A0A096MIP5_POEFO Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession A0A096MIP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 373 aa.

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(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	40.1	Very low	37.2	Very low	240 Å²	240	165.5 Å²	165.5	100%	1.182	88%	0.88	S	S	*	*				0	138.9	0	-95.3	174.2	169.3	0	0	107.7
2	L	33.4	Very low	38	Very low	159 Å²	159	160.9 Å²	160.9	83%	0.832	87%	0.872	S	S	*	*			trans	89.4	93.8	177.2	-65.1	148.2	0	0	0	117.3
3	D	37.8	Very low	38.4	Very low	161 Å²	161	164.4 Å²	164.4	86%	0.861	87%	0.874	S	S	*	*				32.9	141.7	124.6	-60.5	-41.5	0	0	0	122.5
4	G	32.1	Very low	38.7	Very low	76 Å²	76	162.9 Å²	162.9	78%	0.784	88%	0.875	S	S	*	*			trans	167.4	104.4	155.4	0	0	0	0	0	115.7
5	H	40.1	Very low	38.7	Very low	190 Å²	190	161.7 Å²	161.7	88%	0.88	88%	0.875	S	S	*	*			trans	-47.8	144.3	167.5	-83	-96.6	0	0	0	114.7
6	L	35.2	Very low	39.2	Very low	160 Å²	160	161.8 Å²	161.8	84%	0.838	87%	0.873	S	S	*	*				154	127.4	125.2	-102.5	97.9	0	0	0	107.9
7	L	39	Very low	39.4	Very low	169 Å²	169	160 Å²	160	89%	0.885	87%	0.868	S	S	*	*			trans	177.9	84.4	130.3	-90.5	166.1	0	0	0	107.9
8	L	37.9	Very low	39	Very low	179 Å²	179	162.2 Å²	162.2	94%	0.937	87%	0.871	S	S	*	*			trans	-64.2	134.4	149.1	-101.5	90.3	0	0	0	108
9	G	41.1	Very low	39.1	Very low	59 Å²	59	162.4 Å²	162.4	61%	0.608	87%	0.871	S	S	*	*			trans	132.9	135.8	169.3	0	0	0	0	0	109.7
10	W	37.2	Very low	39	Very low	248 Å²	248	162.6 Å²	162.6	94%	0.939	87%	0.871	S	S	*	*			trans	95.9	43.2	175.5	-56.7	65.7	0	0	0	116.8
11	L	35.3	Very low	38.8	Very low	179 Å²	179	160.3 Å²	160.3	94%	0.937	87%	0.868	S	S	*	*			trans	-138	39.3	154.8	-77.5	177.2	0	0	0	112.3
12	S	46.2	Very low	38.4	Very low	111 Å²	111	156.6 Å²	156.6	78%	0.776	85%	0.852	S	S	*	*			trans	-124.5	69.9	169.1	-81	0	0	0	0	109.6
13	F	43.3	Very low	38.2	Very low	206 Å²	206	154.8 Å²	154.8	90%	0.904	85%	0.849	S	S	*	*	S	Bend	trans	-177.1	94.2	158.4	-105.1	-76	0	0	0	106.7
14	T	43.7	Very low	37.9	Very low	144 Å²	144	149.5 Å²	149.5	88%	0.883	83%	0.833	S	S	*	*	S	Bend	trans	156.5	41.3	156.4	44	0	0	0	0	113.9
15	V	38.3	Very low	37.8	Very low	144 Å²	144	152.6 Å²	152.6	87%	0.873	84%	0.839	S	S	*	*			trans	-143.9	51.8	158.8	-162.8	0	0	0	0	110.7
16	I	45.8	Very low	37.5	Very low	164 Å²	164	150 Å²	150	84%	0.841	84%	0.837	S	S	*	*			trans	-129.4	61.2	167.1	-52.7	174.7	0	0	0	108.5
17	V	43.3	Very low	37.5	Very low	131 Å²	131	146.6 Å²	146.6	79%	0.794	82%	0.823	S	S	*	*	S	Bend	trans	-159.9	75.3	154.7	-171.2	0	0	0	0	108.4
18	H	33	Very low	37.2	Very low	199 Å²	199	140.1 Å²	140.1	92%	0.921	79%	0.794	S	S	*	*			trans	-161.1	47.2	155.2	-95.1	-50	0	0	0	110.7
19	L	40	Very low	37.5	Very low	167 Å²	167	134.5 Å²	134.5	87%	0.874	76%	0.761	S	S	*	*			trans	-122	49.1	171.4	-98	162.4	0	0	0	110.2
20	L	37.5	Very low	37.5	Very low	166 Å²	166	132.1 Å²	132.1	87%	0.869	73%	0.733	S	S	*	*			trans	-145.4	91	170.2	-88.3	167.5	0	0	0	110
21	S	33.9	Very low	37.9	Very low	115 Å²	115	120.9 Å²	120.9	80%	0.804	70%	0.695	S	S	*	*			trans	166.3	57.3	138.7	46.9	0	0	0	0	110.5	P23	S21-P23 VanDerWaalsContact O-CD 3.25Å; S21-P23 WeakPolarHBondContact O-CD 3.02Å
22	L	31.4	Very low	38.4	Very low	161 Å²	161	113.4 Å²	113.4	84%	0.843	66%	0.656	S	S	*	*			trans	-71.6	115.6	152.9	-87.1	150.6	0	0	0	106.4	G24	L22-G24 PolarHBondContact O-N 3.11Å
23	P	30.9	Very low	38.4	Very low	121 Å²	121	109 Å²	109	79%	0.786	62%	0.624	S	S	*	*			trans	-60.6	127.8	167.4	24.7	-30.3	0	0	0	107.9	S21	S21-P23 VanDerWaalsContact O-CD 3.25Å; S21-P23 WeakPolarHBondContact O-CD 3.02Å
24	G	30.1	Very low	38.1	Very low	51 Å²	51	99.7 Å²	99.7	53%	0.526	59%	0.586	S	S	.	*			trans	-56.9	163.6	-175	0	0	0	0	0	113.8	L22 T26	L22-G24 PolarHBondContact O-N 3.11Å; G24-T26 PolarHBondContact O-N 2.84Å
25	P	31.5	Very low	38	Very low	140 Å²	140	98.3 Å²	98.3	91%	0.909	57%	0.574	S	S	*	*			trans	-66.7	102.3	-177.7	28.1	-32.7	0	0	0	109.7
26	T	32.4	Very low	37.8	Very low	136 Å²	136	97.4 Å²	97.4	83%	0.834	56%	0.56	S	S	*	*			trans	-77.6	128.1	166.3	38.6	0	0	0	0	108.4	G24	G24-T26 PolarHBondContact O-N 2.84Å
27	T	34.9	Very low	37.2	Very low	89 Å²	89	92 Å²	92	55%	0.546	54%	0.535	S	S	.	.			trans	-62.3	145.7	-174.5	42.8	0	0	0	0	112.3	Y29	T27-Y29 PolarHBondContact OG1-OH 2.98Å
28	A	33.1	Very low	36.9	Very low	32 Å²	32	90.2 Å²	90.2	26%	0.264	52%	0.521	S	S	.	.			trans	-108.9	122.2	-169.9	0	0	0	0	0	108.2	T33 E65	A28-T33 HydrophobicContact CB-CG2 3.64Å; A28-T33 WeakPolarHBondContact O-CG2 3.47Å; A28-E65 HydrophobicContact CB-CG 4.34Å; A28-E65 PolarHBondContact N-OE1 2Å; A28-E65 VanDerWaalsContact O-CD 3.24Å; A28-E65 WeakPolarHBondContact O-CG 3.39Å
29	Y	43.6	Very low	37	Very low	62 Å²	62	84.5 Å²	84.5	24%	0.243	50%	0.503	C	S	.	.	B	Isolated β-bridge	trans	-106.7	124.6	-169.2	-71.5	-62.9	0	0	0	116.8	T27 L32 T33 R186	T27-Y29 PolarHBondContact OG1-OH 2.98Å; Y29-L32 CarbonylContact O-C 3.55Å; Y29-L32 WeakPolarHBondContact O-CA 3.21Å; Y29-L32 WeakPolarHBondContact O-CB 3.32Å; Y29-L32 PolarHBondContact O-N 3.24Å; Y29-T33 WeakPolarHBondContact O-CA 2.95Å; Y29-T33 WeakPolarHBondContact O-CB 3.48Å; Y29-T33 WeakPolarHBondContact O-CG2 3.45Å; Y29-T33 PolarHBondContact O-N 2.93Å; Y29-T33 PolarHBondContact O-OG1 2.96Å; Y29-T33 VanDerWaalsContact O-OG1 3.13Å; Y29-R186 HydrophobicContact CE1-CG 4.13Å; Y29-R186 VanDerWaalsContact CE1-NH2 3.25Å; Y29-R186 VanDerWaalsContact CZ-NE 3.34Å
30	F	42.4	Very low	36.9	Very low	8 Å²	8	81.4 Å²	81.4	4%	0.035	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	143.2	-166.4	-122.8	-105.5	0	0	0	116.4	L32 T33 L62 K63 L64 Q68 I86 F182 L183	F30-L32 PolarHBondContact O-N 2.84Å; F30-T33 VanDerWaalsContact CA-OG1 3.29Å; F30-T33 WeakPolarHBondContact CA-OG1 3.48Å; F30-T33 HydrophobicContact CD2-CG2 3.33Å; F30-T33 WeakPolarHBondContact CD2-OG1 3.37Å; F30-T33 HydrophobicContact CE2-CG2 3.69Å; F30-T33 WeakPolarHBondContact CE2-OG1 3.3Å; F30-T33 HydrophobicContact CG-CG2 4.31Å; F30-L62 HydrophobicContact CE1-CB 4.4Å; F30-L62 HydrophobicContact CE1-CD2 4.35Å; F30-L62 HydrophobicContact CZ-CB 3.8Å; F30-L62 HydrophobicContact CZ-CD2 4.35Å; F30-L62 HydrophobicContact CZ-CG 4.5Å; F30-K63 WeakPolarHBondContact CE2-O 3.27Å; F30-L64 HydrophobicContact CD1-CD2 3.88Å; F30-L64 HydrophobicContact CD2-CD2 3.31Å; F30-L64 HydrophobicContact CD2-CG 4.11Å; F30-L64 HydrophobicContact CE1-CD2 3.53Å; F30-L64 HydrophobicContact CE1-CG 4.21Å; F30-L64 VanDerWaalsContact CE2-CA 3.43Å; F30-L64 HydrophobicContact CE2-CB 3.91Å; F30-L64 HydrophobicContact CE2-CD2 3.02Å; F30-L64 HydrophobicContact CE2-CG 3.35Å; F30-L64 HydrophobicContact CG-CD2 3.81Å; F30-L64 HydrophobicContact CZ-CB 4.43Å; F30-L64 HydrophobicContact CZ-CD1 4.48Å; F30-L64 HydrophobicContact CZ-CD2 3.15Å; F30-L64 HydrophobicContact CZ-CG 3.42Å; F30-L64 VanDerWaalsContact CZ-CG 3.42Å; F30-Q68 VanDerWaalsContact CD2-OE1 3.3Å; F30-I86 HydrophobicContact CE1-CD1 4.05Å; F30-F182 HydrophobicContact CB-CD1 4.36Å; F30-F182 HydrophobicContact CB-CE1 3.54Å; F30-F182 HydrophobicContact CB-CZ 4.28Å; F30-F182 AromaticContact CD1-CE1 3.75Å; F30-F182 HydrophobicContact CD1-CE1 3.75Å; F30-F182 AromaticContact CD1-CZ 3.86Å; F30-F182 HydrophobicContact CD1-CZ 3.86Å; F30-F182 HydrophobicContact CD2-CE1 4.5Å; F30-F182 HydrophobicContact CD2-CZ 4.45Å; F30-F182 HydrophobicContact CE1-CZ 4.48Å; F30-F182 AromaticContact CG-CE1 3.63Å; F30-F182 HydrophobicContact CG-CE1 3.63Å; F30-F182 AromaticContact CG-CZ 3.89Å; F30-F182 HydrophobicContact CG-CZ 3.89Å; F30-L183 HydrophobicContact CB-CD2 4.22Å
31	G	44.7	Very low	36.8	Very low	13 Å²	13	78.6 Å²	78.6	13%	0.134	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	68	-3.2	-165.5	0	0	0	0	0	113.4	R111	G31-R111 VanDerWaalsContact O-CZ 3.29Å; G31-R111 PolarHBondContact O-NH1 2.69Å; G31-R111 PolarHBondContact O-NH2 3.24Å
32	L	47.4	Very low	36.7	Very low	22 Å²	22	78.4 Å²	78.4	12%	0.115	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-142.5	14.3	-173.4	-58.9	146.2	0	0	0	111	Y29 F30 R111 L115 Y126	Y29-L32 CarbonylContact O-C 3.55Å; Y29-L32 WeakPolarHBondContact O-CA 3.21Å; Y29-L32 WeakPolarHBondContact O-CB 3.32Å; Y29-L32 PolarHBondContact O-N 3.24Å; F30-L32 PolarHBondContact O-N 2.84Å; L32-R111 VanDerWaalsContact CA-NH2 3.3Å; L32-L115 HydrophobicContact CB-CD1 4.02Å; L32-L115 HydrophobicContact CD2-CD1 3.67Å; L32-L115 HydrophobicContact CD2-CD2 3.2Å; L32-L115 HydrophobicContact CD2-CG 3.95Å; L32-L115 HydrophobicContact CG-CD1 4.39Å; L32-Y126 HydrophobicContact CD1-CD1 3.36Å; L32-Y126 HydrophobicContact CD1-CD2 4Å; L32-Y126 HydrophobicContact CD1-CE1 3.12Å; L32-Y126 HydrophobicContact CD1-CE2 3.79Å; L32-Y126 HydrophobicContact CD1-CG 3.81Å; L32-Y126 HydrophobicContact CD2-CD2 3.77Å; L32-Y126 HydrophobicContact CD2-CE1 4.42Å; L32-Y126 HydrophobicContact CD2-CE2 3.5Å; L32-Y126 VanDerWaalsContact CD2-CE2 3.5Å; L32-Y126 HydrophobicContact CD2-CG 4.33Å; L32-Y126 HydrophobicContact CG-CE1 4.33Å; L32-Y126 HydrophobicContact CG-CE2 4.25Å
33	T	45.4	Very low	37.1	Very low	18 Å²	18	77.7 Å²	77.7	11%	0.11	47%	0.469	C	S	.	.			trans	-106	-28.4	-152.7	9.8	0	0	0	0	112.2	A28 Y29 F30 K63	A28-T33 HydrophobicContact CB-CG2 3.64Å; A28-T33 WeakPolarHBondContact O-CG2 3.47Å; Y29-T33 WeakPolarHBondContact O-CA 2.95Å; Y29-T33 WeakPolarHBondContact O-CB 3.48Å; Y29-T33 WeakPolarHBondContact O-CG2 3.45Å; Y29-T33 PolarHBondContact O-N 2.93Å; Y29-T33 PolarHBondContact O-OG1 2.96Å; Y29-T33 VanDerWaalsContact O-OG1 3.13Å; F30-T33 VanDerWaalsContact CA-OG1 3.29Å; F30-T33 WeakPolarHBondContact CA-OG1 3.48Å; F30-T33 HydrophobicContact CD2-CG2 3.33Å; F30-T33 WeakPolarHBondContact CD2-OG1 3.37Å; F30-T33 HydrophobicContact CE2-CG2 3.69Å; F30-T33 WeakPolarHBondContact CE2-OG1 3.3Å; F30-T33 HydrophobicContact CG-CG2 4.31Å; T33-K63 WeakPolarHBondContact CB-O 3.38Å; T33-K63 WeakPolarHBondContact CG2-O 3.2Å
34	G	37.5	Very low	37.3	Very low	10 Å²	10	78.7 Å²	78.7	10%	0.103	47%	0.467	C	S	.	.			trans	-95.1	132	178.7	0	0	0	0	0	109.4	E36	G34-E36 PolarHBondContact O-N 2.8Å; G34-E36 VanDerWaalsContact O-N 3.15Å
35	N	40.2	Very low	37.9	Very low	116 Å²	116	81.7 Å²	81.7	62%	0.62	48%	0.48	S	S	*	.	S	Bend	trans	-65.6	1.8	158.1	-70.6	-22.4	0	0	0	112.6
36	E	33.9	Very low	38.3	Very low	125 Å²	125	81.9 Å²	81.9	58%	0.584	47%	0.473	S	S	*	.	S	Bend	trans	-130.9	148.3	-179.7	-72.2	177.2	162	0	0	110.8	G34 K63	G34-E36 PolarHBondContact O-N 2.8Å; G34-E36 VanDerWaalsContact O-N 3.15Å; E36-K63 VanDerWaalsContact CD-NZ 3.34Å; E36-K63 IonicContact OE2-NZ 3.56Å; E36-K63 PolarHBondContact OE2-NZ 2.82Å
37	P	33.5	Very low	38.6	Very low	50 Å²	50	80.7 Å²	80.7	33%	0.325	47%	0.467	S	S	.	.			trans	-66.4	144.2	175.7	26.1	-30	0	0	0	110.8	S39 E107	P37-S39 PolarHBondContact O-N 2.55Å; P37-E107 HydrophobicContact CB-CG 4.42Å
38	L	37.7	Very low	39	Very low	94 Å²	94	86.2 Å²	86.2	49%	0.492	49%	0.487	S	S	.	.			trans	-72.6	108.3	148.2	-70.7	175.1	0	0	0	105.1	V40 L62 I86	L38-V40 PolarHBondContact O-N 2.9Å; L38-L62 HydrophobicContact CD1-CD2 4.11Å; L38-I86 HydrophobicContact CD1-CB 4.35Å; L38-I86 HydrophobicContact CD1-CD1 3.65Å; L38-I86 HydrophobicContact CD1-CG2 3.79Å
39	S	35.4	Very low	39.5	Very low	78 Å²	78	91.9 Å²	91.9	55%	0.545	51%	0.508	S	S	.	.			trans	-52.7	132.5	163.7	42.7	0	0	0	0	107.5	P37 L41	P37-S39 PolarHBondContact O-N 2.55Å; S39-L41 PolarHBondContact O-N 2.79Å
40	V	38.5	Very low	39.7	Very low	103 Å²	103	92.9 Å²	92.9	62%	0.624	52%	0.524	S	S	*	.			trans	-65.2	82.8	161.4	-178.5	0	0	0	0	104.9	L38	L38-V40 PolarHBondContact O-N 2.9Å
41	L	33.9	Very low	40.3	Very low	106 Å²	106	99.1 Å²	99.1	56%	0.555	56%	0.563	S	S	*	*			trans	-61.7	129.6	176.8	-80.1	166.7	0	0	0	107.3	S39 L43	S39-L41 PolarHBondContact O-N 2.79Å; L41-L43 PolarHBondContact O-N 2.91Å
42	P	33.3	Very low	40.7	Very low	111 Å²	111	100.8 Å²	100.8	72%	0.721	58%	0.58	S	S	*	*			trans	-61	137.4	168.6	1.4	9.1	0	0	0	108.5	N44	P42-N44 VanDerWaalsContact C-N 3.34Å; P42-N44 PolarHBondContact O-N 2.93Å
43	L	39.5	Very low	41.5	Very low	147 Å²	147	108.8 Å²	108.8	77%	0.77	61%	0.609	S	S	*	*			trans	-73.7	82.7	-177.1	-158.7	87.7	0	0	0	109.7	L41	L41-L43 PolarHBondContact O-N 2.91Å
44	N	34.3	Very low	43	Very low	142 Å²	142	110.4 Å²	110.4	76%	0.759	63%	0.625	S	S	*	*			trans	-101.6	115.3	162.2	-77.8	7.8	0	0	0	108.9	P42 L46	P42-N44 VanDerWaalsContact C-N 3.34Å; P42-N44 PolarHBondContact O-N 2.93Å; N44-L46 PolarHBondContact O-N 2.75Å
45	S	43.2	Very low	45	Very low	113 Å²	113	111 Å²	111	79%	0.79	62%	0.624	S	S	*	*			trans	-15.9	112.9	173.4	52	0	0	0	0	115.1
46	L	39.7	Very low	47.1	Very low	144 Å²	144	110 Å²	110	75%	0.754	61%	0.613	S	S	*	*			trans	-80.1	132.4	159.6	-74.5	168.7	0	0	0	108	N44	N44-L46 PolarHBondContact O-N 2.75Å
47	P	38.8	Very low	49.6	Very low	111 Å²	111	110.1 Å²	110.1	72%	0.721	61%	0.611	S	S	*	*			trans	-61.8	142.7	173.9	-10.8	24.6	0	0	0	109.4	E49	P47-E49 PolarHBondContact O-N 2.72Å
48	E	43.4	Very low	52	Low	206 Å²	206	109 Å²	109	96%	0.963	60%	0.603	S	S	*	*			trans	-56.5	100.6	168.2	-74.9	-175.7	134.4	0	0	109.5
49	E	43.9	Very low	54.4	Low	151 Å²	151	104.6 Å²	104.6	71%	0.706	58%	0.579	S	S	*	*			trans	-129.3	112	174.8	-151.4	-176.2	-155.6	0	0	109.6	P47	P47-E49 PolarHBondContact O-N 2.72Å
50	S	46.3	Very low	56.8	Low	83 Å²	83	104.4 Å²	104.4	58%	0.58	57%	0.572	S	S	*	*			trans	31.8	95	177	72.4	0	0	0	0	115.9	G52 R53	S50-G52 PolarHBondContact O-N 3.38Å; S50-R53 PolarHBondContact O-N 2.85Å; S50-R53 VanDerWaalsContact O-N 3.17Å
51	T	54.6	Low	58.9	Low	138 Å²	138	107.5 Å²	107.5	85%	0.847	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.5	-24.1	177.6	45.2	0	0	0	0	115.1
52	G	54.8	Low	61.1	Low	49 Å²	49	102.7 Å²	102.7	51%	0.505	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-25.3	-179.5	0	0	0	0	0	116.6	S50 H55	S50-G52 PolarHBondContact O-N 3.38Å; G52-H55 PolarHBondContact O-CE1 2.99Å
53	R	63.9	Low	63.3	Low	189 Å²	189	101.9 Å²	101.9	71%	0.713	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-12.2	-173.1	-70	-174.9	-176.6	177.6	2.9	115.8	S50 H55 Y56 K57	S50-R53 PolarHBondContact O-N 2.85Å; S50-R53 VanDerWaalsContact O-N 3.17Å; R53-H55 PolarHBondContact O-N 3.4Å; R53-Y56 PolarHBondContact O-N 2.94Å; R53-K57 PolarHBondContact O-N 3.45Å
54	A	75.8	Confident	65.4	Low	53 Å²	53	95.1 Å²	95.1	44%	0.438	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-42.1	-178.3	0	0	0	0	0	112.8	Y56 K57 L58	A54-Y56 VanDerWaalsContact C-N 3.34Å; A54-Y56 PolarHBondContact O-N 3.44Å; A54-K57 WeakPolarHBondContact O-CB 3.45Å; A54-K57 PolarHBondContact O-N 2.04Å; A54-L58 PolarHBondContact O-N 3.48Å
55	H	80.3	Confident	67.7	Low	21 Å²	21	91.3 Å²	91.3	10%	0.097	48%	0.475	C	S	.	.	H	α-helix	trans	-67.3	-31.7	-178.2	76.3	-88.4	0	0	0	112.9	G52 R53 L58 C59 P76 A79	G52-H55 PolarHBondContact O-CE1 2.99Å; R53-H55 PolarHBondContact O-N 3.4Å; H55-L58 PolarHBondContact O-N 3.03Å; H55-C59 PolarHBondContact O-N 2.87Å; H55-C59 PolarHBondContact O-SG 3.05Å; H55-P76 HydrophobicContact CB-CB 4.05Å; H55-A79 HydrophobicContact CB-CB 4.07Å
56	Y	84.9	Confident	69.8	Low	96 Å²	96	93.5 Å²	93.5	38%	0.376	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-45.9	172.8	-72.5	-87.7	0	0	0	111.4	R53 A54 L58 C59 D60 R73	R53-Y56 PolarHBondContact O-N 2.94Å; A54-Y56 VanDerWaalsContact C-N 3.34Å; A54-Y56 PolarHBondContact O-N 3.44Å; Y56-L58 VanDerWaalsContact C-N 3.27Å; Y56-L58 PolarHBondContact O-N 3.28Å; Y56-C59 PolarHBondContact O-N 3.49Å; Y56-D60 PolarHBondContact O-N 2.86Å; Y56-R73 HydrophobicContact CD1-CB 3.99Å; Y56-R73 HydrophobicContact CD1-CG 3.53Å; Y56-R73 HydrophobicContact CE1-CB 3.7Å; Y56-R73 HydrophobicContact CE1-CG 3.8Å; Y56-R73 HydrophobicContact CG-CG 4.47Å
57	K	85.6	Confident	72.1	Confident	127 Å²	127	91.9 Å²	91.9	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-61	-38.3	176.2	-66.1	-179.8	-178.8	175.2	0	110.9	R53 A54 D60 R61	R53-K57 PolarHBondContact O-N 3.45Å; A54-K57 WeakPolarHBondContact O-CB 3.45Å; A54-K57 PolarHBondContact O-N 2.04Å; K57-D60 PolarHBondContact O-N 3.04Å; K57-R61 WeakPolarHBondContact O-CG 3.33Å; K57-R61 PolarHBondContact O-N 3.34Å
58	L	84.9	Confident	74.5	Confident	28 Å²	28	86.6 Å²	86.6	15%	0.147	42%	0.423	C	S	.	.	H	α-helix	trans	-65	-47.9	175.7	-177.3	58.8	0	0	0	111.7	A54 H55 Y56 D60 R61 L62 A79 D80	A54-L58 PolarHBondContact O-N 3.48Å; H55-L58 PolarHBondContact O-N 3.03Å; Y56-L58 VanDerWaalsContact C-N 3.27Å; Y56-L58 PolarHBondContact O-N 3.28Å; L58-D60 PolarHBondContact O-N 2.89Å; L58-R61 PolarHBondContact O-N 3.48Å; L58-L62 WeakPolarHBondContact O-CG 3.35Å; L58-L62 PolarHBondContact O-N 3.17Å; L58-L62 VanDerWaalsContact O-N 3.14Å; L58-A79 HydrophobicContact CB-CB 4.15Å; L58-A79 VanDerWaalsContact CD2-C 3.46Å; L58-A79 HydrophobicContact CD2-CB 3.71Å; L58-A79 HydrophobicContact CG-CB 4.02Å; L58-D80 VanDerWaalsContact CD2-OD1 3.25Å; L58-D80 WeakPolarHBondContact CD2-OD1 3.32Å
59	C	87.1	Confident	76.8	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-59.3	-30	173.2	-67	0	0	0	0	113	H55 Y56 L62 L64 C72 R73 A79	H55-C59 PolarHBondContact O-N 2.87Å; H55-C59 PolarHBondContact O-SG 3.05Å; Y56-C59 PolarHBondContact O-N 3.49Å; C59-L62 WeakPolarHBondContact O-CB 3.31Å; C59-L64 HydrophobicContact CB-CD1 4.33Å; C59-L64 WeakPolarHBondContact O-CD1 3.47Å; C59-C72 VanDerWaalsContact CA-SG 3.58Å; C59-C72 HydrophobicContact CB-CB 3.88Å; C59-C72 WeakPolarHBondContact CB-SG 3.09Å; C59-C72 WeakPolarHBondContact SG-CB 3.38Å; C59-C72 PolarHBondContact SG-O 3.33Å; C59-C72 CovalentContact SG-SG 2.04Å; C59-C72 PolarHBondContact SG-SG 2.89Å; C59-R73 HydrophobicContact CB-CG 3.99Å; C59-A79 VanDerWaalsContact SG-CB 3.6Å
60	D	85.4	Confident	79	Confident	74 Å²	74	81 Å²	81	40%	0.396	39%	0.387	S	S	.	.	H	α-helix	trans	-79.5	-29.8	179.2	-69.2	-21.4	0	0	0	113.1	Y56 K57 L58 L62 R69 R73	Y56-D60 PolarHBondContact O-N 2.86Å; K57-D60 PolarHBondContact O-N 3.04Å; L58-D60 PolarHBondContact O-N 2.89Å; D60-L62 VanDerWaalsContact C-N 3.28Å; D60-R69 WeakPolarHBondContact OD1-CD 3.03Å; D60-R73 IonicContact OD1-CZ 3.89Å; D60-R73 IonicContact OD1-NE 2.65Å; D60-R73 PolarHBondContact OD1-NE 2.96Å; D60-R73 IonicContact OD1-NH2 2.82Å; D60-R73 PolarHBondContact OD1-NH2 3.45Å; D60-R73 IonicContact OD2-CZ 3.88Å; D60-R73 IonicContact OD2-NH2 3.05Å; D60-R73 PolarHBondContact OD2-NH2 2.82Å
61	R	84.1	Confident	81.2	Confident	169 Å²	169	77.5 Å²	77.5	64%	0.638	36%	0.361	S	S	*	.	H	α-helix	trans	-69.3	-30.2	170.6	-72.3	173.6	176.6	179.1	-1.3	112	K57 L58 K63	K57-R61 WeakPolarHBondContact O-CG 3.33Å; K57-R61 PolarHBondContact O-N 3.34Å; L58-R61 PolarHBondContact O-N 3.48Å; R61-K63 PolarHBondContact O-N 3Å
62	L	79.7	Confident	82.9	Confident	5 Å²	5	70.9 Å²	70.9	3%	0.026	32%	0.32	C	S	.	.	S	Bend	trans	-70.7	119.6	170	-69.4	-179.3	0	0	0	108.5	F30 L38 L58 C59 D60 L64 L82 I86	F30-L62 HydrophobicContact CE1-CB 4.4Å; F30-L62 HydrophobicContact CE1-CD2 4.35Å; F30-L62 HydrophobicContact CZ-CB 3.8Å; F30-L62 HydrophobicContact CZ-CD2 4.35Å; F30-L62 HydrophobicContact CZ-CG 4.5Å; L38-L62 HydrophobicContact CD1-CD2 4.11Å; L58-L62 WeakPolarHBondContact O-CG 3.35Å; L58-L62 PolarHBondContact O-N 3.17Å; L58-L62 VanDerWaalsContact O-N 3.14Å; C59-L62 WeakPolarHBondContact O-CB 3.31Å; D60-L62 VanDerWaalsContact C-N 3.28Å; L62-L64 HydrophobicContact CB-CD1 3.71Å; L62-L64 HydrophobicContact CB-CG 3.81Å; L62-L64 HydrophobicContact CD1-CD1 4.33Å; L62-L64 PolarHBondContact O-N 3.19Å; L62-L82 HydrophobicContact CD1-CB 4.01Å; L62-L82 HydrophobicContact CD1-CD1 4.2Å; L62-I86 HydrophobicContact CD2-CD1 3.9Å
63	K	79.1	Confident	84.7	Confident	93 Å²	93	72.7 Å²	72.7	40%	0.404	31%	0.312	S	S	.	.			trans	-70	60.3	-179.5	-68.2	-171.2	176.8	-172.9	0	112.7	F30 T33 E36 R61	F30-K63 WeakPolarHBondContact CE2-O 3.27Å; T33-K63 WeakPolarHBondContact CB-O 3.38Å; T33-K63 WeakPolarHBondContact CG2-O 3.2Å; E36-K63 VanDerWaalsContact CD-NZ 3.34Å; E36-K63 IonicContact OE2-NZ 3.56Å; E36-K63 PolarHBondContact OE2-NZ 2.82Å; R61-K63 PolarHBondContact O-N 3Å
64	L	83.8	Confident	85.9	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.031	30%	0.304	C	S	.	.			trans	-84.1	142.4	-172.2	-68.1	161	0	0	0	112.1	F30 C59 L62 Q68 R69 C72 F182	F30-L64 HydrophobicContact CD1-CD2 3.88Å; F30-L64 HydrophobicContact CD2-CD2 3.31Å; F30-L64 HydrophobicContact CD2-CG 4.11Å; F30-L64 HydrophobicContact CE1-CD2 3.53Å; F30-L64 HydrophobicContact CE1-CG 4.21Å; F30-L64 VanDerWaalsContact CE2-CA 3.43Å; F30-L64 HydrophobicContact CE2-CB 3.91Å; F30-L64 HydrophobicContact CE2-CD2 3.02Å; F30-L64 HydrophobicContact CE2-CG 3.35Å; F30-L64 HydrophobicContact CG-CD2 3.81Å; F30-L64 HydrophobicContact CZ-CB 4.43Å; F30-L64 HydrophobicContact CZ-CD1 4.48Å; F30-L64 HydrophobicContact CZ-CD2 3.15Å; F30-L64 HydrophobicContact CZ-CG 3.42Å; F30-L64 VanDerWaalsContact CZ-CG 3.42Å; C59-L64 HydrophobicContact CB-CD1 4.33Å; C59-L64 WeakPolarHBondContact O-CD1 3.47Å; L62-L64 HydrophobicContact CB-CD1 3.71Å; L62-L64 HydrophobicContact CB-CG 3.81Å; L62-L64 HydrophobicContact CD1-CD1 4.33Å; L62-L64 PolarHBondContact O-N 3.19Å; L64-Q68 HydrophobicContact CB-CB 4.01Å; L64-Q68 HydrophobicContact CD2-CB 3.57Å; L64-Q68 HydrophobicContact CG-CB 4.37Å; L64-R69 HydrophobicContact CB-CB 3.91Å; L64-R69 HydrophobicContact CD1-CB 4.4Å; L64-R69 PolarHBondContact O-NH2 3.39Å; L64-R69 VanDerWaalsContact O-NH2 3.11Å; L64-C72 HydrophobicContact CD1-CB 3.7Å; L64-F182 HydrophobicContact CD2-CE1 4.46Å; L64-F182 HydrophobicContact CD2-CE2 3.93Å; L64-F182 HydrophobicContact CD2-CZ 3.42Å; L64-F182 VanDerWaalsContact CD2-CZ 3.42Å
65	E	83.2	Confident	86.5	Confident	62 Å²	62	68.3 Å²	68.3	29%	0.29	28%	0.284	S	S	.	.			trans	-61.2	159	164.9	-64	-172	154	0	0	111.2	A28 K67 Q68 R69	A28-E65 HydrophobicContact CB-CG 4.34Å; A28-E65 PolarHBondContact N-OE1 2Å; A28-E65 VanDerWaalsContact O-CD 3.24Å; A28-E65 WeakPolarHBondContact O-CG 3.39Å; E65-K67 PolarHBondContact O-N 3.21Å; E65-K67 VanDerWaalsContact O-N 3.08Å; E65-Q68 HydrophobicContact CB-CB 4.42Å; E65-Q68 HydrophobicContact CB-CG 4.3Å; E65-Q68 PolarHBondContact O-N 2.79Å; E65-Q68 VanDerWaalsContact O-N 3.08Å; E65-R69 WeakPolarHBondContact O-CB 3.33Å; E65-R69 PolarHBondContact O-N 3.12Å
66	K	86.6	Confident	86.7	Confident	158 Å²	158	69.3 Å²	69.3	69%	0.687	29%	0.292	S	S	*	.	H	α-helix	trans	-55.2	-33.9	-177.8	-168.2	179	-179.5	175.5	0	113.2	R70	K66-R70 WeakPolarHBondContact O-CG 3.46Å; K66-R70 PolarHBondContact O-N 2.95Å; K66-R70 PolarHBondContact O-NE 3.28Å
67	K	88	Confident	87	Confident	110 Å²	110	65.1 Å²	65.1	48%	0.478	28%	0.279	S	S	.	.	H	α-helix	trans	-74.4	-49.2	176	-177.5	-176.1	171.5	-164.2	0	111.3	E65 R69 R70 M71 E181	E65-K67 PolarHBondContact O-N 3.21Å; E65-K67 VanDerWaalsContact O-N 3.08Å; K67-R69 VanDerWaalsContact C-N 3.32Å; K67-R69 PolarHBondContact O-N 2.9Å; K67-R70 WeakPolarHBondContact O-CB 3.46Å; K67-R70 PolarHBondContact O-N 2.04Å; K67-R70 VanDerWaalsContact O-N 3.17Å; K67-M71 HydrophobicContact CG-SD 4.48Å; K67-M71 PolarHBondContact O-N 3.4Å; K67-E181 WeakPolarHBondContact CE-O 3.28Å; K67-E181 PolarHBondContact NZ-O 2.85Å
68	Q	89.4	Confident	87.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-41	179	-69.2	166.8	-17.1	0	0	112.1	F30 L64 E65 R70 M71 C72 F182	F30-Q68 VanDerWaalsContact CD2-OE1 3.3Å; L64-Q68 HydrophobicContact CB-CB 4.01Å; L64-Q68 HydrophobicContact CD2-CB 3.57Å; L64-Q68 HydrophobicContact CG-CB 4.37Å; E65-Q68 HydrophobicContact CB-CB 4.42Å; E65-Q68 HydrophobicContact CB-CG 4.3Å; E65-Q68 PolarHBondContact O-N 2.79Å; E65-Q68 VanDerWaalsContact O-N 3.08Å; Q68-R70 VanDerWaalsContact C-N 3.34Å; Q68-R70 PolarHBondContact O-N 3.23Å; Q68-M71 WeakPolarHBondContact O-CB 3.04Å; Q68-M71 PolarHBondContact O-N 2.98Å; Q68-M71 VanDerWaalsContact O-N 3.12Å; Q68-C72 WeakPolarHBondContact O-CB 3.46Å; Q68-C72 PolarHBondContact O-N 3.4Å; Q68-F182 HydrophobicContact CB-CD2 4.17Å; Q68-F182 HydrophobicContact CB-CE2 3.68Å; Q68-F182 HydrophobicContact CB-CZ 3.99Å; Q68-F182 HydrophobicContact CG-CD1 4.48Å; Q68-F182 HydrophobicContact CG-CD2 4.12Å; Q68-F182 HydrophobicContact CG-CE1 4.37Å; Q68-F182 HydrophobicContact CG-CE2 3.99Å; Q68-F182 HydrophobicContact CG-CG 4.37Å; Q68-F182 HydrophobicContact CG-CZ 4.13Å; Q68-F182 VanDerWaalsContact CG-O 3.22Å; Q68-F182 WeakPolarHBondContact CG-O 3.29Å; Q68-F182 PolarHBondContact NE2-O 3.42Å
69	R	90.6	Very high	87.6	Confident	95 Å²	95	57.9 Å²	57.9	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-41.9	175.4	-167.3	-179.8	-55.1	173.9	7.2	112.1	D60 L64 E65 K67 M71 C72 R73	D60-R69 WeakPolarHBondContact OD1-CD 3.03Å; L64-R69 HydrophobicContact CB-CB 3.91Å; L64-R69 HydrophobicContact CD1-CB 4.4Å; L64-R69 PolarHBondContact O-NH2 3.39Å; L64-R69 VanDerWaalsContact O-NH2 3.11Å; E65-R69 WeakPolarHBondContact O-CB 3.33Å; E65-R69 PolarHBondContact O-N 3.12Å; K67-R69 VanDerWaalsContact C-N 3.32Å; K67-R69 PolarHBondContact O-N 2.9Å; R69-M71 VanDerWaalsContact C-N 3.3Å; R69-M71 PolarHBondContact O-N 2.04Å; R69-C72 PolarHBondContact O-N 3.49Å; R69-R73 WeakPolarHBondContact O-CB 3.13Å; R69-R73 VanDerWaalsContact O-CG 3.3Å; R69-R73 WeakPolarHBondContact O-CG 3.09Å; R69-R73 PolarHBondContact O-N 3.46Å
70	R	90.9	Very high	87.7	Confident	145 Å²	145	62.1 Å²	62.1	55%	0.547	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-39.5	173.6	-80.1	-174.8	-99.2	-177.8	-5.4	111.5	K66 K67 Q68 R74	K66-R70 WeakPolarHBondContact O-CG 3.46Å; K66-R70 PolarHBondContact O-N 2.95Å; K66-R70 PolarHBondContact O-NE 3.28Å; K67-R70 WeakPolarHBondContact O-CB 3.46Å; K67-R70 PolarHBondContact O-N 2.04Å; K67-R70 VanDerWaalsContact O-N 3.17Å; Q68-R70 VanDerWaalsContact C-N 3.34Å; Q68-R70 PolarHBondContact O-N 3.23Å; R70-R74 WeakPolarHBondContact O-CG 3.08Å
71	M	92.1	Very high	88.1	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.039	25%	0.25	C	S	.	.	H	α-helix	trans	-68.1	-42.6	176	-66.8	177.3	66.6	0	0	112.4	K67 Q68 R69 R73 R74 F178 E181 F182	K67-M71 HydrophobicContact CG-SD 4.48Å; K67-M71 PolarHBondContact O-N 3.4Å; Q68-M71 WeakPolarHBondContact O-CB 3.04Å; Q68-M71 PolarHBondContact O-N 2.98Å; Q68-M71 VanDerWaalsContact O-N 3.12Å; R69-M71 VanDerWaalsContact C-N 3.3Å; R69-M71 PolarHBondContact O-N 2.04Å; M71-R73 VanDerWaalsContact C-N 3.31Å; M71-R73 PolarHBondContact O-N 2.81Å; M71-R74 WeakPolarHBondContact O-CB 3.5Å; M71-R74 PolarHBondContact O-N 3.29Å; M71-F178 HydrophobicContact CE-CD2 4.39Å; M71-F178 HydrophobicContact CE-CE2 4.21Å; M71-F178 HydrophobicContact CE-CZ 4.28Å; M71-E181 HydrophobicContact CE-CB 3.85Å; M71-F182 HydrophobicContact CB-CD2 4.17Å; M71-F182 HydrophobicContact CE-CB 3.87Å; M71-F182 HydrophobicContact CE-CD2 4.27Å; M71-F182 HydrophobicContact SD-CB 4.29Å; M71-F182 HydrophobicContact SD-CD2 4.21Å
72	C	91.3	Very high	88.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-41.8	176.7	-175.3	0	0	0	0	112.2	C59 L64 Q68 R69 R74 V78 L82	C59-C72 VanDerWaalsContact CA-SG 3.58Å; C59-C72 HydrophobicContact CB-CB 3.88Å; C59-C72 WeakPolarHBondContact CB-SG 3.09Å; C59-C72 WeakPolarHBondContact SG-CB 3.38Å; C59-C72 PolarHBondContact SG-O 3.33Å; C59-C72 CovalentContact SG-SG 2.04Å; C59-C72 PolarHBondContact SG-SG 2.89Å; L64-C72 HydrophobicContact CD1-CB 3.7Å; Q68-C72 WeakPolarHBondContact O-CB 3.46Å; Q68-C72 PolarHBondContact O-N 3.4Å; R69-C72 PolarHBondContact O-N 3.49Å; C72-R74 VanDerWaalsContact C-N 3.28Å; C72-R74 PolarHBondContact O-N 3.22Å; C72-V78 HydrophobicContact CB-CG1 4.49Å; C72-L82 HydrophobicContact CB-CD1 4.11Å
73	R	91.4	Very high	88.8	Confident	87 Å²	87	54.6 Å²	54.6	33%	0.328	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.1	-178.4	-69	173.7	170.4	-159.1	-2.7	115	Y56 C59 D60 R69 M71	Y56-R73 HydrophobicContact CD1-CB 3.99Å; Y56-R73 HydrophobicContact CD1-CG 3.53Å; Y56-R73 HydrophobicContact CE1-CB 3.7Å; Y56-R73 HydrophobicContact CE1-CG 3.8Å; Y56-R73 HydrophobicContact CG-CG 4.47Å; C59-R73 HydrophobicContact CB-CG 3.99Å; D60-R73 IonicContact OD1-CZ 3.89Å; D60-R73 IonicContact OD1-NE 2.65Å; D60-R73 PolarHBondContact OD1-NE 2.96Å; D60-R73 IonicContact OD1-NH2 2.82Å; D60-R73 PolarHBondContact OD1-NH2 3.45Å; D60-R73 IonicContact OD2-CZ 3.88Å; D60-R73 IonicContact OD2-NH2 3.05Å; D60-R73 PolarHBondContact OD2-NH2 2.82Å; R69-R73 WeakPolarHBondContact O-CB 3.13Å; R69-R73 VanDerWaalsContact O-CG 3.3Å; R69-R73 WeakPolarHBondContact O-CG 3.09Å; R69-R73 PolarHBondContact O-N 3.46Å; M71-R73 VanDerWaalsContact C-N 3.31Å; M71-R73 PolarHBondContact O-N 2.81Å
74	R	89.9	Confident	89.3	Confident	147 Å²	147	53.2 Å²	53.2	56%	0.555	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-20.4	-177.8	-84.6	171.9	-171.8	173.2	-2.3	114	R70 M71 C72 R148	R70-R74 WeakPolarHBondContact O-CG 3.08Å; M71-R74 WeakPolarHBondContact O-CB 3.5Å; M71-R74 PolarHBondContact O-N 3.29Å; C72-R74 VanDerWaalsContact C-N 3.28Å; C72-R74 PolarHBondContact O-N 3.22Å; R74-R148 PolarHBondContact O-NE 3.01Å; R74-R148 PolarHBondContact O-NH2 2.79Å
75	D	87.4	Confident	89.7	Confident	2 Å²	2	53 Å²	53	1%	0.011	23%	0.229	C	C	.	.			trans	-151	121.5	-175.1	176.8	-25.5	0	0	0	106.7	G77 V78 E147 R148	D75-G77 PolarHBondContact O-N 2.9Å; D75-G77 PolarHBondContact OD1-N 3.3Å; D75-V78 HydrophobicContact CB-CG2 3.72Å; D75-V78 WeakPolarHBondContact O-CB 3.44Å; D75-V78 PolarHBondContact O-N 3.16Å; D75-V78 VanDerWaalsContact O-N 3.09Å; D75-E147 PolarHBondContact OD2-N 3.4Å; D75-E147 VanDerWaalsContact OD2-N 3.08Å; D75-R148 HydrophobicContact CB-CG 4.38Å; D75-R148 PolarHBondContact OD2-N 3.41Å
76	P	86	Confident	89.9	Confident	42 Å²	42	51.6 Å²	51.6	27%	0.273	22%	0.223	S	C	.	.	H	α-helix	trans	-58.1	-35.4	-176.9	21.8	-30.5	0	0	0	112.4	H55 V78 A79	H55-P76 HydrophobicContact CB-CB 4.05Å; P76-V78 PolarHBondContact O-N 3.1Å; P76-A79 PolarHBondContact O-N 3.24Å
77	G	90.8	Very high	89.9	Confident	9 Å²	9	46.5 Å²	46.5	9%	0.093	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-22.3	179.2	0	0	0	0	0	113.9	D75 T81 R145	D75-G77 PolarHBondContact O-N 2.9Å; D75-G77 PolarHBondContact OD1-N 3.3Å; G77-T81 VanDerWaalsContact O-CB 3.29Å; G77-T81 WeakPolarHBondContact O-CB 3.04Å; G77-T81 PolarHBondContact O-N 2.03Å; G77-T81 VanDerWaalsContact O-N 3.12Å; G77-T81 PolarHBondContact O-OG1 2.84Å; G77-R145 WeakPolarHBondContact CA-O 3.32Å
78	V	92.4	Very high	90.1	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-40.4	177.8	174.2	0	0	0	0	111.1	C72 D75 P76 D80 T81 L82 M146 F178	C72-V78 HydrophobicContact CB-CG1 4.49Å; D75-V78 HydrophobicContact CB-CG2 3.72Å; D75-V78 WeakPolarHBondContact O-CB 3.44Å; D75-V78 PolarHBondContact O-N 3.16Å; D75-V78 VanDerWaalsContact O-N 3.09Å; P76-V78 PolarHBondContact O-N 3.1Å; V78-D80 PolarHBondContact O-N 3.38Å; V78-T81 PolarHBondContact O-N 3.34Å; V78-L82 HydrophobicContact CG1-CD1 3.81Å; V78-L82 HydrophobicContact CG1-CG 3.99Å; V78-L82 WeakPolarHBondContact O-CB 3.01Å; V78-L82 VanDerWaalsContact O-CG 3.23Å; V78-L82 WeakPolarHBondContact O-CG 3.11Å; V78-L82 PolarHBondContact O-N 2.83Å; V78-M146 HydrophobicContact CG2-CE 3.5Å; V78-F178 HydrophobicContact CG1-CE2 4.26Å; V78-F178 HydrophobicContact CG1-CZ 3.65Å; V78-F178 HydrophobicContact CG2-CE2 4.11Å; V78-F178 HydrophobicContact CG2-CZ 4.3Å
79	A	89.9	Confident	90.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-47	-174.8	0	0	0	0	0	111.6	H55 L58 C59 P76 L82 R83	H55-A79 HydrophobicContact CB-CB 4.07Å; L58-A79 HydrophobicContact CB-CB 4.15Å; L58-A79 VanDerWaalsContact CD2-C 3.46Å; L58-A79 HydrophobicContact CD2-CB 3.71Å; L58-A79 HydrophobicContact CG-CB 4.02Å; C59-A79 VanDerWaalsContact SG-CB 3.6Å; P76-A79 PolarHBondContact O-N 3.24Å; A79-L82 PolarHBondContact O-N 3.02Å; A79-R83 PolarHBondContact O-N 3.31Å
80	D	89.1	Confident	90.2	Very high	90 Å²	90	39.8 Å²	39.8	48%	0.481	18%	0.182	S	C	.	.	H	α-helix	trans	-67.5	-41.3	177.4	-67.8	-54.8	0	0	0	111.8	L58 V78 L82 R83 E84	L58-D80 VanDerWaalsContact CD2-OD1 3.25Å; L58-D80 WeakPolarHBondContact CD2-OD1 3.32Å; V78-D80 PolarHBondContact O-N 3.38Å; D80-L82 VanDerWaalsContact C-N 3.34Å; D80-L82 PolarHBondContact O-N 2.7Å; D80-R83 WeakPolarHBondContact O-CB 3.1Å; D80-R83 PolarHBondContact O-N 2.83Å; D80-R83 VanDerWaalsContact O-N 3.14Å; D80-E84 PolarHBondContact O-N 3.46Å
81	T	93.6	Very high	90.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-38.1	177.9	-56.4	0	0	0	0	112.1	G77 V78 R83 E84 A85 A136 L137 A140	G77-T81 VanDerWaalsContact O-CB 3.29Å; G77-T81 WeakPolarHBondContact O-CB 3.04Å; G77-T81 PolarHBondContact O-N 2.03Å; G77-T81 VanDerWaalsContact O-N 3.12Å; G77-T81 PolarHBondContact O-OG1 2.84Å; V78-T81 PolarHBondContact O-N 3.34Å; T81-R83 VanDerWaalsContact C-N 3.34Å; T81-E84 PolarHBondContact O-N 3.16Å; T81-A85 WeakPolarHBondContact O-CB 3.18Å; T81-A85 PolarHBondContact O-N 3.3Å; T81-A136 HydrophobicContact CG2-CB 3.91Å; T81-A136 WeakPolarHBondContact CG2-O 3.11Å; T81-L137 HydrophobicContact CG2-CD2 3.84Å; T81-L137 HydrophobicContact CG2-CG 4.1Å; T81-A140 HydrophobicContact CG2-CB 3.71Å; T81-A140 WeakPolarHBondContact OG1-CB 3.41Å
82	L	91.2	Very high	90.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-39.5	173.8	-72.6	176.9	0	0	0	111.6	L62 C72 V78 A79 D80 A85 I86 L133 F182	L62-L82 HydrophobicContact CD1-CB 4.01Å; L62-L82 HydrophobicContact CD1-CD1 4.2Å; C72-L82 HydrophobicContact CB-CD1 4.11Å; V78-L82 HydrophobicContact CG1-CD1 3.81Å; V78-L82 HydrophobicContact CG1-CG 3.99Å; V78-L82 WeakPolarHBondContact O-CB 3.01Å; V78-L82 VanDerWaalsContact O-CG 3.23Å; V78-L82 WeakPolarHBondContact O-CG 3.11Å; V78-L82 PolarHBondContact O-N 2.83Å; A79-L82 PolarHBondContact O-N 3.02Å; D80-L82 VanDerWaalsContact C-N 3.34Å; D80-L82 PolarHBondContact O-N 2.7Å; L82-A85 PolarHBondContact O-N 2.81Å; L82-I86 WeakPolarHBondContact O-CD1 3.31Å; L82-I86 VanDerWaalsContact O-CG1 3.25Å; L82-I86 WeakPolarHBondContact O-CG1 3.42Å; L82-I86 PolarHBondContact O-N 3.17Å; L82-I86 VanDerWaalsContact O-N 3.15Å; L82-L133 HydrophobicContact CD2-CD2 3.47Å; L82-L133 VanDerWaalsContact CD2-CD2 3.47Å; L82-F182 HydrophobicContact CD1-CE2 4.03Å; L82-F182 HydrophobicContact CD1-CZ 3.83Å; L82-F182 HydrophobicContact CD2-CE1 4.16Å; L82-F182 HydrophobicContact CD2-CE2 4.47Å; L82-F182 HydrophobicContact CD2-CZ 3.94Å
83	R	88.6	Confident	90.8	Very high	89 Å²	89	37.8 Å²	37.8	34%	0.336	18%	0.181	S	C	.	.	H	α-helix	trans	-63.8	-47.4	175.4	-178.2	-179.5	-176.5	-97.6	-1.4	111	A79 D80 T81 A85 I86 I87	A79-R83 PolarHBondContact O-N 3.31Å; D80-R83 WeakPolarHBondContact O-CB 3.1Å; D80-R83 PolarHBondContact O-N 2.83Å; D80-R83 VanDerWaalsContact O-N 3.14Å; T81-R83 VanDerWaalsContact C-N 3.34Å; R83-A85 VanDerWaalsContact C-N 3.34Å; R83-A85 PolarHBondContact O-N 3.42Å; R83-I86 PolarHBondContact O-N 3.08Å; R83-I87 HydrophobicContact CG-CD1 3.98Å; R83-I87 WeakPolarHBondContact O-CG1 3.33Å; R83-I87 PolarHBondContact O-N 3.18Å; R83-I87 VanDerWaalsContact O-N 3.08Å
84	E	89.1	Confident	90.9	Very high	63 Å²	63	37 Å²	37	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-55.6	-48.6	175.9	-174.9	-173.9	166.1	0	0	111.1	D80 T81 I86 I87 M88 R145	D80-E84 PolarHBondContact O-N 3.46Å; T81-E84 PolarHBondContact O-N 3.16Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.4Å; E84-I87 PolarHBondContact O-N 3.27Å; E84-M88 HydrophobicContact CG-CE 4.22Å; E84-M88 VanDerWaalsContact O-CB 3.25Å; E84-M88 WeakPolarHBondContact O-CB 3.3Å; E84-M88 PolarHBondContact O-N 2.85Å; E84-R145 IonicContact OE1-NH2 3.2Å; E84-R145 IonicContact OE2-CZ 2.64Å; E84-R145 VanDerWaalsContact OE2-CZ 3.28Å; E84-R145 IonicContact OE2-NH1 2.69Å; E84-R145 PolarHBondContact OE2-NH1 3.49Å; E84-R145 IonicContact OE2-NH2 3.87Å; E84-R145 PolarHBondContact OE2-NH2 3.16Å
85	A	92.3	Very high	91.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-41.8	178.5	0	0	0	0	0	112.8	T81 L82 R83 S89 L133 A136	T81-A85 WeakPolarHBondContact O-CB 3.18Å; T81-A85 PolarHBondContact O-N 3.3Å; L82-A85 PolarHBondContact O-N 2.81Å; R83-A85 VanDerWaalsContact C-N 3.34Å; R83-A85 PolarHBondContact O-N 3.42Å; A85-S89 VanDerWaalsContact O-CB 3.31Å; A85-S89 WeakPolarHBondContact O-CB 3.27Å; A85-S89 PolarHBondContact O-N 3.23Å; A85-S89 PolarHBondContact O-OG 2.94Å; A85-L133 HydrophobicContact CB-CD2 3.85Å; A85-L133 HydrophobicContact CB-CG 4.34Å; A85-A136 HydrophobicContact CB-CB 3.75Å
86	I	87.2	Confident	91.5	Very high	34 Å²	34	34.1 Å²	34.1	17%	0.174	17%	0.174	C	C	.	.	H	α-helix	trans	-67.9	-45.9	-179.8	-64.3	161.5	0	0	0	110.7	F30 L38 L62 L82 R83 E84 S89 A90	F30-I86 HydrophobicContact CE1-CD1 4.05Å; L38-I86 HydrophobicContact CD1-CB 4.35Å; L38-I86 HydrophobicContact CD1-CD1 3.65Å; L38-I86 HydrophobicContact CD1-CG2 3.79Å; L62-I86 HydrophobicContact CD2-CD1 3.9Å; L82-I86 WeakPolarHBondContact O-CD1 3.31Å; L82-I86 VanDerWaalsContact O-CG1 3.25Å; L82-I86 WeakPolarHBondContact O-CG1 3.42Å; L82-I86 PolarHBondContact O-N 3.17Å; L82-I86 VanDerWaalsContact O-N 3.15Å; R83-I86 PolarHBondContact O-N 3.08Å; E84-I86 VanDerWaalsContact C-N 3.31Å; E84-I86 PolarHBondContact O-N 3.4Å; I86-S89 PolarHBondContact O-N 3.35Å; I86-A90 VanDerWaalsContact O-CB 3.26Å; I86-A90 WeakPolarHBondContact O-CB 3.19Å; I86-A90 PolarHBondContact O-N 3.43Å
87	I	87.6	Confident	91.9	Very high	51 Å²	51	32.2 Å²	32.2	26%	0.262	16%	0.161	S	C	.	.	H	α-helix	trans	-62.5	-48.7	179	-66.9	169.5	0	0	0	109.9	R83 E84 S89 A90 L91	R83-I87 HydrophobicContact CG-CD1 3.98Å; R83-I87 WeakPolarHBondContact O-CG1 3.33Å; R83-I87 PolarHBondContact O-N 3.18Å; R83-I87 VanDerWaalsContact O-N 3.08Å; E84-I87 PolarHBondContact O-N 3.27Å; I87-S89 VanDerWaalsContact C-N 3.35Å; I87-S89 PolarHBondContact O-N 2.99Å; I87-A90 PolarHBondContact O-N 2.73Å; I87-L91 HydrophobicContact CG2-CD1 3.71Å; I87-L91 HydrophobicContact CG2-CG 4.21Å; I87-L91 WeakPolarHBondContact O-CB 3.2Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.26Å; I87-L91 PolarHBondContact O-N 3.29Å
88	M	92.5	Very high	92	Very high	40 Å²	40	37 Å²	37	20%	0.197	18%	0.176	C	C	.	.	H	α-helix	trans	-57.7	-46.3	178.9	-172.5	-171.1	-59.5	0	0	111.7	E84 E92 F236	E84-M88 HydrophobicContact CG-CE 4.22Å; E84-M88 VanDerWaalsContact O-CB 3.25Å; E84-M88 WeakPolarHBondContact O-CB 3.3Å; E84-M88 PolarHBondContact O-N 2.85Å; M88-E92 WeakPolarHBondContact O-CB 2.98Å; M88-E92 PolarHBondContact O-N 3.37Å; M88-F236 HydrophobicContact CG-CB 4.24Å; M88-F236 HydrophobicContact CG-CD1 3.48Å; M88-F236 VanDerWaalsContact CG-CD1 3.48Å; M88-F236 HydrophobicContact CG-CE1 3.87Å; M88-F236 HydrophobicContact CG-CG 3.85Å; M88-F236 HydrophobicContact SD-CB 3.81Å; M88-F236 HydrophobicContact SD-CD1 3.86Å; M88-F236 HydrophobicContact SD-CD2 3.87Å; M88-F236 HydrophobicContact SD-CE1 4.36Å; M88-F236 HydrophobicContact SD-CE2 4.41Å; M88-F236 HydrophobicContact SD-CG 3.56Å; M88-F236 VanDerWaalsContact SD-CG 3.56Å
89	S	92.6	Very high	91.9	Very high	8 Å²	8	40.1 Å²	40.1	6%	0.056	19%	0.19	C	C	.	.	H	α-helix	trans	-65.3	-40.8	178.2	-55.1	0	0	0	0	112.6	A85 I86 I87 C93 I128	A85-S89 VanDerWaalsContact O-CB 3.31Å; A85-S89 WeakPolarHBondContact O-CB 3.27Å; A85-S89 PolarHBondContact O-N 3.23Å; A85-S89 PolarHBondContact O-OG 2.94Å; I86-S89 PolarHBondContact O-N 3.35Å; I87-S89 VanDerWaalsContact C-N 3.35Å; I87-S89 PolarHBondContact O-N 2.99Å; S89-C93 VanDerWaalsContact O-CB 3.31Å; S89-C93 WeakPolarHBondContact O-CB 3.42Å; S89-C93 PolarHBondContact O-N 3.28Å; S89-I128 PolarHBondContact OG-O 2.97Å
90	A	89.3	Confident	92	Very high	17 Å²	17	43.8 Å²	43.8	14%	0.14	21%	0.207	C	C	.	.	H	α-helix	trans	-66.5	-47.6	-179.9	0	0	0	0	0	111.7	I86 I87 C93 Q94 L106	I86-A90 VanDerWaalsContact O-CB 3.26Å; I86-A90 WeakPolarHBondContact O-CB 3.19Å; I86-A90 PolarHBondContact O-N 3.43Å; I87-A90 PolarHBondContact O-N 2.73Å; A90-C93 PolarHBondContact O-N 3.03Å; A90-Q94 WeakPolarHBondContact O-CG 3.41Å; A90-Q94 PolarHBondContact O-N 3.39Å; A90-L106 HydrophobicContact CB-CD1 3.62Å
91	L	92.6	Very high	92.3	Very high	91 Å²	91	44.8 Å²	44.8	48%	0.476	20%	0.204	S	C	.	.	H	α-helix	trans	-62.9	-43.4	178.2	-69.7	176.5	0	0	0	111.2	I87 C93 Q94 H95	I87-L91 HydrophobicContact CG2-CD1 3.71Å; I87-L91 HydrophobicContact CG2-CG 4.21Å; I87-L91 WeakPolarHBondContact O-CB 3.2Å; I87-L91 VanDerWaalsContact O-CG 3.31Å; I87-L91 WeakPolarHBondContact O-CG 3.26Å; I87-L91 PolarHBondContact O-N 3.29Å; L91-C93 VanDerWaalsContact C-N 3.34Å; L91-C93 PolarHBondContact O-N 3.48Å; L91-Q94 PolarHBondContact O-N 3.41Å; L91-H95 VanDerWaalsContact O-CB 3.29Å; L91-H95 WeakPolarHBondContact O-CB 3.34Å; L91-H95 PolarHBondContact O-N 3.39Å
92	E	96.8	Very high	92.3	Very high	19 Å²	19	45.1 Å²	45.1	9%	0.089	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-39.6	177.2	-171.1	57	-146.9	0	0	111.5	M88 H95 Q96 I128 F236 H237	M88-E92 WeakPolarHBondContact O-CB 2.98Å; M88-E92 PolarHBondContact O-N 3.37Å; E92-H95 WeakPolarHBondContact O-CB 3.47Å; E92-H95 PolarHBondContact O-N 3.17Å; E92-H95 IonicContact OE1-ND1 3.62Å; E92-Q96 HydrophobicContact CG-CG 4.32Å; E92-Q96 WeakPolarHBondContact O-CB 3.35Å; E92-Q96 VanDerWaalsContact O-CG 3.25Å; E92-Q96 WeakPolarHBondContact O-CG 3.34Å; E92-Q96 PolarHBondContact O-N 3.23Å; E92-Q96 WeakPolarHBondContact OE1-CG 3.2Å; E92-Q96 PolarHBondContact OE1-NE2 2.84Å; E92-I128 HydrophobicContact CB-CD1 4.38Å; E92-I128 HydrophobicContact CG-CD1 4.01Å; E92-F236 HydrophobicContact CB-CD1 3.77Å; E92-F236 HydrophobicContact CB-CE1 3.55Å; E92-F236 HydrophobicContact CG-CD1 3.93Å; E92-F236 HydrophobicContact CG-CE1 3.87Å; E92-H237 IonicContact OE1-CE1 3.97Å; E92-H237 IonicContact OE1-CG 2.85Å; E92-H237 IonicContact OE1-ND1 3.79Å; E92-H237 PolarHBondContact OE1-ND1 2.76Å; E92-H237 IonicContact OE2-ND1 2.95Å
93	C	95.7	Very high	92.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-46.7	175.5	-172.4	0	0	0	0	112.1	S89 A90 L91 H95 Q96 F97 C104 F124	S89-C93 VanDerWaalsContact O-CB 3.31Å; S89-C93 WeakPolarHBondContact O-CB 3.42Å; S89-C93 PolarHBondContact O-N 3.28Å; A90-C93 PolarHBondContact O-N 3.03Å; L91-C93 VanDerWaalsContact C-N 3.34Å; L91-C93 PolarHBondContact O-N 3.48Å; C93-H95 VanDerWaalsContact C-N 3.28Å; C93-H95 PolarHBondContact O-N 3.44Å; C93-Q96 PolarHBondContact O-N 3.48Å; C93-F97 WeakPolarHBondContact O-CB 3.46Å; C93-F97 WeakPolarHBondContact O-CD2 3.26Å; C93-F97 PolarHBondContact O-N 2.96Å; C93-F97 VanDerWaalsContact O-N 3.09Å; C93-C104 HydrophobicContact CB-CB 3.97Å; C93-C104 WeakPolarHBondContact CB-SG 3.25Å; C93-C104 WeakPolarHBondContact SG-CB 3.29Å; C93-C104 CovalentContact SG-SG 2.02Å; C93-C104 PolarHBondContact SG-SG 3.45Å; C93-F124 HydrophobicContact CB-CE1 4.1Å
94	Q	93.8	Very high	92.5	Very high	71 Å²	71	43.1 Å²	43.1	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-60.8	-40	174.8	-71.9	173.2	-13.6	0	0	111.6	A90 L91 F97 R98 C104	A90-Q94 WeakPolarHBondContact O-CG 3.41Å; A90-Q94 PolarHBondContact O-N 3.39Å; L91-Q94 PolarHBondContact O-N 3.41Å; Q94-F97 PolarHBondContact O-N 3.15Å; Q94-R98 WeakPolarHBondContact O-CA 3.43Å; Q94-R98 WeakPolarHBondContact O-CB 3.4Å; Q94-R98 PolarHBondContact O-N 2.8Å; Q94-C104 HydrophobicContact CG-CB 4.37Å
95	H	94.8	Very high	92.2	Very high	67 Å²	67	42 Å²	42	31%	0.31	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-52	176.3	-178.5	-104.8	0	0	0	111.3	L91 E92 C93 F97 R98 H237	L91-H95 VanDerWaalsContact O-CB 3.29Å; L91-H95 WeakPolarHBondContact O-CB 3.34Å; L91-H95 PolarHBondContact O-N 3.39Å; E92-H95 WeakPolarHBondContact O-CB 3.47Å; E92-H95 PolarHBondContact O-N 3.17Å; E92-H95 IonicContact OE1-ND1 3.62Å; C93-H95 VanDerWaalsContact C-N 3.28Å; C93-H95 PolarHBondContact O-N 3.44Å; H95-F97 PolarHBondContact O-N 2.74Å; H95-R98 PolarHBondContact CE1-NH1 3.47Å; H95-R98 VanDerWaalsContact CE1-NH1 3.27Å; H95-R98 PolarHBondContact NE2-NH1 2.95Å; H95-R98 VanDerWaalsContact NE2-NH1 3.18Å; H95-R98 WeakPolarHBondContact O-CD 3.37Å; H95-R98 WeakPolarHBondContact O-CG 3.45Å; H95-R98 PolarHBondContact O-N 3.33Å; H95-R98 PolarHBondContact O-NH1 3.24Å; H95-H237 AromaticContact CE1-CE1 3.24Å; H95-H237 PolarHBondContact CE1-CE1 3.08Å; H95-H237 AromaticContact CE1-ND1 3.65Å; H95-H237 AromaticContact CE1-NE2 3.98Å; H95-H237 AromaticContact ND1-CE1 3.47Å; H95-H237 PolarHBondContact ND1-CE1 2.98Å; H95-H237 AromaticContact ND1-ND1 3.54Å
96	Q	96.3	Very high	91.3	Very high	21 Å²	21	43.3 Å²	43.3	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-29.4	-179.1	-69.6	-62	-26.4	0	0	113.1	E92 C93 F124 G240 N241 K244	E92-Q96 HydrophobicContact CG-CG 4.32Å; E92-Q96 WeakPolarHBondContact O-CB 3.35Å; E92-Q96 VanDerWaalsContact O-CG 3.25Å; E92-Q96 WeakPolarHBondContact O-CG 3.34Å; E92-Q96 PolarHBondContact O-N 3.23Å; E92-Q96 WeakPolarHBondContact OE1-CG 3.2Å; E92-Q96 PolarHBondContact OE1-NE2 2.84Å; C93-Q96 PolarHBondContact O-N 3.48Å; Q96-F124 HydrophobicContact CB-CZ 4.31Å; Q96-F124 HydrophobicContact CG-CZ 4.29Å; Q96-G240 VanDerWaalsContact NE2-C 3.33Å; Q96-N241 PolarHBondContact NE2-OD1 3.04Å; Q96-K244 HydrophobicContact CG-CB 4.43Å
97	F	94.6	Very high	90.6	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-107.6	7.2	-175.7	-74.7	-92.1	0	0	0	114.1	C93 Q94 H95 F99 E100 W102 N103 C104 F124 K244 Y247	C93-F97 WeakPolarHBondContact O-CB 3.46Å; C93-F97 WeakPolarHBondContact O-CD2 3.26Å; C93-F97 PolarHBondContact O-N 2.96Å; C93-F97 VanDerWaalsContact O-N 3.09Å; Q94-F97 PolarHBondContact O-N 3.15Å; H95-F97 PolarHBondContact O-N 2.74Å; F97-F99 PolarHBondContact O-N 2.71Å; F97-E100 HydrophobicContact CB-CB 4.44Å; F97-E100 HydrophobicContact CB-CG 4.49Å; F97-E100 HydrophobicContact CD1-CB 4.03Å; F97-E100 HydrophobicContact CD1-CG 3.89Å; F97-E100 WeakPolarHBondContact O-CB 3.34Å; F97-E100 PolarHBondContact O-N 3.11Å; F97-W102 HydrophobicContact CB-CE3 4.33Å; F97-W102 HydrophobicContact CB-CZ3 4.46Å; F97-W102 WeakPolarHBondContact CB-O 3.42Å; F97-W102 AromaticContact CD1-CE3 3.41Å; F97-W102 HydrophobicContact CD1-CE3 3.41Å; F97-W102 VanDerWaalsContact CD1-CE3 3.41Å; F97-W102 AromaticContact CD1-CZ3 3.67Å; F97-W102 HydrophobicContact CD1-CZ3 3.67Å; F97-W102 WeakPolarHBondContact CD1-O 3.24Å; F97-W102 HydrophobicContact CD2-CE3 4.39Å; F97-W102 AromaticContact CD2-CZ3 3.86Å; F97-W102 HydrophobicContact CD2-CZ3 3.86Å; F97-W102 AromaticContact CE1-CE3 3.68Å; F97-W102 HydrophobicContact CE1-CE3 3.68Å; F97-W102 AromaticContact CE1-CZ3 3.73Å; F97-W102 HydrophobicContact CE1-CZ3 3.73Å; F97-W102 AromaticContact CE2-CZ3 3.94Å; F97-W102 HydrophobicContact CE2-CZ3 3.94Å; F97-W102 AromaticContact CG-CE3 3.79Å; F97-W102 HydrophobicContact CG-CE3 3.79Å; F97-W102 AromaticContact CG-CZ3 3.72Å; F97-W102 HydrophobicContact CG-CZ3 3.72Å; F97-W102 HydrophobicContact CZ-CE3 4.3Å; F97-W102 AromaticContact CZ-CZ3 3.87Å; F97-W102 HydrophobicContact CZ-CZ3 3.87Å; F97-N103 WeakPolarHBondContact O-CA 3.36Å; F97-C104 HydrophobicContact CB-CB 4.15Å; F97-F124 HydrophobicContact CD2-CD1 4.43Å; F97-F124 HydrophobicContact CD2-CE1 4.18Å; F97-F124 AromaticContact CE2-CD1 3.52Å; F97-F124 HydrophobicContact CE2-CD1 3.52Å; F97-F124 HydrophobicContact CE2-CD2 4.2Å; F97-F124 AromaticContact CE2-CE1 3.53Å; F97-F124 HydrophobicContact CE2-CE1 3.53Å; F97-F124 HydrophobicContact CE2-CE2 4.17Å; F97-F124 AromaticContact CE2-CG 3.88Å; F97-F124 HydrophobicContact CE2-CG 3.88Å; F97-F124 AromaticContact CE2-CZ 3.86Å; F97-F124 HydrophobicContact CE2-CZ 3.86Å; F97-F124 HydrophobicContact CZ-CD1 4.18Å; F97-F124 HydrophobicContact CZ-CD2 4.49Å; F97-F124 HydrophobicContact CZ-CG 4.14Å; F97-K244 HydrophobicContact CE2-CD 4.31Å; F97-K244 HydrophobicContact CZ-CD 4.2Å; F97-Y247 HydrophobicContact CE1-CD1 4.29Å; F97-Y247 AromaticContact CE1-CE1 3.73Å; F97-Y247 HydrophobicContact CE1-CE1 3.73Å; F97-Y247 HydrophobicContact CE1-CE2 4.06Å; F97-Y247 AromaticContact CE1-CZ 3.59Å; F97-Y247 AromaticContact CZ-CD1 3.97Å; F97-Y247 HydrophobicContact CZ-CD1 3.97Å; F97-Y247 HydrophobicContact CZ-CD2 4.02Å; F97-Y247 AromaticContact CZ-CE1 3.87Å; F97-Y247 HydrophobicContact CZ-CE1 3.87Å; F97-Y247 AromaticContact CZ-CE2 3.86Å; F97-Y247 HydrophobicContact CZ-CE2 3.86Å; F97-Y247 HydrophobicContact CZ-CG 4.05Å; F97-Y247 AromaticContact CZ-CZ 3.79Å
98	R	91.7	Very high	90	Very high	111 Å²	111	47.2 Å²	47.2	42%	0.419	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.4	-175	66.7	-169.5	-177.3	-86.8	7.8	114.4	Q94 H95 R319	Q94-R98 WeakPolarHBondContact O-CA 3.43Å; Q94-R98 WeakPolarHBondContact O-CB 3.4Å; Q94-R98 PolarHBondContact O-N 2.8Å; H95-R98 PolarHBondContact CE1-NH1 3.47Å; H95-R98 VanDerWaalsContact CE1-NH1 3.27Å; H95-R98 PolarHBondContact NE2-NH1 2.95Å; H95-R98 VanDerWaalsContact NE2-NH1 3.18Å; H95-R98 WeakPolarHBondContact O-CD 3.37Å; H95-R98 WeakPolarHBondContact O-CG 3.45Å; H95-R98 PolarHBondContact O-N 3.33Å; H95-R98 PolarHBondContact O-NH1 3.24Å; R98-R319 PolarHBondContact O-NH2 3.18Å
99	F	90	Very high	89.6	Confident	67 Å²	67	55.4 Å²	55.4	29%	0.294	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	11.9	-177.3	-59.9	-33.7	0	0	0	113.9	F97 Y322 N326 I330	F97-F99 PolarHBondContact O-N 2.71Å; F99-Y322 HydrophobicContact CD1-CD2 4.15Å; F99-Y322 AromaticContact CD1-CE2 3.84Å; F99-Y322 HydrophobicContact CD1-CE2 3.84Å; F99-Y322 AromaticContact CE1-CD2 3.84Å; F99-Y322 HydrophobicContact CE1-CD2 3.84Å; F99-Y322 AromaticContact CE1-CE2 3.19Å; F99-Y322 HydrophobicContact CE1-CE2 3.19Å; F99-Y322 AromaticContact CE1-CZ 3.89Å; F99-Y322 HydrophobicContact CZ-CD2 4.49Å; F99-Y322 AromaticContact CZ-CE2 3.93Å; F99-Y322 HydrophobicContact CZ-CE2 3.93Å; F99-N326 VanDerWaalsContact CB-ND2 3.27Å; F99-N326 WeakPolarHBondContact CB-ND2 3.48Å; F99-N326 WeakPolarHBondContact CD1-ND2 3.35Å; F99-N326 VanDerWaalsContact CG-ND2 3.3Å; F99-N326 WeakPolarHBondContact CG-ND2 3.18Å; F99-I330 WeakPolarHBondContact O-CD1 3Å; F99-I330 VanDerWaalsContact O-CG1 3.26Å; F99-I330 WeakPolarHBondContact O-CG1 3.22Å
100	E	93	Very high	89.2	Confident	77 Å²	77	57.7 Å²	57.7	36%	0.36	27%	0.269	S	S	.	.	S	Bend	trans	-103	161.7	-179.4	-63.4	-72.3	-169	0	0	110.8	F97 W102 K244 R319	F97-E100 HydrophobicContact CB-CB 4.44Å; F97-E100 HydrophobicContact CB-CG 4.49Å; F97-E100 HydrophobicContact CD1-CB 4.03Å; F97-E100 HydrophobicContact CD1-CG 3.89Å; F97-E100 WeakPolarHBondContact O-CB 3.34Å; F97-E100 PolarHBondContact O-N 3.11Å; E100-W102 VanDerWaalsContact C-N 3.27Å; E100-W102 WeakPolarHBondContact CB-O 3.5Å; E100-W102 PolarHBondContact O-N 2.64Å; E100-K244 IonicContact OE1-NZ 3.05Å; E100-K244 PolarHBondContact OE1-NZ 3.26Å; E100-R319 PolarHBondContact O-NH1 2.84Å; E100-R319 PolarHBondContact O-NH2 3.36Å
101	R	94.7	Very high	88.9	Confident	111 Å²	111	58.1 Å²	58.1	42%	0.419	27%	0.267	S	S	.	.	S	Bend	trans	-62.2	-35.7	176.3	-61.9	173.3	-175.1	151.6	3.1	112.3	F306 T316 R319 A329	R101-F306 HydrophobicContact CB-CB 3.87Å; R101-T316 HydrophobicContact CB-CG2 4.03Å; R101-T316 HydrophobicContact CG-CG2 4.36Å; R101-R319 VanDerWaalsContact C-NH1 3.32Å; R101-R319 PolarHBondContact O-NH1 3.23Å; R101-A329 PolarHBondContact NE-O 3.36Å; R101-A329 PolarHBondContact NH2-O 3.18Å
102	W	94.1	Very high	88.5	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.027	25%	0.249	C	C	.	.	S	Bend	trans	-98.8	116.8	164.8	178.4	79.8	0	0	0	108.7	F97 E100 C104 I114 E121 L125 F306	F97-W102 HydrophobicContact CB-CE3 4.33Å; F97-W102 HydrophobicContact CB-CZ3 4.46Å; F97-W102 WeakPolarHBondContact CB-O 3.42Å; F97-W102 AromaticContact CD1-CE3 3.41Å; F97-W102 HydrophobicContact CD1-CE3 3.41Å; F97-W102 VanDerWaalsContact CD1-CE3 3.41Å; F97-W102 AromaticContact CD1-CZ3 3.67Å; F97-W102 HydrophobicContact CD1-CZ3 3.67Å; F97-W102 WeakPolarHBondContact CD1-O 3.24Å; F97-W102 HydrophobicContact CD2-CE3 4.39Å; F97-W102 AromaticContact CD2-CZ3 3.86Å; F97-W102 HydrophobicContact CD2-CZ3 3.86Å; F97-W102 AromaticContact CE1-CE3 3.68Å; F97-W102 HydrophobicContact CE1-CE3 3.68Å; F97-W102 AromaticContact CE1-CZ3 3.73Å; F97-W102 HydrophobicContact CE1-CZ3 3.73Å; F97-W102 AromaticContact CE2-CZ3 3.94Å; F97-W102 HydrophobicContact CE2-CZ3 3.94Å; F97-W102 AromaticContact CG-CE3 3.79Å; F97-W102 HydrophobicContact CG-CE3 3.79Å; F97-W102 AromaticContact CG-CZ3 3.72Å; F97-W102 HydrophobicContact CG-CZ3 3.72Å; F97-W102 HydrophobicContact CZ-CE3 4.3Å; F97-W102 AromaticContact CZ-CZ3 3.87Å; F97-W102 HydrophobicContact CZ-CZ3 3.87Å; E100-W102 VanDerWaalsContact C-N 3.27Å; E100-W102 WeakPolarHBondContact CB-O 3.5Å; E100-W102 PolarHBondContact O-N 2.64Å; W102-C104 HydrophobicContact CE3-CB 4.37Å; W102-C104 HydrophobicContact CH2-CB 3.66Å; W102-C104 VanDerWaalsContact CH2-SG 3.55Å; W102-C104 HydrophobicContact CZ2-CB 4.06Å; W102-C104 HydrophobicContact CZ3-CB 3.83Å; W102-I114 HydrophobicContact CZ2-CD1 3.98Å; W102-E121 HydrophobicContact CD2-CB 4.13Å; W102-E121 HydrophobicContact CD2-CG 3.6Å; W102-E121 HydrophobicContact CE3-CB 3.99Å; W102-E121 HydrophobicContact CE3-CG 3.46Å; W102-E121 VanDerWaalsContact CE3-CG 3.46Å; W102-E121 HydrophobicContact CG-CG 4.09Å; W102-E121 HydrophobicContact CH2-CB 3.91Å; W102-E121 HydrophobicContact CH2-CG 4.32Å; W102-E121 HydrophobicContact CZ2-CB 4.05Å; W102-E121 HydrophobicContact CZ2-CG 4.44Å; W102-E121 HydrophobicContact CZ3-CB 3.89Å; W102-E121 HydrophobicContact CZ3-CG 3.86Å; W102-L125 HydrophobicContact CH2-CD1 4.17Å; W102-L125 HydrophobicContact CH2-CD2 4.08Å; W102-L125 HydrophobicContact CH2-CG 4.07Å; W102-L125 HydrophobicContact CZ2-CD1 4.09Å; W102-L125 HydrophobicContact CZ2-CG 4.48Å; W102-F306 HydrophobicContact CB-CB 4.44Å; W102-F306 HydrophobicContact CB-CD1 4.03Å; W102-F306 HydrophobicContact CB-CD2 3.67Å; W102-F306 HydrophobicContact CB-CE1 4.12Å; W102-F306 HydrophobicContact CB-CE2 3.78Å; W102-F306 HydrophobicContact CB-CG 3.79Å; W102-F306 HydrophobicContact CB-CZ 4Å; W102-F306 AromaticContact CD1-CE1 3.81Å; W102-F306 HydrophobicContact CG-CD1 4.41Å; W102-F306 HydrophobicContact CG-CE1 4.17Å; W102-F306 HydrophobicContact CG-CE2 4.42Å; W102-F306 HydrophobicContact CG-CZ 4.17Å
103	N	91.9	Very high	88.1	Confident	47 Å²	47	55.4 Å²	55.4	25%	0.251	26%	0.255	S	S	.	.			trans	-100.1	23.8	-173.5	66.1	-21.3	0	0	0	113.9	F97 T105	F97-N103 WeakPolarHBondContact O-CA 3.36Å; N103-T105 VanDerWaalsContact C-N 3.31Å; N103-T105 PolarHBondContact O-N 2.83Å; N103-T105 VanDerWaalsContact OD1-CG2 3.24Å; N103-T105 WeakPolarHBondContact OD1-CG2 3.49Å; N103-T105 PolarHBondContact OD1-N 3.4Å; N103-T105 PolarHBondContact OD1-OG1 3.09Å
104	C	91.8	Very high	87.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.255	C	S	.	.			trans	54	43.6	-172.4	-161.7	0	0	0	0	113.9	C93 Q94 F97 W102 L106	C93-C104 HydrophobicContact CB-CB 3.97Å; C93-C104 WeakPolarHBondContact CB-SG 3.25Å; C93-C104 WeakPolarHBondContact SG-CB 3.29Å; C93-C104 CovalentContact SG-SG 2.02Å; C93-C104 PolarHBondContact SG-SG 3.45Å; Q94-C104 HydrophobicContact CG-CB 4.37Å; F97-C104 HydrophobicContact CB-CB 4.15Å; W102-C104 HydrophobicContact CE3-CB 4.37Å; W102-C104 HydrophobicContact CH2-CB 3.66Å; W102-C104 VanDerWaalsContact CH2-SG 3.55Å; W102-C104 HydrophobicContact CZ2-CB 4.06Å; W102-C104 HydrophobicContact CZ3-CB 3.83Å; C104-L106 WeakPolarHBondContact O-CG 3.49Å; C104-L106 PolarHBondContact O-N 3.37Å
105	T	82.9	Confident	87.4	Confident	41 Å²	41	53 Å²	53	25%	0.252	24%	0.244	S	C	.	.			trans	-64	106.9	166.9	33.5	0	0	0	0	110.2	N103 E107	N103-T105 VanDerWaalsContact C-N 3.31Å; N103-T105 PolarHBondContact O-N 2.83Å; N103-T105 VanDerWaalsContact OD1-CG2 3.24Å; N103-T105 WeakPolarHBondContact OD1-CG2 3.49Å; N103-T105 PolarHBondContact OD1-N 3.4Å; N103-T105 PolarHBondContact OD1-OG1 3.09Å; T105-E107 VanDerWaalsContact C-N 3.29Å; T105-E107 PolarHBondContact O-N 3.06Å
106	L	73.7	Confident	87	Confident	27 Å²	27	56.4 Å²	56.4	14%	0.141	26%	0.258	C	S	.	.			trans	-91.8	16.8	-178.6	-64.3	-176.2	0	0	0	113.2	A90 C104 R111 L125	A90-L106 HydrophobicContact CB-CD1 3.62Å; C104-L106 WeakPolarHBondContact O-CG 3.49Å; C104-L106 PolarHBondContact O-N 3.37Å; L106-R111 HydrophobicContact CD2-CG 4.39Å; L106-R111 WeakPolarHBondContact O-CD 3.32Å; L106-L125 HydrophobicContact CD2-CD1 4.47Å; L106-L125 HydrophobicContact CD2-CD2 3.81Å
107	E	71.5	Confident	86.6	Confident	137 Å²	137	60.3 Å²	60.3	64%	0.64	27%	0.272	S	S	*	.			trans	-94.8	140.9	-173.2	-66.7	-179.5	-173.4	0	0	113.6	P37 T105	P37-E107 HydrophobicContact CB-CG 4.42Å; T105-E107 VanDerWaalsContact C-N 3.29Å; T105-E107 PolarHBondContact O-N 3.06Å
108	G	75.9	Confident	86.4	Confident	31 Å²	31	60.3 Å²	60.3	32%	0.32	27%	0.272	S	S	.	.	H	α-helix	trans	54.3	-138	168.3	0	0	0	0	0	115.7	H110	G108-H110 PolarHBondContact O-N 2.94Å
109	R	82.8	Confident	86.5	Confident	211 Å²	211	55.4 Å²	55.4	80%	0.796	25%	0.253	S	S	*	.	H	α-helix	trans	-69.1	-30.5	-173.4	-63.4	-178.9	-178	180	0.6	113.1	R111 A112 N113	R109-R111 PolarHBondContact O-N 2.91Å; R109-A112 PolarHBondContact O-N 3.23Å; R109-N113 WeakPolarHBondContact O-CB 3.31Å; R109-N113 PolarHBondContact O-N 3.13Å; R109-N113 PolarHBondContact O-ND2 3.27Å; R109-N113 VanDerWaalsContact O-ND2 3.15Å
110	H	85.4	Confident	86.8	Confident	57 Å²	57	54.2 Å²	54.2	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-47.1	-178.4	-65.4	-50.4	0	0	0	111.5	G108 N113 I114 S310 K311 S313	G108-H110 PolarHBondContact O-N 2.94Å; H110-N113 PolarHBondContact O-N 3.47Å; H110-I114 PolarHBondContact O-N 3.3Å; H110-S310 PolarHBondContact CE1-O 3.03Å; H110-S310 PolarHBondContact ND1-O 2.84Å; H110-K311 PolarHBondContact ND1-O 2.98Å; H110-S313 PolarHBondContact ND1-N 3.44Å
111	R	82.9	Confident	86.9	Confident	26 Å²	26	50.8 Å²	50.8	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-48.3	174.1	178.9	-176.1	148.2	81.4	4.8	111.9	G31 L32 L106 R109 N113 I114 L115	G31-R111 VanDerWaalsContact O-CZ 3.29Å; G31-R111 PolarHBondContact O-NH1 2.69Å; G31-R111 PolarHBondContact O-NH2 3.24Å; L32-R111 VanDerWaalsContact CA-NH2 3.3Å; L106-R111 HydrophobicContact CD2-CG 4.39Å; L106-R111 WeakPolarHBondContact O-CD 3.32Å; R109-R111 PolarHBondContact O-N 2.91Å; R111-N113 PolarHBondContact O-N 2.02Å; R111-I114 WeakPolarHBondContact O-CG2 3.44Å; R111-I114 PolarHBondContact O-N 2.65Å; R111-L115 HydrophobicContact CG-CD1 4.04Å; R111-L115 HydrophobicContact CG-CG 4.43Å; R111-L115 VanDerWaalsContact O-CG 3.28Å; R111-L115 WeakPolarHBondContact O-CG 3.46Å; R111-L115 PolarHBondContact O-N 3.11Å; R111-L115 VanDerWaalsContact O-N 3.13Å
112	A	84.1	Confident	86.8	Confident	12 Å²	12	45.5 Å²	45.5	10%	0.099	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-37.3	179.2	0	0	0	0	0	111.9	R109 K116	R109-A112 PolarHBondContact O-N 3.23Å; A112-K116 WeakPolarHBondContact O-CD 3.47Å; A112-K116 VanDerWaalsContact O-CG 3.26Å; A112-K116 WeakPolarHBondContact O-CG 3.45Å; A112-K116 PolarHBondContact O-N 3.28Å
113	N	88.1	Confident	86.9	Confident	41 Å²	41	45.3 Å²	45.3	22%	0.219	21%	0.212	C	C	.	.	H	α-helix	trans	-73.9	-39.4	179.7	-68.7	-27.3	0	0	0	112.9	R109 H110 R111 K116 K311 Y312	R109-N113 WeakPolarHBondContact O-CB 3.31Å; R109-N113 PolarHBondContact O-N 3.13Å; R109-N113 PolarHBondContact O-ND2 3.27Å; R109-N113 VanDerWaalsContact O-ND2 3.15Å; H110-N113 PolarHBondContact O-N 3.47Å; R111-N113 PolarHBondContact O-N 2.02Å; N113-K116 PolarHBondContact O-N 3.32Å; N113-K311 WeakPolarHBondContact CB-O 3.08Å; N113-K311 PolarHBondContact ND2-O 2.95Å; N113-Y312 HydrophobicContact CB-CD1 3.79Å; N113-Y312 HydrophobicContact CB-CE1 4.06Å
114	I	88.7	Confident	87.1	Confident	2 Å²	2	43 Å²	43	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-65.5	-42.8	179.1	-148.3	171.4	0	0	0	110.5	W102 H110 R111 K116 R117 F119 E121 T122 L125 F306	W102-I114 HydrophobicContact CZ2-CD1 3.98Å; H110-I114 PolarHBondContact O-N 3.3Å; R111-I114 WeakPolarHBondContact O-CG2 3.44Å; R111-I114 PolarHBondContact O-N 2.65Å; I114-K116 VanDerWaalsContact C-N 3.28Å; I114-K116 PolarHBondContact O-N 3.45Å; I114-R117 PolarHBondContact O-N 2.91Å; I114-R117 VanDerWaalsContact O-O 3.1Å; I114-F119 HydrophobicContact CG1-CD2 3.84Å; I114-F119 HydrophobicContact CG1-CE2 4.44Å; I114-E121 HydrophobicContact CD1-CB 3.75Å; I114-E121 HydrophobicContact CD1-CG 4.27Å; I114-T122 PolarHBondContact O-OG1 3.46Å; I114-L125 HydrophobicContact CG2-CD1 4Å; I114-F306 HydrophobicContact CD1-CE1 4.45Å
115	L	87.1	Confident	87.3	Confident	19 Å²	19	43.2 Å²	43.2	10%	0.099	20%	0.201	C	C	.	.	H	α-helix	trans	-68.2	-25.4	-177.5	-66	-176.1	0	0	0	114.3	L32 R111 R117 T122 L125	L32-L115 HydrophobicContact CB-CD1 4.02Å; L32-L115 HydrophobicContact CD2-CD1 3.67Å; L32-L115 HydrophobicContact CD2-CD2 3.2Å; L32-L115 HydrophobicContact CD2-CG 3.95Å; L32-L115 HydrophobicContact CG-CD1 4.39Å; R111-L115 HydrophobicContact CG-CD1 4.04Å; R111-L115 HydrophobicContact CG-CG 4.43Å; R111-L115 VanDerWaalsContact O-CG 3.28Å; R111-L115 WeakPolarHBondContact O-CG 3.46Å; R111-L115 PolarHBondContact O-N 3.11Å; R111-L115 VanDerWaalsContact O-N 3.13Å; L115-R117 PolarHBondContact O-N 3.49Å; L115-T122 HydrophobicContact CD2-CG2 4.07Å; L115-L125 HydrophobicContact CD2-CB 4.22Å; L115-L125 HydrophobicContact CD2-CD1 3.55Å
116	K	86.7	Confident	87.8	Confident	139 Å²	139	41.8 Å²	41.8	60%	0.604	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.1	173.1	-75.4	171.9	-176	-177.5	0	112.9	A112 N113 I114	A112-K116 WeakPolarHBondContact O-CD 3.47Å; A112-K116 VanDerWaalsContact O-CG 3.26Å; A112-K116 WeakPolarHBondContact O-CG 3.45Å; A112-K116 PolarHBondContact O-N 3.28Å; N113-K116 PolarHBondContact O-N 3.32Å; I114-K116 VanDerWaalsContact C-N 3.28Å; I114-K116 PolarHBondContact O-N 3.45Å
117	R	88	Confident	88.9	Confident	103 Å²	103	40.5 Å²	40.5	39%	0.389	18%	0.184	S	C	.	.	S	Bend	trans	-110.5	152.3	-176.7	-56.6	-57.2	-68.7	-158.5	-4	111.2	I114 L115 F119 T122 E301 Y312	I114-R117 PolarHBondContact O-N 2.91Å; I114-R117 VanDerWaalsContact O-O 3.1Å; L115-R117 PolarHBondContact O-N 3.49Å; R117-F119 VanDerWaalsContact C-N 3.25Å; R117-F119 HydrophobicContact CB-CD1 4.19Å; R117-F119 HydrophobicContact CB-CD2 3.69Å; R117-F119 HydrophobicContact CB-CE1 3.89Å; R117-F119 HydrophobicContact CB-CE2 3.38Å; R117-F119 HydrophobicContact CB-CG 4.08Å; R117-F119 HydrophobicContact CB-CZ 3.48Å; R117-F119 VanDerWaalsContact CB-CZ 3.48Å; R117-F119 HydrophobicContact CG-CD2 4.48Å; R117-F119 HydrophobicContact CG-CE1 4.44Å; R117-F119 HydrophobicContact CG-CE2 3.72Å; R117-F119 HydrophobicContact CG-CZ 3.68Å; R117-F119 PolarHBondContact O-N 3.4Å; R117-T122 WeakPolarHBondContact O-CB 3.26Å; R117-T122 WeakPolarHBondContact O-CG2 3.01Å; R117-T122 PolarHBondContact O-OG1 3.43Å; R117-E301 IonicContact CZ-OE1 3.28Å; R117-E301 IonicContact CZ-OE2 3.66Å; R117-E301 VanDerWaalsContact NE-CD 3.29Å; R117-E301 IonicContact NE-OE1 2.82Å; R117-E301 PolarHBondContact NE-OE1 3.3Å; R117-E301 IonicContact NE-OE2 3.72Å; R117-E301 PolarHBondContact NE-OE2 3.39Å; R117-E301 VanDerWaalsContact NH2-CD 3.34Å; R117-E301 IonicContact NH2-OE1 2.84Å; R117-E301 IonicContact NH2-OE2 3.62Å; R117-E301 PolarHBondContact NH2-OE2 3.47Å; R117-Y312 HydrophobicContact CG-CE1 3.74Å
118	G	89.8	Confident	90.1	Very high	1 Å²	1	34 Å²	34	1%	0.01	15%	0.154	C	C	.	.			trans	-86.1	44.2	-179.5	0	0	0	0	0	113.8	H299 I300 E301	G118-H299 WeakPolarHBondContact O-CB 3.08Å; G118-I300 PolarHBondContact O-N 2.9Å; G118-E301 PolarHBondContact N-OE1 3.07Å; G118-E301 PolarHBondContact O-N 3.48Å
119	F	94.1	Very high	90.9	Very high	7 Å²	7	33.2 Å²	33.2	3%	0.031	14%	0.144	C	C	.	.			trans	-77.5	167.4	-178.5	-56.3	-42.7	0	0	0	113.3	I114 R117 E121 T122 A123 E301 D302 P304 Y312	I114-F119 HydrophobicContact CG1-CD2 3.84Å; I114-F119 HydrophobicContact CG1-CE2 4.44Å; R117-F119 VanDerWaalsContact C-N 3.25Å; R117-F119 HydrophobicContact CB-CD1 4.19Å; R117-F119 HydrophobicContact CB-CD2 3.69Å; R117-F119 HydrophobicContact CB-CE1 3.89Å; R117-F119 HydrophobicContact CB-CE2 3.38Å; R117-F119 HydrophobicContact CB-CG 4.08Å; R117-F119 HydrophobicContact CB-CZ 3.48Å; R117-F119 VanDerWaalsContact CB-CZ 3.48Å; R117-F119 HydrophobicContact CG-CD2 4.48Å; R117-F119 HydrophobicContact CG-CE1 4.44Å; R117-F119 HydrophobicContact CG-CE2 3.72Å; R117-F119 HydrophobicContact CG-CZ 3.68Å; R117-F119 PolarHBondContact O-N 3.4Å; F119-E121 VanDerWaalsContact C-N 3.28Å; F119-E121 WeakPolarHBondContact CB-OE2 3.29Å; F119-E121 PolarHBondContact O-N 3.26Å; F119-T122 WeakPolarHBondContact O-CB 3.02Å; F119-T122 PolarHBondContact O-N 2.63Å; F119-T122 VanDerWaalsContact O-N 3.16Å; F119-A123 PolarHBondContact O-N 2.91Å; F119-E301 HydrophobicContact CD1-CB 3.67Å; F119-E301 HydrophobicContact CE1-CB 3.77Å; F119-E301 WeakPolarHBondContact CE1-OE2 3.03Å; F119-D302 VanDerWaalsContact CD1-O 3.3Å; F119-D302 WeakPolarHBondContact CD1-O 3.48Å; F119-D302 VanDerWaalsContact CE1-O 3.29Å; F119-D302 WeakPolarHBondContact CE1-O 3.16Å; F119-P304 HydrophobicContact CE2-CG 4.01Å; F119-P304 HydrophobicContact CZ-CG 4.16Å; F119-Y312 AromaticContact CE2-CD1 3.91Å; F119-Y312 HydrophobicContact CE2-CD1 3.91Å; F119-Y312 HydrophobicContact CE2-CD2 4.35Å; F119-Y312 AromaticContact CE2-CE1 3.76Å; F119-Y312 HydrophobicContact CE2-CE1 3.76Å; F119-Y312 HydrophobicContact CE2-CE2 4.18Å; F119-Y312 HydrophobicContact CE2-CG 4.19Å; F119-Y312 AromaticContact CE2-CZ 3.85Å; F119-Y312 HydrophobicContact CZ-CE1 4.15Å; F119-Y312 HydrophobicContact CZ-CE2 4.05Å; F119-Y312 AromaticContact CZ-CZ 3.78Å
120	K	95.3	Very high	91.5	Very high	42 Å²	42	23.3 Å²	23.3	18%	0.183	11%	0.106	C	C	.	.	H	α-helix	trans	-56.9	-42	173.7	-150.2	175.7	165.1	174.6	0	111.7	T122 A123 F124 Y247 E248 S250 S303	K120-T122 VanDerWaalsContact C-N 3.34Å; K120-T122 PolarHBondContact O-N 3.03Å; K120-A123 WeakPolarHBondContact O-CB 3.37Å; K120-A123 PolarHBondContact O-N 3.48Å; K120-F124 PolarHBondContact O-N 3.04Å; K120-F124 VanDerWaalsContact O-N 3.16Å; K120-Y247 VanDerWaalsContact C-CE2 3.49Å; K120-Y247 HydrophobicContact CB-CD2 4.44Å; K120-Y247 HydrophobicContact CB-CE2 3.8Å; K120-Y247 HydrophobicContact CD-CD2 4.49Å; K120-Y247 HydrophobicContact CD-CE2 4.07Å; K120-Y247 WeakPolarHBondContact CE-O 3.36Å; K120-Y247 HydrophobicContact CG-CD2 3.84Å; K120-Y247 HydrophobicContact CG-CE2 3.56Å; K120-Y247 PolarHBondContact NZ-O 3.22Å; K120-Y247 WeakPolarHBondContact O-CD2 3.44Å; K120-Y247 WeakPolarHBondContact O-CE2 3.41Å; K120-E248 PolarHBondContact NZ-O 3.09Å; K120-S250 WeakPolarHBondContact CD-OG 3.25Å; K120-S250 WeakPolarHBondContact CE-OG 3.32Å; K120-S250 WeakPolarHBondContact CG-OG 3.34Å; K120-S303 WeakPolarHBondContact CB-OG 3.31Å
121	E	94.9	Very high	92.1	Very high	6 Å²	6	20.6 Å²	20.6	3%	0.028	9%	0.094	C	C	.	.	H	α-helix	trans	-65.7	-39.6	178.3	-63.1	73	-160.2	0	0	110.8	W102 I114 F119 A123 F124 L125 Y247 S303 F306	W102-E121 HydrophobicContact CD2-CB 4.13Å; W102-E121 HydrophobicContact CD2-CG 3.6Å; W102-E121 HydrophobicContact CE3-CB 3.99Å; W102-E121 HydrophobicContact CE3-CG 3.46Å; W102-E121 VanDerWaalsContact CE3-CG 3.46Å; W102-E121 HydrophobicContact CG-CG 4.09Å; W102-E121 HydrophobicContact CH2-CB 3.91Å; W102-E121 HydrophobicContact CH2-CG 4.32Å; W102-E121 HydrophobicContact CZ2-CB 4.05Å; W102-E121 HydrophobicContact CZ2-CG 4.44Å; W102-E121 HydrophobicContact CZ3-CB 3.89Å; W102-E121 HydrophobicContact CZ3-CG 3.86Å; I114-E121 HydrophobicContact CD1-CB 3.75Å; I114-E121 HydrophobicContact CD1-CG 4.27Å; F119-E121 VanDerWaalsContact C-N 3.28Å; F119-E121 WeakPolarHBondContact CB-OE2 3.29Å; F119-E121 PolarHBondContact O-N 3.26Å; E121-A123 VanDerWaalsContact C-N 3.34Å; E121-A123 PolarHBondContact O-N 3.15Å; E121-F124 PolarHBondContact O-N 3.37Å; E121-L125 WeakPolarHBondContact O-CG 3.4Å; E121-L125 PolarHBondContact O-N 3.31Å; E121-Y247 HydrophobicContact CG-CE2 4.41Å; E121-Y247 PolarHBondContact OE1-OH 3.05Å; E121-Y247 VanDerWaalsContact OE1-OH 3.06Å; E121-S303 VanDerWaalsContact CD-OG 3.26Å; E121-S303 WeakPolarHBondContact OE1-CB 3.49Å; E121-S303 PolarHBondContact OE1-OG 2.04Å; E121-S303 VanDerWaalsContact OE1-OG 3.11Å; E121-S303 WeakPolarHBondContact OE2-CB 3.3Å; E121-S303 PolarHBondContact OE2-OG 3.41Å; E121-F306 HydrophobicContact CG-CE2 4.33Å; E121-F306 HydrophobicContact CG-CZ 4.08Å; E121-F306 VanDerWaalsContact OE1-CE2 3.26Å; E121-F306 WeakPolarHBondContact OE1-CE2 3.19Å
122	T	93.5	Very high	92.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-44.5	175.1	-54.2	0	0	0	0	110.5	I114 L115 R117 F119 K120 F124 L125 Y126	I114-T122 PolarHBondContact O-OG1 3.46Å; L115-T122 HydrophobicContact CD2-CG2 4.07Å; R117-T122 WeakPolarHBondContact O-CB 3.26Å; R117-T122 WeakPolarHBondContact O-CG2 3.01Å; R117-T122 PolarHBondContact O-OG1 3.43Å; F119-T122 WeakPolarHBondContact O-CB 3.02Å; F119-T122 PolarHBondContact O-N 2.63Å; F119-T122 VanDerWaalsContact O-N 3.16Å; K120-T122 VanDerWaalsContact C-N 3.34Å; K120-T122 PolarHBondContact O-N 3.03Å; T122-F124 VanDerWaalsContact C-N 3.29Å; T122-F124 PolarHBondContact O-N 3.11Å; T122-L125 WeakPolarHBondContact O-CB 3.41Å; T122-L125 PolarHBondContact O-N 3.41Å; T122-L125 VanDerWaalsContact O-N 3.1Å; T122-Y126 HydrophobicContact CG2-CD2 3.8Å; T122-Y126 HydrophobicContact CG2-CE2 3.67Å; T122-Y126 VanDerWaalsContact O-CD2 3.3Å; T122-Y126 WeakPolarHBondContact O-CD2 3.42Å; T122-Y126 PolarHBondContact O-N 3.4Å
123	A	95.4	Very high	93.3	Very high	2 Å²	2	19.1 Å²	19.1	2%	0.017	9%	0.086	C	C	.	.	H	α-helix	trans	-55.6	-44.6	176.3	0	0	0	0	0	112.4	F119 K120 E121 Y126 A127 N199 L297 L298	F119-A123 PolarHBondContact O-N 2.91Å; K120-A123 WeakPolarHBondContact O-CB 3.37Å; K120-A123 PolarHBondContact O-N 3.48Å; E121-A123 VanDerWaalsContact C-N 3.34Å; E121-A123 PolarHBondContact O-N 3.15Å; A123-Y126 PolarHBondContact O-N 3.03Å; A123-A127 PolarHBondContact O-N 3.45Å; A123-A127 VanDerWaalsContact O-N 3.15Å; A123-N199 WeakPolarHBondContact CA-ND2 3.28Å; A123-N199 VanDerWaalsContact CB-ND2 3.28Å; A123-N199 WeakPolarHBondContact CB-ND2 3.43Å; A123-L297 HydrophobicContact CB-CB 4.19Å; A123-L298 VanDerWaalsContact CB-O 3.22Å; A123-L298 WeakPolarHBondContact CB-O 3.39Å
124	F	96.8	Very high	93.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63.2	-44.3	174.9	-176.9	-91.8	0	0	0	112.3	C93 Q96 F97 K120 E121 T122 Y126 A127 I128 L243 K244 Y247 L297	C93-F124 HydrophobicContact CB-CE1 4.1Å; Q96-F124 HydrophobicContact CB-CZ 4.31Å; Q96-F124 HydrophobicContact CG-CZ 4.29Å; F97-F124 HydrophobicContact CD2-CD1 4.43Å; F97-F124 HydrophobicContact CD2-CE1 4.18Å; F97-F124 AromaticContact CE2-CD1 3.52Å; F97-F124 HydrophobicContact CE2-CD1 3.52Å; F97-F124 HydrophobicContact CE2-CD2 4.2Å; F97-F124 AromaticContact CE2-CE1 3.53Å; F97-F124 HydrophobicContact CE2-CE1 3.53Å; F97-F124 HydrophobicContact CE2-CE2 4.17Å; F97-F124 AromaticContact CE2-CG 3.88Å; F97-F124 HydrophobicContact CE2-CG 3.88Å; F97-F124 AromaticContact CE2-CZ 3.86Å; F97-F124 HydrophobicContact CE2-CZ 3.86Å; F97-F124 HydrophobicContact CZ-CD1 4.18Å; F97-F124 HydrophobicContact CZ-CD2 4.49Å; F97-F124 HydrophobicContact CZ-CG 4.14Å; K120-F124 PolarHBondContact O-N 3.04Å; K120-F124 VanDerWaalsContact O-N 3.16Å; E121-F124 PolarHBondContact O-N 3.37Å; T122-F124 VanDerWaalsContact C-N 3.29Å; T122-F124 PolarHBondContact O-N 3.11Å; F124-Y126 VanDerWaalsContact C-N 3.29Å; F124-Y126 PolarHBondContact O-N 3.24Å; F124-A127 PolarHBondContact O-N 2.82Å; F124-A127 VanDerWaalsContact O-N 3.08Å; F124-I128 HydrophobicContact CD1-CB 4.34Å; F124-I128 HydrophobicContact CD1-CG2 4.05Å; F124-I128 HydrophobicContact CE1-CB 3.89Å; F124-I128 HydrophobicContact CE1-CG1 4.23Å; F124-I128 HydrophobicContact CE1-CG2 3.86Å; F124-I128 HydrophobicContact CZ-CB 4.17Å; F124-I128 HydrophobicContact CZ-CD1 4.42Å; F124-I128 HydrophobicContact CZ-CG1 4.33Å; F124-I128 WeakPolarHBondContact O-CG2 3.36Å; F124-I128 PolarHBondContact O-N 3.49Å; F124-L243 HydrophobicContact CD2-CB 4.29Å; F124-L243 HydrophobicContact CE2-CB 3.72Å; F124-K244 HydrophobicContact CE2-CB 4.34Å; F124-Y247 HydrophobicContact CB-CD2 3.77Å; F124-Y247 HydrophobicContact CB-CE2 4.49Å; F124-Y247 HydrophobicContact CB-CG 4.43Å; F124-Y247 HydrophobicContact CD2-CG 4.42Å; F124-Y247 HydrophobicContact CG-CD2 4.45Å; F124-L297 HydrophobicContact CB-CD1 4.33Å; F124-L297 HydrophobicContact CD2-CD1 4.44Å
125	L	95	Very high	94.1	Very high	4 Å²	4	17.3 Å²	17.3	2%	0.021	8%	0.076	C	C	.	.	H	α-helix	trans	-58	-39.8	178.5	-72	172.7	0	0	0	112.6	W102 L106 I114 L115 E121 T122 S129	W102-L125 HydrophobicContact CH2-CD1 4.17Å; W102-L125 HydrophobicContact CH2-CD2 4.08Å; W102-L125 HydrophobicContact CH2-CG 4.07Å; W102-L125 HydrophobicContact CZ2-CD1 4.09Å; W102-L125 HydrophobicContact CZ2-CG 4.48Å; L106-L125 HydrophobicContact CD2-CD1 4.47Å; L106-L125 HydrophobicContact CD2-CD2 3.81Å; I114-L125 HydrophobicContact CG2-CD1 4Å; L115-L125 HydrophobicContact CD2-CB 4.22Å; L115-L125 HydrophobicContact CD2-CD1 3.55Å; E121-L125 WeakPolarHBondContact O-CG 3.4Å; E121-L125 PolarHBondContact O-N 3.31Å; T122-L125 WeakPolarHBondContact O-CB 3.41Å; T122-L125 PolarHBondContact O-N 3.41Å; T122-L125 VanDerWaalsContact O-N 3.1Å; L125-S129 WeakPolarHBondContact O-CB 3.49Å; L125-S129 PolarHBondContact O-N 2.84Å; L125-S129 VanDerWaalsContact O-N 3.12Å; L125-S129 PolarHBondContact O-OG 3.43Å
126	Y	93.8	Very high	94.6	Very high	10 Å²	10	16.4 Å²	16.4	4%	0.039	7%	0.072	C	C	.	.	H	α-helix	trans	-64.5	-44.3	173.7	-88.3	-91.5	0	0	0	112.3	L32 T122 A123 F124 S130 R186 D196	L32-Y126 HydrophobicContact CD1-CD1 3.36Å; L32-Y126 HydrophobicContact CD1-CD2 4Å; L32-Y126 HydrophobicContact CD1-CE1 3.12Å; L32-Y126 HydrophobicContact CD1-CE2 3.79Å; L32-Y126 HydrophobicContact CD1-CG 3.81Å; L32-Y126 HydrophobicContact CD2-CD2 3.77Å; L32-Y126 HydrophobicContact CD2-CE1 4.42Å; L32-Y126 HydrophobicContact CD2-CE2 3.5Å; L32-Y126 VanDerWaalsContact CD2-CE2 3.5Å; L32-Y126 HydrophobicContact CD2-CG 4.33Å; L32-Y126 HydrophobicContact CG-CE1 4.33Å; L32-Y126 HydrophobicContact CG-CE2 4.25Å; T122-Y126 HydrophobicContact CG2-CD2 3.8Å; T122-Y126 HydrophobicContact CG2-CE2 3.67Å; T122-Y126 VanDerWaalsContact O-CD2 3.3Å; T122-Y126 WeakPolarHBondContact O-CD2 3.42Å; T122-Y126 PolarHBondContact O-N 3.4Å; A123-Y126 PolarHBondContact O-N 3.03Å; F124-Y126 VanDerWaalsContact C-N 3.29Å; F124-Y126 PolarHBondContact O-N 3.24Å; Y126-S130 WeakPolarHBondContact O-CB 3.39Å; Y126-S130 PolarHBondContact O-N 3.24Å; Y126-S130 VanDerWaalsContact O-N 3.13Å; Y126-S130 PolarHBondContact O-OG 3.24Å; Y126-R186 VanDerWaalsContact CE1-NH2 3.26Å; Y126-R186 PolarHBondContact OH-NH1 3.11Å; Y126-R186 PolarHBondContact OH-NH2 2.95Å; Y126-D196 HydrophobicContact CD1-CB 4.02Å; Y126-D196 VanDerWaalsContact CD2-OD1 3.31Å; Y126-D196 WeakPolarHBondContact CD2-OD1 3.45Å; Y126-D196 HydrophobicContact CE1-CB 3.6Å; Y126-D196 VanDerWaalsContact CE1-CG 3.46Å; Y126-D196 HydrophobicContact CE2-CB 4.5Å; Y126-D196 WeakPolarHBondContact CE2-OD1 3.31Å; Y126-D196 VanDerWaalsContact CZ-OD2 3.27Å; Y126-D196 PolarHBondContact OH-OD2 2.58Å
127	A	96.3	Very high	95.1	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-69.4	-46.6	-178.3	0	0	0	0	0	112.5	A123 F124 S130 A131 N199 G203 L243 L297	A123-A127 PolarHBondContact O-N 3.45Å; A123-A127 VanDerWaalsContact O-N 3.15Å; F124-A127 PolarHBondContact O-N 2.82Å; F124-A127 VanDerWaalsContact O-N 3.08Å; A127-S130 PolarHBondContact O-OG 3.19Å; A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 2.66Å; A127-A131 PolarHBondContact O-N 3.39Å; A127-N199 WeakPolarHBondContact CA-O 3.43Å; A127-G203 WeakPolarHBondContact O-CA 2.92Å; A127-L243 HydrophobicContact CB-CD1 4.47Å; A127-L243 HydrophobicContact CB-CD2 3.86Å; A127-L297 HydrophobicContact CB-CD1 4.29Å; A127-L297 HydrophobicContact CB-CD2 3.58Å
128	I	96.7	Very high	95.5	Very high	2 Å²	2	4.9 Å²	4.9	1%	0.01	3%	0.025	C	C	.	.	H	α-helix	trans	-68.1	-37.8	179.8	-165.6	64.4	0	0	0	111.9	S89 E92 F124 A131 G132 F236 L243	S89-I128 PolarHBondContact OG-O 2.97Å; E92-I128 HydrophobicContact CB-CD1 4.38Å; E92-I128 HydrophobicContact CG-CD1 4.01Å; F124-I128 HydrophobicContact CD1-CB 4.34Å; F124-I128 HydrophobicContact CD1-CG2 4.05Å; F124-I128 HydrophobicContact CE1-CB 3.89Å; F124-I128 HydrophobicContact CE1-CG1 4.23Å; F124-I128 HydrophobicContact CE1-CG2 3.86Å; F124-I128 HydrophobicContact CZ-CB 4.17Å; F124-I128 HydrophobicContact CZ-CD1 4.42Å; F124-I128 HydrophobicContact CZ-CG1 4.33Å; F124-I128 WeakPolarHBondContact O-CG2 3.36Å; F124-I128 PolarHBondContact O-N 3.49Å; I128-A131 PolarHBondContact O-N 3.35Å; I128-G132 PolarHBondContact O-N 3.04Å; I128-F236 HydrophobicContact CD1-CE1 3.79Å; I128-F236 HydrophobicContact CD1-CE2 4.49Å; I128-F236 HydrophobicContact CD1-CZ 3.57Å; I128-F236 HydrophobicContact CG1-CE1 4.3Å; I128-F236 HydrophobicContact CG1-CZ 4.13Å; I128-L243 HydrophobicContact CB-CD1 4.23Å; I128-L243 HydrophobicContact CD1-CD1 3.69Å
129	S	94.4	Very high	95.8	Very high	14 Å²	14	7.8 Å²	7.8	10%	0.098	4%	0.037	C	C	.	.	H	α-helix	trans	-67.9	-42.3	178.6	-58.4	0	0	0	0	112	L125 G132 L133	L125-S129 WeakPolarHBondContact O-CB 3.49Å; L125-S129 PolarHBondContact O-N 2.84Å; L125-S129 VanDerWaalsContact O-N 3.12Å; L125-S129 PolarHBondContact O-OG 3.43Å; S129-G132 PolarHBondContact O-N 3.2Å; S129-L133 WeakPolarHBondContact O-CB 3.31Å; S129-L133 WeakPolarHBondContact O-CG 3.25Å; S129-L133 PolarHBondContact O-N 3.27Å
130	S	95.6	Very high	96	Very high	2 Å²	2	7.5 Å²	7.5	1%	0.014	4%	0.035	C	C	.	.	H	α-helix	trans	-68.8	-37	176.2	59.1	0	0	0	0	112.1	Y126 A127 T134 T200	Y126-S130 WeakPolarHBondContact O-CB 3.39Å; Y126-S130 PolarHBondContact O-N 3.24Å; Y126-S130 VanDerWaalsContact O-N 3.13Å; Y126-S130 PolarHBondContact O-OG 3.24Å; A127-S130 PolarHBondContact O-OG 3.19Å; S130-T134 PolarHBondContact O-N 3.4Å; S130-T134 VanDerWaalsContact O-N 3.09Å; S130-T134 PolarHBondContact O-OG1 2.92Å; S130-T134 VanDerWaalsContact O-OG1 3.11Å; S130-T200 PolarHBondContact OG-O 2.56Å
131	A	96.9	Very high	96	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-62.7	-46.6	172.3	0	0	0	0	0	111.7	A127 I128 T134 H135 I207 F236 I239 L243	A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 2.66Å; A127-A131 PolarHBondContact O-N 3.39Å; I128-A131 PolarHBondContact O-N 3.35Å; A131-T134 PolarHBondContact O-N 3.1Å; A131-H135 VanDerWaalsContact O-CB 3.29Å; A131-H135 WeakPolarHBondContact O-CB 3.42Å; A131-H135 PolarHBondContact O-N 3.4Å; A131-I207 HydrophobicContact CB-CD1 3.96Å; A131-I207 HydrophobicContact CB-CG1 3.69Å; A131-F236 HydrophobicContact CB-CE2 4.27Å; A131-I239 HydrophobicContact CB-CG2 4.05Å; A131-L243 HydrophobicContact CB-CD1 3.93Å
132	G	96.4	Very high	96	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-65.1	-39.4	179.1	0	0	0	0	0	113.3	I128 S129 H135 A136 F236	I128-G132 PolarHBondContact O-N 3.04Å; S129-G132 PolarHBondContact O-N 3.2Å; G132-H135 PolarHBondContact O-N 3.22Å; G132-A136 VanDerWaalsContact O-CB 3.31Å; G132-A136 WeakPolarHBondContact O-CB 3.33Å; G132-A136 PolarHBondContact O-N 2.88Å; G132-F236 VanDerWaalsContact CA-CE2 3.45Å
133	L	95.3	Very high	96	Very high	7 Å²	7	9.5 Å²	9.5	4%	0.037	6%	0.06	C	C	.	.	H	α-helix	trans	-59.7	-50.4	171.7	-76.4	169	0	0	0	111.4	L82 A85 S129 H135 L137 V179 L183	L82-L133 HydrophobicContact CD2-CD2 3.47Å; L82-L133 VanDerWaalsContact CD2-CD2 3.47Å; A85-L133 HydrophobicContact CB-CD2 3.85Å; A85-L133 HydrophobicContact CB-CG 4.34Å; S129-L133 WeakPolarHBondContact O-CB 3.31Å; S129-L133 WeakPolarHBondContact O-CG 3.25Å; S129-L133 PolarHBondContact O-N 3.27Å; L133-H135 VanDerWaalsContact C-N 3.33Å; L133-H135 PolarHBondContact O-N 3.3Å; L133-L137 VanDerWaalsContact O-CB 3.32Å; L133-L137 WeakPolarHBondContact O-CB 3.21Å; L133-L137 WeakPolarHBondContact O-CD1 3.43Å; L133-L137 VanDerWaalsContact O-CG 3.25Å; L133-L137 WeakPolarHBondContact O-CG 3.22Å; L133-L137 PolarHBondContact O-N 3.02Å; L133-V179 HydrophobicContact CB-CG2 3.82Å; L133-L183 HydrophobicContact CD1-CD2 4.26Å
134	T	97.1	Very high	96	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.2	-40.3	179.8	-62.1	0	0	0	0	111.7	S130 A131 A138 L172 A175 I207	S130-T134 PolarHBondContact O-N 3.4Å; S130-T134 VanDerWaalsContact O-N 3.09Å; S130-T134 PolarHBondContact O-OG1 2.92Å; S130-T134 VanDerWaalsContact O-OG1 3.11Å; A131-T134 PolarHBondContact O-N 3.1Å; T134-A138 VanDerWaalsContact O-CB 3.29Å; T134-A138 WeakPolarHBondContact O-CB 3.39Å; T134-A138 PolarHBondContact O-N 2.81Å; T134-A138 VanDerWaalsContact O-N 3.07Å; T134-L172 HydrophobicContact CG2-CD2 3.63Å; T134-A175 HydrophobicContact CG2-CB 4.04Å; T134-A175 WeakPolarHBondContact O-CB 3.4Å; T134-I207 HydrophobicContact CG2-CB 4.42Å; T134-I207 HydrophobicContact CG2-CG2 3.88Å
135	H	97.7	Very high	95.8	Very high	5 Å²	5	17 Å²	17	2%	0.023	11%	0.106	C	C	.	.	H	α-helix	trans	-64.7	-53.7	179.6	-170.6	-84	0	0	0	111.8	A131 G132 L133 L137 A138 K139 I207 L233 L234 F236	A131-H135 VanDerWaalsContact O-CB 3.29Å; A131-H135 WeakPolarHBondContact O-CB 3.42Å; A131-H135 PolarHBondContact O-N 3.4Å; G132-H135 PolarHBondContact O-N 3.22Å; L133-H135 VanDerWaalsContact C-N 3.33Å; L133-H135 PolarHBondContact O-N 3.3Å; H135-L137 PolarHBondContact O-N 3.35Å; H135-A138 PolarHBondContact O-N 3.44Å; H135-K139 VanDerWaalsContact CE1-CE 3.42Å; H135-K139 WeakPolarHBondContact CE1-CE 3.44Å; H135-K139 PolarHBondContact O-N 2.69Å; H135-I207 HydrophobicContact CB-CD1 3.97Å; H135-L233 HydrophobicContact CB-CD1 4.41Å; H135-L234 PolarHBondContact NE2-O 3.3Å; H135-F236 HydrophobicContact CB-CD2 4Å; H135-F236 HydrophobicContact CB-CE2 4.2Å; H135-F236 AromaticContact CD2-CD2 3.95Å; H135-F236 AromaticContact CG-CD2 3.84Å
136	A	97.3	Very high	95.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-42.6	-179.1	0	0	0	0	0	112	T81 A85 G132 K139 A140	T81-A136 HydrophobicContact CG2-CB 3.91Å; T81-A136 WeakPolarHBondContact CG2-O 3.11Å; A85-A136 HydrophobicContact CB-CB 3.75Å; G132-A136 VanDerWaalsContact O-CB 3.31Å; G132-A136 WeakPolarHBondContact O-CB 3.33Å; G132-A136 PolarHBondContact O-N 2.88Å; A136-K139 PolarHBondContact O-N 3.43Å; A136-A140 VanDerWaalsContact O-CB 3.28Å; A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 3.41Å
137	L	96.5	Very high	95.5	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-65	-43.7	178.2	-73.5	164.6	0	0	0	112.4	T81 L133 H135 K139 A140 C141 M146 A175 F178 V179	T81-L137 HydrophobicContact CG2-CD2 3.84Å; T81-L137 HydrophobicContact CG2-CG 4.1Å; L133-L137 VanDerWaalsContact O-CB 3.32Å; L133-L137 WeakPolarHBondContact O-CB 3.21Å; L133-L137 WeakPolarHBondContact O-CD1 3.43Å; L133-L137 VanDerWaalsContact O-CG 3.25Å; L133-L137 WeakPolarHBondContact O-CG 3.22Å; L133-L137 PolarHBondContact O-N 3.02Å; H135-L137 PolarHBondContact O-N 3.35Å; L137-K139 VanDerWaalsContact C-N 3.31Å; L137-K139 PolarHBondContact O-N 2.97Å; L137-A140 PolarHBondContact O-N 2.82Å; L137-C141 PolarHBondContact O-N 3.34Å; L137-C141 VanDerWaalsContact O-N 3.11Å; L137-C141 PolarHBondContact O-SG 3.37Å; L137-M146 HydrophobicContact CD2-CE 4.09Å; L137-M146 HydrophobicContact CD2-SD 3.88Å; L137-A175 HydrophobicContact CB-CB 3.86Å; L137-F178 HydrophobicContact CD1-CB 4.26Å; L137-F178 HydrophobicContact CD1-CD1 3.31Å; L137-F178 HydrophobicContact CD1-CE1 3.88Å; L137-F178 HydrophobicContact CD1-CG 3.97Å; L137-F178 HydrophobicContact CD2-CD1 4.19Å; L137-F178 HydrophobicContact CD2-CE1 4.27Å; L137-F178 HydrophobicContact CD2-CG 4.49Å; L137-F178 HydrophobicContact CG-CD1 4.42Å; L137-V179 HydrophobicContact CD1-CG2 3.61Å
138	A	97.1	Very high	95.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-40.5	178.8	0	0	0	0	0	111.6	T134 H135 S142 D170 N171 L172 A175 L233	T134-A138 VanDerWaalsContact O-CB 3.29Å; T134-A138 WeakPolarHBondContact O-CB 3.39Å; T134-A138 PolarHBondContact O-N 2.81Å; T134-A138 VanDerWaalsContact O-N 3.07Å; H135-A138 PolarHBondContact O-N 3.44Å; A138-S142 PolarHBondContact O-N 3.08Å; A138-S142 PolarHBondContact O-OG 3.32Å; A138-D170 HydrophobicContact CB-CB 4.29Å; A138-N171 PolarHBondContact O-N 2.75Å; A138-L172 HydrophobicContact CB-CD2 4.01Å; A138-L172 HydrophobicContact CB-CG 4.44Å; A138-A175 HydrophobicContact CB-CB 3.8Å; A138-L233 HydrophobicContact CB-CD1 3.76Å
139	K	96.4	Very high	95.1	Very high	62 Å²	62	32.3 Å²	32.3	27%	0.27	17%	0.172	S	C	.	.	H	α-helix	trans	-70.9	-34.7	175.5	-72.5	-155.3	169	-158.5	0	113.7	H135 A136 L137 C141 S142 A143 L233	H135-K139 VanDerWaalsContact CE1-CE 3.42Å; H135-K139 WeakPolarHBondContact CE1-CE 3.44Å; H135-K139 PolarHBondContact O-N 2.69Å; A136-K139 PolarHBondContact O-N 3.43Å; L137-K139 VanDerWaalsContact C-N 3.31Å; L137-K139 PolarHBondContact O-N 2.97Å; K139-C141 VanDerWaalsContact C-N 3.3Å; K139-S142 WeakPolarHBondContact CA-OG 3.3Å; K139-S142 PolarHBondContact O-OG 3.1Å; K139-S142 VanDerWaalsContact O-OG 3.08Å; K139-A143 WeakPolarHBondContact O-CB 3.49Å; K139-A143 PolarHBondContact O-N 3.33Å; K139-L233 HydrophobicContact CG-CD1 4.4Å
140	A	96.8	Very high	95	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.9	-36.6	176.6	0	0	0	0	0	111.4	T81 A136 L137 G144 R145 M146	T81-A140 HydrophobicContact CG2-CB 3.71Å; T81-A140 WeakPolarHBondContact OG1-CB 3.41Å; A136-A140 VanDerWaalsContact O-CB 3.28Å; A136-A140 WeakPolarHBondContact O-CB 3.43Å; A136-A140 PolarHBondContact O-N 3.41Å; L137-A140 PolarHBondContact O-N 2.82Å; A140-G144 PolarHBondContact O-N 3.05Å; A140-R145 HydrophobicContact CB-CB 4.45Å; A140-R145 PolarHBondContact O-N 3.03Å; A140-M146 HydrophobicContact CB-CG 3.88Å; A140-M146 HydrophobicContact CB-SD 3.71Å
141	C	95.7	Very high	94.8	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.02	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-48.7	174	-65.2	0	0	0	0	112.9	L137 K139 A143 G144 C149 N171 Y174	L137-C141 PolarHBondContact O-N 3.34Å; L137-C141 VanDerWaalsContact O-N 3.11Å; L137-C141 PolarHBondContact O-SG 3.37Å; K139-C141 VanDerWaalsContact C-N 3.3Å; C141-A143 VanDerWaalsContact C-N 3.28Å; C141-A143 PolarHBondContact O-N 3.29Å; C141-G144 PolarHBondContact O-N 3.49Å; C141-G144 VanDerWaalsContact O-N 3.14Å; C141-C149 WeakPolarHBondContact CA-SG 3.25Å; C141-C149 HydrophobicContact CB-CB 3.81Å; C141-C149 WeakPolarHBondContact CB-SG 3.31Å; C141-C149 WeakPolarHBondContact SG-CB 3.34Å; C141-C149 CovalentContact SG-SG 2.03Å; C141-C149 PolarHBondContact SG-SG 3.01Å; C141-N171 HydrophobicContact CB-CB 3.89Å; C141-Y174 WeakPolarHBondContact SG-CD1 3.16Å; C141-Y174 VanDerWaalsContact SG-CE1 3.58Å
142	S	94.9	Very high	94.2	Very high	23 Å²	23	39.3 Å²	39.3	16%	0.161	21%	0.214	C	C	.	.	H	α-helix	trans	-67.6	-28.5	177.4	55.7	0	0	0	0	112.7	A138 K139 G144 C168 G169 D170	A138-S142 PolarHBondContact O-N 3.08Å; A138-S142 PolarHBondContact O-OG 3.32Å; K139-S142 WeakPolarHBondContact CA-OG 3.3Å; K139-S142 PolarHBondContact O-OG 3.1Å; K139-S142 VanDerWaalsContact O-OG 3.08Å; S142-G144 PolarHBondContact O-N 3.24Å; S142-C168 PolarHBondContact O-SG 2.84Å; S142-G169 WeakPolarHBondContact CB-O 3.39Å; S142-D170 PolarHBondContact OG-OD1 2.95Å
143	A	94.9	Very high	93.1	Very high	65 Å²	65	46.8 Å²	46.8	54%	0.537	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.4	173.7	0	0	0	0	0	114.2	K139 C141 R145	K139-A143 WeakPolarHBondContact O-CB 3.49Å; K139-A143 PolarHBondContact O-N 3.33Å; C141-A143 VanDerWaalsContact C-N 3.28Å; C141-A143 PolarHBondContact O-N 3.29Å; A143-R145 HydrophobicContact CB-CG 4.11Å; A143-R145 PolarHBondContact O-N 3.16Å
144	G	94.1	Very high	91.8	Very high	60 Å²	60	49 Å²	49	62%	0.619	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	20.8	-176.4	0	0	0	0	0	114.3	A140 C141 S142 M146	A140-G144 PolarHBondContact O-N 3.05Å; C141-G144 PolarHBondContact O-N 3.49Å; C141-G144 VanDerWaalsContact O-N 3.14Å; S142-G144 PolarHBondContact O-N 3.24Å; G144-M146 VanDerWaalsContact C-N 3.31Å
145	R	93.9	Very high	90.5	Very high	100 Å²	100	51.9 Å²	51.9	38%	0.377	29%	0.287	S	S	.	.			trans	-82.5	-9.4	179	-69.7	-171.1	-69.2	138.5	-12.6	113.7	G77 E84 A140 A143	G77-R145 WeakPolarHBondContact CA-O 3.32Å; E84-R145 IonicContact OE1-NH2 3.2Å; E84-R145 IonicContact OE2-CZ 2.64Å; E84-R145 VanDerWaalsContact OE2-CZ 3.28Å; E84-R145 IonicContact OE2-NH1 2.69Å; E84-R145 PolarHBondContact OE2-NH1 3.49Å; E84-R145 IonicContact OE2-NH2 3.87Å; E84-R145 PolarHBondContact OE2-NH2 3.16Å; A140-R145 HydrophobicContact CB-CB 4.45Å; A140-R145 PolarHBondContact O-N 3.03Å; A143-R145 HydrophobicContact CB-CG 4.11Å; A143-R145 PolarHBondContact O-N 3.16Å
146	M	91.8	Very high	88.9	Confident	6 Å²	6	60.1 Å²	60.1	3%	0.03	33%	0.332	C	S	.	.			trans	-121.3	133.7	-178.2	-69.5	-175.1	61	0	0	109.1	V78 L137 A140 G144 C149 Y174	V78-M146 HydrophobicContact CG2-CE 3.5Å; L137-M146 HydrophobicContact CD2-CE 4.09Å; L137-M146 HydrophobicContact CD2-SD 3.88Å; A140-M146 HydrophobicContact CB-CG 3.88Å; A140-M146 HydrophobicContact CB-SD 3.71Å; G144-M146 VanDerWaalsContact C-N 3.31Å; M146-C149 WeakPolarHBondContact CB-SG 3.36Å; M146-Y174 HydrophobicContact CE-CE1 3.69Å; M146-Y174 VanDerWaalsContact CE-OH 3.25Å; M146-Y174 WeakPolarHBondContact CE-OH 3.4Å; M146-Y174 HydrophobicContact SD-CE1 4.46Å
147	E	89.2	Confident	87.6	Confident	151 Å²	151	63.4 Å²	63.4	71%	0.706	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-26.1	-174.5	-63.7	175.5	177.8	0	0	112.1	D75	D75-E147 PolarHBondContact OD2-N 3.4Å; D75-E147 VanDerWaalsContact OD2-N 3.08Å
148	R	90.6	Very high	86.2	Confident	163 Å²	163	71.7 Å²	71.7	62%	0.615	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	12	-172.2	-61.5	-177.2	179	-93.5	-2.9	114.1	R74 D75 Y174	R74-R148 PolarHBondContact O-NE 3.01Å; R74-R148 PolarHBondContact O-NH2 2.79Å; D75-R148 HydrophobicContact CB-CG 4.38Å; D75-R148 PolarHBondContact OD2-N 3.41Å; R148-Y174 WeakPolarHBondContact O-CE2 3.47Å
149	C	93.6	Very high	84.6	Confident	16 Å²	16	78.8 Å²	78.8	11%	0.108	43%	0.426	C	S	.	.			trans	-148.1	155.4	172.8	57.8	0	0	0	0	111.5	C141 M146 Y174	C141-C149 WeakPolarHBondContact CA-SG 3.25Å; C141-C149 HydrophobicContact CB-CB 3.81Å; C141-C149 WeakPolarHBondContact CB-SG 3.31Å; C141-C149 WeakPolarHBondContact SG-CB 3.34Å; C141-C149 CovalentContact SG-SG 2.03Å; C141-C149 PolarHBondContact SG-SG 3.01Å; M146-C149 WeakPolarHBondContact CB-SG 3.36Å; C149-Y174 HydrophobicContact CB-CD1 3.8Å; C149-Y174 HydrophobicContact CB-CD2 3.58Å; C149-Y174 HydrophobicContact CB-CE1 3.91Å; C149-Y174 HydrophobicContact CB-CE2 3.68Å; C149-Y174 HydrophobicContact CB-CG 3.62Å
150	T	92.5	Very high	82.8	Confident	92 Å²	92	86.5 Å²	86.5	56%	0.564	45%	0.453	S	S	*	.			trans	-119.2	-177.1	174.4	54.8	0	0	0	0	108.9	N171	T150-N171 WeakPolarHBondContact O-CB 3.26Å; T150-N171 PolarHBondContact O-ND2 2.8Å
151	C	91.3	Very high	81.2	Confident	36 Å²	36	93 Å²	93	24%	0.243	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-66.3	164.2	173.4	58.9	0	0	0	0	113.5	E153 C168 G169	C151-E153 PolarHBondContact O-N 2.9Å; C151-C168 HydrophobicContact CB-CB 4.25Å; C151-C168 WeakPolarHBondContact CB-SG 3.43Å; C151-G169 WeakPolarHBondContact CA-O 3.38Å; C151-G169 VanDerWaalsContact CB-O 3.28Å; C151-G169 WeakPolarHBondContact CB-O 3.42Å
152	D	86	Confident	79.7	Confident	35 Å²	35	94.7 Å²	94.7	19%	0.187	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-66.7	124.1	168.8	-154.5	31.2	0	0	0	107.7	G169 R231	D152-G169 PolarHBondContact N-O 3.19Å; D152-R231 IonicContact OD2-NH1 2.81Å; D152-R231 PolarHBondContact OD2-NH1 3.2Å
153	E	73.2	Confident	78.1	Confident	157 Å²	157	100.7 Å²	100.7	73%	0.734	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-72.6	154.8	172.5	-69.8	177	177.3	0	0	109.5	C151	C151-E153 PolarHBondContact O-N 2.9Å
154	A	67.1	Low	77	Confident	55 Å²	55	100.5 Å²	100.5	46%	0.455	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-55.3	141.1	175.2	0	0	0	0	0	110	W165	A154-W165 HydrophobicContact CB-CB 3.58Å; A154-W165 HydrophobicContact CB-CG 4.27Å
155	P	70.7	Confident	76.1	Confident	59 Å²	59	100.4 Å²	100.4	38%	0.383	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-58.2	143.5	173	22.7	-29.7	0	0	0	110.1	L157 W165	P155-L157 HydrophobicContact CB-CG 4.38Å; P155-L157 HydrophobicContact CG-CD1 3.89Å; P155-L157 HydrophobicContact CG-CG 4.13Å; P155-L157 WeakPolarHBondContact O-CG 3.41Å; P155-L157 PolarHBondContact O-N 3.41Å; P155-W165 HydrophobicContact CG-CZ2 4.43Å
156	D	64.1	Low	75.3	Confident	178 Å²	178	97 Å²	97	95%	0.952	48%	0.48	S	S	*	.			trans	-58	101.9	172.2	-84.2	-33	0	0	0	109
157	L	68.3	Low	74.8	Confident	69 Å²	69	99.6 Å²	99.6	36%	0.361	51%	0.508	S	S	.	.			trans	-121.1	147.3	-178.6	-73.3	170.5	0	0	0	109.5	P155 W165	P155-L157 HydrophobicContact CB-CG 4.38Å; P155-L157 HydrophobicContact CG-CD1 3.89Å; P155-L157 HydrophobicContact CG-CG 4.13Å; P155-L157 WeakPolarHBondContact O-CG 3.41Å; P155-L157 PolarHBondContact O-N 3.41Å; L157-W165 HydrophobicContact CD1-CD2 4.36Å; L157-W165 HydrophobicContact CD1-CG 4.12Å; L157-W165 HydrophobicContact CD1-CZ2 4.39Å
158	E	68.7	Low	74.8	Confident	176 Å²	176	95.3 Å²	95.3	82%	0.822	49%	0.494	S	S	*	.			trans	-56.6	143.8	172.7	-70.3	-179.5	159.5	0	0	111.6	R160 K161 A162	E158-R160 PolarHBondContact O-N 2.86Å; E158-K161 PolarHBondContact O-N 3.27Å; E158-A162 PolarHBondContact O-N 3.33Å
159	N	62.9	Low	74.9	Confident	149 Å²	149	87.6 Å²	87.6	80%	0.797	47%	0.466	S	S	*	.	H	α-helix	trans	-45.7	-29.6	-167.9	-73.1	-41.2	0	0	0	116.1
160	R	59	Low	75	Confident	223 Å²	223	87.6 Å²	87.6	84%	0.842	46%	0.464	S	S	*	.	H	α-helix	trans	-79.5	-13.9	-179	-66.6	-169.5	-167	-164.5	4.8	115.1	E158 W163	E158-R160 PolarHBondContact O-N 2.86Å; R160-W163 PolarHBondContact O-NE1 3.15Å
161	K	63.5	Low	75.1	Confident	136 Å²	136	84.1 Å²	84.1	59%	0.591	44%	0.442	S	S	*	.	H	α-helix	trans	-110.3	-19.2	171.9	-67.1	-178	-177.2	176.1	0	111.8	E158 W163 Q164 W165	E158-K161 PolarHBondContact O-N 3.27Å; K161-W163 VanDerWaalsContact C-N 3.31Å; K161-W163 PolarHBondContact O-N 3.08Å; K161-Q164 WeakPolarHBondContact O-CB 3.48Å; K161-Q164 PolarHBondContact O-N 3.26Å; K161-Q164 VanDerWaalsContact O-N 3.12Å; K161-W165 VanDerWaalsContact O-CD1 3.29Å
162	A	63	Low	75.2	Confident	39 Å²	39	82.8 Å²	82.8	32%	0.322	43%	0.433	S	S	.	.	H	α-helix	trans	-56.5	-39.5	-180	0	0	0	0	0	113.4	E158 Q164 W165	E158-A162 PolarHBondContact O-N 3.33Å; A162-Q164 PolarHBondContact O-N 2.93Å; A162-Q164 VanDerWaalsContact O-N 3.17Å; A162-W165 PolarHBondContact O-N 3Å
163	W	61.8	Low	75.6	Confident	149 Å²	149	89.4 Å²	89.4	56%	0.564	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16	179.6	63.4	-92.7	0	0	0	114.5	R160 K161 W165	R160-W163 PolarHBondContact O-NE1 3.15Å; K161-W163 VanDerWaalsContact C-N 3.31Å; K161-W163 PolarHBondContact O-N 3.08Å; W163-W165 VanDerWaalsContact C-N 3.33Å
164	Q	71.6	Confident	76.6	Confident	61 Å²	61	84.2 Å²	84.2	29%	0.285	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.1	174.7	-60.1	179.1	-20.6	0	0	112	K161 A162 C229	K161-Q164 WeakPolarHBondContact O-CB 3.48Å; K161-Q164 PolarHBondContact O-N 3.26Å; K161-Q164 VanDerWaalsContact O-N 3.12Å; A162-Q164 PolarHBondContact O-N 2.93Å; A162-Q164 VanDerWaalsContact O-N 3.17Å; Q164-C229 PolarHBondContact O-N 2.85Å
165	W	74.4	Confident	78	Confident	59 Å²	59	81.6 Å²	81.6	22%	0.223	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-97.2	132.4	178.8	-68.5	88.4	0	0	0	110.6	A154 P155 L157 K161 A162 W163 T213 C229 R231	A154-W165 HydrophobicContact CB-CB 3.58Å; A154-W165 HydrophobicContact CB-CG 4.27Å; P155-W165 HydrophobicContact CG-CZ2 4.43Å; L157-W165 HydrophobicContact CD1-CD2 4.36Å; L157-W165 HydrophobicContact CD1-CG 4.12Å; L157-W165 HydrophobicContact CD1-CZ2 4.39Å; K161-W165 VanDerWaalsContact O-CD1 3.29Å; A162-W165 PolarHBondContact O-N 3Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W165-T213 HydrophobicContact CH2-CG2 3.73Å; W165-T213 HydrophobicContact CZ2-CG2 4.41Å; W165-T213 HydrophobicContact CZ3-CG2 4Å; W165-C229 WeakPolarHBondContact CA-O 3.39Å; W165-R231 HydrophobicContact CH2-CG 4.2Å; W165-R231 HydrophobicContact CZ3-CG 3.74Å
166	G	77.5	Confident	79.2	Confident	28 Å²	28	80.1 Å²	80.1	29%	0.289	40%	0.401	S	S	.	.			trans	179.9	-176.4	177.5	0	0	0	0	0	110.7	T228 C229 W230	G166-T228 VanDerWaalsContact CA-CG2 3.48Å; G166-C229 PolarHBondContact N-O 2.86Å; G166-C229 CarbonylContact O-C 3.55Å; G166-W230 WeakPolarHBondContact O-CB 3.28Å
167	G	82.6	Confident	80.6	Confident	61 Å²	61	77.9 Å²	77.9	63%	0.629	38%	0.383	S	S	*	.	S	Bend	trans	78.4	-163.5	-172.6	0	0	0	0	0	112.4
168	C	88.8	Confident	81.9	Confident	60 Å²	60	75.5 Å²	75.5	41%	0.405	37%	0.37	S	S	.	.			trans	-119.4	91.9	-163.6	-167.9	0	0	0	0	110	S142 C151	S142-C168 PolarHBondContact O-SG 2.84Å; C151-C168 HydrophobicContact CB-CB 4.25Å; C151-C168 WeakPolarHBondContact CB-SG 3.43Å
169	G	92.2	Very high	83	Confident	2 Å²	2	67.2 Å²	67.2	2%	0.021	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-77.5	152.6	-178.9	0	0	0	0	0	113.7	S142 C151 D152 N171 R231	S142-G169 WeakPolarHBondContact CB-O 3.39Å; C151-G169 WeakPolarHBondContact CA-O 3.38Å; C151-G169 VanDerWaalsContact CB-O 3.28Å; C151-G169 WeakPolarHBondContact CB-O 3.42Å; D152-G169 PolarHBondContact N-O 3.19Å; G169-N171 PolarHBondContact O-N 3.01Å; G169-R231 CarbonylContact C-O 3.58Å; G169-R231 WeakPolarHBondContact CA-O 3.43Å
170	D	95.1	Very high	84.4	Confident	15 Å²	15	65.9 Å²	65.9	8%	0.08	32%	0.318	C	S	.	.			trans	-68.3	122.1	177.8	-71.4	-32.1	0	0	0	111.5	A138 S142 L172 R231 L233	A138-D170 HydrophobicContact CB-CB 4.29Å; S142-D170 PolarHBondContact OG-OD1 2.95Å; D170-L172 PolarHBondContact O-N 3.29Å; D170-R231 PolarHBondContact N-O 2.83Å; D170-L233 HydrophobicContact CB-CD1 4.2Å; D170-L233 HydrophobicContact CB-CG 3.84Å; D170-L233 WeakPolarHBondContact OD2-CB 3.25Å; D170-L233 WeakPolarHBondContact OD2-CG 3.48Å; D170-L233 PolarHBondContact OD2-N 3Å
171	N	95.3	Very high	85.9	Confident	19 Å²	19	59.2 Å²	59.2	10%	0.102	30%	0.297	C	S	.	.			trans	-81.6	78.8	-172	-164.3	-28.6	0	0	0	113.3	A138 C141 T150 G169 K173 Y174 A175	A138-N171 PolarHBondContact O-N 2.75Å; C141-N171 HydrophobicContact CB-CB 3.89Å; T150-N171 WeakPolarHBondContact O-CB 3.26Å; T150-N171 PolarHBondContact O-ND2 2.8Å; G169-N171 PolarHBondContact O-N 3.01Å; N171-K173 VanDerWaalsContact C-N 3.32Å; N171-K173 PolarHBondContact O-N 2.62Å; N171-K173 PolarHBondContact OD1-N 3.05Å; N171-Y174 WeakPolarHBondContact OD1-CB 3.25Å; N171-Y174 PolarHBondContact OD1-N 2.72Å; N171-A175 PolarHBondContact O-N 2.97Å; N171-A175 VanDerWaalsContact O-N 3.14Å
172	L	94.3	Very high	87.2	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	27%	0.269	C	S	.	.	H	α-helix	trans	-67.9	-28.2	177.9	-86.4	-175.6	0	0	0	114.6	T134 A138 D170 N176 I207 V211 L233	T134-L172 HydrophobicContact CG2-CD2 3.63Å; A138-L172 HydrophobicContact CB-CD2 4.01Å; A138-L172 HydrophobicContact CB-CG 4.44Å; D170-L172 PolarHBondContact O-N 3.29Å; L172-N176 VanDerWaalsContact O-CB 3.28Å; L172-N176 WeakPolarHBondContact O-CB 3.36Å; L172-N176 VanDerWaalsContact O-CG 3.31Å; L172-N176 PolarHBondContact O-N 2.9Å; L172-N176 PolarHBondContact O-ND2 3.44Å; L172-I207 HydrophobicContact CD1-CG2 4.46Å; L172-I207 HydrophobicContact CD2-CG2 3.53Å; L172-V211 HydrophobicContact CD1-CG2 3.11Å; L172-V211 HydrophobicContact CG-CG2 4.39Å; L172-L233 HydrophobicContact CD1-CD2 3.78Å; L172-L233 HydrophobicContact CD2-CD1 4.28Å; L172-L233 HydrophobicContact CD2-CD2 3.9Å; L172-L233 HydrophobicContact CG-CD2 3.87Å
173	K	93.6	Very high	88.3	Confident	173 Å²	173	52.8 Å²	52.8	75%	0.752	26%	0.263	S	S	*	.	H	α-helix	trans	-64.4	-47.9	179.7	-176.8	-179.9	177.3	-177	0	109.8	N171 K177	N171-K173 VanDerWaalsContact C-N 3.32Å; N171-K173 PolarHBondContact O-N 2.62Å; N171-K173 PolarHBondContact OD1-N 3.05Å; K173-K177 PolarHBondContact O-N 2.97Å
174	Y	94.9	Very high	89.2	Confident	48 Å²	48	47.1 Å²	47.1	19%	0.188	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-52.5	173.9	176.7	-90.9	0	0	0	111.3	C141 M146 R148 C149 N171 N176 K177 F178	C141-Y174 WeakPolarHBondContact SG-CD1 3.16Å; C141-Y174 VanDerWaalsContact SG-CE1 3.58Å; M146-Y174 HydrophobicContact CE-CE1 3.69Å; M146-Y174 VanDerWaalsContact CE-OH 3.25Å; M146-Y174 WeakPolarHBondContact CE-OH 3.4Å; M146-Y174 HydrophobicContact SD-CE1 4.46Å; R148-Y174 WeakPolarHBondContact O-CE2 3.47Å; C149-Y174 HydrophobicContact CB-CD1 3.8Å; C149-Y174 HydrophobicContact CB-CD2 3.58Å; C149-Y174 HydrophobicContact CB-CE1 3.91Å; C149-Y174 HydrophobicContact CB-CE2 3.68Å; C149-Y174 HydrophobicContact CB-CG 3.62Å; N171-Y174 WeakPolarHBondContact OD1-CB 3.25Å; N171-Y174 PolarHBondContact OD1-N 2.72Å; Y174-N176 PolarHBondContact O-N 3.14Å; Y174-K177 WeakPolarHBondContact O-CB 3.47Å; Y174-K177 PolarHBondContact O-N 2.91Å; Y174-K177 VanDerWaalsContact O-N 3.08Å; Y174-F178 HydrophobicContact CE1-CB 4.25Å; Y174-F178 HydrophobicContact CE1-CD2 4.32Å; Y174-F178 PolarHBondContact O-N 3.46Å
175	A	95.9	Very high	89.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.6	-46.6	-175.9	0	0	0	0	0	112.4	T134 L137 A138 N171 K177 F178 V179	T134-A175 HydrophobicContact CG2-CB 4.04Å; T134-A175 WeakPolarHBondContact O-CB 3.4Å; L137-A175 HydrophobicContact CB-CB 3.86Å; A138-A175 HydrophobicContact CB-CB 3.8Å; N171-A175 PolarHBondContact O-N 2.97Å; N171-A175 VanDerWaalsContact O-N 3.14Å; A175-K177 VanDerWaalsContact C-N 3.3Å; A175-K177 PolarHBondContact O-N 3.13Å; A175-F178 PolarHBondContact O-N 3.39Å; A175-V179 WeakPolarHBondContact O-CG2 3.48Å; A175-V179 PolarHBondContact O-N 3.44Å
176	N	94.8	Very high	89	Confident	28 Å²	28	54 Å²	54	15%	0.15	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-37.6	177.1	-78.1	-54.7	0	0	0	112.6	L172 Y174 K180	L172-N176 VanDerWaalsContact O-CB 3.28Å; L172-N176 WeakPolarHBondContact O-CB 3.36Å; L172-N176 VanDerWaalsContact O-CG 3.31Å; L172-N176 PolarHBondContact O-N 2.9Å; L172-N176 PolarHBondContact O-ND2 3.44Å; Y174-N176 PolarHBondContact O-N 3.14Å; N176-K180 WeakPolarHBondContact O-CB 3.47Å; N176-K180 VanDerWaalsContact O-CG 3.23Å; N176-K180 WeakPolarHBondContact O-CG 3.38Å; N176-K180 PolarHBondContact O-N 2.97Å
177	K	94.8	Very high	88.5	Confident	132 Å²	132	56.2 Å²	56.2	57%	0.574	29%	0.291	S	S	*	.	H	α-helix	trans	-66.8	-49.1	175.9	-177.3	-179.3	175.9	-176.9	0	110.5	K173 Y174 A175 V179 K180 E181	K173-K177 PolarHBondContact O-N 2.97Å; Y174-K177 WeakPolarHBondContact O-CB 3.47Å; Y174-K177 PolarHBondContact O-N 2.91Å; Y174-K177 VanDerWaalsContact O-N 3.08Å; A175-K177 VanDerWaalsContact C-N 3.3Å; A175-K177 PolarHBondContact O-N 3.13Å; K177-V179 PolarHBondContact O-N 2.89Å; K177-K180 PolarHBondContact O-N 2.94Å; K177-E181 WeakPolarHBondContact CE-OE1 3.42Å; K177-E181 WeakPolarHBondContact CG-OE1 3.15Å; K177-E181 WeakPolarHBondContact O-CG 3.29Å; K177-E181 PolarHBondContact O-N 2.84Å
178	F	94.6	Very high	87.9	Confident	19 Å²	19	59.3 Å²	59.3	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-56.9	-51.6	178.9	-174.7	-77.8	0	0	0	111.1	M71 V78 L137 Y174 A175 K180 E181 F182	M71-F178 HydrophobicContact CE-CD2 4.39Å; M71-F178 HydrophobicContact CE-CE2 4.21Å; M71-F178 HydrophobicContact CE-CZ 4.28Å; V78-F178 HydrophobicContact CG1-CE2 4.26Å; V78-F178 HydrophobicContact CG1-CZ 3.65Å; V78-F178 HydrophobicContact CG2-CE2 4.11Å; V78-F178 HydrophobicContact CG2-CZ 4.3Å; L137-F178 HydrophobicContact CD1-CB 4.26Å; L137-F178 HydrophobicContact CD1-CD1 3.31Å; L137-F178 HydrophobicContact CD1-CE1 3.88Å; L137-F178 HydrophobicContact CD1-CG 3.97Å; L137-F178 HydrophobicContact CD2-CD1 4.19Å; L137-F178 HydrophobicContact CD2-CE1 4.27Å; L137-F178 HydrophobicContact CD2-CG 4.49Å; L137-F178 HydrophobicContact CG-CD1 4.42Å; Y174-F178 HydrophobicContact CE1-CB 4.25Å; Y174-F178 HydrophobicContact CE1-CD2 4.32Å; Y174-F178 PolarHBondContact O-N 3.46Å; A175-F178 PolarHBondContact O-N 3.39Å; F178-K180 PolarHBondContact O-N 3.44Å; F178-E181 PolarHBondContact O-N 3.46Å; F178-F182 HydrophobicContact CD1-CB 4.1Å; F178-F182 HydrophobicContact CE1-CB 3.93Å; F178-F182 AromaticContact CE1-CD2 3.82Å; F178-F182 HydrophobicContact CE1-CD2 3.82Å; F178-F182 HydrophobicContact CE1-CE2 4.49Å; F178-F182 AromaticContact CE1-CG 3.93Å; F178-F182 HydrophobicContact CE1-CG 3.93Å; F178-F182 HydrophobicContact CZ-CD2 4.12Å; F178-F182 WeakPolarHBondContact O-CB 3.35Å; F178-F182 PolarHBondContact O-N 2.88Å
179	V	93.2	Very high	87.1	Confident	1 Å²	1	65 Å²	65	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-43	-177.4	174.1	0	0	0	0	111.7	L133 L137 A175 K177 E181 F182 L183 M204	L133-V179 HydrophobicContact CB-CG2 3.82Å; L137-V179 HydrophobicContact CD1-CG2 3.61Å; A175-V179 WeakPolarHBondContact O-CG2 3.48Å; A175-V179 PolarHBondContact O-N 3.44Å; K177-V179 PolarHBondContact O-N 2.89Å; V179-E181 VanDerWaalsContact C-N 3.35Å; V179-E181 PolarHBondContact O-N 3.31Å; V179-F182 PolarHBondContact O-N 2.79Å; V179-L183 HydrophobicContact CG1-CD1 3.63Å; V179-L183 HydrophobicContact CG1-CG 4.11Å; V179-L183 WeakPolarHBondContact O-CB 3.31Å; V179-L183 WeakPolarHBondContact O-CG 3.23Å; V179-L183 PolarHBondContact O-N 3.03Å; V179-M204 HydrophobicContact CB-SD 4.16Å; V179-M204 HydrophobicContact CG1-CG 4.41Å; V179-M204 HydrophobicContact CG1-SD 3.74Å
180	K	91.1	Very high	86.7	Confident	122 Å²	122	69 Å²	69	53%	0.53	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-42.7	175.4	-76.3	176.2	179.7	-179	0	112.5	N176 K177 F178 G184 M204	N176-K180 WeakPolarHBondContact O-CB 3.47Å; N176-K180 VanDerWaalsContact O-CG 3.23Å; N176-K180 WeakPolarHBondContact O-CG 3.38Å; N176-K180 PolarHBondContact O-N 2.97Å; K177-K180 PolarHBondContact O-N 2.94Å; F178-K180 PolarHBondContact O-N 3.44Å; K180-G184 PolarHBondContact O-N 2.98Å; K180-G184 VanDerWaalsContact O-N 3.08Å; K180-M204 HydrophobicContact CG-CE 3.98Å; K180-M204 HydrophobicContact CG-SD 4.16Å
181	E	91.4	Very high	86.2	Confident	83 Å²	83	69.4 Å²	69.4	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-70.1	-37.5	178.3	-73.5	179.5	-162.6	0	0	112.5	K67 M71 K177 F178 V179	K67-E181 WeakPolarHBondContact CE-O 3.28Å; K67-E181 PolarHBondContact NZ-O 2.85Å; M71-E181 HydrophobicContact CE-CB 3.85Å; K177-E181 WeakPolarHBondContact CE-OE1 3.42Å; K177-E181 WeakPolarHBondContact CG-OE1 3.15Å; K177-E181 WeakPolarHBondContact O-CG 3.29Å; K177-E181 PolarHBondContact O-N 2.84Å; F178-E181 PolarHBondContact O-N 3.46Å; V179-E181 VanDerWaalsContact C-N 3.35Å; V179-E181 PolarHBondContact O-N 3.31Å
182	F	90.6	Very high	85.8	Confident	3 Å²	3	70.3 Å²	70.3	1%	0.013	34%	0.336	C	S	.	.	H	α-helix	trans	-72.2	-44.5	-177.2	-175.5	-98.7	0	0	0	112.5	F30 L64 Q68 M71 L82 F178 V179 G184	F30-F182 HydrophobicContact CB-CD1 4.36Å; F30-F182 HydrophobicContact CB-CE1 3.54Å; F30-F182 HydrophobicContact CB-CZ 4.28Å; F30-F182 AromaticContact CD1-CE1 3.75Å; F30-F182 HydrophobicContact CD1-CE1 3.75Å; F30-F182 AromaticContact CD1-CZ 3.86Å; F30-F182 HydrophobicContact CD1-CZ 3.86Å; F30-F182 HydrophobicContact CD2-CE1 4.5Å; F30-F182 HydrophobicContact CD2-CZ 4.45Å; F30-F182 HydrophobicContact CE1-CZ 4.48Å; F30-F182 AromaticContact CG-CE1 3.63Å; F30-F182 HydrophobicContact CG-CE1 3.63Å; F30-F182 AromaticContact CG-CZ 3.89Å; F30-F182 HydrophobicContact CG-CZ 3.89Å; L64-F182 HydrophobicContact CD2-CE1 4.46Å; L64-F182 HydrophobicContact CD2-CE2 3.93Å; L64-F182 HydrophobicContact CD2-CZ 3.42Å; L64-F182 VanDerWaalsContact CD2-CZ 3.42Å; Q68-F182 HydrophobicContact CB-CD2 4.17Å; Q68-F182 HydrophobicContact CB-CE2 3.68Å; Q68-F182 HydrophobicContact CB-CZ 3.99Å; Q68-F182 HydrophobicContact CG-CD1 4.48Å; Q68-F182 HydrophobicContact CG-CD2 4.12Å; Q68-F182 HydrophobicContact CG-CE1 4.37Å; Q68-F182 HydrophobicContact CG-CE2 3.99Å; Q68-F182 HydrophobicContact CG-CG 4.37Å; Q68-F182 HydrophobicContact CG-CZ 4.13Å; Q68-F182 VanDerWaalsContact CG-O 3.22Å; Q68-F182 WeakPolarHBondContact CG-O 3.29Å; Q68-F182 PolarHBondContact NE2-O 3.42Å; M71-F182 HydrophobicContact CB-CD2 4.17Å; M71-F182 HydrophobicContact CE-CB 3.87Å; M71-F182 HydrophobicContact CE-CD2 4.27Å; M71-F182 HydrophobicContact SD-CB 4.29Å; M71-F182 HydrophobicContact SD-CD2 4.21Å; L82-F182 HydrophobicContact CD1-CE2 4.03Å; L82-F182 HydrophobicContact CD1-CZ 3.83Å; L82-F182 HydrophobicContact CD2-CE1 4.16Å; L82-F182 HydrophobicContact CD2-CE2 4.47Å; L82-F182 HydrophobicContact CD2-CZ 3.94Å; F178-F182 HydrophobicContact CD1-CB 4.1Å; F178-F182 HydrophobicContact CE1-CB 3.93Å; F178-F182 AromaticContact CE1-CD2 3.82Å; F178-F182 HydrophobicContact CE1-CD2 3.82Å; F178-F182 HydrophobicContact CE1-CE2 4.49Å; F178-F182 AromaticContact CE1-CG 3.93Å; F178-F182 HydrophobicContact CE1-CG 3.93Å; F178-F182 HydrophobicContact CZ-CD2 4.12Å; F178-F182 WeakPolarHBondContact O-CB 3.35Å; F178-F182 PolarHBondContact O-N 2.88Å; V179-F182 PolarHBondContact O-N 2.79Å; F182-G184 VanDerWaalsContact C-N 3.32Å
183	L	86.7	Confident	85.4	Confident	36 Å²	36	70.2 Å²	70.2	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-75.8	-24.4	174.9	-62	-179.3	0	0	0	112.1	F30 L133 V179 T200	F30-L183 HydrophobicContact CB-CD2 4.22Å; L133-L183 HydrophobicContact CD1-CD2 4.26Å; V179-L183 HydrophobicContact CG1-CD1 3.63Å; V179-L183 HydrophobicContact CG1-CG 4.11Å; V179-L183 WeakPolarHBondContact O-CB 3.31Å; V179-L183 WeakPolarHBondContact O-CG 3.23Å; V179-L183 PolarHBondContact O-N 3.03Å; L183-T200 HydrophobicContact CD1-CG2 3.39Å
184	G	80.6	Confident	85.1	Confident	30 Å²	30	63.4 Å²	63.4	31%	0.309	31%	0.306	S	S	.	.			trans	73.1	172.8	175.6	0	0	0	0	0	113.9	K180 F182	K180-G184 PolarHBondContact O-N 2.98Å; K180-G184 VanDerWaalsContact O-N 3.08Å; F182-G184 VanDerWaalsContact C-N 3.32Å
185	K	71.4	Confident	84.8	Confident	215 Å²	215	61.2 Å²	61.2	94%	0.935	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-89	125.6	172	-67.1	-176.1	179	-179.2	0	108.5
186	R	70.4	Confident	84.5	Confident	50 Å²	50	61.3 Å²	61.3	19%	0.189	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-85.8	160.4	170.7	-62.3	-166.9	-176.7	-173.6	2.4	110.8	Y29 Y126 N188 A193 D196	Y29-R186 HydrophobicContact CE1-CG 4.13Å; Y29-R186 VanDerWaalsContact CE1-NH2 3.25Å; Y29-R186 VanDerWaalsContact CZ-NE 3.34Å; Y126-R186 VanDerWaalsContact CE1-NH2 3.26Å; Y126-R186 PolarHBondContact OH-NH1 3.11Å; Y126-R186 PolarHBondContact OH-NH2 2.95Å; R186-N188 PolarHBondContact O-N 3.13Å; R186-A193 HydrophobicContact CB-CB 4.03Å; R186-D196 IonicContact CZ-OD2 2.72Å; R186-D196 IonicContact NH1-OD2 2.98Å; R186-D196 PolarHBondContact NH1-OD2 3.01Å
187	S	67.3	Low	84.3	Confident	75 Å²	75	62.6 Å²	62.6	52%	0.524	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-55.6	128.1	172.1	-179.1	0	0	0	0	109.8	K189 A193	S187-K189 PolarHBondContact O-N 2.95Å; S187-K189 PolarHBondContact OG-N 3.12Å; S187-A193 WeakPolarHBondContact O-CB 3.26Å
188	N	68.8	Low	84.2	Confident	125 Å²	125	57.2 Å²	57.2	67%	0.668	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.4	178.7	-160.3	23.2	0	0	0	112.6	R186 R194	R186-N188 PolarHBondContact O-N 3.13Å; N188-R194 WeakPolarHBondContact O-CD 3.34Å; N188-R194 VanDerWaalsContact OD1-CD 3.24Å; N188-R194 WeakPolarHBondContact OD1-CD 3.5Å; N188-R194 WeakPolarHBondContact OD1-CG 3.45Å
189	K	71.8	Confident	84.1	Confident	181 Å²	181	56.3 Å²	56.3	79%	0.787	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-29.6	-176.6	-61	-173.5	175.9	-171.4	0	113	S187	S187-K189 PolarHBondContact O-N 2.95Å; S187-K189 PolarHBondContact OG-N 3.12Å
190	D	83.4	Confident	84.2	Confident	84 Å²	84	57.2 Å²	57.2	45%	0.449	29%	0.285	S	S	.	.			trans	-94.6	126.4	-177.5	171	22.7	0	0	0	110.6	R192 A193 R194	D190-R192 PolarHBondContact O-N 2.95Å; D190-R192 WeakPolarHBondContact OD1-CB 3.38Å; D190-R192 PolarHBondContact OD1-N 3.15Å; D190-R192 WeakPolarHBondContact OD2-CB 3.43Å; D190-A193 HydrophobicContact CB-CB 4Å; D190-A193 PolarHBondContact O-N 2.85Å; D190-A193 PolarHBondContact OD2-N 3.44Å; D190-R194 WeakPolarHBondContact O-CB 3.28Å; D190-R194 WeakPolarHBondContact O-CG 3.39Å; D190-R194 PolarHBondContact O-N 3.28Å
191	L	85.4	Confident	84.3	Confident	24 Å²	24	54.1 Å²	54.1	13%	0.126	27%	0.274	C	S	.	.	H	α-helix	trans	-56.2	-38.3	175	178.3	63.8	0	0	0	111.4	R194 V195 I300	L191-R194 WeakPolarHBondContact O-CB 3.47Å; L191-R194 PolarHBondContact O-N 2.82Å; L191-V195 HydrophobicContact CD1-CG2 4.17Å; L191-V195 HydrophobicContact CG-CG2 4.39Å; L191-V195 WeakPolarHBondContact O-CG2 3.19Å; L191-V195 PolarHBondContact O-N 2.68Å; L191-I300 HydrophobicContact CD2-CD1 4.29Å; L191-I300 HydrophobicContact CG-CD1 4.03Å
192	R	86.2	Confident	84.5	Confident	39 Å²	39	50.1 Å²	50.1	15%	0.147	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-47.9	178.7	-178.4	75.7	-168.5	91.7	15.3	111.2	D190 R194 V195 D196 I300	D190-R192 PolarHBondContact O-N 2.95Å; D190-R192 WeakPolarHBondContact OD1-CB 3.38Å; D190-R192 PolarHBondContact OD1-N 3.15Å; D190-R192 WeakPolarHBondContact OD2-CB 3.43Å; R192-R194 VanDerWaalsContact C-N 3.29Å; R192-R194 PolarHBondContact O-N 2.84Å; R192-V195 PolarHBondContact O-N 3.2Å; R192-D196 VanDerWaalsContact CZ-CG 3.43Å; R192-D196 IonicContact CZ-OD1 2.58Å; R192-D196 IonicContact CZ-OD2 3.42Å; R192-D196 VanDerWaalsContact CZ-OD2 3.32Å; R192-D196 IonicContact NE-OD2 3.84Å; R192-D196 IonicContact NH1-OD1 3.4Å; R192-D196 PolarHBondContact NH1-OD1 3.01Å; R192-D196 IonicContact NH1-OD2 2.8Å; R192-D196 PolarHBondContact NH1-OD2 2.73Å; R192-D196 VanDerWaalsContact NH2-CG 3.32Å; R192-D196 IonicContact NH2-OD1 3.41Å; R192-D196 PolarHBondContact NH2-OD1 2.72Å; R192-D196 IonicContact NH2-OD2 3.98Å; R192-D196 PolarHBondContact NH2-OD2 3.18Å; R192-D196 WeakPolarHBondContact O-CB 3Å; R192-D196 PolarHBondContact O-N 2.8Å; R192-I300 HydrophobicContact CB-CD1 4.08Å
193	A	85.6	Confident	84.8	Confident	6 Å²	6	50 Å²	50	5%	0.05	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-38.2	176.1	0	0	0	0	0	112.8	R186 S187 D190 T197	R186-A193 HydrophobicContact CB-CB 4.03Å; S187-A193 WeakPolarHBondContact O-CB 3.26Å; D190-A193 HydrophobicContact CB-CB 4Å; D190-A193 PolarHBondContact O-N 2.85Å; D190-A193 PolarHBondContact OD2-N 3.44Å; A193-T197 WeakPolarHBondContact O-CB 3.22Å; A193-T197 PolarHBondContact O-N 3.35Å; A193-T197 PolarHBondContact O-OG1 2.83Å
194	R	87.8	Confident	85.2	Confident	31 Å²	31	48.7 Å²	48.7	12%	0.117	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-51.8	173.9	-83.7	-164.5	-65	162.3	-7.2	112	N188 D190 L191 R192 D196 T197 H198 D289 I291	N188-R194 WeakPolarHBondContact O-CD 3.34Å; N188-R194 VanDerWaalsContact OD1-CD 3.24Å; N188-R194 WeakPolarHBondContact OD1-CD 3.5Å; N188-R194 WeakPolarHBondContact OD1-CG 3.45Å; D190-R194 WeakPolarHBondContact O-CB 3.28Å; D190-R194 WeakPolarHBondContact O-CG 3.39Å; D190-R194 PolarHBondContact O-N 3.28Å; L191-R194 WeakPolarHBondContact O-CB 3.47Å; L191-R194 PolarHBondContact O-N 2.82Å; R192-R194 VanDerWaalsContact C-N 3.29Å; R192-R194 PolarHBondContact O-N 2.84Å; R194-D196 PolarHBondContact O-N 2.91Å; R194-T197 PolarHBondContact O-N 3.49Å; R194-H198 PolarHBondContact O-N 3.12Å; R194-D289 IonicContact CZ-OD1 3.05Å; R194-D289 PolarHBondContact NH1-O 3.47Å; R194-D289 IonicContact NH1-OD1 2.63Å; R194-D289 IonicContact NH2-OD1 3.93Å; R194-D289 PolarHBondContact NH2-OD1 3.29Å; R194-I291 HydrophobicContact CB-CD1 3.49Å; R194-I291 VanDerWaalsContact CB-CD1 3.49Å; R194-I291 HydrophobicContact CB-CG1 4.06Å; R194-I291 HydrophobicContact CG-CD1 4.03Å
195	V	89.7	Confident	85.9	Confident	1 Å²	1	52 Å²	52	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-43.7	177.4	167.2	0	0	0	0	112	L191 R192 T197 H198 N199 V253 L298 I300	L191-V195 HydrophobicContact CD1-CG2 4.17Å; L191-V195 HydrophobicContact CG-CG2 4.39Å; L191-V195 WeakPolarHBondContact O-CG2 3.19Å; L191-V195 PolarHBondContact O-N 2.68Å; R192-V195 PolarHBondContact O-N 3.2Å; V195-T197 VanDerWaalsContact C-N 3.32Å; V195-T197 PolarHBondContact O-N 3.42Å; V195-H198 WeakPolarHBondContact O-CB 3.31Å; V195-H198 PolarHBondContact O-N 3.14Å; V195-N199 PolarHBondContact O-N 3.42Å; V195-N199 PolarHBondContact O-ND2 3.21Å; V195-V253 HydrophobicContact CG2-CG2 3.52Å; V195-L298 HydrophobicContact CG1-CB 4Å; V195-L298 VanDerWaalsContact CG1-O 3.26Å; V195-L298 WeakPolarHBondContact CG1-O 3.23Å; V195-L298 HydrophobicContact CG2-CB 4.47Å; V195-I300 HydrophobicContact CB-CD1 4.23Å; V195-I300 HydrophobicContact CB-CG1 4.41Å; V195-I300 HydrophobicContact CG1-CG1 4.37Å; V195-I300 HydrophobicContact CG2-CD1 4.02Å; V195-I300 HydrophobicContact CG2-CG1 3.99Å
196	D	89.3	Confident	87.2	Confident	3 Å²	3	42 Å²	42	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-60.3	-42.8	175.7	-82.4	-22.5	0	0	0	112.8	Y126 R186 R192 R194 H198 N199 T200	Y126-D196 HydrophobicContact CD1-CB 4.02Å; Y126-D196 VanDerWaalsContact CD2-OD1 3.31Å; Y126-D196 WeakPolarHBondContact CD2-OD1 3.45Å; Y126-D196 HydrophobicContact CE1-CB 3.6Å; Y126-D196 VanDerWaalsContact CE1-CG 3.46Å; Y126-D196 HydrophobicContact CE2-CB 4.5Å; Y126-D196 WeakPolarHBondContact CE2-OD1 3.31Å; Y126-D196 VanDerWaalsContact CZ-OD2 3.27Å; Y126-D196 PolarHBondContact OH-OD2 2.58Å; R186-D196 IonicContact CZ-OD2 2.72Å; R186-D196 IonicContact NH1-OD2 2.98Å; R186-D196 PolarHBondContact NH1-OD2 3.01Å; R192-D196 VanDerWaalsContact CZ-CG 3.43Å; R192-D196 IonicContact CZ-OD1 2.58Å; R192-D196 IonicContact CZ-OD2 3.42Å; R192-D196 VanDerWaalsContact CZ-OD2 3.32Å; R192-D196 IonicContact NE-OD2 3.84Å; R192-D196 IonicContact NH1-OD1 3.4Å; R192-D196 PolarHBondContact NH1-OD1 3.01Å; R192-D196 IonicContact NH1-OD2 2.8Å; R192-D196 PolarHBondContact NH1-OD2 2.73Å; R192-D196 VanDerWaalsContact NH2-CG 3.32Å; R192-D196 IonicContact NH2-OD1 3.41Å; R192-D196 PolarHBondContact NH2-OD1 2.72Å; R192-D196 IonicContact NH2-OD2 3.98Å; R192-D196 PolarHBondContact NH2-OD2 3.18Å; R192-D196 WeakPolarHBondContact O-CB 3Å; R192-D196 PolarHBondContact O-N 2.8Å; R194-D196 PolarHBondContact O-N 2.91Å; D196-H198 VanDerWaalsContact C-N 3.33Å; D196-N199 PolarHBondContact O-N 3.47Å; D196-T200 WeakPolarHBondContact O-CB 2.94Å; D196-T200 PolarHBondContact O-N 3.48Å; D196-T200 PolarHBondContact O-OG1 3.07Å
197	T	89.9	Confident	88.4	Confident	55 Å²	55	39.6 Å²	39.6	34%	0.337	20%	0.202	S	C	.	.	H	α-helix	trans	-65.3	-39.8	177.3	-58.3	0	0	0	0	110.6	A193 R194 V195 N201	A193-T197 WeakPolarHBondContact O-CB 3.22Å; A193-T197 PolarHBondContact O-N 3.35Å; A193-T197 PolarHBondContact O-OG1 2.83Å; R194-T197 PolarHBondContact O-N 3.49Å; V195-T197 VanDerWaalsContact C-N 3.32Å; V195-T197 PolarHBondContact O-N 3.42Å; T197-N201 WeakPolarHBondContact O-CB 3.29Å; T197-N201 VanDerWaalsContact O-CG 3.23Å; T197-N201 PolarHBondContact O-N 2.81Å; T197-N201 PolarHBondContact O-ND2 3.35Å
198	H	92.4	Very high	89.7	Confident	19 Å²	19	42.6 Å²	42.6	9%	0.088	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-53.5	173.8	176.6	86.3	0	0	0	111.9	R194 V195 D196 T200 N201 V202 I291 T294 D296 L298	R194-H198 PolarHBondContact O-N 3.12Å; V195-H198 WeakPolarHBondContact O-CB 3.31Å; V195-H198 PolarHBondContact O-N 3.14Å; D196-H198 VanDerWaalsContact C-N 3.33Å; H198-T200 VanDerWaalsContact C-N 3.29Å; H198-T200 PolarHBondContact O-N 2.86Å; H198-N201 CarbonylContact O-C 3.56Å; H198-N201 WeakPolarHBondContact O-CA 3.25Å; H198-N201 WeakPolarHBondContact O-CB 3.43Å; H198-N201 PolarHBondContact O-N 3.13Å; H198-V202 WeakPolarHBondContact NE2-CG2 3.14Å; H198-V202 WeakPolarHBondContact O-CG2 3.35Å; H198-V202 PolarHBondContact O-N 3.26Å; H198-I291 HydrophobicContact CB-CG2 4.08Å; H198-T294 PolarHBondContact CE1-O 3.29Å; H198-T294 VanDerWaalsContact CE1-O 3.23Å; H198-D296 PolarHBondContact NE2-O 2.77Å; H198-L298 HydrophobicContact CB-CD1 4.29Å; H198-L298 VanDerWaalsContact CD2-CD1 3.42Å; H198-L298 WeakPolarHBondContact CD2-CD1 3.32Å; H198-L298 VanDerWaalsContact CD2-CG 3.47Å; H198-L298 WeakPolarHBondContact CD2-CG 3.36Å
199	N	94.2	Very high	90.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.1	-38.5	-178.7	-67.6	-30.2	0	0	0	112.2	A123 A127 V195 D196 N201 V202 G203 L297 L298	A123-N199 WeakPolarHBondContact CA-ND2 3.28Å; A123-N199 VanDerWaalsContact CB-ND2 3.28Å; A123-N199 WeakPolarHBondContact CB-ND2 3.43Å; A127-N199 WeakPolarHBondContact CA-O 3.43Å; V195-N199 PolarHBondContact O-N 3.42Å; V195-N199 PolarHBondContact O-ND2 3.21Å; D196-N199 PolarHBondContact O-N 3.47Å; N199-N201 VanDerWaalsContact C-N 3.35Å; N199-N201 PolarHBondContact O-N 2.98Å; N199-V202 PolarHBondContact O-N 2.89Å; N199-G203 PolarHBondContact O-N 3.14Å; N199-L297 HydrophobicContact CB-CD2 4.3Å; N199-L297 WeakPolarHBondContact OD1-CA 3.43Å; N199-L298 PolarHBondContact ND2-O 3.28Å; N199-L298 PolarHBondContact OD1-N 3.27Å
200	T	93.7	Very high	92	Very high	19 Å²	19	31.6 Å²	31.6	12%	0.117	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-45.2	171.3	-59.6	0	0	0	0	111.6	S130 L183 D196 H198 G203 M204	S130-T200 PolarHBondContact OG-O 2.56Å; L183-T200 HydrophobicContact CD1-CG2 3.39Å; D196-T200 WeakPolarHBondContact O-CB 2.94Å; D196-T200 PolarHBondContact O-N 3.48Å; D196-T200 PolarHBondContact O-OG1 3.07Å; H198-T200 VanDerWaalsContact C-N 3.29Å; H198-T200 PolarHBondContact O-N 2.86Å; T200-G203 PolarHBondContact O-N 3.21Å; T200-M204 HydrophobicContact CG2-CE 4.38Å; T200-M204 PolarHBondContact O-N 3.25Å
201	N	93.6	Very high	92.4	Very high	57 Å²	57	29.1 Å²	29.1	31%	0.305	15%	0.154	S	C	.	.	H	α-helix	trans	-68.1	-35.9	178.3	-72.6	-40.5	0	0	0	112.1	T197 H198 N199 M204 K205	T197-N201 WeakPolarHBondContact O-CB 3.29Å; T197-N201 VanDerWaalsContact O-CG 3.23Å; T197-N201 PolarHBondContact O-N 2.81Å; T197-N201 PolarHBondContact O-ND2 3.35Å; H198-N201 CarbonylContact O-C 3.56Å; H198-N201 WeakPolarHBondContact O-CA 3.25Å; H198-N201 WeakPolarHBondContact O-CB 3.43Å; H198-N201 PolarHBondContact O-N 3.13Å; N199-N201 VanDerWaalsContact C-N 3.35Å; N199-N201 PolarHBondContact O-N 2.98Å; N201-M204 HydrophobicContact CB-CE 4.5Å; N201-M204 PolarHBondContact O-N 2.7Å; N201-M204 WeakPolarHBondContact OD1-CE 3.09Å; N201-K205 WeakPolarHBondContact O-CB 3.41Å; N201-K205 WeakPolarHBondContact O-CG 3.49Å; N201-K205 PolarHBondContact O-N 3.37Å
202	V	96.3	Very high	92.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60	-47.2	173.7	172.3	0	0	0	0	110	H198 N199 M204 K205 V206 M295 L297	H198-V202 WeakPolarHBondContact NE2-CG2 3.14Å; H198-V202 WeakPolarHBondContact O-CG2 3.35Å; H198-V202 PolarHBondContact O-N 3.26Å; N199-V202 PolarHBondContact O-N 2.89Å; V202-M204 PolarHBondContact O-N 3.42Å; V202-K205 PolarHBondContact O-N 2.88Å; V202-K205 VanDerWaalsContact O-N 3.12Å; V202-V206 HydrophobicContact CG1-CG2 4.22Å; V202-V206 WeakPolarHBondContact O-CG2 3.41Å; V202-V206 PolarHBondContact O-N 3.06Å; V202-M295 WeakPolarHBondContact CG1-O 3.36Å; V202-L297 HydrophobicContact CB-CD2 4.03Å; V202-L297 HydrophobicContact CG1-CD2 3.75Å
203	G	95.8	Very high	92.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-52.9	-52.2	175.7	0	0	0	0	0	113.2	A127 N199 T200 K205 V206 I207	A127-G203 WeakPolarHBondContact O-CA 2.92Å; N199-G203 PolarHBondContact O-N 3.14Å; T200-G203 PolarHBondContact O-N 3.21Å; G203-K205 VanDerWaalsContact C-N 3.34Å; G203-K205 PolarHBondContact O-N 3.17Å; G203-V206 PolarHBondContact O-N 3.2Å; G203-I207 PolarHBondContact O-N 3.47Å
204	M	95.3	Very high	93.1	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.039	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-38	176.8	-64.7	-170.8	-70.5	0	0	113.2	V179 K180 T200 N201 V202 I207 K208	V179-M204 HydrophobicContact CB-SD 4.16Å; V179-M204 HydrophobicContact CG1-CG 4.41Å; V179-M204 HydrophobicContact CG1-SD 3.74Å; K180-M204 HydrophobicContact CG-CE 3.98Å; K180-M204 HydrophobicContact CG-SD 4.16Å; T200-M204 HydrophobicContact CG2-CE 4.38Å; T200-M204 PolarHBondContact O-N 3.25Å; N201-M204 HydrophobicContact CB-CE 4.5Å; N201-M204 PolarHBondContact O-N 2.7Å; N201-M204 WeakPolarHBondContact OD1-CE 3.09Å; V202-M204 PolarHBondContact O-N 3.42Å; M204-I207 PolarHBondContact O-N 3.39Å; M204-K208 PolarHBondContact O-N 3.05Å
205	K	96.4	Very high	93.3	Very high	99 Å²	99	37.8 Å²	37.8	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-69.7	-36.1	178.2	-75	175.7	-172.9	177.3	0	112.2	N201 V202 G203 I207 K208 A209 M295	N201-K205 WeakPolarHBondContact O-CB 3.41Å; N201-K205 WeakPolarHBondContact O-CG 3.49Å; N201-K205 PolarHBondContact O-N 3.37Å; V202-K205 PolarHBondContact O-N 2.88Å; V202-K205 VanDerWaalsContact O-N 3.12Å; G203-K205 VanDerWaalsContact C-N 3.34Å; G203-K205 PolarHBondContact O-N 3.17Å; K205-I207 VanDerWaalsContact C-N 3.34Å; K205-K208 PolarHBondContact O-N 3.45Å; K205-A209 WeakPolarHBondContact O-CB 3.2Å; K205-A209 PolarHBondContact O-N 3.38Å; K205-M295 HydrophobicContact CB-CE 3.52Å; K205-M295 HydrophobicContact CB-SD 4.26Å; K205-M295 HydrophobicContact CD-CE 3.86Å; K205-M295 HydrophobicContact CD-SD 3.45Å; K205-M295 WeakPolarHBondContact CD-SD 3.44Å; K205-M295 HydrophobicContact CG-CE 4.38Å
206	V	97.3	Very high	93.3	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-41.6	175.9	172	0	0	0	0	110.6	V202 G203 A209 G210 I239 R242 L243 M295	V202-V206 HydrophobicContact CG1-CG2 4.22Å; V202-V206 WeakPolarHBondContact O-CG2 3.41Å; V202-V206 PolarHBondContact O-N 3.06Å; G203-V206 PolarHBondContact O-N 3.2Å; V206-A209 PolarHBondContact O-N 3.4Å; V206-G210 PolarHBondContact O-N 3.29Å; V206-I239 HydrophobicContact CG1-CD1 4.47Å; V206-I239 HydrophobicContact CG1-CG2 4.14Å; V206-R242 HydrophobicContact CG1-CB 3.86Å; V206-L243 HydrophobicContact CB-CD2 4.15Å; V206-L243 HydrophobicContact CG1-CD2 4.33Å; V206-L243 HydrophobicContact CG1-CG 4.25Å; V206-L243 HydrophobicContact CG2-CD2 3.86Å; V206-M295 HydrophobicContact CG2-CE 4.5Å
207	I	95.9	Very high	93.4	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-50.6	171.1	-67.2	-67.4	0	0	0	110.9	A131 T134 H135 L172 G203 M204 K205 A209 G210 L233 F236 I239	A131-I207 HydrophobicContact CB-CD1 3.96Å; A131-I207 HydrophobicContact CB-CG1 3.69Å; T134-I207 HydrophobicContact CG2-CB 4.42Å; T134-I207 HydrophobicContact CG2-CG2 3.88Å; H135-I207 HydrophobicContact CB-CD1 3.97Å; L172-I207 HydrophobicContact CD1-CG2 4.46Å; L172-I207 HydrophobicContact CD2-CG2 3.53Å; G203-I207 PolarHBondContact O-N 3.47Å; M204-I207 PolarHBondContact O-N 3.39Å; K205-I207 VanDerWaalsContact C-N 3.34Å; I207-A209 VanDerWaalsContact C-N 3.26Å; I207-A209 PolarHBondContact O-N 3.27Å; I207-G210 CarbonylContact O-C 3.55Å; I207-G210 PolarHBondContact O-N 2.91Å; I207-L233 HydrophobicContact CG2-CD1 4.47Å; I207-L233 HydrophobicContact CG2-CD2 3.86Å; I207-F236 HydrophobicContact CD1-CE2 4.48Å; I207-I239 HydrophobicContact CD1-CB 4.2Å; I207-I239 HydrophobicContact CD1-CD1 4Å; I207-I239 HydrophobicContact CD1-CG1 3.74Å; I207-I239 HydrophobicContact CD1-CG2 3.58Å; I207-I239 HydrophobicContact CG1-CG2 4.34Å
208	K	94.9	Very high	93.4	Very high	137 Å²	137	47.5 Å²	47.5	60%	0.596	25%	0.253	S	S	*	.	H	α-helix	trans	-60	-36.6	-179.5	-174.4	-179.4	177.4	-175.2	0	112.6	M204 K205 G210 V211	M204-K208 PolarHBondContact O-N 3.05Å; K205-K208 PolarHBondContact O-N 3.45Å; K208-G210 VanDerWaalsContact C-N 3.29Å; K208-V211 WeakPolarHBondContact O-CG2 3.15Å
209	A	95.1	Very high	93.3	Very high	75 Å²	75	47.2 Å²	47.2	62%	0.62	26%	0.255	S	S	*	.	H	α-helix	trans	-77.9	-12.3	177.3	0	0	0	0	0	113.5	K205 V206 I207 R242	K205-A209 WeakPolarHBondContact O-CB 3.2Å; K205-A209 PolarHBondContact O-N 3.38Å; V206-A209 PolarHBondContact O-N 3.4Å; I207-A209 VanDerWaalsContact C-N 3.26Å; I207-A209 PolarHBondContact O-N 3.27Å; A209-R242 PolarHBondContact O-NH1 3.33Å
210	G	93.3	Very high	93.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.01	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	25.7	176.5	0	0	0	0	0	113.6	V206 I207 K208 L234 R242	V206-G210 PolarHBondContact O-N 3.29Å; I207-G210 CarbonylContact O-C 3.55Å; I207-G210 PolarHBondContact O-N 2.91Å; K208-G210 VanDerWaalsContact C-N 3.29Å; G210-L234 WeakPolarHBondContact O-CB 3.42Å; G210-L234 WeakPolarHBondContact O-CD1 3.37Å; G210-L234 WeakPolarHBondContact O-CG 3.38Å; G210-L234 PolarHBondContact O-N 3.06Å; G210-R242 VanDerWaalsContact CA-NH1 3.34Å
211	V	93	Very high	93.2	Very high	31 Å²	31	58.4 Å²	58.4	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	129.1	174.1	-178.8	0	0	0	0	108.4	L172 K208 R231 L233	L172-V211 HydrophobicContact CD1-CG2 3.11Å; L172-V211 HydrophobicContact CG-CG2 4.39Å; K208-V211 WeakPolarHBondContact O-CG2 3.15Å; V211-R231 HydrophobicContact CG1-CB 3.91Å; V211-L233 HydrophobicContact CG2-CD2 3.86Å
212	E	92	Very high	92.9	Very high	103 Å²	103	58.5 Å²	58.5	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.8	177.6	-67.9	-178.7	179.6	0	0	110.6	Q232 L234	E212-Q232 PolarHBondContact N-O 3.41Å; E212-Q232 PolarHBondContact O-N 2.65Å; E212-L234 HydrophobicContact CG-CD2 4.39Å; E212-L234 HydrophobicContact CG-CG 4.46Å
213	T	90.1	Very high	92.7	Very high	78 Å²	78	60.6 Å²	60.6	48%	0.479	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.9	172.3	-58.1	0	0	0	0	108.1	W165 C229 W230	W165-T213 HydrophobicContact CH2-CG2 3.73Å; W165-T213 HydrophobicContact CZ2-CG2 4.41Å; W165-T213 HydrophobicContact CZ3-CG2 4Å; T213-C229 HydrophobicContact CG2-CB 3.73Å; T213-W230 WeakPolarHBondContact CA-O 3.33Å
214	T	90.4	Very high	92.5	Very high	50 Å²	50	64.2 Å²	64.2	31%	0.307	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.7	174.4	-61	0	0	0	0	109	C229 W230	T214-C229 CarbonylContact O-C 3.46Å; T214-C229 WeakPolarHBondContact O-CA 3.33Å; T214-W230 HydrophobicContact CG2-CZ2 3.97Å; T214-W230 PolarHBondContact N-O 3.11Å; T214-W230 PolarHBondContact O-N 3.33Å
215	C	90.5	Very high	92.2	Very high	52 Å²	52	69.1 Å²	69.1	35%	0.351	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.9	-178	-57.1	0	0	0	0	111.2	T228 C229	C215-T228 CarbonylContact C-O 3.59Å; C215-T228 WeakPolarHBondContact CA-O 3.18Å; C215-C229 HydrophobicContact CB-CB 4.07Å; C215-C229 WeakPolarHBondContact CB-SG 3.37Å; C215-C229 WeakPolarHBondContact SG-CB 3.4Å; C215-C229 CovalentContact SG-SG 2.04Å; C215-C229 PolarHBondContact SG-SG 2.98Å
216	K	90.9	Very high	91.8	Very high	120 Å²	120	68.1 Å²	68.1	52%	0.522	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.5	169.1	-176.1	174.4	178.2	179.5	0	110	H218 Q227 T228 W230	K216-H218 PolarHBondContact O-CD2 3.24Å; K216-H218 VanDerWaalsContact O-CD2 3.28Å; K216-Q227 CarbonylContact O-C 3.51Å; K216-Q227 WeakPolarHBondContact O-CA 3.14Å; K216-Q227 WeakPolarHBondContact O-CB 3.05Å; K216-T228 PolarHBondContact N-O 2.92Å; K216-T228 PolarHBondContact O-N 2.84Å; K216-W230 HydrophobicContact CB-CH2 3.83Å; K216-W230 HydrophobicContact CB-CZ3 3.9Å
217	C	91.6	Very high	91.4	Very high	40 Å²	40	70.8 Å²	70.8	27%	0.27	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	136.9	178.8	-58.9	0	0	0	0	111.1	C224	C217-C224 HydrophobicContact CB-CB 3.82Å; C217-C224 WeakPolarHBondContact CB-SG 3.34Å; C217-C224 VanDerWaalsContact SG-CA 3.59Å; C217-C224 WeakPolarHBondContact SG-CB 3.43Å; C217-C224 CovalentContact SG-SG 2.03Å; C217-C224 PolarHBondContact SG-SG 2.03Å
218	H	89.6	Confident	91	Very high	103 Å²	103	72.6 Å²	72.6	48%	0.477	44%	0.438	S	S	.	.			trans	-129.8	11.8	-173.8	-65.3	-74.4	0	0	0	113.4	K216 V226	K216-H218 PolarHBondContact O-CD2 3.24Å; K216-H218 VanDerWaalsContact O-CD2 3.28Å; H218-V226 PolarHBondContact N-O 2.82Å
219	G	90.1	Very high	90.8	Very high	13 Å²	13	66.5 Å²	66.5	13%	0.134	41%	0.412	C	S	.	.	S	Bend	trans	-72.4	166.8	177.2	0	0	0	0	0	113.2	S221 G222 S223	G219-S221 PolarHBondContact O-N 2.77Å; G219-G222 PolarHBondContact O-N 3.18Å; G219-S223 VanDerWaalsContact C-OG 3.25Å; G219-S223 WeakPolarHBondContact CA-O 3.49Å; G219-S223 WeakPolarHBondContact CA-OG 3.5Å; G219-S223 PolarHBondContact N-O 3.46Å; G219-S223 PolarHBondContact O-N 2.78Å
220	V	94.3	Very high	90.6	Very high	125 Å²	125	65.8 Å²	65.8	76%	0.758	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-52.3	133	178.1	-177.4	0	0	0	0	109.6	G222 S223	V220-G222 PolarHBondContact O-N 3.25Å; V220-S223 PolarHBondContact N-OG 3.21Å; V220-S223 WeakPolarHBondContact O-CB 3.09Å; V220-S223 PolarHBondContact O-N 3Å; V220-S223 PolarHBondContact O-OG 3.36Å
221	S	91.2	Very high	90.4	Very high	129 Å²	129	70 Å²	70	90%	0.902	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	57.1	26.9	-177.6	-51.9	0	0	0	0	115	G219	G219-S221 PolarHBondContact O-N 2.77Å
222	G	87.1	Confident	90.4	Very high	59 Å²	59	71.6 Å²	71.6	61%	0.608	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	83.1	13.3	179.7	0	0	0	0	0	114.5	G219 V220	G219-G222 PolarHBondContact O-N 3.18Å; V220-G222 PolarHBondContact O-N 3.25Å
223	S	92.4	Very high	90.6	Very high	44 Å²	44	67 Å²	67	31%	0.308	39%	0.394	S	S	.	.			trans	-65	154	173.8	54.4	0	0	0	0	112.9	G219 V220	G219-S223 VanDerWaalsContact C-OG 3.25Å; G219-S223 WeakPolarHBondContact CA-O 3.49Å; G219-S223 WeakPolarHBondContact CA-OG 3.5Å; G219-S223 PolarHBondContact N-O 3.46Å; G219-S223 PolarHBondContact O-N 2.78Å; V220-S223 PolarHBondContact N-OG 3.21Å; V220-S223 WeakPolarHBondContact O-CB 3.09Å; V220-S223 PolarHBondContact O-N 3Å; V220-S223 PolarHBondContact O-OG 3.36Å
224	C	90.7	Very high	90.9	Very high	76 Å²	76	64.2 Å²	64.2	51%	0.514	38%	0.376	S	S	.	.	S	Bend	trans	-96	23.3	179.2	-61.5	0	0	0	0	113.9	C217 V226	C217-C224 HydrophobicContact CB-CB 3.82Å; C217-C224 WeakPolarHBondContact CB-SG 3.34Å; C217-C224 VanDerWaalsContact SG-CA 3.59Å; C217-C224 WeakPolarHBondContact SG-CB 3.43Å; C217-C224 CovalentContact SG-SG 2.03Å; C217-C224 PolarHBondContact SG-SG 2.03Å; C224-V226 PolarHBondContact O-N 2.87Å
225	T	89.4	Confident	91.2	Very high	111 Å²	111	65.8 Å²	65.8	68%	0.681	39%	0.386	S	S	*	.	S	Bend	trans	-61.9	-35.5	176	48.3	0	0	0	0	112
226	V	87.7	Confident	91.5	Very high	78 Å²	78	64.1 Å²	64.1	47%	0.473	37%	0.373	S	S	.	.	S	Bend	trans	-119.9	129.3	166.5	-177.7	0	0	0	0	107.5	H218 C224	H218-V226 PolarHBondContact N-O 2.82Å; C224-V226 PolarHBondContact O-N 2.87Å
227	Q	89.3	Confident	91.9	Very high	61 Å²	61	61.8 Å²	61.8	29%	0.285	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.5	176.1	65	177.4	-7.2	0	0	110.8	K216	K216-Q227 CarbonylContact O-C 3.51Å; K216-Q227 WeakPolarHBondContact O-CA 3.14Å; K216-Q227 WeakPolarHBondContact O-CB 3.05Å
228	T	87.9	Confident	92.2	Very high	39 Å²	39	63.9 Å²	63.9	24%	0.239	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.8	176.7	-55.6	0	0	0	0	108.4	G166 C215 K216 W230	G166-T228 VanDerWaalsContact CA-CG2 3.48Å; C215-T228 CarbonylContact C-O 3.59Å; C215-T228 WeakPolarHBondContact CA-O 3.18Å; K216-T228 PolarHBondContact N-O 2.92Å; K216-T228 PolarHBondContact O-N 2.84Å; T228-W230 WeakPolarHBondContact O-CZ3 3.01Å
229	C	89.8	Confident	92.6	Very high	8 Å²	8	59.1 Å²	59.1	5%	0.054	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.9	-175.6	-55.6	0	0	0	0	112.2	Q164 W165 G166 T213 T214 C215	Q164-C229 PolarHBondContact O-N 2.85Å; W165-C229 WeakPolarHBondContact CA-O 3.39Å; G166-C229 PolarHBondContact N-O 2.86Å; G166-C229 CarbonylContact O-C 3.55Å; T213-C229 HydrophobicContact CG2-CB 3.73Å; T214-C229 CarbonylContact O-C 3.46Å; T214-C229 WeakPolarHBondContact O-CA 3.33Å; C215-C229 HydrophobicContact CB-CB 4.07Å; C215-C229 WeakPolarHBondContact CB-SG 3.37Å; C215-C229 WeakPolarHBondContact SG-CB 3.4Å; C215-C229 CovalentContact SG-SG 2.04Å; C215-C229 PolarHBondContact SG-SG 2.98Å
230	W	90.7	Very high	92.9	Very high	61 Å²	61	58.5 Å²	58.5	23%	0.231	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163.1	172.9	58.2	93.1	0	0	0	111	G166 T213 T214 K216 T228	G166-W230 WeakPolarHBondContact O-CB 3.28Å; T213-W230 WeakPolarHBondContact CA-O 3.33Å; T214-W230 HydrophobicContact CG2-CZ2 3.97Å; T214-W230 PolarHBondContact N-O 3.11Å; T214-W230 PolarHBondContact O-N 3.33Å; K216-W230 HydrophobicContact CB-CH2 3.83Å; K216-W230 HydrophobicContact CB-CZ3 3.9Å; T228-W230 WeakPolarHBondContact O-CZ3 3.01Å
231	R	90.8	Very high	93.1	Very high	88 Å²	88	55.2 Å²	55.2	33%	0.332	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.2	174.9	-60	-179.3	69.3	-154.2	6.2	109.4	D152 W165 G169 D170 V211	D152-R231 IonicContact OD2-NH1 2.81Å; D152-R231 PolarHBondContact OD2-NH1 3.2Å; W165-R231 HydrophobicContact CH2-CG 4.2Å; W165-R231 HydrophobicContact CZ3-CG 3.74Å; G169-R231 CarbonylContact C-O 3.58Å; G169-R231 WeakPolarHBondContact CA-O 3.43Å; D170-R231 PolarHBondContact N-O 2.83Å; V211-R231 HydrophobicContact CG1-CB 3.91Å
232	Q	92.8	Very high	93.5	Very high	65 Å²	65	53.2 Å²	53.2	30%	0.304	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.1	-176.4	-172.1	168.1	-18.7	0	0	110.8	E212	E212-Q232 PolarHBondContact N-O 3.41Å; E212-Q232 PolarHBondContact O-N 2.65Å
233	L	95.4	Very high	94	Very high	7 Å²	7	50.4 Å²	50.4	4%	0.037	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	138.4	172.3	-65.6	-179.5	0	0	0	111.2	H135 A138 K139 D170 L172 I207 V211	H135-L233 HydrophobicContact CB-CD1 4.41Å; A138-L233 HydrophobicContact CB-CD1 3.76Å; K139-L233 HydrophobicContact CG-CD1 4.4Å; D170-L233 HydrophobicContact CB-CD1 4.2Å; D170-L233 HydrophobicContact CB-CG 3.84Å; D170-L233 WeakPolarHBondContact OD2-CB 3.25Å; D170-L233 WeakPolarHBondContact OD2-CG 3.48Å; D170-L233 PolarHBondContact OD2-N 3Å; L172-L233 HydrophobicContact CD1-CD2 3.78Å; L172-L233 HydrophobicContact CD2-CD1 4.28Å; L172-L233 HydrophobicContact CD2-CD2 3.9Å; L172-L233 HydrophobicContact CG-CD2 3.87Å; I207-L233 HydrophobicContact CG2-CD1 4.47Å; I207-L233 HydrophobicContact CG2-CD2 3.86Å; V211-L233 HydrophobicContact CG2-CD2 3.86Å
234	L	96.4	Very high	94.3	Very high	20 Å²	20	49.4 Å²	49.4	11%	0.105	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-53.1	154.9	167.5	-79.3	172.7	0	0	0	112.1	H135 G210 E212 F236 E238 I239 R242	H135-L234 PolarHBondContact NE2-O 3.3Å; G210-L234 WeakPolarHBondContact O-CB 3.42Å; G210-L234 WeakPolarHBondContact O-CD1 3.37Å; G210-L234 WeakPolarHBondContact O-CG 3.38Å; G210-L234 PolarHBondContact O-N 3.06Å; E212-L234 HydrophobicContact CG-CD2 4.39Å; E212-L234 HydrophobicContact CG-CG 4.46Å; L234-F236 PolarHBondContact O-N 3.34Å; L234-E238 HydrophobicContact CB-CB 4.33Å; L234-E238 HydrophobicContact CD1-CB 4.42Å; L234-I239 HydrophobicContact CB-CD1 4.4Å; L234-R242 VanDerWaalsContact CD1-NH2 3.27Å
235	P	96.9	Very high	94.6	Very high	82 Å²	82	51.4 Å²	51.4	53%	0.532	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-50.7	139.2	166.7	-24.4	34.6	0	0	0	110.7	H237 E238	P235-H237 PolarHBondContact O-N 2.89Å; P235-H237 VanDerWaalsContact O-N 3.14Å; P235-E238 WeakPolarHBondContact O-CB 3.42Å; P235-E238 PolarHBondContact O-N 2.66Å
236	F	97.5	Very high	95	Very high	17 Å²	17	49.3 Å²	49.3	8%	0.075	24%	0.238	C	C	.	.	H	α-helix	trans	-63	-26.5	-174.2	-168.1	-109.8	0	0	0	112.9	M88 E92 I128 A131 G132 H135 I207 L234 E238 I239 G240	M88-F236 HydrophobicContact CG-CB 4.24Å; M88-F236 HydrophobicContact CG-CD1 3.48Å; M88-F236 VanDerWaalsContact CG-CD1 3.48Å; M88-F236 HydrophobicContact CG-CE1 3.87Å; M88-F236 HydrophobicContact CG-CG 3.85Å; M88-F236 HydrophobicContact SD-CB 3.81Å; M88-F236 HydrophobicContact SD-CD1 3.86Å; M88-F236 HydrophobicContact SD-CD2 3.87Å; M88-F236 HydrophobicContact SD-CE1 4.36Å; M88-F236 HydrophobicContact SD-CE2 4.41Å; M88-F236 HydrophobicContact SD-CG 3.56Å; M88-F236 VanDerWaalsContact SD-CG 3.56Å; E92-F236 HydrophobicContact CB-CD1 3.77Å; E92-F236 HydrophobicContact CB-CE1 3.55Å; E92-F236 HydrophobicContact CG-CD1 3.93Å; E92-F236 HydrophobicContact CG-CE1 3.87Å; I128-F236 HydrophobicContact CD1-CE1 3.79Å; I128-F236 HydrophobicContact CD1-CE2 4.49Å; I128-F236 HydrophobicContact CD1-CZ 3.57Å; I128-F236 HydrophobicContact CG1-CE1 4.3Å; I128-F236 HydrophobicContact CG1-CZ 4.13Å; A131-F236 HydrophobicContact CB-CE2 4.27Å; G132-F236 VanDerWaalsContact CA-CE2 3.45Å; H135-F236 HydrophobicContact CB-CD2 4Å; H135-F236 HydrophobicContact CB-CE2 4.2Å; H135-F236 AromaticContact CD2-CD2 3.95Å; H135-F236 AromaticContact CG-CD2 3.84Å; I207-F236 HydrophobicContact CD1-CE2 4.48Å; L234-F236 PolarHBondContact O-N 3.34Å; F236-E238 VanDerWaalsContact C-N 3.32Å; F236-E238 PolarHBondContact O-N 3.07Å; F236-I239 HydrophobicContact CD2-CB 4.3Å; F236-I239 HydrophobicContact CE2-CG2 4.31Å; F236-I239 WeakPolarHBondContact O-CB 3.46Å; F236-I239 PolarHBondContact O-N 3.21Å; F236-I239 VanDerWaalsContact O-N 3.13Å; F236-G240 PolarHBondContact O-N 2.86Å
237	H	97.6	Very high	95.4	Very high	72 Å²	72	46.5 Å²	46.5	33%	0.333	22%	0.219	S	C	.	.	H	α-helix	trans	-59	-40.2	173.3	-178.5	46.3	0	0	0	113.1	E92 H95 P235 I239 G240 N241	E92-H237 IonicContact OE1-CE1 3.97Å; E92-H237 IonicContact OE1-CG 2.85Å; E92-H237 IonicContact OE1-ND1 3.79Å; E92-H237 PolarHBondContact OE1-ND1 2.76Å; E92-H237 IonicContact OE2-ND1 2.95Å; H95-H237 AromaticContact CE1-CE1 3.24Å; H95-H237 PolarHBondContact CE1-CE1 3.08Å; H95-H237 AromaticContact CE1-ND1 3.65Å; H95-H237 AromaticContact CE1-NE2 3.98Å; H95-H237 AromaticContact ND1-CE1 3.47Å; H95-H237 PolarHBondContact ND1-CE1 2.98Å; H95-H237 AromaticContact ND1-ND1 3.54Å; P235-H237 PolarHBondContact O-N 2.89Å; P235-H237 VanDerWaalsContact O-N 3.14Å; H237-I239 VanDerWaalsContact C-N 3.27Å; H237-I239 PolarHBondContact O-N 3.25Å; H237-G240 WeakPolarHBondContact O-CA 3.48Å; H237-G240 PolarHBondContact O-N 2.9Å; H237-G240 VanDerWaalsContact O-N 3.11Å; H237-N241 PolarHBondContact CE1-OD1 3.3Å; H237-N241 PolarHBondContact NE2-ND2 3.36Å; H237-N241 VanDerWaalsContact NE2-ND2 3.18Å; H237-N241 PolarHBondContact O-N 3.12Å; H237-N241 PolarHBondContact O-ND2 3.37Å
238	E	98.1	Very high	95.8	Very high	84 Å²	84	48 Å²	48	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-64.7	-34.6	176	-68.4	-58.2	149.7	0	0	112	L234 P235 F236 N241 R242	L234-E238 HydrophobicContact CB-CB 4.33Å; L234-E238 HydrophobicContact CD1-CB 4.42Å; P235-E238 WeakPolarHBondContact O-CB 3.42Å; P235-E238 PolarHBondContact O-N 2.66Å; F236-E238 VanDerWaalsContact C-N 3.32Å; F236-E238 PolarHBondContact O-N 3.07Å; E238-N241 PolarHBondContact O-N 2.95Å; E238-R242 VanDerWaalsContact O-CG 3.31Å; E238-R242 WeakPolarHBondContact O-CG 3.47Å; E238-R242 PolarHBondContact O-N 3.49Å
239	I	98	Very high	96.1	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-42.7	173.2	-56.4	-60.5	0	0	0	110.3	A131 V206 I207 L234 F236 H237 N241 R242 L243	A131-I239 HydrophobicContact CB-CG2 4.05Å; V206-I239 HydrophobicContact CG1-CD1 4.47Å; V206-I239 HydrophobicContact CG1-CG2 4.14Å; I207-I239 HydrophobicContact CD1-CB 4.2Å; I207-I239 HydrophobicContact CD1-CD1 4Å; I207-I239 HydrophobicContact CD1-CG1 3.74Å; I207-I239 HydrophobicContact CD1-CG2 3.58Å; I207-I239 HydrophobicContact CG1-CG2 4.34Å; L234-I239 HydrophobicContact CB-CD1 4.4Å; F236-I239 HydrophobicContact CD2-CB 4.3Å; F236-I239 HydrophobicContact CE2-CG2 4.31Å; F236-I239 WeakPolarHBondContact O-CB 3.46Å; F236-I239 PolarHBondContact O-N 3.21Å; F236-I239 VanDerWaalsContact O-N 3.13Å; H237-I239 VanDerWaalsContact C-N 3.27Å; H237-I239 PolarHBondContact O-N 3.25Å; I239-N241 VanDerWaalsContact C-N 3.34Å; I239-N241 PolarHBondContact O-N 3.41Å; I239-R242 PolarHBondContact O-N 2.84Å; I239-L243 HydrophobicContact CG2-CD1 4.07Å; I239-L243 HydrophobicContact CG2-CG 4.47Å; I239-L243 WeakPolarHBondContact O-CB 3.38Å; I239-L243 WeakPolarHBondContact O-CG 3.17Å; I239-L243 PolarHBondContact O-N 3.29Å
240	G	97.9	Very high	96.4	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.1	-47.7	172.7	0	0	0	0	0	112.1	Q96 F236 H237 R242 L243 K244	Q96-G240 VanDerWaalsContact NE2-C 3.33Å; F236-G240 PolarHBondContact O-N 2.86Å; H237-G240 WeakPolarHBondContact O-CA 3.48Å; H237-G240 PolarHBondContact O-N 2.9Å; H237-G240 VanDerWaalsContact O-N 3.11Å; G240-R242 PolarHBondContact O-N 2.86Å; G240-L243 PolarHBondContact O-N 3.39Å; G240-K244 WeakPolarHBondContact O-CB 3.28Å; G240-K244 PolarHBondContact O-N 2.93Å
241	N	98.4	Very high	96.5	Very high	56 Å²	56	50 Å²	50	30%	0.299	25%	0.246	S	C	.	.	H	α-helix	trans	-59.8	-47.6	177.4	-67.1	-24.1	0	0	0	111.5	Q96 H237 E238 I239 L243 K244 L245	Q96-N241 PolarHBondContact NE2-OD1 3.04Å; H237-N241 PolarHBondContact CE1-OD1 3.3Å; H237-N241 PolarHBondContact NE2-ND2 3.36Å; H237-N241 VanDerWaalsContact NE2-ND2 3.18Å; H237-N241 PolarHBondContact O-N 3.12Å; H237-N241 PolarHBondContact O-ND2 3.37Å; E238-N241 PolarHBondContact O-N 2.95Å; I239-N241 VanDerWaalsContact C-N 3.34Å; I239-N241 PolarHBondContact O-N 3.41Å; N241-L243 VanDerWaalsContact C-N 3.32Å; N241-L243 PolarHBondContact O-N 3.46Å; N241-K244 PolarHBondContact O-N 3.42Å; N241-L245 PolarHBondContact O-N 3.23Å
242	R	98.2	Very high	96.6	Very high	88 Å²	88	50.8 Å²	50.8	33%	0.332	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-38.5	177.4	-70.3	174.9	-175.2	-157.5	1.4	112.3	V206 A209 G210 L234 E238 I239 G240 R246	V206-R242 HydrophobicContact CG1-CB 3.86Å; A209-R242 PolarHBondContact O-NH1 3.33Å; G210-R242 VanDerWaalsContact CA-NH1 3.34Å; L234-R242 VanDerWaalsContact CD1-NH2 3.27Å; E238-R242 VanDerWaalsContact O-CG 3.31Å; E238-R242 WeakPolarHBondContact O-CG 3.47Å; E238-R242 PolarHBondContact O-N 3.49Å; I239-R242 PolarHBondContact O-N 2.84Å; G240-R242 PolarHBondContact O-N 2.86Å; R242-R246 WeakPolarHBondContact O-CG 3.29Å; R242-R246 PolarHBondContact O-N 3.44Å
243	L	98.2	Very high	96.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-72.8	-34.8	176.3	-73.6	175	0	0	0	112.5	F124 A127 I128 A131 V206 I239 G240 N241 R246 Y247	F124-L243 HydrophobicContact CD2-CB 4.29Å; F124-L243 HydrophobicContact CE2-CB 3.72Å; A127-L243 HydrophobicContact CB-CD1 4.47Å; A127-L243 HydrophobicContact CB-CD2 3.86Å; I128-L243 HydrophobicContact CB-CD1 4.23Å; I128-L243 HydrophobicContact CD1-CD1 3.69Å; A131-L243 HydrophobicContact CB-CD1 3.93Å; V206-L243 HydrophobicContact CB-CD2 4.15Å; V206-L243 HydrophobicContact CG1-CD2 4.33Å; V206-L243 HydrophobicContact CG1-CG 4.25Å; V206-L243 HydrophobicContact CG2-CD2 3.86Å; I239-L243 HydrophobicContact CG2-CD1 4.07Å; I239-L243 HydrophobicContact CG2-CG 4.47Å; I239-L243 WeakPolarHBondContact O-CB 3.38Å; I239-L243 WeakPolarHBondContact O-CG 3.17Å; I239-L243 PolarHBondContact O-N 3.29Å; G240-L243 PolarHBondContact O-N 3.39Å; N241-L243 VanDerWaalsContact C-N 3.32Å; N241-L243 PolarHBondContact O-N 3.46Å; L243-R246 PolarHBondContact O-N 3.42Å; L243-Y247 PolarHBondContact O-N 3.33Å
244	K	98	Very high	95.7	Very high	23 Å²	23	51.2 Å²	51.2	10%	0.1	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-38.9	177	177.6	56.1	163.3	149.4	0	111	Q96 F97 E100 F124 G240 N241 R246 Y247 E248	Q96-K244 HydrophobicContact CG-CB 4.43Å; F97-K244 HydrophobicContact CE2-CD 4.31Å; F97-K244 HydrophobicContact CZ-CD 4.2Å; E100-K244 IonicContact OE1-NZ 3.05Å; E100-K244 PolarHBondContact OE1-NZ 3.26Å; F124-K244 HydrophobicContact CE2-CB 4.34Å; G240-K244 WeakPolarHBondContact O-CB 3.28Å; G240-K244 PolarHBondContact O-N 2.93Å; N241-K244 PolarHBondContact O-N 3.42Å; K244-R246 VanDerWaalsContact C-N 3.33Å; K244-R246 PolarHBondContact O-N 3.06Å; K244-Y247 HydrophobicContact CD-CD1 3.99Å; K244-Y247 VanDerWaalsContact O-CB 3.31Å; K244-Y247 WeakPolarHBondContact O-CB 3.49Å; K244-Y247 PolarHBondContact O-N 3.07Å; K244-E248 WeakPolarHBondContact CE-OE1 3.02Å; K244-E248 IonicContact NZ-OE1 2.75Å; K244-E248 PolarHBondContact NZ-OE1 3.01Å; K244-E248 PolarHBondContact O-N 3.45Å
245	L	97.5	Very high	93.9	Very high	118 Å²	118	52.3 Å²	52.3	62%	0.618	28%	0.28	S	S	*	.	H	α-helix	trans	-58.7	-44.6	171.3	-179.9	61.7	0	0	0	112	N241 Y247 E248 T249	N241-L245 PolarHBondContact O-N 3.23Å; L245-Y247 VanDerWaalsContact C-N 3.29Å; L245-Y247 PolarHBondContact O-N 3.11Å; L245-E248 WeakPolarHBondContact O-CB 3.37Å; L245-E248 PolarHBondContact O-N 3.11Å; L245-E248 VanDerWaalsContact O-N 3.11Å; L245-T249 PolarHBondContact O-N 3.31Å; L245-T249 VanDerWaalsContact O-N 3.1Å; L245-T249 PolarHBondContact O-OG1 2.83Å
246	R	97.6	Very high	91.8	Very high	66 Å²	66	52.1 Å²	52.1	25%	0.249	28%	0.281	C	S	.	.	H	α-helix	trans	-70	-26.7	177.6	-66.1	-179.4	176	-57.3	-9	113.6	R242 L243 K244 S250 M295 D296 L297	R242-R246 WeakPolarHBondContact O-CG 3.29Å; R242-R246 PolarHBondContact O-N 3.44Å; L243-R246 PolarHBondContact O-N 3.42Å; K244-R246 VanDerWaalsContact C-N 3.33Å; K244-R246 PolarHBondContact O-N 3.06Å; R246-S250 PolarHBondContact O-N 2.97Å; R246-M295 VanDerWaalsContact CD-O 3.29Å; R246-M295 WeakPolarHBondContact CD-O 3.34Å; R246-M295 VanDerWaalsContact NH1-C 3.28Å; R246-M295 VanDerWaalsContact NH1-CB 3.3Å; R246-M295 PolarHBondContact NH1-O 3.32Å; R246-D296 IonicContact NH1-OD1 3.32Å; R246-L297 HydrophobicContact CB-CD1 4.49Å; R246-L297 HydrophobicContact CB-CG 4.09Å
247	Y	97.3	Very high	89.3	Confident	20 Å²	20	54.1 Å²	54.1	8%	0.078	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-51.7	166.4	166.2	-89.4	0	0	0	108.9	F97 K120 E121 F124 L243 K244 L245 T249 S250	F97-Y247 HydrophobicContact CE1-CD1 4.29Å; F97-Y247 AromaticContact CE1-CE1 3.73Å; F97-Y247 HydrophobicContact CE1-CE1 3.73Å; F97-Y247 HydrophobicContact CE1-CE2 4.06Å; F97-Y247 AromaticContact CE1-CZ 3.59Å; F97-Y247 AromaticContact CZ-CD1 3.97Å; F97-Y247 HydrophobicContact CZ-CD1 3.97Å; F97-Y247 HydrophobicContact CZ-CD2 4.02Å; F97-Y247 AromaticContact CZ-CE1 3.87Å; F97-Y247 HydrophobicContact CZ-CE1 3.87Å; F97-Y247 AromaticContact CZ-CE2 3.86Å; F97-Y247 HydrophobicContact CZ-CE2 3.86Å; F97-Y247 HydrophobicContact CZ-CG 4.05Å; F97-Y247 AromaticContact CZ-CZ 3.79Å; K120-Y247 VanDerWaalsContact C-CE2 3.49Å; K120-Y247 HydrophobicContact CB-CD2 4.44Å; K120-Y247 HydrophobicContact CB-CE2 3.8Å; K120-Y247 HydrophobicContact CD-CD2 4.49Å; K120-Y247 HydrophobicContact CD-CE2 4.07Å; K120-Y247 WeakPolarHBondContact CE-O 3.36Å; K120-Y247 HydrophobicContact CG-CD2 3.84Å; K120-Y247 HydrophobicContact CG-CE2 3.56Å; K120-Y247 PolarHBondContact NZ-O 3.22Å; K120-Y247 WeakPolarHBondContact O-CD2 3.44Å; K120-Y247 WeakPolarHBondContact O-CE2 3.41Å; E121-Y247 HydrophobicContact CG-CE2 4.41Å; E121-Y247 PolarHBondContact OE1-OH 3.05Å; E121-Y247 VanDerWaalsContact OE1-OH 3.06Å; F124-Y247 HydrophobicContact CB-CD2 3.77Å; F124-Y247 HydrophobicContact CB-CE2 4.49Å; F124-Y247 HydrophobicContact CB-CG 4.43Å; F124-Y247 HydrophobicContact CD2-CG 4.42Å; F124-Y247 HydrophobicContact CG-CD2 4.45Å; L243-Y247 PolarHBondContact O-N 3.33Å; K244-Y247 HydrophobicContact CD-CD1 3.99Å; K244-Y247 VanDerWaalsContact O-CB 3.31Å; K244-Y247 WeakPolarHBondContact O-CB 3.49Å; K244-Y247 PolarHBondContact O-N 3.07Å; L245-Y247 VanDerWaalsContact C-N 3.29Å; L245-Y247 PolarHBondContact O-N 3.11Å; Y247-T249 VanDerWaalsContact C-N 3.28Å; Y247-T249 PolarHBondContact O-N 3.49Å; Y247-S250 VanDerWaalsContact O-CB 3.25Å; Y247-S250 WeakPolarHBondContact O-CB 3.41Å; Y247-S250 PolarHBondContact O-N 3Å; Y247-S250 PolarHBondContact O-OG 3.42Å
248	E	95.9	Very high	86.9	Confident	91 Å²	91	55.7 Å²	55.7	43%	0.425	31%	0.306	S	S	.	.	H	α-helix	trans	-55.6	-43.3	179.9	-64.8	-48.3	143.2	0	0	113.2	K120 K244 L245 S250	K120-E248 PolarHBondContact NZ-O 3.09Å; K244-E248 WeakPolarHBondContact CE-OE1 3.02Å; K244-E248 IonicContact NZ-OE1 2.75Å; K244-E248 PolarHBondContact NZ-OE1 3.01Å; K244-E248 PolarHBondContact O-N 3.45Å; L245-E248 WeakPolarHBondContact O-CB 3.37Å; L245-E248 PolarHBondContact O-N 3.11Å; L245-E248 VanDerWaalsContact O-N 3.11Å; E248-S250 VanDerWaalsContact C-N 3.31Å; E248-S250 PolarHBondContact O-N 3.32Å
249	T	95.4	Very high	84.6	Confident	73 Å²	73	59.1 Å²	59.1	45%	0.448	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	14	-179.7	65	0	0	0	0	114.6	L245 Y247 D296	L245-T249 PolarHBondContact O-N 3.31Å; L245-T249 VanDerWaalsContact O-N 3.1Å; L245-T249 PolarHBondContact O-OG1 2.83Å; Y247-T249 VanDerWaalsContact C-N 3.28Å; Y247-T249 PolarHBondContact O-N 3.49Å; T249-D296 PolarHBondContact OG1-OD1 3.44Å
250	S	95.1	Very high	82.3	Confident	16 Å²	16	63.8 Å²	63.8	11%	0.112	36%	0.36	C	S	.	.			trans	-61.8	148.3	-175.2	78.6	0	0	0	0	112.7	K120 R246 Y247 E248 L297 H299	K120-S250 WeakPolarHBondContact CD-OG 3.25Å; K120-S250 WeakPolarHBondContact CE-OG 3.32Å; K120-S250 WeakPolarHBondContact CG-OG 3.34Å; R246-S250 PolarHBondContact O-N 2.97Å; Y247-S250 VanDerWaalsContact O-CB 3.25Å; Y247-S250 WeakPolarHBondContact O-CB 3.41Å; Y247-S250 PolarHBondContact O-N 3Å; Y247-S250 PolarHBondContact O-OG 3.42Å; E248-S250 VanDerWaalsContact C-N 3.31Å; E248-S250 PolarHBondContact O-N 3.32Å; S250-L297 CarbonylContact C-O 3.48Å; S250-L297 WeakPolarHBondContact CA-O 3.36Å; S250-L297 WeakPolarHBondContact CB-O 3.29Å; S250-H299 PolarHBondContact OG-CE1 3.45Å; S250-H299 VanDerWaalsContact OG-CE1 3.3Å; S250-H299 PolarHBondContact OG-ND1 2.98Å
251	V	93.9	Very high	79.9	Confident	62 Å²	62	68.3 Å²	68.3	38%	0.376	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.3	-177.3	-178.2	0	0	0	0	111.1	D296 L297 L298 H299	V251-D296 HydrophobicContact CG2-CB 4.46Å; V251-L297 PolarHBondContact N-O 2.91Å; V251-L298 HydrophobicContact CB-CD2 3.88Å; V251-L298 WeakPolarHBondContact O-CA 3.34Å; V251-H299 PolarHBondContact O-N 2.94Å; V251-H299 PolarHBondContact O-ND1 3.23Å
252	K	92.4	Very high	77.2	Confident	104 Å²	104	69.2 Å²	69.2	45%	0.452	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	131.2	171.9	-167.1	176.2	178.9	179.2	0	110	H299 I300 D302	K252-H299 CarbonylContact C-O 2.62Å; K252-H299 VanDerWaalsContact CA-O 3.28Å; K252-H299 WeakPolarHBondContact CA-O 3.32Å; K252-H299 WeakPolarHBondContact CB-NE2 3.06Å; K252-H299 PolarHBondContact N-CE1 3.32Å; K252-H299 VanDerWaalsContact N-CE1 3.35Å; K252-I300 VanDerWaalsContact CE-O 3.28Å; K252-I300 WeakPolarHBondContact CE-O 3.33Å; K252-D302 WeakPolarHBondContact CD-OD1 3.3Å; K252-D302 WeakPolarHBondContact CE-OD1 3.45Å; K252-D302 IonicContact NZ-OD1 3.05Å; K252-D302 PolarHBondContact NZ-OD1 3.32Å; K252-D302 IonicContact NZ-OD2 2.62Å; K252-D302 PolarHBondContact NZ-OD2 3.32Å
253	V	90.8	Very high	74.6	Confident	20 Å²	20	72.3 Å²	72.3	12%	0.121	43%	0.429	C	S	.	.			trans	-121.3	130.2	176.3	-61.1	0	0	0	0	110	V195 P292 L298 H299 I300	V195-V253 HydrophobicContact CG2-CG2 3.52Å; V253-P292 HydrophobicContact CG1-CG 4.44Å; V253-L298 HydrophobicContact CG1-CD1 4.42Å; V253-L298 HydrophobicContact CG1-CD2 4.06Å; V253-L298 HydrophobicContact CG2-CB 4.45Å; V253-H299 PolarHBondContact N-O 3.2Å; V253-I300 HydrophobicContact CG2-CG1 4.21Å; V253-I300 WeakPolarHBondContact O-CA 3.5Å
254	G	78	Confident	71.9	Confident	61 Å²	61	74.8 Å²	74.8	63%	0.629	46%	0.455	S	S	*	.			trans	-104.5	158.2	174	0	0	0	0	0	111.6
255	S	59.5	Low	69.1	Low	43 Å²	43	81.1 Å²	81.1	30%	0.301	49%	0.49	S	S	.	.			trans	-98.4	131.6	162.6	-149	0	0	0	0	107.9	T257	S255-T257 PolarHBondContact OG-O 2.92Å
256	S	52.7	Low	66.5	Low	79 Å²	79	81.9 Å²	81.9	55%	0.552	49%	0.493	S	S	*	.	S	Bend	trans	-79	-9.9	165.3	55.8	0	0	0	0	112.7	S288	S256-S288 WeakPolarHBondContact CB-OG 3.38Å; S256-S288 WeakPolarHBondContact OG-CB 3.41Å; S256-S288 PolarHBondContact OG-OG 3.01Å
257	T	45.6	Very low	63.9	Low	59 Å²	59	84.2 Å²	84.2	36%	0.362	52%	0.519	S	S	.	.			trans	-142.6	121.8	-172.2	39.4	0	0	0	0	110.1	S255 E259	S255-T257 PolarHBondContact OG-O 2.92Å; T257-E259 PolarHBondContact O-N 3.42Å
258	N	47	Very low	61.1	Low	105 Å²	105	89.3 Å²	89.3	56%	0.561	55%	0.552	S	S	*	*			trans	-92	79.9	169.1	-74	-31.5	0	0	0	108.8	A260 T261 G262	N258-A260 PolarHBondContact O-N 3.5Å; N258-T261 PolarHBondContact O-N 3.27Å; N258-G262 PolarHBondContact O-N 2.98Å
259	E	49.9	Very low	58.3	Low	155 Å²	155	88.1 Å²	88.1	72%	0.724	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-4.9	177.5	-65.6	-175.7	153.3	0	0	113.7	T257	T257-E259 PolarHBondContact O-N 3.42Å
260	A	49.2	Very low	55.6	Low	100 Å²	100	96 Å²	96	83%	0.826	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-13.1	177.2	0	0	0	0	0	114.2	N258	N258-A260 PolarHBondContact O-N 3.5Å
261	T	48.3	Very low	53	Low	95 Å²	95	102 Å²	102	58%	0.583	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.5	-7.7	-178.2	46.8	0	0	0	0	114.3	N258 E263	N258-T261 PolarHBondContact O-N 3.27Å; T261-E263 PolarHBondContact O-N 2.68Å
262	G	40.6	Very low	50.3	Low	75 Å²	75	108.7 Å²	108.7	77%	0.773	64%	0.644	S	S	*	*	S	Bend	trans	66.7	-4.7	-179.5	0	0	0	0	0	114.7	N258 G264	N258-G262 PolarHBondContact O-N 2.98Å; G262-G264 PolarHBondContact O-N 2.75Å
263	E	43	Very low	47.9	Very low	154 Å²	154	112.4 Å²	112.4	72%	0.72	66%	0.663	S	S	*	*			trans	-90.5	95.2	171.5	-72.5	-177	153.6	0	0	108.6	T261	T261-E263 PolarHBondContact O-N 2.68Å
264	G	41.6	Very low	45.6	Very low	52 Å²	52	120 Å²	120	54%	0.536	70%	0.697	S	S	.	*			trans	-64.9	135.6	159.4	0	0	0	0	0	108.7	G262 I266	G262-G264 PolarHBondContact O-N 2.75Å; G264-I266 VanDerWaalsContact C-N 3.27Å; G264-I266 PolarHBondContact O-N 3.01Å
265	D	39.3	Very low	43.8	Very low	156 Å²	156	125.7 Å²	125.7	83%	0.834	71%	0.708	S	S	*	*			trans	-69.1	91.5	172	-155.4	4.9	0	0	0	107.3	S267	D265-S267 PolarHBondContact O-N 3.32Å
266	I	42.7	Very low	42.8	Very low	134 Å²	134	133.2 Å²	133.2	69%	0.687	74%	0.738	S	S	*	*			trans	-69.6	102.1	172	-57.9	175.2	0	0	0	104.9	G264 T268	G264-I266 VanDerWaalsContact C-N 3.27Å; G264-I266 PolarHBondContact O-N 3.01Å; I266-T268 HydrophobicContact CG2-CG2 3.88Å; I266-T268 PolarHBondContact O-N 2.92Å
267	S	44.2	Very low	42.1	Very low	115 Å²	115	138.4 Å²	138.4	80%	0.804	75%	0.754	S	S	*	*			trans	-61.1	84.8	169	-45.2	0	0	0	0	109.2	D265 G269	D265-S267 PolarHBondContact O-N 3.32Å; S267-G269 PolarHBondContact O-N 2.91Å
268	T	38.3	Very low	41.7	Very low	126 Å²	126	144.8 Å²	144.8	77%	0.773	78%	0.779	S	S	*	*			trans	-78.5	96.5	171.8	40	0	0	0	0	109	I266	I266-T268 HydrophobicContact CG2-CG2 3.88Å; I266-T268 PolarHBondContact O-N 2.92Å
269	G	36	Very low	41.3	Very low	66 Å²	66	149.1 Å²	149.1	68%	0.68	80%	0.796	S	S	*	*			trans	76	106.4	132.2	0	0	0	0	0	119.8	S267	S267-G269 PolarHBondContact O-N 2.91Å
270	R	40.1	Very low	41	Very low	240 Å²	240	150.7 Å²	150.7	91%	0.906	80%	0.803	S	S	*	*				72.9	124.6	127.1	-86.5	175.9	168.3	157.7	-3.2	120.8
271	N	40.2	Very low	40.5	Very low	142 Å²	142	154.5 Å²	154.5	76%	0.759	80%	0.804	S	S	*	*			trans	74.4	81.4	149.1	-66	-2.8	0	0	0	117.7
272	Q	37.6	Very low	40	Very low	201 Å²	201	158 Å²	158	94%	0.939	81%	0.813	S	S	*	*			trans	-150	79.7	134.6	-105.8	167.6	55.2	0	0	108.6
273	Q	41.6	Very low	39.7	Very low	182 Å²	182	159.6 Å²	159.6	85%	0.85	81%	0.813	S	S	*	*			trans	-75.2	142.3	156.9	-85.4	178	-9.1	0	0	108.3
274	Q	43.1	Very low	39.3	Very low	180 Å²	180	159.5 Å²	159.5	84%	0.841	82%	0.817	S	S	*	*	S	Bend	trans	90.3	77.1	171.8	-56.3	179	9.3	0	0	116.3
275	Q	38.8	Very low	39.1	Very low	181 Å²	181	163.3 Å²	163.3	85%	0.846	83%	0.832	S	S	*	*	S	Bend		172.6	88.1	121.5	-93.9	171.9	28	0	0	109.7
276	Q	38.4	Very low	39	Very low	201 Å²	201	159.1 Å²	159.1	94%	0.939	83%	0.825	S	S	*	*			trans	179.7	66.5	151.9	-101.1	162.1	58.5	0	0	110.1
277	Q	39.3	Very low	38.9	Very low	188 Å²	188	159.1 Å²	159.1	88%	0.879	83%	0.826	S	S	*	*			trans	-93.9	93.4	157.6	-82.1	178.9	0	0	0	107.5
278	Q	36.7	Very low	39.3	Very low	193 Å²	193	156.8 Å²	156.8	90%	0.902	81%	0.809	S	S	*	*	S	Bend	trans	-169.9	14.1	151	-111	168.6	47	0	0	117.3
279	Q	38.7	Very low	40	Very low	196 Å²	196	154.4 Å²	154.4	92%	0.916	79%	0.792	S	S	*	*			trans	-134.6	65.6	167	-73.2	-177.7	11.1	0	0	111.2
280	Q	42.9	Very low	41.4	Very low	188 Å²	188	157.8 Å²	157.8	88%	0.879	79%	0.79	S	S	*	*			trans	-98.5	96.8	158.8	-84.3	-178.6	12.1	0	0	108.3
281	Q	39.3	Very low	43.2	Very low	179 Å²	179	148.9 Å²	148.9	84%	0.836	76%	0.76	S	S	*	*			trans	-131.4	104.8	157.6	-120.9	173	3.5	0	0	109
282	H	36.9	Very low	45.2	Very low	169 Å²	169	144.9 Å²	144.9	78%	0.782	74%	0.742	S	S	*	*			trans	68.8	60.8	159.8	-69	51	0	0	0	118.1
283	S	35.8	Very low	47.3	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	74%	0.742	S	S	*	*			trans	-95.8	101.3	147.7	30.2	0	0	0	0	108.6
284	L	34.9	Very low	49.6	Very low	152 Å²	152	140.3 Å²	140.3	80%	0.796	71%	0.712	S	S	*	*			trans	-62.4	131.1	169.6	-83.5	98.3	0	0	0	109.4
285	P	36.3	Very low	51.9	Low	131 Å²	131	134.7 Å²	134.7	85%	0.851	69%	0.686	S	S	*	*	S	Bend	trans	-80.9	121.7	174.1	7.5	8.3	0	0	0	110
286	G	36.3	Very low	54.6	Low	68 Å²	68	128.1 Å²	128.1	70%	0.701	66%	0.657	S	S	*	*	S	Bend	trans	97.1	77.6	162.1	0	0	0	0	0	116.4
287	L	40.6	Very low	57.3	Low	135 Å²	135	118.6 Å²	118.6	71%	0.707	61%	0.613	S	S	*	*			trans	-164	59.9	152.4	-134.9	88.1	0	0	0	110.9	D289 Q290	L287-D289 PolarHBondContact O-N 3.4Å; L287-Q290 HydrophobicContact CD2-CB 4.11Å
288	S	52.7	Low	60	Low	65 Å²	65	109.6 Å²	109.6	46%	0.455	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	16.5	-160.6	-148.1	0	0	0	0	117.3	S256	S256-S288 WeakPolarHBondContact CB-OG 3.38Å; S256-S288 WeakPolarHBondContact OG-CB 3.41Å; S256-S288 PolarHBondContact OG-OG 3.01Å
289	D	53.3	Low	62.7	Low	76 Å²	76	101.3 Å²	101.3	41%	0.406	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	6.6	-178.9	-112.2	-35.8	0	0	0	116.6	R194 L287	R194-D289 IonicContact CZ-OD1 3.05Å; R194-D289 PolarHBondContact NH1-O 3.47Å; R194-D289 IonicContact NH1-OD1 2.63Å; R194-D289 IonicContact NH2-OD1 3.93Å; R194-D289 PolarHBondContact NH2-OD1 3.29Å; L287-D289 PolarHBondContact O-N 3.4Å
290	Q	66.8	Low	65.3	Low	138 Å²	138	93.8 Å²	93.8	65%	0.645	50%	0.498	S	S	*	.			trans	-112.3	124.7	178.2	-61.2	-165.5	13.5	0	0	110.8	L287 P292	L287-Q290 HydrophobicContact CD2-CB 4.11Å; Q290-P292 WeakPolarHBondContact O-CD 3.48Å
291	I	77.8	Confident	67.6	Low	53 Å²	53	87 Å²	87	27%	0.272	47%	0.466	S	S	.	.			trans	-56	123.3	168.3	-52.8	175.2	0	0	0	107.2	R194 H198 R293 L298	R194-I291 HydrophobicContact CB-CD1 3.49Å; R194-I291 VanDerWaalsContact CB-CD1 3.49Å; R194-I291 HydrophobicContact CB-CG1 4.06Å; R194-I291 HydrophobicContact CG-CD1 4.03Å; H198-I291 HydrophobicContact CB-CG2 4.08Å; I291-R293 PolarHBondContact O-N 2.74Å; I291-L298 HydrophobicContact CG2-CD1 3.35Å
292	P	80.9	Confident	70.2	Confident	57 Å²	57	83.5 Å²	83.5	37%	0.37	45%	0.453	S	S	.	.			trans	-56	136.1	178.5	-24.8	33.6	0	0	0	110.8	V253 Q290 T294	V253-P292 HydrophobicContact CG1-CG 4.44Å; Q290-P292 WeakPolarHBondContact O-CD 3.48Å; P292-T294 HydrophobicContact CB-CG2 4.2Å; P292-T294 PolarHBondContact O-N 3.25Å
293	R	82.3	Confident	72.9	Confident	253 Å²	253	77.5 Å²	77.5	96%	0.955	43%	0.43	S	S	*	.			trans	-76.2	68.9	172.9	-63.8	-173.4	-169.9	-171.9	4.9	109.8	I291	I291-R293 PolarHBondContact O-N 2.74Å
294	T	89	Confident	75.7	Confident	35 Å²	35	73.9 Å²	73.9	22%	0.215	40%	0.404	C	S	.	.			trans	-113.3	165	178	-175.9	0	0	0	0	111.6	H198 P292 D296 L298	H198-T294 PolarHBondContact CE1-O 3.29Å; H198-T294 VanDerWaalsContact CE1-O 3.23Å; P292-T294 HydrophobicContact CB-CG2 4.2Å; P292-T294 PolarHBondContact O-N 3.25Å; T294-D296 HydrophobicContact CG2-CB 4.01Å; T294-D296 VanDerWaalsContact OG1-CG 3.29Å; T294-D296 PolarHBondContact OG1-N 2.91Å; T294-D296 PolarHBondContact OG1-OD2 2.87Å; T294-L298 HydrophobicContact CG2-CD2 4.03Å
295	M	92.3	Very high	78.5	Confident	61 Å²	61	70.6 Å²	70.6	30%	0.3	39%	0.393	S	S	.	.	S	Bend	trans	-95.4	-1.2	165.5	-73.6	-58.6	-62.3	0	0	112.3	V202 K205 V206 R246	V202-M295 WeakPolarHBondContact CG1-O 3.36Å; K205-M295 HydrophobicContact CB-CE 3.52Å; K205-M295 HydrophobicContact CB-SD 4.26Å; K205-M295 HydrophobicContact CD-CE 3.86Å; K205-M295 HydrophobicContact CD-SD 3.45Å; K205-M295 WeakPolarHBondContact CD-SD 3.44Å; K205-M295 HydrophobicContact CG-CE 4.38Å; V206-M295 HydrophobicContact CG2-CE 4.5Å; R246-M295 VanDerWaalsContact CD-O 3.29Å; R246-M295 WeakPolarHBondContact CD-O 3.34Å; R246-M295 VanDerWaalsContact NH1-C 3.28Å; R246-M295 VanDerWaalsContact NH1-CB 3.3Å; R246-M295 PolarHBondContact NH1-O 3.32Å
296	D	95.1	Very high	81.3	Confident	44 Å²	44	65 Å²	65	24%	0.235	36%	0.356	C	S	.	.	S	Bend	trans	-75.8	154.9	175.1	-55.3	-45	0	0	0	111.5	H198 R246 T249 V251 T294	H198-D296 PolarHBondContact NE2-O 2.77Å; R246-D296 IonicContact NH1-OD1 3.32Å; T249-D296 PolarHBondContact OG1-OD1 3.44Å; V251-D296 HydrophobicContact CG2-CB 4.46Å; T294-D296 HydrophobicContact CG2-CB 4.01Å; T294-D296 VanDerWaalsContact OG1-CG 3.29Å; T294-D296 PolarHBondContact OG1-N 2.91Å; T294-D296 PolarHBondContact OG1-OD2 2.87Å
297	L	96.3	Very high	84	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.328	C	S	.	.			trans	-73.8	148.7	171.7	-63.3	-177.4	0	0	0	110	A123 F124 A127 N199 V202 R246 S250 V251	A123-L297 HydrophobicContact CB-CB 4.19Å; F124-L297 HydrophobicContact CB-CD1 4.33Å; F124-L297 HydrophobicContact CD2-CD1 4.44Å; A127-L297 HydrophobicContact CB-CD1 4.29Å; A127-L297 HydrophobicContact CB-CD2 3.58Å; N199-L297 HydrophobicContact CB-CD2 4.3Å; N199-L297 WeakPolarHBondContact OD1-CA 3.43Å; V202-L297 HydrophobicContact CB-CD2 4.03Å; V202-L297 HydrophobicContact CG1-CD2 3.75Å; R246-L297 HydrophobicContact CB-CD1 4.49Å; R246-L297 HydrophobicContact CB-CG 4.09Å; S250-L297 CarbonylContact C-O 3.48Å; S250-L297 WeakPolarHBondContact CA-O 3.36Å; S250-L297 WeakPolarHBondContact CB-O 3.29Å; V251-L297 PolarHBondContact N-O 2.91Å
298	L	95.5	Very high	86.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.9	-179.4	-57.8	180	0	0	0	110.4	A123 V195 H198 N199 V251 V253 I291 T294	A123-L298 VanDerWaalsContact CB-O 3.22Å; A123-L298 WeakPolarHBondContact CB-O 3.39Å; V195-L298 HydrophobicContact CG1-CB 4Å; V195-L298 VanDerWaalsContact CG1-O 3.26Å; V195-L298 WeakPolarHBondContact CG1-O 3.23Å; V195-L298 HydrophobicContact CG2-CB 4.47Å; H198-L298 HydrophobicContact CB-CD1 4.29Å; H198-L298 VanDerWaalsContact CD2-CD1 3.42Å; H198-L298 WeakPolarHBondContact CD2-CD1 3.32Å; H198-L298 VanDerWaalsContact CD2-CG 3.47Å; H198-L298 WeakPolarHBondContact CD2-CG 3.36Å; N199-L298 PolarHBondContact ND2-O 3.28Å; N199-L298 PolarHBondContact OD1-N 3.27Å; V251-L298 HydrophobicContact CB-CD2 3.88Å; V251-L298 WeakPolarHBondContact O-CA 3.34Å; V253-L298 HydrophobicContact CG1-CD1 4.42Å; V253-L298 HydrophobicContact CG1-CD2 4.06Å; V253-L298 HydrophobicContact CG2-CB 4.45Å; I291-L298 HydrophobicContact CG2-CD1 3.35Å; T294-L298 HydrophobicContact CG2-CD2 4.03Å
299	H	93.7	Very high	88.5	Confident	19 Å²	19	65 Å²	65	9%	0.088	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	159.1	173.8	65.1	-82.6	0	0	0	110.1	G118 S250 V251 K252 V253 E301	G118-H299 WeakPolarHBondContact O-CB 3.08Å; S250-H299 PolarHBondContact OG-CE1 3.45Å; S250-H299 VanDerWaalsContact OG-CE1 3.3Å; S250-H299 PolarHBondContact OG-ND1 2.98Å; V251-H299 PolarHBondContact O-N 2.94Å; V251-H299 PolarHBondContact O-ND1 3.23Å; K252-H299 CarbonylContact C-O 2.62Å; K252-H299 VanDerWaalsContact CA-O 3.28Å; K252-H299 WeakPolarHBondContact CA-O 3.32Å; K252-H299 WeakPolarHBondContact CB-NE2 3.06Å; K252-H299 PolarHBondContact N-CE1 3.32Å; K252-H299 VanDerWaalsContact N-CE1 3.35Å; V253-H299 PolarHBondContact N-O 3.2Å; H299-E301 PolarHBondContact CD2-O 3.09Å
300	I	91.9	Very high	90.4	Very high	38 Å²	38	63.5 Å²	63.5	20%	0.195	33%	0.33	C	S	.	.	S	Bend	trans	-108.3	-35.6	-175.8	-58.2	178	0	0	0	110.5	G118 L191 R192 V195 K252 V253	G118-I300 PolarHBondContact O-N 2.9Å; L191-I300 HydrophobicContact CD2-CD1 4.29Å; L191-I300 HydrophobicContact CG-CD1 4.03Å; R192-I300 HydrophobicContact CB-CD1 4.08Å; V195-I300 HydrophobicContact CB-CD1 4.23Å; V195-I300 HydrophobicContact CB-CG1 4.41Å; V195-I300 HydrophobicContact CG1-CG1 4.37Å; V195-I300 HydrophobicContact CG2-CD1 4.02Å; V195-I300 HydrophobicContact CG2-CG1 3.99Å; K252-I300 VanDerWaalsContact CE-O 3.28Å; K252-I300 WeakPolarHBondContact CE-O 3.33Å; V253-I300 HydrophobicContact CG2-CG1 4.21Å; V253-I300 WeakPolarHBondContact O-CA 3.5Å
301	E	91.7	Very high	91.5	Very high	46 Å²	46	63 Å²	63	22%	0.215	33%	0.326	C	S	.	.	S	Bend	trans	-118.7	146.7	-172.7	-60.5	176.3	-124.1	0	0	110.7	R117 G118 F119 H299	R117-E301 IonicContact CZ-OE1 3.28Å; R117-E301 IonicContact CZ-OE2 3.66Å; R117-E301 VanDerWaalsContact NE-CD 3.29Å; R117-E301 IonicContact NE-OE1 2.82Å; R117-E301 PolarHBondContact NE-OE1 3.3Å; R117-E301 IonicContact NE-OE2 3.72Å; R117-E301 PolarHBondContact NE-OE2 3.39Å; R117-E301 VanDerWaalsContact NH2-CD 3.34Å; R117-E301 IonicContact NH2-OE1 2.84Å; R117-E301 IonicContact NH2-OE2 3.62Å; R117-E301 PolarHBondContact NH2-OE2 3.47Å; G118-E301 PolarHBondContact N-OE1 3.07Å; G118-E301 PolarHBondContact O-N 3.48Å; F119-E301 HydrophobicContact CD1-CB 3.67Å; F119-E301 HydrophobicContact CE1-CB 3.77Å; F119-E301 WeakPolarHBondContact CE1-OE2 3.03Å; H299-E301 PolarHBondContact CD2-O 3.09Å
302	D	93.6	Very high	92.1	Very high	104 Å²	104	61.7 Å²	61.7	56%	0.556	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-66.7	138.3	171.7	-56.1	-45.6	0	0	0	110	F119 K252	F119-D302 VanDerWaalsContact CD1-O 3.3Å; F119-D302 WeakPolarHBondContact CD1-O 3.48Å; F119-D302 VanDerWaalsContact CE1-O 3.29Å; F119-D302 WeakPolarHBondContact CE1-O 3.16Å; K252-D302 WeakPolarHBondContact CD-OD1 3.3Å; K252-D302 WeakPolarHBondContact CE-OD1 3.45Å; K252-D302 IonicContact NZ-OD1 3.05Å; K252-D302 PolarHBondContact NZ-OD1 3.32Å; K252-D302 IonicContact NZ-OD2 2.62Å; K252-D302 PolarHBondContact NZ-OD2 3.32Å
303	S	94.4	Very high	92.6	Very high	43 Å²	43	59.1 Å²	59.1	30%	0.301	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64	138.1	178	-63.2	0	0	0	0	110.8	K120 E121	K120-S303 WeakPolarHBondContact CB-OG 3.31Å; E121-S303 VanDerWaalsContact CD-OG 3.26Å; E121-S303 WeakPolarHBondContact OE1-CB 3.49Å; E121-S303 PolarHBondContact OE1-OG 2.04Å; E121-S303 VanDerWaalsContact OE1-OG 3.11Å; E121-S303 WeakPolarHBondContact OE2-CB 3.3Å; E121-S303 PolarHBondContact OE2-OG 3.41Å
304	P	93.9	Very high	93	Very high	33 Å²	33	50 Å²	50	21%	0.214	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-68.7	162.7	177.9	31.4	-35.9	0	0	0	110.7	F119 F306 Y312	F119-P304 HydrophobicContact CE2-CG 4.01Å; F119-P304 HydrophobicContact CZ-CG 4.16Å; P304-F306 HydrophobicContact CG-CD1 4.43Å; P304-F306 HydrophobicContact CG-CE1 3.77Å; P304-F306 HydrophobicContact CG-CZ 3.91Å; P304-F306 WeakPolarHBondContact O-CD2 3.41Å; P304-F306 WeakPolarHBondContact O-CE2 3.06Å; P304-F306 PolarHBondContact O-N 3.05Å; P304-Y312 HydrophobicContact CB-CD2 3.94Å; P304-Y312 HydrophobicContact CB-CE2 4.29Å; P304-Y312 HydrophobicContact CG-CD2 3.62Å; P304-Y312 HydrophobicContact CG-CE2 4.21Å; P304-Y312 HydrophobicContact CG-CG 4.11Å
305	S	93.3	Very high	93.3	Very high	83 Å²	83	48.7 Å²	48.7	58%	0.58	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-67	123.7	168.1	-178.4	0	0	0	0	110.6	C307	S305-C307 PolarHBondContact OG-N 3.41Å
306	F	95.2	Very high	93.4	Very high	14 Å²	14	45.8 Å²	45.8	6%	0.061	26%	0.259	C	S	.	.			trans	-93	6.2	175.6	-57	-69.4	0	0	0	113.5	R101 W102 I114 E121 P304 G315	R101-F306 HydrophobicContact CB-CB 3.87Å; W102-F306 HydrophobicContact CB-CB 4.44Å; W102-F306 HydrophobicContact CB-CD1 4.03Å; W102-F306 HydrophobicContact CB-CD2 3.67Å; W102-F306 HydrophobicContact CB-CE1 4.12Å; W102-F306 HydrophobicContact CB-CE2 3.78Å; W102-F306 HydrophobicContact CB-CG 3.79Å; W102-F306 HydrophobicContact CB-CZ 4Å; W102-F306 AromaticContact CD1-CE1 3.81Å; W102-F306 HydrophobicContact CG-CD1 4.41Å; W102-F306 HydrophobicContact CG-CE1 4.17Å; W102-F306 HydrophobicContact CG-CE2 4.42Å; W102-F306 HydrophobicContact CG-CZ 4.17Å; I114-F306 HydrophobicContact CD1-CE1 4.45Å; E121-F306 HydrophobicContact CG-CE2 4.33Å; E121-F306 HydrophobicContact CG-CZ 4.08Å; E121-F306 VanDerWaalsContact OE1-CE2 3.26Å; E121-F306 WeakPolarHBondContact OE1-CE2 3.19Å; P304-F306 HydrophobicContact CG-CD1 4.43Å; P304-F306 HydrophobicContact CG-CE1 3.77Å; P304-F306 HydrophobicContact CG-CZ 3.91Å; P304-F306 WeakPolarHBondContact O-CD2 3.41Å; P304-F306 WeakPolarHBondContact O-CE2 3.06Å; P304-F306 PolarHBondContact O-N 3.05Å; F306-G315 WeakPolarHBondContact O-CA 3.41Å
307	C	94.4	Very high	93.4	Very high	17 Å²	17	45.9 Å²	45.9	12%	0.115	27%	0.266	C	S	.	.	S	Bend	trans	-69.4	-38.4	-176.9	-68.6	0	0	0	0	113.3	S305 T316 C332 R334	S305-C307 PolarHBondContact OG-N 3.41Å; C307-T316 PolarHBondContact O-N 2.91Å; C307-T316 VanDerWaalsContact O-N 3.16Å; C307-T316 PolarHBondContact O-OG1 2.86Å; C307-C332 VanDerWaalsContact CA-SG 3.56Å; C307-C332 HydrophobicContact CB-CB 3.71Å; C307-C332 WeakPolarHBondContact CB-SG 3.23Å; C307-C332 WeakPolarHBondContact SG-CB 3.4Å; C307-C332 CovalentContact SG-SG 2.03Å; C307-C332 PolarHBondContact SG-SG 2.03Å; C307-R334 PolarHBondContact O-NH1 3.45Å; C307-R334 PolarHBondContact O-NH2 3.2Å
308	K	94.3	Very high	93.2	Very high	151 Å²	151	49.6 Å²	49.6	66%	0.657	30%	0.297	S	S	*	.	S	Bend	trans	-110.8	154.1	-179.5	-66.9	-173.9	-179.5	-177.7	0	110.1	S310	K308-S310 PolarHBondContact O-N 2.81Å
309	P	93.2	Very high	93.1	Very high	101 Å²	101	51.3 Å²	51.3	66%	0.656	30%	0.303	S	S	*	.			trans	-55.1	135.3	173.9	-20.1	28.7	0	0	0	111.5	A314	P309-A314 WeakPolarHBondContact CG-O 3.42Å
310	S	92.1	Very high	93.1	Very high	44 Å²	44	56.8 Å²	56.8	31%	0.308	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-149.8	178.2	178.3	73.6	0	0	0	0	110.7	H110 K308 Y312 S313	H110-S310 PolarHBondContact CE1-O 3.03Å; H110-S310 PolarHBondContact ND1-O 2.84Å; K308-S310 PolarHBondContact O-N 2.81Å; S310-Y312 PolarHBondContact O-N 3.12Å; S310-Y312 VanDerWaalsContact O-N 3.08Å; S310-Y312 PolarHBondContact OG-N 3.46Å; S310-Y312 VanDerWaalsContact OG-N 3.17Å; S310-S313 PolarHBondContact N-O 2.04Å; S310-S313 PolarHBondContact O-N 3.08Å; S310-S313 PolarHBondContact OG-N 3.41Å
311	K	90.8	Very high	93.2	Very high	126 Å²	126	55.2 Å²	55.2	55%	0.548	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.9	173.3	72.5	-174.3	-176.2	-173.8	0	113.4	H110 N113	H110-K311 PolarHBondContact ND1-O 2.98Å; N113-K311 WeakPolarHBondContact CB-O 3.08Å; N113-K311 PolarHBondContact ND2-O 2.95Å
312	Y	90.4	Very high	93.2	Very high	26 Å²	26	58.5 Å²	58.5	10%	0.102	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-18.2	-176.6	-51.7	-65.2	0	0	0	114.5	N113 R117 F119 P304 S310	N113-Y312 HydrophobicContact CB-CD1 3.79Å; N113-Y312 HydrophobicContact CB-CE1 4.06Å; R117-Y312 HydrophobicContact CG-CE1 3.74Å; F119-Y312 AromaticContact CE2-CD1 3.91Å; F119-Y312 HydrophobicContact CE2-CD1 3.91Å; F119-Y312 HydrophobicContact CE2-CD2 4.35Å; F119-Y312 AromaticContact CE2-CE1 3.76Å; F119-Y312 HydrophobicContact CE2-CE1 3.76Å; F119-Y312 HydrophobicContact CE2-CE2 4.18Å; F119-Y312 HydrophobicContact CE2-CG 4.19Å; F119-Y312 AromaticContact CE2-CZ 3.85Å; F119-Y312 HydrophobicContact CZ-CE1 4.15Å; F119-Y312 HydrophobicContact CZ-CE2 4.05Å; F119-Y312 AromaticContact CZ-CZ 3.78Å; P304-Y312 HydrophobicContact CB-CD2 3.94Å; P304-Y312 HydrophobicContact CB-CE2 4.29Å; P304-Y312 HydrophobicContact CG-CD2 3.62Å; P304-Y312 HydrophobicContact CG-CE2 4.21Å; P304-Y312 HydrophobicContact CG-CG 4.11Å; S310-Y312 PolarHBondContact O-N 3.12Å; S310-Y312 VanDerWaalsContact O-N 3.08Å; S310-Y312 PolarHBondContact OG-N 3.46Å; S310-Y312 VanDerWaalsContact OG-N 3.17Å
313	S	91.6	Very high	92.8	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.021	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-157.8	152.8	-179	173.7	0	0	0	0	111.5	H110 S310 G315	H110-S313 PolarHBondContact ND1-N 3.44Å; S310-S313 PolarHBondContact N-O 2.04Å; S310-S313 PolarHBondContact O-N 3.08Å; S310-S313 PolarHBondContact OG-N 3.41Å; S313-G315 PolarHBondContact O-N 2.8Å; S313-G315 PolarHBondContact OG-N 3.28Å; S313-G315 VanDerWaalsContact OG-N 3.16Å
314	A	91.2	Very high	92.3	Very high	63 Å²	63	63.5 Å²	63.5	52%	0.521	35%	0.349	S	S	.	.			trans	-70.4	-9.2	172.9	0	0	0	0	0	113.6	P309	P309-A314 WeakPolarHBondContact CG-O 3.42Å
315	G	93.4	Very high	92	Very high	7 Å²	7	69 Å²	69	7%	0.072	37%	0.372	C	S	.	.			trans	89.1	-178.5	-173.7	0	0	0	0	0	112.6	F306 S313	F306-G315 WeakPolarHBondContact O-CA 3.41Å; S313-G315 PolarHBondContact O-N 2.8Å; S313-G315 PolarHBondContact OG-N 3.28Å; S313-G315 VanDerWaalsContact OG-N 3.16Å
316	T	95.4	Very high	91.9	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-106.4	2.2	-178.6	58.2	0	0	0	0	115	R101 C307 R319 I330 R334 C371	R101-T316 HydrophobicContact CB-CG2 4.03Å; R101-T316 HydrophobicContact CG-CG2 4.36Å; C307-T316 PolarHBondContact O-N 2.91Å; C307-T316 VanDerWaalsContact O-N 3.16Å; C307-T316 PolarHBondContact O-OG1 2.86Å; T316-R319 WeakPolarHBondContact O-CB 3.46Å; T316-R319 PolarHBondContact O-N 3.04Å; T316-I330 WeakPolarHBondContact CB-O 3.37Å; T316-I330 HydrophobicContact CG2-CG2 4Å; T316-I330 VanDerWaalsContact CG2-O 3.31Å; T316-I330 WeakPolarHBondContact CG2-O 3.42Å; T316-I330 PolarHBondContact OG1-O 2.99Å; T316-R334 PolarHBondContact OG1-NH2 3.05Å; T316-C371 WeakPolarHBondContact O-CB 3.48Å
317	A	94.6	Very high	91.8	Very high	45 Å²	45	65.1 Å²	65.1	37%	0.372	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	140	174.8	0	0	0	0	0	111.1	R319	A317-R319 PolarHBondContact O-N 2.98Å
318	A	93.3	Very high	91.6	Very high	79 Å²	79	70.6 Å²	70.6	65%	0.653	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	8.5	-179.1	0	0	0	0	0	116	C371	A318-C371 WeakPolarHBondContact CA-O 3.46Å; A318-C371 PolarHBondContact N-O 2.69Å
319	R	93.6	Very high	91.4	Very high	36 Å²	36	65.8 Å²	65.8	14%	0.136	36%	0.362	C	S	.	.			trans	-72.9	139.2	173.5	-72.5	-170.8	59.1	-161.1	-12.6	110.8	R98 E100 R101 T316 A317 I330 T370 C371	R98-R319 PolarHBondContact O-NH2 3.18Å; E100-R319 PolarHBondContact O-NH1 2.84Å; E100-R319 PolarHBondContact O-NH2 3.36Å; R101-R319 VanDerWaalsContact C-NH1 3.32Å; R101-R319 PolarHBondContact O-NH1 3.23Å; T316-R319 WeakPolarHBondContact O-CB 3.46Å; T316-R319 PolarHBondContact O-N 3.04Å; A317-R319 PolarHBondContact O-N 2.98Å; R319-I330 HydrophobicContact CB-CG2 4.44Å; R319-T370 CarbonylContact O-C 3.55Å; R319-T370 WeakPolarHBondContact O-CA 3.43Å; R319-C371 PolarHBondContact O-N 3.35Å
320	K	92.9	Very high	91.5	Very high	133 Å²	133	61 Å²	61	58%	0.578	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	140.2	171	-68.4	-174.5	179.5	-175.5	0	110.5	V368 Y369 T370	K320-V368 HydrophobicContact CD-CG1 4.29Å; K320-V368 HydrophobicContact CG-CG1 4.32Å; K320-Y369 VanDerWaalsContact CA-O 3.31Å; K320-Y369 WeakPolarHBondContact CA-O 3.49Å; K320-T370 HydrophobicContact CG-CG2 4.22Å
321	C	93.4	Very high	91.6	Very high	6 Å²	6	59 Å²	59	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	171	173.6	69.3	0	0	0	0	110.2	N326 C327 C331 Y369	C321-N326 WeakPolarHBondContact CA-OD1 3.45Å; C321-N326 WeakPolarHBondContact CB-OD1 3.18Å; C321-C327 HydrophobicContact CB-CB 3.87Å; C321-C327 WeakPolarHBondContact CB-SG 3.21Å; C321-C327 WeakPolarHBondContact SG-CA 3.28Å; C321-C327 WeakPolarHBondContact SG-CB 3.37Å; C321-C327 CovalentContact SG-SG 2.04Å; C321-C327 PolarHBondContact SG-SG 3.29Å; C321-C331 VanDerWaalsContact SG-SG 3.67Å; C321-Y369 PolarHBondContact N-O 3.08Å
322	Y	91.6	Very high	91.8	Very high	114 Å²	114	54.8 Å²	54.8	45%	0.447	30%	0.303	S	S	.	.			trans	-117.1	117.5	-179.6	-61.4	-95.2	0	0	0	107.6	F99 D324 Q325 N326 C327	F99-Y322 HydrophobicContact CD1-CD2 4.15Å; F99-Y322 AromaticContact CD1-CE2 3.84Å; F99-Y322 HydrophobicContact CD1-CE2 3.84Å; F99-Y322 AromaticContact CE1-CD2 3.84Å; F99-Y322 HydrophobicContact CE1-CD2 3.84Å; F99-Y322 AromaticContact CE1-CE2 3.19Å; F99-Y322 HydrophobicContact CE1-CE2 3.19Å; F99-Y322 AromaticContact CE1-CZ 3.89Å; F99-Y322 HydrophobicContact CZ-CD2 4.49Å; F99-Y322 AromaticContact CZ-CE2 3.93Å; F99-Y322 HydrophobicContact CZ-CE2 3.93Å; Y322-D324 VanDerWaalsContact C-N 3.3Å; Y322-D324 PolarHBondContact O-N 2.88Å; Y322-Q325 PolarHBondContact O-N 3.38Å; Y322-N326 PolarHBondContact N-OD1 2.83Å; Y322-N326 PolarHBondContact O-N 2.82Å; Y322-C327 PolarHBondContact N-SG 3.26Å; Y322-C327 VanDerWaalsContact N-SG 3.4Å; Y322-C327 PolarHBondContact O-N 3.38Å; Y322-C327 PolarHBondContact O-SG 3.43Å
323	K	85.4	Confident	91.8	Very high	103 Å²	103	56.9 Å²	56.9	45%	0.448	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	-50.7	-167.7	-176	179	174.2	-174	0	112.8	C327 Y369	K323-C327 VanDerWaalsContact CA-SG 3.58Å; K323-C327 PolarHBondContact N-SG 2.93Å; K323-C327 VanDerWaalsContact N-SG 3.44Å; K323-Y369 HydrophobicContact CB-CD1 4.38Å; K323-Y369 HydrophobicContact CB-CD2 3.92Å; K323-Y369 HydrophobicContact CB-CE1 4.14Å; K323-Y369 HydrophobicContact CB-CE2 3.64Å; K323-Y369 HydrophobicContact CB-CG 4.27Å; K323-Y369 HydrophobicContact CD-CE1 3.82Å; K323-Y369 HydrophobicContact CD-CE2 4.4Å; K323-Y369 WeakPolarHBondContact CD-OH 3.44Å; K323-Y369 HydrophobicContact CG-CE1 4.36Å
324	D	84.8	Confident	91.9	Very high	150 Å²	150	59.6 Å²	59.6	80%	0.802	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	11.7	-174.3	-49.6	-50.1	0	0	0	113.7	Y322	Y322-D324 VanDerWaalsContact C-N 3.3Å; Y322-D324 PolarHBondContact O-N 2.88Å
325	Q	87.3	Confident	92	Very high	147 Å²	147	57.9 Å²	57.9	69%	0.687	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.9	-51.5	-178.4	-55.1	-179.4	8.1	0	0	112.8	Y322	Y322-Q325 PolarHBondContact O-N 3.38Å
326	N	91.9	Very high	92.1	Very high	14 Å²	14	59.7 Å²	59.7	8%	0.075	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	2.6	-166.5	68.2	12.7	0	0	0	115.9	F99 C321 Y322 D328 A329 I330	F99-N326 VanDerWaalsContact CB-ND2 3.27Å; F99-N326 WeakPolarHBondContact CB-ND2 3.48Å; F99-N326 WeakPolarHBondContact CD1-ND2 3.35Å; F99-N326 VanDerWaalsContact CG-ND2 3.3Å; F99-N326 WeakPolarHBondContact CG-ND2 3.18Å; C321-N326 WeakPolarHBondContact CA-OD1 3.45Å; C321-N326 WeakPolarHBondContact CB-OD1 3.18Å; Y322-N326 PolarHBondContact N-OD1 2.83Å; Y322-N326 PolarHBondContact O-N 2.82Å; N326-D328 VanDerWaalsContact C-N 3.33Å; N326-D328 PolarHBondContact O-N 3.14Å; N326-A329 PolarHBondContact O-N 3.31Å; N326-I330 HydrophobicContact CB-CD1 4.04Å; N326-I330 HydrophobicContact CB-CG1 4.3Å; N326-I330 WeakPolarHBondContact O-CG1 3.2Å; N326-I330 PolarHBondContact O-N 2.91Å
327	C	92.5	Very high	92	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.014	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-43.6	179.8	-78	0	0	0	0	112.2	C321 Y322 K323 A329 C331	C321-C327 HydrophobicContact CB-CB 3.87Å; C321-C327 WeakPolarHBondContact CB-SG 3.21Å; C321-C327 WeakPolarHBondContact SG-CA 3.28Å; C321-C327 WeakPolarHBondContact SG-CB 3.37Å; C321-C327 CovalentContact SG-SG 2.04Å; C321-C327 PolarHBondContact SG-SG 3.29Å; Y322-C327 PolarHBondContact N-SG 3.26Å; Y322-C327 VanDerWaalsContact N-SG 3.4Å; Y322-C327 PolarHBondContact O-N 3.38Å; Y322-C327 PolarHBondContact O-SG 3.43Å; K323-C327 VanDerWaalsContact CA-SG 3.58Å; K323-C327 PolarHBondContact N-SG 2.93Å; K323-C327 VanDerWaalsContact N-SG 3.44Å; C327-A329 VanDerWaalsContact C-N 3.33Å; C327-A329 PolarHBondContact O-N 2.91Å; C327-C331 WeakPolarHBondContact O-CB 3.37Å; C327-C331 PolarHBondContact O-N 3.39Å; C327-C331 PolarHBondContact O-SG 3.14Å
328	D	90.7	Very high	92	Very high	132 Å²	132	65.2 Å²	65.2	71%	0.706	36%	0.363	S	S	*	.	H	α-helix	trans	-62.8	-41.1	179.3	-64.6	-26.9	0	0	0	112.3	N326 C332	N326-D328 VanDerWaalsContact C-N 3.33Å; N326-D328 PolarHBondContact O-N 3.14Å; D328-C332 PolarHBondContact O-N 2.95Å
329	A	90.3	Very high	92	Very high	51 Å²	51	67.7 Å²	67.7	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-69.5	-48.9	-179.1	0	0	0	0	0	112.5	R101 N326 C327	R101-A329 PolarHBondContact NE-O 3.36Å; R101-A329 PolarHBondContact NH2-O 3.18Å; N326-A329 PolarHBondContact O-N 3.31Å; C327-A329 VanDerWaalsContact C-N 3.33Å; C327-A329 PolarHBondContact O-N 2.91Å
330	I	93.8	Very high	91.9	Very high	1 Å²	1	68.3 Å²	68.3	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-75.6	-38.5	-176.2	-61.1	175.9	0	0	0	111.1	F99 T316 R319 N326 C332	F99-I330 WeakPolarHBondContact O-CD1 3Å; F99-I330 VanDerWaalsContact O-CG1 3.26Å; F99-I330 WeakPolarHBondContact O-CG1 3.22Å; T316-I330 WeakPolarHBondContact CB-O 3.37Å; T316-I330 HydrophobicContact CG2-CG2 4Å; T316-I330 VanDerWaalsContact CG2-O 3.31Å; T316-I330 WeakPolarHBondContact CG2-O 3.42Å; T316-I330 PolarHBondContact OG1-O 2.99Å; R319-I330 HydrophobicContact CB-CG2 4.44Å; N326-I330 HydrophobicContact CB-CD1 4.04Å; N326-I330 HydrophobicContact CB-CG1 4.3Å; N326-I330 WeakPolarHBondContact O-CG1 3.2Å; N326-I330 PolarHBondContact O-N 2.91Å; I330-C332 PolarHBondContact O-N 2.62Å; I330-C332 PolarHBondContact O-SG 2.69Å
331	C	95.1	Very high	91.9	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.007	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.4	-176.2	-52.3	0	0	0	0	113.4	C321 C327 G333 R334 G335 C371	C321-C331 VanDerWaalsContact SG-SG 3.67Å; C327-C331 WeakPolarHBondContact O-CB 3.37Å; C327-C331 PolarHBondContact O-N 3.39Å; C327-C331 PolarHBondContact O-SG 3.14Å; C331-G333 VanDerWaalsContact C-N 3.25Å; C331-G333 PolarHBondContact O-N 3.05Å; C331-R334 WeakPolarHBondContact O-CB 3.08Å; C331-R334 PolarHBondContact O-N 2.89Å; C331-G335 WeakPolarHBondContact CB-O 3.46Å; C331-C371 WeakPolarHBondContact CA-SG 3.5Å; C331-C371 HydrophobicContact CB-CB 3.69Å; C331-C371 WeakPolarHBondContact CB-SG 3.46Å; C331-C371 PolarHBondContact N-SG 3.3Å; C331-C371 WeakPolarHBondContact SG-CA 3.33Å; C331-C371 WeakPolarHBondContact SG-CB 3.28Å; C331-C371 CovalentContact SG-SG 2.04Å; C331-C371 PolarHBondContact SG-SG 3.32Å
332	C	94.1	Very high	91.9	Very high	37 Å²	37	75.7 Å²	75.7	25%	0.25	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	39.6	173.2	-53.7	0	0	0	0	113.2	C307 D328 I330 R334	C307-C332 VanDerWaalsContact CA-SG 3.56Å; C307-C332 HydrophobicContact CB-CB 3.71Å; C307-C332 WeakPolarHBondContact CB-SG 3.23Å; C307-C332 WeakPolarHBondContact SG-CB 3.4Å; C307-C332 CovalentContact SG-SG 2.03Å; C307-C332 PolarHBondContact SG-SG 2.03Å; D328-C332 PolarHBondContact O-N 2.95Å; I330-C332 PolarHBondContact O-N 2.62Å; I330-C332 PolarHBondContact O-SG 2.69Å; C332-R334 PolarHBondContact O-N 3.27Å
333	G	91.1	Very high	91.9	Very high	70 Å²	70	73 Å²	73	72%	0.722	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-0.1	-179.6	0	0	0	0	0	115.9	C331 G335	C331-G333 VanDerWaalsContact C-N 3.25Å; C331-G333 PolarHBondContact O-N 3.05Å; G333-G335 PolarHBondContact O-N 3.43Å
334	R	93.7	Very high	92.4	Very high	60 Å²	60	71.7 Å²	71.7	23%	0.226	40%	0.397	C	S	.	.	S	Bend	trans	-73.8	-11	176.5	-60.1	-171.8	-62.8	-104.6	-7.2	113.5	C307 T316 C331 C332 K372 G373	C307-R334 PolarHBondContact O-NH1 3.45Å; C307-R334 PolarHBondContact O-NH2 3.2Å; T316-R334 PolarHBondContact OG1-NH2 3.05Å; C331-R334 WeakPolarHBondContact O-CB 3.08Å; C331-R334 PolarHBondContact O-N 2.89Å; C332-R334 PolarHBondContact O-N 3.27Å; R334-K372 HydrophobicContact CB-CB 4.32Å; R334-K372 PolarHBondContact NE-O 2.94Å; R334-K372 PolarHBondContact NH2-O 2.87Å; R334-K372 WeakPolarHBondContact O-CD 3.41Å; R334-G373 PolarHBondContact NE-OXT 2.85Å
335	G	92.8	Very high	92.8	Very high	27 Å²	27	65.8 Å²	65.8	28%	0.278	37%	0.371	S	S	.	.			trans	75.1	-175.3	-170.7	0	0	0	0	0	113.2	C331 G333 K372	C331-G335 WeakPolarHBondContact CB-O 3.46Å; G333-G335 PolarHBondContact O-N 3.43Å; G335-K372 PolarHBondContact O-N 3.4Å
336	H	95.3	Very high	93.1	Very high	45 Å²	45	63.8 Å²	63.8	21%	0.208	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.7	-177.3	58	75.8	0	0	0	111.9	Y369 T370 K372	H336-Y369 AromaticContact CE1-CD1 3.68Å; H336-Y369 AromaticContact ND1-CD1 3.58Å; H336-T370 CarbonylContact C-O 3.56Å; H336-T370 WeakPolarHBondContact CA-O 3.38Å; H336-T370 WeakPolarHBondContact CB-O 3.41Å; H336-K372 VanDerWaalsContact O-CE 3.27Å; H336-K372 WeakPolarHBondContact O-CE 3.19Å
337	N	94.4	Very high	93.3	Very high	84 Å²	84	64.3 Å²	64.3	45%	0.449	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	144.3	166.3	-64.7	-34	0	0	0	109.1	Y369 T370 K372	N337-Y369 CarbonylContact O-C 3.59Å; N337-Y369 VanDerWaalsContact O-CA 3.3Å; N337-Y369 WeakPolarHBondContact O-CA 3.45Å; N337-T370 PolarHBondContact N-O 3.32Å; N337-T370 PolarHBondContact O-N 2.88Å; N337-K372 WeakPolarHBondContact OD1-CE 3.05Å
338	T	94.6	Very high	93.3	Very high	77 Å²	77	70.1 Å²	70.1	47%	0.472	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.8	176	-54.3	0	0	0	0	108.8	E367 Y369	T338-E367 HydrophobicContact CG2-CB 4.33Å; T338-E367 HydrophobicContact CG2-CG 4.49Å; T338-Y369 HydrophobicContact CG2-CD1 3.91Å; T338-Y369 HydrophobicContact CG2-CE1 3.55Å; T338-Y369 WeakPolarHBondContact OG1-CD1 3.25Å; T338-Y369 WeakPolarHBondContact OG1-CE1 3.34Å
339	Q	92.9	Very high	93.5	Very high	131 Å²	131	67 Å²	67	61%	0.612	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.2	175.6	-174.2	179.3	29.3	0	0	109.3	V368	Q339-V368 PolarHBondContact N-O 3.23Å; Q339-V368 PolarHBondContact O-N 3.38Å
340	S	92.3	Very high	93.6	Very high	50 Å²	50	70.6 Å²	70.6	35%	0.35	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.8	171.2	68.8	0	0	0	0	110.2	R365 E366	S340-R365 PolarHBondContact OG-NE 3.01Å; S340-R365 VanDerWaalsContact OG-NE 3.11Å; S340-R365 PolarHBondContact OG-NH2 3.05Å; S340-E366 CarbonylContact C-O 3.58Å; S340-E366 WeakPolarHBondContact CA-O 3.46Å
341	R	91.1	Very high	93.6	Very high	152 Å²	152	76.4 Å²	76.4	57%	0.574	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.8	177.6	-178.7	177.9	177.1	175.7	-0.4	109.7	V343 E366 V368	R341-V343 HydrophobicContact CG-CG2 4.25Å; R341-E366 PolarHBondContact N-O 2.77Å; R341-E366 PolarHBondContact O-N 3.36Å; R341-V368 HydrophobicContact CB-CG2 4.28Å
342	E	94	Very high	93.4	Very high	142 Å²	142	81.8 Å²	81.8	66%	0.664	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	124.5	166.8	-74.9	-175.9	-179.5	0	0	109.8	T363 Q364	E342-T363 HydrophobicContact CB-CG2 3.74Å; E342-T363 HydrophobicContact CG-CG2 4.07Å; E342-Q364 WeakPolarHBondContact CA-O 3.22Å
343	V	92.3	Very high	92.7	Very high	57 Å²	57	92.3 Å²	92.3	35%	0.345	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.9	177.9	-177.1	0	0	0	0	107.4	R341 Q364 E366	R341-V343 HydrophobicContact CG-CG2 4.25Å; V343-Q364 PolarHBondContact N-O 3.12Å; V343-Q364 PolarHBondContact O-N 3.17Å; V343-E366 HydrophobicContact CG2-CB 4.22Å
344	T	94.7	Very high	91.7	Very high	76 Å²	76	93.3 Å²	93.3	47%	0.466	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.8	173.9	-56.4	0	0	0	0	109	Q361 C362 T363	T344-Q361 HydrophobicContact CG2-CB 4Å; T344-C362 VanDerWaalsContact CA-O 3.32Å; T344-C362 WeakPolarHBondContact CA-O 3.18Å; T344-T363 PolarHBondContact OG1-OG1 3.21Å
345	G	94.1	Very high	91.3	Very high	26 Å²	26	96.7 Å²	96.7	27%	0.268	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	167.5	-179.3	0	0	0	0	0	112.6	C347 C362	G345-C347 PolarHBondContact O-N 3.47Å; G345-C362 PolarHBondContact N-O 3.17Å; G345-C362 PolarHBondContact O-N 3.02Å
346	P	94.3	Very high	91.1	Very high	104 Å²	104	101.3 Å²	101.3	68%	0.675	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.7	173.9	27.8	-32.8	0	0	0	110.1	C359 K360	P346-C359 HydrophobicContact CB-CB 3.74Å; P346-K360 CarbonylContact C-O 3.44Å; P346-K360 WeakPolarHBondContact CA-O 3.24Å
347	C	94.6	Very high	91.1	Very high	26 Å²	26	103.4 Å²	103.4	18%	0.176	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	165.3	179.5	66.4	0	0	0	0	109.9	G345 C349 K360 C362	G345-C347 PolarHBondContact O-N 3.47Å; C347-C349 PolarHBondContact O-N 2.83Å; C347-C349 VanDerWaalsContact O-N 3.17Å; C347-K360 PolarHBondContact N-O 3.37Å; C347-K360 PolarHBondContact O-N 3.26Å; C347-K360 PolarHBondContact SG-O 3.47Å; C347-K360 VanDerWaalsContact SG-O 3.38Å; C347-C362 HydrophobicContact CB-CB 3.51Å; C347-C362 WeakPolarHBondContact CB-SG 3.49Å; C347-C362 WeakPolarHBondContact SG-CB 3.46Å; C347-C362 PolarHBondContact SG-N 3.08Å; C347-C362 CovalentContact SG-SG 2Å; C347-C362 PolarHBondContact SG-SG 3.39Å
348	Q	93.8	Very high	91.1	Very high	123 Å²	123	102.8 Å²	102.8	58%	0.575	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.9	45.1	175.3	-57.4	-177.4	4.6	0	0	112.3	K360	Q348-K360 HydrophobicContact CB-CD 4.5Å
349	C	94.6	Very high	91.1	Very high	68 Å²	68	101.8 Å²	101.8	46%	0.459	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.5	-177.3	-62.4	0	0	0	0	111	C347 V357 E358 C359	C347-C349 PolarHBondContact O-N 2.83Å; C347-C349 VanDerWaalsContact O-N 3.17Å; C349-V357 HydrophobicContact CB-CG1 3.7Å; C349-E358 CarbonylContact C-O 3.48Å; C349-E358 WeakPolarHBondContact CA-O 3.25Å; C349-C359 HydrophobicContact CB-CB 4.11Å; C349-C359 WeakPolarHBondContact CB-SG 3.02Å; C349-C359 WeakPolarHBondContact SG-CB 3.41Å; C349-C359 CovalentContact SG-SG 2.04Å; C349-C359 PolarHBondContact SG-SG 2.96Å
350	Q	93.1	Very high	91.3	Very high	126 Å²	126	101.6 Å²	101.6	59%	0.589	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.2	176	-65.4	-174.6	-6	0	0	109.9	R352 E358	Q350-R352 PolarHBondContact O-N 3.08Å; Q350-E358 PolarHBondContact N-O 2.86Å; Q350-E358 PolarHBondContact O-N 3.08Å
351	V	92.2	Very high	91.5	Very high	122 Å²	122	107 Å²	107	74%	0.739	55%	0.548	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	117.9	173.5	-177.1	0	0	0	0	107.7	V357	V351-V357 HydrophobicContact CG2-CG2 4.37Å
352	R	90.9	Very high	91.7	Very high	115 Å²	115	102 Å²	102	43%	0.434	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.1	170.5	-67.8	-79.4	-172	-167.9	-4.2	108.2	Q350 C354 C355 Y356 E358	Q350-R352 PolarHBondContact O-N 3.08Å; R352-C354 PolarHBondContact O-N 3.41Å; R352-C354 VanDerWaalsContact O-N 3.1Å; R352-C355 PolarHBondContact O-N 3.24Å; R352-Y356 HydrophobicContact CB-CE1 4.15Å; R352-Y356 HydrophobicContact CB-CE2 4.31Å; R352-Y356 HydrophobicContact CG-CE2 3.98Å; R352-Y356 PolarHBondContact N-O 3.21Å; R352-E358 HydrophobicContact CG-CG 4.09Å; R352-E358 IonicContact CZ-OE1 3.86Å; R352-E358 IonicContact CZ-OE2 3.23Å; R352-E358 VanDerWaalsContact CZ-OE2 3.23Å; R352-E358 IonicContact NE-OE1 3.05Å; R352-E358 PolarHBondContact NE-OE1 2.89Å; R352-E358 IonicContact NE-OE2 2.89Å; R352-E358 PolarHBondContact NE-OE2 3.31Å; R352-E358 IonicContact NH2-OE1 3.87Å; R352-E358 IonicContact NH2-OE2 2.72Å; R352-E358 PolarHBondContact NH2-OE2 3.38Å
353	W	80.9	Confident	91.8	Very high	258 Å²	258	99 Å²	99	98%	0.977	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	114	174	-156.1	86.1	0	0	0	107.5
354	C	69.2	Low	91.8	Very high	91 Å²	91	103.3 Å²	103.3	62%	0.615	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	102	40	-162.8	99.8	0	0	0	0	118	R352	R352-C354 PolarHBondContact O-N 3.41Å; R352-C354 VanDerWaalsContact O-N 3.1Å
355	C	85.9	Confident	91.8	Very high	131 Å²	131	108.1 Å²	108.1	89%	0.885	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.6	12.7	141.2	-48.7	0	0	0	0	118.6	R352	R352-C355 PolarHBondContact O-N 3.24Å
356	Y	88.9	Confident	91.6	Very high	123 Å²	123	112 Å²	112	48%	0.482	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-136.5	154.6	173.1	65.4	-81.4	0	0	0	112.1	R352 E358	R352-Y356 HydrophobicContact CB-CE1 4.15Å; R352-Y356 HydrophobicContact CB-CE2 4.31Å; R352-Y356 HydrophobicContact CG-CE2 3.98Å; R352-Y356 PolarHBondContact N-O 3.21Å; Y356-E358 HydrophobicContact CD2-CG 3.95Å; Y356-E358 HydrophobicContact CE2-CG 3.6Å; Y356-E358 WeakPolarHBondContact CE2-OE1 3.14Å; Y356-E358 PolarHBondContact OH-OE1 3.33Å
357	V	93.9	Very high	91.5	Very high	89 Å²	89	112 Å²	112	54%	0.539	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	121.3	-178.9	-176.9	0	0	0	0	107.9	C349 V351	C349-V357 HydrophobicContact CB-CG1 3.7Å; V351-V357 HydrophobicContact CG2-CG2 4.37Å
358	E	94.3	Very high	91.5	Very high	71 Å²	71	111.9 Å²	111.9	33%	0.332	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.7	122	171.6	-73.6	178.3	-160.9	0	0	109	C349 Q350 R352 Y356	C349-E358 CarbonylContact C-O 3.48Å; C349-E358 WeakPolarHBondContact CA-O 3.25Å; Q350-E358 PolarHBondContact N-O 2.86Å; Q350-E358 PolarHBondContact O-N 3.08Å; R352-E358 HydrophobicContact CG-CG 4.09Å; R352-E358 IonicContact CZ-OE1 3.86Å; R352-E358 IonicContact CZ-OE2 3.23Å; R352-E358 VanDerWaalsContact CZ-OE2 3.23Å; R352-E358 IonicContact NE-OE1 3.05Å; R352-E358 PolarHBondContact NE-OE1 2.89Å; R352-E358 IonicContact NE-OE2 2.89Å; R352-E358 PolarHBondContact NE-OE2 3.31Å; R352-E358 IonicContact NH2-OE1 3.87Å; R352-E358 IonicContact NH2-OE2 2.72Å; R352-E358 PolarHBondContact NH2-OE2 3.38Å; Y356-E358 HydrophobicContact CD2-CG 3.95Å; Y356-E358 HydrophobicContact CE2-CG 3.6Å; Y356-E358 WeakPolarHBondContact CE2-OE1 3.14Å; Y356-E358 PolarHBondContact OH-OE1 3.33Å
359	C	96.1	Very high	91.5	Very high	57 Å²	57	107.6 Å²	107.6	39%	0.385	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.5	175.2	-56.1	0	0	0	0	109.9	P346 C349	P346-C359 HydrophobicContact CB-CB 3.74Å; C349-C359 HydrophobicContact CB-CB 4.11Å; C349-C359 WeakPolarHBondContact CB-SG 3.02Å; C349-C359 WeakPolarHBondContact SG-CB 3.41Å; C349-C359 CovalentContact SG-SG 2.04Å; C349-C359 PolarHBondContact SG-SG 2.96Å
360	K	96.1	Very high	91.5	Very high	126 Å²	126	105.9 Å²	105.9	55%	0.548	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	161.5	164.7	-62.8	-179.1	-169.8	165.9	0	109.3	P346 C347 Q348	P346-K360 CarbonylContact C-O 3.44Å; P346-K360 WeakPolarHBondContact CA-O 3.24Å; C347-K360 PolarHBondContact N-O 3.37Å; C347-K360 PolarHBondContact O-N 3.26Å; C347-K360 PolarHBondContact SG-O 3.47Å; C347-K360 VanDerWaalsContact SG-O 3.38Å; Q348-K360 HydrophobicContact CB-CD 4.5Å
361	Q	96.4	Very high	91.7	Very high	165 Å²	165	100 Å²	100	77%	0.771	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.2	165.7	-67.2	-159	-2.5	0	0	109.2	T344	T344-Q361 HydrophobicContact CG2-CB 4Å
362	C	95.8	Very high	91.7	Very high	46 Å²	46	98.5 Å²	98.5	31%	0.311	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.1	171.8	-66.2	0	0	0	0	109	T344 G345 C347	T344-C362 VanDerWaalsContact CA-O 3.32Å; T344-C362 WeakPolarHBondContact CA-O 3.18Å; G345-C362 PolarHBondContact N-O 3.17Å; G345-C362 PolarHBondContact O-N 3.02Å; C347-C362 HydrophobicContact CB-CB 3.51Å; C347-C362 WeakPolarHBondContact CB-SG 3.49Å; C347-C362 WeakPolarHBondContact SG-CB 3.46Å; C347-C362 PolarHBondContact SG-N 3.08Å; C347-C362 CovalentContact SG-SG 2Å; C347-C362 PolarHBondContact SG-SG 3.39Å
363	T	94.9	Very high	91.5	Very high	78 Å²	78	97.8 Å²	97.8	48%	0.479	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.3	169.7	-55.9	0	0	0	0	108.4	E342 T344	E342-T363 HydrophobicContact CB-CG2 3.74Å; E342-T363 HydrophobicContact CG-CG2 4.07Å; T344-T363 PolarHBondContact OG1-OG1 3.21Å
364	Q	93.8	Very high	92	Very high	148 Å²	148	89.8 Å²	89.8	69%	0.692	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.2	174.6	-176.1	174.2	-1.9	0	0	109.6	E342 V343	E342-Q364 WeakPolarHBondContact CA-O 3.22Å; V343-Q364 PolarHBondContact N-O 3.12Å; V343-Q364 PolarHBondContact O-N 3.17Å
365	R	93.1	Very high	93.2	Very high	177 Å²	177	89.7 Å²	89.7	67%	0.668	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	117.7	172.4	-163.8	171.6	-178.1	-174.6	-3.3	109	S340	S340-R365 PolarHBondContact OG-NE 3.01Å; S340-R365 VanDerWaalsContact OG-NE 3.11Å; S340-R365 PolarHBondContact OG-NH2 3.05Å
366	E	91.4	Very high	93.6	Very high	107 Å²	107	87.4 Å²	87.4	50%	0.5	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.9	177.6	-170.3	-177	-176.5	0	0	109.6	S340 R341 V343	S340-E366 CarbonylContact C-O 3.58Å; S340-E366 WeakPolarHBondContact CA-O 3.46Å; R341-E366 PolarHBondContact N-O 2.77Å; R341-E366 PolarHBondContact O-N 3.36Å; V343-E366 HydrophobicContact CG2-CB 4.22Å
367	E	92.4	Very high	93.9	Very high	104 Å²	104	85.3 Å²	85.3	49%	0.486	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.6	171.5	-64.6	-165.9	157.2	0	0	110.6	T338 Y369	T338-E367 HydrophobicContact CG2-CB 4.33Å; T338-E367 HydrophobicContact CG2-CG 4.49Å; E367-Y369 HydrophobicContact CB-CE1 4.42Å; E367-Y369 HydrophobicContact CB-CE2 4.19Å; E367-Y369 PolarHBondContact OE2-OH 2.93Å
368	V	93.2	Very high	93.9	Very high	24 Å²	24	85.1 Å²	85.1	15%	0.145	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.9	176.3	-176.6	0	0	0	0	108.9	K320 Q339 R341 T370	K320-V368 HydrophobicContact CD-CG1 4.29Å; K320-V368 HydrophobicContact CG-CG1 4.32Å; Q339-V368 PolarHBondContact N-O 3.23Å; Q339-V368 PolarHBondContact O-N 3.38Å; R341-V368 HydrophobicContact CB-CG2 4.28Å; V368-T370 HydrophobicContact CG1-CG2 4.36Å
369	Y	94.7	Very high	93.9	Very high	34 Å²	34	86 Å²	86	13%	0.133	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	177	-49.1	-81.3	0	0	0	110.8	K320 C321 K323 H336 N337 T338 E367	K320-Y369 VanDerWaalsContact CA-O 3.31Å; K320-Y369 WeakPolarHBondContact CA-O 3.49Å; C321-Y369 PolarHBondContact N-O 3.08Å; K323-Y369 HydrophobicContact CB-CD1 4.38Å; K323-Y369 HydrophobicContact CB-CD2 3.92Å; K323-Y369 HydrophobicContact CB-CE1 4.14Å; K323-Y369 HydrophobicContact CB-CE2 3.64Å; K323-Y369 HydrophobicContact CB-CG 4.27Å; K323-Y369 HydrophobicContact CD-CE1 3.82Å; K323-Y369 HydrophobicContact CD-CE2 4.4Å; K323-Y369 WeakPolarHBondContact CD-OH 3.44Å; K323-Y369 HydrophobicContact CG-CE1 4.36Å; H336-Y369 AromaticContact CE1-CD1 3.68Å; H336-Y369 AromaticContact ND1-CD1 3.58Å; N337-Y369 CarbonylContact O-C 3.59Å; N337-Y369 VanDerWaalsContact O-CA 3.3Å; N337-Y369 WeakPolarHBondContact O-CA 3.45Å; T338-Y369 HydrophobicContact CG2-CD1 3.91Å; T338-Y369 HydrophobicContact CG2-CE1 3.55Å; T338-Y369 WeakPolarHBondContact OG1-CD1 3.25Å; T338-Y369 WeakPolarHBondContact OG1-CE1 3.34Å; E367-Y369 HydrophobicContact CB-CE1 4.42Å; E367-Y369 HydrophobicContact CB-CE2 4.19Å; E367-Y369 PolarHBondContact OE2-OH 2.93Å
370	T	95.2	Very high	93.7	Very high	32 Å²	32	88.1 Å²	88.1	20%	0.196	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.6	179.7	51.5	0	0	0	0	111.2	R319 K320 H336 N337 V368	R319-T370 CarbonylContact O-C 3.55Å; R319-T370 WeakPolarHBondContact O-CA 3.43Å; K320-T370 HydrophobicContact CG-CG2 4.22Å; H336-T370 CarbonylContact C-O 3.56Å; H336-T370 WeakPolarHBondContact CA-O 3.38Å; H336-T370 WeakPolarHBondContact CB-O 3.41Å; N337-T370 PolarHBondContact N-O 3.32Å; N337-T370 PolarHBondContact O-N 2.88Å; V368-T370 HydrophobicContact CG1-CG2 4.36Å
371	C	95.3	Very high	93.5	Very high	2 Å²	2	85.2 Å²	85.2	1%	0.014	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	138.4	-178	-66.5	0	0	0	0	112.5	T316 A318 R319 C331	T316-C371 WeakPolarHBondContact O-CB 3.48Å; A318-C371 WeakPolarHBondContact CA-O 3.46Å; A318-C371 PolarHBondContact N-O 2.69Å; R319-C371 PolarHBondContact O-N 3.35Å; C331-C371 WeakPolarHBondContact CA-SG 3.5Å; C331-C371 HydrophobicContact CB-CB 3.69Å; C331-C371 WeakPolarHBondContact CB-SG 3.46Å; C331-C371 PolarHBondContact N-SG 3.3Å; C331-C371 WeakPolarHBondContact SG-CA 3.33Å; C331-C371 WeakPolarHBondContact SG-CB 3.28Å; C331-C371 CovalentContact SG-SG 2.04Å; C331-C371 PolarHBondContact SG-SG 3.32Å
372	K	94.3	Very high	93.3	Very high	91 Å²	91	78.5 Å²	78.5	40%	0.396	42%	0.42	S	S	.	.			trans	-69.4	153.5	173.9	-64.7	-176.2	-175.3	177.2	0	111.4	R334 G335 H336 N337	R334-K372 HydrophobicContact CB-CB 4.32Å; R334-K372 PolarHBondContact NE-O 2.94Å; R334-K372 PolarHBondContact NH2-O 2.87Å; R334-K372 WeakPolarHBondContact O-CD 3.41Å; G335-K372 PolarHBondContact O-N 3.4Å; H336-K372 VanDerWaalsContact O-CE 3.27Å; H336-K372 WeakPolarHBondContact O-CE 3.19Å; N337-K372 WeakPolarHBondContact OD1-CE 3.05Å
373	G	85.3	Confident	93.1	Very high	99 Å²	99	81.5 Å²	81.5	100%	1.021	43%	0.43	S	S	*	.			trans	-67.6	0	179.1	0	0	0	0	0	113.3	R334	R334-G373 PolarHBondContact NE-OXT 2.85Å

Retrieved 373 of 373 residues in 64 ms (Link to these results)

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