarHBondContact OG-OH 3.16Å; S41-G211 WeakPolarHBondContact OG-CA 3.29Å; S41-S212 VanDerWaalsContact CB-O 3.31Å; S41-S212 WeakPolarHBondContact CB-O 3.34Å; S41-S212 PolarHBondContact N-OG 3.19Å; S41-S212 PolarHBondContact OG-N 2.83Å; S41-S212 PolarHBondContact OG-O 3.34Å; S41-W224 PolarHBondContact OG-NE1 3.22Å; S41-W224 VanDerWaalsContact OG-NE1 3.09Å; S41-R266 WeakPolarHBondContact O-CD 3.3Å; S41-R266 PolarHBondContact O-NH1 2.89Å
42	P	98.9	Very high	97.7	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.301	C	S	.	.			cis	-80.5	174.6	0.8	35.9	-39.4	0	0	0	112.5	E119 T214 R266 T268 Q269	P42-E119 VanDerWaalsContact CB-C 3.44Å; P42-E119 HydrophobicContact CB-CB 3.79Å; P42-E119 WeakPolarHBondContact CB-O 3.44Å; P42-E119 HydrophobicContact CG-CB 3.78Å; P42-E119 WeakPolarHBondContact CG-O 3.49Å; P42-T214 HydrophobicContact CB-CG2 4.3Å; P42-R266 WeakPolarHBondContact CG-O 3.46Å; P42-T268 CarbonylContact O-C 3.56Å; P42-T268 WeakPolarHBondContact O-CA 3.41Å; P42-Q269 WeakPolarHBondContact O-CB 3.36Å; P42-Q269 PolarHBondContact O-N 2.82Å
43	I	98.9	Very high	97.9	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.305	C	S	.	.			trans	-125.7	159.8	174.9	61.8	168.1	0	0	0	111.9	H120 T121 Y209 L271 V276	I43-H120 PolarHBondContact N-CD2 3.38Å; I43-T121 PolarHBondContact O-N 3.02Å; I43-Y209 HydrophobicContact CD1-CD1 3.92Å; I43-Y209 HydrophobicContact CD1-CD2 3.96Å; I43-Y209 HydrophobicContact CD1-CE1 3.94Å; I43-Y209 HydrophobicContact CD1-CE2 4.02Å; I43-Y209 HydrophobicContact CD1-CG 3.93Å; I43-Y209 HydrophobicContact CG1-CD1 4.42Å; I43-Y209 HydrophobicContact CG1-CE1 3.93Å; I43-Y209 HydrophobicContact CG1-CE2 4.16Å; I43-Y209 HydrophobicContact CG2-CE2 4.16Å; I43-L271 HydrophobicContact CD1-CD1 3.7Å; I43-V276 HydrophobicContact CD1-CG2 3.82Å
44	N	98.8	Very high	98	Very high	31 Å²	31	61.3 Å²	61.3	17%	0.166	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	125.3	156.8	169.1	63.6	0	0	0	109.5	T121 F124	N44-T121 WeakPolarHBondContact CA-OG1 3.37Å; N44-T121 WeakPolarHBondContact CB-OG1 3.2Å; N44-T121 PolarHBondContact OD1-OG1 2.75Å; N44-F124 HydrophobicContact CB-CD1 4.26Å; N44-F124 HydrophobicContact CB-CE1 4.14Å; N44-F124 VanDerWaalsContact ND2-CE1 3.31Å; N44-F124 WeakPolarHBondContact ND2-CE1 3.45Å; N44-F124 VanDerWaalsContact ND2-CZ 3.32Å; N44-F124 WeakPolarHBondContact ND2-CZ 3.48Å; N44-F124 WeakPolarHBondContact OD1-CA 3.44Å; N44-F124 PolarHBondContact OD1-N 3.47Å
45	L	98.6	Very high	98	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	110.2	177.2	-168.2	154.6	0	0	0	109.8	S47 T121 V122 N123 W207 L226 V276	L45-S47 PolarHBondContact O-N 3.25Å; L45-T121 PolarHBondContact N-O 3.48Å; L45-V122 HydrophobicContact CD2-CG1 4.43Å; L45-V122 CarbonylContact O-C 3.59Å; L45-V122 WeakPolarHBondContact O-CA 3.28Å; L45-N123 PolarHBondContact O-N 2.84Å; L45-W207 HydrophobicContact CD1-CB 3.58Å; L45-W207 HydrophobicContact CD1-CD2 3.56Å; L45-W207 HydrophobicContact CD1-CE3 3.76Å; L45-W207 HydrophobicContact CD1-CG 3.51Å; L45-W207 HydrophobicContact CD2-CD2 3.74Å; L45-W207 HydrophobicContact CD2-CE3 4.21Å; L45-W207 HydrophobicContact CD2-CG 4.1Å; L45-W207 HydrophobicContact CD2-CH2 4.32Å; L45-W207 HydrophobicContact CD2-CZ2 3.87Å; L45-W207 HydrophobicContact CD2-CZ3 4.46Å; L45-W207 HydrophobicContact CG-CD2 4.33Å; L45-W207 HydrophobicContact CG-CG 4.4Å; L45-L226 HydrophobicContact CD1-CD2 4.49Å; L45-V276 HydrophobicContact CD1-CG1 3.9Å; L45-V276 HydrophobicContact CG-CG1 4.16Å
46	N	98.1	Very high	98	Very high	44 Å²	44	59.9 Å²	59.9	24%	0.235	29%	0.292	C	S	.	.			trans	-81.9	107.3	167.6	-175.1	-16.6	0	0	0	109.5	R48 E49 A50 N123	N46-R48 PolarHBondContact O-N 3.1Å; N46-R48 VanDerWaalsContact O-N 3.11Å; N46-R48 PolarHBondContact OD1-N 3.28Å; N46-R48 VanDerWaalsContact OD1-N 3.1Å; N46-E49 HydrophobicContact CB-CB 4.17Å; N46-E49 HydrophobicContact CB-CG 4.18Å; N46-E49 PolarHBondContact ND2-OE1 3.31Å; N46-E49 PolarHBondContact O-N 3.47Å; N46-A50 PolarHBondContact O-N 3.36Å; N46-N123 WeakPolarHBondContact CA-OD1 3.33Å; N46-N123 PolarHBondContact OD1-OD1 2.91Å
47	S	96.5	Very high	97.8	Very high	45 Å²	45	58.9 Å²	58.9	32%	0.315	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.1	-173	67.7	0	0	0	0	113.2	L45 N123	L45-S47 PolarHBondContact O-N 3.25Å; S47-N123 PolarHBondContact N-OD1 3.03Å; S47-N123 PolarHBondContact OG-ND2 2.76Å; S47-N123 PolarHBondContact OG-OD1 2.95Å
48	R	96.4	Very high	97.7	Very high	233 Å²	233	64 Å²	64	88%	0.879	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.4	178	-62.6	-178.5	178.4	-179.1	-0	113.2	N46	N46-R48 PolarHBondContact O-N 3.1Å; N46-R48 VanDerWaalsContact O-N 3.11Å; N46-R48 PolarHBondContact OD1-N 3.28Å; N46-R48 VanDerWaalsContact OD1-N 3.1Å
49	E	97.4	Very high	97.5	Very high	126 Å²	126	62.8 Å²	62.8	59%	0.589	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-14.1	178.7	-69.2	171.6	-168.5	0	0	112.1	N46 R51	N46-E49 HydrophobicContact CB-CB 4.17Å; N46-E49 HydrophobicContact CB-CG 4.18Å; N46-E49 PolarHBondContact ND2-OE1 3.31Å; N46-E49 PolarHBondContact O-N 3.47Å; E49-R51 PolarHBondContact O-N 3.25Å
50	A	98.1	Very high	97.3	Very high	19 Å²	19	60.5 Å²	60.5	16%	0.157	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-59.8	127.7	173.4	0	0	0	0	0	110.4	N46 V276 A278	N46-A50 PolarHBondContact O-N 3.36Å; A50-V276 WeakPolarHBondContact CA-O 3.25Å; A50-V276 HydrophobicContact CB-CG1 4.19Å; A50-A278 HydrophobicContact CB-CB 4.23Å
51	R	98.4	Very high	97.3	Very high	165 Å²	165	61.3 Å²	61.3	62%	0.623	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.6	-178.4	-61.3	-169.1	-174	172.8	1.5	109.8	E49 D53 T275 V276 R277 A278	E49-R51 PolarHBondContact O-N 3.25Å; R51-D53 PolarHBondContact O-N 3.43Å; R51-T275 HydrophobicContact CB-CG2 4.31Å; R51-T275 HydrophobicContact CG-CG2 3.97Å; R51-V276 PolarHBondContact N-O 2.97Å; R51-R277 CarbonylContact O-C 3.58Å; R51-R277 WeakPolarHBondContact O-CA 3.43Å; R51-A278 PolarHBondContact O-N 3.15Å
52	Y	98.4	Very high	97.2	Very high	88 Å²	88	64.7 Å²	64.7	35%	0.345	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	127	171.2	175.3	-120.6	0	0	0	110.1	P54 L57 A278 F280 Q281	Y52-P54 HydrophobicContact CE1-CB 3.89Å; Y52-P54 HydrophobicContact CE1-CG 4.3Å; Y52-L57 HydrophobicContact CE2-CD1 4.43Å; Y52-A278 WeakPolarHBondContact CA-O 3.36Å; Y52-A278 WeakPolarHBondContact CD2-O 3.32Å; Y52-F280 WeakPolarHBondContact CD2-O 3.47Å; Y52-Q281 HydrophobicContact CD1-CG 3.63Å; Y52-Q281 HydrophobicContact CD2-CG 3.92Å; Y52-Q281 HydrophobicContact CE1-CG 3.71Å; Y52-Q281 VanDerWaalsContact CE1-NE2 3.25Å; Y52-Q281 HydrophobicContact CE2-CG 3.99Å; Y52-Q281 HydrophobicContact CG-CG 3.72Å
53	D	98.3	Very high	97.1	Very high	33 Å²	33	65.2 Å²	65.2	18%	0.176	34%	0.337	C	S	.	.			trans	-124.2	102.3	176.9	-176.8	2	0	0	0	109.4	R51 S55 L56 R277 A278	R51-D53 PolarHBondContact O-N 3.43Å; D53-S55 PolarHBondContact O-N 3.05Å; D53-S55 PolarHBondContact OD1-N 3.2Å; D53-S55 VanDerWaalsContact OD1-N 3.16Å; D53-S55 PolarHBondContact OD1-OG 3.38Å; D53-S55 VanDerWaalsContact OD1-OG 3.08Å; D53-L56 HydrophobicContact CB-CD1 3.92Å; D53-L56 HydrophobicContact CB-CG 4Å; D53-L56 WeakPolarHBondContact O-CB 3.33Å; D53-L56 WeakPolarHBondContact O-CG 3.43Å; D53-L56 PolarHBondContact O-N 3.34Å; D53-R277 HydrophobicContact CB-CB 4.14Å; D53-R277 HydrophobicContact CB-CG 4.42Å; D53-R277 WeakPolarHBondContact OD2-CD 3.42Å; D53-R277 IonicContact OD2-CZ 3.7Å; D53-R277 IonicContact OD2-NE 3.91Å; D53-R277 IonicContact OD2-NH1 2.73Å; D53-R277 PolarHBondContact OD2-NH1 3.07Å; D53-A278 PolarHBondContact N-O 2.88Å
54	P	97.1	Very high	97	Very high	71 Å²	71	69.9 Å²	69.9	46%	0.461	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-66.4	-21.7	-177.1	27	-34	0	0	0	113.2	Y52 L56 L57	Y52-P54 HydrophobicContact CE1-CB 3.89Å; Y52-P54 HydrophobicContact CE1-CG 4.3Å; P54-L56 PolarHBondContact O-N 3.49Å; P54-L57 WeakPolarHBondContact O-CB 3.36Å; P54-L57 PolarHBondContact O-N 3.36Å
55	S	96.9	Very high	97	Very high	55 Å²	55	68.8 Å²	68.8	39%	0.385	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-68.3	-18.2	-179.8	79.2	0	0	0	0	112.3	D53 L57 D58	D53-S55 PolarHBondContact O-N 3.05Å; D53-S55 PolarHBondContact OD1-N 3.2Å; D53-S55 VanDerWaalsContact OD1-N 3.16Å; D53-S55 PolarHBondContact OD1-OG 3.38Å; D53-S55 VanDerWaalsContact OD1-OG 3.08Å; S55-L57 PolarHBondContact O-N 3.28Å; S55-L57 VanDerWaalsContact O-N 3.13Å; S55-D58 PolarHBondContact O-N 3.03Å
56	L	97.1	Very high	96.9	Very high	1 Å²	1	71.7 Å²	71.7	1%	0.005	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-63.5	-11.8	171.3	-64.2	178.4	0	0	0	113.2	D53 P54 P94 Y206 I208 R277 A279	D53-L56 HydrophobicContact CB-CD1 3.92Å; D53-L56 HydrophobicContact CB-CG 4Å; D53-L56 WeakPolarHBondContact O-CB 3.33Å; D53-L56 WeakPolarHBondContact O-CG 3.43Å; D53-L56 PolarHBondContact O-N 3.34Å; P54-L56 PolarHBondContact O-N 3.49Å; L56-P94 HydrophobicContact CD2-CB 3.68Å; L56-Y206 HydrophobicContact CD1-CE2 4.43Å; L56-Y206 PolarHBondContact O-OH 2.71Å; L56-I208 HydrophobicContact CD1-CG2 3.81Å; L56-I208 HydrophobicContact CD2-CG2 4.19Å; L56-R277 HydrophobicContact CD1-CB 4.22Å; L56-A279 HydrophobicContact CB-CB 3.99Å; L56-A279 HydrophobicContact CD1-CB 4.03Å
57	L	95.3	Very high	96.9	Very high	91 Å²	91	73.3 Å²	73.3	48%	0.476	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-107.5	-7.7	-179.9	-56.2	179	0	0	0	113.2	Y52 P54 S55 V59 A279	Y52-L57 HydrophobicContact CE2-CD1 4.43Å; P54-L57 WeakPolarHBondContact O-CB 3.36Å; P54-L57 PolarHBondContact O-N 3.36Å; S55-L57 PolarHBondContact O-N 3.28Å; S55-L57 VanDerWaalsContact O-N 3.13Å; L57-V59 VanDerWaalsContact C-N 3.31Å; L57-V59 PolarHBondContact O-N 3.08Å; L57-A279 HydrophobicContact CD2-CB 4.18Å
58	D	94.6	Very high	96.8	Very high	136 Å²	136	71.1 Å²	71.1	73%	0.727	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-45.5	-179.5	-72.4	-18.2	0	0	0	111.2	S55	S55-D58 PolarHBondContact O-N 3.03Å
59	V	94.3	Very high	96.8	Very high	92 Å²	92	69.4 Å²	69.4	56%	0.558	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	103.7	163.6	-178.4	0	0	0	0	105.3	L57 G93	L57-V59 VanDerWaalsContact C-N 3.31Å; L57-V59 PolarHBondContact O-N 3.08Å; V59-G93 WeakPolarHBondContact O-CA 3.36Å; V59-G93 PolarHBondContact O-N 3.41Å
60	G	94	Very high	96.6	Very high	34 Å²	34	68.6 Å²	68.6	35%	0.351	36%	0.363	S	S	.	.			trans	-57.9	149.9	-176.3	0	0	0	0	0	113.2	T62	G60-T62 PolarHBondContact O-N 3.09Å; G60-T62 PolarHBondContact O-OG1 3.09Å
61	L	97.6	Very high	96.4	Very high	22 Å²	22	67.7 Å²	67.7	12%	0.115	36%	0.355	C	S	.	.			trans	-57.7	121.6	174.7	-175.6	72.8	0	0	0	109.8	P63 V90 L95 Y206 I225	L61-P63 WeakPolarHBondContact O-CD 3.35Å; L61-V90 HydrophobicContact CD1-CG1 3.55Å; L61-V90 HydrophobicContact CG-CG1 4.24Å; L61-L95 HydrophobicContact CD1-CD1 4.5Å; L61-Y206 HydrophobicContact CB-CE1 3.84Å; L61-Y206 HydrophobicContact CD2-CD1 4.25Å; L61-Y206 HydrophobicContact CD2-CE1 4.18Å; L61-I225 HydrophobicContact CD1-CD1 3.49Å; L61-I225 VanDerWaalsContact CD1-CD1 3.49Å; L61-I225 HydrophobicContact CD2-CD1 3.68Å; L61-I225 HydrophobicContact CD2-CG2 3.87Å; L61-I225 HydrophobicContact CG-CD1 4.23Å
62	T	97.2	Very high	96.4	Very high	70 Å²	70	62.2 Å²	62.2	43%	0.429	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	89.6	-171.1	-58.6	0	0	0	0	110.5	G60 N64 T91	G60-T62 PolarHBondContact O-N 3.09Å; G60-T62 PolarHBondContact O-OG1 3.09Å; T62-N64 PolarHBondContact O-N 3.05Å; T62-T91 PolarHBondContact N-O 3.46Å; T62-T91 PolarHBondContact O-N 2.99Å
63	P	97.6	Very high	96.4	Very high	11 Å²	11	58 Å²	58	7%	0.071	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	114.6	166.2	-13	29	0	0	0	109.9	L61 Y65 V90 L198	L61-P63 WeakPolarHBondContact O-CD 3.35Å; P63-Y65 HydrophobicContact CB-CD1 4.35Å; P63-Y65 HydrophobicContact CB-CE1 4.08Å; P63-Y65 HydrophobicContact CB-CE2 4.22Å; P63-V90 HydrophobicContact CB-CG2 4.18Å; P63-L198 HydrophobicContact CB-CD1 3.63Å; P63-L198 HydrophobicContact CB-CD2 4.39Å; P63-L198 HydrophobicContact CG-CD1 4.07Å; P63-L198 HydrophobicContact CG-CD2 4.31Å
64	N	97.1	Very high	96.4	Very high	100 Å²	100	58.3 Å²	58.3	54%	0.535	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	85.3	172.1	-176	15.2	0	0	0	109.2	T62 S88 V89	T62-N64 PolarHBondContact O-N 3.05Å; N64-S88 WeakPolarHBondContact O-CA 3.46Å; N64-V89 HydrophobicContact CB-CG2 4.15Å; N64-V89 PolarHBondContact N-O 2.81Å; N64-V89 PolarHBondContact O-N 2.72Å
65	Y	97.9	Very high	96.4	Very high	8 Å²	8	55 Å²	55	3%	0.031	30%	0.299	C	S	.	.			trans	-96.7	145.2	-176.9	-71.3	-7	0	0	0	111.3	P63 V90 L103 L133 H135 P194 N195 L198	P63-Y65 HydrophobicContact CB-CD1 4.35Å; P63-Y65 HydrophobicContact CB-CE1 4.08Å; P63-Y65 HydrophobicContact CB-CE2 4.22Å; Y65-V90 HydrophobicContact CE1-CG2 3.68Å; Y65-L103 HydrophobicContact CD1-CD2 4.39Å; Y65-L103 HydrophobicContact CE1-CB 4.33Å; Y65-L103 HydrophobicContact CE1-CD2 4.13Å; Y65-L103 HydrophobicContact CE2-CD2 4.38Å; Y65-L133 HydrophobicContact CE2-CD2 3.54Å; Y65-L133 WeakPolarHBondContact OH-CD2 3.38Å; Y65-H135 AromaticContact CE1-NE2 3.58Å; Y65-H135 AromaticContact CZ-NE2 3.49Å; Y65-H135 PolarHBondContact OH-CE1 3.41Å; Y65-H135 PolarHBondContact OH-NE2 3.25Å; Y65-P194 HydrophobicContact CD2-CB 3.87Å; Y65-P194 HydrophobicContact CD2-CG 4.29Å; Y65-P194 HydrophobicContact CE2-CB 4.43Å; Y65-P194 HydrophobicContact CG-CB 4.33Å; Y65-P194 HydrophobicContact CG-CG 4.26Å; Y65-N195 VanDerWaalsContact C-ND2 3.3Å; Y65-N195 WeakPolarHBondContact CB-ND2 3.4Å; Y65-N195 PolarHBondContact O-ND2 2.87Å; Y65-L198 HydrophobicContact CD2-CD1 3.69Å; Y65-L198 HydrophobicContact CD2-CG 4.08Å; Y65-L198 HydrophobicContact CE2-CD1 3.78Å; Y65-L198 HydrophobicContact CE2-CD2 3.81Å; Y65-L198 HydrophobicContact CE2-CG 3.88Å
66	V	97	Very high	96.5	Very high	62 Å²	62	53.9 Å²	53.9	38%	0.376	29%	0.289	S	S	.	.			trans	-124.2	159.1	177.2	-61.5	0	0	0	0	110.1	C68 S88 P194	V66-C68 PolarHBondContact O-N 3.25Å; V66-S88 PolarHBondContact N-OG 3Å; V66-S88 PolarHBondContact O-OG 2.96Å; V66-P194 VanDerWaalsContact O-CD 3.32Å; V66-P194 WeakPolarHBondContact O-CD 3.47Å
67	V	97.1	Very high	96.5	Very high	77 Å²	77	54 Å²	54	47%	0.467	29%	0.291	S	S	.	.			trans	-62.2	124.9	176.3	179.9	0	0	0	0	109.4	C191 N193	V67-C191 HydrophobicContact CG1-CB 4.2Å; V67-N193 HydrophobicContact CG2-CB 4.07Å
68	C	96.1	Very high	96.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	134	167.2	165.9	0	0	0	0	109	V66 C71 L84 C191 F192	V66-C68 PolarHBondContact O-N 3.25Å; C68-C71 HydrophobicContact CB-CB 4.42Å; C68-C71 WeakPolarHBondContact CB-SG 3.27Å; C68-C71 PolarHBondContact O-SG 2.96Å; C68-C71 WeakPolarHBondContact SG-CB 3.21Å; C68-C71 CovalentContact SG-SG 2.03Å; C68-C71 PolarHBondContact SG-SG 3.28Å; C68-L84 HydrophobicContact CB-CD2 3.84Å; C68-C191 CarbonylContact O-C 3.5Å; C68-C191 VanDerWaalsContact O-CA 3.3Å; C68-C191 WeakPolarHBondContact O-CA 3.44Å; C68-F192 PolarHBondContact N-O 2.81Å; C68-F192 PolarHBondContact O-N 3.12Å
69	R	95.1	Very high	96.8	Very high	197 Å²	197	44.6 Å²	44.6	74%	0.743	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.9	171.7	-67.6	-177.3	179.5	-106.1	1.5	108.8	C71 P190	R69-C71 PolarHBondContact O-N 3.08Å; R69-P190 WeakPolarHBondContact CA-O 3.48Å
70	D	93.1	Very high	97	Very high	109 Å²	109	40.3 Å²	40.3	58%	0.583	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	50.8	47.5	-179.5	-55.9	-37.5	0	0	0	112.2	I188 I189 P190	D70-I188 HydrophobicContact CB-CG2 3.89Å; D70-I189 CarbonylContact C-O 3.41Å; D70-I189 VanDerWaalsContact CA-O 3.28Å; D70-I189 WeakPolarHBondContact CA-O 3.45Å; D70-I189 PolarHBondContact N-O 2.87Å; D70-P190 PolarHBondContact N-O 3.15Å
71	C	94.5	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	145.7	179.2	-39	0	0	0	0	109.5	C68 R69 I82 I188 I189	C68-C71 HydrophobicContact CB-CB 4.42Å; C68-C71 WeakPolarHBondContact CB-SG 3.27Å; C68-C71 PolarHBondContact O-SG 2.96Å; C68-C71 WeakPolarHBondContact SG-CB 3.21Å; C68-C71 CovalentContact SG-SG 2.03Å; C68-C71 PolarHBondContact SG-SG 3.28Å; R69-C71 PolarHBondContact O-N 3.08Å; C71-I82 HydrophobicContact CB-CG2 4.29Å; C71-I188 WeakPolarHBondContact O-CA 3.21Å; C71-I189 HydrophobicContact CB-CD1 4.46Å; C71-I189 HydrophobicContact CB-CG1 4.02Å; C71-I189 PolarHBondContact N-O 2.92Å; C71-I189 VanDerWaalsContact N-O 3.12Å; C71-I189 WeakPolarHBondContact O-CG1 3.05Å; C71-I189 PolarHBondContact O-N 2.76Å
72	E	97.5	Very high	97.2	Very high	50 Å²	50	40.1 Å²	40.1	23%	0.234	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125	-177.6	-168.7	176.9	-170.4	0	0	110.3	I74 I82 I83 T186	E72-I74 HydrophobicContact CG-CD1 4.07Å; E72-I74 HydrophobicContact CG-CG1 3.81Å; E72-I82 CarbonylContact O-C 3.59Å; E72-I82 WeakPolarHBondContact O-CA 3.33Å; E72-I83 HydrophobicContact CB-CB 4.22Å; E72-I83 PolarHBondContact N-O 3.32Å; E72-I83 PolarHBondContact O-N 2.79Å; E72-T186 VanDerWaalsContact CD-OG1 3.32Å; E72-T186 WeakPolarHBondContact CG-OG1 3.43Å; E72-T186 PolarHBondContact OE1-OG1 3.49Å
73	V	98.4	Very high	97.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.2	174.6	-169.5	0	0	0	0	108.8	R81 I82 I173 V176 L180 T186 K187 I189	V73-R81 CarbonylContact C-O 3.2Å; V73-R81 VanDerWaalsContact CA-O 3.25Å; V73-R81 WeakPolarHBondContact CA-O 3.4Å; V73-I82 HydrophobicContact CG2-CG1 4.45Å; V73-I173 HydrophobicContact CG1-CG2 4.21Å; V73-I173 HydrophobicContact CG2-CD1 4.09Å; V73-V176 HydrophobicContact CB-CG2 4.49Å; V73-V176 HydrophobicContact CG2-CG2 4.42Å; V73-L180 HydrophobicContact CB-CD1 3.78Å; V73-L180 HydrophobicContact CG1-CD1 3.42Å; V73-L180 VanDerWaalsContact CG1-CD1 3.42Å; V73-T186 CarbonylContact O-C 3.48Å; V73-T186 VanDerWaalsContact O-CA 3.28Å; V73-T186 WeakPolarHBondContact O-CA 3.47Å; V73-K187 PolarHBondContact N-O 2.9Å; V73-K187 PolarHBondContact O-N 3.03Å; V73-I189 HydrophobicContact CG2-CD1 3.78Å; V73-I189 HydrophobicContact CG2-CG1 4.07Å; V73-I189 HydrophobicContact CG2-CG2 4.03Å
74	I	98.5	Very high	97	Very high	38 Å²	38	37.8 Å²	37.8	20%	0.195	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.3	-171.1	-50.4	175	0	0	0	109.2	E72 D76 A80 R81 I83 K185	E72-I74 HydrophobicContact CG-CD1 4.07Å; E72-I74 HydrophobicContact CG-CG1 3.81Å; I74-D76 HydrophobicContact CG2-CB 4.45Å; I74-A80 CarbonylContact O-C 3.26Å; I74-A80 VanDerWaalsContact O-CA 3.3Å; I74-A80 WeakPolarHBondContact O-CA 3.38Å; I74-R81 PolarHBondContact N-O 3.08Å; I74-R81 PolarHBondContact O-N 3.23Å; I74-I83 HydrophobicContact CD1-CD1 4.43Å; I74-I83 HydrophobicContact CD1-CG1 3.75Å; I74-K185 WeakPolarHBondContact CA-O 3.39Å
75	N	98.6	Very high	96.4	Very high	1 Å²	1	42 Å²	42	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	107	157	174.7	-0.5	0	0	0	107.6	G77 L180 Q181 Y182 K183 G184 K185 R245	N75-G77 VanDerWaalsContact C-N 3.3Å; N75-G77 WeakPolarHBondContact OD1-CA 3.24Å; N75-G77 PolarHBondContact OD1-N 3.31Å; N75-L180 HydrophobicContact CB-CB 4.33Å; N75-L180 WeakPolarHBondContact CB-O 3.28Å; N75-L180 PolarHBondContact ND2-O 3.03Å; N75-Q181 PolarHBondContact ND2-O 3.34Å; N75-Y182 VanDerWaalsContact ND2-C 3.32Å; N75-Y182 PolarHBondContact ND2-O 3.12Å; N75-K183 CarbonylContact O-C 3.59Å; N75-G184 PolarHBondContact O-N 3.1Å; N75-K185 PolarHBondContact N-O 3.46Å; N75-R245 PolarHBondContact ND2-O 3.28Å
76	D	97.1	Very high	95.7	Very high	33 Å²	33	42.1 Å²	42.1	18%	0.176	20%	0.196	C	C	.	.			trans	-89.5	3.2	-179.1	69.8	4.6	0	0	0	113.4	I74 H78 T79 R81 K183	I74-D76 HydrophobicContact CG2-CB 4.45Å; D76-H78 VanDerWaalsContact C-N 3.32Å; D76-H78 PolarHBondContact O-CD2 3.17Å; D76-H78 WeakPolarHBondContact OD1-CA 3.39Å; D76-H78 IonicContact OD1-CD2 2.68Å; D76-H78 PolarHBondContact OD1-N 3.07Å; D76-T79 PolarHBondContact N-O 2.65Å; D76-T79 PolarHBondContact OD1-N 3.25Å; D76-T79 VanDerWaalsContact OD1-O 3.11Å; D76-R81 WeakPolarHBondContact OD2-CD 3.49Å; D76-R81 IonicContact OD2-NE 2.84Å; D76-R81 IonicContact OD2-NH1 3.65Å; D76-R81 PolarHBondContact OD2-NH1 3.31Å; D76-K183 WeakPolarHBondContact O-CE 3.11Å; D76-K183 WeakPolarHBondContact O-CG 3.36Å
77	G	97.3	Very high	95.5	Very high	3 Å²	3	46.1 Å²	46.1	3%	0.031	21%	0.208	C	C	.	.	S	Bend	trans	90.3	-12.5	-176.1	0	0	0	0	0	114.2	N75 S246 L261	N75-G77 VanDerWaalsContact C-N 3.3Å; N75-G77 WeakPolarHBondContact OD1-CA 3.24Å; N75-G77 PolarHBondContact OD1-N 3.31Å; G77-S246 WeakPolarHBondContact CA-O 3.44Å; G77-S246 VanDerWaalsContact O-CA 3.27Å; G77-S246 WeakPolarHBondContact O-CA 3.32Å; G77-S246 WeakPolarHBondContact O-CB 3.42Å; G77-L261 WeakPolarHBondContact O-CD1 3.47Å
78	H	97.6	Very high	95.5	Very high	27 Å²	27	42.4 Å²	42.4	13%	0.125	19%	0.186	C	C	.	.	S	Bend	trans	-117.5	-26.9	179.1	-48.7	-79.3	0	0	0	112	W20 Y22 D76 N264	W20-H78 AromaticContact CD2-ND1 3.95Å; W20-H78 AromaticContact CE2-CE1 3.81Å; W20-H78 AromaticContact CE2-ND1 3.78Å; W20-H78 AromaticContact CE3-ND1 3.96Å; W20-H78 HydrophobicContact CH2-CB 3.62Å; W20-H78 AromaticContact CH2-CG 3.62Å; W20-H78 AromaticContact CH2-ND1 3.67Å; W20-H78 HydrophobicContact CZ2-CB 4.01Å; W20-H78 AromaticContact CZ2-CD2 3.95Å; W20-H78 AromaticContact CZ2-CG 3.58Å; W20-H78 AromaticContact CZ2-ND1 3.65Å; W20-H78 HydrophobicContact CZ3-CB 4.29Å; W20-H78 AromaticContact CZ3-ND1 3.83Å; W20-H78 PolarHBondContact O-CE1 3.15Å; W20-H78 PolarHBondContact O-ND1 3.36Å; Y22-H78 HydrophobicContact CE2-CB 4.31Å; D76-H78 VanDerWaalsContact C-N 3.32Å; D76-H78 PolarHBondContact O-CD2 3.17Å; D76-H78 WeakPolarHBondContact OD1-CA 3.39Å; D76-H78 IonicContact OD1-CD2 2.68Å; D76-H78 PolarHBondContact OD1-N 3.07Å; H78-N264 PolarHBondContact O-ND2 3.23Å
79	T	98.5	Very high	95.6	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.018	19%	0.192	C	C	.	.			trans	-157.2	164.1	176.1	177.3	0	0	0	0	110.6	D76 R81 R107 F108	D76-T79 PolarHBondContact N-O 2.65Å; D76-T79 PolarHBondContact OD1-N 3.25Å; D76-T79 VanDerWaalsContact OD1-O 3.11Å; T79-R81 HydrophobicContact CG2-CG 3.45Å; T79-R81 VanDerWaalsContact CG2-CG 3.45Å; T79-R107 HydrophobicContact CG2-CB 4.46Å; T79-R107 HydrophobicContact CG2-CG 4.5Å; T79-F108 PolarHBondContact OG1-N 2.82Å; T79-F108 VanDerWaalsContact OG1-N 3.07Å; T79-F108 PolarHBondContact OG1-O 2.74Å
80	A	98.3	Very high	95.7	Very high	1 Å²	1	34 Å²	34	1%	0.008	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	140.1	154	0	0	0	0	0	108.8	I74 F108 W110 L177 F241 L244	I74-A80 CarbonylContact O-C 3.26Å; I74-A80 VanDerWaalsContact O-CA 3.3Å; I74-A80 WeakPolarHBondContact O-CA 3.38Å; A80-F108 HydrophobicContact CB-CD2 4.23Å; A80-F108 WeakPolarHBondContact O-CD2 3.37Å; A80-W110 HydrophobicContact CB-CH2 4.5Å; A80-W110 HydrophobicContact CB-CZ3 4.47Å; A80-L177 HydrophobicContact CB-CD2 4.42Å; A80-F241 HydrophobicContact CB-CD1 4.35Å; A80-F241 HydrophobicContact CB-CE1 3.95Å; A80-L244 HydrophobicContact CB-CD1 4.11Å
81	R	97.7	Very high	96	Very high	52 Å²	52	30.9 Å²	30.9	20%	0.196	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.6	179.1	-61.5	176.4	57.4	179.3	-5	110.3	V73 I74 D76 T79 I83 E105 V106 R107	V73-R81 CarbonylContact C-O 3.2Å; V73-R81 VanDerWaalsContact CA-O 3.25Å; V73-R81 WeakPolarHBondContact CA-O 3.4Å; I74-R81 PolarHBondContact N-O 3.08Å; I74-R81 PolarHBondContact O-N 3.23Å; D76-R81 WeakPolarHBondContact OD2-CD 3.49Å; D76-R81 IonicContact OD2-NE 2.84Å; D76-R81 IonicContact OD2-NH1 3.65Å; D76-R81 PolarHBondContact OD2-NH1 3.31Å; T79-R81 HydrophobicContact CG2-CG 3.45Å; T79-R81 VanDerWaalsContact CG2-CG 3.45Å; R81-I83 HydrophobicContact CB-CD1 4.44Å; R81-E105 IonicContact CZ-OE1 2.98Å; R81-E105 IonicContact CZ-OE2 3Å; R81-E105 IonicContact NE-OE1 3.79Å; R81-E105 IonicContact NE-OE2 3.88Å; R81-E105 PolarHBondContact NE-OE2 3.11Å; R81-E105 IonicContact NH2-OE1 3.56Å; R81-E105 PolarHBondContact NH2-OE1 3.01Å; R81-E105 IonicContact NH2-OE2 3.04Å; R81-E105 PolarHBondContact NH2-OE2 3.38Å; R81-V106 CarbonylContact C-O 3.58Å; R81-V106 VanDerWaalsContact CA-O 3.3Å; R81-V106 WeakPolarHBondContact CA-O 3.37Å; R81-R107 HydrophobicContact CG-CG 4.14Å
82	I	98.1	Very high	96.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	108.8	169.6	-53	164	0	0	0	107	C71 E72 V73 L84 E105 V106 F108 I173 F192	C71-I82 HydrophobicContact CB-CG2 4.29Å; E72-I82 CarbonylContact O-C 3.59Å; E72-I82 WeakPolarHBondContact O-CA 3.33Å; V73-I82 HydrophobicContact CG2-CG1 4.45Å; I82-L84 HydrophobicContact CG2-CG 4.36Å; I82-E105 CarbonylContact O-C 3.52Å; I82-E105 WeakPolarHBondContact O-CA 3.31Å; I82-E105 WeakPolarHBondContact O-CB 3.44Å; I82-V106 HydrophobicContact CB-CB 4.25Å; I82-V106 HydrophobicContact CD1-CB 4.23Å; I82-V106 PolarHBondContact N-O 2.85Å; I82-V106 PolarHBondContact O-N 2.84Å; I82-F108 HydrophobicContact CD1-CE2 3.71Å; I82-F108 HydrophobicContact CD1-CZ 3.73Å; I82-F108 HydrophobicContact CG1-CE2 3.99Å; I82-F108 HydrophobicContact CG1-CZ 4.48Å; I82-I173 HydrophobicContact CD1-CD1 3.5Å; I82-I173 VanDerWaalsContact CD1-CD1 3.5Å; I82-I173 HydrophobicContact CD1-CG1 3.66Å; I82-I173 HydrophobicContact CD1-CG2 4.27Å; I82-I173 HydrophobicContact CG1-CD1 3.98Å; I82-I173 HydrophobicContact CG1-CG1 4.49Å; I82-I173 HydrophobicContact CG1-CG2 4.49Å; I82-F192 HydrophobicContact CD1-CE1 4.06Å; I82-F192 HydrophobicContact CD1-CE2 4.32Å; I82-F192 HydrophobicContact CD1-CZ 3.95Å; I82-F192 HydrophobicContact CG2-CD1 4.22Å
83	I	97.6	Very high	96.1	Very high	22 Å²	22	29.5 Å²	29.5	11%	0.113	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	120.5	174.5	-50.3	-55.7	0	0	0	108.2	E72 I74 R81 E105	E72-I83 HydrophobicContact CB-CB 4.22Å; E72-I83 PolarHBondContact N-O 3.32Å; E72-I83 PolarHBondContact O-N 2.79Å; I74-I83 HydrophobicContact CD1-CD1 4.43Å; I74-I83 HydrophobicContact CD1-CG1 3.75Å; R81-I83 HydrophobicContact CB-CD1 4.44Å; I83-E105 HydrophobicContact CD1-CB 4.08Å; I83-E105 VanDerWaalsContact CD1-OE2 3.27Å; I83-E105 WeakPolarHBondContact CD1-OE2 3.34Å
84	L	93.8	Very high	95.9	Very high	10 Å²	10	31 Å²	31	5%	0.052	15%	0.15	C	C	.	.			trans	-101.1	131.1	-178.6	-59	120.1	0	0	0	109.6	C68 I82 L103 H104 V106 F192 P194	C68-L84 HydrophobicContact CB-CD2 3.84Å; I82-L84 HydrophobicContact CG2-CG 4.36Å; L84-L103 HydrophobicContact CD1-CD1 4.18Å; L84-L103 HydrophobicContact CD1-CD2 3.81Å; L84-L103 HydrophobicContact CD1-CG 3.69Å; L84-L103 HydrophobicContact CD2-CD2 4.34Å; L84-H104 PolarHBondContact N-O 3.04Å; L84-V106 HydrophobicContact CD1-CG2 3.83Å; L84-F192 HydrophobicContact CD2-CD1 3.95Å; L84-F192 HydrophobicContact CD2-CE1 4.39Å; L84-P194 HydrophobicContact CD2-CB 4.31Å; L84-P194 HydrophobicContact CD2-CG 3.97Å
85	R	84.4	Confident	95.9	Very high	188 Å²	188	29.9 Å²	29.9	71%	0.709	14%	0.144	S	C	*	.			trans	-115.2	48.4	175.5	-61.1	-179.4	-174.5	-104.2	1.6	109.9
86	S	84.4	Confident	95.7	Very high	12 Å²	12	31.8 Å²	31.8	8%	0.084	16%	0.157	C	C	.	.	S	Bend	trans	-132.3	146.1	-175.1	71.3	0	0	0	0	110.6	S88	S86-S88 PolarHBondContact O-N 3.13Å; S86-S88 PolarHBondContact OG-OG 2.98Å
87	K	90.9	Very high	95.3	Very high	145 Å²	145	36 Å²	36	63%	0.63	19%	0.189	S	C	*	.			trans	-75.4	61.7	176.7	-67.1	-65.4	179.8	-166.8	0	112.2	E102	K87-E102 VanDerWaalsContact NZ-CD 3.3Å; K87-E102 IonicContact NZ-OE1 3.11Å; K87-E102 PolarHBondContact NZ-OE1 2.81Å; K87-E102 VanDerWaalsContact NZ-OE1 3.11Å; K87-E102 IonicContact NZ-OE2 2.65Å; K87-E102 PolarHBondContact NZ-OE2 3.06Å
88	S	97.6	Very high	95	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.			trans	-92.2	122.4	171.7	-72.7	0	0	0	0	108	N64 V66 S86 E102 L103	N64-S88 WeakPolarHBondContact O-CA 3.46Å; V66-S88 PolarHBondContact N-OG 3Å; V66-S88 PolarHBondContact O-OG 2.96Å; S86-S88 PolarHBondContact O-N 3.13Å; S86-S88 PolarHBondContact OG-OG 2.98Å; S88-E102 WeakPolarHBondContact O-CA 3.49Å; S88-L103 PolarHBondContact O-N 3.16Å
89	V	97.9	Very high	95	Very high	21 Å²	21	40.8 Å²	40.8	13%	0.127	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	156.6	-173	-61.9	0	0	0	0	112.1	N64 Y101 E102	N64-V89 HydrophobicContact CB-CG2 4.15Å; N64-V89 PolarHBondContact N-O 2.81Å; N64-V89 PolarHBondContact O-N 2.72Å; V89-Y101 CarbonylContact C-O 3.47Å; V89-Y101 VanDerWaalsContact CA-O 3.29Å; V89-Y101 WeakPolarHBondContact CA-O 3.32Å; V89-E102 HydrophobicContact CG1-CB 4.38Å
90	V	98.3	Very high	95	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.3	170.3	-176	0	0	0	0	109.2	L61 P63 Y65 L95 Y101 H135 L155 I157	L61-V90 HydrophobicContact CD1-CG1 3.55Å; L61-V90 HydrophobicContact CG-CG1 4.24Å; P63-V90 HydrophobicContact CB-CG2 4.18Å; Y65-V90 HydrophobicContact CE1-CG2 3.68Å; V90-L95 HydrophobicContact CG1-CD1 3.98Å; V90-Y101 PolarHBondContact N-O 3.36Å; V90-Y101 PolarHBondContact O-N 3.03Å; V90-H135 VanDerWaalsContact CG2-NE2 3.27Å; V90-H135 WeakPolarHBondContact CG2-NE2 3.33Å; V90-L155 HydrophobicContact CB-CD2 4.06Å; V90-L155 HydrophobicContact CG1-CD2 3.95Å; V90-I157 HydrophobicContact CG1-CD1 4.47Å; V90-I157 HydrophobicContact CG2-CD1 4.04Å
91	T	98.3	Very high	95	Very high	42 Å²	42	45.3 Å²	45.3	26%	0.258	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	170.6	173.8	61.3	0	0	0	0	110.6	T62 E100	T62-T91 PolarHBondContact N-O 3.46Å; T62-T91 PolarHBondContact O-N 2.99Å; T91-E100 HydrophobicContact CG2-CB 4.49Å; T91-E100 HydrophobicContact CG2-CG 3.93Å
92	G	97.4	Very high	95	Very high	7 Å²	7	44.3 Å²	44.3	7%	0.072	23%	0.232	C	C	.	.	S	Bend	trans	71	-163	175.4	0	0	0	0	0	114.4	P94 L95	G92-P94 WeakPolarHBondContact O-CD 3.26Å; G92-L95 VanDerWaalsContact O-CB 3.31Å; G92-L95 WeakPolarHBondContact O-CB 3.42Å; G92-L95 VanDerWaalsContact O-CG 3.23Å; G92-L95 WeakPolarHBondContact O-CG 3.26Å; G92-L95 PolarHBondContact O-N 3.21Å; G92-L95 VanDerWaalsContact O-N 3.15Å
93	G	96.5	Very high	95	Very high	14 Å²	14	44.3 Å²	44.3	14%	0.144	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	-116.6	-171.6	0	0	0	0	0	110.9	V59 L95 Y206	V59-G93 WeakPolarHBondContact O-CA 3.36Å; V59-G93 PolarHBondContact O-N 3.41Å; G93-L95 VanDerWaalsContact C-N 3.33Å; G93-Y206 WeakPolarHBondContact CA-OH 3.27Å
94	P	95.9	Very high	95	Very high	32 Å²	32	45.7 Å²	45.7	21%	0.208	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.3	179.2	34.1	-34.2	0	0	0	114.7	L56 G92 I208 I225	L56-P94 HydrophobicContact CD2-CB 3.68Å; G92-P94 WeakPolarHBondContact O-CD 3.26Å; P94-I208 HydrophobicContact CB-CD1 3.11Å; P94-I208 HydrophobicContact CB-CG1 4.44Å; P94-I208 HydrophobicContact CG-CD1 3.34Å; P94-I225 HydrophobicContact CG-CD1 3.84Å; P94-I225 HydrophobicContact CG-CG1 4.29Å
95	L	97	Very high	95.2	Very high	14 Å²	14	45.3 Å²	45.3	7%	0.073	24%	0.236	C	C	.	.	S	Bend	trans	-79.4	149.9	-172.6	-52.8	173	0	0	0	110.6	L61 V90 G92 G93 Y101 L155	L61-L95 HydrophobicContact CD1-CD1 4.5Å; V90-L95 HydrophobicContact CG1-CD1 3.98Å; G92-L95 VanDerWaalsContact O-CB 3.31Å; G92-L95 WeakPolarHBondContact O-CB 3.42Å; G92-L95 VanDerWaalsContact O-CG 3.23Å; G92-L95 WeakPolarHBondContact O-CG 3.26Å; G92-L95 PolarHBondContact O-N 3.21Å; G92-L95 VanDerWaalsContact O-N 3.15Å; G93-L95 VanDerWaalsContact C-N 3.33Å; L95-Y101 HydrophobicContact CB-CE2 4.14Å; L95-Y101 HydrophobicContact CD1-CD2 3.73Å; L95-Y101 HydrophobicContact CD1-CE2 4.12Å; L95-Y101 HydrophobicContact CD1-CG 4.42Å; L95-Y101 HydrophobicContact CD2-CD2 4.05Å; L95-Y101 HydrophobicContact CD2-CE2 3.72Å; L95-Y101 HydrophobicContact CG-CD2 4.31Å; L95-Y101 HydrophobicContact CG-CE2 4.19Å; L95-L155 HydrophobicContact CD1-CD2 3.82Å; L95-L155 HydrophobicContact CD2-CD1 4.16Å; L95-L155 HydrophobicContact CD2-CD2 4Å; L95-L155 HydrophobicContact CD2-CG 4.47Å; L95-L155 HydrophobicContact CG-CD2 4.48Å
96	P	95.1	Very high	95.9	Very high	42 Å²	42	36.4 Å²	36.4	27%	0.273	20%	0.203	S	C	.	.			trans	-56.3	141.8	171.5	-24.1	35.7	0	0	0	111.3	D98 H99	P96-D98 PolarHBondContact O-N 3.3Å; P96-D98 VanDerWaalsContact O-N 3.07Å; P96-H99 HydrophobicContact CB-CB 4.19Å; P96-H99 WeakPolarHBondContact CG-ND1 3.42Å; P96-H99 PolarHBondContact O-N 3.14Å
97	S	89.3	Confident	96.5	Very high	121 Å²	121	38 Å²	38	85%	0.846	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24	-164.2	48.9	0	0	0	0	115.7
98	D	91.1	Very high	96.9	Very high	112 Å²	112	31 Å²	31	60%	0.599	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	7.2	-177.7	61.2	-30.8	0	0	0	112.9	P96 T139	P96-D98 PolarHBondContact O-N 3.3Å; P96-D98 VanDerWaalsContact O-N 3.07Å; D98-T139 PolarHBondContact O-OG1 2.73Å
99	H	97.3	Very high	97	Very high	19 Å²	19	31.1 Å²	31.1	9%	0.088	18%	0.177	C	C	.	.			trans	-94.9	134.3	-179	-70.9	-166.3	0	0	0	112	P96 Y101 N137 T139	P96-H99 HydrophobicContact CB-CB 4.19Å; P96-H99 WeakPolarHBondContact CG-ND1 3.42Å; P96-H99 PolarHBondContact O-N 3.14Å; H99-Y101 HydrophobicContact CB-CD2 4.36Å; H99-Y101 HydrophobicContact CB-CE2 3.74Å; H99-N137 PolarHBondContact ND1-ND2 3.24Å; H99-T139 WeakPolarHBondContact CA-OG1 3.33Å
100	E	97.9	Very high	97	Very high	97 Å²	97	30.1 Å²	30.1	45%	0.453	17%	0.171	S	C	.	.			trans	-108.4	134.2	170.3	-63.5	-169.4	166.2	0	0	110.3	T91 N137 T138 T139	T91-E100 HydrophobicContact CG2-CB 4.49Å; T91-E100 HydrophobicContact CG2-CG 3.93Å; E100-N137 WeakPolarHBondContact O-CA 3.47Å; E100-T138 PolarHBondContact O-N 3.41Å; E100-T138 PolarHBondContact O-OG1 3.15Å; E100-T139 PolarHBondContact N-OG1 3.4Å
101	Y	98.4	Very high	97	Very high	1 Å²	1	30.1 Å²	30.1	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	108.7	176.4	-72.5	-104.5	0	0	0	109.4	V89 V90 L95 H99 W136 N137 N152 L155	V89-Y101 CarbonylContact C-O 3.47Å; V89-Y101 VanDerWaalsContact CA-O 3.29Å; V89-Y101 WeakPolarHBondContact CA-O 3.32Å; V90-Y101 PolarHBondContact N-O 3.36Å; V90-Y101 PolarHBondContact O-N 3.03Å; L95-Y101 HydrophobicContact CB-CE2 4.14Å; L95-Y101 HydrophobicContact CD1-CD2 3.73Å; L95-Y101 HydrophobicContact CD1-CE2 4.12Å; L95-Y101 HydrophobicContact CD1-CG 4.42Å; L95-Y101 HydrophobicContact CD2-CD2 4.05Å; L95-Y101 HydrophobicContact CD2-CE2 3.72Å; L95-Y101 HydrophobicContact CG-CD2 4.31Å; L95-Y101 HydrophobicContact CG-CE2 4.19Å; H99-Y101 HydrophobicContact CB-CD2 4.36Å; H99-Y101 HydrophobicContact CB-CE2 3.74Å; Y101-W136 CarbonylContact C-O 3.56Å; Y101-W136 VanDerWaalsContact CA-O 3.25Å; Y101-W136 WeakPolarHBondContact CA-O 3.41Å; Y101-N137 HydrophobicContact CD1-CB 3.94Å; Y101-N137 HydrophobicContact CE1-CB 3.56Å; Y101-N137 HydrophobicContact CE2-CB 4.38Å; Y101-N137 PolarHBondContact OH-ND2 2.73Å; Y101-N152 WeakPolarHBondContact CE1-O 3.25Å; Y101-N152 WeakPolarHBondContact OH-CB 3.39Å; Y101-N152 PolarHBondContact OH-O 3.36Å; Y101-L155 HydrophobicContact CD1-CB 3.55Å; Y101-L155 HydrophobicContact CD1-CD2 4.48Å; Y101-L155 HydrophobicContact CE1-CB 3.98Å; Y101-L155 HydrophobicContact CG-CB 4.13Å; Y101-L155 HydrophobicContact CG-CD2 4.22Å
102	E	98.3	Very high	97	Very high	31 Å²	31	31 Å²	31	15%	0.145	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	130.7	-178.4	-175.1	168.2	154.6	0	0	110.7	K87 S88 V89 H104 H135 W136 T138	K87-E102 VanDerWaalsContact NZ-CD 3.3Å; K87-E102 IonicContact NZ-OE1 3.11Å; K87-E102 PolarHBondContact NZ-OE1 2.81Å; K87-E102 VanDerWaalsContact NZ-OE1 3.11Å; K87-E102 IonicContact NZ-OE2 2.65Å; K87-E102 PolarHBondContact NZ-OE2 3.06Å; S88-E102 WeakPolarHBondContact O-CA 3.49Å; V89-E102 HydrophobicContact CG1-CB 4.38Å; E102-H104 PolarHBondContact O-N 2.89Å; E102-H135 WeakPolarHBondContact O-CA 3.46Å; E102-H135 WeakPolarHBondContact O-CB 3.19Å; E102-W136 PolarHBondContact N-O 3.32Å; E102-W136 PolarHBondContact O-N 3.18Å; E102-T138 HydrophobicContact CB-CG2 3.46Å; E102-T138 VanDerWaalsContact CB-CG2 3.46Å
103	L	98.3	Very high	97.1	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	113.3	176.7	176.9	62.1	0	0	0	109.5	Y65 L84 S88 L133 H135 P194	Y65-L103 HydrophobicContact CD1-CD2 4.39Å; Y65-L103 HydrophobicContact CE1-CB 4.33Å; Y65-L103 HydrophobicContact CE1-CD2 4.13Å; Y65-L103 HydrophobicContact CE2-CD2 4.38Å; L84-L103 HydrophobicContact CD1-CD1 4.18Å; L84-L103 HydrophobicContact CD1-CD2 3.81Å; L84-L103 HydrophobicContact CD1-CG 3.69Å; L84-L103 HydrophobicContact CD2-CD2 4.34Å; S88-L103 PolarHBondContact O-N 3.16Å; L103-L133 HydrophobicContact CD1-CB 3.83Å; L103-L133 HydrophobicContact CD1-CG 4.31Å; L103-H135 VanDerWaalsContact CA-CD2 3.44Å; L103-H135 WeakPolarHBondContact CA-CD2 3.44Å; L103-P194 HydrophobicContact CD2-CB 3.71Å; L103-P194 HydrophobicContact CD2-CG 3.93Å
104	H	97.2	Very high	97.2	Very high	50 Å²	50	36.9 Å²	36.9	23%	0.231	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-48.2	179.1	177.7	60.2	0	0	0	111.5	L84 E102 I134 V144	L84-H104 PolarHBondContact N-O 3.04Å; E102-H104 PolarHBondContact O-N 2.89Å; H104-I134 PolarHBondContact N-O 2.85Å; H104-V144 HydrophobicContact CB-CG2 4.07Å
105	E	97.6	Very high	97.3	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	166.1	-174.3	66.2	177.6	172.4	0	0	114.5	R81 I82 I83 R107 I134	R81-E105 IonicContact CZ-OE1 2.98Å; R81-E105 IonicContact CZ-OE2 3Å; R81-E105 IonicContact NE-OE1 3.79Å; R81-E105 IonicContact NE-OE2 3.88Å; R81-E105 PolarHBondContact NE-OE2 3.11Å; R81-E105 IonicContact NH2-OE1 3.56Å; R81-E105 PolarHBondContact NH2-OE1 3.01Å; R81-E105 IonicContact NH2-OE2 3.04Å; R81-E105 PolarHBondContact NH2-OE2 3.38Å; I82-E105 CarbonylContact O-C 3.52Å; I82-E105 WeakPolarHBondContact O-CA 3.31Å; I82-E105 WeakPolarHBondContact O-CB 3.44Å; I83-E105 HydrophobicContact CD1-CB 4.08Å; I83-E105 VanDerWaalsContact CD1-OE2 3.27Å; I83-E105 WeakPolarHBondContact CD1-OE2 3.34Å; E105-R107 HydrophobicContact CG-CG 4.47Å; E105-R107 IonicContact OE1-CZ 3.2Å; E105-R107 IonicContact OE1-NE 2.74Å; E105-R107 PolarHBondContact OE1-NE 3.35Å; E105-R107 IonicContact OE1-NH2 3.56Å; E105-R107 PolarHBondContact OE1-NH2 3.4Å; E105-R107 IonicContact OE2-NE 3.77Å; E105-I134 HydrophobicContact CG-CB 3.94Å; E105-I134 HydrophobicContact CG-CD1 4.03Å; E105-I134 HydrophobicContact CG-CG1 4.28Å; E105-I134 PolarHBondContact N-O 2.91Å; E105-I134 PolarHBondContact O-N 3.38Å
106	V	98.7	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.4	167.1	-173.8	0	0	0	0	110	R81 I82 L84 F108 L131 H132 L133 L197	R81-V106 CarbonylContact C-O 3.58Å; R81-V106 VanDerWaalsContact CA-O 3.3Å; R81-V106 WeakPolarHBondContact CA-O 3.37Å; I82-V106 HydrophobicContact CB-CB 4.25Å; I82-V106 HydrophobicContact CD1-CB 4.23Å; I82-V106 PolarHBondContact N-O 2.85Å; I82-V106 PolarHBondContact O-N 2.84Å; L84-V106 HydrophobicContact CD1-CG2 3.83Å; V106-F108 HydrophobicContact CB-CE2 4.38Å; V106-F108 HydrophobicContact CG1-CD2 4.45Å; V106-F108 HydrophobicContact CG1-CE2 3.83Å; V106-F108 HydrophobicContact CG1-CZ 3.98Å; V106-L131 HydrophobicContact CG1-CB 4.33Å; V106-L131 HydrophobicContact CG1-CD2 4.14Å; V106-H132 CarbonylContact C-O 3.27Å; V106-H132 VanDerWaalsContact CA-O 3.24Å; V106-H132 WeakPolarHBondContact CA-O 3.46Å; V106-L133 HydrophobicContact CG1-CD1 4.3Å; V106-L133 HydrophobicContact CG2-CG 4.1Å; V106-L197 HydrophobicContact CG1-CD1 4Å; V106-L197 HydrophobicContact CG2-CD1 3.88Å
107	R	98.6	Very high	97.5	Very high	45 Å²	45	43.6 Å²	43.6	17%	0.17	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	158.2	171.4	-54.9	-164.8	-179.9	176.1	2.4	111.5	T79 R81 E105 L131 H132 I134 T215	T79-R107 HydrophobicContact CG2-CB 4.46Å; T79-R107 HydrophobicContact CG2-CG 4.5Å; R81-R107 HydrophobicContact CG-CG 4.14Å; E105-R107 HydrophobicContact CG-CG 4.47Å; E105-R107 IonicContact OE1-CZ 3.2Å; E105-R107 IonicContact OE1-NE 2.74Å; E105-R107 PolarHBondContact OE1-NE 3.35Å; E105-R107 IonicContact OE1-NH2 3.56Å; E105-R107 PolarHBondContact OE1-NH2 3.4Å; E105-R107 IonicContact OE2-NE 3.77Å; R107-L131 WeakPolarHBondContact O-CA 3.48Å; R107-H132 HydrophobicContact CB-CB 4.41Å; R107-H132 PolarHBondContact N-O 3.43Å; R107-H132 PolarHBondContact O-N 3.45Å; R107-I134 HydrophobicContact CG-CD1 3.8Å; R107-T215 PolarHBondContact NH1-OG1 3.21Å
108	F	98.9	Very high	98	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.5	-173.7	-63.7	-102.7	0	0	0	110.8	T79 A80 I82 V106 W110 M129 L131 L170 F241 N264	T79-F108 PolarHBondContact OG1-N 2.82Å; T79-F108 VanDerWaalsContact OG1-N 3.07Å; T79-F108 PolarHBondContact OG1-O 2.74Å; A80-F108 HydrophobicContact CB-CD2 4.23Å; A80-F108 WeakPolarHBondContact O-CD2 3.37Å; I82-F108 HydrophobicContact CD1-CE2 3.71Å; I82-F108 HydrophobicContact CD1-CZ 3.73Å; I82-F108 HydrophobicContact CG1-CE2 3.99Å; I82-F108 HydrophobicContact CG1-CZ 4.48Å; V106-F108 HydrophobicContact CB-CE2 4.38Å; V106-F108 HydrophobicContact CG1-CD2 4.45Å; V106-F108 HydrophobicContact CG1-CE2 3.83Å; V106-F108 HydrophobicContact CG1-CZ 3.98Å; F108-W110 HydrophobicContact CB-CE3 3.87Å; F108-W110 HydrophobicContact CB-CZ3 3.81Å; F108-W110 WeakPolarHBondContact O-CZ3 3.46Å; F108-M129 HydrophobicContact CD1-SD 4.11Å; F108-L131 HydrophobicContact CD1-CD1 4.22Å; F108-L131 HydrophobicContact CD1-CD2 4.05Å; F108-L131 HydrophobicContact CD1-CG 3.66Å; F108-L131 HydrophobicContact CE1-CD1 4.33Å; F108-L131 HydrophobicContact CE1-CD2 3.46Å; F108-L131 VanDerWaalsContact CE1-CD2 3.46Å; F108-L131 HydrophobicContact CE1-CG 3.64Å; F108-L131 HydrophobicContact CG-CG 4.46Å; F108-L131 HydrophobicContact CZ-CD2 3.99Å; F108-L131 HydrophobicContact CZ-CG 4.42Å; F108-L170 HydrophobicContact CE1-CD2 3.83Å; F108-L170 HydrophobicContact CZ-CD2 3.88Å; F108-F241 HydrophobicContact CB-CD1 4.48Å; F108-F241 HydrophobicContact CB-CE1 3.92Å; F108-F241 AromaticContact CD1-CE1 3.61Å; F108-F241 HydrophobicContact CD1-CE1 3.61Å; F108-F241 AromaticContact CD1-CZ 3.51Å; F108-F241 HydrophobicContact CD1-CZ 3.51Å; F108-F241 HydrophobicContact CD2-CE1 4.22Å; F108-F241 HydrophobicContact CE1-CE1 4.15Å; F108-F241 AromaticContact CE1-CZ 3.66Å; F108-F241 HydrophobicContact CE1-CZ 3.66Å; F108-F241 AromaticContact CG-CE1 3.66Å; F108-F241 HydrophobicContact CG-CE1 3.66Å; F108-F241 HydrophobicContact CG-CZ 4.04Å; F108-F241 HydrophobicContact CZ-CZ 4.3Å; F108-N264 PolarHBondContact O-ND2 3.13Å
109	H	98.9	Very high	98.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.6	171.1	-60.1	-89.8	0	0	0	108.3	G117 E119 M129 E130 H132 N264 F265	H109-G117 CarbonylContact C-O 3.53Å; H109-G117 VanDerWaalsContact C-O 3.27Å; H109-E119 HydrophobicContact CB-CG 3.74Å; H109-E119 IonicContact CD2-OE2 2.63Å; H109-E119 VanDerWaalsContact CE1-CD 3.47Å; H109-E119 IonicContact CE1-OE1 2.73Å; H109-E119 IonicContact CE1-OE2 2.67Å; H109-E119 PolarHBondContact CE1-OE2 2.74Å; H109-E119 VanDerWaalsContact CG-CG 3.47Å; H109-E119 IonicContact CG-OE2 3.84Å; H109-E119 IonicContact ND1-OE1 3.94Å; H109-E119 IonicContact ND1-OE2 3.42Å; H109-E119 IonicContact NE2-OE2 3.97Å; H109-E119 PolarHBondContact NE2-OE2 2.86Å; H109-M129 CarbonylContact O-C 3.56Å; H109-M129 WeakPolarHBondContact O-CA 3.27Å; H109-M129 WeakPolarHBondContact O-CB 3.45Å; H109-M129 VanDerWaalsContact O-CG 3.28Å; H109-M129 WeakPolarHBondContact O-CG 3.46Å; H109-E130 PolarHBondContact N-O 2.83Å; H109-E130 PolarHBondContact O-N 2.74Å; H109-H132 AromaticContact CD2-CE1 3.66Å; H109-H132 AromaticContact CD2-ND1 3.77Å; H109-H132 AromaticContact NE2-CE1 3.65Å; H109-H132 AromaticContact NE2-ND1 3.53Å; H109-N264 PolarHBondContact ND1-O 3.4Å; H109-F265 HydrophobicContact CB-CB 4.49Å
110	W	98.9	Very high	98.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.1	-176.5	65.9	91.1	0	0	0	112.9	A80 F108 G117 P128 M129 F241 L244 L261 D263 N264	A80-W110 HydrophobicContact CB-CH2 4.5Å; A80-W110 HydrophobicContact CB-CZ3 4.47Å; F108-W110 HydrophobicContact CB-CE3 3.87Å; F108-W110 HydrophobicContact CB-CZ3 3.81Å; F108-W110 WeakPolarHBondContact O-CZ3 3.46Å; W110-G117 VanDerWaalsContact C-CA 3.47Å; W110-G117 PolarHBondContact N-O 3.25Å; W110-P128 WeakPolarHBondContact CA-O 3.3Å; W110-M129 HydrophobicContact CB-CB 4.16Å; W110-M129 HydrophobicContact CB-CE 3.87Å; W110-M129 HydrophobicContact CB-CG 4.42Å; W110-M129 HydrophobicContact CG-CE 4.5Å; W110-F241 HydrophobicContact CD2-CB 3.91Å; W110-F241 HydrophobicContact CD2-CD1 4.16Å; W110-F241 HydrophobicContact CD2-CG 4.39Å; W110-F241 HydrophobicContact CE3-CB 4.45Å; W110-F241 AromaticContact CE3-CD1 3.83Å; W110-F241 HydrophobicContact CE3-CD1 3.83Å; W110-F241 HydrophobicContact CE3-CG 4.48Å; W110-F241 HydrophobicContact CG-CB 4.11Å; W110-F241 HydrophobicContact CH2-CD1 4.09Å; W110-F241 HydrophobicContact CZ2-CB 4.25Å; W110-F241 HydrophobicContact CZ2-CD1 4.38Å; W110-F241 AromaticContact CZ3-CD1 3.81Å; W110-F241 HydrophobicContact CZ3-CD1 3.81Å; W110-F241 HydrophobicContact CZ3-CE1 4.44Å; W110-F241 PolarHBondContact NE1-O 2.88Å; W110-L244 HydrophobicContact CH2-CD1 3.75Å; W110-L244 HydrophobicContact CZ2-CB 4.32Å; W110-L244 HydrophobicContact CZ2-CD1 3.86Å; W110-L261 HydrophobicContact CH2-CD2 3.68Å; W110-L261 HydrophobicContact CH2-CG 3.8Å; W110-L261 HydrophobicContact CZ2-CB 4.22Å; W110-L261 HydrophobicContact CZ2-CD2 3.91Å; W110-L261 HydrophobicContact CZ2-CG 3.6Å; W110-L261 WeakPolarHBondContact CZ2-O 3.29Å; W110-L261 PolarHBondContact NE1-O 3.32Å; W110-D263 WeakPolarHBondContact O-CA 3.35Å; W110-D263 PolarHBondContact O-N 3.2Å; W110-N264 WeakPolarHBondContact CZ3-ND2 3.45Å; W110-N264 PolarHBondContact N-OD1 3.44Å; W110-N264 PolarHBondContact O-N 3.03Å; W110-N264 PolarHBondContact O-OD1 3.03Å
111	G	98.6	Very high	98.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.128	C	C	.	.			trans	-92.9	152.5	177	0	0	0	0	0	112.3	E113 R116 P128 R242 D263	G111-E113 PolarHBondContact O-N 3.21Å; G111-R116 WeakPolarHBondContact CA-O 3.38Å; G111-P128 PolarHBondContact N-O 2.96Å; G111-R242 PolarHBondContact O-NE 3.26Å; G111-R242 PolarHBondContact O-NH2 2.97Å; G111-D263 WeakPolarHBondContact CA-OD1 3.49Å
112	K	98.2	Very high	98.5	Very high	60 Å²	60	29 Å²	29	26%	0.261	13%	0.134	S	C	.	.	S	Bend	trans	-65.3	-23.1	166.8	-64.3	-179.3	-177.4	-179.7	0	111.6	R242 D258 D263	K112-R242 VanDerWaalsContact O-CZ 3.25Å; K112-R242 PolarHBondContact O-NE 3Å; K112-R242 VanDerWaalsContact O-NE 3.15Å; K112-D258 IonicContact NZ-OD1 2.74Å; K112-D258 PolarHBondContact NZ-OD1 2.92Å; K112-D258 IonicContact NZ-OD2 3.72Å; K112-D258 PolarHBondContact NZ-OD2 2.89Å; K112-D263 WeakPolarHBondContact CD-OD2 3.14Å; K112-D263 WeakPolarHBondContact CG-OD2 3.4Å; K112-D263 PolarHBondContact N-OD1 3.37Å
113	E	98	Very high	98.5	Very high	98 Å²	98	31.2 Å²	31.2	46%	0.458	15%	0.146	S	C	.	.	S	Bend	trans	-128.1	159.6	177.5	-63	-66.2	166.1	0	0	111.6	G111 Q115 R242	G111-E113 PolarHBondContact O-N 3.21Å; E113-Q115 PolarHBondContact O-N 2.74Å; E113-R242 PolarHBondContact O-NH2 3.34Å
114	N	98.6	Very high	98.5	Very high	47 Å²	47	39.3 Å²	39.3	25%	0.251	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-11.6	-173	-68.5	-6.1	0	0	0	114.4	P128 I163 Q235 R242	N114-P128 VanDerWaalsContact O-CG 3.3Å; N114-P128 WeakPolarHBondContact O-CG 3.39Å; N114-I163 HydrophobicContact CB-CG1 4.43Å; N114-Q235 PolarHBondContact ND2-OE1 3.31Å; N114-R242 PolarHBondContact OD1-NH1 2.97Å; N114-R242 PolarHBondContact OD1-NH2 3.31Å
115	Q	98.1	Very high	98.6	Very high	143 Å²	143	42.8 Å²	42.8	67%	0.668	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.6	-177.4	-58.4	77.9	26	0	0	113.6	E113	E113-Q115 PolarHBondContact O-N 2.74Å
116	R	98.4	Very high	98.6	Very high	86 Å²	86	44 Å²	44	33%	0.325	21%	0.207	S	C	.	.			trans	-148.9	169.4	-176.9	67.2	-172.4	-175	-94	0.8	110.7	G111 F127 P128 D263 F265	G111-R116 WeakPolarHBondContact CA-O 3.38Å; R116-F127 CarbonylContact C-O 3.5Å; R116-P128 CarbonylContact O-C 3.56Å; R116-P128 VanDerWaalsContact O-CA 3.29Å; R116-P128 WeakPolarHBondContact O-CA 3.48Å; R116-D263 IonicContact CZ-OD1 3.27Å; R116-D263 IonicContact CZ-OD2 3.96Å; R116-D263 VanDerWaalsContact NE-CG 3.28Å; R116-D263 IonicContact NE-OD1 3.16Å; R116-D263 PolarHBondContact NE-OD1 3.45Å; R116-D263 IonicContact NE-OD2 3.92Å; R116-D263 PolarHBondContact NE-OD2 3.34Å; R116-D263 IonicContact NH2-OD1 3.58Å; R116-D263 PolarHBondContact NH2-OD1 3.21Å; R116-D263 IonicContact NH2-OD2 3.05Å; R116-D263 PolarHBondContact NH2-OD2 2.99Å; R116-F265 HydrophobicContact CB-CE1 4.43Å; R116-F265 HydrophobicContact CB-CZ 4.23Å; R116-F265 HydrophobicContact CG-CE1 4.25Å; R116-F265 HydrophobicContact CG-CZ 4.21Å
117	G	98.6	Very high	98.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.211	C	C	.	.			trans	141.3	-30.5	174.9	0	0	0	0	0	115.3	H109 W110 F127 P128 F265	H109-G117 CarbonylContact C-O 3.53Å; H109-G117 VanDerWaalsContact C-O 3.27Å; W110-G117 VanDerWaalsContact C-CA 3.47Å; W110-G117 PolarHBondContact N-O 3.25Å; G117-F127 CarbonylContact C-O 3.54Å; G117-F127 WeakPolarHBondContact CA-O 3.19Å; G117-F127 PolarHBondContact N-O 3.49Å; G117-P128 WeakPolarHBondContact CA-O 3.43Å; G117-F265 VanDerWaalsContact CA-CD1 3.5Å; G117-F265 WeakPolarHBondContact O-CD1 3.29Å
118	S	98.9	Very high	98.6	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.028	21%	0.206	C	C	.	.			trans	-70	148	170.7	63.8	0	0	0	0	111.2	H120 F127 E130	S118-H120 WeakPolarHBondContact CB-O 3.46Å; S118-H120 PolarHBondContact OG-O 2.91Å; S118-F127 PolarHBondContact N-O 3.46Å; S118-F127 PolarHBondContact OG-N 3.1Å; S118-E130 WeakPolarHBondContact CB-OE2 3.13Å
119	E	98.9	Very high	98.6	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	21%	0.206	C	C	.	.	S	Bend	trans	-78	-50.9	174.4	-62.5	-138.7	90.6	0	0	109.6	P42 H109 E130 H132 T214 F265 R266	P42-E119 VanDerWaalsContact CB-C 3.44Å; P42-E119 HydrophobicContact CB-CB 3.79Å; P42-E119 WeakPolarHBondContact CB-O 3.44Å; P42-E119 HydrophobicContact CG-CB 3.78Å; P42-E119 WeakPolarHBondContact CG-O 3.49Å; H109-E119 HydrophobicContact CB-CG 3.74Å; H109-E119 IonicContact CD2-OE2 2.63Å; H109-E119 VanDerWaalsContact CE1-CD 3.47Å; H109-E119 IonicContact CE1-OE1 2.73Å; H109-E119 IonicContact CE1-OE2 2.67Å; H109-E119 PolarHBondContact CE1-OE2 2.74Å; H109-E119 VanDerWaalsContact CG-CG 3.47Å; H109-E119 IonicContact CG-OE2 3.84Å; H109-E119 IonicContact ND1-OE1 3.94Å; H109-E119 IonicContact ND1-OE2 3.42Å; H109-E119 IonicContact NE2-OE2 3.97Å; H109-E119 PolarHBondContact NE2-OE2 2.86Å; E119-E130 PolarHBondContact N-OE2 2.84Å; E119-H132 IonicContact OE2-CE1 3.87Å; E119-H132 PolarHBondContact OE2-CE1 2.84Å; E119-H132 IonicContact OE2-ND1 3.75Å; E119-H132 IonicContact OE2-NE2 2.79Å; E119-T214 WeakPolarHBondContact OE2-CB 3.44Å; E119-T214 VanDerWaalsContact OE2-CG2 3.29Å; E119-T214 WeakPolarHBondContact OE2-CG2 3.2Å; E119-T214 PolarHBondContact OE2-OG1 3.09Å; E119-F265 HydrophobicContact CB-CB 4.47Å; E119-F265 HydrophobicContact CG-CB 3.74Å; E119-F265 WeakPolarHBondContact OE1-CA 3.49Å; E119-R266 WeakPolarHBondContact OE1-CB 3.08Å; E119-R266 PolarHBondContact OE1-N 2.87Å
120	H	98.9	Very high	98.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-76.2	155.2	172.4	-65.2	90.8	0	0	0	110.8	I43 S118 E130 F160 Y209 W224 L226	I43-H120 PolarHBondContact N-CD2 3.38Å; S118-H120 WeakPolarHBondContact CB-O 3.46Å; S118-H120 PolarHBondContact OG-O 2.91Å; H120-E130 WeakPolarHBondContact CB-OE2 3.36Å; H120-E130 IonicContact CE1-OE1 2.77Å; H120-E130 IonicContact CG-OE1 3.45Å; H120-E130 PolarHBondContact N-OE2 3.22Å; H120-E130 IonicContact ND1-OE1 3.5Å; H120-E130 PolarHBondContact ND1-OE1 2.95Å; H120-E130 IonicContact ND1-OE2 3.21Å; H120-F160 HydrophobicContact CB-CE1 3.75Å; H120-F160 HydrophobicContact CB-CZ 3.72Å; H120-Y209 AromaticContact NE2-CE1 3.57Å; H120-Y209 AromaticContact NE2-CZ 3.56Å; H120-Y209 PolarHBondContact NE2-OH 3.17Å; H120-W224 AromaticContact CE1-CD2 3.91Å; H120-W224 AromaticContact CE1-CE3 3.56Å; H120-W224 AromaticContact CE1-CH2 3.92Å; H120-W224 AromaticContact CE1-CZ3 3.56Å; H120-L226 HydrophobicContact CB-CD2 3.89Å
121	T	98.9	Very high	98.6	Very high	18 Å²	18	43.2 Å²	43.2	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.6	168.7	56.9	0	0	0	0	109.5	I43 N44 L45 K125 A126 T268	I43-T121 PolarHBondContact O-N 3.02Å; N44-T121 WeakPolarHBondContact CA-OG1 3.37Å; N44-T121 WeakPolarHBondContact CB-OG1 3.2Å; N44-T121 PolarHBondContact OD1-OG1 2.75Å; L45-T121 PolarHBondContact N-O 3.48Å; T121-K125 WeakPolarHBondContact CA-O 3.42Å; T121-K125 WeakPolarHBondContact CB-O 3.45Å; T121-A126 HydrophobicContact CG2-CB 3.99Å; T121-T268 HydrophobicContact CG2-CG2 4.39Å
122	V	98.8	Very high	98.6	Very high	21 Å²	21	43.4 Å²	43.4	13%	0.127	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.8	175	-179	0	0	0	0	108.1	L45 F124 K125 F160 W207	L45-V122 HydrophobicContact CD2-CG1 4.43Å; L45-V122 CarbonylContact O-C 3.59Å; L45-V122 WeakPolarHBondContact O-CA 3.28Å; V122-F124 PolarHBondContact O-N 3.36Å; V122-K125 PolarHBondContact N-O 2.85Å; V122-K125 VanDerWaalsContact O-CB 3.26Å; V122-K125 WeakPolarHBondContact O-CB 3.42Å; V122-K125 PolarHBondContact O-N 3.24Å; V122-F160 HydrophobicContact CG2-CE2 3.62Å; V122-F160 HydrophobicContact CG2-CZ 3.69Å; V122-W207 HydrophobicContact CG1-CH2 4.06Å; V122-W207 HydrophobicContact CG2-CZ3 4.24Å
123	N	98.5	Very high	98.7	Very high	76 Å²	76	40.5 Å²	40.5	41%	0.406	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	45.3	-173.1	-56	-42.4	0	0	0	111.7	L45 N46 S47 K125	L45-N123 PolarHBondContact O-N 2.84Å; N46-N123 WeakPolarHBondContact CA-OD1 3.33Å; N46-N123 PolarHBondContact OD1-OD1 2.91Å; S47-N123 PolarHBondContact N-OD1 3.03Å; S47-N123 PolarHBondContact OG-ND2 2.76Å; S47-N123 PolarHBondContact OG-OD1 2.95Å; N123-K125 PolarHBondContact O-N 3.13Å; N123-K125 VanDerWaalsContact O-N 3.13Å
124	F	98.3	Very high	98.7	Very high	171 Å²	171	36.5 Å²	36.5	75%	0.75	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	10.2	-176.4	-54.3	-76.6	0	0	0	115.4	N44 V122	N44-F124 HydrophobicContact CB-CD1 4.26Å; N44-F124 HydrophobicContact CB-CE1 4.14Å; N44-F124 VanDerWaalsContact ND2-CE1 3.31Å; N44-F124 WeakPolarHBondContact ND2-CE1 3.45Å; N44-F124 VanDerWaalsContact ND2-CZ 3.32Å; N44-F124 WeakPolarHBondContact ND2-CZ 3.48Å; N44-F124 WeakPolarHBondContact OD1-CA 3.44Å; N44-F124 PolarHBondContact OD1-N 3.47Å; V122-F124 PolarHBondContact O-N 3.36Å
125	K	98.6	Very high	98.7	Very high	124 Å²	124	34.3 Å²	34.3	54%	0.539	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-90.5	119.7	173	-174.8	-179.4	175	-176	0	110	T121 V122 N123	T121-K125 WeakPolarHBondContact CA-O 3.42Å; T121-K125 WeakPolarHBondContact CB-O 3.45Å; V122-K125 PolarHBondContact N-O 2.85Å; V122-K125 VanDerWaalsContact O-CB 3.26Å; V122-K125 WeakPolarHBondContact O-CB 3.42Å; V122-K125 PolarHBondContact O-N 3.24Å; N123-K125 PolarHBondContact O-N 3.13Å; N123-K125 VanDerWaalsContact O-N 3.13Å
126	A	98.7	Very high	98.7	Very high	29 Å²	29	29 Å²	29	24%	0.24	14%	0.138	C	C	.	.			trans	-84.4	164.1	167.6	0	0	0	0	0	111.7	T121	T121-A126 HydrophobicContact CG2-CB 3.99Å
127	F	98.9	Very high	98.7	Very high	17 Å²	17	24.9 Å²	24.9	8%	0.075	12%	0.122	C	C	.	.			trans	-120.6	155.7	176.7	-67.6	-111.7	0	0	0	109.8	R116 G117 S118 M129 F160 Q162 P230	R116-F127 CarbonylContact C-O 3.5Å; G117-F127 CarbonylContact C-O 3.54Å; G117-F127 WeakPolarHBondContact CA-O 3.19Å; G117-F127 PolarHBondContact N-O 3.49Å; S118-F127 PolarHBondContact N-O 3.46Å; S118-F127 PolarHBondContact OG-N 3.1Å; F127-M129 PolarHBondContact O-N 2.95Å; F127-M129 VanDerWaalsContact O-N 3.16Å; F127-F160 HydrophobicContact CB-CB 4.39Å; F127-F160 HydrophobicContact CB-CD1 4.26Å; F127-F160 HydrophobicContact CD1-CB 3.66Å; F127-F160 HydrophobicContact CD1-CG 4.28Å; F127-F160 HydrophobicContact CD2-CB 4.09Å; F127-F160 AromaticContact CD2-CD1 3.47Å; F127-F160 HydrophobicContact CD2-CD1 3.47Å; F127-F160 VanDerWaalsContact CD2-CD1 3.47Å; F127-F160 HydrophobicContact CD2-CE1 4.04Å; F127-F160 AromaticContact CD2-CG 3.82Å; F127-F160 HydrophobicContact CD2-CG 3.82Å; F127-F160 HydrophobicContact CE1-CB 3.78Å; F127-F160 HydrophobicContact CE1-CG 4.25Å; F127-F160 HydrophobicContact CE2-CB 4.25Å; F127-F160 AromaticContact CE2-CD1 3.86Å; F127-F160 HydrophobicContact CE2-CD1 3.86Å; F127-F160 HydrophobicContact CE2-CD2 4.25Å; F127-F160 HydrophobicContact CE2-CE1 4.27Å; F127-F160 AromaticContact CE2-CG 3.85Å; F127-F160 HydrophobicContact CE2-CG 3.85Å; F127-F160 HydrophobicContact CG-CB 3.82Å; F127-F160 AromaticContact CG-CD1 3.88Å; F127-F160 HydrophobicContact CG-CD1 3.88Å; F127-F160 HydrophobicContact CG-CG 4.07Å; F127-F160 HydrophobicContact CZ-CB 4.1Å; F127-F160 HydrophobicContact CZ-CD2 4.35Å; F127-F160 HydrophobicContact CZ-CG 4.08Å; F127-Q162 HydrophobicContact CD1-CG 3.51Å; F127-Q162 HydrophobicContact CE1-CG 3.89Å; F127-P230 HydrophobicContact CD1-CB 4.33Å; F127-P230 HydrophobicContact CE1-CB 3.97Å; F127-P230 HydrophobicContact CE1-CG 4.21Å
128	P	98.9	Very high	98.6	Very high	12 Å²	12	26.8 Å²	26.8	8%	0.078	13%	0.134	C	C	.	.	S	Bend	trans	-53.6	-31.2	177	-22.9	22.5	0	0	0	115.2	W110 G111 N114 R116 G117 V161 I163 I238	W110-P128 WeakPolarHBondContact CA-O 3.3Å; G111-P128 PolarHBondContact N-O 2.96Å; N114-P128 VanDerWaalsContact O-CG 3.3Å; N114-P128 WeakPolarHBondContact O-CG 3.39Å; R116-P128 CarbonylContact O-C 3.56Å; R116-P128 VanDerWaalsContact O-CA 3.29Å; R116-P128 WeakPolarHBondContact O-CA 3.48Å; G117-P128 WeakPolarHBondContact CA-O 3.43Å; P128-V161 VanDerWaalsContact CD-O 3.26Å; P128-V161 WeakPolarHBondContact CD-O 3.42Å; P128-I163 HydrophobicContact CB-CD1 4.15Å; P128-I163 HydrophobicContact CB-CG1 4.27Å; P128-I163 HydrophobicContact CG-CD1 4.29Å; P128-I163 HydrophobicContact CG-CG1 3.92Å; P128-I238 HydrophobicContact CB-CD1 3.68Å
129	M	98.9	Very high	98.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	153.7	-176.6	166.4	-174.3	-69.2	0	0	111	F108 H109 W110 F127 L131 V161 I233 I238 F241	F108-M129 HydrophobicContact CD1-SD 4.11Å; H109-M129 CarbonylContact O-C 3.56Å; H109-M129 WeakPolarHBondContact O-CA 3.27Å; H109-M129 WeakPolarHBondContact O-CB 3.45Å; H109-M129 VanDerWaalsContact O-CG 3.28Å; H109-M129 WeakPolarHBondContact O-CG 3.46Å; W110-M129 HydrophobicContact CB-CB 4.16Å; W110-M129 HydrophobicContact CB-CE 3.87Å; W110-M129 HydrophobicContact CB-CG 4.42Å; W110-M129 HydrophobicContact CG-CE 4.5Å; F127-M129 PolarHBondContact O-N 2.95Å; F127-M129 VanDerWaalsContact O-N 3.16Å; M129-L131 HydrophobicContact CG-CD1 3.98Å; M129-L131 HydrophobicContact SD-CD1 3.94Å; M129-V161 HydrophobicContact CB-CB 3.96Å; M129-V161 HydrophobicContact CB-CG2 4.46Å; M129-V161 HydrophobicContact CG-CB 4.13Å; M129-V161 HydrophobicContact CG-CG2 4.1Å; M129-V161 PolarHBondContact O-N 3.05Å; M129-V161 HydrophobicContact SD-CB 4.42Å; M129-V161 HydrophobicContact SD-CG1 4.44Å; M129-V161 HydrophobicContact SD-CG2 4.3Å; M129-I233 HydrophobicContact CE-CD1 3.98Å; M129-I233 HydrophobicContact SD-CD1 3.87Å; M129-I238 HydrophobicContact CE-CG1 4.29Å; M129-F241 HydrophobicContact CE-CB 4.34Å; M129-F241 HydrophobicContact CE-CD1 4.18Å; M129-F241 HydrophobicContact CE-CD2 3.55Å; M129-F241 HydrophobicContact CE-CE1 4.37Å; M129-F241 HydrophobicContact CE-CE2 3.77Å; M129-F241 HydrophobicContact CE-CG 3.77Å; M129-F241 HydrophobicContact CE-CZ 4.18Å
130	E	98.9	Very high	98.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	170	-174	176.1	140.5	0	0	109.9	H109 S118 E119 H120 H132 A158 L159	H109-E130 PolarHBondContact N-O 2.83Å; H109-E130 PolarHBondContact O-N 2.74Å; S118-E130 WeakPolarHBondContact CB-OE2 3.13Å; E119-E130 PolarHBondContact N-OE2 2.84Å; H120-E130 WeakPolarHBondContact CB-OE2 3.36Å; H120-E130 IonicContact CE1-OE1 2.77Å; H120-E130 IonicContact CG-OE1 3.45Å; H120-E130 PolarHBondContact N-OE2 3.22Å; H120-E130 IonicContact ND1-OE1 3.5Å; H120-E130 PolarHBondContact ND1-OE1 2.95Å; H120-E130 IonicContact ND1-OE2 3.21Å; E130-H132 IonicContact OE1-CD2 3.27Å; E130-H132 PolarHBondContact OE1-CD2 3.4Å; E130-H132 IonicContact OE1-CE1 3.95Å; E130-H132 IonicContact OE1-NE2 3.65Å; E130-H132 PolarHBondContact OE1-NE2 2.87Å; E130-A158 HydrophobicContact CG-CB 4.47Å; E130-L159 CarbonylContact C-O 3.58Å; E130-L159 VanDerWaalsContact CA-O 3.32Å; E130-L159 WeakPolarHBondContact CA-O 3.48Å
131	L	98.7	Very high	98.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.6	173.9	-69.3	73.6	0	0	0	109.5	V106 R107 F108 M129 L133 A158 L159 V161 L170 L197	V106-L131 HydrophobicContact CG1-CB 4.33Å; V106-L131 HydrophobicContact CG1-CD2 4.14Å; R107-L131 WeakPolarHBondContact O-CA 3.48Å; F108-L131 HydrophobicContact CD1-CD1 4.22Å; F108-L131 HydrophobicContact CD1-CD2 4.05Å; F108-L131 HydrophobicContact CD1-CG 3.66Å; F108-L131 HydrophobicContact CE1-CD1 4.33Å; F108-L131 HydrophobicContact CE1-CD2 3.46Å; F108-L131 VanDerWaalsContact CE1-CD2 3.46Å; F108-L131 HydrophobicContact CE1-CG 3.64Å; F108-L131 HydrophobicContact CG-CG 4.46Å; F108-L131 HydrophobicContact CZ-CD2 3.99Å; F108-L131 HydrophobicContact CZ-CG 4.42Å; M129-L131 HydrophobicContact CG-CD1 3.98Å; M129-L131 HydrophobicContact SD-CD1 3.94Å; L131-L133 HydrophobicContact CB-CD1 4.41Å; L131-A158 WeakPolarHBondContact O-CA 3.14Å; L131-L159 HydrophobicContact CB-CB 4.24Å; L131-L159 PolarHBondContact N-O 2.55Å; L131-L159 PolarHBondContact O-N 2.91Å; L131-V161 HydrophobicContact CD1-CB 4.43Å; L131-V161 HydrophobicContact CD1-CG2 3.09Å; L131-L170 HydrophobicContact CD2-CD1 4.39Å; L131-L170 HydrophobicContact CD2-CD2 4.37Å; L131-L197 HydrophobicContact CD2-CD1 4.03Å; L131-L197 HydrophobicContact CD2-CD2 3.92Å
132	H	98.9	Very high	98.4	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	116.8	172.8	-66.1	170.3	0	0	0	110	V106 R107 H109 E119 E130 I134 I156 W224	V106-H132 CarbonylContact C-O 3.27Å; V106-H132 VanDerWaalsContact CA-O 3.24Å; V106-H132 WeakPolarHBondContact CA-O 3.46Å; R107-H132 HydrophobicContact CB-CB 4.41Å; R107-H132 PolarHBondContact N-O 3.43Å; R107-H132 PolarHBondContact O-N 3.45Å; H109-H132 AromaticContact CD2-CE1 3.66Å; H109-H132 AromaticContact CD2-ND1 3.77Å; H109-H132 AromaticContact NE2-CE1 3.65Å; H109-H132 AromaticContact NE2-ND1 3.53Å; E119-H132 IonicContact OE2-CE1 3.87Å; E119-H132 PolarHBondContact OE2-CE1 2.84Å; E119-H132 IonicContact OE2-ND1 3.75Å; E119-H132 IonicContact OE2-NE2 2.79Å; E130-H132 IonicContact OE1-CD2 3.27Å; E130-H132 PolarHBondContact OE1-CD2 3.4Å; E130-H132 IonicContact OE1-CE1 3.95Å; E130-H132 IonicContact OE1-NE2 3.65Å; E130-H132 PolarHBondContact OE1-NE2 2.87Å; H132-I134 HydrophobicContact CB-CG1 4.26Å; H132-I156 HydrophobicContact CB-CG2 3.67Å; H132-W224 AromaticContact CD2-CH2 3.93Å; H132-W224 AromaticContact CD2-CZ3 3.68Å; H132-W224 AromaticContact CE1-CH2 3.36Å; H132-W224 WeakPolarHBondContact CE1-CH2 3.16Å; H132-W224 AromaticContact CE1-CZ3 3.85Å; H132-W224 AromaticContact CG-CH2 3.99Å; H132-W224 AromaticContact ND1-CH2 3.63Å; H132-W224 AromaticContact NE2-CH2 3.55Å; H132-W224 AromaticContact NE2-CZ3 3.53Å
133	L	98.8	Very high	98.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	105.6	168.9	-75.1	67.4	0	0	0	107.2	Y65 L103 V106 L131 H135 I156 I157 L159 L197	Y65-L133 HydrophobicContact CE2-CD2 3.54Å; Y65-L133 WeakPolarHBondContact OH-CD2 3.38Å; L103-L133 HydrophobicContact CD1-CB 3.83Å; L103-L133 HydrophobicContact CD1-CG 4.31Å; V106-L133 HydrophobicContact CG1-CD1 4.3Å; V106-L133 HydrophobicContact CG2-CG 4.1Å; L131-L133 HydrophobicContact CB-CD1 4.41Å; L133-H135 PolarHBondContact O-CE1 2.8Å; L133-H135 PolarHBondContact O-ND1 2.93Å; L133-I156 WeakPolarHBondContact O-CA 3.41Å; L133-I157 HydrophobicContact CB-CB 4.25Å; L133-I157 PolarHBondContact N-O 2.88Å; L133-I157 PolarHBondContact O-N 3.39Å; L133-L159 HydrophobicContact CD1-CD2 4.24Å; L133-L197 HydrophobicContact CD1-CD1 4.02Å; L133-L197 HydrophobicContact CG-CD1 4.39Å
134	I	98.5	Very high	98	Very high	13 Å²	13	38.9 Å²	38.9	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.5	-172.9	-56.6	-179.7	0	0	0	109.1	H104 E105 R107 H132 V154 I156	H104-I134 PolarHBondContact N-O 2.85Å; E105-I134 HydrophobicContact CG-CB 3.94Å; E105-I134 HydrophobicContact CG-CD1 4.03Å; E105-I134 HydrophobicContact CG-CG1 4.28Å; E105-I134 PolarHBondContact N-O 2.91Å; E105-I134 PolarHBondContact O-N 3.38Å; R107-I134 HydrophobicContact CG-CD1 3.8Å; H132-I134 HydrophobicContact CB-CG1 4.26Å; I134-V154 HydrophobicContact CG2-CG1 4.31Å; I134-I156 HydrophobicContact CG1-CD1 4.14Å; I134-I156 HydrophobicContact CG1-CG1 4.18Å; I134-I156 HydrophobicContact CG1-CG2 4.42Å; I134-I156 HydrophobicContact CG2-CG1 4.39Å
135	H	98.6	Very high	97.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	154.9	178.6	-46.4	71.8	0	0	0	110.6	Y65 V90 E102 L103 L133 V154 L155	Y65-H135 AromaticContact CE1-NE2 3.58Å; Y65-H135 AromaticContact CZ-NE2 3.49Å; Y65-H135 PolarHBondContact OH-CE1 3.41Å; Y65-H135 PolarHBondContact OH-NE2 3.25Å; V90-H135 VanDerWaalsContact CG2-NE2 3.27Å; V90-H135 WeakPolarHBondContact CG2-NE2 3.33Å; E102-H135 WeakPolarHBondContact O-CA 3.46Å; E102-H135 WeakPolarHBondContact O-CB 3.19Å; L103-H135 VanDerWaalsContact CA-CD2 3.44Å; L103-H135 WeakPolarHBondContact CA-CD2 3.44Å; L133-H135 PolarHBondContact O-CE1 2.8Å; L133-H135 PolarHBondContact O-ND1 2.93Å; H135-V154 WeakPolarHBondContact O-CA 3.36Å; H135-L155 WeakPolarHBondContact CA-O 3.46Å; H135-L155 HydrophobicContact CB-CB 4.23Å; H135-L155 WeakPolarHBondContact CB-O 3.32Å; H135-L155 PolarHBondContact N-O 2.98Å; H135-L155 PolarHBondContact ND1-O 3.09Å; H135-L155 PolarHBondContact O-N 2.73Å
136	W	98.1	Very high	97.6	Very high	32 Å²	32	35.6 Å²	35.6	12%	0.121	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.9	176.3	69	-72.2	0	0	0	110.6	Y101 E102 T138 F141 S143 V144 A147 G153	Y101-W136 CarbonylContact C-O 3.56Å; Y101-W136 VanDerWaalsContact CA-O 3.25Å; Y101-W136 WeakPolarHBondContact CA-O 3.41Å; E102-W136 PolarHBondContact N-O 3.32Å; E102-W136 PolarHBondContact O-N 3.18Å; W136-T138 HydrophobicContact CD2-CG2 4.06Å; W136-T138 HydrophobicContact CE3-CG2 4.18Å; W136-T138 HydrophobicContact CH2-CG2 3.74Å; W136-T138 HydrophobicContact CZ2-CG2 3.57Å; W136-T138 HydrophobicContact CZ3-CG2 4.03Å; W136-T138 PolarHBondContact O-N 3.1Å; W136-F141 HydrophobicContact CE3-CB 4.4Å; W136-F141 HydrophobicContact CZ3-CB 4.29Å; W136-F141 VanDerWaalsContact CZ3-O 3.29Å; W136-F141 WeakPolarHBondContact CZ3-O 3.43Å; W136-S143 VanDerWaalsContact CZ3-C 3.49Å; W136-V144 HydrophobicContact CB-CG2 4.09Å; W136-V144 VanDerWaalsContact CD1-CG2 3.41Å; W136-V144 HydrophobicContact CD2-CG2 3.88Å; W136-V144 HydrophobicContact CG-CB 4.31Å; W136-V144 HydrophobicContact CG-CG2 3.51Å; W136-A147 HydrophobicContact CB-CB 4.2Å; W136-A147 HydrophobicContact CE3-CB 4.41Å; W136-G153 CarbonylContact C-O 3.54Å; W136-G153 VanDerWaalsContact CA-O 3.3Å; W136-G153 WeakPolarHBondContact CA-O 3.32Å
137	N	98.4	Very high	97.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	106	-174.6	-174.4	-22.4	0	0	0	111.6	H99 E100 Y101 T139 L140 F141 N152 G153	H99-N137 PolarHBondContact ND1-ND2 3.24Å; E100-N137 WeakPolarHBondContact O-CA 3.47Å; Y101-N137 HydrophobicContact CD1-CB 3.94Å; Y101-N137 HydrophobicContact CE1-CB 3.56Å; Y101-N137 HydrophobicContact CE2-CB 4.38Å; Y101-N137 PolarHBondContact OH-ND2 2.73Å; N137-T139 VanDerWaalsContact C-N 3.34Å; N137-T139 WeakPolarHBondContact OD1-CA 3.48Å; N137-T139 VanDerWaalsContact OD1-CB 3.32Å; N137-T139 WeakPolarHBondContact OD1-CB 3.44Å; N137-T139 PolarHBondContact OD1-N 3.3Å; N137-L140 PolarHBondContact OD1-N 3.49Å; N137-L140 VanDerWaalsContact OD1-N 3.14Å; N137-F141 HydrophobicContact CB-CD2 4.04Å; N137-F141 HydrophobicContact CB-CE2 4.31Å; N137-F141 WeakPolarHBondContact O-CD2 3.33Å; N137-F141 PolarHBondContact O-N 3.27Å; N137-N152 WeakPolarHBondContact CB-O 3.5Å; N137-N152 PolarHBondContact ND2-O 2.73Å; N137-G153 PolarHBondContact N-O 3.32Å
138	T	97.6	Very high	97.1	Very high	40 Å²	40	36.4 Å²	36.4	25%	0.245	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.6	-179.5	56	0	0	0	0	113.1	E100 E102 W136	E100-T138 PolarHBondContact O-N 3.41Å; E100-T138 PolarHBondContact O-OG1 3.15Å; E102-T138 HydrophobicContact CB-CG2 3.46Å; E102-T138 VanDerWaalsContact CB-CG2 3.46Å; W136-T138 HydrophobicContact CD2-CG2 4.06Å; W136-T138 HydrophobicContact CE3-CG2 4.18Å; W136-T138 HydrophobicContact CH2-CG2 3.74Å; W136-T138 HydrophobicContact CZ2-CG2 3.57Å; W136-T138 HydrophobicContact CZ3-CG2 4.03Å; W136-T138 PolarHBondContact O-N 3.1Å
139	T	97.9	Very high	96.7	Very high	64 Å²	64	37.8 Å²	37.8	39%	0.393	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-33.3	174.6	-56.5	0	0	0	0	111.4	D98 H99 E100 N137	D98-T139 PolarHBondContact O-OG1 2.73Å; H99-T139 WeakPolarHBondContact CA-OG1 3.33Å; E100-T139 PolarHBondContact N-OG1 3.4Å; N137-T139 VanDerWaalsContact C-N 3.34Å; N137-T139 WeakPolarHBondContact OD1-CA 3.48Å; N137-T139 VanDerWaalsContact OD1-CB 3.32Å; N137-T139 WeakPolarHBondContact OD1-CB 3.44Å; N137-T139 PolarHBondContact OD1-N 3.3Å
140	L	97.7	Very high	96.5	Very high	86 Å²	86	43 Å²	43	45%	0.45	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-26.9	-174.5	-67	-172.3	0	0	0	115.2	N137 N152	N137-L140 PolarHBondContact OD1-N 3.49Å; N137-L140 VanDerWaalsContact OD1-N 3.14Å; L140-N152 HydrophobicContact CD1-CB 4.32Å
141	F	97.8	Very high	96.3	Very high	37 Å²	37	50.4 Å²	50.4	16%	0.162	26%	0.257	C	S	.	.			trans	-126.6	158.9	-171	-54.3	-74.6	0	0	0	110.8	W136 N137 E146 A147 K150	W136-F141 HydrophobicContact CE3-CB 4.4Å; W136-F141 HydrophobicContact CZ3-CB 4.29Å; W136-F141 VanDerWaalsContact CZ3-O 3.29Å; W136-F141 WeakPolarHBondContact CZ3-O 3.43Å; N137-F141 HydrophobicContact CB-CD2 4.04Å; N137-F141 HydrophobicContact CB-CE2 4.31Å; N137-F141 WeakPolarHBondContact O-CD2 3.33Å; N137-F141 PolarHBondContact O-N 3.27Å; F141-E146 HydrophobicContact CB-CB 4.22Å; F141-E146 HydrophobicContact CD1-CB 4.33Å; F141-A147 HydrophobicContact CB-CB 3.94Å; F141-A147 HydrophobicContact CD2-CB 3.57Å; F141-A147 HydrophobicContact CE2-CB 4.28Å; F141-A147 HydrophobicContact CG-CB 3.75Å; F141-K150 HydrophobicContact CE1-CB 3.85Å; F141-K150 HydrophobicContact CE1-CG 3.75Å; F141-K150 HydrophobicContact CE2-CB 4.23Å; F141-K150 HydrophobicContact CZ-CB 3.48Å; F141-K150 VanDerWaalsContact CZ-CB 3.48Å; F141-K150 HydrophobicContact CZ-CG 3.93Å
142	N	96.5	Very high	96.2	Very high	140 Å²	140	52.7 Å²	52.7	75%	0.749	27%	0.269	S	S	*	.	S	Bend	trans	-98.4	-13.4	179.1	-57.3	-69.4	0	0	0	113	E146	N142-E146 WeakPolarHBondContact CB-OE2 3.49Å; N142-E146 PolarHBondContact N-OE2 3.24Å; N142-E146 PolarHBondContact ND2-OE2 2.95Å
143	S	94.8	Very high	96.1	Very high	32 Å²	32	52.6 Å²	52.6	22%	0.224	27%	0.269	C	S	.	.	S	Bend	trans	-149.9	164.6	175.6	89.3	0	0	0	0	112.1	W136 E145 E146 A147	W136-S143 VanDerWaalsContact CZ3-C 3.49Å; S143-E145 VanDerWaalsContact C-N 3.27Å; S143-E145 WeakPolarHBondContact CB-OE2 3.31Å; S143-E145 PolarHBondContact O-N 2.73Å; S143-E145 PolarHBondContact OG-N 3.48Å; S143-E145 PolarHBondContact OG-OE2 2.87Å; S143-E146 PolarHBondContact O-N 2.82Å; S143-E146 PolarHBondContact OG-N 2.93Å; S143-A147 PolarHBondContact O-N 3.34Å
144	V	93.5	Very high	96.1	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-59.1	-44.1	173.8	177.6	0	0	0	0	109.7	H104 W136 E146 A147 L148	H104-V144 HydrophobicContact CB-CG2 4.07Å; W136-V144 HydrophobicContact CB-CG2 4.09Å; W136-V144 VanDerWaalsContact CD1-CG2 3.41Å; W136-V144 HydrophobicContact CD2-CG2 3.88Å; W136-V144 HydrophobicContact CG-CB 4.31Å; W136-V144 HydrophobicContact CG-CG2 3.51Å; V144-E146 VanDerWaalsContact C-N 3.31Å; V144-E146 PolarHBondContact O-N 2.74Å; V144-A147 CarbonylContact O-C 3.49Å; V144-A147 WeakPolarHBondContact O-CA 3.39Å; V144-A147 WeakPolarHBondContact O-CB 3.36Å; V144-A147 PolarHBondContact O-N 3.1Å; V144-L148 HydrophobicContact CG1-CD2 4.34Å; V144-L148 HydrophobicContact CG1-CG 4.45Å; V144-L148 WeakPolarHBondContact O-CG 3.46Å; V144-L148 PolarHBondContact O-N 3.25Å
145	E	93.2	Very high	96.1	Very high	135 Å²	135	52.1 Å²	52.1	63%	0.631	27%	0.266	S	S	*	.	H	α-helix	trans	-61.4	-37.6	-177.5	-58.1	73.2	-160	0	0	112.1	S143 A147	S143-E145 VanDerWaalsContact C-N 3.27Å; S143-E145 WeakPolarHBondContact CB-OE2 3.31Å; S143-E145 PolarHBondContact O-N 2.73Å; S143-E145 PolarHBondContact OG-N 3.48Å; S143-E145 PolarHBondContact OG-OE2 2.87Å; E145-A147 VanDerWaalsContact C-N 3.34Å
146	E	95.8	Very high	96.1	Very high	91 Å²	91	52.1 Å²	52.1	43%	0.425	27%	0.267	S	S	.	.	H	α-helix	trans	-68	-34.8	173.5	-71.9	-176	173.1	0	0	112.5	F141 N142 S143 V144 K150	F141-E146 HydrophobicContact CB-CB 4.22Å; F141-E146 HydrophobicContact CD1-CB 4.33Å; N142-E146 WeakPolarHBondContact CB-OE2 3.49Å; N142-E146 PolarHBondContact N-OE2 3.24Å; N142-E146 PolarHBondContact ND2-OE2 2.95Å; S143-E146 PolarHBondContact O-N 2.82Å; S143-E146 PolarHBondContact OG-N 2.93Å; V144-E146 VanDerWaalsContact C-N 3.31Å; V144-E146 PolarHBondContact O-N 2.74Å; E146-K150 WeakPolarHBondContact O-CG 2.85Å
147	A	96.5	Very high	96.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-77.8	-25.4	-178.4	0	0	0	0	0	113.1	W136 F141 S143 V144 E145 A149 K150 G153	W136-A147 HydrophobicContact CB-CB 4.2Å; W136-A147 HydrophobicContact CE3-CB 4.41Å; F141-A147 HydrophobicContact CB-CB 3.94Å; F141-A147 HydrophobicContact CD2-CB 3.57Å; F141-A147 HydrophobicContact CE2-CB 4.28Å; F141-A147 HydrophobicContact CG-CB 3.75Å; S143-A147 PolarHBondContact O-N 3.34Å; V144-A147 CarbonylContact O-C 3.49Å; V144-A147 WeakPolarHBondContact O-CA 3.39Å; V144-A147 WeakPolarHBondContact O-CB 3.36Å; V144-A147 PolarHBondContact O-N 3.1Å; E145-A147 VanDerWaalsContact C-N 3.34Å; A147-A149 PolarHBondContact O-N 2.96Å; A147-K150 WeakPolarHBondContact O-CB 3.43Å; A147-K150 PolarHBondContact O-N 3.39Å; A147-K150 VanDerWaalsContact O-N 3.1Å; A147-G153 WeakPolarHBondContact O-CA 3.32Å
148	L	92	Very high	96.2	Very high	63 Å²	63	50.6 Å²	50.6	33%	0.33	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	137.7	177.6	-69.3	-178.8	0	0	0	111.2	V144 K150 V154 L213	V144-L148 HydrophobicContact CG1-CD2 4.34Å; V144-L148 HydrophobicContact CG1-CG 4.45Å; V144-L148 WeakPolarHBondContact O-CG 3.46Å; V144-L148 PolarHBondContact O-N 3.25Å; L148-K150 PolarHBondContact O-N 3.1Å; L148-V154 HydrophobicContact CD2-CG2 4.02Å; L148-L213 HydrophobicContact CD2-CD1 4.31Å
149	A	88.9	Confident	96.2	Very high	40 Å²	40	48.7 Å²	48.7	33%	0.331	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	1.7	-177.4	0	0	0	0	0	115.7	A147 S219 N221	A147-A149 PolarHBondContact O-N 2.96Å; A149-S219 VanDerWaalsContact CB-CB 3.5Å; A149-N221 PolarHBondContact O-ND2 2.69Å
150	K	95.6	Very high	96.3	Very high	111 Å²	111	45.7 Å²	45.7	48%	0.483	23%	0.231	S	C	.	.	S	Bend	trans	-90.6	142.8	178.7	-54.8	-55.8	-178.3	-176	0	110.9	F141 E146 A147 L148 N152 G153	F141-K150 HydrophobicContact CE1-CB 3.85Å; F141-K150 HydrophobicContact CE1-CG 3.75Å; F141-K150 HydrophobicContact CE2-CB 4.23Å; F141-K150 HydrophobicContact CZ-CB 3.48Å; F141-K150 VanDerWaalsContact CZ-CB 3.48Å; F141-K150 HydrophobicContact CZ-CG 3.93Å; E146-K150 WeakPolarHBondContact O-CG 2.85Å; A147-K150 WeakPolarHBondContact O-CB 3.43Å; A147-K150 PolarHBondContact O-N 3.39Å; A147-K150 VanDerWaalsContact O-N 3.1Å; L148-K150 PolarHBondContact O-N 3.1Å; K150-N152 PolarHBondContact O-N 2.79Å; K150-G153 WeakPolarHBondContact O-CA 3.39Å; K150-G153 PolarHBondContact O-N 2.79Å
151	K	95	Very high	96.3	Very high	155 Å²	155	41.6 Å²	41.6	67%	0.674	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	132.8	169.6	-172.5	175	-176.3	176.8	0	110	G153	K151-G153 PolarHBondContact O-N 2.9Å; K151-G153 VanDerWaalsContact O-N 3.17Å
152	N	95.5	Very high	96.4	Very high	48 Å²	48	43 Å²	43	26%	0.257	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	18	-175.2	-54.9	-24.8	0	0	0	113.6	Y101 N137 L140 K150	Y101-N152 WeakPolarHBondContact CE1-O 3.25Å; Y101-N152 WeakPolarHBondContact OH-CB 3.39Å; Y101-N152 PolarHBondContact OH-O 3.36Å; N137-N152 WeakPolarHBondContact CB-O 3.5Å; N137-N152 PolarHBondContact ND2-O 2.73Å; L140-N152 HydrophobicContact CD1-CB 4.32Å; K150-N152 PolarHBondContact O-N 2.79Å
153	G	97.6	Very high	96.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-41.6	-177	0	0	0	0	0	113.4	W136 N137 A147 K150 K151	W136-G153 CarbonylContact C-O 3.54Å; W136-G153 VanDerWaalsContact CA-O 3.3Å; W136-G153 WeakPolarHBondContact CA-O 3.32Å; N137-G153 PolarHBondContact N-O 3.32Å; A147-G153 WeakPolarHBondContact O-CA 3.32Å; K150-G153 WeakPolarHBondContact O-CA 3.39Å; K150-G153 PolarHBondContact O-N 2.79Å; K151-G153 PolarHBondContact O-N 2.9Å; K151-G153 VanDerWaalsContact O-N 3.17Å
154	V	98.4	Very high	96.6	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.2	-172.6	-179.5	0	0	0	0	110.7	I134 H135 L148 I156 V222 T223	I134-V154 HydrophobicContact CG2-CG1 4.31Å; H135-V154 WeakPolarHBondContact O-CA 3.36Å; L148-V154 HydrophobicContact CD2-CG2 4.02Å; V154-I156 HydrophobicContact CG1-CD1 4.38Å; V154-I156 HydrophobicContact CG1-CG1 3.96Å; V154-V222 HydrophobicContact CB-CG2 4.28Å; V154-V222 HydrophobicContact CG1-CG1 4.18Å; V154-V222 HydrophobicContact CG1-CG2 4.26Å; V154-T223 PolarHBondContact O-N 3.1Å
155	L	98.6	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.3	170.6	166.2	70.5	0	0	0	108.5	V90 L95 Y101 H135 T223 I225	V90-L155 HydrophobicContact CB-CD2 4.06Å; V90-L155 HydrophobicContact CG1-CD2 3.95Å; L95-L155 HydrophobicContact CD1-CD2 3.82Å; L95-L155 HydrophobicContact CD2-CD1 4.16Å; L95-L155 HydrophobicContact CD2-CD2 4Å; L95-L155 HydrophobicContact CD2-CG 4.47Å; L95-L155 HydrophobicContact CG-CD2 4.48Å; Y101-L155 HydrophobicContact CD1-CB 3.55Å; Y101-L155 HydrophobicContact CD1-CD2 4.48Å; Y101-L155 HydrophobicContact CE1-CB 3.98Å; Y101-L155 HydrophobicContact CG-CB 4.13Å; Y101-L155 HydrophobicContact CG-CD2 4.22Å; H135-L155 WeakPolarHBondContact CA-O 3.46Å; H135-L155 HydrophobicContact CB-CB 4.23Å; H135-L155 WeakPolarHBondContact CB-O 3.32Å; H135-L155 PolarHBondContact N-O 2.98Å; H135-L155 PolarHBondContact ND1-O 3.09Å; H135-L155 PolarHBondContact O-N 2.73Å; L155-T223 WeakPolarHBondContact CA-O 3.46Å; L155-T223 HydrophobicContact CD1-CG2 3.87Å; L155-T223 WeakPolarHBondContact CD1-O 3.42Å; L155-I225 HydrophobicContact CD1-CB 4.5Å; L155-I225 HydrophobicContact CD1-CD1 3.67Å; L155-I225 HydrophobicContact CD1-CG1 3.77Å
156	I	98.8	Very high	97.1	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.2	172.9	-55.7	-177.1	0	0	0	109.7	H132 L133 I134 V154 L213 V222 T223 W224 I225	H132-I156 HydrophobicContact CB-CG2 3.67Å; L133-I156 WeakPolarHBondContact O-CA 3.41Å; I134-I156 HydrophobicContact CG1-CD1 4.14Å; I134-I156 HydrophobicContact CG1-CG1 4.18Å; I134-I156 HydrophobicContact CG1-CG2 4.42Å; I134-I156 HydrophobicContact CG2-CG1 4.39Å; V154-I156 HydrophobicContact CG1-CD1 4.38Å; V154-I156 HydrophobicContact CG1-CG1 3.96Å; I156-L213 HydrophobicContact CD1-CD2 4.14Å; I156-V222 HydrophobicContact CB-CG1 4.25Å; I156-V222 HydrophobicContact CD1-CG1 3.77Å; I156-V222 HydrophobicContact CG1-CG1 3.72Å; I156-T223 PolarHBondContact N-O 3.17Å; I156-W224 HydrophobicContact CB-CD2 4.24Å; I156-W224 HydrophobicContact CB-CE3 3.93Å; I156-W224 HydrophobicContact CB-CH2 4.01Å; I156-W224 HydrophobicContact CB-CZ2 4.33Å; I156-W224 HydrophobicContact CB-CZ3 3.82Å; I156-W224 HydrophobicContact CD1-CH2 3.88Å; I156-W224 HydrophobicContact CD1-CZ2 3.8Å; I156-W224 HydrophobicContact CG2-CE3 3.88Å; I156-W224 HydrophobicContact CG2-CH2 3.6Å; I156-W224 HydrophobicContact CG2-CZ2 4.38Å; I156-W224 HydrophobicContact CG2-CZ3 3.31Å; I156-I225 PolarHBondContact O-N 2.86Å
157	I	98.9	Very high	97.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	118.1	168.2	-56.3	-177	0	0	0	108.3	V90 L133 L159 I225 Y227	V90-I157 HydrophobicContact CG1-CD1 4.47Å; V90-I157 HydrophobicContact CG2-CD1 4.04Å; L133-I157 HydrophobicContact CB-CB 4.25Å; L133-I157 PolarHBondContact N-O 2.88Å; L133-I157 PolarHBondContact O-N 3.39Å; I157-L159 HydrophobicContact CG2-CD2 3.5Å; I157-L159 VanDerWaalsContact CG2-CD2 3.5Å; I157-I225 CarbonylContact C-O 3.55Å; I157-I225 VanDerWaalsContact CA-O 3.29Å; I157-I225 WeakPolarHBondContact CA-O 3.32Å; I157-I225 HydrophobicContact CG1-CB 4.2Å; I157-I225 HydrophobicContact CG1-CG2 4.43Å; I157-I225 HydrophobicContact CG2-CG2 4.38Å; I157-Y227 HydrophobicContact CG2-CD2 3.66Å; I157-Y227 HydrophobicContact CG2-CE2 3.58Å
158	A	98.9	Very high	97.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.3	177.8	0	0	0	0	0	111.7	E130 L131 W224 I225 L226 Y227	E130-A158 HydrophobicContact CG-CB 4.47Å; L131-A158 WeakPolarHBondContact O-CA 3.14Å; A158-W224 HydrophobicContact CB-CE3 4.02Å; A158-W224 HydrophobicContact CB-CZ3 3.89Å; A158-I225 PolarHBondContact N-O 2.98Å; A158-L226 HydrophobicContact CB-CG 4.12Å; A158-Y227 PolarHBondContact O-N 2.89Å; A158-Y227 VanDerWaalsContact O-N 3.12Å
159	L	98.9	Very high	97.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.2	-179.9	-79.5	-80.7	0	0	0	108.6	E130 L131 L133 I157 L197 P199 Y227 L231	E130-L159 CarbonylContact C-O 3.58Å; E130-L159 VanDerWaalsContact CA-O 3.32Å; E130-L159 WeakPolarHBondContact CA-O 3.48Å; L131-L159 HydrophobicContact CB-CB 4.24Å; L131-L159 PolarHBondContact N-O 2.55Å; L131-L159 PolarHBondContact O-N 2.91Å; L133-L159 HydrophobicContact CD1-CD2 4.24Å; I157-L159 HydrophobicContact CG2-CD2 3.5Å; I157-L159 VanDerWaalsContact CG2-CD2 3.5Å; L159-L197 WeakPolarHBondContact CD1-O 3.3Å; L159-L197 WeakPolarHBondContact CG-O 3.24Å; L159-P199 HydrophobicContact CD1-CG 4.05Å; L159-Y227 HydrophobicContact CD1-CD2 3.95Å; L159-Y227 HydrophobicContact CD2-CD2 3.7Å; L159-Y227 HydrophobicContact CD2-CE2 4.42Å; L159-L231 HydrophobicContact CB-CD1 4.3Å; L159-L231 HydrophobicContact CD1-CD1 4.16Å; L159-L231 HydrophobicContact CD1-CD2 4.21Å; L159-L231 HydrophobicContact CD1-CG 4Å; L159-L231 HydrophobicContact CG-CD1 4.34Å
160	F	98.9	Very high	97.9	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	147.7	168.5	-63.1	-65.1	0	0	0	110.9	H120 V122 F127 L226 P230 L231	H120-F160 HydrophobicContact CB-CE1 3.75Å; H120-F160 HydrophobicContact CB-CZ 3.72Å; V122-F160 HydrophobicContact CG2-CE2 3.62Å; V122-F160 HydrophobicContact CG2-CZ 3.69Å; F127-F160 HydrophobicContact CB-CB 4.39Å; F127-F160 HydrophobicContact CB-CD1 4.26Å; F127-F160 HydrophobicContact CD1-CB 3.66Å; F127-F160 HydrophobicContact CD1-CG 4.28Å; F127-F160 HydrophobicContact CD2-CB 4.09Å; F127-F160 AromaticContact CD2-CD1 3.47Å; F127-F160 HydrophobicContact CD2-CD1 3.47Å; F127-F160 VanDerWaalsContact CD2-CD1 3.47Å; F127-F160 HydrophobicContact CD2-CE1 4.04Å; F127-F160 AromaticContact CD2-CG 3.82Å; F127-F160 HydrophobicContact CD2-CG 3.82Å; F127-F160 HydrophobicContact CE1-CB 3.78Å; F127-F160 HydrophobicContact CE1-CG 4.25Å; F127-F160 HydrophobicContact CE2-CB 4.25Å; F127-F160 AromaticContact CE2-CD1 3.86Å; F127-F160 HydrophobicContact CE2-CD1 3.86Å; F127-F160 HydrophobicContact CE2-CD2 4.25Å; F127-F160 HydrophobicContact CE2-CE1 4.27Å; F127-F160 AromaticContact CE2-CG 3.85Å; F127-F160 HydrophobicContact CE2-CG 3.85Å; F127-F160 HydrophobicContact CG-CB 3.82Å; F127-F160 AromaticContact CG-CD1 3.88Å; F127-F160 HydrophobicContact CG-CD1 3.88Å; F127-F160 HydrophobicContact CG-CG 4.07Å; F127-F160 HydrophobicContact CZ-CB 4.1Å; F127-F160 HydrophobicContact CZ-CD2 4.35Å; F127-F160 HydrophobicContact CZ-CG 4.08Å; F160-L226 HydrophobicContact CZ-CD2 4.26Å; F160-P230 HydrophobicContact CB-CB 4.01Å; F160-P230 CarbonylContact O-C 3.53Å; F160-P230 WeakPolarHBondContact O-CA 3.47Å; F160-P230 WeakPolarHBondContact O-CB 2.92Å; F160-L231 PolarHBondContact O-N 2.79Å
161	V	98.9	Very high	97.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.5	178.5	-173.5	0	0	0	0	111.2	P128 M129 L131 L231 I233	P128-V161 VanDerWaalsContact CD-O 3.26Å; P128-V161 WeakPolarHBondContact CD-O 3.42Å; M129-V161 HydrophobicContact CB-CB 3.96Å; M129-V161 HydrophobicContact CB-CG2 4.46Å; M129-V161 HydrophobicContact CG-CB 4.13Å; M129-V161 HydrophobicContact CG-CG2 4.1Å; M129-V161 PolarHBondContact O-N 3.05Å; M129-V161 HydrophobicContact SD-CB 4.42Å; M129-V161 HydrophobicContact SD-CG1 4.44Å; M129-V161 HydrophobicContact SD-CG2 4.3Å; L131-V161 HydrophobicContact CD1-CB 4.43Å; L131-V161 HydrophobicContact CD1-CG2 3.09Å; V161-L231 WeakPolarHBondContact CA-O 3.09Å; V161-L231 HydrophobicContact CG2-CB 4.2Å; V161-I233 HydrophobicContact CG1-CB 4.17Å; V161-I233 HydrophobicContact CG1-CD1 3.89Å; V161-I233 HydrophobicContact CG1-CG1 3.67Å; V161-I233 HydrophobicContact CG1-CG2 3.71Å
162	Q	98.5	Very high	97.9	Very high	66 Å²	66	34.6 Å²	34.6	31%	0.308	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	160.7	174.7	-64.9	-176.4	-3.5	0	0	112	F127 P230 L231 T232 I233	F127-Q162 HydrophobicContact CD1-CG 3.51Å; F127-Q162 HydrophobicContact CE1-CG 3.89Å; Q162-P230 HydrophobicContact CG-CB 4.07Å; Q162-P230 HydrophobicContact CG-CG 4.12Å; Q162-L231 PolarHBondContact N-O 2.97Å; Q162-T232 WeakPolarHBondContact O-CA 3.36Å; Q162-I233 PolarHBondContact O-N 3.27Å
163	I	98.8	Very high	98	Very high	55 Å²	55	32.3 Å²	32.3	28%	0.282	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.6	171	-54.7	-52.1	0	0	0	109.4	N114 P128 I233 Q235 I238	N114-I163 HydrophobicContact CB-CG1 4.43Å; P128-I163 HydrophobicContact CB-CD1 4.15Å; P128-I163 HydrophobicContact CB-CG1 4.27Å; P128-I163 HydrophobicContact CG-CD1 4.29Å; P128-I163 HydrophobicContact CG-CG1 3.92Å; I163-I233 CarbonylContact C-O 3.09Å; I163-I233 WeakPolarHBondContact CA-O 3.16Å; I163-I233 HydrophobicContact CD1-CG1 4.17Å; I163-Q235 HydrophobicContact CG2-CB 4.31Å; I163-I238 HydrophobicContact CD1-CB 4.03Å; I163-I238 HydrophobicContact CD1-CD1 3.9Å; I163-I238 HydrophobicContact CD1-CG2 3.68Å
164	G	98.5	Very high	98	Very high	44 Å²	44	32.8 Å²	32.8	45%	0.454	18%	0.177	S	C	.	.	S	Bend	trans	-173.6	-128	-178.6	0	0	0	0	0	111.4	I233	G164-I233 CarbonylContact C-O 3.49Å; G164-I233 PolarHBondContact N-O 2.03Å
165	K	98.2	Very high	97.9	Very high	164 Å²	164	38 Å²	38	71%	0.713	20%	0.202	S	C	*	.	S	Bend	trans	-69.8	148.9	178.1	-172.7	-179.5	175	-175.2	0	110.7	H167 T232 I233 S234	K165-H167 PolarHBondContact O-N 3.07Å; K165-T232 CarbonylContact O-C 3.43Å; K165-T232 VanDerWaalsContact O-O 3.13Å; K165-T232 PolarHBondContact O-OG1 3.21Å; K165-I233 CarbonylContact O-C 3.53Å; K165-I233 WeakPolarHBondContact O-CA 3.43Å; K165-S234 PolarHBondContact O-N 3.27Å
166	E	98.5	Very high	97.9	Very high	72 Å²	72	39.1 Å²	39.1	34%	0.336	21%	0.208	S	C	.	.			trans	-53.9	132.5	169.9	-173.4	-171.7	-140.3	0	0	111.4	L168 K171	E166-L168 WeakPolarHBondContact OE2-CD2 3.27Å; E166-K171 IonicContact OE1-NZ 3.43Å; E166-K171 PolarHBondContact OE1-NZ 2.76Å; E166-K171 IonicContact OE2-NZ 2.78Å
167	H	98.5	Very high	97.8	Very high	23 Å²	23	39.1 Å²	39.1	11%	0.106	21%	0.208	C	C	.	.			trans	-89.3	102.3	173	-163.9	-84	0	0	0	110.5	K165 G169 L170 K171 T196 T232 I233 Q237	K165-H167 PolarHBondContact O-N 3.07Å; H167-G169 VanDerWaalsContact C-N 3.29Å; H167-G169 PolarHBondContact ND1-N 3.49Å; H167-G169 PolarHBondContact O-N 2.75Å; H167-L170 HydrophobicContact CB-CB 4.1Å; H167-L170 HydrophobicContact CB-CD1 4.25Å; H167-L170 HydrophobicContact CB-CG 4.5Å; H167-L170 WeakPolarHBondContact ND1-CG 3.29Å; H167-L170 PolarHBondContact ND1-N 3.44Å; H167-L170 PolarHBondContact O-N 3.01Å; H167-L170 VanDerWaalsContact O-N 3.1Å; H167-K171 PolarHBondContact O-N 3.31Å; H167-T196 PolarHBondContact CE1-O 3.12Å; H167-T196 PolarHBondContact NE2-O 3.39Å; H167-T232 VanDerWaalsContact CB-O 3.31Å; H167-T232 WeakPolarHBondContact CB-O 3.38Å; H167-I233 HydrophobicContact CB-CG2 3.78Å; H167-Q237 PolarHBondContact O-NE2 2.95Å
168	L	97.3	Very high	97.7	Very high	124 Å²	124	45.6 Å²	45.6	65%	0.649	24%	0.239	S	C	*	.	H	α-helix	trans	-60.2	-36.5	-174.8	-62.7	179.8	0	0	0	113.2	E166 L170 K171	E166-L168 WeakPolarHBondContact OE2-CD2 3.27Å; L168-L170 VanDerWaalsContact C-N 3.33Å; L168-L170 PolarHBondContact O-N 3.43Å; L168-K171 VanDerWaalsContact O-CB 3.25Å; L168-K171 WeakPolarHBondContact O-CB 2.92Å; L168-K171 PolarHBondContact O-N 2.73Å
169	G	95.8	Very high	97.6	Very high	17 Å²	17	49.4 Å²	49.4	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-31	178.2	0	0	0	0	0	113.8	H167 K171 F192 T196	H167-G169 VanDerWaalsContact C-N 3.29Å; H167-G169 PolarHBondContact ND1-N 3.49Å; H167-G169 PolarHBondContact O-N 2.75Å; G169-K171 VanDerWaalsContact C-N 3.33Å; G169-F192 WeakPolarHBondContact O-CE2 3.31Å; G169-T196 WeakPolarHBondContact CA-OG1 3.4Å
170	L	97.4	Very high	97.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-86.7	-9.9	179.5	-77.5	172.9	0	0	0	112	F108 L131 H167 L168 A172 I173 T174 F192 L197 I233	F108-L170 HydrophobicContact CE1-CD2 3.83Å; F108-L170 HydrophobicContact CZ-CD2 3.88Å; L131-L170 HydrophobicContact CD2-CD1 4.39Å; L131-L170 HydrophobicContact CD2-CD2 4.37Å; H167-L170 HydrophobicContact CB-CB 4.1Å; H167-L170 HydrophobicContact CB-CD1 4.25Å; H167-L170 HydrophobicContact CB-CG 4.5Å; H167-L170 WeakPolarHBondContact ND1-CG 3.29Å; H167-L170 PolarHBondContact ND1-N 3.44Å; H167-L170 PolarHBondContact O-N 3.01Å; H167-L170 VanDerWaalsContact O-N 3.1Å; L168-L170 VanDerWaalsContact C-N 3.33Å; L168-L170 PolarHBondContact O-N 3.43Å; L170-A172 VanDerWaalsContact C-N 3.26Å; L170-A172 PolarHBondContact O-N 3.01Å; L170-I173 HydrophobicContact CD2-CG1 4.16Å; L170-I173 WeakPolarHBondContact O-CA 3.38Å; L170-I173 WeakPolarHBondContact O-CB 3.4Å; L170-I173 PolarHBondContact O-N 2.99Å; L170-T174 PolarHBondContact O-N 2.89Å; L170-T174 PolarHBondContact O-OG1 3.14Å; L170-F192 HydrophobicContact CD2-CE2 4.49Å; L170-L197 HydrophobicContact CD1-CD2 4.22Å; L170-L197 HydrophobicContact CD2-CD2 3.64Å; L170-L197 HydrophobicContact CG-CD2 3.78Å; L170-I233 HydrophobicContact CD1-CG2 3.76Å
171	K	96.7	Very high	97.5	Very high	72 Å²	72	52.4 Å²	52.4	31%	0.313	27%	0.273	S	S	.	.	H	α-helix	trans	-56.5	-42.3	176.7	-170.2	173.6	-172.2	135.3	0	112.1	E166 H167 L168 G169 I173 T174 E175	E166-K171 IonicContact OE1-NZ 3.43Å; E166-K171 PolarHBondContact OE1-NZ 2.76Å; E166-K171 IonicContact OE2-NZ 2.78Å; H167-K171 PolarHBondContact O-N 3.31Å; L168-K171 VanDerWaalsContact O-CB 3.25Å; L168-K171 WeakPolarHBondContact O-CB 2.92Å; L168-K171 PolarHBondContact O-N 2.73Å; G169-K171 VanDerWaalsContact C-N 3.33Å; K171-I173 PolarHBondContact O-N 2.68Å; K171-I173 VanDerWaalsContact O-N 3.1Å; K171-T174 WeakPolarHBondContact CA-OG1 3.45Å; K171-T174 PolarHBondContact O-N 2.85Å; K171-T174 PolarHBondContact O-OG1 2.91Å; K171-E175 WeakPolarHBondContact CE-OE1 3.36Å; K171-E175 HydrophobicContact CG-CG 4.03Å; K171-E175 WeakPolarHBondContact CG-OE1 3.33Å; K171-E175 WeakPolarHBondContact O-CB 3.41Å; K171-E175 VanDerWaalsContact O-CG 3.32Å; K171-E175 WeakPolarHBondContact O-CG 3.33Å; K171-E175 PolarHBondContact O-N 3.45Å
172	A	94.9	Very high	97.5	Very high	36 Å²	36	55.3 Å²	55.3	30%	0.298	28%	0.284	S	S	.	.	H	α-helix	trans	-57.5	-24.9	175.7	0	0	0	0	0	113.3	L170	L170-A172 VanDerWaalsContact C-N 3.26Å; L170-A172 PolarHBondContact O-N 3.01Å
173	I	97.2	Very high	97.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-89	-51.9	177.2	-48.1	-54.8	0	0	0	109.7	V73 I82 L170 K171 E175 V176 L177 I189 F192	V73-I173 HydrophobicContact CG1-CG2 4.21Å; V73-I173 HydrophobicContact CG2-CD1 4.09Å; I82-I173 HydrophobicContact CD1-CD1 3.5Å; I82-I173 VanDerWaalsContact CD1-CD1 3.5Å; I82-I173 HydrophobicContact CD1-CG1 3.66Å; I82-I173 HydrophobicContact CD1-CG2 4.27Å; I82-I173 HydrophobicContact CG1-CD1 3.98Å; I82-I173 HydrophobicContact CG1-CG1 4.49Å; I82-I173 HydrophobicContact CG1-CG2 4.49Å; L170-I173 HydrophobicContact CD2-CG1 4.16Å; L170-I173 WeakPolarHBondContact O-CA 3.38Å; L170-I173 WeakPolarHBondContact O-CB 3.4Å; L170-I173 PolarHBondContact O-N 2.99Å; K171-I173 PolarHBondContact O-N 2.68Å; K171-I173 VanDerWaalsContact O-N 3.1Å; I173-E175 VanDerWaalsContact C-N 3.26Å; I173-E175 PolarHBondContact O-N 2.87Å; I173-V176 WeakPolarHBondContact O-CG2 3.21Å; I173-V176 PolarHBondContact O-N 3.27Å; I173-V176 VanDerWaalsContact O-N 3.1Å; I173-L177 HydrophobicContact CG2-CD2 4.43Å; I173-L177 WeakPolarHBondContact O-CG 3.22Å; I173-L177 PolarHBondContact O-N 2.8Å; I173-I189 HydrophobicContact CD1-CD1 3.39Å; I173-F192 HydrophobicContact CD1-CD2 3.7Å; I173-F192 HydrophobicContact CD1-CE2 3.96Å; I173-F192 HydrophobicContact CD1-CG 4.28Å; I173-F192 HydrophobicContact CG1-CD2 4.04Å; I173-F192 HydrophobicContact CG1-CE2 3.83Å
174	T	97.5	Very high	97.4	Very high	9 Å²	9	55.2 Å²	55.2	6%	0.055	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-31.8	-175.3	52.9	0	0	0	0	113	L170 K171 V176 L177 Q237 F241	L170-T174 PolarHBondContact O-N 2.89Å; L170-T174 PolarHBondContact O-OG1 3.14Å; K171-T174 WeakPolarHBondContact CA-OG1 3.45Å; K171-T174 PolarHBondContact O-N 2.85Å; K171-T174 PolarHBondContact O-OG1 2.91Å; T174-V176 VanDerWaalsContact C-N 3.26Å; T174-V176 PolarHBondContact O-N 2.81Å; T174-L177 HydrophobicContact CG2-CD1 4.38Å; T174-L177 PolarHBondContact O-N 2.98Å; T174-Q237 HydrophobicContact CG2-CB 3.95Å; T174-Q237 HydrophobicContact CG2-CG 3.99Å; T174-F241 HydrophobicContact CG2-CD2 4.33Å; T174-F241 HydrophobicContact CG2-CE2 3.71Å
175	E	96.5	Very high	97.4	Very high	114 Å²	114	58.1 Å²	58.1	53%	0.533	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.1	177.6	-74.5	179	168.8	0	0	113.8	K171 I173	K171-E175 WeakPolarHBondContact CE-OE1 3.36Å; K171-E175 HydrophobicContact CG-CG 4.03Å; K171-E175 WeakPolarHBondContact CG-OE1 3.33Å; K171-E175 WeakPolarHBondContact O-CB 3.41Å; K171-E175 VanDerWaalsContact O-CG 3.32Å; K171-E175 WeakPolarHBondContact O-CG 3.33Å; K171-E175 PolarHBondContact O-N 3.45Å; I173-E175 VanDerWaalsContact C-N 3.26Å; I173-E175 PolarHBondContact O-N 2.87Å
176	V	97.5	Very high	97.4	Very high	22 Å²	22	53.7 Å²	53.7	13%	0.133	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-8.1	179.3	-57.9	0	0	0	0	113.5	V73 I173 T174 Q178 D179 L180 K187 I189	V73-V176 HydrophobicContact CB-CG2 4.49Å; V73-V176 HydrophobicContact CG2-CG2 4.42Å; I173-V176 WeakPolarHBondContact O-CG2 3.21Å; I173-V176 PolarHBondContact O-N 3.27Å; I173-V176 VanDerWaalsContact O-N 3.1Å; T174-V176 VanDerWaalsContact C-N 3.26Å; T174-V176 PolarHBondContact O-N 2.81Å; V176-Q178 PolarHBondContact O-N 3.07Å; V176-D179 WeakPolarHBondContact O-CB 2.96Å; V176-D179 PolarHBondContact O-N 2.85Å; V176-L180 HydrophobicContact CG2-CD1 4.32Å; V176-K187 HydrophobicContact CB-CG 4.22Å; V176-K187 HydrophobicContact CG1-CG 4.34Å; V176-I189 HydrophobicContact CG1-CG2 3.94Å; V176-I189 HydrophobicContact CG2-CG2 3.98Å
177	L	98	Very high	97.3	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-61.7	-30.3	-176.5	-69.6	-176.7	0	0	0	113.4	A80 I173 T174 D179 L180 Q181 E240 F241 L244	A80-L177 HydrophobicContact CB-CD2 4.42Å; I173-L177 HydrophobicContact CG2-CD2 4.43Å; I173-L177 WeakPolarHBondContact O-CG 3.22Å; I173-L177 PolarHBondContact O-N 2.8Å; T174-L177 HydrophobicContact CG2-CD1 4.38Å; T174-L177 PolarHBondContact O-N 2.98Å; L177-D179 PolarHBondContact O-N 3.47Å; L177-L180 HydrophobicContact CD2-CD1 4.45Å; L177-L180 CarbonylContact O-C 3.6Å; L177-L180 WeakPolarHBondContact O-CA 3.25Å; L177-L180 PolarHBondContact O-N 2.66Å; L177-Q181 PolarHBondContact O-N 3.31Å; L177-E240 HydrophobicContact CB-CB 4.29Å; L177-E240 HydrophobicContact CD1-CB 3.91Å; L177-F241 HydrophobicContact CD1-CB 4.48Å; L177-F241 HydrophobicContact CD1-CD1 3.88Å; L177-F241 HydrophobicContact CD1-CD2 3.74Å; L177-F241 HydrophobicContact CD1-CE1 3.98Å; L177-F241 HydrophobicContact CD1-CE2 3.85Å; L177-F241 HydrophobicContact CD1-CG 3.76Å; L177-F241 HydrophobicContact CD1-CZ 3.96Å; L177-L244 HydrophobicContact CB-CD2 4.39Å; L177-L244 HydrophobicContact CD2-CD1 4.34Å
178	Q	96.6	Very high	97.3	Very high	137 Å²	137	58.4 Å²	58.4	64%	0.64	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.4	-32.7	174	63.6	-179.9	-12.3	0	0	113.2	V176 L180	V176-Q178 PolarHBondContact O-N 3.07Å; Q178-L180 PolarHBondContact O-N 3.11Å
179	D	97.3	Very high	97.2	Very high	80 Å²	80	52.8 Å²	52.8	43%	0.428	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-75.5	-18.5	176.2	-67.9	-13.2	0	0	0	111.4	V176 L177 K187	V176-D179 WeakPolarHBondContact O-CB 2.96Å; V176-D179 PolarHBondContact O-N 2.85Å; L177-D179 PolarHBondContact O-N 3.47Å; D179-K187 IonicContact OD2-NZ 2.76Å; D179-K187 PolarHBondContact OD2-NZ 2.84Å
180	L	97.6	Very high	97.2	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-106.3	17.5	-173.5	-57.8	-179.5	0	0	0	113	V73 N75 V176 L177 Q178 Y182 K185 K187 L244	V73-L180 HydrophobicContact CB-CD1 3.78Å; V73-L180 HydrophobicContact CG1-CD1 3.42Å; V73-L180 VanDerWaalsContact CG1-CD1 3.42Å; N75-L180 HydrophobicContact CB-CB 4.33Å; N75-L180 WeakPolarHBondContact CB-O 3.28Å; N75-L180 PolarHBondContact ND2-O 3.03Å; V176-L180 HydrophobicContact CG2-CD1 4.32Å; L177-L180 HydrophobicContact CD2-CD1 4.45Å; L177-L180 CarbonylContact O-C 3.6Å; L177-L180 WeakPolarHBondContact O-CA 3.25Å; L177-L180 PolarHBondContact O-N 2.66Å; Q178-L180 PolarHBondContact O-N 3.11Å; L180-Y182 PolarHBondContact O-N 2.95Å; L180-K185 HydrophobicContact CB-CB 4.48Å; L180-K185 HydrophobicContact CD2-CB 3.95Å; L180-K187 HydrophobicContact CD1-CB 4.26Å; L180-K187 HydrophobicContact CD2-CB 3.74Å; L180-K187 HydrophobicContact CG-CB 4.24Å; L180-L244 WeakPolarHBondContact O-CD2 3.33Å
181	Q	98.1	Very high	97	Very high	63 Å²	63	60.1 Å²	60.1	29%	0.294	32%	0.323	S	S	.	.			trans	-54	-33.2	-168.8	-175.4	174.2	31.5	0	0	114.4	N75 L177 R243 L244 R245	N75-Q181 PolarHBondContact ND2-O 3.34Å; L177-Q181 PolarHBondContact O-N 3.31Å; Q181-R243 WeakPolarHBondContact CG-O 3.43Å; Q181-R243 PolarHBondContact NE2-O 3.16Å; Q181-L244 CarbonylContact O-C 3.45Å; Q181-R245 HydrophobicContact CG-CG 4.03Å; Q181-R245 WeakPolarHBondContact O-CA 3.48Å; Q181-R245 VanDerWaalsContact O-CB 3.28Å; Q181-R245 WeakPolarHBondContact O-CB 3.36Å; Q181-R245 PolarHBondContact O-N 3.29Å
182	Y	98.4	Very high	97	Very high	60 Å²	60	57 Å²	57	24%	0.235	31%	0.309	C	S	.	.	S	Bend	trans	-112.9	156.1	-173.8	-60.7	-91.3	0	0	0	112.2	N75 L180 K185 R245 K249	N75-Y182 VanDerWaalsContact ND2-C 3.32Å; N75-Y182 PolarHBondContact ND2-O 3.12Å; L180-Y182 PolarHBondContact O-N 2.95Å; Y182-K185 VanDerWaalsContact O-CB 3.32Å; Y182-K185 WeakPolarHBondContact O-CB 3.35Å; Y182-K185 VanDerWaalsContact O-CG 3.24Å; Y182-K185 WeakPolarHBondContact O-CG 3.45Å; Y182-K185 PolarHBondContact O-N 3Å; Y182-R245 HydrophobicContact CD1-CB 3.89Å; Y182-R245 HydrophobicContact CD1-CG 3.93Å; Y182-R245 HydrophobicContact CE1-CB 4.31Å; Y182-R245 HydrophobicContact CE1-CG 3.85Å; Y182-K249 VanDerWaalsContact CD1-CA 3.49Å; Y182-K249 HydrophobicContact CD1-CB 3.75Å; Y182-K249 HydrophobicContact CD1-CG 4.25Å; Y182-K249 HydrophobicContact CD2-CB 4Å; Y182-K249 HydrophobicContact CD2-CD 4.33Å; Y182-K249 HydrophobicContact CD2-CG 4.28Å; Y182-K249 HydrophobicContact CE1-CB 4.03Å; Y182-K249 HydrophobicContact CE1-CG 4Å; Y182-K249 HydrophobicContact CE2-CB 4.29Å; Y182-K249 HydrophobicContact CE2-CD 4.06Å; Y182-K249 HydrophobicContact CE2-CG 4.07Å; Y182-K249 HydrophobicContact CG-CB 3.74Å; Y182-K249 HydrophobicContact CG-CG 4.39Å
183	K	97.8	Very high	97.1	Very high	64 Å²	64	57.8 Å²	57.8	28%	0.278	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	142.1	176	177	170.6	-175.6	169.1	0	111.5	N75 D76 K185 S246 H247 L248	N75-K183 CarbonylContact O-C 3.59Å; D76-K183 WeakPolarHBondContact O-CE 3.11Å; D76-K183 WeakPolarHBondContact O-CG 3.36Å; K183-K185 PolarHBondContact O-N 3.05Å; K183-S246 WeakPolarHBondContact CD-O 3.39Å; K183-H247 VanDerWaalsContact CB-C 3.46Å; K183-H247 PolarHBondContact N-O 2.93Å; K183-L248 HydrophobicContact CB-CD2 4.35Å; K183-L248 HydrophobicContact CG-CD2 4.44Å; K183-L248 WeakPolarHBondContact O-CD2 3.07Å
184	G	96.8	Very high	97.2	Very high	55 Å²	55	57.8 Å²	57.8	57%	0.567	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	1.1	178.2	0	0	0	0	0	114.8	N75	N75-G184 PolarHBondContact O-N 3.1Å
185	K	98.2	Very high	97.1	Very high	106 Å²	106	60.1 Å²	60.1	46%	0.461	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.8	173.1	-66.3	-64.3	-178.2	-173.9	0	110.3	I74 N75 L180 Y182 K183	I74-K185 WeakPolarHBondContact CA-O 3.39Å; N75-K185 PolarHBondContact N-O 3.46Å; L180-K185 HydrophobicContact CB-CB 4.48Å; L180-K185 HydrophobicContact CD2-CB 3.95Å; Y182-K185 VanDerWaalsContact O-CB 3.32Å; Y182-K185 WeakPolarHBondContact O-CB 3.35Å; Y182-K185 VanDerWaalsContact O-CG 3.24Å; Y182-K185 WeakPolarHBondContact O-CG 3.45Å; Y182-K185 PolarHBondContact O-N 3Å; K183-K185 PolarHBondContact O-N 3.05Å
186	T	98.1	Very high	97.2	Very high	71 Å²	71	56.9 Å²	56.9	44%	0.436	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.9	178.6	179.2	0	0	0	0	110.9	E72 V73	E72-T186 VanDerWaalsContact CD-OG1 3.32Å; E72-T186 WeakPolarHBondContact CG-OG1 3.43Å; E72-T186 PolarHBondContact OE1-OG1 3.49Å; V73-T186 CarbonylContact O-C 3.48Å; V73-T186 VanDerWaalsContact O-CA 3.28Å; V73-T186 WeakPolarHBondContact O-CA 3.47Å
187	K	97.9	Very high	97.2	Very high	84 Å²	84	55.9 Å²	55.9	37%	0.365	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	131.5	176.2	-172	78.1	174.4	-147.2	0	109.4	V73 V176 D179 L180	V73-K187 PolarHBondContact N-O 2.9Å; V73-K187 PolarHBondContact O-N 3.03Å; V176-K187 HydrophobicContact CB-CG 4.22Å; V176-K187 HydrophobicContact CG1-CG 4.34Å; D179-K187 IonicContact OD2-NZ 2.76Å; D179-K187 PolarHBondContact OD2-NZ 2.84Å; L180-K187 HydrophobicContact CD1-CB 4.26Å; L180-K187 HydrophobicContact CD2-CB 3.74Å; L180-K187 HydrophobicContact CG-CB 4.24Å
188	I	97.3	Very high	97.2	Very high	110 Å²	110	56.4 Å²	56.4	56%	0.564	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.3	169.4	-59.6	174.9	0	0	0	108.7	D70 C71	D70-I188 HydrophobicContact CB-CG2 3.89Å; C71-I188 WeakPolarHBondContact O-CA 3.21Å
189	I	96.1	Very high	97.2	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.9	172.5	61.2	175.2	0	0	0	110.5	D70 C71 V73 I173 V176 C191 F192	D70-I189 CarbonylContact C-O 3.41Å; D70-I189 VanDerWaalsContact CA-O 3.28Å; D70-I189 WeakPolarHBondContact CA-O 3.45Å; D70-I189 PolarHBondContact N-O 2.87Å; C71-I189 HydrophobicContact CB-CD1 4.46Å; C71-I189 HydrophobicContact CB-CG1 4.02Å; C71-I189 PolarHBondContact N-O 2.92Å; C71-I189 VanDerWaalsContact N-O 3.12Å; C71-I189 WeakPolarHBondContact O-CG1 3.05Å; C71-I189 PolarHBondContact O-N 2.76Å; V73-I189 HydrophobicContact CG2-CD1 3.78Å; V73-I189 HydrophobicContact CG2-CG1 4.07Å; V73-I189 HydrophobicContact CG2-CG2 4.03Å; I173-I189 HydrophobicContact CD1-CD1 3.39Å; V176-I189 HydrophobicContact CG1-CG2 3.94Å; V176-I189 HydrophobicContact CG2-CG2 3.98Å; I189-C191 VanDerWaalsContact C-N 3.29Å; I189-C191 PolarHBondContact O-N 3.48Å; I189-F192 HydrophobicContact CD1-CB 3.9Å
190	P	94.6	Very high	97	Very high	101 Å²	101	50.8 Å²	50.8	66%	0.656	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	-34	-173.6	-24.6	33.9	0	0	0	114.1	R69 D70	R69-P190 WeakPolarHBondContact CA-O 3.48Å; D70-P190 PolarHBondContact N-O 3.15Å
191	C	94.3	Very high	96.8	Very high	71 Å²	71	55 Å²	55	48%	0.48	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	146	179.4	64.4	0	0	0	0	113	V67 C68 I189	V67-C191 HydrophobicContact CG1-CB 4.2Å; C68-C191 CarbonylContact O-C 3.5Å; C68-C191 VanDerWaalsContact O-CA 3.3Å; C68-C191 WeakPolarHBondContact O-CA 3.44Å; I189-C191 VanDerWaalsContact C-N 3.29Å; I189-C191 PolarHBondContact O-N 3.48Å
192	F	97.2	Very high	96.5	Very high	5 Å²	5	59.4 Å²	59.4	2%	0.022	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	133.6	168.4	179.9	-108.9	0	0	0	109.6	C68 I82 L84 G169 L170 I173 I189 P194 L197	C68-F192 PolarHBondContact N-O 2.81Å; C68-F192 PolarHBondContact O-N 3.12Å; I82-F192 HydrophobicContact CD1-CE1 4.06Å; I82-F192 HydrophobicContact CD1-CE2 4.32Å; I82-F192 HydrophobicContact CD1-CZ 3.95Å; I82-F192 HydrophobicContact CG2-CD1 4.22Å; L84-F192 HydrophobicContact CD2-CD1 3.95Å; L84-F192 HydrophobicContact CD2-CE1 4.39Å; G169-F192 WeakPolarHBondContact O-CE2 3.31Å; L170-F192 HydrophobicContact CD2-CE2 4.49Å; I173-F192 HydrophobicContact CD1-CD2 3.7Å; I173-F192 HydrophobicContact CD1-CE2 3.96Å; I173-F192 HydrophobicContact CD1-CG 4.28Å; I173-F192 HydrophobicContact CG1-CD2 4.04Å; I173-F192 HydrophobicContact CG1-CE2 3.83Å; I189-F192 HydrophobicContact CD1-CB 3.9Å; F192-P194 HydrophobicContact CE1-CB 4.16Å; F192-P194 WeakPolarHBondContact O-CD 3.5Å; F192-L197 HydrophobicContact CE1-CD1 4.18Å; F192-L197 HydrophobicContact CZ-CD1 3.82Å; F192-L197 HydrophobicContact CZ-CD2 4.07Å; F192-L197 HydrophobicContact CZ-CG 3.94Å
193	N	97.2	Very high	96.4	Very high	54 Å²	54	59.9 Å²	59.9	29%	0.289	34%	0.339	S	S	.	.			trans	-108.7	103.4	178	-173.6	-1.7	0	0	0	110.2	V67 N195 T196	V67-N193 HydrophobicContact CG2-CB 4.07Å; N193-N195 PolarHBondContact O-N 2.97Å; N193-N195 VanDerWaalsContact O-N 3.17Å; N193-N195 VanDerWaalsContact OD1-CB 3.32Å; N193-N195 WeakPolarHBondContact OD1-CB 3.34Å; N193-N195 PolarHBondContact OD1-N 2.89Å; N193-N195 VanDerWaalsContact OD1-N 3.1Å; N193-N195 PolarHBondContact OD1-ND2 2.91Å; N193-T196 HydrophobicContact CB-CG2 4.1Å; N193-T196 WeakPolarHBondContact O-CB 3.12Å; N193-T196 WeakPolarHBondContact O-CG2 3.13Å; N193-T196 PolarHBondContact O-N 2.97Å; N193-T196 PolarHBondContact O-OG1 3Å
194	P	97.4	Very high	96.3	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-64.9	-17.5	-179.6	21.3	-27.5	0	0	0	113.5	Y65 V66 L84 L103 F192 T196 L197	Y65-P194 HydrophobicContact CD2-CB 3.87Å; Y65-P194 HydrophobicContact CD2-CG 4.29Å; Y65-P194 HydrophobicContact CE2-CB 4.43Å; Y65-P194 HydrophobicContact CG-CB 4.33Å; Y65-P194 HydrophobicContact CG-CG 4.26Å; V66-P194 VanDerWaalsContact O-CD 3.32Å; V66-P194 WeakPolarHBondContact O-CD 3.47Å; L84-P194 HydrophobicContact CD2-CB 4.31Å; L84-P194 HydrophobicContact CD2-CG 3.97Å; L103-P194 HydrophobicContact CD2-CB 3.71Å; L103-P194 HydrophobicContact CD2-CG 3.93Å; F192-P194 HydrophobicContact CE1-CB 4.16Å; F192-P194 WeakPolarHBondContact O-CD 3.5Å; P194-T196 PolarHBondContact O-N 3.27Å; P194-T196 VanDerWaalsContact O-N 3.16Å; P194-L197 WeakPolarHBondContact O-CB 3.21Å; P194-L197 PolarHBondContact O-N 3.47Å
195	N	96.7	Very high	96.4	Very high	57 Å²	57	59.3 Å²	59.3	31%	0.305	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.2	170.5	-76.8	-73.8	0	0	0	112.7	Y65 N193 L197 L198	Y65-N195 VanDerWaalsContact C-ND2 3.3Å; Y65-N195 WeakPolarHBondContact CB-ND2 3.4Å; Y65-N195 PolarHBondContact O-ND2 2.87Å; N193-N195 PolarHBondContact O-N 2.97Å; N193-N195 VanDerWaalsContact O-N 3.17Å; N193-N195 VanDerWaalsContact OD1-CB 3.32Å; N193-N195 WeakPolarHBondContact OD1-CB 3.34Å; N193-N195 PolarHBondContact OD1-N 2.89Å; N193-N195 VanDerWaalsContact OD1-N 3.1Å; N193-N195 PolarHBondContact OD1-ND2 2.91Å; N195-L197 PolarHBondContact O-N 2.94Å; N195-L198 PolarHBondContact O-N 2.93Å; N195-L198 VanDerWaalsContact O-N 3.09Å
196	T	97.6	Very high	96.4	Very high	47 Å²	47	54.6 Å²	54.6	29%	0.288	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-65.3	-19.2	179.3	65.4	0	0	0	0	112.3	H167 G169 N193 P194	H167-T196 PolarHBondContact CE1-O 3.12Å; H167-T196 PolarHBondContact NE2-O 3.39Å; G169-T196 WeakPolarHBondContact CA-OG1 3.4Å; N193-T196 HydrophobicContact CB-CG2 4.1Å; N193-T196 WeakPolarHBondContact O-CB 3.12Å; N193-T196 WeakPolarHBondContact O-CG2 3.13Å; N193-T196 PolarHBondContact O-N 2.97Å; N193-T196 PolarHBondContact O-OG1 3Å; P194-T196 PolarHBondContact O-N 3.27Å; P194-T196 VanDerWaalsContact O-N 3.16Å
197	L	98.3	Very high	96.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-85.8	-9.6	176.7	-54.6	-175.1	0	0	0	113.1	V106 L131 L133 L159 L170 F192 P194 N195 L231	V106-L197 HydrophobicContact CG1-CD1 4Å; V106-L197 HydrophobicContact CG2-CD1 3.88Å; L131-L197 HydrophobicContact CD2-CD1 4.03Å; L131-L197 HydrophobicContact CD2-CD2 3.92Å; L133-L197 HydrophobicContact CD1-CD1 4.02Å; L133-L197 HydrophobicContact CG-CD1 4.39Å; L159-L197 WeakPolarHBondContact CD1-O 3.3Å; L159-L197 WeakPolarHBondContact CG-O 3.24Å; L170-L197 HydrophobicContact CD1-CD2 4.22Å; L170-L197 HydrophobicContact CD2-CD2 3.64Å; L170-L197 HydrophobicContact CG-CD2 3.78Å; F192-L197 HydrophobicContact CE1-CD1 4.18Å; F192-L197 HydrophobicContact CZ-CD1 3.82Å; F192-L197 HydrophobicContact CZ-CD2 4.07Å; F192-L197 HydrophobicContact CZ-CG 3.94Å; P194-L197 WeakPolarHBondContact O-CB 3.21Å; P194-L197 PolarHBondContact O-N 3.47Å; N195-L197 PolarHBondContact O-N 2.94Å; L197-L231 HydrophobicContact CB-CD1 4.44Å; L197-L231 HydrophobicContact CD2-CD1 4.5Å; L197-L231 WeakPolarHBondContact O-CD1 3.3Å
198	L	97.9	Very high	96.5	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	26%	0.264	C	S	.	.	S	Bend	trans	-84.6	144.7	177.9	-62.9	174.6	0	0	0	109.6	P63 Y65 N195 Y227	P63-L198 HydrophobicContact CB-CD1 3.63Å; P63-L198 HydrophobicContact CB-CD2 4.39Å; P63-L198 HydrophobicContact CG-CD1 4.07Å; P63-L198 HydrophobicContact CG-CD2 4.31Å; Y65-L198 HydrophobicContact CD2-CD1 3.69Å; Y65-L198 HydrophobicContact CD2-CG 4.08Å; Y65-L198 HydrophobicContact CE2-CD1 3.78Å; Y65-L198 HydrophobicContact CE2-CD2 3.81Å; Y65-L198 HydrophobicContact CE2-CG 3.88Å; N195-L198 PolarHBondContact O-N 2.93Å; N195-L198 VanDerWaalsContact O-N 3.09Å; L198-Y227 HydrophobicContact CD2-CE2 3.81Å
199	P	95.7	Very high	96.6	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.071	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-60.9	161.7	169.1	-17.8	33.2	0	0	0	110.2	L159 L203 R204 Y227	L159-P199 HydrophobicContact CD1-CG 4.05Å; P199-L203 HydrophobicContact CB-CB 4.37Å; P199-L203 WeakPolarHBondContact CB-O 3.38Å; P199-R204 HydrophobicContact CB-CG 4.5Å; P199-R204 PolarHBondContact O-NE 2.63Å; P199-R204 VanDerWaalsContact O-NE 3.16Å; P199-Y227 HydrophobicContact CG-CD1 4.21Å; P199-Y227 HydrophobicContact CG-CD2 3.99Å; P199-Y227 HydrophobicContact CG-CG 3.81Å
200	D	93.9	Very high	96.7	Very high	89 Å²	89	46.2 Å²	46.2	48%	0.476	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-46.1	136.9	168.7	-174.1	-77.3	0	0	0	109.8	L202 L203 R204	D200-L202 PolarHBondContact O-N 3Å; D200-L202 WeakPolarHBondContact OD1-CB 3.48Å; D200-L202 PolarHBondContact OD1-N 2.81Å; D200-L203 HydrophobicContact CB-CB 4.32Å; D200-L203 HydrophobicContact CB-CD1 4.16Å; D200-L203 HydrophobicContact CB-CG 4.19Å; D200-L203 CarbonylContact O-C 3.59Å; D200-L203 WeakPolarHBondContact O-CA 3.28Å; D200-L203 PolarHBondContact O-N 3.32Å; D200-R204 WeakPolarHBondContact O-CG 3.39Å
201	P	93	Very high	96.9	Very high	90 Å²	90	41.5 Å²	41.5	58%	0.584	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-49.3	-30.9	-179.4	-30.1	36.6	0	0	0	115.2	L203	P201-L203 VanDerWaalsContact C-N 3.29Å
202	L	93.3	Very high	97.1	Very high	155 Å²	155	38.1 Å²	38.1	81%	0.812	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-78.8	-11	177.6	-59	177.3	0	0	0	113.7	D200	D200-L202 PolarHBondContact O-N 3Å; D200-L202 WeakPolarHBondContact OD1-CB 3.48Å; D200-L202 PolarHBondContact OD1-N 2.81Å
203	L	95.8	Very high	97.1	Very high	69 Å²	69	38.7 Å²	38.7	36%	0.361	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-116	33.2	-176.5	-58.7	-179.1	0	0	0	111.6	P199 D200 P201 Y229	P199-L203 HydrophobicContact CB-CB 4.37Å; P199-L203 WeakPolarHBondContact CB-O 3.38Å; D200-L203 HydrophobicContact CB-CB 4.32Å; D200-L203 HydrophobicContact CB-CD1 4.16Å; D200-L203 HydrophobicContact CB-CG 4.19Å; D200-L203 CarbonylContact O-C 3.59Å; D200-L203 WeakPolarHBondContact O-CA 3.28Å; D200-L203 PolarHBondContact O-N 3.32Å; P201-L203 VanDerWaalsContact C-N 3.29Å; L203-Y229 HydrophobicContact CB-CD1 4.24Å; L203-Y229 HydrophobicContact CB-CD2 3.81Å; L203-Y229 HydrophobicContact CB-CE2 4.19Å; L203-Y229 HydrophobicContact CB-CG 3.82Å; L203-Y229 HydrophobicContact CD1-CD1 4.34Å; L203-Y229 HydrophobicContact CD2-CD1 4.16Å; L203-Y229 HydrophobicContact CD2-CE1 3.81Å; L203-Y229 HydrophobicContact CD2-CE2 4.21Å; L203-Y229 HydrophobicContact CG-CD1 4.49Å; L203-Y229 WeakPolarHBondContact O-CD2 3.46Å
204	R	96.1	Very high	97.2	Very high	67 Å²	67	36.4 Å²	36.4	25%	0.253	19%	0.192	S	C	.	.			trans	-97.7	29	-177.6	-71.9	-173.6	-174.8	-178	1	113.8	P199 D200 Y206 Y227	P199-R204 HydrophobicContact CB-CG 4.5Å; P199-R204 PolarHBondContact O-NE 2.63Å; P199-R204 VanDerWaalsContact O-NE 3.16Å; D200-R204 WeakPolarHBondContact O-CG 3.39Å; R204-Y206 WeakPolarHBondContact O-CD1 3.22Å; R204-Y206 PolarHBondContact O-N 2.88Å; R204-Y227 HydrophobicContact CB-CD1 4.34Å; R204-Y227 HydrophobicContact CB-CE1 3.65Å; R204-Y227 HydrophobicContact CG-CE1 3.86Å
205	D	98.1	Very high	97.2	Very high	40 Å²	40	36.8 Å²	36.8	21%	0.214	20%	0.195	C	C	.	.			trans	-56.9	132.4	166	-74.4	-2.9	0	0	0	109.6	R228 Y229 F280	D205-R228 HydrophobicContact CB-CB 3.85Å; D205-R228 HydrophobicContact CB-CG 4.49Å; D205-R228 WeakPolarHBondContact O-CB 3.43Å; D205-R228 PolarHBondContact O-N 2.9Å; D205-R228 IonicContact OD2-CZ 3.7Å; D205-R228 IonicContact OD2-NH1 2.73Å; D205-R228 PolarHBondContact OD2-NH1 3.29Å; D205-Y229 HydrophobicContact CB-CD2 4.29Å; D205-Y229 HydrophobicContact CB-CE2 3.88Å; D205-F280 HydrophobicContact CB-CB 4.41Å; D205-F280 HydrophobicContact CB-CD1 3.6Å; D205-F280 HydrophobicContact CB-CE1 3.99Å; D205-F280 HydrophobicContact CB-CG 4Å
206	Y	98.7	Very high	97.1	Very high	8 Å²	8	34.9 Å²	34.9	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.5	178.9	68	-90.2	0	0	0	112.9	L56 L61 G93 R204 I225 L226 A279	L56-Y206 HydrophobicContact CD1-CE2 4.43Å; L56-Y206 PolarHBondContact O-OH 2.71Å; L61-Y206 HydrophobicContact CB-CE1 3.84Å; L61-Y206 HydrophobicContact CD2-CD1 4.25Å; L61-Y206 HydrophobicContact CD2-CE1 4.18Å; G93-Y206 WeakPolarHBondContact CA-OH 3.27Å; R204-Y206 WeakPolarHBondContact O-CD1 3.22Å; R204-Y206 PolarHBondContact O-N 2.88Å; Y206-I225 HydrophobicContact CD2-CG2 3.77Å; Y206-I225 HydrophobicContact CG-CG2 3.89Å; Y206-L226 CarbonylContact C-O 3.48Å; Y206-L226 WeakPolarHBondContact CA-O 3.46Å; Y206-L226 WeakPolarHBondContact CB-O 3.39Å; Y206-A279 HydrophobicContact CD1-CB 3.84Å; Y206-A279 HydrophobicContact CD2-CB 4.22Å; Y206-A279 HydrophobicContact CE1-CB 3.43Å; Y206-A279 VanDerWaalsContact CE1-CB 3.43Å; Y206-A279 HydrophobicContact CE2-CB 3.88Å; Y206-A279 HydrophobicContact CG-CB 4.21Å; Y206-A279 VanDerWaalsContact CZ-CB 3.46Å; Y206-A279 PolarHBondContact O-N 2.65Å
207	W	98.8	Very high	97	Very high	8 Å²	8	35.1 Å²	35.1	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	156.6	164.4	-62.3	-78	0	0	0	110.9	L45 V122 I225 L226 R228 V276 R277 F280	L45-W207 HydrophobicContact CD1-CB 3.58Å; L45-W207 HydrophobicContact CD1-CD2 3.56Å; L45-W207 HydrophobicContact CD1-CE3 3.76Å; L45-W207 HydrophobicContact CD1-CG 3.51Å; L45-W207 HydrophobicContact CD2-CD2 3.74Å; L45-W207 HydrophobicContact CD2-CE3 4.21Å; L45-W207 HydrophobicContact CD2-CG 4.1Å; L45-W207 HydrophobicContact CD2-CH2 4.32Å; L45-W207 HydrophobicContact CD2-CZ2 3.87Å; L45-W207 HydrophobicContact CD2-CZ3 4.46Å; L45-W207 HydrophobicContact CG-CD2 4.33Å; L45-W207 HydrophobicContact CG-CG 4.4Å; V122-W207 HydrophobicContact CG1-CH2 4.06Å; V122-W207 HydrophobicContact CG2-CZ3 4.24Å; W207-I225 CarbonylContact O-C 3.58Å; W207-I225 WeakPolarHBondContact O-CA 3.34Å; W207-L226 HydrophobicContact CE3-CB 4.39Å; W207-L226 PolarHBondContact N-O 3.45Å; W207-L226 PolarHBondContact O-N 2.98Å; W207-R228 HydrophobicContact CE3-CB 4.48Å; W207-R228 HydrophobicContact CH2-CB 4.05Å; W207-R228 HydrophobicContact CH2-CG 3.78Å; W207-R228 HydrophobicContact CZ2-CG 4.47Å; W207-R228 HydrophobicContact CZ3-CB 3.89Å; W207-R228 HydrophobicContact CZ3-CG 4.11Å; W207-V276 HydrophobicContact CB-CG1 3.92Å; W207-V276 HydrophobicContact CG-CG1 4.24Å; W207-R277 CarbonylContact C-O 3.36Å; W207-R277 VanDerWaalsContact CA-O 3.24Å; W207-R277 WeakPolarHBondContact CA-O 3.4Å; W207-F280 HydrophobicContact CD2-CE1 4.26Å; W207-F280 HydrophobicContact CD2-CZ 4.3Å; W207-F280 AromaticContact CE2-CE1 3.89Å; W207-F280 AromaticContact CE2-CZ 3.49Å; W207-F280 VanDerWaalsContact CE2-CZ 3.49Å; W207-F280 HydrophobicContact CG-CE1 4.44Å; W207-F280 HydrophobicContact CH2-CZ 4.45Å; W207-F280 HydrophobicContact CZ2-CE1 4.32Å; W207-F280 AromaticContact CZ2-CZ 3.59Å; W207-F280 HydrophobicContact CZ2-CZ 3.59Å; W207-F280 AromaticContact NE1-CE1 3.78Å; W207-F280 AromaticContact NE1-CZ 3.45Å
208	I	98.6	Very high	97	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	141.4	171.5	171.6	170.7	0	0	0	111.9	L56 P94 T223 W224 R277	L56-I208 HydrophobicContact CD1-CG2 3.81Å; L56-I208 HydrophobicContact CD2-CG2 4.19Å; P94-I208 HydrophobicContact CB-CD1 3.11Å; P94-I208 HydrophobicContact CB-CG1 4.44Å; P94-I208 HydrophobicContact CG-CD1 3.34Å; I208-T223 HydrophobicContact CD1-CG2 3.51Å; I208-T223 HydrophobicContact CG1-CG2 4.22Å; I208-W224 WeakPolarHBondContact CA-O 3.17Å; I208-W224 WeakPolarHBondContact CG1-O 3.4Å; I208-R277 HydrophobicContact CG2-CB 3.84Å; I208-R277 PolarHBondContact N-O 3.01Å; I208-R277 PolarHBondContact O-N 3.2Å
209	Y	98.8	Very high	97	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	164.6	163.1	79.1	-77.9	0	0	0	111.3	S41 I43 H120 W224 L226	S41-Y209 VanDerWaalsContact CB-OH 3.27Å; S41-Y209 WeakPolarHBondContact CB-OH 3.45Å; S41-Y209 PolarHBondContact OG-OH 3.16Å; I43-Y209 HydrophobicContact CD1-CD1 3.92Å; I43-Y209 HydrophobicContact CD1-CD2 3.96Å; I43-Y209 HydrophobicContact CD1-CE1 3.94Å; I43-Y209 HydrophobicContact CD1-CE2 4.02Å; I43-Y209 HydrophobicContact CD1-CG 3.93Å; I43-Y209 HydrophobicContact CG1-CD1 4.42Å; I43-Y209 HydrophobicContact CG1-CE1 3.93Å; I43-Y209 HydrophobicContact CG1-CE2 4.16Å; I43-Y209 HydrophobicContact CG2-CE2 4.16Å; H120-Y209 AromaticContact NE2-CE1 3.57Å; H120-Y209 AromaticContact NE2-CZ 3.56Å; H120-Y209 PolarHBondContact NE2-OH 3.17Å; Y209-W224 HydrophobicContact CD1-CB 3.67Å; Y209-W224 HydrophobicContact CD1-CG 4.33Å; Y209-W224 HydrophobicContact CE1-CB 3.42Å; Y209-W224 VanDerWaalsContact CE1-CB 3.42Å; Y209-W224 HydrophobicContact CE1-CD2 4.4Å; Y209-W224 AromaticContact CE1-CG 3.65Å; Y209-W224 HydrophobicContact CE1-CG 3.65Å; Y209-W224 HydrophobicContact CE2-CG 4.49Å; Y209-W224 HydrophobicContact CG-CB 4.42Å; Y209-W224 AromaticContact CZ-CD1 3.62Å; Y209-W224 AromaticContact CZ-CG 3.72Å; Y209-W224 PolarHBondContact N-O 2.79Å; Y209-W224 PolarHBondContact O-N 3.4Å; Y209-L226 HydrophobicContact CD1-CD1 3.72Å; Y209-L226 HydrophobicContact CE1-CD1 3.73Å
210	E	98.4	Very high	97.1	Very high	82 Å²	82	36.5 Å²	36.5	38%	0.383	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.7	172.1	-65.6	-62.1	136.4	0	0	110.2	T223 R274	E210-T223 PolarHBondContact OE1-OG1 2.84Å; E210-T223 PolarHBondContact OE2-OG1 2.93Å; E210-R274 WeakPolarHBondContact O-CD 3.45Å; E210-R274 PolarHBondContact O-NH1 2.96Å; E210-R274 VanDerWaalsContact O-NH1 3.12Å
211	G	98.5	Very high	97.2	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	-146.1	-173.8	0	0	0	0	0	113.7	Y39 S41 E220 N221 V222	Y39-G211 CarbonylContact O-C 3.53Å; Y39-G211 VanDerWaalsContact O-C 3.26Å; Y39-G211 WeakPolarHBondContact O-CA 3.47Å; S41-G211 WeakPolarHBondContact OG-CA 3.29Å; G211-E220 CarbonylContact O-C 3.48Å; G211-E220 WeakPolarHBondContact O-CA 3.35Å; G211-N221 PolarHBondContact O-N 2.98Å; G211-V222 PolarHBondContact N-O 2.89Å; G211-V222 PolarHBondContact O-N 2.92Å
212	S	98.8	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	173.5	-177.6	75.6	0	0	0	0	112.5	Y39 Q40 S41 C218 S219 W224	Y39-S212 PolarHBondContact O-N 2.86Å; Q40-S212 WeakPolarHBondContact CA-OG 3.14Å; Q40-S212 PolarHBondContact OE1-OG 2.87Å; S41-S212 VanDerWaalsContact CB-O 3.31Å; S41-S212 WeakPolarHBondContact CB-O 3.34Å; S41-S212 PolarHBondContact N-OG 3.19Å; S41-S212 PolarHBondContact OG-N 2.83Å; S41-S212 PolarHBondContact OG-O 3.34Å; S212-C218 WeakPolarHBondContact CB-O 3.04Å; S212-S219 CarbonylContact C-O 3.59Å; S212-S219 VanDerWaalsContact CA-O 3.22Å; S212-S219 WeakPolarHBondContact CA-O 3.38Å; S212-S219 WeakPolarHBondContact CB-O 3.42Å; S212-W224 PolarHBondContact O-NE1 3.3Å
213	L	98.4	Very high	97.7	Very high	17 Å²	17	24.5 Å²	24.5	9%	0.089	13%	0.126	C	C	.	.			trans	-60.9	144.5	156.2	-61.9	175.7	0	0	0	109.4	L148 I156 S219 V222	L148-L213 HydrophobicContact CD2-CD1 4.31Å; I156-L213 HydrophobicContact CD1-CD2 4.14Å; L213-S219 PolarHBondContact N-O 2.88Å; L213-V222 HydrophobicContact CD2-CG2 4.05Å; L213-V222 HydrophobicContact CG-CG2 4.18Å
214	T	98.3	Very high	97.9	Very high	6 Å²	6	21.2 Å²	21.2	4%	0.037	11%	0.108	C	C	.	.	S	Bend	trans	-90.8	-2.8	177.2	54.6	0	0	0	0	113.3	W28 P42 E119 W224	W28-T214 VanDerWaalsContact CZ3-O 3.27Å; W28-T214 WeakPolarHBondContact CZ3-O 3.49Å; P42-T214 HydrophobicContact CB-CG2 4.3Å; E119-T214 WeakPolarHBondContact OE2-CB 3.44Å; E119-T214 VanDerWaalsContact OE2-CG2 3.29Å; E119-T214 WeakPolarHBondContact OE2-CG2 3.2Å; E119-T214 PolarHBondContact OE2-OG1 3.09Å; T214-W224 HydrophobicContact CG2-CH2 4.04Å; T214-W224 HydrophobicContact CG2-CZ2 3.75Å
215	T	96.9	Very high	98	Very high	8 Å²	8	18 Å²	18	5%	0.049	10%	0.096	C	C	.	.	S	Bend	trans	-122.5	156.3	172.8	62.8	0	0	0	0	109.8	W20 Y22 R107 C218	W20-T215 HydrophobicContact CH2-CG2 3.77Å; W20-T215 HydrophobicContact CZ3-CG2 4.41Å; Y22-T215 WeakPolarHBondContact OH-CG2 3.24Å; R107-T215 PolarHBondContact NH1-OG1 3.21Å; T215-C218 VanDerWaalsContact C-SG 3.57Å; T215-C218 WeakPolarHBondContact O-CA 3.38Å; T215-C218 PolarHBondContact O-N 3.01Å
216	P	96.1	Very high	98	Very high	16 Å²	16	16.1 Å²	16.1	10%	0.104	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44	137.5	169.3	-34.2	40.8	0	0	0	113.1	W20 W28 F32 C218	W20-P216 HydrophobicContact CB-CG 4.44Å; W20-P216 HydrophobicContact CD2-CB 4.36Å; W20-P216 HydrophobicContact CD2-CG 3.65Å; W20-P216 HydrophobicContact CE3-CG 4Å; W20-P216 HydrophobicContact CG-CB 4.39Å; W20-P216 HydrophobicContact CG-CG 3.83Å; W28-P216 HydrophobicContact CD2-CG 3.95Å; W28-P216 HydrophobicContact CE3-CG 4.09Å; W28-P216 HydrophobicContact CG-CG 4.18Å; F32-P216 HydrophobicContact CD1-CB 3.89Å; F32-P216 HydrophobicContact CD2-CB 3.62Å; F32-P216 HydrophobicContact CD2-CG 3.66Å; F32-P216 HydrophobicContact CE1-CB 3.89Å; F32-P216 HydrophobicContact CE2-CB 3.63Å; F32-P216 HydrophobicContact CE2-CG 3.67Å; F32-P216 HydrophobicContact CG-CB 3.75Å; F32-P216 HydrophobicContact CG-CG 4.26Å; F32-P216 HydrophobicContact CZ-CB 3.76Å; F32-P216 HydrophobicContact CZ-CG 4.26Å; P216-C218 VanDerWaalsContact C-N 3.32Å; P216-C218 VanDerWaalsContact CA-N 3.34Å
217	P	95.7	Very high	98	Very high	52 Å²	52	15.8 Å²	15.8	34%	0.338	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	cis	-78.2	0.9	8.5	32.3	-36.7	0	0	0	115.4	D34 S219	D34-P217 WeakPolarHBondContact CB-O 3.29Å; P217-S219 VanDerWaalsContact C-N 3.28Å; P217-S219 WeakPolarHBondContact CG-OG 3.41Å; P217-S219 PolarHBondContact O-N 3.16Å
218	C	97.4	Very high	98	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.			trans	65.1	26.2	-177.3	-50	0	0	0	0	114.5	A35 Q40 S212 T215 P216	A35-C218 HydrophobicContact CB-CB 3.67Å; Q40-C218 PolarHBondContact NE2-O 3.24Å; Q40-C218 PolarHBondContact OE1-O 2.77Å; S212-C218 WeakPolarHBondContact CB-O 3.04Å; T215-C218 VanDerWaalsContact C-SG 3.57Å; T215-C218 WeakPolarHBondContact O-CA 3.38Å; T215-C218 PolarHBondContact O-N 3.01Å; P216-C218 VanDerWaalsContact C-N 3.32Å; P216-C218 VanDerWaalsContact CA-N 3.34Å
219	S	97.1	Very high	98	Very high	8 Å²	8	24 Å²	24	6%	0.056	12%	0.116	C	C	.	.			trans	-61.1	138.4	179.4	-55.3	0	0	0	0	112.4	D34 A149 S212 L213 P217	D34-S219 WeakPolarHBondContact OD2-CB 3.41Å; D34-S219 PolarHBondContact OD2-OG 3.03Å; A149-S219 VanDerWaalsContact CB-CB 3.5Å; S212-S219 CarbonylContact C-O 3.59Å; S212-S219 VanDerWaalsContact CA-O 3.22Å; S212-S219 WeakPolarHBondContact CA-O 3.38Å; S212-S219 WeakPolarHBondContact CB-O 3.42Å; L213-S219 PolarHBondContact N-O 2.88Å; P217-S219 VanDerWaalsContact C-N 3.28Å; P217-S219 WeakPolarHBondContact CG-OG 3.41Å; P217-S219 PolarHBondContact O-N 3.16Å
220	E	97.8	Very high	98	Very high	46 Å²	46	25.9 Å²	25.9	22%	0.215	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-173.1	177.8	-61.6	-175.3	162.1	0	0	112.4	G37 E38 Y39 Q40 G211	G37-E220 WeakPolarHBondContact CA-OE1 3.2Å; E38-E220 PolarHBondContact N-OE1 2.74Å; Y39-E220 WeakPolarHBondContact CA-OE1 3.29Å; Y39-E220 PolarHBondContact N-OE1 3.28Å; Q40-E220 PolarHBondContact NE2-OE1 2.85Å; G211-E220 CarbonylContact O-C 3.48Å; G211-E220 WeakPolarHBondContact O-CA 3.35Å
221	N	97.1	Very high	98	Very high	73 Å²	73	22.7 Å²	22.7	39%	0.39	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.8	31.6	-175.7	-55.1	-53.2	0	0	0	114.5	A149 G211	A149-N221 PolarHBondContact O-ND2 2.69Å; G211-N221 PolarHBondContact O-N 2.98Å
222	V	98.5	Very high	98	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.3	171.1	178.7	0	0	0	0	109.6	V154 I156 G211 L213 W224	V154-V222 HydrophobicContact CB-CG2 4.28Å; V154-V222 HydrophobicContact CG1-CG1 4.18Å; V154-V222 HydrophobicContact CG1-CG2 4.26Å; I156-V222 HydrophobicContact CB-CG1 4.25Å; I156-V222 HydrophobicContact CD1-CG1 3.77Å; I156-V222 HydrophobicContact CG1-CG1 3.72Å; G211-V222 PolarHBondContact N-O 2.89Å; G211-V222 PolarHBondContact O-N 2.92Å; L213-V222 HydrophobicContact CD2-CG2 4.05Å; L213-V222 HydrophobicContact CG-CG2 4.18Å; V222-W224 HydrophobicContact CG1-CG 4.42Å; V222-W224 PolarHBondContact O-N 3.12Å
223	T	98.6	Very high	98	Very high	6 Å²	6	25.5 Å²	25.5	4%	0.037	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.9	168	-60.2	0	0	0	0	108.7	V154 L155 I156 I208 E210	V154-T223 PolarHBondContact O-N 3.1Å; L155-T223 WeakPolarHBondContact CA-O 3.46Å; L155-T223 HydrophobicContact CD1-CG2 3.87Å; L155-T223 WeakPolarHBondContact CD1-O 3.42Å; I156-T223 PolarHBondContact N-O 3.17Å; I208-T223 HydrophobicContact CD1-CG2 3.51Å; I208-T223 HydrophobicContact CG1-CG2 4.22Å; E210-T223 PolarHBondContact OE1-OG1 2.84Å; E210-T223 PolarHBondContact OE2-OG1 2.93Å
224	W	98.9	Very high	98	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.4	177.1	-79.6	90.7	0	0	0	111.4	S41 H120 H132 I156 A158 I208 Y209 S212 T214 V222 L226	S41-W224 PolarHBondContact OG-NE1 3.22Å; S41-W224 VanDerWaalsContact OG-NE1 3.09Å; H120-W224 AromaticContact CE1-CD2 3.91Å; H120-W224 AromaticContact CE1-CE3 3.56Å; H120-W224 AromaticContact CE1-CH2 3.92Å; H120-W224 AromaticContact CE1-CZ3 3.56Å; H132-W224 AromaticContact CD2-CH2 3.93Å; H132-W224 AromaticContact CD2-CZ3 3.68Å; H132-W224 AromaticContact CE1-CH2 3.36Å; H132-W224 WeakPolarHBondContact CE1-CH2 3.16Å; H132-W224 AromaticContact CE1-CZ3 3.85Å; H132-W224 AromaticContact CG-CH2 3.99Å; H132-W224 AromaticContact ND1-CH2 3.63Å; H132-W224 AromaticContact NE2-CH2 3.55Å; H132-W224 AromaticContact NE2-CZ3 3.53Å; I156-W224 HydrophobicContact CB-CD2 4.24Å; I156-W224 HydrophobicContact CB-CE3 3.93Å; I156-W224 HydrophobicContact CB-CH2 4.01Å; I156-W224 HydrophobicContact CB-CZ2 4.33Å; I156-W224 HydrophobicContact CB-CZ3 3.82Å; I156-W224 HydrophobicContact CD1-CH2 3.88Å; I156-W224 HydrophobicContact CD1-CZ2 3.8Å; I156-W224 HydrophobicContact CG2-CE3 3.88Å; I156-W224 HydrophobicContact CG2-CH2 3.6Å; I156-W224 HydrophobicContact CG2-CZ2 4.38Å; I156-W224 HydrophobicContact CG2-CZ3 3.31Å; A158-W224 HydrophobicContact CB-CE3 4.02Å; A158-W224 HydrophobicContact CB-CZ3 3.89Å; I208-W224 WeakPolarHBondContact CA-O 3.17Å; I208-W224 WeakPolarHBondContact CG1-O 3.4Å; Y209-W224 HydrophobicContact CD1-CB 3.67Å; Y209-W224 HydrophobicContact CD1-CG 4.33Å; Y209-W224 HydrophobicContact CE1-CB 3.42Å; Y209-W224 VanDerWaalsContact CE1-CB 3.42Å; Y209-W224 HydrophobicContact CE1-CD2 4.4Å; Y209-W224 AromaticContact CE1-CG 3.65Å; Y209-W224 HydrophobicContact CE1-CG 3.65Å; Y209-W224 HydrophobicContact CE2-CG 4.49Å; Y209-W224 HydrophobicContact CG-CB 4.42Å; Y209-W224 AromaticContact CZ-CD1 3.62Å; Y209-W224 AromaticContact CZ-CG 3.72Å; Y209-W224 PolarHBondContact N-O 2.79Å; Y209-W224 PolarHBondContact O-N 3.4Å; S212-W224 PolarHBondContact O-NE1 3.3Å; T214-W224 HydrophobicContact CG2-CH2 4.04Å; T214-W224 HydrophobicContact CG2-CZ2 3.75Å; V222-W224 HydrophobicContact CG1-CG 4.42Å; V222-W224 PolarHBondContact O-N 3.12Å; W224-L226 HydrophobicContact CB-CD1 4.03Å
225	I	98.9	Very high	98	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	121	168	-67.6	-177.7	0	0	0	108.1	L61 P94 L155 I156 I157 A158 Y206 W207	L61-I225 HydrophobicContact CD1-CD1 3.49Å; L61-I225 VanDerWaalsContact CD1-CD1 3.49Å; L61-I225 HydrophobicContact CD2-CD1 3.68Å; L61-I225 HydrophobicContact CD2-CG2 3.87Å; L61-I225 HydrophobicContact CG-CD1 4.23Å; P94-I225 HydrophobicContact CG-CD1 3.84Å; P94-I225 HydrophobicContact CG-CG1 4.29Å; L155-I225 HydrophobicContact CD1-CB 4.5Å; L155-I225 HydrophobicContact CD1-CD1 3.67Å; L155-I225 HydrophobicContact CD1-CG1 3.77Å; I156-I225 PolarHBondContact O-N 2.86Å; I157-I225 CarbonylContact C-O 3.55Å; I157-I225 VanDerWaalsContact CA-O 3.29Å; I157-I225 WeakPolarHBondContact CA-O 3.32Å; I157-I225 HydrophobicContact CG1-CB 4.2Å; I157-I225 HydrophobicContact CG1-CG2 4.43Å; I157-I225 HydrophobicContact CG2-CG2 4.38Å; A158-I225 PolarHBondContact N-O 2.98Å; Y206-I225 HydrophobicContact CD2-CG2 3.77Å; Y206-I225 HydrophobicContact CG-CG2 3.89Å; W207-I225 CarbonylContact O-C 3.58Å; W207-I225 WeakPolarHBondContact O-CA 3.34Å
226	L	98.9	Very high	98.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.9	-178.6	-58	89.6	0	0	0	108.9	L45 H120 A158 F160 Y206 W207 Y209 W224 R228	L45-L226 HydrophobicContact CD1-CD2 4.49Å; H120-L226 HydrophobicContact CB-CD2 3.89Å; A158-L226 HydrophobicContact CB-CG 4.12Å; F160-L226 HydrophobicContact CZ-CD2 4.26Å; Y206-L226 CarbonylContact C-O 3.48Å; Y206-L226 WeakPolarHBondContact CA-O 3.46Å; Y206-L226 WeakPolarHBondContact CB-O 3.39Å; W207-L226 HydrophobicContact CE3-CB 4.39Å; W207-L226 PolarHBondContact N-O 3.45Å; W207-L226 PolarHBondContact O-N 2.98Å; Y209-L226 HydrophobicContact CD1-CD1 3.72Å; Y209-L226 HydrophobicContact CE1-CD1 3.73Å; W224-L226 HydrophobicContact CB-CD1 4.03Å; L226-R228 PolarHBondContact O-N 3.02Å
227	Y	98.8	Very high	98.2	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.8	173.7	-82	-56.7	0	0	0	110.5	I157 A158 L159 L198 P199 R204	I157-Y227 HydrophobicContact CG2-CD2 3.66Å; I157-Y227 HydrophobicContact CG2-CE2 3.58Å; A158-Y227 PolarHBondContact O-N 2.89Å; A158-Y227 VanDerWaalsContact O-N 3.12Å; L159-Y227 HydrophobicContact CD1-CD2 3.95Å; L159-Y227 HydrophobicContact CD2-CD2 3.7Å; L159-Y227 HydrophobicContact CD2-CE2 4.42Å; L198-Y227 HydrophobicContact CD2-CE2 3.81Å; P199-Y227 HydrophobicContact CG-CD1 4.21Å; P199-Y227 HydrophobicContact CG-CD2 3.99Å; P199-Y227 HydrophobicContact CG-CG 3.81Å; R204-Y227 HydrophobicContact CB-CD1 4.34Å; R204-Y227 HydrophobicContact CB-CE1 3.65Å; R204-Y227 HydrophobicContact CG-CE1 3.86Å
228	R	98.3	Very high	98.4	Very high	104 Å²	104	31 Å²	31	39%	0.392	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	-37	179.9	178.3	-177	-179.4	-179.8	6.2	112.5	D205 W207 L226	D205-R228 HydrophobicContact CB-CB 3.85Å; D205-R228 HydrophobicContact CB-CG 4.49Å; D205-R228 WeakPolarHBondContact O-CB 3.43Å; D205-R228 PolarHBondContact O-N 2.9Å; D205-R228 IonicContact OD2-CZ 3.7Å; D205-R228 IonicContact OD2-NH1 2.73Å; D205-R228 PolarHBondContact OD2-NH1 3.29Å; W207-R228 HydrophobicContact CE3-CB 4.48Å; W207-R228 HydrophobicContact CH2-CB 4.05Å; W207-R228 HydrophobicContact CH2-CG 3.78Å; W207-R228 HydrophobicContact CZ2-CG 4.47Å; W207-R228 HydrophobicContact CZ3-CB 3.89Å; W207-R228 HydrophobicContact CZ3-CG 4.11Å; L226-R228 PolarHBondContact O-N 3.02Å
229	Y	98.2	Very high	98.4	Very high	77 Å²	77	34.2 Å²	34.2	30%	0.302	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.7	-173.4	-68	-89.9	0	0	0	110.4	L203 D205	L203-Y229 HydrophobicContact CB-CD1 4.24Å; L203-Y229 HydrophobicContact CB-CD2 3.81Å; L203-Y229 HydrophobicContact CB-CE2 4.19Å; L203-Y229 HydrophobicContact CB-CG 3.82Å; L203-Y229 HydrophobicContact CD1-CD1 4.34Å; L203-Y229 HydrophobicContact CD2-CD1 4.16Å; L203-Y229 HydrophobicContact CD2-CE1 3.81Å; L203-Y229 HydrophobicContact CD2-CE2 4.21Å; L203-Y229 HydrophobicContact CG-CD1 4.49Å; L203-Y229 WeakPolarHBondContact O-CD2 3.46Å; D205-Y229 HydrophobicContact CB-CD2 4.29Å; D205-Y229 HydrophobicContact CB-CE2 3.88Å
230	P	98.1	Very high	98.5	Very high	44 Å²	44	35.5 Å²	35.5	29%	0.286	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	152.9	-177.9	32.6	-35.8	0	0	0	111.9	F127 F160 Q162	F127-P230 HydrophobicContact CD1-CB 4.33Å; F127-P230 HydrophobicContact CE1-CB 3.97Å; F127-P230 HydrophobicContact CE1-CG 4.21Å; F160-P230 HydrophobicContact CB-CB 4.01Å; F160-P230 CarbonylContact O-C 3.53Å; F160-P230 WeakPolarHBondContact O-CA 3.47Å; F160-P230 WeakPolarHBondContact O-CB 2.92Å; Q162-P230 HydrophobicContact CG-CB 4.07Å; Q162-P230 HydrophobicContact CG-CG 4.12Å
231	L	98.3	Very high	98.6	Very high	15 Å²	15	33.4 Å²	33.4	8%	0.079	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	165.8	161.8	-54.3	176.8	0	0	0	110.1	L159 F160 V161 Q162 L197	L159-L231 HydrophobicContact CB-CD1 4.3Å; L159-L231 HydrophobicContact CD1-CD1 4.16Å; L159-L231 HydrophobicContact CD1-CD2 4.21Å; L159-L231 HydrophobicContact CD1-CG 4Å; L159-L231 HydrophobicContact CG-CD1 4.34Å; F160-L231 PolarHBondContact O-N 2.79Å; V161-L231 WeakPolarHBondContact CA-O 3.09Å; V161-L231 HydrophobicContact CG2-CB 4.2Å; Q162-L231 PolarHBondContact N-O 2.97Å; L197-L231 HydrophobicContact CB-CD1 4.44Å; L197-L231 HydrophobicContact CD2-CD1 4.5Å; L197-L231 WeakPolarHBondContact O-CD1 3.3Å
232	T	98.4	Very high	98.6	Very high	59 Å²	59	31 Å²	31	36%	0.362	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.7	171.9	62.4	0	0	0	0	110.5	Q162 K165 H167	Q162-T232 WeakPolarHBondContact O-CA 3.36Å; K165-T232 CarbonylContact O-C 3.43Å; K165-T232 VanDerWaalsContact O-O 3.13Å; K165-T232 PolarHBondContact O-OG1 3.21Å; H167-T232 VanDerWaalsContact CB-O 3.31Å; H167-T232 WeakPolarHBondContact CB-O 3.38Å
233	I	98.8	Very high	98.6	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	157.5	168.4	64.1	178.9	0	0	0	109.8	M129 V161 Q162 I163 G164 K165 H167 L170 Q237 I238	M129-I233 HydrophobicContact CE-CD1 3.98Å; M129-I233 HydrophobicContact SD-CD1 3.87Å; V161-I233 HydrophobicContact CG1-CB 4.17Å; V161-I233 HydrophobicContact CG1-CD1 3.89Å; V161-I233 HydrophobicContact CG1-CG1 3.67Å; V161-I233 HydrophobicContact CG1-CG2 3.71Å; Q162-I233 PolarHBondContact O-N 3.27Å; I163-I233 CarbonylContact C-O 3.09Å; I163-I233 WeakPolarHBondContact CA-O 3.16Å; I163-I233 HydrophobicContact CD1-CG1 4.17Å; G164-I233 CarbonylContact C-O 3.49Å; G164-I233 PolarHBondContact N-O 2.03Å; K165-I233 CarbonylContact O-C 3.53Å; K165-I233 WeakPolarHBondContact O-CA 3.43Å; H167-I233 HydrophobicContact CB-CG2 3.78Å; L170-I233 HydrophobicContact CD1-CG2 3.76Å; I233-Q237 HydrophobicContact CB-CB 4.05Å; I233-I238 HydrophobicContact CD1-CB 3.79Å; I233-I238 HydrophobicContact CD1-CD1 4.42Å; I233-I238 HydrophobicContact CD1-CG1 4.26Å
234	S	98.8	Very high	98.6	Very high	20 Å²	20	37.8 Å²	37.8	14%	0.14	18%	0.176	C	C	.	.			trans	-74.3	162.1	174.2	71.8	0	0	0	0	111.8	K165 L236 Q237 I238	K165-S234 PolarHBondContact O-N 3.27Å; S234-L236 PolarHBondContact O-N 2.96Å; S234-Q237 PolarHBondContact O-N 3.21Å; S234-Q237 VanDerWaalsContact O-N 3.14Å; S234-Q237 WeakPolarHBondContact OG-CG 3.45Å; S234-Q237 PolarHBondContact OG-N 3.39Å; S234-I238 PolarHBondContact O-N 3Å
235	Q	98.7	Very high	98.6	Very high	71 Å²	71	41.2 Å²	41.2	33%	0.332	19%	0.189	S	C	.	.	H	α-helix	trans	-57.4	-40.2	172	-172.2	63.8	45.7	0	0	111.1	N114 I163 Q237 I238 E239 R242	N114-Q235 PolarHBondContact ND2-OE1 3.31Å; I163-Q235 HydrophobicContact CG2-CB 4.31Å; Q235-Q237 VanDerWaalsContact C-N 3.29Å; Q235-Q237 PolarHBondContact O-N 2.85Å; Q235-I238 VanDerWaalsContact O-CG2 3.25Å; Q235-I238 WeakPolarHBondContact O-CG2 3.39Å; Q235-I238 PolarHBondContact O-N 3.24Å; Q235-E239 PolarHBondContact NE2-OE1 2.99Å; Q235-E239 WeakPolarHBondContact O-CG 3.43Å; Q235-E239 PolarHBondContact O-N 3.36Å; Q235-E239 VanDerWaalsContact O-N 3.1Å; Q235-R242 VanDerWaalsContact NE2-NH1 3.18Å
236	L	98.6	Very high	98.5	Very high	119 Å²	119	42.1 Å²	42.1	62%	0.623	20%	0.195	S	C	*	.	H	α-helix	trans	-59.6	-41.6	177.6	-179.6	62.4	0	0	0	111.7	S234 I238 E239 E240	S234-L236 PolarHBondContact O-N 2.96Å; L236-I238 PolarHBondContact O-N 3.1Å; L236-E239 PolarHBondContact O-N 3.23Å; L236-E240 PolarHBondContact O-N 3.02Å
237	Q	98.8	Very high	98.3	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.019	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-42.3	179.7	-76.3	179.6	-61.9	0	0	112.5	H167 T174 I233 S234 Q235 E239 E240 F241	H167-Q237 PolarHBondContact O-NE2 2.95Å; T174-Q237 HydrophobicContact CG2-CB 3.95Å; T174-Q237 HydrophobicContact CG2-CG 3.99Å; I233-Q237 HydrophobicContact CB-CB 4.05Å; S234-Q237 PolarHBondContact O-N 3.21Å; S234-Q237 VanDerWaalsContact O-N 3.14Å; S234-Q237 WeakPolarHBondContact OG-CG 3.45Å; S234-Q237 PolarHBondContact OG-N 3.39Å; Q235-Q237 VanDerWaalsContact C-N 3.29Å; Q235-Q237 PolarHBondContact O-N 2.85Å; Q237-E239 VanDerWaalsContact C-N 3.34Å; Q237-E240 PolarHBondContact O-N 3.46Å; Q237-F241 WeakPolarHBondContact O-CD2 3.46Å
238	I	98.8	Very high	98.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.6	-31.1	177.3	-159.9	165	0	0	0	112.3	P128 M129 I163 I233 S234 Q235 L236 E240 F241 R242	P128-I238 HydrophobicContact CB-CD1 3.68Å; M129-I238 HydrophobicContact CE-CG1 4.29Å; I163-I238 HydrophobicContact CD1-CB 4.03Å; I163-I238 HydrophobicContact CD1-CD1 3.9Å; I163-I238 HydrophobicContact CD1-CG2 3.68Å; I233-I238 HydrophobicContact CD1-CB 3.79Å; I233-I238 HydrophobicContact CD1-CD1 4.42Å; I233-I238 HydrophobicContact CD1-CG1 4.26Å; S234-I238 PolarHBondContact O-N 3Å; Q235-I238 VanDerWaalsContact O-CG2 3.25Å; Q235-I238 WeakPolarHBondContact O-CG2 3.39Å; Q235-I238 PolarHBondContact O-N 3.24Å; L236-I238 PolarHBondContact O-N 3.1Å; I238-E240 VanDerWaalsContact C-N 3.26Å; I238-E240 PolarHBondContact O-N 3.01Å; I238-F241 PolarHBondContact O-N 3.22Å; I238-R242 WeakPolarHBondContact O-CG 3.49Å; I238-R242 PolarHBondContact O-N 2.9Å
239	E	98.8	Very high	98.1	Very high	67 Å²	67	51.6 Å²	51.6	31%	0.313	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-29.9	175.6	-69.4	-49.6	138.8	0	0	112.7	Q235 L236 Q237 R242 R243	Q235-E239 PolarHBondContact NE2-OE1 2.99Å; Q235-E239 WeakPolarHBondContact O-CG 3.43Å; Q235-E239 PolarHBondContact O-N 3.36Å; Q235-E239 VanDerWaalsContact O-N 3.1Å; L236-E239 PolarHBondContact O-N 3.23Å; Q237-E239 VanDerWaalsContact C-N 3.34Å; E239-R242 PolarHBondContact O-N 3.01Å; E239-R242 IonicContact OE1-CZ 3.87Å; E239-R242 IonicContact OE1-NH1 3.48Å; E239-R242 PolarHBondContact OE1-NH1 3.28Å; E239-R243 WeakPolarHBondContact O-CG 3.41Å; E239-R243 PolarHBondContact O-N 3.02Å
240	E	98.7	Very high	97.9	Very high	36 Å²	36	51.7 Å²	51.7	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-39.1	173.7	-64.5	-52.3	135.3	0	0	112	L177 L236 Q237 I238 R243	L177-E240 HydrophobicContact CB-CB 4.29Å; L177-E240 HydrophobicContact CD1-CB 3.91Å; L236-E240 PolarHBondContact O-N 3.02Å; Q237-E240 PolarHBondContact O-N 3.46Å; I238-E240 VanDerWaalsContact C-N 3.26Å; I238-E240 PolarHBondContact O-N 3.01Å; E240-R243 PolarHBondContact O-N 2.73Å
241	F	98.8	Very high	97.7	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-42.2	172.3	-76	-88.6	0	0	0	111.8	A80 F108 W110 M129 T174 L177 Q237 I238 R243 L244	A80-F241 HydrophobicContact CB-CD1 4.35Å; A80-F241 HydrophobicContact CB-CE1 3.95Å; F108-F241 HydrophobicContact CB-CD1 4.48Å; F108-F241 HydrophobicContact CB-CE1 3.92Å; F108-F241 AromaticContact CD1-CE1 3.61Å; F108-F241 HydrophobicContact CD1-CE1 3.61Å; F108-F241 AromaticContact CD1-CZ 3.51Å; F108-F241 HydrophobicContact CD1-CZ 3.51Å; F108-F241 HydrophobicContact CD2-CE1 4.22Å; F108-F241 HydrophobicContact CE1-CE1 4.15Å; F108-F241 AromaticContact CE1-CZ 3.66Å; F108-F241 HydrophobicContact CE1-CZ 3.66Å; F108-F241 AromaticContact CG-CE1 3.66Å; F108-F241 HydrophobicContact CG-CE1 3.66Å; F108-F241 HydrophobicContact CG-CZ 4.04Å; F108-F241 HydrophobicContact CZ-CZ 4.3Å; W110-F241 HydrophobicContact CD2-CB 3.91Å; W110-F241 HydrophobicContact CD2-CD1 4.16Å; W110-F241 HydrophobicContact CD2-CG 4.39Å; W110-F241 HydrophobicContact CE3-CB 4.45Å; W110-F241 AromaticContact CE3-CD1 3.83Å; W110-F241 HydrophobicContact CE3-CD1 3.83Å; W110-F241 HydrophobicContact CE3-CG 4.48Å; W110-F241 HydrophobicContact CG-CB 4.11Å; W110-F241 HydrophobicContact CH2-CD1 4.09Å; W110-F241 HydrophobicContact CZ2-CB 4.25Å; W110-F241 HydrophobicContact CZ2-CD1 4.38Å; W110-F241 AromaticContact CZ3-CD1 3.81Å; W110-F241 HydrophobicContact CZ3-CD1 3.81Å; W110-F241 HydrophobicContact CZ3-CE1 4.44Å; W110-F241 PolarHBondContact NE1-O 2.88Å; M129-F241 HydrophobicContact CE-CB 4.34Å; M129-F241 HydrophobicContact CE-CD1 4.18Å; M129-F241 HydrophobicContact CE-CD2 3.55Å; M129-F241 HydrophobicContact CE-CE1 4.37Å; M129-F241 HydrophobicContact CE-CE2 3.77Å; M129-F241 HydrophobicContact CE-CG 3.77Å; M129-F241 HydrophobicContact CE-CZ 4.18Å; T174-F241 HydrophobicContact CG2-CD2 4.33Å; T174-F241 HydrophobicContact CG2-CE2 3.71Å; L177-F241 HydrophobicContact CD1-CB 4.48Å; L177-F241 HydrophobicContact CD1-CD1 3.88Å; L177-F241 HydrophobicContact CD1-CD2 3.74Å; L177-F241 HydrophobicContact CD1-CE1 3.98Å; L177-F241 HydrophobicContact CD1-CE2 3.85Å; L177-F241 HydrophobicContact CD1-CG 3.76Å; L177-F241 HydrophobicContact CD1-CZ 3.96Å; Q237-F241 WeakPolarHBondContact O-CD2 3.46Å; I238-F241 PolarHBondContact O-N 3.22Å; F241-R243 PolarHBondContact O-N 3.08Å; F241-R243 VanDerWaalsContact O-N 3.08Å; F241-L244 HydrophobicContact CD1-CD1 4.41Å; F241-L244 WeakPolarHBondContact O-CB 3.48Å; F241-L244 WeakPolarHBondContact O-CG 3.16Å; F241-L244 PolarHBondContact O-N 2.72Å; F241-L244 VanDerWaalsContact O-N 3.09Å
242	R	98.7	Very high	97.4	Very high	24 Å²	24	60 Å²	60	9%	0.091	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-10.4	179	-70.6	172.9	178.4	165.9	-1.8	114	G111 K112 E113 N114 Q235 I238 E239 M260	G111-R242 PolarHBondContact O-NE 3.26Å; G111-R242 PolarHBondContact O-NH2 2.97Å; K112-R242 VanDerWaalsContact O-CZ 3.25Å; K112-R242 PolarHBondContact O-NE 3Å; K112-R242 VanDerWaalsContact O-NE 3.15Å; E113-R242 PolarHBondContact O-NH2 3.34Å; N114-R242 PolarHBondContact OD1-NH1 2.97Å; N114-R242 PolarHBondContact OD1-NH2 3.31Å; Q235-R242 VanDerWaalsContact NE2-NH1 3.18Å; I238-R242 WeakPolarHBondContact O-CG 3.49Å; I238-R242 PolarHBondContact O-N 2.9Å; E239-R242 PolarHBondContact O-N 3.01Å; E239-R242 IonicContact OE1-CZ 3.87Å; E239-R242 IonicContact OE1-NH1 3.48Å; E239-R242 PolarHBondContact OE1-NH1 3.28Å; R242-M260 WeakPolarHBondContact O-CE 3.39Å
243	R	98.3	Very high	97.1	Very high	147 Å²	147	61 Å²	61	56%	0.555	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-12.8	175.1	-72.7	168.8	-175.5	-115.9	-0.4	113.9	Q181 E239 E240 F241	Q181-R243 WeakPolarHBondContact CG-O 3.43Å; Q181-R243 PolarHBondContact NE2-O 3.16Å; E239-R243 WeakPolarHBondContact O-CG 3.41Å; E239-R243 PolarHBondContact O-N 3.02Å; E240-R243 PolarHBondContact O-N 2.73Å; F241-R243 PolarHBondContact O-N 3.08Å; F241-R243 VanDerWaalsContact O-N 3.08Å
244	L	98.6	Very high	96.6	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.01	33%	0.334	C	S	.	.			trans	-65.9	155.5	-179.4	-63.1	179.5	0	0	0	111.3	A80 W110 L177 L180 Q181 F241 L261	A80-L244 HydrophobicContact CB-CD1 4.11Å; W110-L244 HydrophobicContact CH2-CD1 3.75Å; W110-L244 HydrophobicContact CZ2-CB 4.32Å; W110-L244 HydrophobicContact CZ2-CD1 3.86Å; L177-L244 HydrophobicContact CB-CD2 4.39Å; L177-L244 HydrophobicContact CD2-CD1 4.34Å; L180-L244 WeakPolarHBondContact O-CD2 3.33Å; Q181-L244 CarbonylContact O-C 3.45Å; F241-L244 HydrophobicContact CD1-CD1 4.41Å; F241-L244 WeakPolarHBondContact O-CB 3.48Å; F241-L244 WeakPolarHBondContact O-CG 3.16Å; F241-L244 PolarHBondContact O-N 2.72Å; F241-L244 VanDerWaalsContact O-N 3.09Å; L244-L261 HydrophobicContact CB-CB 3.97Å; L244-L261 HydrophobicContact CB-CD2 4.19Å; L244-L261 HydrophobicContact CD1-CD2 4.47Å; L244-L261 PolarHBondContact O-N 3.11Å
245	R	98.1	Very high	96	Very high	73 Å²	73	72 Å²	72	28%	0.275	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-122.3	141.4	-178.6	-58.2	-68.6	-178.6	172.4	-7.9	109.7	N75 Q181 Y182 H247 D258 G259 M260	N75-R245 PolarHBondContact ND2-O 3.28Å; Q181-R245 HydrophobicContact CG-CG 4.03Å; Q181-R245 WeakPolarHBondContact O-CA 3.48Å; Q181-R245 VanDerWaalsContact O-CB 3.28Å; Q181-R245 WeakPolarHBondContact O-CB 3.36Å; Q181-R245 PolarHBondContact O-N 3.29Å; Y182-R245 HydrophobicContact CD1-CB 3.89Å; Y182-R245 HydrophobicContact CD1-CG 3.93Å; Y182-R245 HydrophobicContact CE1-CB 4.31Å; Y182-R245 HydrophobicContact CE1-CG 3.85Å; R245-H247 VanDerWaalsContact C-N 3.31Å; R245-D258 PolarHBondContact NH1-O 3.3Å; R245-G259 WeakPolarHBondContact CA-O 3.46Å; R245-G259 WeakPolarHBondContact CB-O 3.25Å; R245-G259 WeakPolarHBondContact CD-O 3.44Å; R245-M260 PolarHBondContact NH1-SD 2.73Å; R245-M260 PolarHBondContact NH2-SD 3.06Å
246	S	96.6	Very high	95.3	Very high	19 Å²	19	71.4 Å²	71.4	13%	0.133	38%	0.381	C	S	.	.	S	Bend	trans	-81.7	-9.5	-179.1	47.4	0	0	0	0	113.6	G77 K183 G259	G77-S246 WeakPolarHBondContact CA-O 3.44Å; G77-S246 VanDerWaalsContact O-CA 3.27Å; G77-S246 WeakPolarHBondContact O-CA 3.32Å; G77-S246 WeakPolarHBondContact O-CB 3.42Å; K183-S246 WeakPolarHBondContact CD-O 3.39Å; S246-G259 PolarHBondContact N-O 2.9Å; S246-G259 VanDerWaalsContact N-O 3.12Å; S246-G259 PolarHBondContact OG-O 3.06Å
247	H	95.7	Very high	94.9	Very high	33 Å²	33	67.2 Å²	67.2	15%	0.153	36%	0.359	C	S	.	.	S	Bend	trans	-123.8	166.3	-173.4	-63.3	73.7	0	0	0	112.4	K183 R245 A251 L253 N257	K183-H247 VanDerWaalsContact CB-C 3.46Å; K183-H247 PolarHBondContact N-O 2.93Å; R245-H247 VanDerWaalsContact C-N 3.31Å; H247-A251 HydrophobicContact CB-CB 4.18Å; H247-L253 HydrophobicContact CB-CD2 4.19Å; H247-N257 PolarHBondContact CE1-OD1 2.9Å
248	L	96.1	Very high	94.6	Very high	109 Å²	109	70.3 Å²	70.3	57%	0.571	38%	0.376	S	S	*	.			trans	-63.3	151.7	171.9	-62.6	176	0	0	0	110.4	K183 G250 A251	K183-L248 HydrophobicContact CB-CD2 4.35Å; K183-L248 HydrophobicContact CG-CD2 4.44Å; K183-L248 WeakPolarHBondContact O-CD2 3.07Å; L248-G250 PolarHBondContact O-N 3.29Å; L248-A251 HydrophobicContact CB-CB 4.34Å; L248-A251 WeakPolarHBondContact O-CB 3.44Å; L248-A251 PolarHBondContact O-N 3.25Å; L248-A251 VanDerWaalsContact O-N 3.14Å
249	K	95.7	Very high	94.4	Very high	161 Å²	161	70.5 Å²	70.5	70%	0.7	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	122.5	177.5	-174.4	177.1	-179.9	179.9	0	110.4	Y182 A251	Y182-K249 VanDerWaalsContact CD1-CA 3.49Å; Y182-K249 HydrophobicContact CD1-CB 3.75Å; Y182-K249 HydrophobicContact CD1-CG 4.25Å; Y182-K249 HydrophobicContact CD2-CB 4Å; Y182-K249 HydrophobicContact CD2-CD 4.33Å; Y182-K249 HydrophobicContact CD2-CG 4.28Å; Y182-K249 HydrophobicContact CE1-CB 4.03Å; Y182-K249 HydrophobicContact CE1-CG 4Å; Y182-K249 HydrophobicContact CE2-CB 4.29Å; Y182-K249 HydrophobicContact CE2-CD 4.06Å; Y182-K249 HydrophobicContact CE2-CG 4.07Å; Y182-K249 HydrophobicContact CG-CB 3.74Å; Y182-K249 HydrophobicContact CG-CG 4.39Å; K249-A251 VanDerWaalsContact C-N 3.32Å
250	G	93.9	Very high	94.3	Very high	79 Å²	79	69.6 Å²	69.6	81%	0.814	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	8	179.7	0	0	0	0	0	114.5	L248	L248-G250 PolarHBondContact O-N 3.29Å
251	A	93.7	Very high	94.3	Very high	44 Å²	44	68.1 Å²	68.1	36%	0.364	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-63.2	144	169.9	0	0	0	0	0	110.8	H247 L248 K249	H247-A251 HydrophobicContact CB-CB 4.18Å; L248-A251 HydrophobicContact CB-CB 4.34Å; L248-A251 WeakPolarHBondContact O-CB 3.44Å; L248-A251 PolarHBondContact O-N 3.25Å; L248-A251 VanDerWaalsContact O-N 3.14Å; K249-A251 VanDerWaalsContact C-N 3.32Å
252	E	93.6	Very high	94.2	Very high	189 Å²	189	68.4 Å²	68.4	88%	0.883	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-68.9	134.1	165.2	-64.8	-173.6	172.3	0	0	108.7
253	L	91.6	Very high	94.1	Very high	82 Å²	82	68.9 Å²	68.9	43%	0.429	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-89.6	137.1	-178	-61.2	178.8	0	0	0	109.5	H247	H247-L253 HydrophobicContact CB-CD2 4.19Å
254	P	87.8	Confident	94.2	Very high	67 Å²	67	61.9 Å²	61.9	44%	0.435	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-55.6	153	168.3	-23.3	33.5	0	0	0	111.5	G256 N257	P254-G256 PolarHBondContact O-N 2.82Å; P254-N257 HydrophobicContact CB-CB 4.31Å; P254-N257 VanDerWaalsContact O-CB 3.31Å; P254-N257 WeakPolarHBondContact O-CB 3.32Å; P254-N257 PolarHBondContact O-N 2.85Å
255	E	87	Confident	94.1	Very high	185 Å²	185	64.3 Å²	64.3	86%	0.864	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	140.4	172.8	-169.9	171.1	-173.1	0	0	110.3	N257	E255-N257 PolarHBondContact O-N 3.25Å
256	G	84.6	Confident	94.2	Very high	58 Å²	58	61.5 Å²	61.5	60%	0.598	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-6.9	-176.2	0	0	0	0	0	115.3	P254	P254-G256 PolarHBondContact O-N 2.82Å
257	N	89.9	Confident	94.2	Very high	31 Å²	31	65.1 Å²	65.1	17%	0.166	37%	0.371	C	S	.	.			trans	-97.3	127.2	-178.9	-157.2	-67.5	0	0	0	113.1	Q23 H247 P254 E255 G259	Q23-N257 PolarHBondContact OE1-ND2 2.81Å; Q23-N257 PolarHBondContact OE1-OD1 3.36Å; H247-N257 PolarHBondContact CE1-OD1 2.9Å; P254-N257 HydrophobicContact CB-CB 4.31Å; P254-N257 VanDerWaalsContact O-CB 3.31Å; P254-N257 WeakPolarHBondContact O-CB 3.32Å; P254-N257 PolarHBondContact O-N 2.85Å; E255-N257 PolarHBondContact O-N 3.25Å; N257-G259 VanDerWaalsContact OD1-CA 3.29Å; N257-G259 WeakPolarHBondContact OD1-CA 3.42Å; N257-G259 PolarHBondContact OD1-N 3.27Å
258	D	92.5	Very high	94.4	Very high	70 Å²	70	66.7 Å²	66.7	37%	0.374	38%	0.383	S	S	.	.			trans	-90.4	-0.2	178	70.9	0.8	0	0	0	113.8	Q23 K112 R245 M260	Q23-D258 PolarHBondContact NE2-OD1 2.75Å; K112-D258 IonicContact NZ-OD1 2.74Å; K112-D258 PolarHBondContact NZ-OD1 2.92Å; K112-D258 IonicContact NZ-OD2 3.72Å; K112-D258 PolarHBondContact NZ-OD2 2.89Å; R245-D258 PolarHBondContact NH1-O 3.3Å; D258-M260 HydrophobicContact CB-CG 4.39Å; D258-M260 PolarHBondContact O-N 3.17Å; D258-M260 VanDerWaalsContact OD1-CB 3.29Å; D258-M260 WeakPolarHBondContact OD1-CB 3.27Å; D258-M260 PolarHBondContact OD1-N 3.26Å
259	G	94.1	Very high	94.5	Very high	3 Å²	3	63.8 Å²	63.8	3%	0.031	37%	0.367	C	S	.	.			trans	66.1	-0.8	-178.2	0	0	0	0	0	114.3	R245 S246 N257	R245-G259 WeakPolarHBondContact CA-O 3.46Å; R245-G259 WeakPolarHBondContact CB-O 3.25Å; R245-G259 WeakPolarHBondContact CD-O 3.44Å; S246-G259 PolarHBondContact N-O 2.9Å; S246-G259 VanDerWaalsContact N-O 3.12Å; S246-G259 PolarHBondContact OG-O 3.06Å; N257-G259 VanDerWaalsContact OD1-CA 3.29Å; N257-G259 WeakPolarHBondContact OD1-CA 3.42Å; N257-G259 PolarHBondContact OD1-N 3.27Å
260	M	96.7	Very high	94.6	Very high	48 Å²	48	60.5 Å²	60.5	24%	0.236	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-77	135.5	177.2	-58	-72.5	-38.4	0	0	109.4	R242 R245 D258	R242-M260 WeakPolarHBondContact O-CE 3.39Å; R245-M260 PolarHBondContact NH1-SD 2.73Å; R245-M260 PolarHBondContact NH2-SD 3.06Å; D258-M260 HydrophobicContact CB-CG 4.39Å; D258-M260 PolarHBondContact O-N 3.17Å; D258-M260 VanDerWaalsContact OD1-CB 3.29Å; D258-M260 WeakPolarHBondContact OD1-CB 3.27Å; D258-M260 PolarHBondContact OD1-N 3.26Å
261	L	97.8	Very high	94.8	Very high	5 Å²	5	59.3 Å²	59.3	3%	0.026	34%	0.337	C	S	.	.			trans	-89.4	106.5	167.4	-175.8	58	0	0	0	109.3	G77 W110 L244 N264	G77-L261 WeakPolarHBondContact O-CD1 3.47Å; W110-L261 HydrophobicContact CH2-CD2 3.68Å; W110-L261 HydrophobicContact CH2-CG 3.8Å; W110-L261 HydrophobicContact CZ2-CB 4.22Å; W110-L261 HydrophobicContact CZ2-CD2 3.91Å; W110-L261 HydrophobicContact CZ2-CG 3.6Å; W110-L261 WeakPolarHBondContact CZ2-O 3.29Å; W110-L261 PolarHBondContact NE1-O 3.32Å; L244-L261 HydrophobicContact CB-CB 3.97Å; L244-L261 HydrophobicContact CB-CD2 4.19Å; L244-L261 HydrophobicContact CD1-CD2 4.47Å; L244-L261 PolarHBondContact O-N 3.11Å; L261-N264 HydrophobicContact CD1-CB 3.96Å
262	G	96.6	Very high	95	Very high	7 Å²	7	60 Å²	60	7%	0.072	34%	0.339	C	S	.	.			trans	176.1	162.9	179	0	0	0	0	0	110.3	N264	G262-N264 PolarHBondContact O-N 3.01Å
263	D	98.3	Very high	95.2	Very high	34 Å²	34	56.2 Å²	56.2	18%	0.182	33%	0.325	C	S	.	.	S	Bend	trans	54	36	-159	-60.6	-33.3	0	0	0	111.2	W110 G111 K112 R116 F265	W110-D263 WeakPolarHBondContact O-CA 3.35Å; W110-D263 PolarHBondContact O-N 3.2Å; G111-D263 WeakPolarHBondContact CA-OD1 3.49Å; K112-D263 WeakPolarHBondContact CD-OD2 3.14Å; K112-D263 WeakPolarHBondContact CG-OD2 3.4Å; K112-D263 PolarHBondContact N-OD1 3.37Å; R116-D263 IonicContact CZ-OD1 3.27Å; R116-D263 IonicContact CZ-OD2 3.96Å; R116-D263 VanDerWaalsContact NE-CG 3.28Å; R116-D263 IonicContact NE-OD1 3.16Å; R116-D263 PolarHBondContact NE-OD1 3.45Å; R116-D263 IonicContact NE-OD2 3.92Å; R116-D263 PolarHBondContact NE-OD2 3.34Å; R116-D263 IonicContact NH2-OD1 3.58Å; R116-D263 PolarHBondContact NH2-OD1 3.21Å; R116-D263 IonicContact NH2-OD2 3.05Å; R116-D263 PolarHBondContact NH2-OD2 2.99Å; D263-F265 VanDerWaalsContact CA-CE1 3.48Å; D263-F265 HydrophobicContact CB-CE1 3.82Å; D263-F265 HydrophobicContact CB-CZ 4.21Å; D263-F265 PolarHBondContact O-N 2.7Å
264	N	98.5	Very high	95.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.309	C	S	.	.			trans	-85.8	49.3	-173.7	68.9	-43.9	0	0	0	111.6	Y22 H78 F108 H109 W110 L261 G262	Y22-N264 HydrophobicContact CD2-CB 3.67Å; Y22-N264 WeakPolarHBondContact CE1-O 3.3Å; Y22-N264 HydrophobicContact CE2-CB 3.61Å; Y22-N264 HydrophobicContact CG-CB 4.24Å; Y22-N264 VanDerWaalsContact CZ-O 3.29Å; Y22-N264 PolarHBondContact OH-O 3.2Å; H78-N264 PolarHBondContact O-ND2 3.23Å; F108-N264 PolarHBondContact O-ND2 3.13Å; H109-N264 PolarHBondContact ND1-O 3.4Å; W110-N264 WeakPolarHBondContact CZ3-ND2 3.45Å; W110-N264 PolarHBondContact N-OD1 3.44Å; W110-N264 PolarHBondContact O-N 3.03Å; W110-N264 PolarHBondContact O-OD1 3.03Å; L261-N264 HydrophobicContact CD1-CB 3.96Å; G262-N264 PolarHBondContact O-N 3.01Å
265	F	98.4	Very high	96	Very high	53 Å²	53	53.4 Å²	53.4	23%	0.232	31%	0.307	C	S	.	.			trans	-124.9	139.8	-179.2	52.5	-97.3	0	0	0	110.6	H109 R116 G117 E119 D263	H109-F265 HydrophobicContact CB-CB 4.49Å; R116-F265 HydrophobicContact CB-CE1 4.43Å; R116-F265 HydrophobicContact CB-CZ 4.23Å; R116-F265 HydrophobicContact CG-CE1 4.25Å; R116-F265 HydrophobicContact CG-CZ 4.21Å; G117-F265 VanDerWaalsContact CA-CD1 3.5Å; G117-F265 WeakPolarHBondContact O-CD1 3.29Å; E119-F265 HydrophobicContact CB-CB 4.47Å; E119-F265 HydrophobicContact CG-CB 3.74Å; E119-F265 WeakPolarHBondContact OE1-CA 3.49Å; D263-F265 VanDerWaalsContact CA-CE1 3.48Å; D263-F265 HydrophobicContact CB-CE1 3.82Å; D263-F265 HydrophobicContact CB-CZ 4.21Å; D263-F265 PolarHBondContact O-N 2.7Å
266	R	98.4	Very high	96.5	Very high	14 Å²	14	45.2 Å²	45.2	5%	0.053	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-72.2	142.1	172.4	-168.6	-170.5	-169.9	-177.6	3.2	109.5	W28 A35 S41 P42 E119	W28-R266 HydrophobicContact CE3-CG 4.38Å; W28-R266 HydrophobicContact CH2-CB 4.04Å; W28-R266 HydrophobicContact CH2-CG 4.03Å; W28-R266 HydrophobicContact CZ3-CB 4.01Å; W28-R266 HydrophobicContact CZ3-CG 3.59Å; A35-R266 PolarHBondContact O-NH2 3.18Å; S41-R266 WeakPolarHBondContact O-CD 3.3Å; S41-R266 PolarHBondContact O-NH1 2.89Å; P42-R266 WeakPolarHBondContact CG-O 3.46Å; E119-R266 WeakPolarHBondContact OE1-CB 3.08Å; E119-R266 PolarHBondContact OE1-N 2.87Å
267	P	98.3	Very high	97.2	Very high	95 Å²	95	45.9 Å²	45.9	62%	0.617	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-56.3	149.4	169.9	-25.4	34.7	0	0	0	112.4	Q269	P267-Q269 PolarHBondContact O-NE2 3.15Å
268	T	98.7	Very high	97.6	Very high	66 Å²	66	44.6 Å²	44.6	41%	0.405	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-61.4	137.9	173.4	54.7	0	0	0	0	111.6	P42 T121	P42-T268 CarbonylContact O-C 3.56Å; P42-T268 WeakPolarHBondContact O-CA 3.41Å; T121-T268 HydrophobicContact CG2-CG2 4.39Å
269	Q	98.7	Very high	97.9	Very high	49 Å²	49	41.7 Å²	41.7	23%	0.229	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-99.2	160.3	-176.9	-56.5	-61.3	-55.7	0	0	110.9	Q40 P42 P267 L271	Q40-Q269 HydrophobicContact CB-CB 3.9Å; Q40-Q269 HydrophobicContact CB-CG 3.73Å; P42-Q269 WeakPolarHBondContact O-CB 3.36Å; P42-Q269 PolarHBondContact O-N 2.82Å; P267-Q269 PolarHBondContact O-NE2 3.15Å; Q269-L271 PolarHBondContact O-N 3.17Å
270	P	98.4	Very high	98	Very high	91 Å²	91	42.9 Å²	42.9	59%	0.591	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-56.7	137.9	174.6	-24.6	35.1	0	0	0	111.9	S272 R274	P270-S272 PolarHBondContact O-N 2.96Å; P270-R274 PolarHBondContact O-NH2 3.14Å
271	L	98	Very high	97.7	Very high	54 Å²	54	50.6 Å²	50.6	28%	0.283	27%	0.273	S	S	.	.			trans	-66.5	-26	173.4	-175.2	61.3	0	0	0	111.8	I43 Q269 R274 V276	I43-L271 HydrophobicContact CD1-CD1 3.7Å; Q269-L271 PolarHBondContact O-N 3.17Å; L271-R274 HydrophobicContact CD1-CB 4.06Å; L271-R274 HydrophobicContact CG-CB 4.48Å; L271-R274 WeakPolarHBondContact O-CB 3.31Å; L271-R274 PolarHBondContact O-N 2.78Å; L271-R274 PolarHBondContact O-NE 3.38Å; L271-V276 HydrophobicContact CD1-CG2 4.18Å
272	S	97.6	Very high	97.7	Very high	58 Å²	58	52.9 Å²	52.9	41%	0.406	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	-134.7	-173.5	-51.7	0	0	0	0	110	E38 P270	E38-S272 PolarHBondContact O-OG 3.04Å; P270-S272 PolarHBondContact O-N 2.96Å
273	D	97.5	Very high	97.7	Very high	111 Å²	111	55.3 Å²	55.3	59%	0.594	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	6.7	177.8	66.1	-11.2	0	0	0	113.8	Y39	Y39-D273 WeakPolarHBondContact CE1-OD1 3.23Å; Y39-D273 PolarHBondContact OH-OD1 3.07Å
274	R	98.1	Very high	97.7	Very high	27 Å²	27	56.4 Å²	56.4	10%	0.102	30%	0.303	C	S	.	.			trans	-68.1	146	-176.8	-64.8	176.1	-74	179.4	-4.8	112.1	Y39 Q40 E210 P270 L271	Y39-R274 VanDerWaalsContact C-NH1 3.26Å; Y39-R274 HydrophobicContact CD1-CG 3.67Å; Y39-R274 HydrophobicContact CE1-CG 4.13Å; Y39-R274 HydrophobicContact CG-CG 4.44Å; Y39-R274 PolarHBondContact O-NH1 3.07Å; Y39-R274 VanDerWaalsContact O-NH1 3.15Å; Q40-R274 PolarHBondContact O-NH1 3.32Å; Q40-R274 PolarHBondContact O-NH2 3Å; E210-R274 WeakPolarHBondContact O-CD 3.45Å; E210-R274 PolarHBondContact O-NH1 2.96Å; E210-R274 VanDerWaalsContact O-NH1 3.12Å; P270-R274 PolarHBondContact O-NH2 3.14Å; L271-R274 HydrophobicContact CD1-CB 4.06Å; L271-R274 HydrophobicContact CG-CB 4.48Å; L271-R274 WeakPolarHBondContact O-CB 3.31Å; L271-R274 PolarHBondContact O-N 2.78Å; L271-R274 PolarHBondContact O-NE 3.38Å
275	T	97.8	Very high	97.7	Very high	63 Å²	63	59.8 Å²	59.8	39%	0.387	32%	0.321	S	S	.	.			trans	-105.9	125.6	172.8	-63.9	0	0	0	0	110.1	R51 R277	R51-T275 HydrophobicContact CB-CG2 4.31Å; R51-T275 HydrophobicContact CG-CG2 3.97Å; T275-R277 HydrophobicContact CG2-CG 4.42Å
276	V	98.6	Very high	97.6	Very high	13 Å²	13	60.2 Å²	60.2	8%	0.079	33%	0.326	C	S	.	.			trans	-81.2	128.5	166.4	-177.8	0	0	0	0	108.6	I43 L45 A50 R51 W207 L271	I43-V276 HydrophobicContact CD1-CG2 3.82Å; L45-V276 HydrophobicContact CD1-CG1 3.9Å; L45-V276 HydrophobicContact CG-CG1 4.16Å; A50-V276 WeakPolarHBondContact CA-O 3.25Å; A50-V276 HydrophobicContact CB-CG1 4.19Å; R51-V276 PolarHBondContact N-O 2.97Å; W207-V276 HydrophobicContact CB-CG1 3.92Å; W207-V276 HydrophobicContact CG-CG1 4.24Å; L271-V276 HydrophobicContact CD1-CG2 4.18Å
277	R	98.7	Very high	97.6	Very high	72 Å²	72	63.3 Å²	63.3	27%	0.272	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	155	173.7	-57	178	-71.5	151.9	-3.5	110.8	R51 D53 L56 W207 I208 T275	R51-R277 CarbonylContact O-C 3.58Å; R51-R277 WeakPolarHBondContact O-CA 3.43Å; D53-R277 HydrophobicContact CB-CB 4.14Å; D53-R277 HydrophobicContact CB-CG 4.42Å; D53-R277 WeakPolarHBondContact OD2-CD 3.42Å; D53-R277 IonicContact OD2-CZ 3.7Å; D53-R277 IonicContact OD2-NE 3.91Å; D53-R277 IonicContact OD2-NH1 2.73Å; D53-R277 PolarHBondContact OD2-NH1 3.07Å; L56-R277 HydrophobicContact CD1-CB 4.22Å; W207-R277 CarbonylContact C-O 3.36Å; W207-R277 VanDerWaalsContact CA-O 3.24Å; W207-R277 WeakPolarHBondContact CA-O 3.4Å; I208-R277 HydrophobicContact CG2-CB 3.84Å; I208-R277 PolarHBondContact N-O 3.01Å; I208-R277 PolarHBondContact O-N 3.2Å; T275-R277 HydrophobicContact CG2-CG 4.42Å
278	A	98.6	Very high	97.5	Very high	4 Å²	4	61 Å²	61	3%	0.033	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.6	178.2	0	0	0	0	0	110.6	A50 R51 Y52 D53 F280	A50-A278 HydrophobicContact CB-CB 4.23Å; R51-A278 PolarHBondContact O-N 3.15Å; Y52-A278 WeakPolarHBondContact CA-O 3.36Å; Y52-A278 WeakPolarHBondContact CD2-O 3.32Å; D53-A278 PolarHBondContact N-O 2.88Å; A278-F280 HydrophobicContact CB-CD1 4.13Å; A278-F280 HydrophobicContact CB-CE1 3.99Å; A278-F280 HydrophobicContact CB-CZ 4.35Å; A278-F280 PolarHBondContact O-N 3.31Å
279	A	97.7	Very high	97.4	Very high	8 Å²	8	60.6 Å²	60.6	7%	0.066	32%	0.319	C	S	.	.	S	Bend	trans	-86.1	20.2	173.3	0	0	0	0	0	112.8	L56 L57 Y206	L56-A279 HydrophobicContact CB-CB 3.99Å; L56-A279 HydrophobicContact CD1-CB 4.03Å; L57-A279 HydrophobicContact CD2-CB 4.18Å; Y206-A279 HydrophobicContact CD1-CB 3.84Å; Y206-A279 HydrophobicContact CD2-CB 4.22Å; Y206-A279 HydrophobicContact CE1-CB 3.43Å; Y206-A279 VanDerWaalsContact CE1-CB 3.43Å; Y206-A279 HydrophobicContact CE2-CB 3.88Å; Y206-A279 HydrophobicContact CG-CB 4.21Å; Y206-A279 VanDerWaalsContact CZ-CB 3.46Å; Y206-A279 PolarHBondContact O-N 2.65Å
280	F	96.8	Very high	97.3	Very high	29 Å²	29	61.6 Å²	61.6	13%	0.127	33%	0.326	C	S	.	.			trans	-152.9	159.4	-178.5	64.5	-85.4	0	0	0	110.2	Y52 D205 W207 A278	Y52-F280 WeakPolarHBondContact CD2-O 3.47Å; D205-F280 HydrophobicContact CB-CB 4.41Å; D205-F280 HydrophobicContact CB-CD1 3.6Å; D205-F280 HydrophobicContact CB-CE1 3.99Å; D205-F280 HydrophobicContact CB-CG 4Å; W207-F280 HydrophobicContact CD2-CE1 4.26Å; W207-F280 HydrophobicContact CD2-CZ 4.3Å; W207-F280 AromaticContact CE2-CE1 3.89Å; W207-F280 AromaticContact CE2-CZ 3.49Å; W207-F280 VanDerWaalsContact CE2-CZ 3.49Å; W207-F280 HydrophobicContact CG-CE1 4.44Å; W207-F280 HydrophobicContact CH2-CZ 4.45Å; W207-F280 HydrophobicContact CZ2-CE1 4.32Å; W207-F280 AromaticContact CZ2-CZ 3.59Å; W207-F280 HydrophobicContact CZ2-CZ 3.59Å; W207-F280 AromaticContact NE1-CE1 3.78Å; W207-F280 AromaticContact NE1-CZ 3.45Å; A278-F280 HydrophobicContact CB-CD1 4.13Å; A278-F280 HydrophobicContact CB-CE1 3.99Å; A278-F280 HydrophobicContact CB-CZ 4.35Å; A278-F280 PolarHBondContact O-N 3.31Å
281	Q	90.3	Very high	97.2	Very high	209 Å²	209	58.9 Å²	58.9	98%	0.977	30%	0.302	S	S	*	.			trans	-91.8	0	178.3	-68.7	-173.8	-12.7	0	0	112.9	Y52	Y52-Q281 HydrophobicContact CD1-CG 3.63Å; Y52-Q281 HydrophobicContact CD2-CG 3.92Å; Y52-Q281 HydrophobicContact CE1-CG 3.71Å; Y52-Q281 VanDerWaalsContact CE1-NE2 3.25Å; Y52-Q281 HydrophobicContact CE2-CG 3.99Å; Y52-Q281 HydrophobicContact CG-CG 3.72Å

Retrieved 281 of 281 residues in 376.5 ms (Link to these results)

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