A0A146MG53_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A146MG53, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 161 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	35.9	Very low	41.2	Very low	225 Å²	225	149.1 Å²	149.1	100%	1.108	79%	0.794	S	S	*	*				0	82.7	0	-168.6	-179.9	84	0	0	108.7
2	I	39.9	Very low	41.4	Very low	172 Å²	172	143.1 Å²	143.1	88%	0.882	78%	0.781	S	S	*	*			trans	-144	109.9	161.7	-60.9	-177	0	0	0	103.9
3	I	43.9	Very low	42	Very low	159 Å²	159	141.5 Å²	141.5	82%	0.815	77%	0.769	S	S	*	*			trans	-87.4	125.2	-171.4	-58.4	169.5	0	0	0	107.3
4	S	41	Very low	42.4	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	76%	0.755	S	S	*	*			trans	-64	132	174.7	166	0	0	0	0	111.8
5	L	39.8	Very low	42.8	Very low	131 Å²	131	141.5 Å²	141.5	69%	0.686	76%	0.76	S	S	*	*			trans	26.3	136.8	153.4	-79.1	93.3	0	0	0	120.4	I7	L5-I7 HydrophobicContact CD2-CG1 3.97Å
6	P	45.7	Very low	42.8	Very low	115 Å²	115	141.9 Å²	141.9	75%	0.747	76%	0.762	S	S	*	*				-132.9	112.3	103.4	32.6	-19.7	0	0	0	110.6	L8	P6-L8 PolarHBondContact O-N 3.39Å
7	I	45.9	Very low	42.9	Very low	124 Å²	124	139.2 Å²	139.2	64%	0.636	76%	0.757	S	S	*	*				46.5	69.3	104.4	-49.1	170.7	0	0	0	111.2	L5 F9	L5-I7 HydrophobicContact CD2-CG1 3.97Å; I7-F9 HydrophobicContact CG2-CB 4.05Å; I7-F9 PolarHBondContact O-N 3.23Å
8	L	40.3	Very low	43.2	Very low	179 Å²	179	137.1 Å²	137.1	94%	0.937	75%	0.752	S	S	*	*			trans	-92	55.2	157.8	-141	99.7	0	0	0	108	P6	P6-L8 PolarHBondContact O-N 3.39Å
9	F	37.3	Very low	43.5	Very low	165 Å²	165	137.2 Å²	137.2	72%	0.724	75%	0.751	S	S	*	*			trans	-99.8	128.8	175.7	-92.7	-77	0	0	0	108.8	I7	I7-F9 HydrophobicContact CG2-CB 4.05Å; I7-F9 PolarHBondContact O-N 3.23Å
10	I	40	Very low	44	Very low	144 Å²	144	133.6 Å²	133.6	74%	0.738	74%	0.736	S	S	*	*			trans	85.5	72.3	156.8	-43.7	142.8	0	0	0	115.3
11	V	43.2	Very low	44.5	Very low	129 Å²	129	135.1 Å²	135.1	78%	0.782	74%	0.736	S	S	*	*				-136.3	35.3	123.4	-159.8	0	0	0	0	109.5	I13	V11-I13 HydrophobicContact CG1-CD1 3.99Å; V11-I13 HydrophobicContact CG1-CG1 3.77Å; V11-I13 PolarHBondContact O-N 2.76Å
12	A	43.7	Very low	45.8	Very low	77 Å²	77	126 Å²	126	64%	0.636	70%	0.7	S	S	*	*			trans	-81	83.7	150.8	0	0	0	0	0	104.3	T14	A12-T14 HydrophobicContact CB-CG2 4.48Å; A12-T14 PolarHBondContact O-N 3.17Å
13	I	48.9	Very low	47.4	Very low	123 Å²	123	121.9 Å²	121.9	63%	0.631	68%	0.677	S	S	*	*			trans	-65.6	84.2	162.8	-40.2	166.6	0	0	0	102.9	V11 F15	V11-I13 HydrophobicContact CG1-CD1 3.99Å; V11-I13 HydrophobicContact CG1-CG1 3.77Å; V11-I13 PolarHBondContact O-N 2.76Å; I13-F15 VanDerWaalsContact C-N 3.28Å; I13-F15 WeakPolarHBondContact O-CD2 3.4Å; I13-F15 PolarHBondContact O-N 2.79Å
14	T	48.1	Very low	49	Very low	93 Å²	93	117.7 Å²	117.7	57%	0.571	66%	0.659	S	S	*	*			trans	-57.2	101.4	171.6	48.6	0	0	0	0	104.7	A12 D16	A12-T14 HydrophobicContact CB-CG2 4.48Å; A12-T14 PolarHBondContact O-N 3.17Å; T14-D16 PolarHBondContact O-N 2.86Å
15	F	48.7	Very low	50.7	Low	189 Å²	189	117.6 Å²	117.6	83%	0.829	65%	0.646	S	S	*	*			trans	-66.8	35.6	167.8	-83.1	-88.4	0	0	0	110.6	I13 S17	I13-F15 VanDerWaalsContact C-N 3.28Å; I13-F15 WeakPolarHBondContact O-CD2 3.4Å; I13-F15 PolarHBondContact O-N 2.79Å; F15-S17 VanDerWaalsContact C-N 3.27Å; F15-S17 PolarHBondContact O-N 3.38Å
16	D	41.8	Very low	52.2	Low	149 Å²	149	118.4 Å²	118.4	80%	0.797	65%	0.646	S	S	*	*			trans	-90.2	20.6	-176.9	-79	-33.8	0	0	0	112.9	T14	T14-D16 PolarHBondContact O-N 2.86Å
17	S	44.8	Very low	53	Low	96 Å²	96	114.2 Å²	114.2	67%	0.671	62%	0.617	S	S	*	*	S	Bend	trans	-138.1	101.5	166	39.2	0	0	0	0	106.3	F15	F15-S17 VanDerWaalsContact C-N 3.27Å; F15-S17 PolarHBondContact O-N 3.38Å
18	C	48.5	Very low	53.6	Low	100 Å²	100	112.7 Å²	112.7	68%	0.676	61%	0.613	S	S	*	*	S	Bend		-170.2	17.4	84.1	-82	0	0	0	0	113.8	S20	C18-S20 VanDerWaalsContact C-N 3.32Å; C18-S20 PolarHBondContact O-N 2.92Å; C18-S20 VanDerWaalsContact O-N 3.15Å
19	L	49.2	Very low	54.3	Low	140 Å²	140	108.4 Å²	108.4	73%	0.733	59%	0.592	S	S	*	*			trans	-89.1	67.7	176.4	-69.4	169.4	0	0	0	110.6	F21 I69	L19-F21 PolarHBondContact O-N 3.15Å; L19-I69 HydrophobicContact CD2-CD1 4.26Å
20	S	52.7	Low	54.8	Low	64 Å²	64	107.6 Å²	107.6	45%	0.448	60%	0.595	S	S	.	*			trans	-69.8	117.2	169.6	55.8	0	0	0	0	109.1	C18 G22 Q23	C18-S20 VanDerWaalsContact C-N 3.32Å; C18-S20 PolarHBondContact O-N 2.92Å; C18-S20 VanDerWaalsContact O-N 3.15Å; S20-G22 PolarHBondContact O-N 3.45Å; S20-Q23 PolarHBondContact O-N 2.9Å; S20-Q23 WeakPolarHBondContact OG-CG 3.21Å; S20-Q23 PolarHBondContact OG-NE2 3.24Å
21	F	56.2	Low	55.2	Low	167 Å²	167	106.6 Å²	106.6	73%	0.732	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.5	131.9	168.7	-71.8	-86.6	0	0	0	110.2	L19 I69	L19-F21 PolarHBondContact O-N 3.15Å; F21-I69 HydrophobicContact CD1-CG2 4.32Å; F21-I69 HydrophobicContact CE1-CG2 4.41Å
22	G	61.9	Low	55.6	Low	34 Å²	34	103 Å²	103	35%	0.351	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	99.9	-9.4	179.6	0	0	0	0	0	116	S20 V24 Q68 I69	S20-G22 PolarHBondContact O-N 3.45Å; G22-V24 PolarHBondContact O-N 3.36Å; G22-Q68 PolarHBondContact O-NE2 3.45Å; G22-I69 PolarHBondContact N-O 3.29Å
23	Q	73.8	Confident	55.9	Low	84 Å²	84	107.3 Å²	107.3	39%	0.393	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-62.9	130.8	171.2	-78.9	-178.9	-5	0	0	111.1	S20 F25	S20-Q23 PolarHBondContact O-N 2.9Å; S20-Q23 WeakPolarHBondContact OG-CG 3.21Å; S20-Q23 PolarHBondContact OG-NE2 3.24Å; Q23-F25 HydrophobicContact CB-CE2 3.82Å; Q23-F25 HydrophobicContact CB-CZ 3.85Å
24	V	78.1	Confident	56.1	Low	72 Å²	72	108.4 Å²	108.4	44%	0.436	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.9	119.5	175.5	-179.3	0	0	0	0	108.2	G22 T66 I67 Q68	G22-V24 PolarHBondContact O-N 3.36Å; V24-T66 HydrophobicContact CG1-CG2 4.04Å; V24-I67 CarbonylContact C-O 3.59Å; V24-I67 WeakPolarHBondContact CA-O 3.31Å; V24-Q68 HydrophobicContact CG2-CB 4.15Å; V24-Q68 HydrophobicContact CG2-CG 3.79Å
25	F	76.4	Confident	56.9	Low	94 Å²	94	105 Å²	105	41%	0.412	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	128.3	177.3	-59.1	-86.7	0	0	0	109.3	Q23 T66 I67	Q23-F25 HydrophobicContact CB-CE2 3.82Å; Q23-F25 HydrophobicContact CB-CZ 3.85Å; F25-T66 CarbonylContact O-C 3.49Å; F25-T66 WeakPolarHBondContact O-CA 3.42Å; F25-I67 PolarHBondContact N-O 2.91Å; F25-I67 PolarHBondContact O-N 3.2Å
26	H	70.2	Confident	58.1	Low	149 Å²	149	100 Å²	100	69%	0.69	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	125.4	171.5	-74.3	-88	0	0	0	109.8	T66	H26-T66 WeakPolarHBondContact ND1-CG2 3.49Å
27	I	64	Low	60.1	Low	27 Å²	27	97.1 Å²	97.1	14%	0.138	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.7	172.4	-46.3	-175.9	0	0	0	108	Q31 M65 I67	I27-Q31 HydrophobicContact CG2-CB 3.52Å; I27-M65 HydrophobicContact CB-CB 4.19Å; I27-M65 HydrophobicContact CB-CG 4.17Å; I27-M65 HydrophobicContact CB-SD 4.27Å; I27-M65 HydrophobicContact CD1-CG 3.78Å; I27-M65 HydrophobicContact CD1-SD 3.52Å; I27-M65 VanDerWaalsContact CD1-SD 3.52Å; I27-M65 HydrophobicContact CG1-CG 4.16Å; I27-M65 HydrophobicContact CG1-SD 4.35Å; I27-M65 PolarHBondContact N-O 3.38Å; I27-I67 HydrophobicContact CD1-CD1 3.28Å; I27-I67 HydrophobicContact CD1-CG1 3.55Å; I27-I67 HydrophobicContact CG1-CD1 4.05Å; I27-I67 HydrophobicContact CG1-CG1 4.09Å
28	T	58.3	Low	62	Low	91 Å²	91	96.1 Å²	96.1	56%	0.558	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-74.4	152.2	170.9	51.5	0	0	0	0	110.3	D30 Q31	T28-D30 PolarHBondContact O-N 3.41Å; T28-Q31 PolarHBondContact O-N 3.04Å
29	N	53.6	Low	63.9	Low	90 Å²	90	91.9 Å²	91.9	48%	0.481	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-51.7	-25.8	-174.5	-92.1	-5.8	0	0	0	115.1	Q31 N32 I62	N29-Q31 VanDerWaalsContact C-N 3.29Å; N29-Q31 PolarHBondContact O-N 3.4Å; N29-N32 PolarHBondContact O-ND2 2.82Å; N29-I62 PolarHBondContact OD1-O 3.08Å
30	D	49.7	Very low	65.9	Low	148 Å²	148	85.6 Å²	85.6	79%	0.791	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-72.7	-16.4	178.2	-67.3	-30.3	0	0	0	114.2	T28	T28-D30 PolarHBondContact O-N 3.41Å
31	Q	48.4	Very low	67.8	Low	123 Å²	123	86.7 Å²	86.7	58%	0.575	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-104.1	13.9	-178.3	-68	-161.2	-14.6	0	0	114.2	I27 T28 N29 L33	I27-Q31 HydrophobicContact CG2-CB 3.52Å; T28-Q31 PolarHBondContact O-N 3.04Å; N29-Q31 VanDerWaalsContact C-N 3.29Å; N29-Q31 PolarHBondContact O-N 3.4Å; Q31-L33 PolarHBondContact O-N 2.85Å
32	N	51	Low	69.5	Low	54 Å²	54	83.3 Å²	83.3	29%	0.289	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-58.5	-9	176.1	-79.8	-41.8	0	0	0	114.4	N29 I34 F35	N29-N32 PolarHBondContact O-ND2 2.82Å; N32-I34 PolarHBondContact O-N 2.83Å; N32-F35 PolarHBondContact O-N 2.89Å; N32-F35 VanDerWaalsContact O-N 3.17Å
33	L	49.7	Very low	71.1	Confident	166 Å²	166	81.7 Å²	81.7	87%	0.869	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-58.2	-24.5	-178.9	-93.7	148.6	0	0	0	114.8	Q31	Q31-L33 PolarHBondContact O-N 2.85Å
34	I	53.3	Low	72.1	Confident	147 Å²	147	78.2 Å²	78.2	75%	0.754	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-87.7	-15.7	-178	-59.2	174.6	0	0	0	111.9	N32	N32-I34 PolarHBondContact O-N 2.83Å
35	F	64.3	Low	72.9	Confident	20 Å²	20	77.2 Å²	77.2	9%	0.088	40%	0.398	C	S	.	.	S	Bend	trans	-87.4	127	-173.3	-161.1	-104	0	0	0	112.2	N32 E37 I39 I40 M65 F75 Y77	N32-F35 PolarHBondContact O-N 2.89Å; N32-F35 VanDerWaalsContact O-N 3.17Å; F35-E37 PolarHBondContact O-N 2.89Å; F35-I39 HydrophobicContact CE1-CB 4.4Å; F35-I39 HydrophobicContact CE1-CG2 4.33Å; F35-I39 HydrophobicContact CZ-CB 4.3Å; F35-I39 HydrophobicContact CZ-CG2 3.91Å; F35-I40 HydrophobicContact CD1-CD1 3.65Å; F35-I40 HydrophobicContact CD1-CG1 3.51Å; F35-I40 HydrophobicContact CE1-CD1 4.11Å; F35-I40 HydrophobicContact CE1-CG1 3.43Å; F35-I40 VanDerWaalsContact CE1-CG1 3.43Å; F35-M65 HydrophobicContact CB-CE 3.91Å; F35-M65 HydrophobicContact CB-SD 4.11Å; F35-M65 HydrophobicContact CD1-CE 3.84Å; F35-M65 HydrophobicContact CD2-CE 4.23Å; F35-M65 HydrophobicContact CD2-SD 4.29Å; F35-M65 HydrophobicContact CE1-CE 4.44Å; F35-M65 HydrophobicContact CG-CE 3.71Å; F35-M65 HydrophobicContact CG-SD 4.17Å; F35-F75 AromaticContact CD2-CD1 3.68Å; F35-F75 HydrophobicContact CD2-CD1 3.68Å; F35-F75 HydrophobicContact CD2-CE1 4.07Å; F35-F75 HydrophobicContact CD2-CG 4.24Å; F35-F75 HydrophobicContact CE2-CB 3.75Å; F35-F75 AromaticContact CE2-CD1 3.6Å; F35-F75 HydrophobicContact CE2-CD1 3.6Å; F35-F75 HydrophobicContact CE2-CD2 4.4Å; F35-F75 HydrophobicContact CE2-CE1 4.29Å; F35-F75 AromaticContact CE2-CG 3.67Å; F35-F75 HydrophobicContact CE2-CG 3.67Å; F35-F75 HydrophobicContact CZ-CB 4.49Å; F35-Y77 HydrophobicContact CE1-CD1 4.25Å; F35-Y77 AromaticContact CE1-CE1 3.72Å; F35-Y77 HydrophobicContact CE1-CE1 3.72Å; F35-Y77 AromaticContact CE1-CZ 3.97Å; F35-Y77 HydrophobicContact CE2-CE1 4.38Å; F35-Y77 AromaticContact CZ-CD1 3.92Å; F35-Y77 HydrophobicContact CZ-CD1 3.92Å; F35-Y77 AromaticContact CZ-CE1 3.39Å; F35-Y77 HydrophobicContact CZ-CE1 3.39Å
36	N	73.3	Confident	73.8	Confident	85 Å²	85	75.9 Å²	75.9	46%	0.455	40%	0.395	S	S	.	.			trans	-69.9	112.6	-172.9	-175.3	-8.3	0	0	0	111.5	T38 I39 I40	N36-T38 PolarHBondContact O-N 2.89Å; N36-T38 WeakPolarHBondContact OD1-CA 3.42Å; N36-T38 WeakPolarHBondContact OD1-CB 3.14Å; N36-T38 PolarHBondContact OD1-N 3.16Å; N36-T38 PolarHBondContact OD1-OG1 3.26Å; N36-I39 HydrophobicContact CB-CG1 4.05Å; N36-I39 WeakPolarHBondContact O-CB 3.19Å; N36-I39 PolarHBondContact O-N 2.91Å; N36-I40 PolarHBondContact O-N 3.42Å
37	E	84	Confident	75.1	Confident	88 Å²	88	68.8 Å²	68.8	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-50.3	-29.9	173.1	-84.2	-68	166.5	0	0	113	F35 I39 I40 N41 R59	F35-E37 PolarHBondContact O-N 2.89Å; E37-I39 PolarHBondContact O-N 2.93Å; E37-I40 PolarHBondContact O-N 3.17Å; E37-N41 WeakPolarHBondContact O-CB 3.33Å; E37-N41 VanDerWaalsContact O-CG 3.23Å; E37-N41 PolarHBondContact O-N 2.9Å; E37-N41 PolarHBondContact O-ND2 2.82Å; E37-N41 VanDerWaalsContact O-ND2 3.1Å; E37-R59 IonicContact OE1-CZ 3.48Å; E37-R59 IonicContact OE1-NH1 2.74Å; E37-R59 PolarHBondContact OE1-NH1 2.9Å; E37-R59 IonicContact OE1-NH2 3.25Å; E37-R59 PolarHBondContact OE1-NH2 3.25Å; E37-R59 IonicContact OE2-CZ 3.56Å; E37-R59 IonicContact OE2-NH1 2.73Å; E37-R59 PolarHBondContact OE2-NH1 3.04Å; E37-R59 IonicContact OE2-NH2 3.6Å
38	T	86.2	Confident	76.6	Confident	75 Å²	75	67.5 Å²	67.5	46%	0.46	36%	0.356	S	S	.	.	H	α-helix	trans	-60.1	-44.4	174.5	-50.1	0	0	0	0	111.8	N36 I40 N41 Q42	N36-T38 PolarHBondContact O-N 2.89Å; N36-T38 WeakPolarHBondContact OD1-CA 3.42Å; N36-T38 WeakPolarHBondContact OD1-CB 3.14Å; N36-T38 PolarHBondContact OD1-N 3.16Å; N36-T38 PolarHBondContact OD1-OG1 3.26Å; T38-I40 VanDerWaalsContact C-N 3.34Å; T38-N41 PolarHBondContact O-N 2.92Å; T38-Q42 WeakPolarHBondContact O-CB 3.33Å; T38-Q42 VanDerWaalsContact O-CG 3.22Å; T38-Q42 WeakPolarHBondContact O-CG 3.29Å; T38-Q42 PolarHBondContact O-N 2.8Å
39	I	87.8	Confident	78.4	Confident	12 Å²	12	70.4 Å²	70.4	6%	0.062	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-38.6	179.8	-59.5	-54.2	0	0	0	110.3	F35 N36 E37 Q42 S43 F115 L127	F35-I39 HydrophobicContact CE1-CB 4.4Å; F35-I39 HydrophobicContact CE1-CG2 4.33Å; F35-I39 HydrophobicContact CZ-CB 4.3Å; F35-I39 HydrophobicContact CZ-CG2 3.91Å; N36-I39 HydrophobicContact CB-CG1 4.05Å; N36-I39 WeakPolarHBondContact O-CB 3.19Å; N36-I39 PolarHBondContact O-N 2.91Å; E37-I39 PolarHBondContact O-N 2.93Å; I39-Q42 PolarHBondContact O-N 2.89Å; I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 2.78Å; I39-F115 HydrophobicContact CD1-CD2 4.44Å; I39-F115 HydrophobicContact CD1-CE1 4.02Å; I39-F115 HydrophobicContact CD1-CE2 3.65Å; I39-F115 HydrophobicContact CD1-CZ 3.4Å; I39-F115 HydrophobicContact CG1-CD1 4.39Å; I39-F115 HydrophobicContact CG1-CE1 3.86Å; I39-F115 HydrophobicContact CG1-CE2 4.28Å; I39-F115 HydrophobicContact CG1-CZ 3.79Å; I39-F115 HydrophobicContact CG2-CB 4.19Å; I39-F115 HydrophobicContact CG2-CD1 3.95Å; I39-F115 HydrophobicContact CG2-CD2 3.87Å; I39-F115 HydrophobicContact CG2-CE1 4.23Å; I39-F115 HydrophobicContact CG2-CE2 4.18Å; I39-F115 HydrophobicContact CG2-CG 3.74Å; I39-F115 HydrophobicContact CG2-CZ 4.34Å; I39-L127 HydrophobicContact CG2-CD1 4.21Å
40	I	91	Very high	80.3	Confident	7 Å²	7	70.9 Å²	70.9	4%	0.036	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-51.4	173.3	-61.8	170.6	0	0	0	110	F35 N36 E37 T38 Q42 S43 V44 I62 L79	F35-I40 HydrophobicContact CD1-CD1 3.65Å; F35-I40 HydrophobicContact CD1-CG1 3.51Å; F35-I40 HydrophobicContact CE1-CD1 4.11Å; F35-I40 HydrophobicContact CE1-CG1 3.43Å; F35-I40 VanDerWaalsContact CE1-CG1 3.43Å; N36-I40 PolarHBondContact O-N 3.42Å; E37-I40 PolarHBondContact O-N 3.17Å; T38-I40 VanDerWaalsContact C-N 3.34Å; I40-Q42 VanDerWaalsContact C-N 3.3Å; I40-Q42 PolarHBondContact O-N 3.17Å; I40-S43 WeakPolarHBondContact O-CA 3.39Å; I40-S43 WeakPolarHBondContact O-CB 3.25Å; I40-S43 PolarHBondContact O-N 2.78Å; I40-S43 PolarHBondContact O-OG 3.19Å; I40-V44 HydrophobicContact CG2-CG2 4.49Å; I40-V44 WeakPolarHBondContact O-CG2 3.05Å; I40-V44 PolarHBondContact O-N 2.88Å; I40-I62 HydrophobicContact CB-CD1 4.37Å; I40-I62 HydrophobicContact CD1-CD1 3.31Å; I40-I62 HydrophobicContact CG1-CD1 3.66Å; I40-I62 HydrophobicContact CG2-CD1 3.78Å; I40-L79 HydrophobicContact CG2-CD1 4.47Å
41	N	92	Very high	82.4	Confident	88 Å²	88	65 Å²	65	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-64.5	-35.8	-178.3	-69.7	-32.1	0	0	0	112.4	E37 T38 S43 V44 T45	E37-N41 WeakPolarHBondContact O-CB 3.33Å; E37-N41 VanDerWaalsContact O-CG 3.23Å; E37-N41 PolarHBondContact O-N 2.9Å; E37-N41 PolarHBondContact O-ND2 2.82Å; E37-N41 VanDerWaalsContact O-ND2 3.1Å; T38-N41 PolarHBondContact O-N 2.92Å; N41-S43 VanDerWaalsContact C-N 3.34Å; N41-V44 PolarHBondContact O-N 2.85Å; N41-T45 WeakPolarHBondContact O-CB 3.28Å; N41-T45 PolarHBondContact O-N 2.93Å; N41-T45 PolarHBondContact O-OG1 3.23Å
42	Q	92.9	Very high	84.5	Confident	96 Å²	96	67.4 Å²	67.4	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-63.3	-40.8	170.8	-75.2	174.3	-7.4	0	0	111.5	T38 I39 I40 T45 L46 L127	T38-Q42 WeakPolarHBondContact O-CB 3.33Å; T38-Q42 VanDerWaalsContact O-CG 3.22Å; T38-Q42 WeakPolarHBondContact O-CG 3.29Å; T38-Q42 PolarHBondContact O-N 2.8Å; I39-Q42 PolarHBondContact O-N 2.89Å; I40-Q42 VanDerWaalsContact C-N 3.3Å; I40-Q42 PolarHBondContact O-N 3.17Å; Q42-T45 PolarHBondContact O-N 2.77Å; Q42-L46 WeakPolarHBondContact O-CB 3.47Å; Q42-L46 PolarHBondContact O-N 2.97Å; Q42-L127 HydrophobicContact CB-CD2 3.9Å
43	S	94.8	Very high	86.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.8	-42.5	176.6	79.6	0	0	0	0	112.2	I39 I40 N41 T45 L46 V47 Y77	I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 2.78Å; I40-S43 WeakPolarHBondContact O-CA 3.39Å; I40-S43 WeakPolarHBondContact O-CB 3.25Å; I40-S43 PolarHBondContact O-N 2.78Å; I40-S43 PolarHBondContact O-OG 3.19Å; N41-S43 VanDerWaalsContact C-N 3.34Å; S43-T45 VanDerWaalsContact C-N 3.3Å; S43-T45 PolarHBondContact O-N 2.86Å; S43-L46 PolarHBondContact O-N 3.4Å; S43-V47 WeakPolarHBondContact O-CB 3.45Å; S43-V47 VanDerWaalsContact O-CG2 3.26Å; S43-V47 WeakPolarHBondContact O-CG2 3.39Å; S43-V47 PolarHBondContact O-N 2.85Å; S43-Y77 VanDerWaalsContact CB-OH 3.26Å; S43-Y77 WeakPolarHBondContact CB-OH 3.38Å; S43-Y77 PolarHBondContact OG-OH 3.45Å; S43-Y77 VanDerWaalsContact OG-OH 3.1Å
44	V	95.5	Very high	88.6	Confident	10 Å²	10	64.1 Å²	64.1	6%	0.061	33%	0.331	C	S	.	.	H	α-helix	trans	-58.5	-46.3	173.6	174.1	0	0	0	0	110	I40 N41 V47 N48 W56 R59 L79 L81	I40-V44 HydrophobicContact CG2-CG2 4.49Å; I40-V44 WeakPolarHBondContact O-CG2 3.05Å; I40-V44 PolarHBondContact O-N 2.88Å; N41-V44 PolarHBondContact O-N 2.85Å; V44-V47 PolarHBondContact O-N 2.88Å; V44-N48 WeakPolarHBondContact O-CB 3.39Å; V44-N48 PolarHBondContact O-N 3Å; V44-N48 PolarHBondContact O-ND2 2.78Å; V44-W56 HydrophobicContact CG1-CZ2 4.42Å; V44-R59 HydrophobicContact CG2-CB 4Å; V44-L79 HydrophobicContact CG2-CD1 4.37Å; V44-L79 HydrophobicContact CG2-CD2 4.06Å; V44-L81 HydrophobicContact CG1-CD2 4.31Å; V44-L81 HydrophobicContact CG2-CD2 4.18Å
45	T	94.6	Very high	90.6	Very high	52 Å²	52	61.8 Å²	61.8	32%	0.319	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-45.1	178.9	-60	0	0	0	0	111.8	N41 Q42 S43 N48 K49 W56	N41-T45 WeakPolarHBondContact O-CB 3.28Å; N41-T45 PolarHBondContact O-N 2.93Å; N41-T45 PolarHBondContact O-OG1 3.23Å; Q42-T45 PolarHBondContact O-N 2.77Å; S43-T45 VanDerWaalsContact C-N 3.3Å; S43-T45 PolarHBondContact O-N 2.86Å; T45-N48 PolarHBondContact O-N 2.8Å; T45-K49 HydrophobicContact CG2-CD 4.45Å; T45-K49 WeakPolarHBondContact O-CG 3.49Å; T45-K49 PolarHBondContact O-N 3.38Å; T45-W56 HydrophobicContact CG2-CH2 4.37Å
46	L	95.4	Very high	92.1	Very high	66 Å²	66	62.1 Å²	62.1	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-44.3	-179.8	-174	63.5	0	0	0	111.4	Q42 S43 N48 K49 M50 L127 I129	Q42-L46 WeakPolarHBondContact O-CB 3.47Å; Q42-L46 PolarHBondContact O-N 2.97Å; S43-L46 PolarHBondContact O-N 3.4Å; L46-N48 VanDerWaalsContact C-N 3.34Å; L46-N48 PolarHBondContact O-N 2.94Å; L46-K49 PolarHBondContact O-N 3.43Å; L46-M50 PolarHBondContact O-N 2.77Å; L46-L127 HydrophobicContact CD2-CD2 4.18Å; L46-L127 HydrophobicContact CD2-CG 4.13Å; L46-I129 HydrophobicContact CB-CD1 4.28Å; L46-I129 HydrophobicContact CD2-CD1 4.03Å; L46-I129 HydrophobicContact CD2-CG1 4.09Å; L46-I129 HydrophobicContact CG-CD1 3.72Å; L46-I129 HydrophobicContact CG-CG1 4.34Å
47	V	97.3	Very high	93.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-46	175.8	170.8	0	0	0	0	110.3	S43 V44 K49 M50 L51 L79 L81 C111 I113 I129	S43-V47 WeakPolarHBondContact O-CB 3.45Å; S43-V47 VanDerWaalsContact O-CG2 3.26Å; S43-V47 WeakPolarHBondContact O-CG2 3.39Å; S43-V47 PolarHBondContact O-N 2.85Å; V44-V47 PolarHBondContact O-N 2.88Å; V47-K49 VanDerWaalsContact C-N 3.3Å; V47-K49 PolarHBondContact O-N 3.29Å; V47-M50 PolarHBondContact O-N 3.4Å; V47-M50 VanDerWaalsContact O-N 3.1Å; V47-L51 HydrophobicContact CG1-CD1 3.6Å; V47-L51 HydrophobicContact CG1-CG 3.9Å; V47-L51 VanDerWaalsContact O-CG 3.31Å; V47-L51 WeakPolarHBondContact O-CG 3.31Å; V47-L51 PolarHBondContact O-N 2.89Å; V47-L79 HydrophobicContact CG2-CD2 4.43Å; V47-L81 HydrophobicContact CB-CD1 4.17Å; V47-L81 HydrophobicContact CG1-CD1 3.44Å; V47-L81 VanDerWaalsContact CG1-CD1 3.44Å; V47-C111 VanDerWaalsContact CG1-SG 3.58Å; V47-C111 HydrophobicContact CG2-CB 4.22Å; V47-I113 HydrophobicContact CG2-CD1 3.83Å; V47-I129 HydrophobicContact CB-CD1 4.19Å; V47-I129 HydrophobicContact CG2-CD1 3.53Å; V47-I129 HydrophobicContact CG2-CG1 3.89Å
48	N	96.4	Very high	93.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-40.3	176.1	-87.2	-77.8	0	0	0	112	V44 T45 L46 M50 W56 Y57 K88	V44-N48 WeakPolarHBondContact O-CB 3.39Å; V44-N48 PolarHBondContact O-N 3Å; V44-N48 PolarHBondContact O-ND2 2.78Å; T45-N48 PolarHBondContact O-N 2.8Å; L46-N48 VanDerWaalsContact C-N 3.34Å; L46-N48 PolarHBondContact O-N 2.94Å; N48-M50 VanDerWaalsContact C-N 3.31Å; N48-M50 PolarHBondContact O-N 2.98Å; N48-W56 HydrophobicContact CB-CD2 4.25Å; N48-W56 HydrophobicContact CB-CE3 3.71Å; N48-W56 HydrophobicContact CB-CH2 3.79Å; N48-W56 HydrophobicContact CB-CZ2 4.31Å; N48-W56 HydrophobicContact CB-CZ3 3.46Å; N48-W56 VanDerWaalsContact CB-CZ3 3.46Å; N48-W56 WeakPolarHBondContact OD1-CA 3.5Å; N48-Y57 PolarHBondContact ND2-O 3.1Å; N48-Y57 PolarHBondContact OD1-N 2.87Å; N48-K88 WeakPolarHBondContact O-CE 3.32Å; N48-K88 PolarHBondContact O-NZ 3.01Å
49	K	94.6	Very high	93.9	Very high	152 Å²	152	57.6 Å²	57.6	66%	0.661	28%	0.281	S	S	*	.	H	α-helix	trans	-62.6	-39.3	175.2	-72	173.2	-179.8	-179.6	0	112.3	T45 L46 V47	T45-K49 HydrophobicContact CG2-CD 4.45Å; T45-K49 WeakPolarHBondContact O-CG 3.49Å; T45-K49 PolarHBondContact O-N 3.38Å; L46-K49 PolarHBondContact O-N 3.43Å; V47-K49 VanDerWaalsContact C-N 3.3Å; V47-K49 PolarHBondContact O-N 3.29Å
50	M	94.7	Very high	94.1	Very high	99 Å²	99	59.7 Å²	59.7	49%	0.488	30%	0.295	S	S	.	.	H	α-helix	trans	-75.5	-38.8	-176.4	-172	-167.5	71.5	0	0	113.8	L46 V47 N48 N52 I129 C132	L46-M50 PolarHBondContact O-N 2.77Å; V47-M50 PolarHBondContact O-N 3.4Å; V47-M50 VanDerWaalsContact O-N 3.1Å; N48-M50 VanDerWaalsContact C-N 3.31Å; N48-M50 PolarHBondContact O-N 2.98Å; M50-N52 PolarHBondContact O-N 2.92Å; M50-I129 HydrophobicContact CB-CD1 4.27Å; M50-I129 HydrophobicContact CE-CD1 4.07Å; M50-I129 HydrophobicContact CE-CG2 3.81Å; M50-I129 HydrophobicContact SD-CB 4.2Å; M50-I129 HydrophobicContact SD-CD1 3.78Å; M50-I129 HydrophobicContact SD-CG2 4.08Å; M50-C132 HydrophobicContact CE-CB 4.16Å; M50-C132 VanDerWaalsContact CE-SG 3.53Å
51	L	94.1	Very high	94.1	Very high	25 Å²	25	62.9 Å²	62.9	13%	0.131	31%	0.312	C	S	.	.	S	Bend	trans	-64.2	134.7	-175.6	-73.1	171	0	0	0	111.5	V47 S53 Y57 K88 Q109 C132	V47-L51 HydrophobicContact CG1-CD1 3.6Å; V47-L51 HydrophobicContact CG1-CG 3.9Å; V47-L51 VanDerWaalsContact O-CG 3.31Å; V47-L51 WeakPolarHBondContact O-CG 3.31Å; V47-L51 PolarHBondContact O-N 2.89Å; L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.1Å; L51-Y57 HydrophobicContact CD1-CD2 4.12Å; L51-Y57 HydrophobicContact CD1-CE2 4.36Å; L51-Y57 HydrophobicContact CD1-CG 4.47Å; L51-K88 PolarHBondContact O-NZ 3.19Å; L51-Q109 HydrophobicContact CD1-CB 4.48Å; L51-Q109 HydrophobicContact CD1-CG 3.82Å; L51-Q109 HydrophobicContact CD2-CG 4.17Å; L51-C132 HydrophobicContact CD2-CB 4.47Å
52	N	92.3	Very high	94	Very high	174 Å²	174	59.3 Å²	59.3	93%	0.93	29%	0.292	S	S	*	.	S	Bend	trans	-79.5	75.6	172.7	-169.6	17.8	0	0	0	111.4	M50	M50-N52 PolarHBondContact O-N 2.92Å
53	S	92.9	Very high	93.9	Very high	20 Å²	20	56 Å²	56	14%	0.14	28%	0.279	C	S	.	.			trans	-145.8	148.2	178.3	-167.3	0	0	0	0	110.4	L51 Y55 K88	L51-S53 VanDerWaalsContact C-N 3.29Å; L51-S53 PolarHBondContact O-N 3.1Å; S53-Y55 VanDerWaalsContact C-N 3.3Å; S53-Y55 PolarHBondContact OG-N 2.74Å; S53-K88 VanDerWaalsContact O-CD 3.23Å; S53-K88 WeakPolarHBondContact O-CD 3.4Å; S53-K88 WeakPolarHBondContact O-CE 3.26Å; S53-K88 PolarHBondContact O-NZ 2.73Å
54	N	94.2	Very high	93.7	Very high	130 Å²	130	61.6 Å²	61.6	70%	0.695	31%	0.309	S	S	*	.	S	Bend	trans	-82.3	-12.4	174.2	-68.5	-17.9	0	0	0	113	T87 K88	N54-T87 CarbonylContact O-C 3.52Å; N54-T87 VanDerWaalsContact O-CA 3.24Å; N54-T87 WeakPolarHBondContact O-CA 3.49Å; N54-T87 WeakPolarHBondContact O-CB 3.41Å; N54-K88 PolarHBondContact O-N 2.88Å
55	Y	94.6	Very high	93.3	Very high	98 Å²	98	61.3 Å²	61.3	38%	0.384	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	152.7	-177	-62.4	-82.4	0	0	0	111.7	S53 R83 C86 K88	S53-Y55 VanDerWaalsContact C-N 3.3Å; S53-Y55 PolarHBondContact OG-N 2.74Å; Y55-R83 VanDerWaalsContact CB-CG 3.46Å; Y55-R83 HydrophobicContact CG-CG 3.95Å; Y55-C86 WeakPolarHBondContact CA-O 3.22Å; Y55-K88 WeakPolarHBondContact O-CG 3.29Å
56	W	95	Very high	93	Very high	27 Å²	27	59.6 Å²	59.6	10%	0.102	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	145.1	168	-167.6	-102.9	0	0	0	110.3	V44 T45 N48 T84 C86 K88 M91	V44-W56 HydrophobicContact CG1-CZ2 4.42Å; T45-W56 HydrophobicContact CG2-CH2 4.37Å; N48-W56 HydrophobicContact CB-CD2 4.25Å; N48-W56 HydrophobicContact CB-CE3 3.71Å; N48-W56 HydrophobicContact CB-CH2 3.79Å; N48-W56 HydrophobicContact CB-CZ2 4.31Å; N48-W56 HydrophobicContact CB-CZ3 3.46Å; N48-W56 VanDerWaalsContact CB-CZ3 3.46Å; N48-W56 WeakPolarHBondContact OD1-CA 3.5Å; W56-T84 PolarHBondContact O-N 3.32Å; W56-T84 PolarHBondContact O-OG1 3.31Å; W56-C86 HydrophobicContact CB-CB 4.28Å; W56-C86 PolarHBondContact N-O 3.31Å; W56-K88 HydrophobicContact CE3-CG 4.31Å; W56-M91 HydrophobicContact CB-CG 3.76Å; W56-M91 HydrophobicContact CD2-CB 3.85Å; W56-M91 HydrophobicContact CD2-CE 4.48Å; W56-M91 HydrophobicContact CD2-CG 3.72Å; W56-M91 HydrophobicContact CE3-CB 3.67Å; W56-M91 HydrophobicContact CE3-CG 4.02Å; W56-M91 HydrophobicContact CG-CB 4.27Å; W56-M91 HydrophobicContact CG-CE 4.44Å; W56-M91 HydrophobicContact CG-CG 3.6Å; W56-M91 HydrophobicContact CZ3-CB 4.09Å
57	Y	95.5	Very high	92.6	Very high	7 Å²	7	58.1 Å²	58.1	3%	0.027	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.5	173.4	-69.1	-106.1	0	0	0	109.3	N48 L51 L81 T82 R83 Q109	N48-Y57 PolarHBondContact ND2-O 3.1Å; N48-Y57 PolarHBondContact OD1-N 2.87Å; L51-Y57 HydrophobicContact CD1-CD2 4.12Å; L51-Y57 HydrophobicContact CD1-CE2 4.36Å; L51-Y57 HydrophobicContact CD1-CG 4.47Å; Y57-L81 HydrophobicContact CD1-CB 4.39Å; Y57-T82 WeakPolarHBondContact CA-O 3.38Å; Y57-R83 HydrophobicContact CD1-CB 3.96Å; Y57-R83 VanDerWaalsContact CD1-N 3.32Å; Y57-R83 HydrophobicContact CE1-CB 3.61Å; Y57-R83 HydrophobicContact CE1-CG 4.16Å; Y57-R83 HydrophobicContact CE2-CG 4.27Å; Y57-R83 PolarHBondContact OH-NE 3.23Å; Y57-R83 VanDerWaalsContact OH-NE 3.14Å; Y57-R83 PolarHBondContact OH-NH2 3.45Å; Y57-Q109 HydrophobicContact CD1-CG 4.12Å; Y57-Q109 HydrophobicContact CE1-CG 3.89Å
58	E	94.5	Very high	92	Very high	58 Å²	58	60.7 Å²	60.7	27%	0.271	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.6	176.1	-79.4	-175	-166.7	0	0	111.6	T60 L81 T82 T84 L102	E58-T60 PolarHBondContact O-N 2.82Å; E58-L81 CarbonylContact O-C 3.5Å; E58-L81 VanDerWaalsContact O-CA 3.26Å; E58-L81 WeakPolarHBondContact O-CA 3.49Å; E58-T82 PolarHBondContact N-O 3.11Å; E58-T82 PolarHBondContact O-N 3.42Å; E58-T84 HydrophobicContact CB-CG2 3.95Å; E58-T84 HydrophobicContact CG-CG2 3.72Å; E58-L102 HydrophobicContact CB-CD2 3.8Å
59	R	92.6	Very high	91.2	Very high	88 Å²	88	63.6 Å²	63.6	33%	0.332	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125.3	175.9	175.5	-168.5	73.9	-178.6	4.4	109.8	E37 V44 I62 L79 H80	E37-R59 IonicContact OE1-CZ 3.48Å; E37-R59 IonicContact OE1-NH1 2.74Å; E37-R59 PolarHBondContact OE1-NH1 2.9Å; E37-R59 IonicContact OE1-NH2 3.25Å; E37-R59 PolarHBondContact OE1-NH2 3.25Å; E37-R59 IonicContact OE2-CZ 3.56Å; E37-R59 IonicContact OE2-NH1 2.73Å; E37-R59 PolarHBondContact OE2-NH1 3.04Å; E37-R59 IonicContact OE2-NH2 3.6Å; V44-R59 HydrophobicContact CG2-CB 4Å; R59-I62 HydrophobicContact CG-CG1 4.34Å; R59-L79 HydrophobicContact CB-CD1 4.12Å; R59-L79 HydrophobicContact CG-CD1 3.79Å; R59-H80 WeakPolarHBondContact CA-O 3.42Å
60	T	91.5	Very high	90.4	Very high	56 Å²	56	58.8 Å²	58.8	34%	0.344	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-33.3	168.3	51.5	0	0	0	0	112.2	E58 H80 T82 L102 Y104	E58-T60 PolarHBondContact O-N 2.82Å; T60-H80 PolarHBondContact N-O 2.61Å; T60-H80 PolarHBondContact OG1-O 2.87Å; T60-T82 VanDerWaalsContact CG2-OG1 3.31Å; T60-T82 WeakPolarHBondContact CG2-OG1 3.5Å; T60-L102 HydrophobicContact CG2-CD1 4.03Å; T60-L102 HydrophobicContact CG2-CD2 4.27Å; T60-Y104 HydrophobicContact CG2-CE1 4.26Å
61	N	90.7	Very high	89.7	Confident	75 Å²	75	60.2 Å²	60.2	40%	0.401	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	160	179.1	-157.7	5	0	0	0	112.1	H80	N61-H80 HydrophobicContact CB-CB 4.07Å; N61-H80 PolarHBondContact N-O 3.02Å; N61-H80 PolarHBondContact O-N 2.86Å
62	I	90	Very high	89.1	Confident	12 Å²	12	59.6 Å²	59.6	6%	0.062	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.2	166.9	-64.7	172.5	0	0	0	107.4	N29 I40 R59 M65 Y77 T78 L79	N29-I62 PolarHBondContact OD1-O 3.08Å; I40-I62 HydrophobicContact CB-CD1 4.37Å; I40-I62 HydrophobicContact CD1-CD1 3.31Å; I40-I62 HydrophobicContact CG1-CD1 3.66Å; I40-I62 HydrophobicContact CG2-CD1 3.78Å; R59-I62 HydrophobicContact CG-CG1 4.34Å; I62-M65 HydrophobicContact CG2-CE 3.83Å; I62-Y77 HydrophobicContact CG2-CD2 3.83Å; I62-Y77 HydrophobicContact CG2-CG 4.13Å; I62-T78 WeakPolarHBondContact CA-O 3.13Å; I62-L79 HydrophobicContact CD1-CD1 4.45Å; I62-L79 HydrophobicContact CG1-CD1 3.96Å
63	T	90.9	Very high	88.7	Confident	28 Å²	28	53.6 Å²	53.6	17%	0.172	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	168.2	-178	58.9	0	0	0	0	110.3	M65 T78 H80	T63-M65 PolarHBondContact O-N 3.16Å; T63-T78 PolarHBondContact N-O 3.34Å; T63-T78 WeakPolarHBondContact O-CA 3.06Å; T63-T78 WeakPolarHBondContact O-CB 3.4Å; T63-T78 PolarHBondContact O-N 3.17Å; T63-T78 WeakPolarHBondContact OG1-CB 3.44Å; T63-H80 PolarHBondContact OG1-CD2 3.03Å; T63-H80 PolarHBondContact OG1-NE2 2.84Å
64	N	89.4	Confident	88.4	Confident	116 Å²	116	53.6 Å²	53.6	62%	0.62	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.5	41.4	176.4	-50.7	-41	0	0	0	112.3	T78	N64-T78 PolarHBondContact ND2-OG1 2.87Å
65	M	88.8	Confident	88.2	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.6	178.2	-173.7	177.1	-72.1	0	0	109.4	I27 F35 I62 T63 E76	I27-M65 HydrophobicContact CB-CB 4.19Å; I27-M65 HydrophobicContact CB-CG 4.17Å; I27-M65 HydrophobicContact CB-SD 4.27Å; I27-M65 HydrophobicContact CD1-CG 3.78Å; I27-M65 HydrophobicContact CD1-SD 3.52Å; I27-M65 VanDerWaalsContact CD1-SD 3.52Å; I27-M65 HydrophobicContact CG1-CG 4.16Å; I27-M65 HydrophobicContact CG1-SD 4.35Å; I27-M65 PolarHBondContact N-O 3.38Å; F35-M65 HydrophobicContact CB-CE 3.91Å; F35-M65 HydrophobicContact CB-SD 4.11Å; F35-M65 HydrophobicContact CD1-CE 3.84Å; F35-M65 HydrophobicContact CD2-CE 4.23Å; F35-M65 HydrophobicContact CD2-SD 4.29Å; F35-M65 HydrophobicContact CE1-CE 4.44Å; F35-M65 HydrophobicContact CG-CE 3.71Å; F35-M65 HydrophobicContact CG-SD 4.17Å; I62-M65 HydrophobicContact CG2-CE 3.83Å; T63-M65 PolarHBondContact O-N 3.16Å; M65-E76 CarbonylContact C-O 3.24Å; M65-E76 VanDerWaalsContact CA-O 3.28Å; M65-E76 WeakPolarHBondContact CA-O 3.42Å
66	T	87.8	Confident	88.1	Confident	17 Å²	17	47.4 Å²	47.4	10%	0.104	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	149.2	177.9	61.4	0	0	0	0	110.8	V24 F25 H26 F75 E76	V24-T66 HydrophobicContact CG1-CG2 4.04Å; F25-T66 CarbonylContact O-C 3.49Å; F25-T66 WeakPolarHBondContact O-CA 3.42Å; H26-T66 WeakPolarHBondContact ND1-CG2 3.49Å; T66-F75 WeakPolarHBondContact O-CA 3.47Å; T66-E76 PolarHBondContact N-O 2.9Å; T66-E76 PolarHBondContact O-N 3.27Å
67	I	86	Confident	87.9	Confident	35 Å²	35	46.3 Å²	46.3	18%	0.179	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.8	172.6	-61.4	178.4	0	0	0	108.2	V24 F25 I27 V73 L74 F75	V24-I67 CarbonylContact C-O 3.59Å; V24-I67 WeakPolarHBondContact CA-O 3.31Å; F25-I67 PolarHBondContact N-O 2.91Å; F25-I67 PolarHBondContact O-N 3.2Å; I27-I67 HydrophobicContact CD1-CD1 3.28Å; I27-I67 HydrophobicContact CD1-CG1 3.55Å; I27-I67 HydrophobicContact CG1-CD1 4.05Å; I27-I67 HydrophobicContact CG1-CG1 4.09Å; I67-V73 HydrophobicContact CG2-CG1 3.59Å; I67-L74 CarbonylContact C-O 3.57Å; I67-L74 WeakPolarHBondContact CA-O 3.36Å; I67-F75 HydrophobicContact CD1-CD1 4.03Å; I67-F75 HydrophobicContact CD1-CE1 3.54Å; I67-F75 HydrophobicContact CD1-CZ 4.46Å; I67-F75 HydrophobicContact CG1-CD1 3.63Å; I67-F75 HydrophobicContact CG1-CE1 3.66Å
68	Q	84.5	Confident	87.9	Confident	54 Å²	54	46.5 Å²	46.5	25%	0.252	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.1	170.9	-164	-176.8	16.7	0	0	110.2	G22 V24 V70 L74	G22-Q68 PolarHBondContact O-NE2 3.45Å; V24-Q68 HydrophobicContact CG2-CB 4.15Å; V24-Q68 HydrophobicContact CG2-CG 3.79Å; Q68-V70 HydrophobicContact CG-CG1 3.94Å; Q68-L74 HydrophobicContact CB-CB 4.24Å; Q68-L74 PolarHBondContact N-O 3.49Å; Q68-L74 PolarHBondContact O-N 2.88Å
69	I	81.5	Confident	87.9	Confident	61 Å²	61	43.8 Å²	43.8	31%	0.313	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.1	173.9	-56.8	175.1	0	0	0	108.1	L19 F21 G22	L19-I69 HydrophobicContact CD2-CD1 4.26Å; F21-I69 HydrophobicContact CD1-CG2 4.32Å; F21-I69 HydrophobicContact CE1-CG2 4.41Å; G22-I69 PolarHBondContact N-O 3.29Å
70	V	77.1	Confident	88	Confident	50 Å²	50	41.4 Å²	41.4	30%	0.303	22%	0.224	S	C	.	.	S	Bend	trans	-132.3	-135.7	-179.9	-67.2	0	0	0	0	108.5	Q68 G72 L74 L116	Q68-V70 HydrophobicContact CG-CG1 3.94Å; V70-G72 PolarHBondContact N-O 3.1Å; V70-G72 PolarHBondContact O-N 3.47Å; V70-L74 HydrophobicContact CG2-CB 4.39Å; V70-L116 HydrophobicContact CG2-CD1 4.4Å
71	N	79.9	Confident	88.2	Confident	129 Å²	129	38.8 Å²	38.8	69%	0.69	21%	0.208	S	C	*	.	S	Bend	trans	-75.1	47.9	165.2	-66.7	-9.6	0	0	0	111.6	S118	N71-S118 PolarHBondContact O-OG 2.57Å
72	G	81.5	Confident	88.4	Confident	13 Å²	13	35.4 Å²	35.4	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	141.7	-170.3	-167.1	0	0	0	0	0	112	V70 L117	V70-G72 PolarHBondContact N-O 3.1Å; V70-G72 PolarHBondContact O-N 3.47Å; G72-L117 CarbonylContact C-O 3.57Å; G72-L117 WeakPolarHBondContact CA-O 3.45Å
73	V	84	Confident	88.6	Confident	48 Å²	48	37.8 Å²	37.8	29%	0.291	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.1	174.2	-170.8	0	0	0	0	108.8	I67 F75 L117	I67-V73 HydrophobicContact CG2-CG1 3.59Å; V73-F75 HydrophobicContact CB-CE2 3.91Å; V73-F75 HydrophobicContact CB-CZ 4.39Å; V73-F75 HydrophobicContact CG1-CD2 4.09Å; V73-F75 HydrophobicContact CG1-CE1 4.28Å; V73-F75 HydrophobicContact CG1-CE2 3.37Å; V73-F75 HydrophobicContact CG1-CZ 3.49Å; V73-F75 VanDerWaalsContact CG1-CZ 3.49Å; V73-L117 HydrophobicContact CB-CB 4.38Å; V73-L117 PolarHBondContact N-O 3.35Å; V73-L117 PolarHBondContact O-N 3.1Å
74	L	87.2	Confident	88.8	Confident	19 Å²	19	36.5 Å²	36.5	10%	0.099	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.8	177	-179.1	65.1	0	0	0	109.7	I67 Q68 V70 E76 Q114 L116	I67-L74 CarbonylContact C-O 3.57Å; I67-L74 WeakPolarHBondContact CA-O 3.36Å; Q68-L74 HydrophobicContact CB-CB 4.24Å; Q68-L74 PolarHBondContact N-O 3.49Å; Q68-L74 PolarHBondContact O-N 2.88Å; V70-L74 HydrophobicContact CG2-CB 4.39Å; L74-E76 HydrophobicContact CG-CG 4.36Å; L74-Q114 HydrophobicContact CD1-CG 3.44Å; L74-Q114 VanDerWaalsContact CD1-CG 3.44Å; L74-Q114 HydrophobicContact CG-CG 4.41Å; L74-L116 HydrophobicContact CB-CD1 4.15Å; L74-L116 HydrophobicContact CD1-CB 4.03Å; L74-L116 HydrophobicContact CD1-CD1 4.15Å
75	F	88.7	Confident	89	Confident	23 Å²	23	35.1 Å²	35.1	10%	0.101	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.7	172.3	-60.3	-96.6	0	0	0	109.3	F35 T66 I67 V73 Q114 F115 L117	F35-F75 AromaticContact CD2-CD1 3.68Å; F35-F75 HydrophobicContact CD2-CD1 3.68Å; F35-F75 HydrophobicContact CD2-CE1 4.07Å; F35-F75 HydrophobicContact CD2-CG 4.24Å; F35-F75 HydrophobicContact CE2-CB 3.75Å; F35-F75 AromaticContact CE2-CD1 3.6Å; F35-F75 HydrophobicContact CE2-CD1 3.6Å; F35-F75 HydrophobicContact CE2-CD2 4.4Å; F35-F75 HydrophobicContact CE2-CE1 4.29Å; F35-F75 AromaticContact CE2-CG 3.67Å; F35-F75 HydrophobicContact CE2-CG 3.67Å; F35-F75 HydrophobicContact CZ-CB 4.49Å; T66-F75 WeakPolarHBondContact O-CA 3.47Å; I67-F75 HydrophobicContact CD1-CD1 4.03Å; I67-F75 HydrophobicContact CD1-CE1 3.54Å; I67-F75 HydrophobicContact CD1-CZ 4.46Å; I67-F75 HydrophobicContact CG1-CD1 3.63Å; I67-F75 HydrophobicContact CG1-CE1 3.66Å; V73-F75 HydrophobicContact CB-CE2 3.91Å; V73-F75 HydrophobicContact CB-CZ 4.39Å; V73-F75 HydrophobicContact CG1-CD2 4.09Å; V73-F75 HydrophobicContact CG1-CE1 4.28Å; V73-F75 HydrophobicContact CG1-CE2 3.37Å; V73-F75 HydrophobicContact CG1-CZ 3.49Å; V73-F75 VanDerWaalsContact CG1-CZ 3.49Å; F75-Q114 CarbonylContact O-C 3.53Å; F75-Q114 WeakPolarHBondContact O-CA 3.48Å; F75-F115 HydrophobicContact CB-CB 4.34Å; F75-F115 AromaticContact CD2-CD1 3.92Å; F75-F115 HydrophobicContact CD2-CD1 3.92Å; F75-F115 PolarHBondContact N-O 3.28Å; F75-F115 PolarHBondContact O-N 2.8Å; F75-L117 HydrophobicContact CE2-CD1 3.71Å; F75-L117 HydrophobicContact CE2-CG 4.12Å; F75-L117 HydrophobicContact CZ-CD1 4.42Å
76	E	92	Very high	89.2	Confident	76 Å²	76	35.3 Å²	35.3	36%	0.355	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.2	168.1	-57.1	-164.5	150	0	0	110.2	M65 T66 L74 I113 Q114	M65-E76 CarbonylContact C-O 3.24Å; M65-E76 VanDerWaalsContact CA-O 3.28Å; M65-E76 WeakPolarHBondContact CA-O 3.42Å; T66-E76 PolarHBondContact N-O 2.9Å; T66-E76 PolarHBondContact O-N 3.27Å; L74-E76 HydrophobicContact CG-CG 4.36Å; E76-I113 VanDerWaalsContact CA-O 3.29Å; E76-I113 WeakPolarHBondContact CA-O 3.22Å; E76-Q114 HydrophobicContact CG-CB 4.43Å; E76-Q114 HydrophobicContact CG-CG 4.12Å
77	Y	92.7	Very high	89.4	Confident	3 Å²	3	36.3 Å²	36.3	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	159.6	176.5	58.8	-84.8	0	0	0	111.6	F35 S43 I62 L79 I113	F35-Y77 HydrophobicContact CE1-CD1 4.25Å; F35-Y77 AromaticContact CE1-CE1 3.72Å; F35-Y77 HydrophobicContact CE1-CE1 3.72Å; F35-Y77 AromaticContact CE1-CZ 3.97Å; F35-Y77 HydrophobicContact CE2-CE1 4.38Å; F35-Y77 AromaticContact CZ-CD1 3.92Å; F35-Y77 HydrophobicContact CZ-CD1 3.92Å; F35-Y77 AromaticContact CZ-CE1 3.39Å; F35-Y77 HydrophobicContact CZ-CE1 3.39Å; S43-Y77 VanDerWaalsContact CB-OH 3.26Å; S43-Y77 WeakPolarHBondContact CB-OH 3.38Å; S43-Y77 PolarHBondContact OG-OH 3.45Å; S43-Y77 VanDerWaalsContact OG-OH 3.1Å; I62-Y77 HydrophobicContact CG2-CD2 3.83Å; I62-Y77 HydrophobicContact CG2-CG 4.13Å; Y77-L79 HydrophobicContact CD2-CB 4.31Å; Y77-L79 HydrophobicContact CE2-CB 4.16Å; Y77-I113 HydrophobicContact CD1-CB 4.28Å; Y77-I113 HydrophobicContact CD2-CB 4.1Å; Y77-I113 HydrophobicContact CD2-CG1 4.23Å; Y77-I113 HydrophobicContact CE1-CB 3.86Å; Y77-I113 HydrophobicContact CE1-CG2 3.76Å; Y77-I113 HydrophobicContact CE2-CB 3.69Å; Y77-I113 HydrophobicContact CE2-CG1 3.72Å; Y77-I113 HydrophobicContact CE2-CG2 4.1Å; Y77-I113 HydrophobicContact CG-CB 4.39Å; Y77-I113 VanDerWaalsContact CZ-CG2 3.49Å; Y77-I113 PolarHBondContact N-O 2.98Å; Y77-I113 PolarHBondContact O-N 3.5Å; Y77-I113 WeakPolarHBondContact OH-CG2 3.46Å
78	T	94.3	Very high	89.7	Confident	12 Å²	12	36.5 Å²	36.5	7%	0.074	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	111.6	174.1	-58.4	0	0	0	0	109.4	I62 T63 N64 V110 C111	I62-T78 WeakPolarHBondContact CA-O 3.13Å; T63-T78 PolarHBondContact N-O 3.34Å; T63-T78 WeakPolarHBondContact O-CA 3.06Å; T63-T78 WeakPolarHBondContact O-CB 3.4Å; T63-T78 PolarHBondContact O-N 3.17Å; T63-T78 WeakPolarHBondContact OG1-CB 3.44Å; N64-T78 PolarHBondContact ND2-OG1 2.87Å; T78-V110 HydrophobicContact CG2-CG1 3.19Å; T78-C111 CarbonylContact C-O 3.45Å; T78-C111 WeakPolarHBondContact CA-O 3.36Å
79	L	94.7	Very high	90	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.8	177.5	-176.6	66.3	0	0	0	110.1	I40 V44 V47 R59 I62 Y77 L81 V110 C111 I113	I40-L79 HydrophobicContact CG2-CD1 4.47Å; V44-L79 HydrophobicContact CG2-CD1 4.37Å; V44-L79 HydrophobicContact CG2-CD2 4.06Å; V47-L79 HydrophobicContact CG2-CD2 4.43Å; R59-L79 HydrophobicContact CB-CD1 4.12Å; R59-L79 HydrophobicContact CG-CD1 3.79Å; I62-L79 HydrophobicContact CD1-CD1 4.45Å; I62-L79 HydrophobicContact CG1-CD1 3.96Å; Y77-L79 HydrophobicContact CD2-CB 4.31Å; Y77-L79 HydrophobicContact CE2-CB 4.16Å; L79-L81 HydrophobicContact CD2-CD1 4.11Å; L79-L81 HydrophobicContact CD2-CD2 4.01Å; L79-L81 HydrophobicContact CD2-CG 4.16Å; L79-L81 HydrophobicContact CG-CD1 4.39Å; L79-L81 HydrophobicContact CG-CD2 4.08Å; L79-L81 HydrophobicContact CG-CG 4.01Å; L79-V110 WeakPolarHBondContact O-CA 3.38Å; L79-C111 PolarHBondContact N-O 2.92Å; L79-C111 PolarHBondContact O-N 3.18Å; L79-I113 HydrophobicContact CB-CG1 3.87Å; L79-I113 HydrophobicContact CD2-CD1 4.47Å; L79-I113 HydrophobicContact CD2-CG1 4.31Å
80	H	94.8	Very high	90.3	Very high	38 Å²	38	39.6 Å²	39.6	18%	0.176	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.4	174.2	-62.7	-97.8	0	0	0	109.8	R59 T60 N61 T63 V110	R59-H80 WeakPolarHBondContact CA-O 3.42Å; T60-H80 PolarHBondContact N-O 2.61Å; T60-H80 PolarHBondContact OG1-O 2.87Å; N61-H80 HydrophobicContact CB-CB 4.07Å; N61-H80 PolarHBondContact N-O 3.02Å; N61-H80 PolarHBondContact O-N 2.86Å; T63-H80 PolarHBondContact OG1-CD2 3.03Å; T63-H80 PolarHBondContact OG1-NE2 2.84Å; H80-V110 WeakPolarHBondContact ND1-CG2 3.19Å
81	L	95.4	Very high	90.8	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.4	-171	-67.4	164.9	0	0	0	110.1	V44 V47 Y57 E58 L79 G108 Q109	V44-L81 HydrophobicContact CG1-CD2 4.31Å; V44-L81 HydrophobicContact CG2-CD2 4.18Å; V47-L81 HydrophobicContact CB-CD1 4.17Å; V47-L81 HydrophobicContact CG1-CD1 3.44Å; V47-L81 VanDerWaalsContact CG1-CD1 3.44Å; Y57-L81 HydrophobicContact CD1-CB 4.39Å; E58-L81 CarbonylContact O-C 3.5Å; E58-L81 VanDerWaalsContact O-CA 3.26Å; E58-L81 WeakPolarHBondContact O-CA 3.49Å; L79-L81 HydrophobicContact CD2-CD1 4.11Å; L79-L81 HydrophobicContact CD2-CD2 4.01Å; L79-L81 HydrophobicContact CD2-CG 4.16Å; L79-L81 HydrophobicContact CG-CD1 4.39Å; L79-L81 HydrophobicContact CG-CD2 4.08Å; L79-L81 HydrophobicContact CG-CG 4.01Å; L81-G108 CarbonylContact O-C 3.48Å; L81-G108 WeakPolarHBondContact O-CA 3.31Å; L81-Q109 HydrophobicContact CB-CB 4.12Å; L81-Q109 WeakPolarHBondContact CB-O 2.87Å; L81-Q109 HydrophobicContact CD1-CB 4.27Å; L81-Q109 PolarHBondContact N-O 3.28Å; L81-Q109 PolarHBondContact O-N 3.03Å
82	T	95	Very high	90.9	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.5	172	-67.8	0	0	0	0	109.1	Y57 E58 T60 L102 Y104 S138	Y57-T82 WeakPolarHBondContact CA-O 3.38Å; E58-T82 PolarHBondContact N-O 3.11Å; E58-T82 PolarHBondContact O-N 3.42Å; T60-T82 VanDerWaalsContact CG2-OG1 3.31Å; T60-T82 WeakPolarHBondContact CG2-OG1 3.5Å; T82-L102 HydrophobicContact CG2-CB 4.39Å; T82-L102 HydrophobicContact CG2-CD2 4.48Å; T82-Y104 HydrophobicContact CG2-CD1 3.98Å; T82-Y104 HydrophobicContact CG2-CE1 4.33Å; T82-S138 PolarHBondContact OG1-OG 2.79Å
83	R	95	Very high	90.9	Very high	63 Å²	63	42.4 Å²	42.4	24%	0.238	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	142.9	177.5	-166.1	-170.9	-77.4	-170.4	-1.4	109.5	Y55 Y57 N103 T106	Y55-R83 VanDerWaalsContact CB-CG 3.46Å; Y55-R83 HydrophobicContact CG-CG 3.95Å; Y57-R83 HydrophobicContact CD1-CB 3.96Å; Y57-R83 VanDerWaalsContact CD1-N 3.32Å; Y57-R83 HydrophobicContact CE1-CB 3.61Å; Y57-R83 HydrophobicContact CE1-CG 4.16Å; Y57-R83 HydrophobicContact CE2-CG 4.27Å; Y57-R83 PolarHBondContact OH-NE 3.23Å; Y57-R83 VanDerWaalsContact OH-NE 3.14Å; Y57-R83 PolarHBondContact OH-NH2 3.45Å; R83-N103 PolarHBondContact O-N 3.14Å; R83-T106 WeakPolarHBondContact CB-OG1 3.37Å
84	T	94.3	Very high	90.2	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	175.7	171.4	77.1	0	0	0	0	111.6	W56 E58 C86 C100 Q101 L102	W56-T84 PolarHBondContact O-N 3.32Å; W56-T84 PolarHBondContact O-OG1 3.31Å; E58-T84 HydrophobicContact CB-CG2 3.95Å; E58-T84 HydrophobicContact CG-CG2 3.72Å; T84-C86 WeakPolarHBondContact OG1-CB 3.07Å; T84-C86 PolarHBondContact OG1-N 3.37Å; T84-C100 HydrophobicContact CG2-CB 4Å; T84-Q101 CarbonylContact C-O 3.54Å; T84-Q101 WeakPolarHBondContact CA-O 3.41Å; T84-Q101 WeakPolarHBondContact CB-O 3.4Å; T84-L102 HydrophobicContact CG2-CD2 4.16Å
85	N	93.1	Very high	89	Confident	87 Å²	87	52.4 Å²	52.4	47%	0.465	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-5.6	168.1	65.9	-18.8	0	0	0	113.8	Q101	N85-Q101 PolarHBondContact N-O 3.33Å; N85-Q101 PolarHBondContact OD1-N 3.11Å; N85-Q101 PolarHBondContact OD1-O 3.29Å
86	C	93.3	Very high	87.7	Confident	7 Å²	7	59.3 Å²	59.3	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	150.5	178.7	-66.2	0	0	0	0	112.2	Y55 W56 T84 M91 C100	Y55-C86 WeakPolarHBondContact CA-O 3.22Å; W56-C86 HydrophobicContact CB-CB 4.28Å; W56-C86 PolarHBondContact N-O 3.31Å; T84-C86 WeakPolarHBondContact OG1-CB 3.07Å; T84-C86 PolarHBondContact OG1-N 3.37Å; C86-M91 HydrophobicContact CB-CG 4.15Å; C86-M91 HydrophobicContact CB-SD 4.21Å; C86-C100 HydrophobicContact CB-CB 3.95Å; C86-C100 WeakPolarHBondContact CB-SG 3.39Å; C86-C100 WeakPolarHBondContact SG-CA 3.4Å; C86-C100 WeakPolarHBondContact SG-CB 3.41Å; C86-C100 CovalentContact SG-SG 2.03Å; C86-C100 PolarHBondContact SG-SG 3.36Å
87	T	93.2	Very high	86.2	Confident	39 Å²	39	62.1 Å²	62.1	24%	0.239	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	156.2	170.1	72.7	0	0	0	0	111.1	N54 M89 Q90 M91	N54-T87 CarbonylContact O-C 3.52Å; N54-T87 VanDerWaalsContact O-CA 3.24Å; N54-T87 WeakPolarHBondContact O-CA 3.49Å; N54-T87 WeakPolarHBondContact O-CB 3.41Å; T87-M89 VanDerWaalsContact C-N 3.26Å; T87-M89 PolarHBondContact O-N 3Å; T87-Q90 WeakPolarHBondContact O-CB 3.39Å; T87-Q90 PolarHBondContact O-N 2.91Å; T87-Q90 VanDerWaalsContact OG1-CG 3.25Å; T87-Q90 WeakPolarHBondContact OG1-CG 3.44Å; T87-Q90 PolarHBondContact OG1-N 3.37Å; T87-M91 WeakPolarHBondContact O-CG 3.13Å; T87-M91 PolarHBondContact O-N 3.34Å
88	K	92.1	Very high	85.3	Confident	38 Å²	38	67.4 Å²	67.4	17%	0.165	34%	0.337	C	S	.	.	H	α-helix	trans	-58.3	-41.7	174.3	-69.7	-172.7	-178.5	173	0	112.2	N48 L51 S53 N54 Y55 W56 Q90 M91 T92	N48-K88 WeakPolarHBondContact O-CE 3.32Å; N48-K88 PolarHBondContact O-NZ 3.01Å; L51-K88 PolarHBondContact O-NZ 3.19Å; S53-K88 VanDerWaalsContact O-CD 3.23Å; S53-K88 WeakPolarHBondContact O-CD 3.4Å; S53-K88 WeakPolarHBondContact O-CE 3.26Å; S53-K88 PolarHBondContact O-NZ 2.73Å; N54-K88 PolarHBondContact O-N 2.88Å; Y55-K88 WeakPolarHBondContact O-CG 3.29Å; W56-K88 HydrophobicContact CE3-CG 4.31Å; K88-Q90 VanDerWaalsContact C-N 3.26Å; K88-Q90 PolarHBondContact O-N 2.92Å; K88-M91 PolarHBondContact O-N 2.88Å; K88-T92 WeakPolarHBondContact O-CG2 3.26Å; K88-T92 PolarHBondContact O-N 3.36Å; K88-T92 PolarHBondContact O-OG1 2.93Å
89	M	89.4	Confident	84.9	Confident	121 Å²	121	78.4 Å²	78.4	60%	0.596	38%	0.378	S	S	*	.	H	α-helix	trans	-55.1	-45.5	177.6	-174.9	-177	73.6	0	0	111	T87 M91 T92 Q93	T87-M89 VanDerWaalsContact C-N 3.26Å; T87-M89 PolarHBondContact O-N 3Å; M89-M91 VanDerWaalsContact C-N 3.3Å; M89-M91 PolarHBondContact O-N 2.83Å; M89-T92 PolarHBondContact O-N 2.04Å; M89-T92 PolarHBondContact O-OG1 3.11Å; M89-T92 VanDerWaalsContact O-OG1 3.1Å; M89-Q93 VanDerWaalsContact O-CG 3.28Å; M89-Q93 WeakPolarHBondContact O-CG 3.37Å; M89-Q93 PolarHBondContact O-N 3.34Å
90	Q	88.2	Confident	84.7	Confident	59 Å²	59	79.3 Å²	79.3	28%	0.276	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-36.3	177.2	-70.2	168.6	-22.5	0	0	112.6	T87 K88	T87-Q90 WeakPolarHBondContact O-CB 3.39Å; T87-Q90 PolarHBondContact O-N 2.91Å; T87-Q90 VanDerWaalsContact OG1-CG 3.25Å; T87-Q90 WeakPolarHBondContact OG1-CG 3.44Å; T87-Q90 PolarHBondContact OG1-N 3.37Å; K88-Q90 VanDerWaalsContact C-N 3.26Å; K88-Q90 PolarHBondContact O-N 2.92Å
91	M	87.4	Confident	84.5	Confident	61 Å²	61	84.3 Å²	84.3	30%	0.3	41%	0.407	S	S	.	.	H	α-helix	trans	-81.1	-23.9	-178.3	-65	-57	-72.1	0	0	113.9	W56 C86 T87 K88 M89 C100	W56-M91 HydrophobicContact CB-CG 3.76Å; W56-M91 HydrophobicContact CD2-CB 3.85Å; W56-M91 HydrophobicContact CD2-CE 4.48Å; W56-M91 HydrophobicContact CD2-CG 3.72Å; W56-M91 HydrophobicContact CE3-CB 3.67Å; W56-M91 HydrophobicContact CE3-CG 4.02Å; W56-M91 HydrophobicContact CG-CB 4.27Å; W56-M91 HydrophobicContact CG-CE 4.44Å; W56-M91 HydrophobicContact CG-CG 3.6Å; W56-M91 HydrophobicContact CZ3-CB 4.09Å; C86-M91 HydrophobicContact CB-CG 4.15Å; C86-M91 HydrophobicContact CB-SD 4.21Å; T87-M91 WeakPolarHBondContact O-CG 3.13Å; T87-M91 PolarHBondContact O-N 3.34Å; K88-M91 PolarHBondContact O-N 2.88Å; M89-M91 VanDerWaalsContact C-N 3.3Å; M89-M91 PolarHBondContact O-N 2.83Å; M91-C100 PolarHBondContact SD-SG 2.96Å
92	T	83.3	Confident	84.4	Confident	97 Å²	97	86.9 Å²	86.9	60%	0.595	42%	0.421	S	S	*	.	H	α-helix	trans	-87.1	-19	177.6	51	0	0	0	0	113.6	K88 M89	K88-T92 WeakPolarHBondContact O-CG2 3.26Å; K88-T92 PolarHBondContact O-N 3.36Å; K88-T92 PolarHBondContact O-OG1 2.93Å; M89-T92 PolarHBondContact O-N 2.04Å; M89-T92 PolarHBondContact O-OG1 3.11Å; M89-T92 VanDerWaalsContact O-OG1 3.1Å
93	Q	81.5	Confident	84.2	Confident	93 Å²	93	89.4 Å²	89.4	44%	0.435	43%	0.434	S	S	.	.	S	Bend	trans	-74.8	133.9	177	-75.3	173.7	4.9	0	0	110	M89 S95	M89-Q93 VanDerWaalsContact O-CG 3.28Å; M89-Q93 WeakPolarHBondContact O-CG 3.37Å; M89-Q93 PolarHBondContact O-N 3.34Å; Q93-S95 PolarHBondContact O-N 3.14Å
94	K	68.8	Low	83.9	Confident	221 Å²	221	91.1 Å²	91.1	96%	0.961	44%	0.441	S	S	*	.			trans	-62.9	2.4	178.3	-68.2	-175.6	178.2	-179.9	0	114.8
95	S	61.8	Low	83.5	Confident	56 Å²	56	96.7 Å²	96.7	39%	0.392	47%	0.465	S	S	.	.	S	Bend	trans	-62.9	150.6	173.4	61.7	0	0	0	0	110.4	Q93	Q93-S95 PolarHBondContact O-N 3.14Å
96	Q	60.5	Low	83.3	Confident	169 Å²	169	93.7 Å²	93.7	79%	0.79	45%	0.45	S	S	*	.	S	Bend	trans	-31.8	149.8	-174.3	-66.6	177.8	-0.8	0	0	116.3	R98	Q96-R98 WeakPolarHBondContact O-CG 3.26Å; Q96-R98 PolarHBondContact O-N 2.94Å
97	P	61.7	Low	83.1	Confident	134 Å²	134	96 Å²	96	87%	0.87	46%	0.461	S	S	*	.			trans	-52.6	111.1	179	22.6	-34.1	0	0	0	110.7
98	R	73.7	Confident	83.2	Confident	114 Å²	114	94.1 Å²	94.1	43%	0.43	45%	0.45	S	S	.	.			trans	-87.5	132.7	178.1	-64.3	-167.6	-175.2	-151.6	2.2	109.3	Q96 C100	Q96-R98 WeakPolarHBondContact O-CG 3.26Å; Q96-R98 PolarHBondContact O-N 2.94Å; R98-C100 PolarHBondContact O-N 3.5Å
99	R	85.6	Confident	83.3	Confident	244 Å²	244	93.2 Å²	93.2	92%	0.921	45%	0.446	S	S	*	.			trans	-82.4	109.9	171.7	-65.9	-175	-177	175.2	1.6	108.7
100	C	90.1	Very high	83.7	Confident	19 Å²	19	88.3 Å²	88.3	13%	0.128	42%	0.423	C	S	.	.			trans	-89.9	144.4	174	-59.2	0	0	0	0	110.1	T84 C86 M91 R98	T84-C100 HydrophobicContact CG2-CB 4Å; C86-C100 HydrophobicContact CB-CB 3.95Å; C86-C100 WeakPolarHBondContact CB-SG 3.39Å; C86-C100 WeakPolarHBondContact SG-CA 3.4Å; C86-C100 WeakPolarHBondContact SG-CB 3.41Å; C86-C100 CovalentContact SG-SG 2.03Å; C86-C100 PolarHBondContact SG-SG 3.36Å; M91-C100 PolarHBondContact SD-SG 2.96Å; R98-C100 PolarHBondContact O-N 3.5Å
101	Q	92	Very high	84.1	Confident	142 Å²	142	85.5 Å²	85.5	66%	0.664	41%	0.41	S	S	*	.			trans	-106.1	132.8	175.3	-65.9	-179.3	3.3	0	0	109.3	T84 N85	T84-Q101 CarbonylContact C-O 3.54Å; T84-Q101 WeakPolarHBondContact CA-O 3.41Å; T84-Q101 WeakPolarHBondContact CB-O 3.4Å; N85-Q101 PolarHBondContact N-O 3.33Å; N85-Q101 PolarHBondContact OD1-N 3.11Å; N85-Q101 PolarHBondContact OD1-O 3.29Å
102	L	92	Very high	84.6	Confident	55 Å²	55	90.3 Å²	90.3	29%	0.288	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-64.2	132.5	174.7	-63.1	174	0	0	0	110.1	E58 T60 T82 T84 Y104	E58-L102 HydrophobicContact CB-CD2 3.8Å; T60-L102 HydrophobicContact CG2-CD1 4.03Å; T60-L102 HydrophobicContact CG2-CD2 4.27Å; T82-L102 HydrophobicContact CG2-CB 4.39Å; T82-L102 HydrophobicContact CG2-CD2 4.48Å; T84-L102 HydrophobicContact CG2-CD2 4.16Å; L102-Y104 HydrophobicContact CB-CD2 4.37Å; L102-Y104 HydrophobicContact CB-CE2 3.84Å; L102-Y104 HydrophobicContact CD1-CE1 4.36Å; L102-Y104 HydrophobicContact CD1-CE2 4.28Å; L102-Y104 WeakPolarHBondContact CD1-OH 3.45Å
103	N	91.7	Very high	85.2	Confident	57 Å²	57	85.8 Å²	85.8	31%	0.305	40%	0.397	S	S	.	.			trans	-109.6	86	175.2	-173.1	-8.5	0	0	0	110.4	R83 K105 T106	R83-N103 PolarHBondContact O-N 3.14Å; N103-K105 PolarHBondContact O-N 3.48Å; N103-K105 VanDerWaalsContact O-N 3.1Å; N103-K105 WeakPolarHBondContact OD1-CB 3.47Å; N103-K105 PolarHBondContact OD1-N 3.39Å; N103-K105 VanDerWaalsContact OD1-N 3.15Å; N103-T106 HydrophobicContact CB-CG2 4.29Å; N103-T106 PolarHBondContact O-N 2.94Å; N103-T106 VanDerWaalsContact O-N 3.17Å; N103-T106 PolarHBondContact O-OG1 3.49Å
104	Y	88.2	Confident	85.7	Confident	100 Å²	100	83 Å²	83	39%	0.392	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-11	178.9	-62.1	-74.6	0	0	0	114.2	T60 T82 L102 T106 S138 M139 Y142	T60-Y104 HydrophobicContact CG2-CE1 4.26Å; T82-Y104 HydrophobicContact CG2-CD1 3.98Å; T82-Y104 HydrophobicContact CG2-CE1 4.33Å; L102-Y104 HydrophobicContact CB-CD2 4.37Å; L102-Y104 HydrophobicContact CB-CE2 3.84Å; L102-Y104 HydrophobicContact CD1-CE1 4.36Å; L102-Y104 HydrophobicContact CD1-CE2 4.28Å; L102-Y104 WeakPolarHBondContact CD1-OH 3.45Å; Y104-T106 PolarHBondContact O-N 2.82Å; Y104-S138 CarbonylContact O-C 3.58Å; Y104-S138 VanDerWaalsContact O-C 3.24Å; Y104-M139 WeakPolarHBondContact O-CA 3.44Å; Y104-M139 PolarHBondContact O-N 3.21Å; Y104-Y142 WeakPolarHBondContact O-CB 3.24Å
105	K	86.8	Confident	86.8	Confident	118 Å²	118	72.9 Å²	72.9	51%	0.513	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5	175.3	-45.9	-164.6	-166.7	-165.9	0	113	N103 Y142	N103-K105 PolarHBondContact O-N 3.48Å; N103-K105 VanDerWaalsContact O-N 3.1Å; N103-K105 WeakPolarHBondContact OD1-CB 3.47Å; N103-K105 PolarHBondContact OD1-N 3.39Å; N103-K105 VanDerWaalsContact OD1-N 3.15Å; K105-Y142 HydrophobicContact CB-CD1 4.3Å; K105-Y142 HydrophobicContact CB-CG 4.42Å; K105-Y142 HydrophobicContact CD-CD1 4.24Å; K105-Y142 HydrophobicContact CD-CD2 4.35Å; K105-Y142 HydrophobicContact CD-CE1 3.7Å; K105-Y142 HydrophobicContact CD-CE2 3.86Å; K105-Y142 WeakPolarHBondContact CE-OH 3.46Å; K105-Y142 HydrophobicContact CG-CD1 3.79Å; K105-Y142 HydrophobicContact CG-CD2 3.7Å; K105-Y142 HydrophobicContact CG-CE1 3.78Å; K105-Y142 HydrophobicContact CG-CE2 3.73Å; K105-Y142 HydrophobicContact CG-CG 3.74Å; K105-Y142 PolarHBondContact NZ-OH 2.95Å
106	T	87.4	Confident	88	Confident	23 Å²	23	72.4 Å²	72.4	14%	0.141	33%	0.333	C	S	.	.	S	Bend	trans	-108.5	156.3	-175.3	65.2	0	0	0	0	111.6	R83 N103 Y104 G108 S138	R83-T106 WeakPolarHBondContact CB-OG1 3.37Å; N103-T106 HydrophobicContact CB-CG2 4.29Å; N103-T106 PolarHBondContact O-N 2.94Å; N103-T106 VanDerWaalsContact O-N 3.17Å; N103-T106 PolarHBondContact O-OG1 3.49Å; Y104-T106 PolarHBondContact O-N 2.82Å; T106-G108 PolarHBondContact O-N 2.86Å; T106-S138 WeakPolarHBondContact O-CB 2.83Å; T106-S138 PolarHBondContact O-OG 2.79Å
107	I	90.5	Very high	89.1	Confident	56 Å²	56	67 Å²	67	29%	0.287	31%	0.309	S	S	.	.			trans	-62.1	122.4	173.5	-64.3	162.7	0	0	0	108.8	Q134 M139	I107-Q134 HydrophobicContact CG2-CB 3.58Å; I107-Q134 HydrophobicContact CG2-CG 3.75Å; I107-M139 HydrophobicContact CG1-SD 3.67Å
108	G	93.7	Very high	90	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-172.7	175.2	0	0	0	0	0	112.1	L81 T106 D135	L81-G108 CarbonylContact O-C 3.48Å; L81-G108 WeakPolarHBondContact O-CA 3.31Å; T106-G108 PolarHBondContact O-N 2.86Å; G108-D135 PolarHBondContact N-O 3.44Å; G108-D135 PolarHBondContact O-N 3.24Å
109	Q	95.8	Very high	89.8	Confident	19 Å²	19	62 Å²	62	9%	0.089	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.6	170.7	-61.2	-67.4	-49.2	0	0	109.5	L51 Y57 L81 K133	L51-Q109 HydrophobicContact CD1-CB 4.48Å; L51-Q109 HydrophobicContact CD1-CG 3.82Å; L51-Q109 HydrophobicContact CD2-CG 4.17Å; Y57-Q109 HydrophobicContact CD1-CG 4.12Å; Y57-Q109 HydrophobicContact CE1-CG 3.89Å; L81-Q109 HydrophobicContact CB-CB 4.12Å; L81-Q109 WeakPolarHBondContact CB-O 2.87Å; L81-Q109 HydrophobicContact CD1-CB 4.27Å; L81-Q109 PolarHBondContact N-O 3.28Å; L81-Q109 PolarHBondContact O-N 3.03Å; Q109-K133 CarbonylContact C-O 3.44Å; Q109-K133 WeakPolarHBondContact CA-O 3.5Å; Q109-K133 PolarHBondContact OE1-O 3.48Å
110	V	96.2	Very high	88.7	Confident	18 Å²	18	57.1 Å²	57.1	11%	0.109	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.6	166.8	-175.5	0	0	0	0	107.8	T78 L79 H80 C132 K133 D135	T78-V110 HydrophobicContact CG2-CG1 3.19Å; L79-V110 WeakPolarHBondContact O-CA 3.38Å; H80-V110 WeakPolarHBondContact ND1-CG2 3.19Å; V110-C132 WeakPolarHBondContact O-CA 3.01Å; V110-K133 HydrophobicContact CB-CG 4.31Å; V110-K133 PolarHBondContact N-O 3.14Å; V110-K133 PolarHBondContact O-N 2.91Å; V110-D135 HydrophobicContact CG2-CB 3.51Å
111	C	97.6	Very high	87.4	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.7	-179.9	-65.2	0	0	0	0	111.3	V47 T78 L79 I113 S131 C132	V47-C111 VanDerWaalsContact CG1-SG 3.58Å; V47-C111 HydrophobicContact CG2-CB 4.22Å; T78-C111 CarbonylContact C-O 3.45Å; T78-C111 WeakPolarHBondContact CA-O 3.36Å; L79-C111 PolarHBondContact N-O 2.92Å; L79-C111 PolarHBondContact O-N 3.18Å; C111-I113 HydrophobicContact CB-CD1 4Å; C111-S131 CarbonylContact C-O 3.53Å; C111-S131 VanDerWaalsContact CA-O 3.22Å; C111-S131 WeakPolarHBondContact CA-O 2.96Å; C111-C132 HydrophobicContact CB-CB 4.2Å; C111-C132 WeakPolarHBondContact CB-SG 3.44Å; C111-C132 WeakPolarHBondContact SG-CB 3.42Å; C111-C132 CovalentContact SG-SG 2.04Å; C111-C132 PolarHBondContact SG-SG 3.41Å
112	R	97.3	Very high	85.8	Confident	161 Å²	161	63.3 Å²	63.3	61%	0.608	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.5	169.7	-69.4	-174.7	174.7	-176.8	-1.4	108.7	K130 S131	R112-K130 HydrophobicContact CB-CB 4.16Å; R112-K130 PolarHBondContact O-N 2.96Å; R112-S131 PolarHBondContact N-O 2.83Å
113	I	95.7	Very high	84	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.4	-176.2	-49.7	-58.8	0	0	0	108.6	V47 E76 Y77 L79 C111 L127 I129	V47-I113 HydrophobicContact CG2-CD1 3.83Å; E76-I113 VanDerWaalsContact CA-O 3.29Å; E76-I113 WeakPolarHBondContact CA-O 3.22Å; Y77-I113 HydrophobicContact CD1-CB 4.28Å; Y77-I113 HydrophobicContact CD2-CB 4.1Å; Y77-I113 HydrophobicContact CD2-CG1 4.23Å; Y77-I113 HydrophobicContact CE1-CB 3.86Å; Y77-I113 HydrophobicContact CE1-CG2 3.76Å; Y77-I113 HydrophobicContact CE2-CB 3.69Å; Y77-I113 HydrophobicContact CE2-CG1 3.72Å; Y77-I113 HydrophobicContact CE2-CG2 4.1Å; Y77-I113 HydrophobicContact CG-CB 4.39Å; Y77-I113 VanDerWaalsContact CZ-CG2 3.49Å; Y77-I113 PolarHBondContact N-O 2.98Å; Y77-I113 PolarHBondContact O-N 3.5Å; Y77-I113 WeakPolarHBondContact OH-CG2 3.46Å; L79-I113 HydrophobicContact CB-CG1 3.87Å; L79-I113 HydrophobicContact CD2-CD1 4.47Å; L79-I113 HydrophobicContact CD2-CG1 4.31Å; C111-I113 HydrophobicContact CB-CD1 4Å; I113-L127 HydrophobicContact CG2-CD1 3.49Å; I113-L127 VanDerWaalsContact CG2-CD1 3.49Å; I113-I129 HydrophobicContact CD1-CG1 4.01Å; I113-I129 HydrophobicContact CD1-CG2 4.35Å
114	Q	93.2	Very high	82.7	Confident	35 Å²	35	73.7 Å²	73.7	16%	0.164	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.1	175.1	-174.8	-177.5	-26.5	0	0	108.2	L74 F75 E76 T128 K130	L74-Q114 HydrophobicContact CD1-CG 3.44Å; L74-Q114 VanDerWaalsContact CD1-CG 3.44Å; L74-Q114 HydrophobicContact CG-CG 4.41Å; F75-Q114 CarbonylContact O-C 3.53Å; F75-Q114 WeakPolarHBondContact O-CA 3.48Å; E76-Q114 HydrophobicContact CG-CB 4.43Å; E76-Q114 HydrophobicContact CG-CG 4.12Å; Q114-T128 PolarHBondContact N-O 2.84Å; Q114-T128 PolarHBondContact O-N 3.41Å; Q114-K130 HydrophobicContact CB-CD 4.09Å; Q114-K130 HydrophobicContact CB-CG 3.82Å; Q114-K130 VanDerWaalsContact OE1-CE 3.25Å
115	F	90.9	Very high	82	Confident	8 Å²	8	73.3 Å²	73.3	4%	0.035	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.8	176.9	179.1	-113.5	0	0	0	110.4	I39 F75 L117 N125 Q126 L127	I39-F115 HydrophobicContact CD1-CD2 4.44Å; I39-F115 HydrophobicContact CD1-CE1 4.02Å; I39-F115 HydrophobicContact CD1-CE2 3.65Å; I39-F115 HydrophobicContact CD1-CZ 3.4Å; I39-F115 HydrophobicContact CG1-CD1 4.39Å; I39-F115 HydrophobicContact CG1-CE1 3.86Å; I39-F115 HydrophobicContact CG1-CE2 4.28Å; I39-F115 HydrophobicContact CG1-CZ 3.79Å; I39-F115 HydrophobicContact CG2-CB 4.19Å; I39-F115 HydrophobicContact CG2-CD1 3.95Å; I39-F115 HydrophobicContact CG2-CD2 3.87Å; I39-F115 HydrophobicContact CG2-CE1 4.23Å; I39-F115 HydrophobicContact CG2-CE2 4.18Å; I39-F115 HydrophobicContact CG2-CG 3.74Å; I39-F115 HydrophobicContact CG2-CZ 4.34Å; F75-F115 HydrophobicContact CB-CB 4.34Å; F75-F115 AromaticContact CD2-CD1 3.92Å; F75-F115 HydrophobicContact CD2-CD1 3.92Å; F75-F115 PolarHBondContact N-O 3.28Å; F75-F115 PolarHBondContact O-N 2.8Å; F115-L117 HydrophobicContact CD1-CD2 4.33Å; F115-L117 HydrophobicContact CD1-CG 4.18Å; F115-L117 HydrophobicContact CE1-CD1 4.16Å; F115-L117 HydrophobicContact CE1-CD2 3.26Å; F115-L117 HydrophobicContact CE1-CG 3.49Å; F115-L117 VanDerWaalsContact CE1-CG 3.49Å; F115-L117 HydrophobicContact CE2-CD2 4.47Å; F115-L117 HydrophobicContact CZ-CD2 3.35Å; F115-L117 HydrophobicContact CZ-CG 4.08Å; F115-N125 HydrophobicContact CE2-CB 3.62Å; F115-N125 HydrophobicContact CZ-CB 3.66Å; F115-Q126 VanDerWaalsContact CA-O 3.32Å; F115-Q126 WeakPolarHBondContact CA-O 3.19Å; F115-L127 HydrophobicContact CB-CD1 4.17Å; F115-L127 HydrophobicContact CD2-CB 4.08Å; F115-L127 HydrophobicContact CD2-CD1 4.17Å
116	L	87.9	Confident	81.9	Confident	47 Å²	47	73.1 Å²	73.1	25%	0.246	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.1	-179.7	178.8	63.5	0	0	0	110.2	V70 L74 N125 Q126	V70-L116 HydrophobicContact CG2-CD1 4.4Å; L74-L116 HydrophobicContact CB-CD1 4.15Å; L74-L116 HydrophobicContact CD1-CB 4.03Å; L74-L116 HydrophobicContact CD1-CD1 4.15Å; L116-N125 VanDerWaalsContact O-CA 3.31Å; L116-N125 WeakPolarHBondContact O-CA 3.34Å; L116-Q126 PolarHBondContact N-O 3.27Å; L116-Q126 PolarHBondContact O-N 3.03Å
117	L	82.9	Confident	82.1	Confident	56 Å²	56	73.8 Å²	73.8	29%	0.293	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	110.6	164.7	-66.7	-178.9	0	0	0	108.4	G72 V73 F75 F115 N125	G72-L117 CarbonylContact C-O 3.57Å; G72-L117 WeakPolarHBondContact CA-O 3.45Å; V73-L117 HydrophobicContact CB-CB 4.38Å; V73-L117 PolarHBondContact N-O 3.35Å; V73-L117 PolarHBondContact O-N 3.1Å; F75-L117 HydrophobicContact CE2-CD1 3.71Å; F75-L117 HydrophobicContact CE2-CG 4.12Å; F75-L117 HydrophobicContact CZ-CD1 4.42Å; F115-L117 HydrophobicContact CD1-CD2 4.33Å; F115-L117 HydrophobicContact CD1-CG 4.18Å; F115-L117 HydrophobicContact CE1-CD1 4.16Å; F115-L117 HydrophobicContact CE1-CD2 3.26Å; F115-L117 HydrophobicContact CE1-CG 3.49Å; F115-L117 VanDerWaalsContact CE1-CG 3.49Å; F115-L117 HydrophobicContact CE2-CD2 4.47Å; F115-L117 HydrophobicContact CZ-CD2 3.35Å; F115-L117 HydrophobicContact CZ-CG 4.08Å; L117-N125 HydrophobicContact CD2-CB 4.02Å; L117-N125 WeakPolarHBondContact CD2-ND2 3.15Å; L117-N125 VanDerWaalsContact CD2-OD1 3.25Å; L117-N125 WeakPolarHBondContact CD2-OD1 3.42Å
118	S	80.9	Confident	82.3	Confident	25 Å²	25	73 Å²	73	18%	0.175	36%	0.363	C	S	.	.			trans	-118.6	120.3	173	-168.6	0	0	0	0	110.2	N71 L120	N71-S118 PolarHBondContact O-OG 2.57Å; S118-L120 VanDerWaalsContact C-N 3.32Å
119	P	68.4	Low	82.3	Confident	116 Å²	116	74.4 Å²	74.4	75%	0.753	37%	0.37	S	S	*	.	S	Bend	trans	-76.8	-20.8	176.1	28.6	-31.1	0	0	0	112.8
120	L	63.4	Low	82.3	Confident	143 Å²	143	79.3 Å²	79.3	75%	0.749	39%	0.391	S	S	*	.	S	Bend	trans	-89.6	-20.8	-169.6	-62.4	174.7	0	0	0	113.5	S118	S118-L120 VanDerWaalsContact C-N 3.32Å
121	V	62.3	Low	82.3	Confident	80 Å²	80	81.2 Å²	81.2	49%	0.485	41%	0.405	S	S	.	.			trans	-97	115.9	178.9	-174.5	0	0	0	0	107.6	Q123	V121-Q123 HydrophobicContact CG1-CB 3.97Å; V121-Q123 CarbonylContact O-C 3.59Å; V121-Q123 PolarHBondContact O-N 3.03Å
122	K	58.3	Low	82.3	Confident	211 Å²	211	83.1 Å²	83.1	92%	0.917	42%	0.418	S	S	*	.	S	Bend	trans	-55	-21.2	176	-69.7	-175.7	177.6	-179.3	0	112.6	H124	K122-H124 PolarHBondContact O-N 3.5Å
123	Q	54.9	Low	82.2	Confident	160 Å²	160	82.4 Å²	82.4	75%	0.748	42%	0.42	S	S	*	.	S	Bend	trans	-85.8	99.6	171.1	-78.9	176.2	-20.4	0	0	111.4	V121	V121-Q123 HydrophobicContact CG1-CB 3.97Å; V121-Q123 CarbonylContact O-C 3.59Å; V121-Q123 PolarHBondContact O-N 3.03Å
124	H	64	Low	82.1	Confident	170 Å²	170	88.4 Å²	88.4	79%	0.787	45%	0.448	S	S	*	.			trans	12.3	136.1	153.5	-60.6	-73.7	0	0	0	120.1	K122 Q126	K122-H124 PolarHBondContact O-N 3.5Å; H124-Q126 PolarHBondContact O-N 2.86Å
125	N	74.2	Confident	81.8	Confident	91 Å²	91	87.7 Å²	87.7	49%	0.487	45%	0.445	S	S	.	.			trans	-27.5	121.1	161.1	-56.2	-16.1	0	0	0	113.1	F115 L116 L117	F115-N125 HydrophobicContact CE2-CB 3.62Å; F115-N125 HydrophobicContact CZ-CB 3.66Å; L116-N125 VanDerWaalsContact O-CA 3.31Å; L116-N125 WeakPolarHBondContact O-CA 3.34Å; L117-N125 HydrophobicContact CD2-CB 4.02Å; L117-N125 WeakPolarHBondContact CD2-ND2 3.15Å; L117-N125 VanDerWaalsContact CD2-OD1 3.25Å; L117-N125 WeakPolarHBondContact CD2-OD1 3.42Å
126	Q	85.3	Confident	81.1	Confident	115 Å²	115	93.5 Å²	93.5	54%	0.537	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.3	-174.1	-176.1	179.5	-23	0	0	110.7	F115 L116 H124 T128	F115-Q126 VanDerWaalsContact CA-O 3.32Å; F115-Q126 WeakPolarHBondContact CA-O 3.19Å; L116-Q126 PolarHBondContact N-O 3.27Å; L116-Q126 PolarHBondContact O-N 3.03Å; H124-Q126 PolarHBondContact O-N 2.86Å; Q126-T128 PolarHBondContact NE2-OG1 2.97Å; Q126-T128 VanDerWaalsContact NE2-OG1 3.08Å
127	L	90.9	Very high	80.3	Confident	36 Å²	36	95.7 Å²	95.7	19%	0.188	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.1	171.1	-178.2	64.1	0	0	0	109.9	I39 Q42 L46 I113 F115	I39-L127 HydrophobicContact CG2-CD1 4.21Å; Q42-L127 HydrophobicContact CB-CD2 3.9Å; L46-L127 HydrophobicContact CD2-CD2 4.18Å; L46-L127 HydrophobicContact CD2-CG 4.13Å; I113-L127 HydrophobicContact CG2-CD1 3.49Å; I113-L127 VanDerWaalsContact CG2-CD1 3.49Å; F115-L127 HydrophobicContact CB-CD1 4.17Å; F115-L127 HydrophobicContact CD2-CB 4.08Å; F115-L127 HydrophobicContact CD2-CD1 4.17Å
128	T	93.5	Very high	79.4	Confident	39 Å²	39	93.2 Å²	93.2	24%	0.239	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	137.8	-175.6	-58.6	0	0	0	0	110.9	Q114 Q126 K130	Q114-T128 PolarHBondContact N-O 2.84Å; Q114-T128 PolarHBondContact O-N 3.41Å; Q126-T128 PolarHBondContact NE2-OG1 2.97Å; Q126-T128 VanDerWaalsContact NE2-OG1 3.08Å; T128-K130 HydrophobicContact CG2-CD 4.21Å
129	I	95.2	Very high	78.3	Confident	30 Å²	30	95.2 Å²	95.2	15%	0.154	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.7	170.7	-57.6	165.6	0	0	0	107.6	L46 V47 M50 I113 C132	L46-I129 HydrophobicContact CB-CD1 4.28Å; L46-I129 HydrophobicContact CD2-CD1 4.03Å; L46-I129 HydrophobicContact CD2-CG1 4.09Å; L46-I129 HydrophobicContact CG-CD1 3.72Å; L46-I129 HydrophobicContact CG-CG1 4.34Å; V47-I129 HydrophobicContact CB-CD1 4.19Å; V47-I129 HydrophobicContact CG2-CD1 3.53Å; V47-I129 HydrophobicContact CG2-CG1 3.89Å; M50-I129 HydrophobicContact CB-CD1 4.27Å; M50-I129 HydrophobicContact CE-CD1 4.07Å; M50-I129 HydrophobicContact CE-CG2 3.81Å; M50-I129 HydrophobicContact SD-CB 4.2Å; M50-I129 HydrophobicContact SD-CD1 3.78Å; M50-I129 HydrophobicContact SD-CG2 4.08Å; I113-I129 HydrophobicContact CD1-CG1 4.01Å; I113-I129 HydrophobicContact CD1-CG2 4.35Å; I129-C132 VanDerWaalsContact CG2-SG 3.59Å
130	K	96.2	Very high	77.9	Confident	123 Å²	123	93.5 Å²	93.5	54%	0.535	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-39.7	-177.3	-62.2	-67.9	-78.1	-150.8	0	112.3	R112 Q114 T128	R112-K130 HydrophobicContact CB-CB 4.16Å; R112-K130 PolarHBondContact O-N 2.96Å; Q114-K130 HydrophobicContact CB-CD 4.09Å; Q114-K130 HydrophobicContact CB-CG 3.82Å; Q114-K130 VanDerWaalsContact OE1-CE 3.25Å; T128-K130 HydrophobicContact CG2-CD 4.21Å
131	S	96.2	Very high	77.7	Confident	57 Å²	57	90.6 Å²	90.6	40%	0.399	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	150.7	179.9	62.3	0	0	0	0	109.8	C111 R112	C111-S131 CarbonylContact C-O 3.53Å; C111-S131 VanDerWaalsContact CA-O 3.22Å; C111-S131 WeakPolarHBondContact CA-O 2.96Å; R112-S131 PolarHBondContact N-O 2.83Å
132	C	96.7	Very high	77.2	Confident	41 Å²	41	90.3 Å²	90.3	28%	0.277	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.4	166.2	-71.1	0	0	0	0	109.3	M50 L51 V110 C111 I129	M50-C132 HydrophobicContact CE-CB 4.16Å; M50-C132 VanDerWaalsContact CE-SG 3.53Å; L51-C132 HydrophobicContact CD2-CB 4.47Å; V110-C132 WeakPolarHBondContact O-CA 3.01Å; C111-C132 HydrophobicContact CB-CB 4.2Å; C111-C132 WeakPolarHBondContact CB-SG 3.44Å; C111-C132 WeakPolarHBondContact SG-CB 3.42Å; C111-C132 CovalentContact SG-SG 2.04Å; C111-C132 PolarHBondContact SG-SG 3.41Å; I129-C132 VanDerWaalsContact CG2-SG 3.59Å
133	K	95.3	Very high	76.8	Confident	146 Å²	146	85.4 Å²	85.4	64%	0.635	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.6	173.7	62.7	-179.7	-179	177.3	0	110.5	Q109 V110	Q109-K133 CarbonylContact C-O 3.44Å; Q109-K133 WeakPolarHBondContact CA-O 3.5Å; Q109-K133 PolarHBondContact OE1-O 3.48Å; V110-K133 HydrophobicContact CB-CG 4.31Å; V110-K133 PolarHBondContact N-O 3.14Å; V110-K133 PolarHBondContact O-N 2.91Å
134	Q	93.3	Very high	76.7	Confident	128 Å²	128	85.2 Å²	85.2	60%	0.598	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	137.1	173	-76.1	-179.8	-2	0	0	111	I107	I107-Q134 HydrophobicContact CG2-CB 3.58Å; I107-Q134 HydrophobicContact CG2-CG 3.75Å
135	D	86.8	Confident	76	Confident	20 Å²	20	84.2 Å²	84.2	11%	0.107	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	109.8	175.3	-170.5	20.5	0	0	0	111.1	G108 V110 N137	G108-D135 PolarHBondContact N-O 3.44Å; G108-D135 PolarHBondContact O-N 3.24Å; V110-D135 HydrophobicContact CG2-CB 3.51Å; D135-N137 VanDerWaalsContact C-N 3.26Å; D135-N137 VanDerWaalsContact OD1-CB 3.29Å; D135-N137 WeakPolarHBondContact OD1-CB 3.23Å; D135-N137 PolarHBondContact OD1-N 3.1Å; D135-N137 PolarHBondContact OD1-ND2 3.17Å; D135-N137 VanDerWaalsContact OD1-ND2 3.17Å
136	M	77.1	Confident	74.2	Confident	130 Å²	130	82 Å²	82	64%	0.64	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.3	174	-64.5	-177.5	179.2	0	0	112.1	S138 M139 N140	M136-S138 VanDerWaalsContact C-N 3.27Å; M136-S138 PolarHBondContact O-N 3.36Å; M136-M139 WeakPolarHBondContact O-CB 3.43Å; M136-M139 PolarHBondContact O-N 2.65Å; M136-M139 VanDerWaalsContact O-N 3.11Å; M136-N140 PolarHBondContact O-N 3.15Å
137	N	71	Confident	72.4	Confident	93 Å²	93	81.7 Å²	81.7	50%	0.497	41%	0.411	S	S	.	.	H	α-helix	trans	-68	-27.2	-178.6	-64.9	-41.9	0	0	0	113.2	D135 M139 N140 N141	D135-N137 VanDerWaalsContact C-N 3.26Å; D135-N137 VanDerWaalsContact OD1-CB 3.29Å; D135-N137 WeakPolarHBondContact OD1-CB 3.23Å; D135-N137 PolarHBondContact OD1-N 3.1Å; D135-N137 PolarHBondContact OD1-ND2 3.17Å; D135-N137 VanDerWaalsContact OD1-ND2 3.17Å; N137-M139 VanDerWaalsContact C-N 3.25Å; N137-M139 PolarHBondContact O-N 3.1Å; N137-N140 PolarHBondContact O-N 2.72Å; N137-N140 VanDerWaalsContact O-N 3.1Å; N137-N140 PolarHBondContact OD1-ND2 2.84Å; N137-N141 PolarHBondContact O-N 2.03Å
138	S	64.2	Low	70.5	Confident	3 Å²	3	87.1 Å²	87.1	2%	0.021	44%	0.439	C	S	.	.	H	α-helix	trans	-51.6	-46.9	169.4	-179.3	0	0	0	0	111	T82 Y104 T106 M136 N141 Y142	T82-S138 PolarHBondContact OG1-OG 2.79Å; Y104-S138 CarbonylContact O-C 3.58Å; Y104-S138 VanDerWaalsContact O-C 3.24Å; T106-S138 WeakPolarHBondContact O-CB 2.83Å; T106-S138 PolarHBondContact O-OG 2.79Å; M136-S138 VanDerWaalsContact C-N 3.27Å; M136-S138 PolarHBondContact O-N 3.36Å; S138-N141 PolarHBondContact O-N 3.38Å; S138-Y142 PolarHBondContact O-N 2.82Å
139	M	57.3	Low	67.9	Low	67 Å²	67	87.7 Å²	87.7	33%	0.33	45%	0.445	S	S	.	.	H	α-helix	trans	-69.7	-37.1	175.7	-66.1	-179.7	65.6	0	0	112.9	Y104 I107 M136 N137 N141 Y142 M143	Y104-M139 WeakPolarHBondContact O-CA 3.44Å; Y104-M139 PolarHBondContact O-N 3.21Å; I107-M139 HydrophobicContact CG1-SD 3.67Å; M136-M139 WeakPolarHBondContact O-CB 3.43Å; M136-M139 PolarHBondContact O-N 2.65Å; M136-M139 VanDerWaalsContact O-N 3.11Å; N137-M139 VanDerWaalsContact C-N 3.25Å; N137-M139 PolarHBondContact O-N 3.1Å; M139-N141 VanDerWaalsContact C-N 3.32Å; M139-N141 PolarHBondContact O-N 3.42Å; M139-Y142 WeakPolarHBondContact O-CB 3.39Å; M139-Y142 PolarHBondContact O-N 2.9Å; M139-Y142 VanDerWaalsContact O-N 3.14Å; M139-M143 PolarHBondContact O-N 2.89Å
140	N	59.5	Low	65.3	Low	81 Å²	81	91.1 Å²	91.1	43%	0.433	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-37.3	176.8	-68.1	-24	0	0	0	112.1	M136 N137 Y142 M143 K144	M136-N140 PolarHBondContact O-N 3.15Å; N137-N140 PolarHBondContact O-N 2.72Å; N137-N140 VanDerWaalsContact O-N 3.1Å; N137-N140 PolarHBondContact OD1-ND2 2.84Å; N140-Y142 VanDerWaalsContact C-N 3.32Å; N140-Y142 PolarHBondContact O-N 3.43Å; N140-M143 PolarHBondContact O-N 2.98Å; N140-K144 PolarHBondContact O-N 3.07Å
141	N	59.7	Low	62.6	Low	82 Å²	82	93 Å²	93	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-62.6	-39.8	173.1	-76.4	-26.3	0	0	0	111	N137 S138 M139 K144 H145	N137-N141 PolarHBondContact O-N 2.03Å; S138-N141 PolarHBondContact O-N 3.38Å; M139-N141 VanDerWaalsContact C-N 3.32Å; M139-N141 PolarHBondContact O-N 3.42Å; N141-K144 PolarHBondContact O-N 3.49Å; N141-H145 PolarHBondContact O-CD2 2.9Å; N141-H145 PolarHBondContact O-N 2.92Å; N141-H145 VanDerWaalsContact O-N 3.11Å
142	Y	51.6	Low	59.8	Low	74 Å²	74	101.5 Å²	101.5	29%	0.29	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-43.4	171.1	179	-106.1	0	0	0	112.7	Y104 K105 S138 M139 N140 K144 H145 N146	Y104-Y142 WeakPolarHBondContact O-CB 3.24Å; K105-Y142 HydrophobicContact CB-CD1 4.3Å; K105-Y142 HydrophobicContact CB-CG 4.42Å; K105-Y142 HydrophobicContact CD-CD1 4.24Å; K105-Y142 HydrophobicContact CD-CD2 4.35Å; K105-Y142 HydrophobicContact CD-CE1 3.7Å; K105-Y142 HydrophobicContact CD-CE2 3.86Å; K105-Y142 WeakPolarHBondContact CE-OH 3.46Å; K105-Y142 HydrophobicContact CG-CD1 3.79Å; K105-Y142 HydrophobicContact CG-CD2 3.7Å; K105-Y142 HydrophobicContact CG-CE1 3.78Å; K105-Y142 HydrophobicContact CG-CE2 3.73Å; K105-Y142 HydrophobicContact CG-CG 3.74Å; K105-Y142 PolarHBondContact NZ-OH 2.95Å; S138-Y142 PolarHBondContact O-N 2.82Å; M139-Y142 WeakPolarHBondContact O-CB 3.39Å; M139-Y142 PolarHBondContact O-N 2.9Å; M139-Y142 VanDerWaalsContact O-N 3.14Å; N140-Y142 VanDerWaalsContact C-N 3.32Å; N140-Y142 PolarHBondContact O-N 3.43Å; Y142-K144 PolarHBondContact O-N 2.88Å; Y142-H145 CarbonylContact O-C 3.48Å; Y142-H145 PolarHBondContact O-N 2.6Å; Y142-H145 VanDerWaalsContact O-N 3.14Å; Y142-N146 HydrophobicContact CE1-CB 4.41Å; Y142-N146 WeakPolarHBondContact O-CB 3.45Å; Y142-N146 PolarHBondContact O-N 2.83Å
143	M	50.7	Low	57	Low	107 Å²	107	109.3 Å²	109.3	53%	0.527	53%	0.534	S	S	.	.	H	α-helix	trans	-62.9	-30.3	175.3	-67.9	-166.3	-179.9	0	0	112.6	M139 N140 S149	M139-M143 PolarHBondContact O-N 2.89Å; N140-M143 PolarHBondContact O-N 2.98Å; M143-S149 WeakPolarHBondContact O-CB 3.28Å; M143-S149 PolarHBondContact O-OG 3.41Å
144	K	52.9	Low	54	Low	156 Å²	156	111.9 Å²	111.9	68%	0.678	55%	0.549	S	S	*	.	H	α-helix	trans	-72.8	-31.1	174.9	-165.6	179.9	178.2	-171.8	0	112.7	N140 N141 Y142	N140-K144 PolarHBondContact O-N 3.07Å; N141-K144 PolarHBondContact O-N 3.49Å; Y142-K144 PolarHBondContact O-N 2.88Å
145	H	49.2	Very low	51	Low	149 Å²	149	109.6 Å²	109.6	69%	0.69	56%	0.56	S	S	*	*	H	α-helix	trans	-96.5	-8.8	-178.6	-70.2	-65.4	0	0	0	114.7	N141 Y142 P147	N141-H145 PolarHBondContact O-CD2 2.9Å; N141-H145 PolarHBondContact O-N 2.92Å; N141-H145 VanDerWaalsContact O-N 3.11Å; Y142-H145 CarbonylContact O-C 3.48Å; Y142-H145 PolarHBondContact O-N 2.6Å; Y142-H145 VanDerWaalsContact O-N 3.14Å; H145-P147 WeakPolarHBondContact O-CD 3.25Å
146	N	35	Very low	48.4	Very low	46 Å²	46	114.1 Å²	114.1	25%	0.246	59%	0.593	C	S	.	*	S	Bend	trans	-78	117.4	171	-174.2	14.4	0	0	0	109.4	Y142 L148 S149	Y142-N146 HydrophobicContact CE1-CB 4.41Å; Y142-N146 WeakPolarHBondContact O-CB 3.45Å; Y142-N146 PolarHBondContact O-N 2.83Å; N146-L148 PolarHBondContact O-N 3.31Å; N146-S149 PolarHBondContact O-N 3.19Å; N146-S149 PolarHBondContact O-OG 3.03Å; N146-S149 VanDerWaalsContact O-OG 3.1Å
147	P	48	Very low	46.3	Very low	108 Å²	108	118.3 Å²	118.3	70%	0.701	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-58.8	-20.9	-175.8	18.4	-30.1	0	0	0	114.2	H145 S149	H145-P147 WeakPolarHBondContact O-CD 3.25Å; P147-S149 PolarHBondContact O-N 3.19Å
148	L	50.4	Low	44.4	Very low	150 Å²	150	123 Å²	123	79%	0.785	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-76.9	-13.9	177.1	-70.8	168.6	0	0	0	114.7	N146	N146-L148 PolarHBondContact O-N 3.31Å
149	S	39.7	Very low	42.8	Very low	51 Å²	51	131.8 Å²	131.8	36%	0.357	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-108	4	-178.2	34.8	0	0	0	0	114.7	M143 N146 P147 L151	M143-S149 WeakPolarHBondContact O-CB 3.28Å; M143-S149 PolarHBondContact O-OG 3.41Å; N146-S149 PolarHBondContact O-N 3.19Å; N146-S149 PolarHBondContact O-OG 3.03Å; N146-S149 VanDerWaalsContact O-OG 3.1Å; P147-S149 PolarHBondContact O-N 3.19Å; S149-L151 VanDerWaalsContact C-N 3.25Å; S149-L151 PolarHBondContact O-N 3.37Å
150	V	40.6	Very low	41.4	Very low	101 Å²	101	134.2 Å²	134.2	61%	0.612	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-9.2	176.5	-177.4	0	0	0	0	112.7	R152	V150-R152 VanDerWaalsContact C-N 3.27Å; V150-R152 PolarHBondContact O-N 3.33Å; V150-R152 VanDerWaalsContact O-N 3.16Å
151	L	39.5	Very low	40.7	Very low	164 Å²	164	143.3 Å²	143.3	86%	0.859	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	10.5	-178.2	-74.3	175	0	0	0	116.4	S149	S149-L151 VanDerWaalsContact C-N 3.25Å; S149-L151 PolarHBondContact O-N 3.37Å
152	R	38.1	Very low	39.7	Very low	235 Å²	235	146.4 Å²	146.4	89%	0.887	73%	0.734	S	S	*	*			trans	-139.3	69.9	171.8	-74.8	-168.4	-165.3	142.9	2.7	113.3	V150	V150-R152 VanDerWaalsContact C-N 3.27Å; V150-R152 PolarHBondContact O-N 3.33Å; V150-R152 VanDerWaalsContact O-N 3.16Å
153	K	37.2	Very low	39.1	Very low	205 Å²	205	150.2 Å²	150.2	89%	0.891	76%	0.758	S	S	*	*			trans	-144.7	63.4	149	-74.8	-162.1	178.8	-176.1	0	110.1
154	Q	33.3	Very low	38.4	Very low	200 Å²	200	152.6 Å²	152.6	94%	0.935	77%	0.77	S	S	*	*			trans	-93.5	129.2	156	-77	-174	-7.6	0	0	108.1
155	G	29.5	Very low	37.6	Very low	80 Å²	80	152.4 Å²	152.4	83%	0.825	78%	0.776	S	S	*	*			trans	104.1	83.3	164.2	0	0	0	0	0	115.4
156	S	32.1	Very low	36.9	Very low	115 Å²	115	152.6 Å²	152.6	80%	0.804	78%	0.781	S	S	*	*				-171.1	80.5	121.4	-157.9	0	0	0	0	108.7	K158	S156-K158 PolarHBondContact O-N 3.25Å
157	F	32.8	Very low	37	Very low	217 Å²	217	159.7 Å²	159.7	95%	0.952	82%	0.817	S	S	*	*			trans	-77.4	98	165.6	-118.9	-95.5	0	0	0	106.5	K159	F157-K159 PolarHBondContact O-N 3.1Å; F157-K159 VanDerWaalsContact O-N 3.16Å
158	K	31.4	Very low	36.2	Very low	191 Å²	191	163.4 Å²	163.4	83%	0.83	83%	0.825	S	S	*	*			trans	-70.2	106.9	167.5	-113	-179	176.6	-175.3	0	107.1	S156 C160	S156-K158 PolarHBondContact O-N 3.25Å; K158-C160 PolarHBondContact O-N 3.03Å
159	K	30	Very low	35.1	Very low	188 Å²	188	164.5 Å²	164.5	82%	0.817	83%	0.828	S	S	*	*			trans	-63.4	121	173.5	-131.7	173.2	-178.8	-178.8	0	108	F157 F161	F157-K159 PolarHBondContact O-N 3.1Å; F157-K159 VanDerWaalsContact O-N 3.16Å; K159-F161 PolarHBondContact O-N 2.9Å
160	C	28	Very low	34.7	Very low	119 Å²	119	173.9 Å²	173.9	80%	0.804	87%	0.867	S	S	*	*			trans	-78.9	105.8	160.7	-62.9	0	0	0	0	107.1	K158	K158-C160 PolarHBondContact O-N 3.03Å
161	F	44.3	Very low	34.2	Very low	272 Å²	272	180.5 Å²	180.5	100%	1.193	89%	0.891	S	S	*	*			trans	-159.1	0	148.7	-85.8	-69.6	0	0	0	107	K159	K159-F161 PolarHBondContact O-N 2.9Å

Retrieved 161 of 161 residues in 299 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).