A0A096NQ79_PAPAN Loading...

rRNA adenine N(6)-methyltransferase

Mitochondrial methyltransferase which uses S-adenosyl methionine to dimethylate two highly conserved adjacent adenosine residues (A1583 and A1584) within the loop of helix 45 at the 3-prime end of 12S rRNA, thereby regulating the assembly or stability of the small subunit of the mitochondrial ribosome. Also required for basal transcription of mitochondrial DNA, probably via its interaction with POLRMT and TFAM. Stimulates transcription independently of the methyltransferase activity.

AlphaFold DB , UniProt , Accession A0A096NQ79, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 345 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	43	Very low	46.4	Very low	250 Å²	250	146.8 Å²	146.8	100%	1.232	86%	0.86	S	S	*	*				0	108.6	0	-64.9	-170.7	-156.8	0	0	107.7
2	A	41.6	Very low	46.3	Very low	104 Å²	104	146.5 Å²	146.5	86%	0.86	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-80.6	130.2	179.4	0	0	0	0	0	109.5
3	A	44.5	Very low	46.9	Very low	92 Å²	92	143.7 Å²	143.7	76%	0.76	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-64.1	138	175.9	0	0	0	0	0	110.3	G5	A3-G5 PolarHBondContact O-N 3.21Å
4	P	48.2	Very low	48.5	Very low	127 Å²	127	142.1 Å²	142.1	83%	0.825	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.4	177.7	29	-31.1	0	0	0	109	K6	P4-K6 PolarHBondContact O-N 3.4Å
5	G	46.8	Very low	49.9	Very low	73 Å²	73	138.7 Å²	138.7	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.6	128.3	175.6	0	0	0	0	0	110.9	A3 L7	A3-G5 PolarHBondContact O-N 3.21Å; G5-L7 PolarHBondContact O-N 3Å; G5-L7 VanDerWaalsContact O-N 3.09Å
6	K	50.7	Low	51.3	Low	207 Å²	207	132.1 Å²	132.1	90%	0.9	78%	0.775	S	S	*	*			trans	-57.9	113.3	170.4	-82.2	177	174.7	175.9	0	108.6	P4 S8	P4-K6 PolarHBondContact O-N 3.4Å; K6-S8 PolarHBondContact O-N 3.09Å
7	L	49	Very low	53	Low	170 Å²	170	128.7 Å²	128.7	89%	0.89	76%	0.756	S	S	*	*			trans	-55.9	108.8	164.9	-83.8	151.6	0	0	0	107.9	G5 T9	G5-L7 PolarHBondContact O-N 3Å; G5-L7 VanDerWaalsContact O-N 3.09Å; L7-T9 PolarHBondContact O-N 3.08Å; L7-T9 VanDerWaalsContact O-N 3.08Å
8	S	48.8	Very low	54.2	Low	110 Å²	110	122.1 Å²	122.1	77%	0.769	72%	0.717	S	S	*	*			trans	-60.4	111.2	170.8	52.9	0	0	0	0	107.9	K6 C10	K6-S8 PolarHBondContact O-N 3.09Å; S8-C10 PolarHBondContact O-N 2.96Å
9	T	49.6	Very low	55.4	Low	130 Å²	130	125.6 Å²	125.6	80%	0.798	72%	0.717	S	S	*	*			trans	-57.7	109	172	51	0	0	0	0	107.9	L7 R11	L7-T9 PolarHBondContact O-N 3.08Å; L7-T9 VanDerWaalsContact O-N 3.08Å; T9-R11 PolarHBondContact O-N 2.88Å
10	C	44	Very low	56.5	Low	116 Å²	116	124.5 Å²	124.5	78%	0.784	71%	0.705	S	S	*	*			trans	-63.6	98.7	175	-168.6	0	0	0	0	107.5	S8 L12	S8-C10 PolarHBondContact O-N 2.96Å; C10-L12 PolarHBondContact O-N 3.18Å
11	R	43.9	Very low	57.3	Low	236 Å²	236	118.8 Å²	118.8	89%	0.891	67%	0.673	S	S	*	*			trans	-84.3	98.7	-179.1	-157.3	179	-168.8	-170.7	3.6	107	T9	T9-R11 PolarHBondContact O-N 2.88Å
12	L	45.5	Very low	58.8	Low	143 Å²	143	108.4 Å²	108.4	75%	0.749	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-56.8	143.2	173.3	-66.9	174.6	0	0	0	109.5	C10	C10-L12 PolarHBondContact O-N 3.18Å
13	P	54.4	Low	60.5	Low	110 Å²	110	111.9 Å²	111.9	71%	0.714	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-60.2	146.8	175.4	25.9	-33.1	0	0	0	109.9
14	P	69.1	Low	61.7	Low	121 Å²	121	113 Å²	113	79%	0.786	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-59.7	149.2	174.7	27.9	-34.6	0	0	0	109.8
15	L	69.3	Low	62.6	Low	91 Å²	91	110 Å²	110	48%	0.476	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-55.7	141.7	173.8	-71	171.4	0	0	0	110.2	T17 L97 A100	L15-T17 PolarHBondContact O-N 2.95Å; L15-L97 HydrophobicContact CD1-CD2 4.45Å; L15-A100 HydrophobicContact CD1-CB 3.58Å; L15-A100 HydrophobicContact CD2-CB 3.98Å; L15-A100 HydrophobicContact CG-CB 4.3Å
16	P	72.3	Confident	63.5	Low	34 Å²	34	117.1 Å²	117.1	22%	0.221	59%	0.589	C	S	.	*	P	Polyproline II helix	trans	-56.7	137	176.6	-21.2	31.2	0	0	0	110.7	E20 I21 M96	P16-E20 HydrophobicContact CB-CB 4.12Å; P16-I21 HydrophobicContact CB-CG1 3.92Å; P16-M96 HydrophobicContact CG-CE 3.77Å
17	T	80.2	Confident	64.3	Low	74 Å²	74	107.6 Å²	107.6	45%	0.454	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-62.1	159.1	172.4	64.4	0	0	0	0	110.3	L15 R19 E20 I21	L15-T17 PolarHBondContact O-N 2.95Å; T17-R19 PolarHBondContact O-N 3.04Å; T17-E20 WeakPolarHBondContact CB-OE2 3.35Å; T17-E20 WeakPolarHBondContact CG2-OE2 3.28Å; T17-E20 PolarHBondContact N-OE2 3.24Å; T17-E20 PolarHBondContact O-N 3.07Å; T17-E20 VanDerWaalsContact OG1-CD 3.23Å; T17-E20 VanDerWaalsContact OG1-CG 3.28Å; T17-E20 WeakPolarHBondContact OG1-CG 3.44Å; T17-E20 PolarHBondContact OG1-N 3.11Å; T17-E20 PolarHBondContact OG1-OE2 3.4Å; T17-I21 PolarHBondContact O-N 2.77Å
18	I	74.8	Confident	64.9	Low	9 Å²	9	107 Å²	107	5%	0.046	54%	0.54	C	S	.	.	H	α-helix	trans	-57.7	-35.9	178.7	-46.9	177.6	0	0	0	111.1	I21 I22 L39 L41 P66	I18-I21 PolarHBondContact O-N 2.92Å; I18-I22 HydrophobicContact CG2-CD1 4.28Å; I18-I22 WeakPolarHBondContact O-CB 3.33Å; I18-I22 VanDerWaalsContact O-CG1 3.26Å; I18-I22 WeakPolarHBondContact O-CG1 3.4Å; I18-I22 PolarHBondContact O-N 3.1Å; I18-L39 HydrophobicContact CB-CD2 4.1Å; I18-L39 HydrophobicContact CG2-CD2 3.39Å; I18-L41 HydrophobicContact CD1-CD2 4.15Å; I18-P66 HydrophobicContact CG2-CB 3.53Å; I18-P66 HydrophobicContact CG2-CG 3.75Å
19	R	76.6	Confident	65.4	Low	189 Å²	189	103.4 Å²	103.4	71%	0.713	52%	0.517	S	S	*	.	H	α-helix	trans	-66	-40.2	175.6	-74.5	-174.4	-177.3	-175	1.7	112.6	T17 I22 K23 L39	T17-R19 PolarHBondContact O-N 3.04Å; R19-I22 PolarHBondContact O-N 3.17Å; R19-K23 PolarHBondContact O-N 3.43Å; R19-L39 HydrophobicContact CG-CD1 3.98Å
20	E	77.9	Confident	65.9	Low	103 Å²	103	99.1 Å²	99.1	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-68	-41.3	177.3	-73.3	160.8	154	0	0	111.3	P16 T17 I22 K23 L24	P16-E20 HydrophobicContact CB-CB 4.12Å; T17-E20 WeakPolarHBondContact CB-OE2 3.35Å; T17-E20 WeakPolarHBondContact CG2-OE2 3.28Å; T17-E20 PolarHBondContact N-OE2 3.24Å; T17-E20 PolarHBondContact O-N 3.07Å; T17-E20 VanDerWaalsContact OG1-CD 3.23Å; T17-E20 VanDerWaalsContact OG1-CG 3.28Å; T17-E20 WeakPolarHBondContact OG1-CG 3.44Å; T17-E20 PolarHBondContact OG1-N 3.11Å; T17-E20 PolarHBondContact OG1-OE2 3.4Å; E20-I22 VanDerWaalsContact C-N 3.33Å; E20-I22 PolarHBondContact O-N 3.15Å; E20-K23 PolarHBondContact O-N 3.07Å; E20-L24 WeakPolarHBondContact O-CB 3.22Å; E20-L24 PolarHBondContact O-N 3.22Å
21	I	73.1	Confident	66.5	Low	5 Å²	5	103.2 Å²	103.2	3%	0.026	50%	0.495	C	S	.	.	H	α-helix	trans	-58.1	-47.7	172.9	-67.1	-175.7	0	0	0	110.3	P16 T17 I18 K23 L24 F25 L27	P16-I21 HydrophobicContact CB-CG1 3.92Å; T17-I21 PolarHBondContact O-N 2.77Å; I18-I21 PolarHBondContact O-N 2.92Å; I21-K23 VanDerWaalsContact C-N 3.27Å; I21-K23 PolarHBondContact O-N 3.35Å; I21-L24 PolarHBondContact O-N 2.88Å; I21-F25 HydrophobicContact CB-CD2 4.49Å; I21-F25 HydrophobicContact CG2-CD2 3.66Å; I21-F25 HydrophobicContact CG2-CE2 3.95Å; I21-F25 WeakPolarHBondContact O-CD2 3.3Å; I21-F25 PolarHBondContact O-N 2.95Å; I21-L27 HydrophobicContact CG2-CD1 4.2Å
22	I	74.4	Confident	67.3	Low	33 Å²	33	100.7 Å²	100.7	17%	0.169	49%	0.494	C	S	.	.	H	α-helix	trans	-57.3	-42.7	177.8	-74.3	169.6	0	0	0	111.3	I18 R19 E20 R26 L27 F37 L39 P66	I18-I22 HydrophobicContact CG2-CD1 4.28Å; I18-I22 WeakPolarHBondContact O-CB 3.33Å; I18-I22 VanDerWaalsContact O-CG1 3.26Å; I18-I22 WeakPolarHBondContact O-CG1 3.4Å; I18-I22 PolarHBondContact O-N 3.1Å; R19-I22 PolarHBondContact O-N 3.17Å; E20-I22 VanDerWaalsContact C-N 3.33Å; E20-I22 PolarHBondContact O-N 3.15Å; I22-R26 PolarHBondContact O-N 3.36Å; I22-L27 HydrophobicContact CG1-CB 4.5Å; I22-L27 HydrophobicContact CG2-CB 4.34Å; I22-L27 WeakPolarHBondContact CG2-O 3.32Å; I22-L27 PolarHBondContact O-N 2.56Å; I22-F37 HydrophobicContact CD1-CD2 4.26Å; I22-L39 HydrophobicContact CD1-CD1 4.05Å; I22-L39 HydrophobicContact CD1-CD2 3.56Å; I22-L39 HydrophobicContact CD1-CG 4.48Å; I22-P66 HydrophobicContact CD1-CB 4.31Å; I22-P66 HydrophobicContact CD1-CG 4.41Å; I22-P66 HydrophobicContact CG1-CB 4.21Å
23	K	77.1	Confident	68.1	Low	176 Å²	176	96.8 Å²	96.8	77%	0.765	47%	0.473	S	S	*	.	H	α-helix	trans	-70.4	-45	178.3	-171.7	178.8	177.8	-176	0	112.4	R19 E20 I21 R26	R19-K23 PolarHBondContact O-N 3.43Å; E20-K23 PolarHBondContact O-N 3.07Å; I21-K23 VanDerWaalsContact C-N 3.27Å; I21-K23 PolarHBondContact O-N 3.35Å; K23-R26 PolarHBondContact O-N 2.97Å; K23-R26 VanDerWaalsContact O-N 3.15Å
24	L	69.5	Low	68.7	Low	116 Å²	116	94.3 Å²	94.3	61%	0.607	46%	0.458	S	S	*	.	H	α-helix	trans	-64.6	-44.3	-174.4	-172.1	148.9	0	0	0	111.3	E20 I21 R26	E20-L24 WeakPolarHBondContact O-CB 3.22Å; E20-L24 PolarHBondContact O-N 3.22Å; I21-L24 PolarHBondContact O-N 2.88Å; L24-R26 VanDerWaalsContact C-N 3.27Å; L24-R26 PolarHBondContact O-N 3.34Å
25	F	67.5	Low	69.2	Low	64 Å²	64	89.4 Å²	89.4	28%	0.281	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	9.2	177	-64.3	-71.4	0	0	0	113.3	I21 L27 P92 M96	I21-F25 HydrophobicContact CB-CD2 4.49Å; I21-F25 HydrophobicContact CG2-CD2 3.66Å; I21-F25 HydrophobicContact CG2-CE2 3.95Å; I21-F25 WeakPolarHBondContact O-CD2 3.3Å; I21-F25 PolarHBondContact O-N 2.95Å; F25-L27 HydrophobicContact CB-CD1 3.63Å; F25-L27 HydrophobicContact CB-CD2 4.36Å; F25-L27 HydrophobicContact CB-CG 3.62Å; F25-L27 HydrophobicContact CD2-CD1 4.34Å; F25-L27 HydrophobicContact CG-CD1 4.39Å; F25-L27 PolarHBondContact O-N 3.1Å; F25-L27 VanDerWaalsContact O-N 3.1Å; F25-P92 HydrophobicContact CD1-CB 4.4Å; F25-P92 HydrophobicContact CE1-CB 3.58Å; F25-P92 HydrophobicContact CE1-CG 4.19Å; F25-P92 HydrophobicContact CZ-CB 3.66Å; F25-M96 HydrophobicContact CZ-SD 4.42Å
26	R	66.4	Low	70	Confident	223 Å²	223	86.4 Å²	86.4	84%	0.842	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	40.3	-176.5	-59.3	-176	179.5	-176.8	0.1	112.4	I22 K23 L24 Q28	I22-R26 PolarHBondContact O-N 3.36Å; K23-R26 PolarHBondContact O-N 2.97Å; K23-R26 VanDerWaalsContact O-N 3.15Å; L24-R26 VanDerWaalsContact C-N 3.27Å; L24-R26 PolarHBondContact O-N 3.34Å; R26-Q28 VanDerWaalsContact C-N 3.33Å; R26-Q28 PolarHBondContact O-N 3.35Å
27	L	66.6	Low	70.7	Confident	6 Å²	6	85.4 Å²	85.4	3%	0.031	40%	0.402	C	S	.	.			trans	-74	84.8	-176	-69	160.6	0	0	0	109.5	I21 I22 F25 R89 F90	I21-L27 HydrophobicContact CG2-CD1 4.2Å; I22-L27 HydrophobicContact CG1-CB 4.5Å; I22-L27 HydrophobicContact CG2-CB 4.34Å; I22-L27 WeakPolarHBondContact CG2-O 3.32Å; I22-L27 PolarHBondContact O-N 2.56Å; F25-L27 HydrophobicContact CB-CD1 3.63Å; F25-L27 HydrophobicContact CB-CD2 4.36Å; F25-L27 HydrophobicContact CB-CG 3.62Å; F25-L27 HydrophobicContact CD2-CD1 4.34Å; F25-L27 HydrophobicContact CG-CD1 4.39Å; F25-L27 PolarHBondContact O-N 3.1Å; F25-L27 VanDerWaalsContact O-N 3.1Å; L27-R89 HydrophobicContact CD2-CB 3.25Å; L27-R89 HydrophobicContact CD2-CG 4.38Å; L27-F90 HydrophobicContact CB-CE1 4.18Å; L27-F90 HydrophobicContact CD1-CD1 3.63Å; L27-F90 HydrophobicContact CD1-CE1 3.58Å; L27-F90 HydrophobicContact CD2-CD1 3.94Å; L27-F90 HydrophobicContact CD2-CE1 3.72Å; L27-F90 HydrophobicContact CD2-CG 4.47Å; L27-F90 HydrophobicContact CD2-CZ 4.02Å; L27-F90 HydrophobicContact CG-CD1 4.36Å; L27-F90 HydrophobicContact CG-CE1 4.03Å
28	Q	61.9	Low	71.1	Confident	159 Å²	159	82.2 Å²	82.2	74%	0.743	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-78.2	131.2	163.6	-68	-170.8	-13.3	0	0	108.8	R26 T30 R89	R26-Q28 VanDerWaalsContact C-N 3.33Å; R26-Q28 PolarHBondContact O-N 3.35Å; Q28-T30 PolarHBondContact O-N 3.01Å; Q28-R89 PolarHBondContact O-NH1 3.42Å
29	A	59	Low	71.7	Confident	34 Å²	34	83.2 Å²	83.2	28%	0.281	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-55.5	117.7	168.3	0	0	0	0	0	107.7	F37 P219	A29-F37 HydrophobicContact CB-CE2 3.76Å; A29-F37 HydrophobicContact CB-CZ 4.17Å; A29-P219 HydrophobicContact CB-CG 3.87Å
30	T	60	Low	72.4	Confident	40 Å²	40	76.4 Å²	76.4	25%	0.245	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-81	126.5	179.6	45	0	0	0	0	107.7	Q28 Q32 L33 S34 R89	Q28-T30 PolarHBondContact O-N 3.01Å; T30-Q32 PolarHBondContact O-N 3.29Å; T30-Q32 VanDerWaalsContact O-N 3.09Å; T30-L33 PolarHBondContact O-N 3.18Å; T30-L33 WeakPolarHBondContact OG1-CB 3.41Å; T30-L33 WeakPolarHBondContact OG1-CD1 3.45Å; T30-L33 WeakPolarHBondContact OG1-CG 3.2Å; T30-S34 PolarHBondContact O-N 2.8Å; T30-R89 PolarHBondContact OG1-NH2 2.92Å
31	K	57.8	Low	73	Confident	201 Å²	201	75 Å²	75	87%	0.874	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-52.2	-33.9	173.7	-71.9	-173.7	178.5	-178.9	0	111.3	L33 S34	K31-L33 VanDerWaalsContact C-N 3.32Å; K31-L33 PolarHBondContact O-N 2.68Å; K31-S34 PolarHBondContact O-N 3.02Å; K31-S34 PolarHBondContact O-OG 3.49Å
32	Q	59	Low	74	Confident	184 Å²	184	83.5 Å²	83.5	86%	0.86	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-60.2	-34.4	176.8	-69.1	179.3	-9	0	0	113.9	T30	T30-Q32 PolarHBondContact O-N 3.29Å; T30-Q32 VanDerWaalsContact O-N 3.09Å
33	L	62.9	Low	75	Confident	60 Å²	60	83.5 Å²	83.5	31%	0.314	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-97.2	-4	-179.4	-61.4	179	0	0	0	113.3	T30 K31 Q35 D87 P143	T30-L33 PolarHBondContact O-N 3.18Å; T30-L33 WeakPolarHBondContact OG1-CB 3.41Å; T30-L33 WeakPolarHBondContact OG1-CD1 3.45Å; T30-L33 WeakPolarHBondContact OG1-CG 3.2Å; K31-L33 VanDerWaalsContact C-N 3.32Å; K31-L33 PolarHBondContact O-N 2.68Å; L33-Q35 HydrophobicContact CB-CG 3.86Å; L33-Q35 PolarHBondContact O-N 3.32Å; L33-Q35 VanDerWaalsContact O-N 3.08Å; L33-D87 HydrophobicContact CD1-CB 4.1Å; L33-D87 WeakPolarHBondContact CD1-OD2 3.44Å; L33-P143 WeakPolarHBondContact O-CB 3.34Å; L33-P143 WeakPolarHBondContact O-CG 3.3Å
34	S	68.4	Low	75.9	Confident	58 Å²	58	75.1 Å²	75.1	41%	0.406	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	37	176.8	-62.9	0	0	0	0	113.7	T30 K31	T30-S34 PolarHBondContact O-N 2.8Å; K31-S34 PolarHBondContact O-N 3.02Å; K31-S34 PolarHBondContact O-OG 3.49Å
35	Q	78	Confident	77.2	Confident	18 Å²	18	72 Å²	72	8%	0.084	34%	0.34	C	S	.	.			trans	-79.2	132.7	-175.8	-71.6	166.8	-24.9	0	0	111.1	L33 F37 D87 P143 P219	L33-Q35 HydrophobicContact CB-CG 3.86Å; L33-Q35 PolarHBondContact O-N 3.32Å; L33-Q35 VanDerWaalsContact O-N 3.08Å; Q35-F37 HydrophobicContact CB-CD1 4.41Å; Q35-F37 HydrophobicContact CB-CE1 3.59Å; Q35-F37 HydrophobicContact CB-CZ 3.68Å; Q35-F37 HydrophobicContact CG-CE1 4.15Å; Q35-F37 HydrophobicContact CG-CZ 4.39Å; Q35-D87 PolarHBondContact NE2-OD2 2.94Å; Q35-P143 HydrophobicContact CG-CG 4.23Å; Q35-P219 WeakPolarHBondContact O-CD 3.23Å
36	N	85.6	Confident	78.6	Confident	29 Å²	29	72.6 Å²	72.6	16%	0.155	34%	0.342	C	S	.	.			trans	-122.6	109.5	170.7	-61.2	-63.8	0	0	0	108.3	N141 F217 P219	N36-N141 PolarHBondContact O-ND2 3.09Å; N36-N141 VanDerWaalsContact O-ND2 3.11Å; N36-F217 HydrophobicContact CB-CB 4.08Å; N36-F217 HydrophobicContact CB-CD1 4.01Å; N36-F217 HydrophobicContact CB-CG 4.28Å; N36-P219 PolarHBondContact OD1-O 3.19Å
37	F	88.1	Confident	80.1	Confident	13 Å²	13	62.1 Å²	62.1	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	132.8	-174.8	-50.2	-53.8	0	0	0	111.5	I22 A29 Q35 L39 P66 F90 F217 V218	I22-F37 HydrophobicContact CD1-CD2 4.26Å; A29-F37 HydrophobicContact CB-CE2 3.76Å; A29-F37 HydrophobicContact CB-CZ 4.17Å; Q35-F37 HydrophobicContact CB-CD1 4.41Å; Q35-F37 HydrophobicContact CB-CE1 3.59Å; Q35-F37 HydrophobicContact CB-CZ 3.68Å; Q35-F37 HydrophobicContact CG-CE1 4.15Å; Q35-F37 HydrophobicContact CG-CZ 4.39Å; F37-L39 HydrophobicContact CB-CD2 3.77Å; F37-L39 HydrophobicContact CB-CG 4.39Å; F37-P66 HydrophobicContact CB-CG 4.05Å; F37-P66 VanDerWaalsContact CD1-CD 3.4Å; F37-P66 HydrophobicContact CD1-CG 3.88Å; F37-P66 HydrophobicContact CG-CG 4Å; F37-F90 HydrophobicContact CE1-CE1 4.2Å; F37-F90 HydrophobicContact CE1-CE2 4.12Å; F37-F90 AromaticContact CE1-CZ 3.51Å; F37-F90 HydrophobicContact CE1-CZ 3.51Å; F37-F90 HydrophobicContact CE2-CZ 4.32Å; F37-F90 HydrophobicContact CZ-CE1 4.19Å; F37-F90 HydrophobicContact CZ-CE2 4.24Å; F37-F90 AromaticContact CZ-CZ 3.41Å; F37-F90 HydrophobicContact CZ-CZ 3.41Å; F37-F90 VanDerWaalsContact CZ-CZ 3.41Å; F37-F217 CarbonylContact O-C 3.58Å; F37-F217 VanDerWaalsContact O-CA 3.27Å; F37-F217 WeakPolarHBondContact O-CA 3.24Å; F37-V218 WeakPolarHBondContact CB-O 3.23Å; F37-V218 WeakPolarHBondContact CD2-O 3.27Å; F37-V218 WeakPolarHBondContact CG-O 3.2Å; F37-V218 PolarHBondContact N-O 3.31Å; F37-V218 PolarHBondContact O-N 3.03Å
38	L	89.5	Confident	81.5	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.037	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	104	172.7	-168.5	60.8	0	0	0	108.9	L43 T44 I47 I212 A216 F217	L38-L43 HydrophobicContact CD1-CB 4.2Å; L38-L43 HydrophobicContact CD1-CD1 3.85Å; L38-L43 HydrophobicContact CD2-CB 4.06Å; L38-L43 HydrophobicContact CG-CB 4.33Å; L38-T44 HydrophobicContact CB-CG2 4.31Å; L38-T44 HydrophobicContact CD2-CG2 3.81Å; L38-T44 HydrophobicContact CG-CG2 3.93Å; L38-I47 HydrophobicContact CD2-CD1 3.67Å; L38-I212 HydrophobicContact CD1-CG2 4.42Å; L38-I212 HydrophobicContact CD2-CD1 4.05Å; L38-A216 HydrophobicContact CD1-CB 4.24Å; L38-F217 HydrophobicContact CB-CD1 4.07Å; L38-F217 HydrophobicContact CB-CE1 3.91Å; L38-F217 HydrophobicContact CD1-CD1 4.13Å; L38-F217 HydrophobicContact CD1-CE1 3.92Å; L38-F217 HydrophobicContact CD1-CE2 4.43Å; L38-F217 HydrophobicContact CD1-CG 4.47Å; L38-F217 HydrophobicContact CD1-CZ 4.08Å; L38-F217 HydrophobicContact CD2-CE1 4.41Å; L38-F217 HydrophobicContact CG-CE1 4.31Å
39	L	86.5	Confident	83.2	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.152	30%	0.298	C	S	.	.			trans	-97.4	-12.1	-173.8	-50.3	-176.8	0	0	0	113.5	I18 R19 I22 F37 L41 P66 V218	I18-L39 HydrophobicContact CB-CD2 4.1Å; I18-L39 HydrophobicContact CG2-CD2 3.39Å; R19-L39 HydrophobicContact CG-CD1 3.98Å; I22-L39 HydrophobicContact CD1-CD1 4.05Å; I22-L39 HydrophobicContact CD1-CD2 3.56Å; I22-L39 HydrophobicContact CD1-CG 4.48Å; F37-L39 HydrophobicContact CB-CD2 3.77Å; F37-L39 HydrophobicContact CB-CG 4.39Å; L39-L41 PolarHBondContact O-N 3.42Å; L39-P66 HydrophobicContact CD2-CG 4.25Å; L39-V218 HydrophobicContact CD1-CB 4.07Å; L39-V218 HydrophobicContact CD1-CG2 3.87Å; L39-V218 HydrophobicContact CG-CG2 4.42Å
40	D	90.6	Very high	84.9	Confident	47 Å²	47	66.5 Å²	66.5	25%	0.251	31%	0.309	S	S	.	.			trans	-84.2	107.2	179.8	-172.4	-20.2	0	0	0	110.2	R42 L43 T44	D40-R42 PolarHBondContact O-N 2.75Å; D40-R42 VanDerWaalsContact OD1-CB 3.28Å; D40-R42 WeakPolarHBondContact OD1-CB 3.42Å; D40-R42 IonicContact OD1-CZ 3.88Å; D40-R42 PolarHBondContact OD1-N 3.38Å; D40-R42 IonicContact OD1-NE 3.04Å; D40-R42 PolarHBondContact OD1-NE 3.04Å; D40-R42 IonicContact OD1-NH2 3.8Å; D40-R42 IonicContact OD2-CZ 3.51Å; D40-R42 IonicContact OD2-NE 3.4Å; D40-R42 PolarHBondContact OD2-NE 2.92Å; D40-R42 IonicContact OD2-NH2 2.77Å; D40-R42 PolarHBondContact OD2-NH2 3.02Å; D40-L43 HydrophobicContact CB-CB 4.41Å; D40-L43 HydrophobicContact CB-CD1 4.1Å; D40-L43 HydrophobicContact CB-CG 4.27Å; D40-L43 WeakPolarHBondContact O-CB 3.41Å; D40-L43 PolarHBondContact O-N 3.26Å; D40-T44 PolarHBondContact O-N 3.17Å
41	L	90.1	Very high	86.6	Confident	74 Å²	74	64.6 Å²	64.6	39%	0.387	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-29.1	-179.3	-71	177.4	0	0	0	113	I18 L39 L43 T44 D45 R71	I18-L41 HydrophobicContact CD1-CD2 4.15Å; L39-L41 PolarHBondContact O-N 3.42Å; L41-L43 PolarHBondContact O-N 3Å; L41-T44 VanDerWaalsContact CA-OG1 3.26Å; L41-T44 WeakPolarHBondContact CA-OG1 3.26Å; L41-T44 PolarHBondContact O-N 2.81Å; L41-T44 PolarHBondContact O-OG1 3.11Å; L41-D45 VanDerWaalsContact O-CB 3.23Å; L41-D45 WeakPolarHBondContact O-CB 3.48Å; L41-D45 PolarHBondContact O-N 3.42Å; L41-R71 HydrophobicContact CD2-CB 4.24Å
42	R	94.6	Very high	88.2	Confident	182 Å²	182	56.7 Å²	56.7	69%	0.687	27%	0.273	S	S	*	.	H	α-helix	trans	-65.8	-32	178.2	-57	171	-63.7	176.5	2	111.5	D40 K46	D40-R42 PolarHBondContact O-N 2.75Å; D40-R42 VanDerWaalsContact OD1-CB 3.28Å; D40-R42 WeakPolarHBondContact OD1-CB 3.42Å; D40-R42 IonicContact OD1-CZ 3.88Å; D40-R42 PolarHBondContact OD1-N 3.38Å; D40-R42 IonicContact OD1-NE 3.04Å; D40-R42 PolarHBondContact OD1-NE 3.04Å; D40-R42 IonicContact OD1-NH2 3.8Å; D40-R42 IonicContact OD2-CZ 3.51Å; D40-R42 IonicContact OD2-NE 3.4Å; D40-R42 PolarHBondContact OD2-NE 2.92Å; D40-R42 IonicContact OD2-NH2 2.77Å; D40-R42 PolarHBondContact OD2-NH2 3.02Å; R42-K46 WeakPolarHBondContact O-CB 3.5Å; R42-K46 PolarHBondContact O-N 3.24Å; R42-K46 VanDerWaalsContact O-N 3.15Å
43	L	95.6	Very high	89.8	Confident	34 Å²	34	53.9 Å²	53.9	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-78.7	-41.8	176.7	-69.5	175.4	0	0	0	111.4	L38 D40 L41 K46 I47 I212 A216	L38-L43 HydrophobicContact CD1-CB 4.2Å; L38-L43 HydrophobicContact CD1-CD1 3.85Å; L38-L43 HydrophobicContact CD2-CB 4.06Å; L38-L43 HydrophobicContact CG-CB 4.33Å; D40-L43 HydrophobicContact CB-CB 4.41Å; D40-L43 HydrophobicContact CB-CD1 4.1Å; D40-L43 HydrophobicContact CB-CG 4.27Å; D40-L43 WeakPolarHBondContact O-CB 3.41Å; D40-L43 PolarHBondContact O-N 3.26Å; L41-L43 PolarHBondContact O-N 3Å; L43-K46 WeakPolarHBondContact O-CB 3.29Å; L43-K46 PolarHBondContact O-N 2.74Å; L43-K46 VanDerWaalsContact O-N 3.17Å; L43-I47 WeakPolarHBondContact O-CG1 3.44Å; L43-I47 PolarHBondContact O-N 2.97Å; L43-I212 HydrophobicContact CD1-CG2 3.92Å; L43-A216 HydrophobicContact CD1-CB 3.55Å
44	T	96.1	Very high	91.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.5	-40	175.6	56.9	0	0	0	0	111.2	L38 D40 L41 K46 I47 V48 G68 I69 S72	L38-T44 HydrophobicContact CB-CG2 4.31Å; L38-T44 HydrophobicContact CD2-CG2 3.81Å; L38-T44 HydrophobicContact CG-CG2 3.93Å; D40-T44 PolarHBondContact O-N 3.17Å; L41-T44 VanDerWaalsContact CA-OG1 3.26Å; L41-T44 WeakPolarHBondContact CA-OG1 3.26Å; L41-T44 PolarHBondContact O-N 2.81Å; L41-T44 PolarHBondContact O-OG1 3.11Å; T44-K46 VanDerWaalsContact C-N 3.27Å; T44-K46 PolarHBondContact O-N 3.37Å; T44-I47 WeakPolarHBondContact O-CB 3.27Å; T44-I47 PolarHBondContact O-N 2.97Å; T44-I47 VanDerWaalsContact O-N 3.1Å; T44-V48 PolarHBondContact O-N 2.96Å; T44-G68 PolarHBondContact OG1-O 2.85Å; T44-I69 HydrophobicContact CG2-CG1 3.74Å; T44-S72 VanDerWaalsContact CB-OG 3.27Å; T44-S72 WeakPolarHBondContact CB-OG 3.33Å; T44-S72 PolarHBondContact OG1-OG 2.97Å
45	D	96.4	Very high	92.7	Very high	50 Å²	50	50 Å²	50	27%	0.267	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-37.1	172.1	-66.9	-15.5	0	0	0	111.3	L41 V48 R49 S72	L41-D45 VanDerWaalsContact O-CB 3.23Å; L41-D45 WeakPolarHBondContact O-CB 3.48Å; L41-D45 PolarHBondContact O-N 3.42Å; D45-V48 PolarHBondContact O-N 2.79Å; D45-R49 WeakPolarHBondContact O-CB 3.32Å; D45-R49 WeakPolarHBondContact O-CG 3.28Å; D45-R49 PolarHBondContact O-N 3.26Å; D45-S72 PolarHBondContact N-OG 3.48Å; D45-S72 WeakPolarHBondContact OD1-CB 3.26Å; D45-S72 PolarHBondContact OD1-OG 2.96Å
46	K	97.6	Very high	93.5	Very high	77 Å²	77	54 Å²	54	34%	0.335	27%	0.266	S	S	.	.	H	α-helix	trans	-66.7	-37.8	174.9	-172.8	179.7	175.5	179.8	0	111.9	R42 L43 T44 K50 F210	R42-K46 WeakPolarHBondContact O-CB 3.5Å; R42-K46 PolarHBondContact O-N 3.24Å; R42-K46 VanDerWaalsContact O-N 3.15Å; L43-K46 WeakPolarHBondContact O-CB 3.29Å; L43-K46 PolarHBondContact O-N 2.74Å; L43-K46 VanDerWaalsContact O-N 3.17Å; T44-K46 VanDerWaalsContact C-N 3.27Å; T44-K46 PolarHBondContact O-N 3.37Å; K46-K50 WeakPolarHBondContact O-CB 3.41Å; K46-K50 WeakPolarHBondContact O-CG 3.49Å; K46-K50 PolarHBondContact O-N 3.26Å; K46-F210 HydrophobicContact CB-CZ 4.16Å; K46-F210 HydrophobicContact CD-CD2 4.18Å; K46-F210 HydrophobicContact CD-CE1 4.19Å; K46-F210 HydrophobicContact CD-CE2 3.75Å; K46-F210 HydrophobicContact CD-CZ 3.77Å; K46-F210 HydrophobicContact CG-CE1 3.92Å; K46-F210 HydrophobicContact CG-CE2 4.21Å; K46-F210 HydrophobicContact CG-CZ 3.69Å
47	I	97.3	Very high	94.1	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-51.4	173.5	-66.6	169.3	0	0	0	109.3	L38 L43 T44 K50 A51 I69 I139 T173 T175 F210 I212 V227	L38-I47 HydrophobicContact CD2-CD1 3.67Å; L43-I47 WeakPolarHBondContact O-CG1 3.44Å; L43-I47 PolarHBondContact O-N 2.97Å; T44-I47 WeakPolarHBondContact O-CB 3.27Å; T44-I47 PolarHBondContact O-N 2.97Å; T44-I47 VanDerWaalsContact O-N 3.1Å; I47-K50 CarbonylContact O-C 3.6Å; I47-K50 PolarHBondContact O-N 3.08Å; I47-K50 VanDerWaalsContact O-N 3.07Å; I47-A51 PolarHBondContact O-N 3.44Å; I47-I69 HydrophobicContact CD1-CD1 3.98Å; I47-I69 HydrophobicContact CD1-CG1 4.47Å; I47-I139 HydrophobicContact CG2-CG2 4.24Å; I47-T173 HydrophobicContact CG2-CG2 4.1Å; I47-T175 HydrophobicContact CD1-CG2 4.37Å; I47-F210 HydrophobicContact CG1-CZ 3.9Å; I47-I212 HydrophobicContact CD1-CD1 4.07Å; I47-I212 HydrophobicContact CG1-CD1 4.44Å; I47-V227 HydrophobicContact CG1-CG2 4.17Å
48	V	97.3	Very high	94.6	Very high	10 Å²	10	54.8 Å²	54.8	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-49.4	-179.1	167.7	0	0	0	0	111.9	T44 D45 K50 A51 L54 I73 A76	T44-V48 PolarHBondContact O-N 2.96Å; D45-V48 PolarHBondContact O-N 2.79Å; V48-K50 PolarHBondContact O-N 3.34Å; V48-K50 VanDerWaalsContact O-N 3.11Å; V48-A51 WeakPolarHBondContact O-CB 3.2Å; V48-A51 PolarHBondContact O-N 2.86Å; V48-L54 HydrophobicContact CG1-CD1 3.68Å; V48-I73 HydrophobicContact CG2-CG1 3.69Å; V48-A76 HydrophobicContact CG1-CB 3.86Å
49	R	96.1	Very high	95	Very high	164 Å²	164	54.4 Å²	54.4	62%	0.619	27%	0.265	S	S	*	.	H	α-helix	trans	-58.4	-27.6	175.7	-75.3	-169.6	-56.2	-97.7	-2.6	113.7	D45	D45-R49 WeakPolarHBondContact O-CB 3.32Å; D45-R49 WeakPolarHBondContact O-CG 3.28Å; D45-R49 PolarHBondContact O-N 3.26Å
50	K	96.1	Very high	95.6	Very high	117 Å²	117	53.3 Å²	53.3	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-91.7	-10.6	178.6	-68.2	-64.4	-173.6	-174.8	0	113.2	K46 I47 V48 G52 I209 F210	K46-K50 WeakPolarHBondContact O-CB 3.41Å; K46-K50 WeakPolarHBondContact O-CG 3.49Å; K46-K50 PolarHBondContact O-N 3.26Å; I47-K50 CarbonylContact O-C 3.6Å; I47-K50 PolarHBondContact O-N 3.08Å; I47-K50 VanDerWaalsContact O-N 3.07Å; V48-K50 PolarHBondContact O-N 3.34Å; V48-K50 VanDerWaalsContact O-N 3.11Å; K50-G52 VanDerWaalsContact C-N 3.31Å; K50-I209 HydrophobicContact CB-CG2 3.57Å; K50-I209 HydrophobicContact CD-CG2 3.7Å; K50-I209 HydrophobicContact CG-CG2 3.54Å; K50-F210 HydrophobicContact CG-CE1 4.24Å
51	A	94.2	Very high	96	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-75.5	-21.4	175.5	0	0	0	0	0	113	I47 V48 I139 T173 H229	I47-A51 PolarHBondContact O-N 3.44Å; V48-A51 WeakPolarHBondContact O-CB 3.2Å; V48-A51 PolarHBondContact O-N 2.86Å; A51-I139 HydrophobicContact CB-CD1 3.72Å; A51-I139 HydrophobicContact CB-CG1 4.23Å; A51-T173 VanDerWaalsContact CA-OG1 3.27Å; A51-T173 WeakPolarHBondContact CA-OG1 3.43Å; A51-T173 HydrophobicContact CB-CG2 4.07Å; A51-T173 WeakPolarHBondContact CB-OG1 3.42Å; A51-H229 PolarHBondContact O-CE1 3.48Å
52	G	91.5	Very high	96.3	Very high	35 Å²	35	47.7 Å²	47.7	36%	0.361	23%	0.228	S	C	.	.			trans	134.5	-169.9	179.9	0	0	0	0	0	111.6	K50	K50-G52 VanDerWaalsContact C-N 3.31Å
53	N	93.8	Very high	96.3	Very high	124 Å²	124	39.9 Å²	39.9	66%	0.663	21%	0.205	S	C	*	.			trans	-77.9	118.6	165.7	-178.6	14.6	0	0	0	108.4	A55	N53-A55 VanDerWaalsContact OD1-CB 3.3Å; N53-A55 WeakPolarHBondContact OD1-CB 3.36Å; N53-A55 PolarHBondContact OD1-N 2.96Å
54	L	96.3	Very high	96.3	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.026	20%	0.199	C	C	.	.			trans	-102.1	5	179	-57.7	-171	0	0	0	113.3	V48 N56 A57 V59 I73 A76 V78 H137 I139	V48-L54 HydrophobicContact CG1-CD1 3.68Å; L54-N56 PolarHBondContact O-N 2.89Å; L54-A57 HydrophobicContact CB-CB 4.25Å; L54-A57 HydrophobicContact CD2-CB 4.36Å; L54-A57 WeakPolarHBondContact O-CB 3.32Å; L54-A57 PolarHBondContact O-N 3.49Å; L54-V59 HydrophobicContact CD1-CG2 4.21Å; L54-V59 HydrophobicContact CD2-CG2 4.31Å; L54-I73 HydrophobicContact CD1-CG2 4.42Å; L54-A76 CarbonylContact C-O 3.55Å; L54-A76 HydrophobicContact CB-CB 4.08Å; L54-A76 HydrophobicContact CD1-CB 4.44Å; L54-V78 HydrophobicContact CB-CG1 3.99Å; L54-V78 WeakPolarHBondContact O-CA 3.26Å; L54-H137 HydrophobicContact CD2-CB 3.95Å; L54-I139 HydrophobicContact CD1-CD1 3.74Å
55	A	95.3	Very high	96.1	Very high	33 Å²	33	38.9 Å²	38.9	27%	0.273	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	125	176.3	0	0	0	0	0	110.2	N53 A57 D77	N53-A55 VanDerWaalsContact OD1-CB 3.3Å; N53-A55 WeakPolarHBondContact OD1-CB 3.36Å; N53-A55 PolarHBondContact OD1-N 2.96Å; A55-A57 PolarHBondContact O-N 3.28Å; A55-A57 VanDerWaalsContact O-N 3.11Å; A55-D77 CarbonylContact C-O 3.54Å; A55-D77 WeakPolarHBondContact CA-O 3.42Å
56	N	95.5	Very high	95.8	Very high	101 Å²	101	37 Å²	37	54%	0.54	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	18.5	-173.5	-58.7	-61.4	0	0	0	114.8	L54 D77 A79 N135	L54-N56 PolarHBondContact O-N 2.89Å; N56-D77 PolarHBondContact N-O 3.31Å; N56-A79 VanDerWaalsContact O-CB 3.26Å; N56-A79 WeakPolarHBondContact O-CB 3.27Å; N56-N135 VanDerWaalsContact C-ND2 3.31Å; N56-N135 PolarHBondContact O-ND2 3.14Å
57	A	97.6	Very high	95.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.			trans	-81	155.4	178.8	0	0	0	0	0	112.6	L54 A55 V59 A79 E80 N135	L54-A57 HydrophobicContact CB-CB 4.25Å; L54-A57 HydrophobicContact CD2-CB 4.36Å; L54-A57 WeakPolarHBondContact O-CB 3.32Å; L54-A57 PolarHBondContact O-N 3.49Å; A55-A57 PolarHBondContact O-N 3.28Å; A55-A57 VanDerWaalsContact O-N 3.11Å; A57-V59 HydrophobicContact CB-CG2 4.34Å; A57-A79 PolarHBondContact O-N 3.28Å; A57-E80 PolarHBondContact O-N 3.01Å; A57-N135 WeakPolarHBondContact CA-ND2 3.41Å; A57-N135 WeakPolarHBondContact CA-OD1 3.39Å; A57-N135 VanDerWaalsContact CB-OD1 3.22Å; A57-N135 WeakPolarHBondContact CB-OD1 3.07Å; A57-N135 PolarHBondContact N-ND2 3.43Å
58	Y	98.4	Very high	95.3	Very high	58 Å²	58	33.4 Å²	33.4	23%	0.227	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.6	169.7	-69.3	-99.5	0	0	0	108.6	A79 E80 F121 L125 N135 V136 H137	Y58-A79 HydrophobicContact CD2-CB 4.16Å; Y58-A79 HydrophobicContact CE1-CB 4.41Å; Y58-A79 HydrophobicContact CE2-CB 3.78Å; Y58-E80 CarbonylContact C-O 3.6Å; Y58-E80 WeakPolarHBondContact CA-O 3.47Å; Y58-E80 HydrophobicContact CD1-CB 3.66Å; Y58-E80 HydrophobicContact CE1-CB 3.87Å; Y58-F121 HydrophobicContact CD1-CB 4.23Å; Y58-F121 AromaticContact CD1-CD1 3.55Å; Y58-F121 HydrophobicContact CD1-CD1 3.55Å; Y58-F121 HydrophobicContact CD1-CE1 4.09Å; Y58-F121 HydrophobicContact CD1-CG 4.06Å; Y58-F121 HydrophobicContact CE1-CD1 4.49Å; Y58-F121 HydrophobicContact CG-CD1 4.22Å; Y58-F121 HydrophobicContact CG-CG 4.41Å; Y58-L125 HydrophobicContact CD1-CD1 3.73Å; Y58-L125 HydrophobicContact CD2-CD1 3.37Å; Y58-L125 HydrophobicContact CD2-CD2 3.56Å; Y58-L125 HydrophobicContact CD2-CG 4.09Å; Y58-L125 HydrophobicContact CE1-CD1 3.91Å; Y58-L125 HydrophobicContact CE2-CD1 3.58Å; Y58-L125 HydrophobicContact CE2-CD2 3.36Å; Y58-L125 HydrophobicContact CE2-CG 4.05Å; Y58-L125 HydrophobicContact CG-CD1 3.44Å; Y58-L125 VanDerWaalsContact CG-CD1 3.44Å; Y58-L125 HydrophobicContact CG-CD2 4.49Å; Y58-N135 PolarHBondContact N-O 3.47Å; Y58-V136 CarbonylContact O-C 3.58Å; Y58-V136 WeakPolarHBondContact O-CA 3.44Å; Y58-H137 PolarHBondContact O-N 2.76Å
59	V	98.6	Very high	95.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.8	-172.5	-175.4	0	0	0	0	110	L54 A57 I73 V78 E80 L81 L82 H137 I139	L54-V59 HydrophobicContact CD1-CG2 4.21Å; L54-V59 HydrophobicContact CD2-CG2 4.31Å; A57-V59 HydrophobicContact CB-CG2 4.34Å; V59-I73 HydrophobicContact CB-CG2 3.98Å; V59-I73 HydrophobicContact CG1-CD1 3.87Å; V59-I73 HydrophobicContact CG1-CG1 4.47Å; V59-I73 HydrophobicContact CG1-CG2 3.96Å; V59-I73 HydrophobicContact CG2-CG2 3.95Å; V59-V78 HydrophobicContact CG2-CB 4.5Å; V59-V78 HydrophobicContact CG2-CG1 3.65Å; V59-E80 PolarHBondContact N-O 3.5Å; V59-L81 HydrophobicContact CB-CD1 3.91Å; V59-L81 HydrophobicContact CG1-CD1 3.89Å; V59-L81 CarbonylContact O-C 3.3Å; V59-L81 WeakPolarHBondContact O-CA 3.47Å; V59-L81 WeakPolarHBondContact O-CD1 3.34Å; V59-L82 PolarHBondContact O-N 3.17Å; V59-H137 CarbonylContact C-O 3.52Å; V59-H137 WeakPolarHBondContact CA-O 3.38Å; V59-H137 HydrophobicContact CG2-CB 4.45Å; V59-I139 HydrophobicContact CG1-CB 4.49Å; V59-I139 HydrophobicContact CG1-CD1 3.95Å; V59-I139 HydrophobicContact CG1-CG1 4.1Å
60	Y	98.6	Very high	95.3	Very high	5 Å²	5	25.4 Å²	25.4	2%	0.02	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	104.5	168.4	174.2	-149	0	0	0	109.4	V62 L82 V84 V117 H137 I138 I139 W154	Y60-V62 HydrophobicContact CD1-CG1 4.27Å; Y60-V62 HydrophobicContact CD2-CG1 4.35Å; Y60-V62 HydrophobicContact CE1-CG1 3.65Å; Y60-V62 HydrophobicContact CE2-CG1 3.7Å; Y60-V62 WeakPolarHBondContact OH-CG1 3.3Å; Y60-L82 CarbonylContact C-O 3.53Å; Y60-L82 WeakPolarHBondContact CA-O 3.5Å; Y60-L82 HydrophobicContact CD2-CD2 4.18Å; Y60-L82 HydrophobicContact CD2-CG 4.25Å; Y60-V84 HydrophobicContact CE2-CB 3.95Å; Y60-V84 HydrophobicContact CE2-CG2 3.53Å; Y60-V117 HydrophobicContact CD1-CB 4.26Å; Y60-V117 HydrophobicContact CD1-CG1 4.36Å; Y60-V117 HydrophobicContact CD1-CG2 3.82Å; Y60-V117 HydrophobicContact CE1-CB 4.16Å; Y60-V117 HydrophobicContact CE1-CG1 4.35Å; Y60-V117 HydrophobicContact CE1-CG2 4.16Å; Y60-V117 HydrophobicContact CG-CG2 4.03Å; Y60-H137 PolarHBondContact N-O 3.05Å; Y60-I138 HydrophobicContact CD1-CD1 4.42Å; Y60-I138 HydrophobicContact CD1-CG1 4.11Å; Y60-I138 HydrophobicContact CD1-CG2 4.25Å; Y60-I138 VanDerWaalsContact O-CA 3.3Å; Y60-I138 WeakPolarHBondContact O-CA 3.2Å; Y60-I139 PolarHBondContact O-N 2.91Å; Y60-W154 HydrophobicContact CE1-CZ2 4.22Å
61	E	98.5	Very high	95.3	Very high	3 Å²	3	21.3 Å²	21.3	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.4	173.3	-173.8	-178.1	-171.2	0	0	111.2	P64 I69 T70 I73 L81 L82 V83 V84 I139	E61-P64 HydrophobicContact CG-CB 4.32Å; E61-I69 VanDerWaalsContact OE1-CB 3.26Å; E61-I69 WeakPolarHBondContact OE1-CB 3.29Å; E61-I69 WeakPolarHBondContact OE1-CG2 3.27Å; E61-T70 VanDerWaalsContact CD-OG1 3.25Å; E61-T70 PolarHBondContact OE1-N 3.2Å; E61-T70 VanDerWaalsContact OE1-N 3.12Å; E61-T70 PolarHBondContact OE1-OG1 2.87Å; E61-T70 WeakPolarHBondContact OE2-CA 3.44Å; E61-T70 VanDerWaalsContact OE2-CB 3.27Å; E61-T70 WeakPolarHBondContact OE2-CB 3.26Å; E61-T70 PolarHBondContact OE2-N 3.48Å; E61-T70 PolarHBondContact OE2-OG1 3.24Å; E61-I73 HydrophobicContact CB-CD1 4.21Å; E61-I73 HydrophobicContact CG-CD1 4.32Å; E61-L81 HydrophobicContact CB-CD1 3.86Å; E61-L82 PolarHBondContact N-O 3.32Å; E61-V83 HydrophobicContact CB-CG1 4.01Å; E61-V83 WeakPolarHBondContact O-CA 3.46Å; E61-V84 PolarHBondContact O-N 2.83Å; E61-V84 VanDerWaalsContact O-N 3.1Å; E61-I139 WeakPolarHBondContact CA-O 3.46Å
62	V	97.1	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.8	177.6	-70.8	0	0	0	0	110.9	Y60 V112 I139 L142 L150 W154 L174	Y60-V62 HydrophobicContact CD1-CG1 4.27Å; Y60-V62 HydrophobicContact CD2-CG1 4.35Å; Y60-V62 HydrophobicContact CE1-CG1 3.65Å; Y60-V62 HydrophobicContact CE2-CG1 3.7Å; Y60-V62 WeakPolarHBondContact OH-CG1 3.3Å; V62-V112 HydrophobicContact CB-CB 4.35Å; V62-V112 HydrophobicContact CB-CG1 3.81Å; V62-V112 HydrophobicContact CG1-CB 4.17Å; V62-V112 HydrophobicContact CG1-CG1 3.87Å; V62-I139 PolarHBondContact N-O 3.45Å; V62-L142 HydrophobicContact CB-CD1 4.19Å; V62-L142 HydrophobicContact CB-CD2 4.07Å; V62-L142 HydrophobicContact CB-CG 4.36Å; V62-L142 HydrophobicContact CG2-CD1 3.6Å; V62-L142 HydrophobicContact CG2-CD2 4.09Å; V62-L142 HydrophobicContact CG2-CG 3.83Å; V62-L142 WeakPolarHBondContact O-CD2 3.37Å; V62-L150 HydrophobicContact CG2-CD2 4.48Å; V62-W154 HydrophobicContact CG1-CH2 3.8Å; V62-W154 HydrophobicContact CG1-CZ2 4.04Å; V62-W154 HydrophobicContact CG2-CH2 4.05Å; V62-L174 HydrophobicContact CG2-CD2 4.29Å
63	G	94.8	Very high	95.7	Very high	18 Å²	18	19.7 Å²	19.7	19%	0.186	11%	0.111	C	C	.	.			trans	61.7	64.5	178.6	0	0	0	0	0	113.1	G65 V84	G63-G65 PolarHBondContact O-N 3.04Å; G63-V84 WeakPolarHBondContact CA-O 3.37Å; G63-V84 PolarHBondContact N-O 3.16Å
64	P	95	Very high	95.9	Very high	8 Å²	8	15.3 Å²	15.3	5%	0.052	9%	0.087	C	C	.	.			trans	-62.2	-23	-178.1	30.8	-41.2	0	0	0	113.6	E61 G67 T70 V83 V84 E85 L94	E61-P64 HydrophobicContact CG-CB 4.32Å; P64-G67 PolarHBondContact O-N 3.28Å; P64-T70 VanDerWaalsContact CB-OG1 3.28Å; P64-T70 WeakPolarHBondContact CB-OG1 3.48Å; P64-V83 HydrophobicContact CB-CB 4.23Å; P64-V83 HydrophobicContact CB-CG1 4.38Å; P64-V83 HydrophobicContact CG-CB 3.86Å; P64-V83 HydrophobicContact CG-CG2 4.08Å; P64-V84 WeakPolarHBondContact CD-O 3.43Å; P64-E85 VanDerWaalsContact CD-OE2 3.31Å; P64-E85 WeakPolarHBondContact CD-OE2 3.33Å; P64-E85 HydrophobicContact CG-CB 3.82Å; P64-E85 HydrophobicContact CG-CG 4.37Å; P64-L94 HydrophobicContact CB-CD1 4.46Å; P64-L94 HydrophobicContact CB-CD2 4.01Å; P64-L94 HydrophobicContact CG-CD1 3.62Å; P64-L94 HydrophobicContact CG-CD2 4.07Å
65	G	92	Very high	95.8	Very high	6 Å²	6	21.5 Å²	21.5	6%	0.062	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-125.5	-174	0	0	0	0	0	110.6	G63 G67 E85 F90	G63-G65 PolarHBondContact O-N 3.04Å; G65-G67 PolarHBondContact O-N 3.23Å; G65-E85 WeakPolarHBondContact CA-OE2 3.46Å; G65-E85 PolarHBondContact N-OE2 3.37Å; G65-F90 VanDerWaalsContact C-CD1 3.47Å; G65-F90 VanDerWaalsContact C-CG 3.49Å; G65-F90 VanDerWaalsContact O-CB 3.32Å; G65-F90 WeakPolarHBondContact O-CB 3.11Å; G65-F90 WeakPolarHBondContact O-CG 3.41Å
66	P	89.9	Confident	95.8	Very high	10 Å²	10	21.3 Å²	21.3	7%	0.065	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	5.6	-178.6	36.7	-39.7	0	0	0	113.8	I18 I22 F37 L39 R71 F90	I18-P66 HydrophobicContact CG2-CB 3.53Å; I18-P66 HydrophobicContact CG2-CG 3.75Å; I22-P66 HydrophobicContact CD1-CB 4.31Å; I22-P66 HydrophobicContact CD1-CG 4.41Å; I22-P66 HydrophobicContact CG1-CB 4.21Å; F37-P66 HydrophobicContact CB-CG 4.05Å; F37-P66 VanDerWaalsContact CD1-CD 3.4Å; F37-P66 HydrophobicContact CD1-CG 3.88Å; F37-P66 HydrophobicContact CG-CG 4Å; L39-P66 HydrophobicContact CD2-CG 4.25Å; P66-R71 PolarHBondContact O-NH1 3.26Å; P66-F90 HydrophobicContact CB-CD1 4.08Å; P66-F90 HydrophobicContact CB-CE1 3.97Å
67	G	92.9	Very high	95.7	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	31.1	171.4	0	0	0	0	0	114.5	P64 G65 T70 R71	P64-G67 PolarHBondContact O-N 3.28Å; G65-G67 PolarHBondContact O-N 3.23Å; G67-T70 WeakPolarHBondContact CA-OG1 3.43Å; G67-R71 VanDerWaalsContact C-NH1 3.28Å; G67-R71 VanDerWaalsContact O-CG 3.3Å; G67-R71 WeakPolarHBondContact O-CG 3.37Å; G67-R71 PolarHBondContact O-N 3.14Å; G67-R71 VanDerWaalsContact O-N 3.14Å; G67-R71 PolarHBondContact O-NH1 3.05Å
68	G	92.8	Very high	95.6	Very high	3 Å²	3	21.1 Å²	21.1	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-66.5	-52.1	177.9	0	0	0	0	0	112.2	T44 S72	T44-G68 PolarHBondContact OG1-O 2.85Å; G68-S72 PolarHBondContact O-N 3.04Å
69	I	96.4	Very high	95.6	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.036	12%	0.117	C	C	.	.	H	α-helix	trans	-69.1	-40.6	175.4	-69.2	176.7	0	0	0	110.4	T44 I47 E61 R71 S72 I73 I139 N141	T44-I69 HydrophobicContact CG2-CG1 3.74Å; I47-I69 HydrophobicContact CD1-CD1 3.98Å; I47-I69 HydrophobicContact CD1-CG1 4.47Å; E61-I69 VanDerWaalsContact OE1-CB 3.26Å; E61-I69 WeakPolarHBondContact OE1-CB 3.29Å; E61-I69 WeakPolarHBondContact OE1-CG2 3.27Å; I69-R71 VanDerWaalsContact C-N 3.3Å; I69-R71 PolarHBondContact O-N 3.3Å; I69-S72 WeakPolarHBondContact O-CA 3.12Å; I69-S72 WeakPolarHBondContact O-CB 3.49Å; I69-S72 PolarHBondContact O-N 3.4Å; I69-I73 HydrophobicContact CG2-CD1 3.54Å; I69-I73 HydrophobicContact CG2-CG1 4Å; I69-I73 WeakPolarHBondContact O-CG1 3.16Å; I69-I73 PolarHBondContact O-N 2.87Å; I69-I139 HydrophobicContact CG2-CG2 3.78Å; I69-N141 HydrophobicContact CD1-CB 3.53Å
70	T	97.1	Very high	95.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-46.9	-49	172.9	-44.7	0	0	0	0	112.9	E61 P64 G67 S72 I73 L74 L81 V83 L97 L105	E61-T70 VanDerWaalsContact CD-OG1 3.25Å; E61-T70 PolarHBondContact OE1-N 3.2Å; E61-T70 VanDerWaalsContact OE1-N 3.12Å; E61-T70 PolarHBondContact OE1-OG1 2.87Å; E61-T70 WeakPolarHBondContact OE2-CA 3.44Å; E61-T70 VanDerWaalsContact OE2-CB 3.27Å; E61-T70 WeakPolarHBondContact OE2-CB 3.26Å; E61-T70 PolarHBondContact OE2-N 3.48Å; E61-T70 PolarHBondContact OE2-OG1 3.24Å; P64-T70 VanDerWaalsContact CB-OG1 3.28Å; P64-T70 WeakPolarHBondContact CB-OG1 3.48Å; G67-T70 WeakPolarHBondContact CA-OG1 3.43Å; T70-S72 PolarHBondContact O-N 2.74Å; T70-I73 PolarHBondContact O-N 2.83Å; T70-L74 HydrophobicContact CG2-CD1 4.25Å; T70-L74 WeakPolarHBondContact O-CG 3.33Å; T70-L74 PolarHBondContact O-N 2.86Å; T70-L81 HydrophobicContact CG2-CD2 3.64Å; T70-V83 HydrophobicContact CG2-CG1 4.13Å; T70-L97 HydrophobicContact CG2-CD1 4.12Å; T70-L105 HydrophobicContact CG2-CD1 4.14Å; T70-L105 HydrophobicContact CG2-CD2 4.14Å
71	R	95.6	Very high	95.6	Very high	30 Å²	30	21.3 Å²	21.3	11%	0.113	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-46.4	177.1	-76	169.6	178.7	79.7	1.3	112.3	L41 P66 G67 I69 I73 L74 N75 L97	L41-R71 HydrophobicContact CD2-CB 4.24Å; P66-R71 PolarHBondContact O-NH1 3.26Å; G67-R71 VanDerWaalsContact C-NH1 3.28Å; G67-R71 VanDerWaalsContact O-CG 3.3Å; G67-R71 WeakPolarHBondContact O-CG 3.37Å; G67-R71 PolarHBondContact O-N 3.14Å; G67-R71 VanDerWaalsContact O-N 3.14Å; G67-R71 PolarHBondContact O-NH1 3.05Å; I69-R71 VanDerWaalsContact C-N 3.3Å; I69-R71 PolarHBondContact O-N 3.3Å; R71-I73 VanDerWaalsContact C-N 3.29Å; R71-I73 PolarHBondContact O-N 3.12Å; R71-L74 PolarHBondContact O-N 2.83Å; R71-N75 VanDerWaalsContact O-CG 3.29Å; R71-N75 PolarHBondContact O-N 2.88Å; R71-N75 VanDerWaalsContact O-N 3.1Å; R71-N75 PolarHBondContact O-ND2 3.01Å; R71-L97 HydrophobicContact CG-CD1 4.2Å; R71-L97 HydrophobicContact CG-CD2 3.79Å
72	S	96.6	Very high	95.6	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-35.1	178.4	-66.4	0	0	0	0	112.6	T44 D45 G68 I69 T70	T44-S72 VanDerWaalsContact CB-OG 3.27Å; T44-S72 WeakPolarHBondContact CB-OG 3.33Å; T44-S72 PolarHBondContact OG1-OG 2.97Å; D45-S72 PolarHBondContact N-OG 3.48Å; D45-S72 WeakPolarHBondContact OD1-CB 3.26Å; D45-S72 PolarHBondContact OD1-OG 2.96Å; G68-S72 PolarHBondContact O-N 3.04Å; I69-S72 WeakPolarHBondContact O-CA 3.12Å; I69-S72 WeakPolarHBondContact O-CB 3.49Å; I69-S72 PolarHBondContact O-N 3.4Å; T70-S72 PolarHBondContact O-N 2.74Å
73	I	97.6	Very high	95.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.6	-46.1	175.8	-64.3	164.8	0	0	0	110.7	V48 L54 V59 E61 I69 T70 R71 N75 A76 V78 L81 I139	V48-I73 HydrophobicContact CG2-CG1 3.69Å; L54-I73 HydrophobicContact CD1-CG2 4.42Å; V59-I73 HydrophobicContact CB-CG2 3.98Å; V59-I73 HydrophobicContact CG1-CD1 3.87Å; V59-I73 HydrophobicContact CG1-CG1 4.47Å; V59-I73 HydrophobicContact CG1-CG2 3.96Å; V59-I73 HydrophobicContact CG2-CG2 3.95Å; E61-I73 HydrophobicContact CB-CD1 4.21Å; E61-I73 HydrophobicContact CG-CD1 4.32Å; I69-I73 HydrophobicContact CG2-CD1 3.54Å; I69-I73 HydrophobicContact CG2-CG1 4Å; I69-I73 WeakPolarHBondContact O-CG1 3.16Å; I69-I73 PolarHBondContact O-N 2.87Å; T70-I73 PolarHBondContact O-N 2.83Å; R71-I73 VanDerWaalsContact C-N 3.29Å; R71-I73 PolarHBondContact O-N 3.12Å; I73-N75 PolarHBondContact O-N 3.07Å; I73-A76 VanDerWaalsContact O-CB 3.32Å; I73-A76 WeakPolarHBondContact O-CB 3.44Å; I73-A76 PolarHBondContact O-N 3.41Å; I73-V78 HydrophobicContact CG2-CG1 3.58Å; I73-V78 HydrophobicContact CG2-CG2 4.28Å; I73-L81 HydrophobicContact CB-CD2 3.98Å; I73-L81 HydrophobicContact CD1-CD1 4.1Å; I73-L81 HydrophobicContact CD1-CD2 4.47Å; I73-L81 HydrophobicContact CG2-CB 4.49Å; I73-L81 HydrophobicContact CG2-CD1 4.07Å; I73-L81 HydrophobicContact CG2-CD2 3.86Å; I73-L81 HydrophobicContact CG2-CG 4.36Å; I73-I139 HydrophobicContact CD1-CB 4.32Å; I73-I139 HydrophobicContact CD1-CD1 4.2Å; I73-I139 HydrophobicContact CD1-CG2 4.45Å; I73-I139 HydrophobicContact CG1-CD1 4.23Å
74	L	96.5	Very high	95.8	Very high	32 Å²	32	20.4 Å²	20.4	17%	0.168	12%	0.116	C	C	.	.	H	α-helix	trans	-60.4	-32.5	178.6	-70.6	171.5	0	0	0	112.4	T70 R71 A76 V78 L81 A101 K104 L105	T70-L74 HydrophobicContact CG2-CD1 4.25Å; T70-L74 WeakPolarHBondContact O-CG 3.33Å; T70-L74 PolarHBondContact O-N 2.86Å; R71-L74 PolarHBondContact O-N 2.83Å; L74-A76 PolarHBondContact O-N 3.45Å; L74-V78 HydrophobicContact CD2-CG2 4.5Å; L74-L81 HydrophobicContact CD2-CB 4.29Å; L74-L81 HydrophobicContact CD2-CD2 4Å; L74-L81 HydrophobicContact CG-CD2 3.92Å; L74-A101 HydrophobicContact CD1-CB 4.13Å; L74-A101 HydrophobicContact CD2-CB 4.16Å; L74-K104 HydrophobicContact CD2-CB 3.89Å; L74-L105 HydrophobicContact CD1-CD2 4.44Å; L74-L105 HydrophobicContact CD2-CB 4.28Å
75	N	95.4	Very high	95.8	Very high	134 Å²	134	20.4 Å²	20.4	72%	0.717	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-5.6	174.9	-69.2	-20.5	0	0	0	114.1	R71 I73	R71-N75 VanDerWaalsContact O-CG 3.29Å; R71-N75 PolarHBondContact O-N 2.88Å; R71-N75 VanDerWaalsContact O-N 3.1Å; R71-N75 PolarHBondContact O-ND2 3.01Å; I73-N75 PolarHBondContact O-N 3.07Å
76	A	95.1	Very high	95.9	Very high	29 Å²	29	25.7 Å²	25.7	24%	0.24	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	18.6	-177	0	0	0	0	0	113.7	V48 L54 I73 L74 V78	V48-A76 HydrophobicContact CG1-CB 3.86Å; L54-A76 CarbonylContact C-O 3.55Å; L54-A76 HydrophobicContact CB-CB 4.08Å; L54-A76 HydrophobicContact CD1-CB 4.44Å; I73-A76 VanDerWaalsContact O-CB 3.32Å; I73-A76 WeakPolarHBondContact O-CB 3.44Å; I73-A76 PolarHBondContact O-N 3.41Å; L74-A76 PolarHBondContact O-N 3.45Å; A76-V78 PolarHBondContact O-N 3Å
77	D	92.6	Very high	95.9	Very high	96 Å²	96	25.9 Å²	25.9	51%	0.513	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	43.7	178.7	-165.1	31.4	0	0	0	114	A55 N56	A55-D77 CarbonylContact C-O 3.54Å; A55-D77 WeakPolarHBondContact CA-O 3.42Å; N56-D77 PolarHBondContact N-O 3.31Å
78	V	96.9	Very high	95.9	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.012	16%	0.161	C	C	.	.			trans	-66.4	150.1	176.7	-68.4	0	0	0	0	112.2	L54 V59 I73 L74 A76 L81 K104	L54-V78 HydrophobicContact CB-CG1 3.99Å; L54-V78 WeakPolarHBondContact O-CA 3.26Å; V59-V78 HydrophobicContact CG2-CB 4.5Å; V59-V78 HydrophobicContact CG2-CG1 3.65Å; I73-V78 HydrophobicContact CG2-CG1 3.58Å; I73-V78 HydrophobicContact CG2-CG2 4.28Å; L74-V78 HydrophobicContact CD2-CG2 4.5Å; A76-V78 PolarHBondContact O-N 3Å; V78-L81 HydrophobicContact CG2-CB 4.38Å; V78-K104 WeakPolarHBondContact O-CD 3.22Å; V78-K104 PolarHBondContact O-NZ 3.46Å
79	A	97.3	Very high	95.7	Very high	26 Å²	26	33.1 Å²	33.1	22%	0.215	17%	0.173	C	C	.	.	S	Bend	trans	-68.5	-49.8	168.8	0	0	0	0	0	110.2	N56 A57 Y58	N56-A79 VanDerWaalsContact O-CB 3.26Å; N56-A79 WeakPolarHBondContact O-CB 3.27Å; A57-A79 PolarHBondContact O-N 3.28Å; Y58-A79 HydrophobicContact CD2-CB 4.16Å; Y58-A79 HydrophobicContact CE1-CB 4.41Å; Y58-A79 HydrophobicContact CE2-CB 3.78Å
80	E	97.9	Very high	95.5	Very high	41 Å²	41	32.9 Å²	32.9	19%	0.192	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	143	179	-163.9	-167.6	136	0	0	110.6	A57 Y58 V59 R106	A57-E80 PolarHBondContact O-N 3.01Å; Y58-E80 CarbonylContact C-O 3.6Å; Y58-E80 WeakPolarHBondContact CA-O 3.47Å; Y58-E80 HydrophobicContact CD1-CB 3.66Å; Y58-E80 HydrophobicContact CE1-CB 3.87Å; V59-E80 PolarHBondContact N-O 3.5Å; E80-R106 IonicContact OE1-CZ 3.72Å; E80-R106 IonicContact OE1-NE 3.93Å; E80-R106 PolarHBondContact OE1-NE 3.41Å; E80-R106 IonicContact OE1-NH2 3.48Å; E80-R106 PolarHBondContact OE1-NH2 3.26Å
81	L	98.6	Very high	95.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	114.5	171.4	172.6	54.7	0	0	0	109.5	V59 E61 T70 I73 L74 V78 V83 K104 L105 R106	V59-L81 HydrophobicContact CB-CD1 3.91Å; V59-L81 HydrophobicContact CG1-CD1 3.89Å; V59-L81 CarbonylContact O-C 3.3Å; V59-L81 WeakPolarHBondContact O-CA 3.47Å; V59-L81 WeakPolarHBondContact O-CD1 3.34Å; E61-L81 HydrophobicContact CB-CD1 3.86Å; T70-L81 HydrophobicContact CG2-CD2 3.64Å; I73-L81 HydrophobicContact CB-CD2 3.98Å; I73-L81 HydrophobicContact CD1-CD1 4.1Å; I73-L81 HydrophobicContact CD1-CD2 4.47Å; I73-L81 HydrophobicContact CG2-CB 4.49Å; I73-L81 HydrophobicContact CG2-CD1 4.07Å; I73-L81 HydrophobicContact CG2-CD2 3.86Å; I73-L81 HydrophobicContact CG2-CG 4.36Å; L74-L81 HydrophobicContact CD2-CB 4.29Å; L74-L81 HydrophobicContact CD2-CD2 4Å; L74-L81 HydrophobicContact CG-CD2 3.92Å; V78-L81 HydrophobicContact CG2-CB 4.38Å; L81-V83 HydrophobicContact CD1-CG1 3.96Å; L81-V83 HydrophobicContact CD2-CG1 4.21Å; L81-V83 HydrophobicContact CG-CG1 3.84Å; L81-K104 PolarHBondContact N-O 2.85Å; L81-L105 HydrophobicContact CB-CD1 4.35Å; L81-L105 HydrophobicContact CD2-CD1 4.01Å; L81-L105 HydrophobicContact CG-CD1 3.84Å; L81-L105 CarbonylContact O-C 3.57Å; L81-L105 WeakPolarHBondContact O-CA 3.22Å; L81-R106 PolarHBondContact O-N 2.75Å
82	L	98.6	Very high	95.2	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.1	166.8	171.1	65.6	0	0	0	109.2	V59 Y60 E61 R106 V108 F115 V117 A120 F121	V59-L82 PolarHBondContact O-N 3.17Å; Y60-L82 CarbonylContact C-O 3.53Å; Y60-L82 WeakPolarHBondContact CA-O 3.5Å; Y60-L82 HydrophobicContact CD2-CD2 4.18Å; Y60-L82 HydrophobicContact CD2-CG 4.25Å; E61-L82 PolarHBondContact N-O 3.32Å; L82-R106 WeakPolarHBondContact CA-O 3.42Å; L82-R106 HydrophobicContact CD1-CB 4.29Å; L82-R106 HydrophobicContact CD1-CG 4.13Å; L82-V108 HydrophobicContact CD1-CB 4.48Å; L82-V108 HydrophobicContact CD1-CG2 3.71Å; L82-F115 HydrophobicContact CD2-CE1 3.98Å; L82-F115 HydrophobicContact CD2-CZ 4.23Å; L82-V117 HydrophobicContact CD2-CG2 4.12Å; L82-A120 HydrophobicContact CD2-CB 3.52Å; L82-F121 HydrophobicContact CB-CE1 3.87Å; L82-F121 HydrophobicContact CB-CZ 3.79Å; L82-F121 HydrophobicContact CD2-CZ 4.43Å
83	V	98.4	Very high	94.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.7	171.7	-48.2	0	0	0	0	110.6	E61 P64 T70 L81 L94 L105 R106 I107 V108	E61-V83 HydrophobicContact CB-CG1 4.01Å; E61-V83 WeakPolarHBondContact O-CA 3.46Å; P64-V83 HydrophobicContact CB-CB 4.23Å; P64-V83 HydrophobicContact CB-CG1 4.38Å; P64-V83 HydrophobicContact CG-CB 3.86Å; P64-V83 HydrophobicContact CG-CG2 4.08Å; T70-V83 HydrophobicContact CG2-CG1 4.13Å; L81-V83 HydrophobicContact CD1-CG1 3.96Å; L81-V83 HydrophobicContact CD2-CG1 4.21Å; L81-V83 HydrophobicContact CG-CG1 3.84Å; V83-L94 HydrophobicContact CG2-CD1 4.28Å; V83-L105 HydrophobicContact CB-CD1 4.44Å; V83-L105 HydrophobicContact CG1-CD1 3.53Å; V83-L105 HydrophobicContact CG2-CD1 4.04Å; V83-R106 PolarHBondContact N-O 3.4Å; V83-I107 HydrophobicContact CG2-CB 4.08Å; V83-I107 HydrophobicContact CG2-CG1 3.78Å; V83-I107 HydrophobicContact CG2-CG2 4.03Å; V83-V108 PolarHBondContact O-N 3.01Å
84	V	98	Very high	94.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.3	171	175.9	0	0	0	0	108.8	Y60 E61 G63 P64 V108 G110 V112 F115	Y60-V84 HydrophobicContact CE2-CB 3.95Å; Y60-V84 HydrophobicContact CE2-CG2 3.53Å; E61-V84 PolarHBondContact O-N 2.83Å; E61-V84 VanDerWaalsContact O-N 3.1Å; G63-V84 WeakPolarHBondContact CA-O 3.37Å; G63-V84 PolarHBondContact N-O 3.16Å; P64-V84 WeakPolarHBondContact CD-O 3.43Å; V84-V108 WeakPolarHBondContact CA-O 3.31Å; V84-V108 HydrophobicContact CG2-CB 4.04Å; V84-V108 HydrophobicContact CG2-CG1 4.35Å; V84-G110 WeakPolarHBondContact CG1-O 3.46Å; V84-V112 HydrophobicContact CB-CG1 3.98Å; V84-V112 HydrophobicContact CG1-CG1 3.77Å; V84-F115 HydrophobicContact CG1-CB 4.25Å; V84-F115 HydrophobicContact CG1-CG 4.3Å; V84-F115 HydrophobicContact CG2-CD1 3.58Å; V84-F115 HydrophobicContact CG2-CD2 4.26Å; V84-F115 HydrophobicContact CG2-CE1 3.69Å; V84-F115 HydrophobicContact CG2-CE2 4.38Å; V84-F115 HydrophobicContact CG2-CG 3.86Å; V84-F115 HydrophobicContact CG2-CZ 4.1Å
85	E	95.8	Very high	94.6	Very high	7 Å²	7	38.3 Å²	38.3	3%	0.033	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.8	-179.2	-179.9	49.8	-109	0	0	110.3	P64 G65 D87 F90 I91 L94 V108 H109 G110	P64-E85 VanDerWaalsContact CD-OE2 3.31Å; P64-E85 WeakPolarHBondContact CD-OE2 3.33Å; P64-E85 HydrophobicContact CG-CB 3.82Å; P64-E85 HydrophobicContact CG-CG 4.37Å; G65-E85 WeakPolarHBondContact CA-OE2 3.46Å; G65-E85 PolarHBondContact N-OE2 3.37Å; E85-D87 WeakPolarHBondContact OE1-CB 3.34Å; E85-D87 PolarHBondContact OE1-N 2.79Å; E85-F90 HydrophobicContact CG-CB 4.13Å; E85-F90 HydrophobicContact CG-CD2 4.49Å; E85-I91 HydrophobicContact CB-CD1 3.89Å; E85-I91 HydrophobicContact CG-CD1 4.14Å; E85-L94 HydrophobicContact CB-CD1 4.01Å; E85-L94 HydrophobicContact CG-CD1 4.23Å; E85-V108 PolarHBondContact N-O 3.31Å; E85-H109 CarbonylContact O-C 3.58Å; E85-H109 VanDerWaalsContact O-CA 3.29Å; E85-H109 WeakPolarHBondContact O-CA 3.34Å; E85-H109 PolarHBondContact O-CD2 3.15Å; E85-G110 CarbonylContact C-O 3.47Å; E85-G110 VanDerWaalsContact C-O 3.3Å; E85-G110 PolarHBondContact O-N 2.93Å
86	K	93.8	Very high	94.5	Very high	118 Å²	118	34.8 Å²	34.8	51%	0.513	18%	0.184	S	C	.	.	S	Bend	trans	-89.9	-29.3	-178.6	-174.8	174	-179.1	170.1	0	112.1	H109 G110 D111	K86-H109 PolarHBondContact O-NE2 2.97Å; K86-G110 VanDerWaalsContact CA-O 3.27Å; K86-G110 WeakPolarHBondContact CA-O 3.36Å; K86-G110 WeakPolarHBondContact CB-O 3.32Å; K86-G110 PolarHBondContact N-O 3.06Å; K86-D111 HydrophobicContact CD-CB 4.16Å; K86-D111 WeakPolarHBondContact CE-OD2 3.43Å; K86-D111 IonicContact NZ-OD2 3.6Å; K86-D111 PolarHBondContact NZ-OD2 3.21Å
87	D	90.8	Very high	94.4	Very high	13 Å²	13	33.8 Å²	33.8	7%	0.07	17%	0.174	C	C	.	.			trans	-92.8	106	-175.5	-174.3	-14.1	0	0	0	110.4	L33 Q35 E85 R89 F90	L33-D87 HydrophobicContact CD1-CB 4.1Å; L33-D87 WeakPolarHBondContact CD1-OD2 3.44Å; Q35-D87 PolarHBondContact NE2-OD2 2.94Å; E85-D87 WeakPolarHBondContact OE1-CB 3.34Å; E85-D87 PolarHBondContact OE1-N 2.79Å; D87-R89 PolarHBondContact O-N 3.5Å; D87-R89 WeakPolarHBondContact OD1-CB 3.35Å; D87-R89 VanDerWaalsContact OD1-CG 3.26Å; D87-R89 WeakPolarHBondContact OD1-CG 3.44Å; D87-R89 IonicContact OD1-CZ 2.95Å; D87-R89 PolarHBondContact OD1-N 3.38Å; D87-R89 IonicContact OD1-NE 2.63Å; D87-R89 PolarHBondContact OD1-NE 3.11Å; D87-R89 IonicContact OD1-NH2 3.54Å; D87-R89 IonicContact OD2-CZ 2.89Å; D87-R89 IonicContact OD2-NE 3.73Å; D87-R89 PolarHBondContact OD2-NE 3.17Å; D87-R89 IonicContact OD2-NH2 3.38Å; D87-R89 PolarHBondContact OD2-NH2 3.49Å; D87-F90 HydrophobicContact CB-CD2 3.83Å; D87-F90 HydrophobicContact CB-CE2 4.07Å; D87-F90 PolarHBondContact O-N 2.89Å; D87-F90 VanDerWaalsContact O-N 3.11Å; D87-F90 WeakPolarHBondContact OD2-CE2 3.35Å
88	T	91.7	Very high	94.5	Very high	80 Å²	80	30.4 Å²	30.4	49%	0.491	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-52.7	-26.3	-178.2	51.9	0	0	0	0	113.6	F90 I91 P92 H109	T88-F90 PolarHBondContact O-N 3.35Å; T88-I91 WeakPolarHBondContact O-CB 3.22Å; T88-I91 PolarHBondContact O-N 2.83Å; T88-P92 WeakPolarHBondContact O-CD 3.27Å; T88-H109 WeakPolarHBondContact CG2-CE1 3.5Å; T88-H109 WeakPolarHBondContact CG2-NE2 3.44Å
89	R	89.1	Confident	94.4	Very high	75 Å²	75	37.2 Å²	37.2	28%	0.283	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-66.8	-24.5	-176.7	-53.5	175.6	-69	162.7	0.7	112.7	L27 Q28 T30 D87	L27-R89 HydrophobicContact CD2-CB 3.25Å; L27-R89 HydrophobicContact CD2-CG 4.38Å; Q28-R89 PolarHBondContact O-NH1 3.42Å; T30-R89 PolarHBondContact OG1-NH2 2.92Å; D87-R89 PolarHBondContact O-N 3.5Å; D87-R89 WeakPolarHBondContact OD1-CB 3.35Å; D87-R89 VanDerWaalsContact OD1-CG 3.26Å; D87-R89 WeakPolarHBondContact OD1-CG 3.44Å; D87-R89 IonicContact OD1-CZ 2.95Å; D87-R89 PolarHBondContact OD1-N 3.38Å; D87-R89 IonicContact OD1-NE 2.63Å; D87-R89 PolarHBondContact OD1-NE 3.11Å; D87-R89 IonicContact OD1-NH2 3.54Å; D87-R89 IonicContact OD2-CZ 2.89Å; D87-R89 IonicContact OD2-NE 3.73Å; D87-R89 PolarHBondContact OD2-NE 3.17Å; D87-R89 IonicContact OD2-NH2 3.38Å; D87-R89 PolarHBondContact OD2-NH2 3.49Å
90	F	91.4	Very high	94.1	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.009	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-86.6	-18.3	176.4	-64.7	-65.4	0	0	0	113.7	L27 F37 G65 P66 E85 D87 T88 G93 L94	L27-F90 HydrophobicContact CB-CE1 4.18Å; L27-F90 HydrophobicContact CD1-CD1 3.63Å; L27-F90 HydrophobicContact CD1-CE1 3.58Å; L27-F90 HydrophobicContact CD2-CD1 3.94Å; L27-F90 HydrophobicContact CD2-CE1 3.72Å; L27-F90 HydrophobicContact CD2-CG 4.47Å; L27-F90 HydrophobicContact CD2-CZ 4.02Å; L27-F90 HydrophobicContact CG-CD1 4.36Å; L27-F90 HydrophobicContact CG-CE1 4.03Å; F37-F90 HydrophobicContact CE1-CE1 4.2Å; F37-F90 HydrophobicContact CE1-CE2 4.12Å; F37-F90 AromaticContact CE1-CZ 3.51Å; F37-F90 HydrophobicContact CE1-CZ 3.51Å; F37-F90 HydrophobicContact CE2-CZ 4.32Å; F37-F90 HydrophobicContact CZ-CE1 4.19Å; F37-F90 HydrophobicContact CZ-CE2 4.24Å; F37-F90 AromaticContact CZ-CZ 3.41Å; F37-F90 HydrophobicContact CZ-CZ 3.41Å; F37-F90 VanDerWaalsContact CZ-CZ 3.41Å; G65-F90 VanDerWaalsContact C-CD1 3.47Å; G65-F90 VanDerWaalsContact C-CG 3.49Å; G65-F90 VanDerWaalsContact O-CB 3.32Å; G65-F90 WeakPolarHBondContact O-CB 3.11Å; G65-F90 WeakPolarHBondContact O-CG 3.41Å; P66-F90 HydrophobicContact CB-CD1 4.08Å; P66-F90 HydrophobicContact CB-CE1 3.97Å; E85-F90 HydrophobicContact CG-CB 4.13Å; E85-F90 HydrophobicContact CG-CD2 4.49Å; D87-F90 HydrophobicContact CB-CD2 3.83Å; D87-F90 HydrophobicContact CB-CE2 4.07Å; D87-F90 PolarHBondContact O-N 2.89Å; D87-F90 VanDerWaalsContact O-N 3.11Å; D87-F90 WeakPolarHBondContact OD2-CE2 3.35Å; T88-F90 PolarHBondContact O-N 3.35Å; F90-G93 PolarHBondContact O-N 2.88Å; F90-G93 VanDerWaalsContact O-N 3.11Å; F90-L94 HydrophobicContact CB-CD1 4.5Å; F90-L94 WeakPolarHBondContact O-CG 3.3Å; F90-L94 PolarHBondContact O-N 2.99Å
91	I	93.9	Very high	93.8	Very high	32 Å²	32	37.8 Å²	37.8	16%	0.164	20%	0.201	C	C	.	.	H	α-helix	trans	-56.3	-44.7	-175.3	-57.7	-65.2	0	0	0	112.4	E85 T88 G93 L94 Q95 I107 H109	E85-I91 HydrophobicContact CB-CD1 3.89Å; E85-I91 HydrophobicContact CG-CD1 4.14Å; T88-I91 WeakPolarHBondContact O-CB 3.22Å; T88-I91 PolarHBondContact O-N 2.83Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 3.46Å; I91-L94 HydrophobicContact CD1-CD1 4.41Å; I91-L94 PolarHBondContact O-N 2.87Å; I91-L94 VanDerWaalsContact O-N 3.17Å; I91-Q95 HydrophobicContact CG2-CG 4.35Å; I91-Q95 WeakPolarHBondContact O-CG 3.31Å; I91-Q95 PolarHBondContact O-N 2.78Å; I91-I107 HydrophobicContact CD1-CG2 3.89Å; I91-I107 HydrophobicContact CG2-CG2 4.49Å; I91-H109 HydrophobicContact CD1-CB 4.12Å
92	P	92.2	Very high	93.5	Very high	57 Å²	57	42.8 Å²	42.8	37%	0.37	23%	0.234	S	C	.	.	H	α-helix	trans	-59.9	-41.6	177.3	-25.3	35.8	0	0	0	113.2	F25 T88 L94 Q95 M96	F25-P92 HydrophobicContact CD1-CB 4.4Å; F25-P92 HydrophobicContact CE1-CB 3.58Å; F25-P92 HydrophobicContact CE1-CG 4.19Å; F25-P92 HydrophobicContact CZ-CB 3.66Å; T88-P92 WeakPolarHBondContact O-CD 3.27Å; P92-L94 VanDerWaalsContact C-N 3.32Å; P92-L94 PolarHBondContact O-N 2.84Å; P92-Q95 PolarHBondContact O-N 2.8Å; P92-M96 WeakPolarHBondContact O-CG 3.39Å; P92-M96 PolarHBondContact O-N 3.33Å; P92-M96 VanDerWaalsContact O-N 3.08Å
93	G	90.6	Very high	93.2	Very high	4 Å²	4	46.4 Å²	46.4	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-32.9	177.3	0	0	0	0	0	113	F90 I91 L97	F90-G93 PolarHBondContact O-N 2.88Å; F90-G93 VanDerWaalsContact O-N 3.11Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 3.46Å; G93-L97 PolarHBondContact O-N 2.93Å
94	L	94.1	Very high	93.1	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-37.7	172.2	-64	169.3	0	0	0	111.3	P64 V83 E85 F90 I91 P92 M96 L97 S98 I107	P64-L94 HydrophobicContact CB-CD1 4.46Å; P64-L94 HydrophobicContact CB-CD2 4.01Å; P64-L94 HydrophobicContact CG-CD1 3.62Å; P64-L94 HydrophobicContact CG-CD2 4.07Å; V83-L94 HydrophobicContact CG2-CD1 4.28Å; E85-L94 HydrophobicContact CB-CD1 4.01Å; E85-L94 HydrophobicContact CG-CD1 4.23Å; F90-L94 HydrophobicContact CB-CD1 4.5Å; F90-L94 WeakPolarHBondContact O-CG 3.3Å; F90-L94 PolarHBondContact O-N 2.99Å; I91-L94 HydrophobicContact CD1-CD1 4.41Å; I91-L94 PolarHBondContact O-N 2.87Å; I91-L94 VanDerWaalsContact O-N 3.17Å; P92-L94 VanDerWaalsContact C-N 3.32Å; P92-L94 PolarHBondContact O-N 2.84Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-M96 PolarHBondContact O-N 2.87Å; L94-L97 HydrophobicContact CD2-CD1 4.32Å; L94-L97 WeakPolarHBondContact O-CA 3.3Å; L94-L97 WeakPolarHBondContact O-CB 3.49Å; L94-L97 PolarHBondContact O-N 2.86Å; L94-S98 PolarHBondContact O-N 2.81Å; L94-I107 HydrophobicContact CB-CD1 3.63Å; L94-I107 HydrophobicContact CB-CG1 4.13Å; L94-I107 HydrophobicContact CB-CG2 4.42Å; L94-I107 HydrophobicContact CD1-CG2 4.32Å; L94-I107 WeakPolarHBondContact O-CD1 3.16Å
95	Q	95.3	Very high	93.1	Very high	85 Å²	85	50.4 Å²	50.4	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-40.8	175.7	-72.2	-66.2	5	0	0	111.8	I91 P92 L97 S98 E99 I107	I91-Q95 HydrophobicContact CG2-CG 4.35Å; I91-Q95 WeakPolarHBondContact O-CG 3.31Å; I91-Q95 PolarHBondContact O-N 2.78Å; P92-Q95 PolarHBondContact O-N 2.8Å; Q95-L97 PolarHBondContact O-N 3.09Å; Q95-S98 WeakPolarHBondContact O-CA 3.28Å; Q95-S98 VanDerWaalsContact O-CB 3.3Å; Q95-S98 WeakPolarHBondContact O-CB 3.45Å; Q95-S98 PolarHBondContact O-N 2.99Å; Q95-E99 WeakPolarHBondContact O-CG 3.45Å; Q95-E99 PolarHBondContact O-N 2.98Å; Q95-I107 HydrophobicContact CG-CD1 4.13Å
96	M	92.6	Very high	93.1	Very high	61 Å²	61	54.7 Å²	54.7	30%	0.3	31%	0.305	S	S	.	.	H	α-helix	trans	-58.5	-34.8	172.2	-64.2	177.2	71.9	0	0	112.6	P16 F25 P92 L94 A100	P16-M96 HydrophobicContact CG-CE 3.77Å; F25-M96 HydrophobicContact CZ-SD 4.42Å; P92-M96 WeakPolarHBondContact O-CG 3.39Å; P92-M96 PolarHBondContact O-N 3.33Å; P92-M96 VanDerWaalsContact O-N 3.08Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-M96 PolarHBondContact O-N 2.87Å; M96-A100 WeakPolarHBondContact O-CB 3.45Å; M96-A100 PolarHBondContact O-N 2.6Å
97	L	92.4	Very high	93.4	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-70.8	-35.5	173.2	-71	173.8	0	0	0	112.3	L15 T70 R71 G93 L94 Q95 A100 A101 L105	L15-L97 HydrophobicContact CD1-CD2 4.45Å; T70-L97 HydrophobicContact CG2-CD1 4.12Å; R71-L97 HydrophobicContact CG-CD1 4.2Å; R71-L97 HydrophobicContact CG-CD2 3.79Å; G93-L97 PolarHBondContact O-N 2.93Å; L94-L97 HydrophobicContact CD2-CD1 4.32Å; L94-L97 WeakPolarHBondContact O-CA 3.3Å; L94-L97 WeakPolarHBondContact O-CB 3.49Å; L94-L97 PolarHBondContact O-N 2.86Å; Q95-L97 PolarHBondContact O-N 3.09Å; L97-A100 PolarHBondContact O-N 3.3Å; L97-A101 PolarHBondContact O-N 2.91Å; L97-L105 HydrophobicContact CB-CD2 3.86Å
98	S	94.9	Very high	93.7	Very high	25 Å²	25	51.8 Å²	51.8	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-65.5	-43.7	177.8	-171.6	0	0	0	0	111.2	L94 Q95 A100 A101 L105	L94-S98 PolarHBondContact O-N 2.81Å; Q95-S98 WeakPolarHBondContact O-CA 3.28Å; Q95-S98 VanDerWaalsContact O-CB 3.3Å; Q95-S98 WeakPolarHBondContact O-CB 3.45Å; Q95-S98 PolarHBondContact O-N 2.99Å; S98-A100 VanDerWaalsContact C-N 3.26Å; S98-A100 PolarHBondContact O-N 3.2Å; S98-A101 CarbonylContact O-C 3.54Å; S98-A101 PolarHBondContact O-N 2.97Å; S98-A101 VanDerWaalsContact O-N 3.16Å; S98-L105 PolarHBondContact OG-O 2.89Å
99	E	94.1	Very high	94	Very high	145 Å²	145	53.2 Å²	53.2	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-61.2	-35	173.9	-69.6	169.3	-172.6	0	0	112.2	Q95 P102	Q95-E99 WeakPolarHBondContact O-CG 3.45Å; Q95-E99 PolarHBondContact O-N 2.98Å; E99-P102 WeakPolarHBondContact O-CG 3.34Å
100	A	91.4	Very high	94.3	Very high	56 Å²	56	50.5 Å²	50.5	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-78.6	-18.5	177.5	0	0	0	0	0	114.4	L15 M96 L97 S98 P102	L15-A100 HydrophobicContact CD1-CB 3.58Å; L15-A100 HydrophobicContact CD2-CB 3.98Å; L15-A100 HydrophobicContact CG-CB 4.3Å; M96-A100 WeakPolarHBondContact O-CB 3.45Å; M96-A100 PolarHBondContact O-N 2.6Å; L97-A100 PolarHBondContact O-N 3.3Å; S98-A100 VanDerWaalsContact C-N 3.26Å; S98-A100 PolarHBondContact O-N 3.2Å; A100-P102 VanDerWaalsContact C-CD 3.49Å
101	A	91.9	Very high	94.4	Very high	22 Å²	22	52.1 Å²	52.1	18%	0.182	30%	0.302	C	S	.	.	S	Bend	trans	-128.2	66.9	175.7	0	0	0	0	0	110.8	L74 L97 S98 G103 K104	L74-A101 HydrophobicContact CD1-CB 4.13Å; L74-A101 HydrophobicContact CD2-CB 4.16Å; L97-A101 PolarHBondContact O-N 2.91Å; S98-A101 CarbonylContact O-C 3.54Å; S98-A101 PolarHBondContact O-N 2.97Å; S98-A101 VanDerWaalsContact O-N 3.16Å; A101-G103 PolarHBondContact O-N 2.95Å; A101-K104 HydrophobicContact CB-CB 4.2Å; A101-K104 WeakPolarHBondContact O-CB 3.33Å; A101-K104 PolarHBondContact O-N 3.21Å; A101-K104 VanDerWaalsContact O-N 3.08Å
102	P	92.1	Very high	94.5	Very high	105 Å²	105	51 Å²	51	68%	0.682	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	131.9	-172.8	-25.5	34.7	0	0	0	112.5	E99 A100 K104	E99-P102 WeakPolarHBondContact O-CG 3.34Å; A100-P102 VanDerWaalsContact C-CD 3.49Å; P102-K104 PolarHBondContact O-N 3.46Å
103	G	92.3	Very high	94.5	Very high	78 Å²	78	51 Å²	51	80%	0.804	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-2.5	178.2	0	0	0	0	0	115.4	A101	A101-G103 PolarHBondContact O-N 2.95Å
104	K	95.9	Very high	94.7	Very high	73 Å²	73	55.6 Å²	55.6	32%	0.317	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-34.1	-179.9	-65.1	-69.6	-169.7	172.2	0	113.6	L74 V78 L81 A101 P102	L74-K104 HydrophobicContact CD2-CB 3.89Å; V78-K104 WeakPolarHBondContact O-CD 3.22Å; V78-K104 PolarHBondContact O-NZ 3.46Å; L81-K104 PolarHBondContact N-O 2.85Å; A101-K104 HydrophobicContact CB-CB 4.2Å; A101-K104 WeakPolarHBondContact O-CB 3.33Å; A101-K104 PolarHBondContact O-N 3.21Å; A101-K104 VanDerWaalsContact O-N 3.08Å; P102-K104 PolarHBondContact O-N 3.46Å
105	L	97.9	Very high	94.8	Very high	12 Å²	12	58.2 Å²	58.2	6%	0.063	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.2	-174.4	176.9	58.3	0	0	0	111.6	T70 L74 L81 V83 L97 S98 I107	T70-L105 HydrophobicContact CG2-CD1 4.14Å; T70-L105 HydrophobicContact CG2-CD2 4.14Å; L74-L105 HydrophobicContact CD1-CD2 4.44Å; L74-L105 HydrophobicContact CD2-CB 4.28Å; L81-L105 HydrophobicContact CB-CD1 4.35Å; L81-L105 HydrophobicContact CD2-CD1 4.01Å; L81-L105 HydrophobicContact CG-CD1 3.84Å; L81-L105 CarbonylContact O-C 3.57Å; L81-L105 WeakPolarHBondContact O-CA 3.22Å; V83-L105 HydrophobicContact CB-CD1 4.44Å; V83-L105 HydrophobicContact CG1-CD1 3.53Å; V83-L105 HydrophobicContact CG2-CD1 4.04Å; L97-L105 HydrophobicContact CB-CD2 3.86Å; S98-L105 PolarHBondContact OG-O 2.89Å; L105-I107 HydrophobicContact CD1-CG1 4.24Å; L105-I107 HydrophobicContact CD2-CD1 4.17Å; L105-I107 HydrophobicContact CD2-CG1 4.18Å; L105-I107 HydrophobicContact CG-CD1 4.32Å; L105-I107 HydrophobicContact CG-CG1 3.93Å
106	R	97.9	Very high	94.7	Very high	96 Å²	96	61.6 Å²	61.6	36%	0.362	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128	170.3	-174.3	166.1	50.4	160.7	3.4	109.8	E80 L81 L82 V83 A120	E80-R106 IonicContact OE1-CZ 3.72Å; E80-R106 IonicContact OE1-NE 3.93Å; E80-R106 PolarHBondContact OE1-NE 3.41Å; E80-R106 IonicContact OE1-NH2 3.48Å; E80-R106 PolarHBondContact OE1-NH2 3.26Å; L81-R106 PolarHBondContact O-N 2.75Å; L82-R106 WeakPolarHBondContact CA-O 3.42Å; L82-R106 HydrophobicContact CD1-CB 4.29Å; L82-R106 HydrophobicContact CD1-CG 4.13Å; V83-R106 PolarHBondContact N-O 3.4Å; R106-A120 PolarHBondContact NH1-O 3.45Å; R106-A120 VanDerWaalsContact NH1-O 3.13Å; R106-A120 PolarHBondContact NH2-O 2.89Å
107	I	98.3	Very high	94.8	Very high	31 Å²	31	59 Å²	59	16%	0.159	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.1	-173.9	-57.7	158.1	0	0	0	109.1	V83 I91 L94 Q95 L105	V83-I107 HydrophobicContact CG2-CB 4.08Å; V83-I107 HydrophobicContact CG2-CG1 3.78Å; V83-I107 HydrophobicContact CG2-CG2 4.03Å; I91-I107 HydrophobicContact CD1-CG2 3.89Å; I91-I107 HydrophobicContact CG2-CG2 4.49Å; L94-I107 HydrophobicContact CB-CD1 3.63Å; L94-I107 HydrophobicContact CB-CG1 4.13Å; L94-I107 HydrophobicContact CB-CG2 4.42Å; L94-I107 HydrophobicContact CD1-CG2 4.32Å; L94-I107 WeakPolarHBondContact O-CD1 3.16Å; Q95-I107 HydrophobicContact CG-CD1 4.13Å; L105-I107 HydrophobicContact CD1-CG1 4.24Å; L105-I107 HydrophobicContact CD2-CD1 4.17Å; L105-I107 HydrophobicContact CD2-CG1 4.18Å; L105-I107 HydrophobicContact CG-CD1 4.32Å; L105-I107 HydrophobicContact CG-CG1 3.93Å
108	V	98	Very high	94.8	Very high	39 Å²	39	61.1 Å²	61.1	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.3	172	174.3	0	0	0	0	109	L82 V83 V84 E85 G110 F115	L82-V108 HydrophobicContact CD1-CB 4.48Å; L82-V108 HydrophobicContact CD1-CG2 3.71Å; V83-V108 PolarHBondContact O-N 3.01Å; V84-V108 WeakPolarHBondContact CA-O 3.31Å; V84-V108 HydrophobicContact CG2-CB 4.04Å; V84-V108 HydrophobicContact CG2-CG1 4.35Å; E85-V108 PolarHBondContact N-O 3.31Å; V108-G110 PolarHBondContact O-N 2.71Å; V108-F115 HydrophobicContact CB-CE2 4.41Å; V108-F115 HydrophobicContact CG1-CD2 4.03Å; V108-F115 HydrophobicContact CG1-CE2 3.7Å; V108-F115 HydrophobicContact CG1-CZ 4.43Å; V108-F115 HydrophobicContact CG2-CE2 4.32Å; V108-F115 HydrophobicContact CG2-CZ 4.36Å
109	H	97.4	Very high	94.6	Very high	110 Å²	110	69 Å²	69	51%	0.509	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112	167.1	173.5	-134.4	0	0	0	109	E85 K86 T88 I91	E85-H109 CarbonylContact O-C 3.58Å; E85-H109 VanDerWaalsContact O-CA 3.29Å; E85-H109 WeakPolarHBondContact O-CA 3.34Å; E85-H109 PolarHBondContact O-CD2 3.15Å; K86-H109 PolarHBondContact O-NE2 2.97Å; T88-H109 WeakPolarHBondContact CG2-CE1 3.5Å; T88-H109 WeakPolarHBondContact CG2-NE2 3.44Å; I91-H109 HydrophobicContact CD1-CB 4.12Å
110	G	95.4	Very high	94.6	Very high	19 Å²	19	62.7 Å²	62.7	20%	0.196	35%	0.346	C	S	.	.	S	Bend	trans	-178.3	172.2	-175.9	0	0	0	0	0	114.4	V84 E85 K86 V108	V84-G110 WeakPolarHBondContact CG1-O 3.46Å; E85-G110 CarbonylContact C-O 3.47Å; E85-G110 VanDerWaalsContact C-O 3.3Å; E85-G110 PolarHBondContact O-N 2.93Å; K86-G110 VanDerWaalsContact CA-O 3.27Å; K86-G110 WeakPolarHBondContact CA-O 3.36Å; K86-G110 WeakPolarHBondContact CB-O 3.32Å; K86-G110 PolarHBondContact N-O 3.06Å; V108-G110 PolarHBondContact O-N 2.71Å
111	D	94.6	Very high	94.8	Very high	35 Å²	35	60.5 Å²	60.5	19%	0.187	33%	0.326	C	S	.	.			trans	-93.5	122.8	176.3	-167.9	-28.1	0	0	0	110.6	K86 L113 T114 F115	K86-D111 HydrophobicContact CD-CB 4.16Å; K86-D111 WeakPolarHBondContact CE-OD2 3.43Å; K86-D111 IonicContact NZ-OD2 3.6Å; K86-D111 PolarHBondContact NZ-OD2 3.21Å; D111-L113 PolarHBondContact O-N 3.08Å; D111-L113 VanDerWaalsContact O-N 3.15Å; D111-L113 WeakPolarHBondContact OD1-CB 3.32Å; D111-L113 PolarHBondContact OD1-N 2.87Å; D111-T114 PolarHBondContact O-N 3.21Å; D111-T114 PolarHBondContact O-OG1 2.79Å; D111-F115 WeakPolarHBondContact O-CB 3.32Å; D111-F115 PolarHBondContact O-N 3.15Å
112	V	94.8	Very high	94.9	Very high	10 Å²	10	62.3 Å²	62.3	6%	0.061	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.7	178.2	-59.5	0	0	0	0	113.1	V62 V84 T114 L142 V146 L150	V62-V112 HydrophobicContact CB-CB 4.35Å; V62-V112 HydrophobicContact CB-CG1 3.81Å; V62-V112 HydrophobicContact CG1-CB 4.17Å; V62-V112 HydrophobicContact CG1-CG1 3.87Å; V84-V112 HydrophobicContact CB-CG1 3.98Å; V84-V112 HydrophobicContact CG1-CG1 3.77Å; V112-T114 VanDerWaalsContact C-N 3.3Å; V112-T114 PolarHBondContact O-N 3.45Å; V112-L142 HydrophobicContact CG2-CD2 4.39Å; V112-V146 HydrophobicContact CG2-CG1 3.91Å; V112-L150 HydrophobicContact CG2-CD2 4.07Å
113	L	93.6	Very high	95	Very high	55 Å²	55	62.5 Å²	62.5	29%	0.288	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-22.3	176.5	-68.3	172	0	0	0	112.8	D111 V146 P149 L150 K153	D111-L113 PolarHBondContact O-N 3.08Å; D111-L113 VanDerWaalsContact O-N 3.15Å; D111-L113 WeakPolarHBondContact OD1-CB 3.32Å; D111-L113 PolarHBondContact OD1-N 2.87Å; L113-V146 HydrophobicContact CD1-CG1 4.5Å; L113-V146 HydrophobicContact CD2-CG1 4.47Å; L113-V146 HydrophobicContact CG-CG1 4.31Å; L113-P149 HydrophobicContact CD2-CB 4.47Å; L113-L150 HydrophobicContact CD2-CB 3.99Å; L113-L150 HydrophobicContact CD2-CD1 4Å; L113-K153 PolarHBondContact O-NZ 3.14Å
114	T	94.3	Very high	95.1	Very high	102 Å²	102	63.4 Å²	63.4	63%	0.626	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	-20.5	-177.3	59.4	0	0	0	0	113.5	D111 V112	D111-T114 PolarHBondContact O-N 3.21Å; D111-T114 PolarHBondContact O-OG1 2.79Å; V112-T114 VanDerWaalsContact C-N 3.3Å; V112-T114 PolarHBondContact O-N 3.45Å
115	F	95.5	Very high	95.1	Very high	55 Å²	55	61.2 Å²	61.2	24%	0.241	32%	0.315	C	S	.	.			trans	-59.9	138.1	177.5	-175	-100.7	0	0	0	111.6	L82 V84 V108 D111 V117	L82-F115 HydrophobicContact CD2-CE1 3.98Å; L82-F115 HydrophobicContact CD2-CZ 4.23Å; V84-F115 HydrophobicContact CG1-CB 4.25Å; V84-F115 HydrophobicContact CG1-CG 4.3Å; V84-F115 HydrophobicContact CG2-CD1 3.58Å; V84-F115 HydrophobicContact CG2-CD2 4.26Å; V84-F115 HydrophobicContact CG2-CE1 3.69Å; V84-F115 HydrophobicContact CG2-CE2 4.38Å; V84-F115 HydrophobicContact CG2-CG 3.86Å; V84-F115 HydrophobicContact CG2-CZ 4.1Å; V108-F115 HydrophobicContact CB-CE2 4.41Å; V108-F115 HydrophobicContact CG1-CD2 4.03Å; V108-F115 HydrophobicContact CG1-CE2 3.7Å; V108-F115 HydrophobicContact CG1-CZ 4.43Å; V108-F115 HydrophobicContact CG2-CE2 4.32Å; V108-F115 HydrophobicContact CG2-CZ 4.36Å; D111-F115 WeakPolarHBondContact O-CB 3.32Å; D111-F115 PolarHBondContact O-N 3.15Å; F115-V117 HydrophobicContact CD1-CB 4.4Å; F115-V117 HydrophobicContact CE1-CB 4.13Å; F115-V117 HydrophobicContact CE1-CG2 4.36Å
116	K	93.9	Very high	95.1	Very high	157 Å²	157	64.1 Å²	64.1	68%	0.683	33%	0.327	S	S	*	.			trans	-108.5	107.9	-178.1	-75.4	-169.4	-179.9	-173.5	0	109.4	E118	K116-E118 WeakPolarHBondContact CA-OE2 3.34Å; K116-E118 WeakPolarHBondContact CB-OE2 3.45Å
117	V	93.6	Very high	95.1	Very high	6 Å²	6	65.2 Å²	65.2	4%	0.036	33%	0.332	C	S	.	.			trans	-89.4	-4.6	-176.6	75.2	0	0	0	0	112.7	Y60 L82 F115 K119 A120 F121 P164 Y167	Y60-V117 HydrophobicContact CD1-CB 4.26Å; Y60-V117 HydrophobicContact CD1-CG1 4.36Å; Y60-V117 HydrophobicContact CD1-CG2 3.82Å; Y60-V117 HydrophobicContact CE1-CB 4.16Å; Y60-V117 HydrophobicContact CE1-CG1 4.35Å; Y60-V117 HydrophobicContact CE1-CG2 4.16Å; Y60-V117 HydrophobicContact CG-CG2 4.03Å; L82-V117 HydrophobicContact CD2-CG2 4.12Å; F115-V117 HydrophobicContact CD1-CB 4.4Å; F115-V117 HydrophobicContact CE1-CB 4.13Å; F115-V117 HydrophobicContact CE1-CG2 4.36Å; V117-K119 PolarHBondContact O-N 3.39Å; V117-A120 HydrophobicContact CB-CB 4.41Å; V117-A120 HydrophobicContact CG2-CB 3.56Å; V117-A120 VanDerWaalsContact O-CB 3.25Å; V117-A120 WeakPolarHBondContact O-CB 3.36Å; V117-A120 PolarHBondContact O-N 2.84Å; V117-F121 HydrophobicContact CG2-CE2 4.39Å; V117-P164 HydrophobicContact CG1-CB 3.67Å; V117-P164 HydrophobicContact CG1-CG 3.69Å; V117-Y167 PolarHBondContact O-OH 2.96Å
118	E	93	Very high	95	Very high	52 Å²	52	67.8 Å²	67.8	24%	0.243	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.9	-174.4	-66.7	88.2	146.4	0	0	113.9	K116 G163 V166 Y167	K116-E118 WeakPolarHBondContact CA-OE2 3.34Å; K116-E118 WeakPolarHBondContact CB-OE2 3.45Å; E118-G163 WeakPolarHBondContact CG-O 3.42Å; E118-G163 WeakPolarHBondContact OE1-CA 3.31Å; E118-V166 HydrophobicContact CB-CG1 4.5Å; E118-V166 HydrophobicContact CB-CG2 4.12Å; E118-V166 HydrophobicContact CG-CG1 3.96Å; E118-V166 HydrophobicContact CG-CG2 4.28Å; E118-Y167 PolarHBondContact O-OH 2.92Å
119	K	91.9	Very high	95	Very high	190 Å²	190	67.1 Å²	67.1	83%	0.826	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	13	180	-60.9	-173.7	177.8	-174.7	0	112.7	V117	V117-K119 PolarHBondContact O-N 3.39Å
120	A	92.7	Very high	95	Very high	13 Å²	13	67.4 Å²	67.4	11%	0.107	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-46	-177.5	0	0	0	0	0	110.9	L82 R106 V117 Y167	L82-A120 HydrophobicContact CD2-CB 3.52Å; R106-A120 PolarHBondContact NH1-O 3.45Å; R106-A120 VanDerWaalsContact NH1-O 3.13Å; R106-A120 PolarHBondContact NH2-O 2.89Å; V117-A120 HydrophobicContact CB-CB 4.41Å; V117-A120 HydrophobicContact CG2-CB 3.56Å; V117-A120 VanDerWaalsContact O-CB 3.25Å; V117-A120 WeakPolarHBondContact O-CB 3.36Å; V117-A120 PolarHBondContact O-N 2.84Å; A120-Y167 PolarHBondContact N-OH 2.94Å
121	F	95.4	Very high	95.1	Very high	10 Å²	10	69.7 Å²	69.7	4%	0.044	35%	0.353	C	S	.	.	S	Bend	trans	-110	164.4	-178.4	-49.4	-62.6	0	0	0	112.2	Y58 L82 V117 L125 V136 Y167	Y58-F121 HydrophobicContact CD1-CB 4.23Å; Y58-F121 AromaticContact CD1-CD1 3.55Å; Y58-F121 HydrophobicContact CD1-CD1 3.55Å; Y58-F121 HydrophobicContact CD1-CE1 4.09Å; Y58-F121 HydrophobicContact CD1-CG 4.06Å; Y58-F121 HydrophobicContact CE1-CD1 4.49Å; Y58-F121 HydrophobicContact CG-CD1 4.22Å; Y58-F121 HydrophobicContact CG-CG 4.41Å; L82-F121 HydrophobicContact CB-CE1 3.87Å; L82-F121 HydrophobicContact CB-CZ 3.79Å; L82-F121 HydrophobicContact CD2-CZ 4.43Å; V117-F121 HydrophobicContact CG2-CE2 4.39Å; F121-L125 HydrophobicContact CB-CD1 3.59Å; F121-L125 HydrophobicContact CG-CD1 4.46Å; F121-V136 HydrophobicContact CD2-CG1 4.07Å; F121-V136 HydrophobicContact CE2-CG1 4Å; F121-Y167 WeakPolarHBondContact CA-OH 3.42Å; F121-Y167 HydrophobicContact CB-CE1 4.06Å; F121-Y167 HydrophobicContact CD2-CE2 4.27Å; F121-Y167 PolarHBondContact N-OH 3.22Å; F121-Y167 PolarHBondContact O-OH 2.83Å
122	S	94.1	Very high	95.2	Very high	60 Å²	60	73.7 Å²	73.7	42%	0.42	37%	0.374	S	S	.	.			trans	-55.5	139.4	-178.9	-178.9	0	0	0	0	112.7	S124 L125	S122-S124 WeakPolarHBondContact CB-OG 3.44Å; S122-S124 PolarHBondContact O-N 3.06Å; S122-S124 PolarHBondContact OG-N 2.97Å; S122-S124 PolarHBondContact OG-OG 2.79Å; S122-L125 WeakPolarHBondContact O-CB 3.45Å; S122-L125 PolarHBondContact O-N 3.02Å; S122-L125 VanDerWaalsContact O-N 3.09Å
123	E	94.2	Very high	95.3	Very high	109 Å²	109	74.9 Å²	74.9	51%	0.509	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-58.4	-26	172.3	-69.3	-72.3	135.2	0	0	112.4	L125 K126	E123-L125 PolarHBondContact O-N 2.79Å; E123-L125 VanDerWaalsContact O-N 3.12Å; E123-K126 VanDerWaalsContact CD-CE 3.41Å; E123-K126 WeakPolarHBondContact O-CB 3.49Å; E123-K126 WeakPolarHBondContact O-CG 3.09Å; E123-K126 PolarHBondContact O-N 3.11Å; E123-K126 VanDerWaalsContact O-N 3.07Å; E123-K126 VanDerWaalsContact OE1-CE 3.25Å; E123-K126 WeakPolarHBondContact OE1-CE 3.44Å; E123-K126 IonicContact OE1-NZ 3.24Å; E123-K126 PolarHBondContact OE1-NZ 3.45Å; E123-K126 VanDerWaalsContact OE2-CD 3.29Å; E123-K126 WeakPolarHBondContact OE2-CD 3.3Å; E123-K126 WeakPolarHBondContact OE2-CE 3.3Å; E123-K126 IonicContact OE2-NZ 2.66Å; E123-K126 PolarHBondContact OE2-NZ 3.17Å
124	S	95	Very high	95.5	Very high	98 Å²	98	72.4 Å²	72.4	69%	0.685	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-63.7	-15	176.2	64.7	0	0	0	0	114	S122	S122-S124 WeakPolarHBondContact CB-OG 3.44Å; S122-S124 PolarHBondContact O-N 3.06Å; S122-S124 PolarHBondContact OG-N 2.97Å; S122-S124 PolarHBondContact OG-OG 2.79Å
125	L	95.8	Very high	95.6	Very high	26 Å²	26	70.7 Å²	70.7	14%	0.136	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-85.7	-10.8	177.3	-59.8	168.6	0	0	0	113	Y58 F121 S122 E123 R127 P134 V136 Y167	Y58-L125 HydrophobicContact CD1-CD1 3.73Å; Y58-L125 HydrophobicContact CD2-CD1 3.37Å; Y58-L125 HydrophobicContact CD2-CD2 3.56Å; Y58-L125 HydrophobicContact CD2-CG 4.09Å; Y58-L125 HydrophobicContact CE1-CD1 3.91Å; Y58-L125 HydrophobicContact CE2-CD1 3.58Å; Y58-L125 HydrophobicContact CE2-CD2 3.36Å; Y58-L125 HydrophobicContact CE2-CG 4.05Å; Y58-L125 HydrophobicContact CG-CD1 3.44Å; Y58-L125 VanDerWaalsContact CG-CD1 3.44Å; Y58-L125 HydrophobicContact CG-CD2 4.49Å; F121-L125 HydrophobicContact CB-CD1 3.59Å; F121-L125 HydrophobicContact CG-CD1 4.46Å; S122-L125 WeakPolarHBondContact O-CB 3.45Å; S122-L125 PolarHBondContact O-N 3.02Å; S122-L125 VanDerWaalsContact O-N 3.09Å; E123-L125 PolarHBondContact O-N 2.79Å; E123-L125 VanDerWaalsContact O-N 3.12Å; L125-R127 PolarHBondContact O-N 3.11Å; L125-P134 WeakPolarHBondContact O-CB 3.48Å; L125-V136 HydrophobicContact CB-CG2 4.22Å; L125-V136 HydrophobicContact CD1-CG2 4.36Å; L125-Y167 HydrophobicContact CB-CD1 4.2Å
126	K	97.1	Very high	95.7	Very high	74 Å²	74	68.2 Å²	68.2	32%	0.322	35%	0.345	S	S	.	.			trans	-64.6	133.9	177.5	-62.7	-170.5	170.3	170.5	0	109.7	E123 V166 Y167	E123-K126 VanDerWaalsContact CD-CE 3.41Å; E123-K126 WeakPolarHBondContact O-CB 3.49Å; E123-K126 WeakPolarHBondContact O-CG 3.09Å; E123-K126 PolarHBondContact O-N 3.11Å; E123-K126 VanDerWaalsContact O-N 3.07Å; E123-K126 VanDerWaalsContact OE1-CE 3.25Å; E123-K126 WeakPolarHBondContact OE1-CE 3.44Å; E123-K126 IonicContact OE1-NZ 3.24Å; E123-K126 PolarHBondContact OE1-NZ 3.45Å; E123-K126 VanDerWaalsContact OE2-CD 3.29Å; E123-K126 WeakPolarHBondContact OE2-CD 3.3Å; E123-K126 WeakPolarHBondContact OE2-CE 3.3Å; E123-K126 IonicContact OE2-NZ 2.66Å; E123-K126 PolarHBondContact OE2-NZ 3.17Å; K126-V166 WeakPolarHBondContact CD-O 3.4Å; K126-V166 WeakPolarHBondContact CG-O 3.42Å; K126-Y167 HydrophobicContact CG-CD1 3.82Å; K126-Y167 HydrophobicContact CG-CE1 4.37Å
127	R	97.8	Very high	95.9	Very high	119 Å²	119	61.1 Å²	61.1	45%	0.449	32%	0.315	S	S	.	.			trans	-118	145.2	174	-61	-69.7	-99.6	161.7	-0.6	109.4	L125 D131 P134 Y167	L125-R127 PolarHBondContact O-N 3.11Å; R127-D131 HydrophobicContact CB-CB 4.49Å; R127-D131 IonicContact CZ-OD2 3.85Å; R127-D131 IonicContact NE-OD2 2.89Å; R127-D131 IonicContact NH1-OD2 2.78Å; R127-D131 PolarHBondContact NH1-OD2 2.69Å; R127-D131 IonicContact NH2-OD2 3.76Å; R127-P134 HydrophobicContact CB-CB 4.42Å; R127-P134 HydrophobicContact CG-CB 3.87Å; R127-Y167 PolarHBondContact N-O 3.32Å
128	P	97.6	Very high	96.1	Very high	84 Å²	84	60.9 Å²	60.9	55%	0.545	31%	0.313	S	S	.	.			trans	-52.2	147.6	167.2	-22.8	33	0	0	0	110.7	E130 D131	P128-E130 PolarHBondContact O-N 3.38Å; P128-D131 HydrophobicContact CB-CB 4.25Å; P128-D131 HydrophobicContact CG-CB 4.48Å; P128-D131 WeakPolarHBondContact O-CB 3.38Å; P128-D131 PolarHBondContact O-N 3.22Å; P128-D131 VanDerWaalsContact O-N 3.14Å
129	W	97.9	Very high	96.4	Very high	25 Å²	25	58.4 Å²	58.4	10%	0.095	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-36.6	-175.9	-168.6	-96.1	0	0	0	113.3	D131 I158 R161 F165 R169 P232 L233 I234	W129-D131 VanDerWaalsContact C-N 3.29Å; W129-D131 PolarHBondContact O-N 2.88Å; W129-I158 HydrophobicContact CH2-CG2 4.02Å; W129-I158 HydrophobicContact CZ2-CG2 4.09Å; W129-R161 HydrophobicContact CD2-CG 4.27Å; W129-R161 HydrophobicContact CE3-CB 4.33Å; W129-R161 HydrophobicContact CE3-CG 4.01Å; W129-R161 HydrophobicContact CH2-CG 4.22Å; W129-R161 HydrophobicContact CZ2-CG 4.48Å; W129-R161 HydrophobicContact CZ3-CB 4.19Å; W129-R161 HydrophobicContact CZ3-CG 3.98Å; W129-F165 HydrophobicContact CH2-CB 4.31Å; W129-F165 HydrophobicContact CZ3-CB 3.98Å; W129-R169 HydrophobicContact CD2-CG 3.75Å; W129-R169 HydrophobicContact CE3-CG 4.02Å; W129-R169 HydrophobicContact CG-CG 4.26Å; W129-R169 HydrophobicContact CH2-CG 4.18Å; W129-R169 HydrophobicContact CZ2-CG 3.91Å; W129-R169 HydrophobicContact CZ3-CG 4.23Å; W129-R169 WeakPolarHBondContact O-CD 3.26Å; W129-R169 WeakPolarHBondContact O-CG 3.34Å; W129-R169 PolarHBondContact O-NE 3.11Å; W129-P232 HydrophobicContact CH2-CB 4.04Å; W129-P232 HydrophobicContact CZ2-CB 3.96Å; W129-L233 PolarHBondContact NE1-O 3.41Å; W129-I234 VanDerWaalsContact CD1-O 3.25Å; W129-I234 PolarHBondContact NE1-O 3.36Å
130	E	97.5	Very high	96.6	Very high	117 Å²	117	49.5 Å²	49.5	55%	0.547	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-17.8	-177.8	-50.7	-59.9	125.9	0	0	113.1	P128 I234	P128-E130 PolarHBondContact O-N 3.38Å; E130-I234 WeakPolarHBondContact OE2-CG2 3.29Å
131	D	97.3	Very high	96.7	Very high	67 Å²	67	50.1 Å²	50.1	36%	0.358	27%	0.265	S	S	.	.	S	Bend	trans	-76.4	174.2	-178.9	-123.6	11.7	0	0	0	111.2	R127 P128 W129 R169	R127-D131 HydrophobicContact CB-CB 4.49Å; R127-D131 IonicContact CZ-OD2 3.85Å; R127-D131 IonicContact NE-OD2 2.89Å; R127-D131 IonicContact NH1-OD2 2.78Å; R127-D131 PolarHBondContact NH1-OD2 2.69Å; R127-D131 IonicContact NH2-OD2 3.76Å; P128-D131 HydrophobicContact CB-CB 4.25Å; P128-D131 HydrophobicContact CG-CB 4.48Å; P128-D131 WeakPolarHBondContact O-CB 3.38Å; P128-D131 PolarHBondContact O-N 3.22Å; P128-D131 VanDerWaalsContact O-N 3.14Å; W129-D131 VanDerWaalsContact C-N 3.29Å; W129-D131 PolarHBondContact O-N 2.88Å; D131-R169 PolarHBondContact O-NE 3.1Å; D131-R169 PolarHBondContact O-NH2 3.44Å
132	D	96.3	Very high	96.3	Very high	119 Å²	119	50.2 Å²	50.2	64%	0.636	27%	0.266	S	S	*	.	S	Bend	trans	-56.3	149.9	169.6	-78.8	-39.6	0	0	0	112
133	P	97.1	Very high	96	Very high	35 Å²	35	48.4 Å²	48.4	23%	0.227	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-50.8	142.9	178.2	-26.7	36.4	0	0	0	112	Q171 T231	P133-Q171 HydrophobicContact CB-CG 4.03Å; P133-Q171 HydrophobicContact CG-CG 4.35Å; P133-T231 HydrophobicContact CG-CG2 4.26Å
134	P	97.1	Very high	95.6	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.019	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-61.3	160	174.7	31.1	-38.1	0	0	0	110.5	L125 R127 V136 Y167	L125-P134 WeakPolarHBondContact O-CB 3.48Å; R127-P134 HydrophobicContact CB-CB 4.42Å; R127-P134 HydrophobicContact CG-CB 3.87Å; P134-V136 HydrophobicContact CB-CB 4.37Å; P134-V136 HydrophobicContact CB-CG2 4.16Å; P134-V136 HydrophobicContact CG-CB 4.24Å; P134-V136 HydrophobicContact CG-CG2 4.49Å; P134-V136 PolarHBondContact O-N 3.39Å; P134-Y167 VanDerWaalsContact CB-O 3.3Å; P134-Y167 WeakPolarHBondContact CB-O 3.5Å; P134-Y167 VanDerWaalsContact CG-O 3.3Å; P134-Y167 WeakPolarHBondContact CG-O 3.3Å
135	N	96.1	Very high	95.3	Very high	65 Å²	65	43.6 Å²	43.6	35%	0.348	23%	0.228	S	C	.	.	S	Bend	trans	-75.8	43.9	172.4	-157.1	17.1	0	0	0	111.7	N56 A57 Y58	N56-N135 VanDerWaalsContact C-ND2 3.31Å; N56-N135 PolarHBondContact O-ND2 3.14Å; A57-N135 WeakPolarHBondContact CA-ND2 3.41Å; A57-N135 WeakPolarHBondContact CA-OD1 3.39Å; A57-N135 VanDerWaalsContact CB-OD1 3.22Å; A57-N135 WeakPolarHBondContact CB-OD1 3.07Å; A57-N135 PolarHBondContact N-ND2 3.43Å; Y58-N135 PolarHBondContact N-O 3.47Å
136	V	97.8	Very high	95.1	Very high	3 Å²	3	44 Å²	44	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.7	179.2	-176.1	0	0	0	0	107.5	Y58 F121 L125 P134 Y167 T170	Y58-V136 CarbonylContact O-C 3.58Å; Y58-V136 WeakPolarHBondContact O-CA 3.44Å; F121-V136 HydrophobicContact CD2-CG1 4.07Å; F121-V136 HydrophobicContact CE2-CG1 4Å; L125-V136 HydrophobicContact CB-CG2 4.22Å; L125-V136 HydrophobicContact CD1-CG2 4.36Å; P134-V136 HydrophobicContact CB-CB 4.37Å; P134-V136 HydrophobicContact CB-CG2 4.16Å; P134-V136 HydrophobicContact CG-CB 4.24Å; P134-V136 HydrophobicContact CG-CG2 4.49Å; P134-V136 PolarHBondContact O-N 3.39Å; V136-Y167 HydrophobicContact CG2-CD1 4.42Å; V136-Y167 HydrophobicContact CG2-CG 4.2Å; V136-T170 HydrophobicContact CB-CG2 4.11Å; V136-T170 HydrophobicContact CG1-CG2 3.81Å; V136-T170 WeakPolarHBondContact O-CG2 2.83Å
137	H	98.5	Very high	94.9	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137	-178	-67.3	-104.9	0	0	0	110.8	L54 Y58 V59 Y60 Q171	L54-H137 HydrophobicContact CD2-CB 3.95Å; Y58-H137 PolarHBondContact O-N 2.76Å; V59-H137 CarbonylContact C-O 3.52Å; V59-H137 WeakPolarHBondContact CA-O 3.38Å; V59-H137 HydrophobicContact CG2-CB 4.45Å; Y60-H137 PolarHBondContact N-O 3.05Å; H137-Q171 PolarHBondContact CE1-OE1 3.34Å
138	I	98.6	Very high	94.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.8	172.7	-56.5	172.5	0	0	0	108.4	Y60 W154 P164 T170 Q171 M172 T173 L174	Y60-I138 HydrophobicContact CD1-CD1 4.42Å; Y60-I138 HydrophobicContact CD1-CG1 4.11Å; Y60-I138 HydrophobicContact CD1-CG2 4.25Å; Y60-I138 VanDerWaalsContact O-CA 3.3Å; Y60-I138 WeakPolarHBondContact O-CA 3.2Å; I138-W154 HydrophobicContact CG2-CH2 3.47Å; I138-W154 VanDerWaalsContact CG2-CH2 3.47Å; I138-W154 HydrophobicContact CG2-CZ2 4.15Å; I138-W154 HydrophobicContact CG2-CZ3 3.9Å; I138-P164 HydrophobicContact CD1-CB 3.45Å; I138-P164 VanDerWaalsContact CD1-CB 3.45Å; I138-P164 HydrophobicContact CD1-CG 4Å; I138-T170 HydrophobicContact CD1-CG2 3.89Å; I138-T170 HydrophobicContact CG1-CG2 3.83Å; I138-Q171 PolarHBondContact N-O 3.25Å; I138-M172 HydrophobicContact CB-CB 4.45Å; I138-M172 HydrophobicContact CB-CG 3.99Å; I138-M172 HydrophobicContact CD1-CG 3.99Å; I138-M172 HydrophobicContact CG1-CG 4.45Å; I138-M172 HydrophobicContact CG2-CG 4.49Å; I138-M172 CarbonylContact O-C 3.56Å; I138-M172 WeakPolarHBondContact O-CA 3.34Å; I138-T173 PolarHBondContact O-N 2.66Å; I138-L174 HydrophobicContact CG2-CD2 4.45Å
139	I	98.6	Very high	94.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.8	-178.7	-54.3	-178.2	0	0	0	109	I47 A51 L54 V59 Y60 E61 V62 I69 I73 T173	I47-I139 HydrophobicContact CG2-CG2 4.24Å; A51-I139 HydrophobicContact CB-CD1 3.72Å; A51-I139 HydrophobicContact CB-CG1 4.23Å; L54-I139 HydrophobicContact CD1-CD1 3.74Å; V59-I139 HydrophobicContact CG1-CB 4.49Å; V59-I139 HydrophobicContact CG1-CD1 3.95Å; V59-I139 HydrophobicContact CG1-CG1 4.1Å; Y60-I139 PolarHBondContact O-N 2.91Å; E61-I139 WeakPolarHBondContact CA-O 3.46Å; V62-I139 PolarHBondContact N-O 3.45Å; I69-I139 HydrophobicContact CG2-CG2 3.78Å; I73-I139 HydrophobicContact CD1-CB 4.32Å; I73-I139 HydrophobicContact CD1-CD1 4.2Å; I73-I139 HydrophobicContact CD1-CG2 4.45Å; I73-I139 HydrophobicContact CG1-CD1 4.23Å; I139-T173 WeakPolarHBondContact CA-O 3.28Å
140	G	96.4	Very high	94.5	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	138.9	-179.3	0	0	0	0	0	115	T173 L174 T175	G140-T173 PolarHBondContact N-O 3.24Å; G140-T173 VanDerWaalsContact N-O 3.09Å; G140-L174 WeakPolarHBondContact O-CA 3.36Å; G140-T175 PolarHBondContact O-N 2.86Å
141	N	94.6	Very high	94.5	Very high	27 Å²	27	29.2 Å²	29.2	14%	0.144	17%	0.171	C	C	.	.			trans	-112.8	78.3	164.2	176.7	60.3	0	0	0	109.8	N36 I69 T175	N36-N141 PolarHBondContact O-ND2 3.09Å; N36-N141 VanDerWaalsContact O-ND2 3.11Å; I69-N141 HydrophobicContact CD1-CB 3.53Å; N141-T175 VanDerWaalsContact CA-OG1 3.3Å; N141-T175 WeakPolarHBondContact CA-OG1 3.45Å; N141-T175 HydrophobicContact CB-CG2 4.06Å; N141-T175 WeakPolarHBondContact OD1-CG2 3.36Å; N141-T175 PolarHBondContact OD1-OG1 3.17Å
142	L	87.8	Confident	94.5	Very high	12 Å²	12	27.6 Å²	27.6	6%	0.063	16%	0.162	C	C	.	.			trans	-86.2	153.9	-172.4	-71	171.5	0	0	0	112.6	V62 V112 V146 L150	V62-L142 HydrophobicContact CB-CD1 4.19Å; V62-L142 HydrophobicContact CB-CD2 4.07Å; V62-L142 HydrophobicContact CB-CG 4.36Å; V62-L142 HydrophobicContact CG2-CD1 3.6Å; V62-L142 HydrophobicContact CG2-CD2 4.09Å; V62-L142 HydrophobicContact CG2-CG 3.83Å; V62-L142 WeakPolarHBondContact O-CD2 3.37Å; V112-L142 HydrophobicContact CG2-CD2 4.39Å; L142-V146 HydrophobicContact CD1-CG1 4.39Å; L142-L150 HydrophobicContact CD1-CD2 3.23Å
143	P	87.5	Confident	94.5	Very high	21 Å²	21	25 Å²	25	14%	0.136	15%	0.145	C	C	.	.			trans	-51.6	142.4	163.6	-25.4	35	0	0	0	111.5	L33 Q35 S145 V146 S147	L33-P143 WeakPolarHBondContact O-CB 3.34Å; L33-P143 WeakPolarHBondContact O-CG 3.3Å; Q35-P143 HydrophobicContact CG-CG 4.23Å; P143-S145 VanDerWaalsContact C-N 3.25Å; P143-S145 PolarHBondContact O-N 2.99Å; P143-V146 HydrophobicContact CB-CG2 4.22Å; P143-V146 HydrophobicContact CG-CG2 4.48Å; P143-V146 PolarHBondContact O-N 3.48Å; P143-S147 PolarHBondContact O-N 2.81Å
144	F	86.3	Confident	94.6	Very high	30 Å²	30	23.6 Å²	23.6	13%	0.132	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-34.9	-174.5	-55.3	-40	0	0	0	113.1	V146 S147 Q177 P221 V223 V225	F144-V146 PolarHBondContact O-N 2.84Å; F144-S147 PolarHBondContact O-OG 3.34Å; F144-Q177 HydrophobicContact CB-CG 3.81Å; F144-Q177 HydrophobicContact CD1-CB 4.47Å; F144-Q177 HydrophobicContact CD1-CG 3.44Å; F144-Q177 VanDerWaalsContact CD1-CG 3.44Å; F144-Q177 HydrophobicContact CD2-CG 3.32Å; F144-Q177 VanDerWaalsContact CD2-NE2 3.27Å; F144-Q177 HydrophobicContact CE1-CG 3.72Å; F144-Q177 HydrophobicContact CE2-CG 3.6Å; F144-Q177 HydrophobicContact CG-CG 3.23Å; F144-Q177 HydrophobicContact CZ-CG 3.8Å; F144-P221 HydrophobicContact CE2-CB 3.98Å; F144-P221 HydrophobicContact CZ-CB 4.28Å; F144-V223 HydrophobicContact CE2-CG2 4.24Å; F144-V225 HydrophobicContact CE1-CG2 4.06Å; F144-V225 HydrophobicContact CZ-CG2 3.73Å
145	S	87.5	Confident	94.7	Very high	77 Å²	77	23.5 Å²	23.5	54%	0.538	13%	0.134	S	C	.	.	H	α-helix	trans	-63.1	-24.7	174.7	53.2	0	0	0	0	113.7	P143 P149	P143-S145 VanDerWaalsContact C-N 3.25Å; P143-S145 PolarHBondContact O-N 2.99Å; S145-P149 VanDerWaalsContact O-CD 3.24Å; S145-P149 WeakPolarHBondContact O-CD 3.09Å; S145-P149 VanDerWaalsContact O-CG 3.23Å; S145-P149 WeakPolarHBondContact O-CG 3.43Å
146	V	91.8	Very high	94.8	Very high	33 Å²	33	22.9 Å²	22.9	20%	0.2	13%	0.129	C	C	.	.	H	α-helix	trans	-97.4	-38.5	-179.5	-178.3	0	0	0	0	111.4	V112 L113 L142 P143 F144 T148 P149 L150	V112-V146 HydrophobicContact CG2-CG1 3.91Å; L113-V146 HydrophobicContact CD1-CG1 4.5Å; L113-V146 HydrophobicContact CD2-CG1 4.47Å; L113-V146 HydrophobicContact CG-CG1 4.31Å; L142-V146 HydrophobicContact CD1-CG1 4.39Å; P143-V146 HydrophobicContact CB-CG2 4.22Å; P143-V146 HydrophobicContact CG-CG2 4.48Å; P143-V146 PolarHBondContact O-N 3.48Å; F144-V146 PolarHBondContact O-N 2.84Å; V146-T148 PolarHBondContact O-N 2.89Å; V146-P149 WeakPolarHBondContact O-CD 3.49Å; V146-P149 VanDerWaalsContact O-CG 3.28Å; V146-P149 WeakPolarHBondContact O-CG 3.4Å; V146-L150 VanDerWaalsContact O-CB 3.23Å; V146-L150 WeakPolarHBondContact O-CB 3.2Å; V146-L150 PolarHBondContact O-N 3.04Å
147	S	93.2	Very high	94.8	Very high	6 Å²	6	23.7 Å²	23.7	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-56.5	-43.8	-175.6	64.1	0	0	0	0	113.7	P143 F144 I151	P143-S147 PolarHBondContact O-N 2.81Å; F144-S147 PolarHBondContact O-OG 3.34Å; S147-I151 WeakPolarHBondContact O-CG2 3.46Å; S147-I151 PolarHBondContact O-N 2.81Å
148	T	92.5	Very high	94.8	Very high	45 Å²	45	23.6 Å²	23.6	28%	0.276	13%	0.133	S	C	.	.	H	α-helix	trans	-69.7	-50.7	-177.4	-60.1	0	0	0	0	113.4	V146 L150 I151 I152	V146-T148 PolarHBondContact O-N 2.89Å; T148-L150 VanDerWaalsContact C-N 3.28Å; T148-L150 PolarHBondContact O-N 2.82Å; T148-I151 VanDerWaalsContact O-CG2 3.28Å; T148-I151 WeakPolarHBondContact O-CG2 3.42Å; T148-I152 HydrophobicContact CG2-CD1 4.12Å; T148-I152 WeakPolarHBondContact O-CG1 3.14Å; T148-I152 PolarHBondContact O-N 2.78Å
149	P	94.9	Very high	94.8	Very high	56 Å²	56	25.2 Å²	25.2	36%	0.364	15%	0.145	S	C	.	.	H	α-helix	trans	-63.7	-34.9	174.8	22.8	-31.9	0	0	0	112.1	L113 S145 V146 I152 K153	L113-P149 HydrophobicContact CD2-CB 4.47Å; S145-P149 VanDerWaalsContact O-CD 3.24Å; S145-P149 WeakPolarHBondContact O-CD 3.09Å; S145-P149 VanDerWaalsContact O-CG 3.23Å; S145-P149 WeakPolarHBondContact O-CG 3.43Å; V146-P149 WeakPolarHBondContact O-CD 3.49Å; V146-P149 VanDerWaalsContact O-CG 3.28Å; V146-P149 WeakPolarHBondContact O-CG 3.4Å; P149-I152 PolarHBondContact O-N 3.27Å; P149-K153 PolarHBondContact O-N 2.97Å
150	L	96.6	Very high	94.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-45.7	178.7	-172.8	66	0	0	0	112.2	V62 V112 L113 L142 V146 T148 I152 K153 W154	V62-L150 HydrophobicContact CG2-CD2 4.48Å; V112-L150 HydrophobicContact CG2-CD2 4.07Å; L113-L150 HydrophobicContact CD2-CB 3.99Å; L113-L150 HydrophobicContact CD2-CD1 4Å; L142-L150 HydrophobicContact CD1-CD2 3.23Å; V146-L150 VanDerWaalsContact O-CB 3.23Å; V146-L150 WeakPolarHBondContact O-CB 3.2Å; V146-L150 PolarHBondContact O-N 3.04Å; T148-L150 VanDerWaalsContact C-N 3.28Å; T148-L150 PolarHBondContact O-N 2.82Å; L150-I152 VanDerWaalsContact C-N 3.3Å; L150-I152 PolarHBondContact O-N 3.49Å; L150-K153 WeakPolarHBondContact O-CB 3.18Å; L150-K153 PolarHBondContact O-N 2.85Å; L150-W154 HydrophobicContact CD1-CD2 4.22Å; L150-W154 HydrophobicContact CD1-CH2 4.36Å; L150-W154 HydrophobicContact CD1-CZ2 3.82Å; L150-W154 HydrophobicContact CD2-CE3 4.29Å; L150-W154 HydrophobicContact CD2-CH2 3.38Å; L150-W154 HydrophobicContact CD2-CZ2 3.67Å; L150-W154 HydrophobicContact CD2-CZ3 3.71Å; L150-W154 HydrophobicContact CG-CD2 3.93Å; L150-W154 HydrophobicContact CG-CE3 3.95Å; L150-W154 HydrophobicContact CG-CH2 3.84Å; L150-W154 HydrophobicContact CG-CZ2 3.8Å; L150-W154 HydrophobicContact CG-CZ3 3.9Å; L150-W154 PolarHBondContact O-N 2.8Å
151	I	97.8	Very high	94.8	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-34.2	177.2	-168.4	58	0	0	0	111.6	S147 T148 W154 L155 M172 L174 F176 F230	S147-I151 WeakPolarHBondContact O-CG2 3.46Å; S147-I151 PolarHBondContact O-N 2.81Å; T148-I151 VanDerWaalsContact O-CG2 3.28Å; T148-I151 WeakPolarHBondContact O-CG2 3.42Å; I151-W154 PolarHBondContact O-N 2.63Å; I151-L155 HydrophobicContact CG1-CD1 4.39Å; I151-L155 HydrophobicContact CG1-CG 4.4Å; I151-L155 WeakPolarHBondContact O-CB 3.26Å; I151-L155 WeakPolarHBondContact O-CG 3.38Å; I151-L155 PolarHBondContact O-N 3Å; I151-M172 HydrophobicContact CD1-CE 4.35Å; I151-M172 HydrophobicContact CD1-SD 4.11Å; I151-L174 HydrophobicContact CD1-CD1 4.08Å; I151-F176 HydrophobicContact CB-CE1 4.17Å; I151-F176 HydrophobicContact CB-CZ 4.04Å; I151-F176 HydrophobicContact CG1-CZ 4.24Å; I151-F176 HydrophobicContact CG2-CE1 3.87Å; I151-F176 HydrophobicContact CG2-CZ 4.16Å; I151-F230 HydrophobicContact CD1-CD1 4.33Å; I151-F230 HydrophobicContact CD1-CE1 4.02Å; I151-F230 HydrophobicContact CD1-CE2 4.31Å; I151-F230 HydrophobicContact CD1-CZ 4Å; I151-F230 HydrophobicContact CG1-CE1 4.16Å; I151-F230 HydrophobicContact CG1-CZ 4.07Å
152	I	96.9	Very high	95	Very high	33 Å²	33	36.6 Å²	36.6	17%	0.169	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-46	174.5	-69.1	164.9	0	0	0	110.6	T148 P149 L150 W154 L155 E156 L196 F242	T148-I152 HydrophobicContact CG2-CD1 4.12Å; T148-I152 WeakPolarHBondContact O-CG1 3.14Å; T148-I152 PolarHBondContact O-N 2.78Å; P149-I152 PolarHBondContact O-N 3.27Å; L150-I152 VanDerWaalsContact C-N 3.3Å; L150-I152 PolarHBondContact O-N 3.49Å; I152-W154 VanDerWaalsContact C-N 3.32Å; I152-W154 PolarHBondContact O-N 3Å; I152-L155 PolarHBondContact O-N 2.94Å; I152-E156 PolarHBondContact O-N 3.24Å; I152-L196 HydrophobicContact CG1-CD1 4.32Å; I152-F242 HydrophobicContact CG2-CZ 4.36Å
153	K	97.8	Very high	95.4	Very high	65 Å²	65	36.1 Å²	36.1	28%	0.283	20%	0.199	S	C	.	.	H	α-helix	trans	-57.5	-45.7	174.5	-178.3	-171.9	173.3	-167.7	0	111.1	L113 P149 L150 E156 N157	L113-K153 PolarHBondContact O-NZ 3.14Å; P149-K153 PolarHBondContact O-N 2.97Å; L150-K153 WeakPolarHBondContact O-CB 3.18Å; L150-K153 PolarHBondContact O-N 2.85Å; K153-E156 WeakPolarHBondContact O-CB 3.27Å; K153-E156 PolarHBondContact O-N 2.97Å; K153-N157 PolarHBondContact O-N 3.4Å; K153-N157 PolarHBondContact O-OD1 2.87Å
154	W	98.5	Very high	95.8	Very high	6 Å²	6	35.5 Å²	35.5	2%	0.023	20%	0.195	C	C	.	.	H	α-helix	trans	-69.4	-32.1	178.9	-73	-21.4	0	0	0	113.8	Y60 V62 I138 L150 I151 I152 E156 N157 I158 F165 M172 L174	Y60-W154 HydrophobicContact CE1-CZ2 4.22Å; V62-W154 HydrophobicContact CG1-CH2 3.8Å; V62-W154 HydrophobicContact CG1-CZ2 4.04Å; V62-W154 HydrophobicContact CG2-CH2 4.05Å; I138-W154 HydrophobicContact CG2-CH2 3.47Å; I138-W154 VanDerWaalsContact CG2-CH2 3.47Å; I138-W154 HydrophobicContact CG2-CZ2 4.15Å; I138-W154 HydrophobicContact CG2-CZ3 3.9Å; L150-W154 HydrophobicContact CD1-CD2 4.22Å; L150-W154 HydrophobicContact CD1-CH2 4.36Å; L150-W154 HydrophobicContact CD1-CZ2 3.82Å; L150-W154 HydrophobicContact CD2-CE3 4.29Å; L150-W154 HydrophobicContact CD2-CH2 3.38Å; L150-W154 HydrophobicContact CD2-CZ2 3.67Å; L150-W154 HydrophobicContact CD2-CZ3 3.71Å; L150-W154 HydrophobicContact CG-CD2 3.93Å; L150-W154 HydrophobicContact CG-CE3 3.95Å; L150-W154 HydrophobicContact CG-CH2 3.84Å; L150-W154 HydrophobicContact CG-CZ2 3.8Å; L150-W154 HydrophobicContact CG-CZ3 3.9Å; L150-W154 PolarHBondContact O-N 2.8Å; I151-W154 PolarHBondContact O-N 2.63Å; I152-W154 VanDerWaalsContact C-N 3.32Å; I152-W154 PolarHBondContact O-N 3Å; W154-E156 VanDerWaalsContact C-N 3.31Å; W154-N157 CarbonylContact O-C 3.57Å; W154-N157 PolarHBondContact O-N 3.27Å; W154-I158 WeakPolarHBondContact O-CD1 3.49Å; W154-I158 VanDerWaalsContact O-CG1 3.26Å; W154-I158 WeakPolarHBondContact O-CG1 3.48Å; W154-I158 PolarHBondContact O-N 2.81Å; W154-F165 HydrophobicContact CB-CE2 3.9Å; W154-F165 HydrophobicContact CB-CZ 4.04Å; W154-F165 HydrophobicContact CG-CE2 4.24Å; W154-F165 HydrophobicContact CG-CZ 4.43Å; W154-F165 VanDerWaalsContact O-CE2 3.23Å; W154-F165 WeakPolarHBondContact O-CE2 3.21Å; W154-M172 HydrophobicContact CB-SD 4.25Å; W154-M172 HydrophobicContact CD2-SD 4.19Å; W154-M172 HydrophobicContact CE3-SD 3.59Å; W154-M172 VanDerWaalsContact CE3-SD 3.59Å; W154-M172 HydrophobicContact CZ3-SD 4.24Å; W154-L174 HydrophobicContact CE3-CD1 4.04Å; W154-L174 HydrophobicContact CH2-CD2 4.49Å; W154-L174 HydrophobicContact CZ3-CD1 3.65Å; W154-L174 HydrophobicContact CZ3-CD2 3.91Å; W154-L174 HydrophobicContact CZ3-CG 4.4Å
155	L	98.7	Very high	96.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-39.2	170.2	-70.6	170.3	0	0	0	111.2	I151 I152 N157 I158 S159 M199 A200 L203 F242	I151-L155 HydrophobicContact CG1-CD1 4.39Å; I151-L155 HydrophobicContact CG1-CG 4.4Å; I151-L155 WeakPolarHBondContact O-CB 3.26Å; I151-L155 WeakPolarHBondContact O-CG 3.38Å; I151-L155 PolarHBondContact O-N 3Å; I152-L155 PolarHBondContact O-N 2.94Å; L155-N157 VanDerWaalsContact C-N 3.34Å; L155-I158 HydrophobicContact CD2-CD1 4.1Å; L155-I158 PolarHBondContact O-N 2.88Å; L155-S159 PolarHBondContact O-N 3.04Å; L155-M199 HydrophobicContact CD1-CB 4.23Å; L155-A200 HydrophobicContact CD1-CB 4.08Å; L155-A200 HydrophobicContact CD2-CB 4.37Å; L155-L203 HydrophobicContact CB-CD1 3.93Å; L155-L203 HydrophobicContact CD2-CB 4.25Å; L155-L203 HydrophobicContact CD2-CD1 4.06Å; L155-L203 WeakPolarHBondContact O-CD1 3.22Å; L155-F242 HydrophobicContact CB-CE2 3.88Å; L155-F242 HydrophobicContact CB-CZ 4.42Å
156	E	98.5	Very high	96.9	Very high	52 Å²	52	32.4 Å²	32.4	24%	0.243	18%	0.175	C	C	.	.	H	α-helix	trans	-62.2	-43.4	170.7	-175.8	161.3	-146.7	0	0	111.1	I152 K153 W154 I158 S159 C160 F242 K243	I152-E156 PolarHBondContact O-N 3.24Å; K153-E156 WeakPolarHBondContact O-CB 3.27Å; K153-E156 PolarHBondContact O-N 2.97Å; W154-E156 VanDerWaalsContact C-N 3.31Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 3.23Å; E156-S159 WeakPolarHBondContact O-CB 3.35Å; E156-S159 PolarHBondContact O-N 3.24Å; E156-S159 VanDerWaalsContact O-N 3.11Å; E156-C160 PolarHBondContact O-N 2.53Å; E156-C160 PolarHBondContact O-SG 3.2Å; E156-F242 HydrophobicContact CB-CD1 3.82Å; E156-F242 HydrophobicContact CB-CD2 4.08Å; E156-F242 HydrophobicContact CB-CE1 3.84Å; E156-F242 HydrophobicContact CB-CE2 4.09Å; E156-F242 HydrophobicContact CB-CG 3.95Å; E156-F242 HydrophobicContact CB-CZ 3.97Å; E156-F242 HydrophobicContact CG-CB 4.33Å; E156-F242 HydrophobicContact CG-CD1 3.8Å; E156-F242 HydrophobicContact CG-CE1 4.26Å; E156-F242 HydrophobicContact CG-CG 3.98Å; E156-K243 WeakPolarHBondContact OE1-CE 3.36Å; E156-K243 IonicContact OE1-NZ 3.22Å; E156-K243 PolarHBondContact OE1-NZ 3.08Å; E156-K243 IonicContact OE2-NZ 3.82Å; E156-K243 PolarHBondContact OE2-NZ 2.96Å
157	N	98.5	Very high	97.2	Very high	20 Å²	20	30.9 Å²	30.9	11%	0.107	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-34	176.8	-63.6	140.3	0	0	0	113.3	K153 W154 L155 S159 C160 R161 D162 F165	K153-N157 PolarHBondContact O-N 3.4Å; K153-N157 PolarHBondContact O-OD1 2.87Å; W154-N157 CarbonylContact O-C 3.57Å; W154-N157 PolarHBondContact O-N 3.27Å; L155-N157 VanDerWaalsContact C-N 3.34Å; N157-S159 VanDerWaalsContact C-N 3.35Å; N157-C160 CarbonylContact O-C 3.36Å; N157-C160 PolarHBondContact O-N 3.31Å; N157-R161 VanDerWaalsContact O-CA 3.29Å; N157-R161 WeakPolarHBondContact O-CA 3.34Å; N157-R161 PolarHBondContact O-N 2.89Å; N157-D162 WeakPolarHBondContact CA-OD1 3.42Å; N157-D162 WeakPolarHBondContact CB-OD1 3.4Å; N157-D162 PolarHBondContact ND2-OD1 3.23Å; N157-D162 PolarHBondContact O-N 3.1Å; N157-F165 HydrophobicContact CB-CD2 3.65Å; N157-F165 HydrophobicContact CB-CE2 3.86Å
158	I	98.7	Very high	97.5	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-44.4	171.8	-70.6	157.5	0	0	0	110.1	W129 W154 L155 E156 C160 R161 F165 M172 L203 C204 P232	W129-I158 HydrophobicContact CH2-CG2 4.02Å; W129-I158 HydrophobicContact CZ2-CG2 4.09Å; W154-I158 WeakPolarHBondContact O-CD1 3.49Å; W154-I158 VanDerWaalsContact O-CG1 3.26Å; W154-I158 WeakPolarHBondContact O-CG1 3.48Å; W154-I158 PolarHBondContact O-N 2.81Å; L155-I158 HydrophobicContact CD2-CD1 4.1Å; L155-I158 PolarHBondContact O-N 2.88Å; E156-I158 VanDerWaalsContact C-N 3.33Å; E156-I158 PolarHBondContact O-N 3.23Å; I158-C160 VanDerWaalsContact C-N 3.28Å; I158-C160 PolarHBondContact O-N 3.23Å; I158-R161 PolarHBondContact O-N 2.9Å; I158-F165 HydrophobicContact CB-CD2 4.48Å; I158-F165 HydrophobicContact CD1-CE1 3.85Å; I158-F165 HydrophobicContact CD1-CE2 4.17Å; I158-F165 HydrophobicContact CD1-CZ 3.66Å; I158-F165 HydrophobicContact CG1-CD1 3.65Å; I158-F165 HydrophobicContact CG1-CD2 3.68Å; I158-F165 HydrophobicContact CG1-CE1 3.44Å; I158-F165 VanDerWaalsContact CG1-CE1 3.44Å; I158-F165 HydrophobicContact CG1-CE2 3.5Å; I158-F165 HydrophobicContact CG1-CG 3.77Å; I158-F165 HydrophobicContact CG1-CZ 3.37Å; I158-M172 HydrophobicContact CD1-CE 3.66Å; I158-L203 HydrophobicContact CG2-CB 3.96Å; I158-L203 HydrophobicContact CG2-CD2 4.19Å; I158-L203 HydrophobicContact CG2-CG 4.45Å; I158-C204 VanDerWaalsContact CD1-SG 3.52Å; I158-P232 HydrophobicContact CD1-CG 4.13Å; I158-P232 HydrophobicContact CG1-CB 4.49Å; I158-P232 HydrophobicContact CG1-CG 4.13Å; I158-P232 HydrophobicContact CG2-CB 4.08Å
159	S	98.4	Very high	97.7	Very high	37 Å²	37	29.6 Å²	29.6	26%	0.259	16%	0.156	S	C	.	.	H	α-helix	trans	-62.1	-37	177.8	-174.3	0	0	0	0	112.2	L155 E156 N157	L155-S159 PolarHBondContact O-N 3.04Å; E156-S159 WeakPolarHBondContact O-CB 3.35Å; E156-S159 PolarHBondContact O-N 3.24Å; E156-S159 VanDerWaalsContact O-N 3.11Å; N157-S159 VanDerWaalsContact C-N 3.35Å
160	C	97.5	Very high	97.9	Very high	80 Å²	80	27 Å²	27	54%	0.541	14%	0.139	S	C	.	.	H	α-helix	trans	-87.8	-9	178.2	-64.2	0	0	0	0	113.5	E156 N157 I158 D162	E156-C160 PolarHBondContact O-N 2.53Å; E156-C160 PolarHBondContact O-SG 3.2Å; N157-C160 CarbonylContact O-C 3.36Å; N157-C160 PolarHBondContact O-N 3.31Å; I158-C160 VanDerWaalsContact C-N 3.28Å; I158-C160 PolarHBondContact O-N 3.23Å; C160-D162 HydrophobicContact CB-CB 4.47Å; C160-D162 PolarHBondContact O-N 2.9Å
161	R	97.5	Very high	98	Very high	124 Å²	124	28.8 Å²	28.8	47%	0.468	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	38.2	-172.6	-52.7	179.7	-179.3	-173	-5.8	112.9	W129 N157 I158	W129-R161 HydrophobicContact CD2-CG 4.27Å; W129-R161 HydrophobicContact CE3-CB 4.33Å; W129-R161 HydrophobicContact CE3-CG 4.01Å; W129-R161 HydrophobicContact CH2-CG 4.22Å; W129-R161 HydrophobicContact CZ2-CG 4.48Å; W129-R161 HydrophobicContact CZ3-CB 4.19Å; W129-R161 HydrophobicContact CZ3-CG 3.98Å; N157-R161 VanDerWaalsContact O-CA 3.29Å; N157-R161 WeakPolarHBondContact O-CA 3.34Å; N157-R161 PolarHBondContact O-N 2.89Å; I158-R161 PolarHBondContact O-N 2.9Å
162	D	97.4	Very high	98	Very high	64 Å²	64	28.8 Å²	28.8	34%	0.342	15%	0.147	S	C	.	.			trans	-120.2	-168.5	179.9	72	-5.7	0	0	0	112	N157 C160 F165	N157-D162 WeakPolarHBondContact CA-OD1 3.42Å; N157-D162 WeakPolarHBondContact CB-OD1 3.4Å; N157-D162 PolarHBondContact ND2-OD1 3.23Å; N157-D162 PolarHBondContact O-N 3.1Å; C160-D162 HydrophobicContact CB-CB 4.47Å; C160-D162 PolarHBondContact O-N 2.9Å; D162-F165 WeakPolarHBondContact O-CB 3.46Å; D162-F165 WeakPolarHBondContact O-CD2 3.49Å; D162-F165 PolarHBondContact O-N 3.21Å
163	G	96.8	Very high	98.1	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.021	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	60	-133.3	179.7	0	0	0	0	0	112.1	E118 F165 V166	E118-G163 WeakPolarHBondContact CG-O 3.42Å; E118-G163 WeakPolarHBondContact OE1-CA 3.31Å; G163-F165 PolarHBondContact O-N 2.94Å; G163-V166 WeakPolarHBondContact O-CG1 3.43Å; G163-V166 WeakPolarHBondContact O-CG2 3.41Å; G163-V166 PolarHBondContact O-N 3.01Å
164	P	97.1	Very high	98.1	Very high	8 Å²	8	24.5 Å²	24.5	5%	0.052	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-63.3	-11.2	176.2	-15	27	0	0	0	115.2	V117 I138 T170	V117-P164 HydrophobicContact CG1-CB 3.67Å; V117-P164 HydrophobicContact CG1-CG 3.69Å; I138-P164 HydrophobicContact CD1-CB 3.45Å; I138-P164 VanDerWaalsContact CD1-CB 3.45Å; I138-P164 HydrophobicContact CD1-CG 4Å; P164-T170 PolarHBondContact O-OG1 3.08Å
165	F	98.4	Very high	98	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.009	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-97.3	3.5	-174.9	-49.5	-76.5	0	0	0	112.8	W129 W154 N157 I158 D162 G163 Y167 G168 M172 P232	W129-F165 HydrophobicContact CH2-CB 4.31Å; W129-F165 HydrophobicContact CZ3-CB 3.98Å; W154-F165 HydrophobicContact CB-CE2 3.9Å; W154-F165 HydrophobicContact CB-CZ 4.04Å; W154-F165 HydrophobicContact CG-CE2 4.24Å; W154-F165 HydrophobicContact CG-CZ 4.43Å; W154-F165 VanDerWaalsContact O-CE2 3.23Å; W154-F165 WeakPolarHBondContact O-CE2 3.21Å; N157-F165 HydrophobicContact CB-CD2 3.65Å; N157-F165 HydrophobicContact CB-CE2 3.86Å; I158-F165 HydrophobicContact CB-CD2 4.48Å; I158-F165 HydrophobicContact CD1-CE1 3.85Å; I158-F165 HydrophobicContact CD1-CE2 4.17Å; I158-F165 HydrophobicContact CD1-CZ 3.66Å; I158-F165 HydrophobicContact CG1-CD1 3.65Å; I158-F165 HydrophobicContact CG1-CD2 3.68Å; I158-F165 HydrophobicContact CG1-CE1 3.44Å; I158-F165 VanDerWaalsContact CG1-CE1 3.44Å; I158-F165 HydrophobicContact CG1-CE2 3.5Å; I158-F165 HydrophobicContact CG1-CG 3.77Å; I158-F165 HydrophobicContact CG1-CZ 3.37Å; D162-F165 WeakPolarHBondContact O-CB 3.46Å; D162-F165 WeakPolarHBondContact O-CD2 3.49Å; D162-F165 PolarHBondContact O-N 3.21Å; G163-F165 PolarHBondContact O-N 2.94Å; F165-Y167 PolarHBondContact O-N 3.3Å; F165-G168 WeakPolarHBondContact CA-O 3.45Å; F165-G168 PolarHBondContact O-N 3.17Å; F165-M172 HydrophobicContact CE1-CE 3.87Å; F165-M172 HydrophobicContact CE1-SD 4.32Å; F165-M172 HydrophobicContact CZ-CE 3.7Å; F165-M172 HydrophobicContact CZ-SD 3.82Å; F165-P232 HydrophobicContact CD1-CG 4.04Å; F165-P232 HydrophobicContact CE1-CG 3.95Å
166	V	97.9	Very high	97.9	Very high	39 Å²	39	24.2 Å²	24.2	24%	0.236	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-61.8	-20.4	165.9	-59.1	0	0	0	0	112.6	E118 K126 G163 G168	E118-V166 HydrophobicContact CB-CG1 4.5Å; E118-V166 HydrophobicContact CB-CG2 4.12Å; E118-V166 HydrophobicContact CG-CG1 3.96Å; E118-V166 HydrophobicContact CG-CG2 4.28Å; K126-V166 WeakPolarHBondContact CD-O 3.4Å; K126-V166 WeakPolarHBondContact CG-O 3.42Å; G163-V166 WeakPolarHBondContact O-CG1 3.43Å; G163-V166 WeakPolarHBondContact O-CG2 3.41Å; G163-V166 PolarHBondContact O-N 3.01Å; V166-G168 VanDerWaalsContact C-N 3.29Å
167	Y	98.1	Very high	97.8	Very high	2 Å²	2	25 Å²	25	1%	0.008	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-80.9	-7.8	174	-61.1	-75.8	0	0	0	113.4	V117 E118 A120 F121 L125 K126 R127 P134 V136 F165	V117-Y167 PolarHBondContact O-OH 2.96Å; E118-Y167 PolarHBondContact O-OH 2.92Å; A120-Y167 PolarHBondContact N-OH 2.94Å; F121-Y167 WeakPolarHBondContact CA-OH 3.42Å; F121-Y167 HydrophobicContact CB-CE1 4.06Å; F121-Y167 HydrophobicContact CD2-CE2 4.27Å; F121-Y167 PolarHBondContact N-OH 3.22Å; F121-Y167 PolarHBondContact O-OH 2.83Å; L125-Y167 HydrophobicContact CB-CD1 4.2Å; K126-Y167 HydrophobicContact CG-CD1 3.82Å; K126-Y167 HydrophobicContact CG-CE1 4.37Å; R127-Y167 PolarHBondContact N-O 3.32Å; P134-Y167 VanDerWaalsContact CB-O 3.3Å; P134-Y167 WeakPolarHBondContact CB-O 3.5Å; P134-Y167 VanDerWaalsContact CG-O 3.3Å; P134-Y167 WeakPolarHBondContact CG-O 3.3Å; V136-Y167 HydrophobicContact CG2-CD1 4.42Å; V136-Y167 HydrophobicContact CG2-CG 4.2Å; F165-Y167 PolarHBondContact O-N 3.3Å
168	G	98.2	Very high	97.7	Very high	3 Å²	3	27.6 Å²	27.6	3%	0.031	14%	0.141	C	C	.	.	S	Bend	trans	111.8	-152.2	-171.9	0	0	0	0	0	111	F165 V166 T170	F165-G168 WeakPolarHBondContact CA-O 3.45Å; F165-G168 PolarHBondContact O-N 3.17Å; V166-G168 VanDerWaalsContact C-N 3.29Å; G168-T170 PolarHBondContact O-N 2.98Å
169	R	98.3	Very high	97.6	Very high	21 Å²	21	31.7 Å²	31.7	8%	0.079	16%	0.16	C	C	.	.	S	Bend	trans	-78.2	49.7	-176.3	-61.5	-174.9	-59.8	106.1	-1.2	113.2	W129 D131 Q171 P232	W129-R169 HydrophobicContact CD2-CG 3.75Å; W129-R169 HydrophobicContact CE3-CG 4.02Å; W129-R169 HydrophobicContact CG-CG 4.26Å; W129-R169 HydrophobicContact CH2-CG 4.18Å; W129-R169 HydrophobicContact CZ2-CG 3.91Å; W129-R169 HydrophobicContact CZ3-CG 4.23Å; W129-R169 WeakPolarHBondContact O-CD 3.26Å; W129-R169 WeakPolarHBondContact O-CG 3.34Å; W129-R169 PolarHBondContact O-NE 3.11Å; D131-R169 PolarHBondContact O-NE 3.1Å; D131-R169 PolarHBondContact O-NH2 3.44Å; R169-Q171 PolarHBondContact O-N 3.29Å; R169-P232 HydrophobicContact CB-CB 3.95Å; R169-P232 HydrophobicContact CB-CG 4.26Å; R169-P232 WeakPolarHBondContact CD-O 3.34Å; R169-P232 HydrophobicContact CG-CB 4.08Å; R169-P232 PolarHBondContact NH1-O 3.28Å
170	T	98.3	Very high	97.6	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.151	C	C	.	.			trans	-43.9	126.3	178.8	-56.3	0	0	0	0	111.3	V136 I138 P164 G168 P232	V136-T170 HydrophobicContact CB-CG2 4.11Å; V136-T170 HydrophobicContact CG1-CG2 3.81Å; V136-T170 WeakPolarHBondContact O-CG2 2.83Å; I138-T170 HydrophobicContact CD1-CG2 3.89Å; I138-T170 HydrophobicContact CG1-CG2 3.83Å; P164-T170 PolarHBondContact O-OG1 3.08Å; G168-T170 PolarHBondContact O-N 2.98Å; T170-P232 WeakPolarHBondContact O-CD 3.32Å
171	Q	98.2	Very high	97.6	Very high	39 Å²	39	26.7 Å²	26.7	18%	0.182	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.7	-175.9	-62.8	-178	-57.5	0	0	111.3	P133 H137 I138 R169 T231	P133-Q171 HydrophobicContact CB-CG 4.03Å; P133-Q171 HydrophobicContact CG-CG 4.35Å; H137-Q171 PolarHBondContact CE1-OE1 3.34Å; I138-Q171 PolarHBondContact N-O 3.25Å; R169-Q171 PolarHBondContact O-N 3.29Å; Q171-T231 HydrophobicContact CG-CG2 4.28Å; Q171-T231 PolarHBondContact NE2-OG1 3.13Å
172	M	98.6	Very high	97.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.9	178.7	-59.3	170.6	-84.8	0	0	111.2	I138 I151 W154 I158 F165 L174 H229 F230	I138-M172 HydrophobicContact CB-CB 4.45Å; I138-M172 HydrophobicContact CB-CG 3.99Å; I138-M172 HydrophobicContact CD1-CG 3.99Å; I138-M172 HydrophobicContact CG1-CG 4.45Å; I138-M172 HydrophobicContact CG2-CG 4.49Å; I138-M172 CarbonylContact O-C 3.56Å; I138-M172 WeakPolarHBondContact O-CA 3.34Å; I151-M172 HydrophobicContact CD1-CE 4.35Å; I151-M172 HydrophobicContact CD1-SD 4.11Å; W154-M172 HydrophobicContact CB-SD 4.25Å; W154-M172 HydrophobicContact CD2-SD 4.19Å; W154-M172 HydrophobicContact CE3-SD 3.59Å; W154-M172 VanDerWaalsContact CE3-SD 3.59Å; W154-M172 HydrophobicContact CZ3-SD 4.24Å; I158-M172 HydrophobicContact CD1-CE 3.66Å; F165-M172 HydrophobicContact CE1-CE 3.87Å; F165-M172 HydrophobicContact CE1-SD 4.32Å; F165-M172 HydrophobicContact CZ-CE 3.7Å; F165-M172 HydrophobicContact CZ-SD 3.82Å; M172-L174 HydrophobicContact CB-CD1 4.24Å; M172-L174 HydrophobicContact CB-CG 4.24Å; M172-H229 CarbonylContact O-C 3.56Å; M172-H229 VanDerWaalsContact O-CA 3.31Å; M172-H229 WeakPolarHBondContact O-CA 3.37Å; M172-H229 PolarHBondContact O-ND1 2.82Å; M172-F230 HydrophobicContact CB-CB 4.19Å; M172-F230 HydrophobicContact CB-CD2 4.21Å; M172-F230 HydrophobicContact CE-CB 3.81Å; M172-F230 HydrophobicContact CE-CG 4.32Å; M172-F230 PolarHBondContact N-O 3.41Å; M172-F230 PolarHBondContact O-N 3.03Å
173	T	98.6	Very high	97.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	105.4	170.8	-55.7	0	0	0	0	109.6	I47 A51 I138 I139 G140 V227 H229	I47-T173 HydrophobicContact CG2-CG2 4.1Å; A51-T173 VanDerWaalsContact CA-OG1 3.27Å; A51-T173 WeakPolarHBondContact CA-OG1 3.43Å; A51-T173 HydrophobicContact CB-CG2 4.07Å; A51-T173 WeakPolarHBondContact CB-OG1 3.42Å; I138-T173 PolarHBondContact O-N 2.66Å; I139-T173 WeakPolarHBondContact CA-O 3.28Å; G140-T173 PolarHBondContact N-O 3.24Å; G140-T173 VanDerWaalsContact N-O 3.09Å; T173-V227 HydrophobicContact CG2-CG1 3.95Å; T173-H229 PolarHBondContact OG1-ND1 3.25Å
174	L	98.2	Very high	97.7	Very high	7 Å²	7	24.6 Å²	24.6	4%	0.037	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	151.2	-167.7	-55.7	172	0	0	0	110.9	V62 I138 G140 I151 W154 M172 F176 V228 F230	V62-L174 HydrophobicContact CG2-CD2 4.29Å; I138-L174 HydrophobicContact CG2-CD2 4.45Å; G140-L174 WeakPolarHBondContact O-CA 3.36Å; I151-L174 HydrophobicContact CD1-CD1 4.08Å; W154-L174 HydrophobicContact CE3-CD1 4.04Å; W154-L174 HydrophobicContact CH2-CD2 4.49Å; W154-L174 HydrophobicContact CZ3-CD1 3.65Å; W154-L174 HydrophobicContact CZ3-CD2 3.91Å; W154-L174 HydrophobicContact CZ3-CG 4.4Å; M172-L174 HydrophobicContact CB-CD1 4.24Å; M172-L174 HydrophobicContact CB-CG 4.24Å; L174-F176 HydrophobicContact CB-CD2 4.46Å; L174-F176 HydrophobicContact CB-CE2 3.62Å; L174-F176 HydrophobicContact CB-CZ 3.93Å; L174-F176 HydrophobicContact CD1-CE2 4.39Å; L174-F176 HydrophobicContact CD1-CZ 3.99Å; L174-V228 PolarHBondContact N-O 2.76Å; L174-V228 PolarHBondContact O-N 3.38Å; L174-F230 HydrophobicContact CD1-CE2 4.34Å
175	T	96.8	Very high	97.7	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	145.2	170.9	73.7	0	0	0	0	111.6	I47 G140 N141 V225 G226 V227	I47-T175 HydrophobicContact CD1-CG2 4.37Å; G140-T175 PolarHBondContact O-N 2.86Å; N141-T175 VanDerWaalsContact CA-OG1 3.3Å; N141-T175 WeakPolarHBondContact CA-OG1 3.45Å; N141-T175 HydrophobicContact CB-CG2 4.06Å; N141-T175 WeakPolarHBondContact OD1-CG2 3.36Å; N141-T175 PolarHBondContact OD1-OG1 3.17Å; T175-V225 HydrophobicContact CG2-CG1 4.28Å; T175-G226 WeakPolarHBondContact CA-O 3.25Å; T175-V227 HydrophobicContact CG2-CG2 4.34Å
176	F	96.6	Very high	97.7	Very high	1 Å²	1	26 Å²	26	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	164.6	173.9	-59.7	-88.7	0	0	0	109.8	I151 L174 K178 V180 A181 L184 V225 G226 V228 F230	I151-F176 HydrophobicContact CB-CE1 4.17Å; I151-F176 HydrophobicContact CB-CZ 4.04Å; I151-F176 HydrophobicContact CG1-CZ 4.24Å; I151-F176 HydrophobicContact CG2-CE1 3.87Å; I151-F176 HydrophobicContact CG2-CZ 4.16Å; L174-F176 HydrophobicContact CB-CD2 4.46Å; L174-F176 HydrophobicContact CB-CE2 3.62Å; L174-F176 HydrophobicContact CB-CZ 3.93Å; L174-F176 HydrophobicContact CD1-CE2 4.39Å; L174-F176 HydrophobicContact CD1-CZ 3.99Å; F176-K178 PolarHBondContact O-N 3.09Å; F176-V180 HydrophobicContact CB-CB 3.98Å; F176-V180 HydrophobicContact CB-CG1 3.92Å; F176-V180 HydrophobicContact CD1-CG1 3.78Å; F176-V180 HydrophobicContact CG-CG1 4.04Å; F176-A181 HydrophobicContact CB-CB 4.45Å; F176-L184 HydrophobicContact CD1-CD1 4.28Å; F176-L184 HydrophobicContact CD2-CD1 3.76Å; F176-L184 HydrophobicContact CE1-CD1 4.27Å; F176-L184 HydrophobicContact CE2-CD1 3.76Å; F176-L184 HydrophobicContact CG-CD1 4.03Å; F176-L184 HydrophobicContact CZ-CD1 4.03Å; F176-V225 CarbonylContact O-C 3.52Å; F176-V225 WeakPolarHBondContact O-CA 2.83Å; F176-V225 WeakPolarHBondContact O-CG1 3.05Å; F176-G226 PolarHBondContact N-O 3.3Å; F176-G226 PolarHBondContact O-N 2.62Å; F176-V228 HydrophobicContact CD2-CB 4.12Å; F176-V228 HydrophobicContact CD2-CG2 3.87Å; F176-V228 HydrophobicContact CE2-CB 4.12Å; F176-V228 HydrophobicContact CE2-CG2 4.36Å; F176-F230 AromaticContact CE2-CE2 3.81Å; F176-F230 HydrophobicContact CE2-CE2 3.81Å; F176-F230 AromaticContact CE2-CZ 3.92Å; F176-F230 HydrophobicContact CE2-CZ 3.92Å; F176-F230 HydrophobicContact CZ-CE2 4.25Å; F176-F230 HydrophobicContact CZ-CZ 4.16Å
177	Q	96.1	Very high	97.7	Very high	67 Å²	67	30 Å²	30	31%	0.313	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	142	162.4	-63.4	-178.5	-50.6	0	0	109.6	F144 E179 V180 A181 V223	F144-Q177 HydrophobicContact CB-CG 3.81Å; F144-Q177 HydrophobicContact CD1-CB 4.47Å; F144-Q177 HydrophobicContact CD1-CG 3.44Å; F144-Q177 VanDerWaalsContact CD1-CG 3.44Å; F144-Q177 HydrophobicContact CD2-CG 3.32Å; F144-Q177 VanDerWaalsContact CD2-NE2 3.27Å; F144-Q177 HydrophobicContact CE1-CG 3.72Å; F144-Q177 HydrophobicContact CE2-CG 3.6Å; F144-Q177 HydrophobicContact CG-CG 3.23Å; F144-Q177 HydrophobicContact CZ-CG 3.8Å; Q177-E179 PolarHBondContact O-N 3Å; Q177-E179 VanDerWaalsContact O-N 3.15Å; Q177-V180 HydrophobicContact CB-CB 4.49Å; Q177-V180 HydrophobicContact CB-CG2 4.2Å; Q177-V180 WeakPolarHBondContact O-CA 3.29Å; Q177-V180 WeakPolarHBondContact O-CB 3.45Å; Q177-V180 PolarHBondContact O-N 2.95Å; Q177-A181 PolarHBondContact O-N 3.26Å; Q177-V223 HydrophobicContact CB-CG2 3.97Å; Q177-V223 HydrophobicContact CG-CG2 3.78Å
178	K	96.5	Very high	97.7	Very high	76 Å²	76	33.1 Å²	33.1	33%	0.33	16%	0.163	S	C	.	.	H	α-helix	trans	-49.3	-44.7	-177.9	178.3	178.5	176.4	-178.9	0	112.7	F176 V180 A181 E182 T211 D224	F176-K178 PolarHBondContact O-N 3.09Å; K178-V180 VanDerWaalsContact C-N 3.33Å; K178-V180 PolarHBondContact O-N 3.07Å; K178-A181 PolarHBondContact O-N 3.2Å; K178-E182 WeakPolarHBondContact CE-OE1 3.42Å; K178-E182 HydrophobicContact CG-CG 4.46Å; K178-E182 WeakPolarHBondContact O-CG 3.46Å; K178-E182 PolarHBondContact O-N 3.12Å; K178-T211 HydrophobicContact CD-CG2 4.17Å; K178-T211 HydrophobicContact CG-CG2 4.46Å; K178-D224 HydrophobicContact CB-CB 4.11Å; K178-D224 WeakPolarHBondContact CB-O 3.32Å; K178-D224 HydrophobicContact CD-CB 3.99Å; K178-D224 PolarHBondContact N-O 3.4Å
179	E	96.8	Very high	97.5	Very high	90 Å²	90	35.2 Å²	35.2	42%	0.421	19%	0.185	S	C	.	.	H	α-helix	trans	-62.5	-38.8	178.5	-169.9	-174.2	-179.1	0	0	112.5	Q177 E182 R183	Q177-E179 PolarHBondContact O-N 3Å; Q177-E179 VanDerWaalsContact O-N 3.15Å; E179-E182 PolarHBondContact O-N 3.07Å; E179-R183 WeakPolarHBondContact O-CB 3.18Å; E179-R183 WeakPolarHBondContact O-CG 3.21Å; E179-R183 PolarHBondContact O-N 3.25Å; E179-R183 IonicContact OE1-CZ 3Å; E179-R183 IonicContact OE1-NE 3.43Å; E179-R183 PolarHBondContact OE1-NE 3.03Å; E179-R183 IonicContact OE1-NH2 3.32Å; E179-R183 PolarHBondContact OE1-NH2 2.99Å; E179-R183 IonicContact OE2-NH2 3.03Å
180	V	97.4	Very high	97.5	Very high	13 Å²	13	36.3 Å²	36.3	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-68.3	-41.8	177.3	176.9	0	0	0	0	110.5	F176 Q177 K178 R183 L184 L196	F176-V180 HydrophobicContact CB-CB 3.98Å; F176-V180 HydrophobicContact CB-CG1 3.92Å; F176-V180 HydrophobicContact CD1-CG1 3.78Å; F176-V180 HydrophobicContact CG-CG1 4.04Å; Q177-V180 HydrophobicContact CB-CB 4.49Å; Q177-V180 HydrophobicContact CB-CG2 4.2Å; Q177-V180 WeakPolarHBondContact O-CA 3.29Å; Q177-V180 WeakPolarHBondContact O-CB 3.45Å; Q177-V180 PolarHBondContact O-N 2.95Å; K178-V180 VanDerWaalsContact C-N 3.33Å; K178-V180 PolarHBondContact O-N 3.07Å; V180-R183 WeakPolarHBondContact O-CB 3.33Å; V180-R183 PolarHBondContact O-N 2.94Å; V180-L184 HydrophobicContact CG1-CD1 4.08Å; V180-L184 WeakPolarHBondContact O-CD1 3.49Å; V180-L184 WeakPolarHBondContact O-CG 3.14Å; V180-L184 PolarHBondContact O-N 2.87Å; V180-L196 HydrophobicContact CG1-CD2 3.75Å
181	A	97.9	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-42.9	174.1	0	0	0	0	0	112.5	F176 Q177 K178 L184 T185 V228	F176-A181 HydrophobicContact CB-CB 4.45Å; Q177-A181 PolarHBondContact O-N 3.26Å; K178-A181 PolarHBondContact O-N 3.2Å; A181-L184 PolarHBondContact O-N 3.23Å; A181-T185 PolarHBondContact O-N 2.78Å; A181-T185 PolarHBondContact O-OG1 2.99Å; A181-V228 HydrophobicContact CB-CG2 3.49Å; A181-V228 VanDerWaalsContact CB-CG2 3.49Å
182	E	98.1	Very high	97.3	Very high	57 Å²	57	44.8 Å²	44.8	27%	0.266	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-40.4	174.1	-72.6	173.9	-179.2	0	0	111.7	K178 E179 T185 A186 Q192	K178-E182 WeakPolarHBondContact CE-OE1 3.42Å; K178-E182 HydrophobicContact CG-CG 4.46Å; K178-E182 WeakPolarHBondContact O-CG 3.46Å; K178-E182 PolarHBondContact O-N 3.12Å; E179-E182 PolarHBondContact O-N 3.07Å; E182-T185 PolarHBondContact O-N 2.81Å; E182-T185 PolarHBondContact O-OG1 3.04Å; E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.38Å; E182-A186 PolarHBondContact O-N 2.87Å; E182-Q192 HydrophobicContact CB-CB 4.43Å; E182-Q192 HydrophobicContact CB-CG 4.11Å; E182-Q192 PolarHBondContact OE2-NE2 3.08Å
183	R	97.8	Very high	97.2	Very high	89 Å²	89	44.9 Å²	44.9	34%	0.336	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-46.8	175.1	-75.6	168.5	179.3	-172	1.7	111.5	E179 V180 T185 A186 Q192 S197	E179-R183 WeakPolarHBondContact O-CB 3.18Å; E179-R183 WeakPolarHBondContact O-CG 3.21Å; E179-R183 PolarHBondContact O-N 3.25Å; E179-R183 IonicContact OE1-CZ 3Å; E179-R183 IonicContact OE1-NE 3.43Å; E179-R183 PolarHBondContact OE1-NE 3.03Å; E179-R183 IonicContact OE1-NH2 3.32Å; E179-R183 PolarHBondContact OE1-NH2 2.99Å; E179-R183 IonicContact OE2-NH2 3.03Å; V180-R183 WeakPolarHBondContact O-CB 3.33Å; V180-R183 PolarHBondContact O-N 2.94Å; R183-T185 PolarHBondContact O-N 3.22Å; R183-A186 PolarHBondContact O-N 2.9Å; R183-Q192 HydrophobicContact CG-CB 4.4Å; R183-Q192 WeakPolarHBondContact CG-O 3.49Å; R183-S197 WeakPolarHBondContact O-CA 3.2Å; R183-S197 WeakPolarHBondContact O-CB 3.46Å; R183-S197 PolarHBondContact O-OG 3.09Å
184	L	98.1	Very high	97.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-56	-34.9	178.8	-78.1	159.2	0	0	0	112.6	F176 V180 A181 L196 A200 Q201 V206 V228 F230	F176-L184 HydrophobicContact CD1-CD1 4.28Å; F176-L184 HydrophobicContact CD2-CD1 3.76Å; F176-L184 HydrophobicContact CE1-CD1 4.27Å; F176-L184 HydrophobicContact CE2-CD1 3.76Å; F176-L184 HydrophobicContact CG-CD1 4.03Å; F176-L184 HydrophobicContact CZ-CD1 4.03Å; V180-L184 HydrophobicContact CG1-CD1 4.08Å; V180-L184 WeakPolarHBondContact O-CD1 3.49Å; V180-L184 WeakPolarHBondContact O-CG 3.14Å; V180-L184 PolarHBondContact O-N 2.87Å; A181-L184 PolarHBondContact O-N 3.23Å; L184-L196 HydrophobicContact CD1-CD2 4.37Å; L184-L196 HydrophobicContact CD2-CD1 3.99Å; L184-L196 HydrophobicContact CD2-CD2 3.78Å; L184-L196 HydrophobicContact CD2-CG 3.53Å; L184-L196 HydrophobicContact CG-CD2 3.7Å; L184-L196 HydrophobicContact CG-CG 3.93Å; L184-A200 HydrophobicContact CD2-CB 3.71Å; L184-Q201 PolarHBondContact O-NE2 3.36Å; L184-V206 HydrophobicContact CB-CG1 4.21Å; L184-V228 HydrophobicContact CD1-CG2 4.39Å; L184-F230 HydrophobicContact CD1-CZ 3.93Å; L184-F230 HydrophobicContact CD2-CE1 3.93Å; L184-F230 HydrophobicContact CD2-CZ 3.99Å; L184-F230 HydrophobicContact CG-CZ 4.47Å
185	T	97.8	Very high	97	Very high	34 Å²	34	48.9 Å²	48.9	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-103.5	3.4	-175	54.5	0	0	0	0	113.8	A181 E182 R183 N187 V206 H208 V228	A181-T185 PolarHBondContact O-N 2.78Å; A181-T185 PolarHBondContact O-OG1 2.99Å; E182-T185 PolarHBondContact O-N 2.81Å; E182-T185 PolarHBondContact O-OG1 3.04Å; R183-T185 PolarHBondContact O-N 3.22Å; T185-N187 PolarHBondContact O-N 3.19Å; T185-V206 HydrophobicContact CG2-CB 4.41Å; T185-V206 HydrophobicContact CG2-CG1 3.79Å; T185-H208 HydrophobicContact CG2-CB 3.95Å; T185-V228 HydrophobicContact CG2-CG1 4.43Å
186	A	98.2	Very high	97	Very high	6 Å²	6	49.8 Å²	49.8	5%	0.05	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-69.4	122.6	-176.8	0	0	0	0	0	112.6	E182 R183 Q192 R193 Q201	E182-A186 VanDerWaalsContact O-CB 3.31Å; E182-A186 WeakPolarHBondContact O-CB 3.38Å; E182-A186 PolarHBondContact O-N 2.87Å; R183-A186 PolarHBondContact O-N 2.9Å; A186-Q192 HydrophobicContact CB-CB 3.98Å; A186-R193 HydrophobicContact CB-CB 4.37Å; A186-R193 PolarHBondContact O-NH1 3.38Å; A186-Q201 PolarHBondContact O-NE2 3.46Å
187	N	97	Very high	97.1	Very high	121 Å²	121	49.8 Å²	49.8	65%	0.647	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-73.2	166.6	172.8	-66.7	-32.4	0	0	0	112.7	T185 S190 R193	T185-N187 PolarHBondContact O-N 3.19Å; N187-S190 WeakPolarHBondContact O-CB 3.26Å; N187-S190 PolarHBondContact O-N 3.33Å; N187-S190 VanDerWaalsContact O-N 3.14Å; N187-R193 VanDerWaalsContact C-CD 3.47Å; N187-R193 WeakPolarHBondContact O-CD 3.36Å
188	T	97.5	Very high	97.2	Very high	69 Å²	69	46.6 Å²	46.6	42%	0.423	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	136.3	170.1	-47.9	0	0	0	0	111.1	S190 Q294	T188-S190 PolarHBondContact O-N 2.92Å; T188-Q294 WeakPolarHBondContact CG2-O 3.23Å
189	G	95.9	Very high	97.3	Very high	47 Å²	47	43.2 Å²	43.2	49%	0.485	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-21.1	-177.6	0	0	0	0	0	115.1	R293	G189-R293 PolarHBondContact N-O 3.25Å
190	S	97	Very high	97.4	Very high	44 Å²	44	38.9 Å²	38.9	31%	0.308	20%	0.204	S	C	.	.			trans	-60.5	143.3	-179.3	174.8	0	0	0	0	112.3	N187 T188 Q192 R193 R293	N187-S190 WeakPolarHBondContact O-CB 3.26Å; N187-S190 PolarHBondContact O-N 3.33Å; N187-S190 VanDerWaalsContact O-N 3.14Å; T188-S190 PolarHBondContact O-N 2.92Å; S190-Q192 PolarHBondContact O-N 3.13Å; S190-Q192 PolarHBondContact OG-N 3.47Å; S190-R193 VanDerWaalsContact O-CB 3.27Å; S190-R193 WeakPolarHBondContact O-CB 3.25Å; S190-R193 PolarHBondContact O-N 2.7Å; S190-R293 WeakPolarHBondContact O-CD 3.39Å
191	K	94.9	Very high	97.5	Very high	165 Å²	165	39.2 Å²	39.2	72%	0.717	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-32.5	174.3	-68	-175.5	-176.2	175.8	0	112.3	R193 R256 R293	K191-R193 VanDerWaalsContact C-N 3.33Å; K191-R256 PolarHBondContact O-NH2 3.36Å; K191-R293 WeakPolarHBondContact O-CD 3.49Å; K191-R293 PolarHBondContact O-NH1 2.87Å
192	Q	96.8	Very high	97.5	Very high	53 Å²	53	39.2 Å²	39.2	25%	0.248	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-4.8	179.7	-59.3	-64.9	38.8	0	0	113.7	E182 R183 A186 S190 S194	E182-Q192 HydrophobicContact CB-CB 4.43Å; E182-Q192 HydrophobicContact CB-CG 4.11Å; E182-Q192 PolarHBondContact OE2-NE2 3.08Å; R183-Q192 HydrophobicContact CG-CB 4.4Å; R183-Q192 WeakPolarHBondContact CG-O 3.49Å; A186-Q192 HydrophobicContact CB-CB 3.98Å; S190-Q192 PolarHBondContact O-N 3.13Å; S190-Q192 PolarHBondContact OG-N 3.47Å; Q192-S194 PolarHBondContact O-N 3.39Å
193	R	97.3	Very high	97.6	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	19%	0.193	C	C	.	.			trans	-57.8	129.8	175.3	-170	118.9	176.5	107.7	-1.3	110.2	A186 N187 S190 K191 S197 F253 R256 R293 L295	A186-R193 HydrophobicContact CB-CB 4.37Å; A186-R193 PolarHBondContact O-NH1 3.38Å; N187-R193 VanDerWaalsContact C-CD 3.47Å; N187-R193 WeakPolarHBondContact O-CD 3.36Å; S190-R193 VanDerWaalsContact O-CB 3.27Å; S190-R193 WeakPolarHBondContact O-CB 3.25Å; S190-R193 PolarHBondContact O-N 2.7Å; K191-R193 VanDerWaalsContact C-N 3.33Å; R193-S197 VanDerWaalsContact NH1-CB 3.33Å; R193-F253 HydrophobicContact CG-CE1 4.32Å; R193-F253 HydrophobicContact CG-CZ 3.97Å; R193-R256 PolarHBondContact O-NH1 3.22Å; R193-R256 PolarHBondContact O-NH2 3.38Å; R193-R293 HydrophobicContact CB-CB 4.04Å; R193-R293 HydrophobicContact CB-CG 4.09Å; R193-L295 PolarHBondContact NE-O 2.86Å
194	S	96.6	Very high	97.6	Very high	13 Å²	13	32.5 Å²	32.5	9%	0.091	18%	0.178	C	C	.	.			trans	-150.3	177.6	-173.4	70.1	0	0	0	0	110.7	Q192 L196 S197 V198	Q192-S194 PolarHBondContact O-N 3.39Å; S194-L196 PolarHBondContact O-N 2.88Å; S194-L196 PolarHBondContact OG-N 3.2Å; S194-S197 PolarHBondContact N-OG 3.23Å; S194-S197 VanDerWaalsContact O-CB 3.26Å; S194-S197 WeakPolarHBondContact O-CB 3.48Å; S194-S197 PolarHBondContact O-N 3.2Å; S194-S197 VanDerWaalsContact O-N 3.1Å; S194-S197 PolarHBondContact O-OG 2.85Å; S194-S197 PolarHBondContact OG-OG 3.32Å; S194-V198 PolarHBondContact O-N 3.49Å
195	R	96.7	Very high	97.6	Very high	80 Å²	80	35.2 Å²	35.2	30%	0.302	19%	0.192	S	C	.	.	H	α-helix	trans	-49	-47.1	170.6	177.7	175.6	81.6	117.7	4.9	111.5	S197 V198 M199 E246 V249 F253	R195-S197 VanDerWaalsContact C-N 3.26Å; R195-S197 PolarHBondContact O-N 3.07Å; R195-V198 PolarHBondContact O-N 3.38Å; R195-M199 HydrophobicContact CG-CG 4.08Å; R195-M199 WeakPolarHBondContact O-CG 3.35Å; R195-M199 PolarHBondContact O-N 3Å; R195-E246 IonicContact CZ-OE1 2.86Å; R195-E246 IonicContact NH1-OE1 3.77Å; R195-E246 PolarHBondContact NH1-OE1 3.41Å; R195-V249 HydrophobicContact CB-CG1 4.08Å; R195-V249 HydrophobicContact CG-CG1 3.79Å; R195-F253 HydrophobicContact CB-CB 4.5Å; R195-F253 HydrophobicContact CB-CD2 4.39Å
196	L	96.9	Very high	97.7	Very high	20 Å²	20	34.5 Å²	34.5	11%	0.105	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-31.9	-176.5	-167.7	62.9	0	0	0	112.5	I152 V180 L184 S194 A200	I152-L196 HydrophobicContact CG1-CD1 4.32Å; V180-L196 HydrophobicContact CG1-CD2 3.75Å; L184-L196 HydrophobicContact CD1-CD2 4.37Å; L184-L196 HydrophobicContact CD2-CD1 3.99Å; L184-L196 HydrophobicContact CD2-CD2 3.78Å; L184-L196 HydrophobicContact CD2-CG 3.53Å; L184-L196 HydrophobicContact CG-CD2 3.7Å; L184-L196 HydrophobicContact CG-CG 3.93Å; S194-L196 PolarHBondContact O-N 2.88Å; S194-L196 PolarHBondContact OG-N 3.2Å; L196-A200 WeakPolarHBondContact O-CB 3.33Å; L196-A200 PolarHBondContact O-N 3.17Å
197	S	98.3	Very high	97.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-49	174.7	-40	0	0	0	0	111.2	R183 R193 S194 R195 Q201	R183-S197 WeakPolarHBondContact O-CA 3.2Å; R183-S197 WeakPolarHBondContact O-CB 3.46Å; R183-S197 PolarHBondContact O-OG 3.09Å; R193-S197 VanDerWaalsContact NH1-CB 3.33Å; S194-S197 PolarHBondContact N-OG 3.23Å; S194-S197 VanDerWaalsContact O-CB 3.26Å; S194-S197 WeakPolarHBondContact O-CB 3.48Å; S194-S197 PolarHBondContact O-N 3.2Å; S194-S197 VanDerWaalsContact O-N 3.1Å; S194-S197 PolarHBondContact O-OG 2.85Å; S194-S197 PolarHBondContact OG-OG 3.32Å; R195-S197 VanDerWaalsContact C-N 3.26Å; R195-S197 PolarHBondContact O-N 3.07Å; S197-Q201 WeakPolarHBondContact O-CB 3.23Å; S197-Q201 WeakPolarHBondContact O-CG 3.28Å; S197-Q201 PolarHBondContact O-N 3.42Å; S197-Q201 VanDerWaalsContact O-N 3.09Å; S197-Q201 PolarHBondContact O-OE1 3.19Å
198	V	98.4	Very high	97.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-52.1	-179.2	-174.6	0	0	0	0	109.7	S194 R195 A200 Q201 Y202 V249 F253 F300	S194-V198 PolarHBondContact O-N 3.49Å; R195-V198 PolarHBondContact O-N 3.38Å; V198-A200 VanDerWaalsContact C-N 3.26Å; V198-A200 PolarHBondContact O-N 3.06Å; V198-Q201 PolarHBondContact O-N 3.3Å; V198-Y202 WeakPolarHBondContact O-CD1 3.41Å; V198-Y202 PolarHBondContact O-N 3.4Å; V198-Y202 VanDerWaalsContact O-N 3.07Å; V198-V249 HydrophobicContact CB-CG1 3.89Å; V198-V249 HydrophobicContact CB-CG2 4.21Å; V198-V249 HydrophobicContact CG1-CG1 4.31Å; V198-V249 HydrophobicContact CG1-CG2 3.71Å; V198-V249 HydrophobicContact CG2-CG1 4.13Å; V198-F253 HydrophobicContact CG2-CE2 3.75Å; V198-F253 HydrophobicContact CG2-CZ 4.29Å; V198-F300 HydrophobicContact CB-CD2 4.41Å; V198-F300 HydrophobicContact CB-CE2 4.44Å; V198-F300 HydrophobicContact CG1-CB 4.25Å; V198-F300 HydrophobicContact CG1-CD1 4.49Å; V198-F300 HydrophobicContact CG1-CD2 3.69Å; V198-F300 HydrophobicContact CG1-CE2 4.17Å; V198-F300 HydrophobicContact CG1-CG 3.89Å; V198-F300 HydrophobicContact CG2-CD2 3.77Å; V198-F300 HydrophobicContact CG2-CE2 3.42Å; V198-F300 VanDerWaalsContact CG2-CE2 3.42Å; V198-F300 HydrophobicContact CG2-CZ 3.99Å
199	M	98.6	Very high	97.7	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.025	19%	0.189	C	C	.	.	H	α-helix	trans	-57.5	-37.6	-175.6	-65	-51.3	-67.9	0	0	112.7	L155 R195 Y202 F242 V245 E246 V249	L155-M199 HydrophobicContact CD1-CB 4.23Å; R195-M199 HydrophobicContact CG-CG 4.08Å; R195-M199 WeakPolarHBondContact O-CG 3.35Å; R195-M199 PolarHBondContact O-N 3Å; M199-Y202 HydrophobicContact CE-CE1 3.91Å; M199-Y202 WeakPolarHBondContact O-CD1 3.28Å; M199-Y202 WeakPolarHBondContact O-CE1 3.44Å; M199-Y202 HydrophobicContact SD-CE1 4.18Å; M199-F242 HydrophobicContact CE-CD2 3.97Å; M199-F242 HydrophobicContact CE-CE1 4.06Å; M199-F242 HydrophobicContact CE-CE2 3.39Å; M199-F242 HydrophobicContact CE-CZ 3.44Å; M199-F242 VanDerWaalsContact CE-CZ 3.44Å; M199-V245 HydrophobicContact CE-CG1 4.49Å; M199-V245 HydrophobicContact SD-CG1 4.06Å; M199-E246 HydrophobicContact CE-CB 3.76Å; M199-E246 HydrophobicContact CE-CG 4.36Å; M199-E246 HydrophobicContact SD-CB 4.37Å; M199-V249 HydrophobicContact SD-CB 4.24Å; M199-V249 HydrophobicContact SD-CG1 4.46Å; M199-V249 HydrophobicContact SD-CG2 4.17Å
200	A	98.6	Very high	97.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-77.9	-45.6	177.3	0	0	0	0	0	112.3	L155 L184 L196 V198 Y202 L203 C204 V206 F230	L155-A200 HydrophobicContact CD1-CB 4.08Å; L155-A200 HydrophobicContact CD2-CB 4.37Å; L184-A200 HydrophobicContact CD2-CB 3.71Å; L196-A200 WeakPolarHBondContact O-CB 3.33Å; L196-A200 PolarHBondContact O-N 3.17Å; V198-A200 VanDerWaalsContact C-N 3.26Å; V198-A200 PolarHBondContact O-N 3.06Å; A200-Y202 PolarHBondContact O-N 2.85Å; A200-L203 PolarHBondContact O-N 3.36Å; A200-C204 WeakPolarHBondContact O-CB 3.38Å; A200-C204 PolarHBondContact O-N 2.89Å; A200-V206 HydrophobicContact CB-CG2 3.88Å; A200-F230 HydrophobicContact CB-CE1 4.3Å
201	Q	98.8	Very high	97.9	Very high	19 Å²	19	37.1 Å²	37.1	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-78.7	-14.8	-169.5	-65.4	166.5	7.4	0	0	114.8	L184 A186 S197 V198 C204 V206 K237 I297	L184-Q201 PolarHBondContact O-NE2 3.36Å; A186-Q201 PolarHBondContact O-NE2 3.46Å; S197-Q201 WeakPolarHBondContact O-CB 3.23Å; S197-Q201 WeakPolarHBondContact O-CG 3.28Å; S197-Q201 PolarHBondContact O-N 3.42Å; S197-Q201 VanDerWaalsContact O-N 3.09Å; S197-Q201 PolarHBondContact O-OE1 3.19Å; V198-Q201 PolarHBondContact O-N 3.3Å; Q201-C204 WeakPolarHBondContact CA-O 3.38Å; Q201-V206 HydrophobicContact CG-CG2 4.28Å; Q201-K237 WeakPolarHBondContact O-CD 3.48Å; Q201-K237 WeakPolarHBondContact O-CE 3.45Å; Q201-K237 PolarHBondContact O-NZ 2.99Å; Q201-I297 HydrophobicContact CB-CD1 3.61Å
202	Y	98.6	Very high	98	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-23.8	172.9	92.9	-89.3	0	0	0	112.4	V198 M199 A200 P236 K237 I238 F242 V245	V198-Y202 WeakPolarHBondContact O-CD1 3.41Å; V198-Y202 PolarHBondContact O-N 3.4Å; V198-Y202 VanDerWaalsContact O-N 3.07Å; M199-Y202 HydrophobicContact CE-CE1 3.91Å; M199-Y202 WeakPolarHBondContact O-CD1 3.28Å; M199-Y202 WeakPolarHBondContact O-CE1 3.44Å; M199-Y202 HydrophobicContact SD-CE1 4.18Å; A200-Y202 PolarHBondContact O-N 2.85Å; Y202-P236 CarbonylContact O-C 3.54Å; Y202-P236 WeakPolarHBondContact O-CA 3.43Å; Y202-K237 PolarHBondContact O-N 3.04Å; Y202-I238 HydrophobicContact CD2-CB 3.77Å; Y202-I238 HydrophobicContact CD2-CD1 4.39Å; Y202-I238 HydrophobicContact CD2-CG1 4.2Å; Y202-I238 HydrophobicContact CE2-CB 4.32Å; Y202-I238 HydrophobicContact CG-CB 4.41Å; Y202-I238 HydrophobicContact CG-CD1 4.21Å; Y202-I238 HydrophobicContact CG-CG1 4.36Å; Y202-F242 VanDerWaalsContact OH-CD2 3.24Å; Y202-F242 WeakPolarHBondContact OH-CD2 3.24Å; Y202-V245 HydrophobicContact CD1-CG1 4.33Å; Y202-V245 HydrophobicContact CE1-CG1 3.96Å; Y202-V245 HydrophobicContact CE2-CG1 4.46Å; Y202-V245 HydrophobicContact CE2-CG2 4.43Å
203	L	98.8	Very high	98.1	Very high	5 Å²	5	29 Å²	29	3%	0.026	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-26	179.6	-68.1	169	0	0	0	113.3	L155 I158 A200 L233 P236 F242	L155-L203 HydrophobicContact CB-CD1 3.93Å; L155-L203 HydrophobicContact CD2-CB 4.25Å; L155-L203 HydrophobicContact CD2-CD1 4.06Å; L155-L203 WeakPolarHBondContact O-CD1 3.22Å; I158-L203 HydrophobicContact CG2-CB 3.96Å; I158-L203 HydrophobicContact CG2-CD2 4.19Å; I158-L203 HydrophobicContact CG2-CG 4.45Å; A200-L203 PolarHBondContact O-N 3.36Å; L203-L233 WeakPolarHBondContact O-CG 3.45Å; L203-L233 PolarHBondContact O-N 3.21Å; L203-P236 HydrophobicContact CD2-CB 4.03Å; L203-F242 HydrophobicContact CD1-CD2 4.31Å; L203-F242 HydrophobicContact CD1-CE2 4.31Å
204	C	98.8	Very high	97.9	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.7	-173	-67.3	0	0	0	0	112.4	I158 A200 Q201 V206 F230 T231	I158-C204 VanDerWaalsContact CD1-SG 3.52Å; A200-C204 WeakPolarHBondContact O-CB 3.38Å; A200-C204 PolarHBondContact O-N 2.89Å; Q201-C204 WeakPolarHBondContact CA-O 3.38Å; C204-V206 HydrophobicContact CB-CG2 3.79Å; C204-F230 HydrophobicContact CB-CB 4.47Å; C204-F230 HydrophobicContact CB-CD1 4.33Å; C204-T231 CarbonylContact C-O 3.14Å; C204-T231 VanDerWaalsContact CA-O 3.3Å; C204-T231 WeakPolarHBondContact CA-O 3.41Å
205	N	98.5	Very high	97.8	Very high	57 Å²	57	38 Å²	38	31%	0.305	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	117.6	150.7	169.7	50.3	0	0	0	108.3	R207 F230 T231 L233	N205-R207 PolarHBondContact ND2-NE 2.82Å; N205-R207 VanDerWaalsContact ND2-NE 3.17Å; N205-F230 WeakPolarHBondContact O-CA 3.49Å; N205-T231 PolarHBondContact N-O 3.42Å; N205-T231 PolarHBondContact O-N 3.25Å; N205-L233 HydrophobicContact CB-CD2 4.24Å
206	V	98.6	Very high	97.6	Very high	19 Å²	19	35.5 Å²	35.5	12%	0.115	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.6	-173.5	-167.9	0	0	0	0	109.5	L184 T185 A200 Q201 C204 V228 F230	L184-V206 HydrophobicContact CB-CG1 4.21Å; T185-V206 HydrophobicContact CG2-CB 4.41Å; T185-V206 HydrophobicContact CG2-CG1 3.79Å; A200-V206 HydrophobicContact CB-CG2 3.88Å; Q201-V206 HydrophobicContact CG-CG2 4.28Å; C204-V206 HydrophobicContact CB-CG2 3.79Å; V206-V228 HydrophobicContact CG1-CG1 3.5Å; V206-V228 VanDerWaalsContact CG1-CG1 3.5Å; V206-F230 HydrophobicContact CB-CD1 4.35Å; V206-F230 HydrophobicContact CB-CE1 4.47Å; V206-F230 HydrophobicContact CG1-CD1 3.82Å; V206-F230 HydrophobicContact CG1-CE1 3.58Å; V206-F230 HydrophobicContact CG1-CZ 4.1Å; V206-F230 HydrophobicContact CG2-CD1 3.82Å; V206-F230 HydrophobicContact CG2-CE1 4.08Å
207	R	98.4	Very high	97.3	Very high	150 Å²	150	34.7 Å²	34.7	57%	0.566	16%	0.164	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.8	-176.5	-64	-177.1	-178.1	174.4	3	111.3	N205 I209 V228 H229	N205-R207 PolarHBondContact ND2-NE 2.82Å; N205-R207 VanDerWaalsContact ND2-NE 3.17Å; R207-I209 HydrophobicContact CB-CD1 3.92Å; R207-I209 PolarHBondContact O-N 3.29Å; R207-V228 CarbonylContact O-C 3.52Å; R207-V228 WeakPolarHBondContact O-CA 3.27Å; R207-V228 WeakPolarHBondContact O-CG1 3.49Å; R207-H229 PolarHBondContact N-O 2.61Å; R207-H229 PolarHBondContact O-N 2.95Å
208	H	98.3	Very high	96.8	Very high	64 Å²	64	38.2 Å²	38.2	30%	0.296	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	111.6	168.9	-176.4	-179.1	0	0	0	107.1	T185 F210 T211 V227	T185-H208 HydrophobicContact CG2-CB 3.95Å; H208-F210 PolarHBondContact NE2-O 3.43Å; H208-T211 PolarHBondContact CE1-OG1 3.44Å; H208-T211 PolarHBondContact NE2-OG1 3.1Å; H208-V227 PolarHBondContact CD2-O 3.47Å
209	I	97.9	Very high	96.3	Very high	53 Å²	53	41.1 Å²	41.1	27%	0.272	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-51	-171.5	-51.9	-60.9	0	0	0	110.7	K50 R207 V227 H229	K50-I209 HydrophobicContact CB-CG2 3.57Å; K50-I209 HydrophobicContact CD-CG2 3.7Å; K50-I209 HydrophobicContact CG-CG2 3.54Å; R207-I209 HydrophobicContact CB-CD1 3.92Å; R207-I209 PolarHBondContact O-N 3.29Å; I209-V227 HydrophobicContact CB-CG1 4.45Å; I209-V227 PolarHBondContact N-O 2.94Å; I209-H229 HydrophobicContact CD1-CB 3.63Å; I209-H229 HydrophobicContact CG1-CB 3.78Å
210	F	98.3	Very high	95.9	Very high	24 Å²	24	48.1 Å²	48.1	11%	0.105	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	165	173.4	63.5	-78.1	0	0	0	110.8	K46 I47 K50 H208 I212 V227	K46-F210 HydrophobicContact CB-CZ 4.16Å; K46-F210 HydrophobicContact CD-CD2 4.18Å; K46-F210 HydrophobicContact CD-CE1 4.19Å; K46-F210 HydrophobicContact CD-CE2 3.75Å; K46-F210 HydrophobicContact CD-CZ 3.77Å; K46-F210 HydrophobicContact CG-CE1 3.92Å; K46-F210 HydrophobicContact CG-CE2 4.21Å; K46-F210 HydrophobicContact CG-CZ 3.69Å; I47-F210 HydrophobicContact CG1-CZ 3.9Å; K50-F210 HydrophobicContact CG-CE1 4.24Å; H208-F210 PolarHBondContact NE2-O 3.43Å; F210-I212 HydrophobicContact CD2-CG1 3.93Å; F210-I212 HydrophobicContact CE2-CD1 3.91Å; F210-I212 HydrophobicContact CE2-CG1 3.47Å; F210-I212 VanDerWaalsContact CE2-CG1 3.47Å; F210-I212 HydrophobicContact CZ-CD1 4.4Å; F210-I212 HydrophobicContact CZ-CG1 4.4Å; F210-V227 HydrophobicContact CD1-CB 4.15Å; F210-V227 HydrophobicContact CD1-CG2 4.28Å; F210-V227 HydrophobicContact CD2-CG2 4.36Å; F210-V227 HydrophobicContact CE1-CB 3.99Å; F210-V227 HydrophobicContact CE1-CG1 4.09Å; F210-V227 HydrophobicContact CE1-CG2 3.87Å; F210-V227 HydrophobicContact CE2-CG2 3.98Å; F210-V227 HydrophobicContact CZ-CB 4.35Å; F210-V227 HydrophobicContact CZ-CG2 3.71Å; F210-V227 PolarHBondContact O-N 3.26Å
211	T	98.3	Very high	95.5	Very high	51 Å²	51	48.6 Å²	48.6	31%	0.313	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.4	172.9	-56.6	0	0	0	0	110.5	K178 H208 D224 V225	K178-T211 HydrophobicContact CD-CG2 4.17Å; K178-T211 HydrophobicContact CG-CG2 4.46Å; H208-T211 PolarHBondContact CE1-OG1 3.44Å; H208-T211 PolarHBondContact NE2-OG1 3.1Å; T211-D224 HydrophobicContact CG2-CB 3.72Å; T211-V225 CarbonylContact C-O 3.42Å; T211-V225 WeakPolarHBondContact CA-O 3.38Å
212	I	97.5	Very high	95.1	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.4	172.9	-58.3	172.5	0	0	0	108.1	L38 L43 I47 F210 G214 A216 F217 V225 V227	L38-I212 HydrophobicContact CD1-CG2 4.42Å; L38-I212 HydrophobicContact CD2-CD1 4.05Å; L43-I212 HydrophobicContact CD1-CG2 3.92Å; I47-I212 HydrophobicContact CD1-CD1 4.07Å; I47-I212 HydrophobicContact CG1-CD1 4.44Å; F210-I212 HydrophobicContact CD2-CG1 3.93Å; F210-I212 HydrophobicContact CE2-CD1 3.91Å; F210-I212 HydrophobicContact CE2-CG1 3.47Å; F210-I212 VanDerWaalsContact CE2-CG1 3.47Å; F210-I212 HydrophobicContact CZ-CD1 4.4Å; F210-I212 HydrophobicContact CZ-CG1 4.4Å; I212-G214 PolarHBondContact O-N 2.81Å; I212-A216 HydrophobicContact CG2-CB 3.69Å; I212-F217 HydrophobicContact CB-CE2 3.92Å; I212-F217 HydrophobicContact CB-CZ 4.2Å; I212-F217 HydrophobicContact CD1-CZ 4.21Å; I212-F217 HydrophobicContact CG2-CD2 4.32Å; I212-F217 HydrophobicContact CG2-CE2 3.44Å; I212-F217 VanDerWaalsContact CG2-CE2 3.44Å; I212-F217 HydrophobicContact CG2-CZ 3.92Å; I212-V225 HydrophobicContact CB-CB 4.47Å; I212-V225 PolarHBondContact N-O 3.43Å; I212-V225 PolarHBondContact O-N 3.36Å; I212-V227 HydrophobicContact CD1-CG2 3.8Å; I212-V227 HydrophobicContact CG1-CG2 4.17Å
213	P	97.3	Very high	94.9	Very high	47 Å²	47	60 Å²	60	31%	0.305	30%	0.295	S	S	.	.			trans	-58.7	136.5	174.6	-24.8	34.8	0	0	0	111.5	R215 A216 D224	P213-R215 HydrophobicContact CB-CG 3.84Å; P213-R215 PolarHBondContact O-N 2.99Å; P213-A216 VanDerWaalsContact O-CB 3.29Å; P213-A216 WeakPolarHBondContact O-CB 3.37Å; P213-A216 PolarHBondContact O-N 3.37Å; P213-D224 WeakPolarHBondContact CA-OD1 3.29Å
214	G	94.2	Very high	94.8	Very high	2 Å²	2	62.8 Å²	62.8	2%	0.021	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-55.1	-31.1	-179.1	0	0	0	0	0	113.3	I212 A216 F217 P221 D224	I212-G214 PolarHBondContact O-N 2.81Å; G214-A216 PolarHBondContact O-N 3.44Å; G214-F217 PolarHBondContact O-N 3.31Å; G214-F217 VanDerWaalsContact O-N 3.07Å; G214-P221 WeakPolarHBondContact O-CD 3.44Å; G214-D224 PolarHBondContact N-OD1 2.88Å
215	R	93.8	Very high	94.8	Very high	199 Å²	199	62.7 Å²	62.7	75%	0.751	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-59.1	-15.2	175.2	65.2	173.5	179.2	-118.8	1.4	115.1	P213 F217 K220	P213-R215 HydrophobicContact CB-CG 3.84Å; P213-R215 PolarHBondContact O-N 2.99Å; R215-F217 VanDerWaalsContact C-N 3.29Å; R215-K220 HydrophobicContact CB-CD 4.48Å
216	A	92.6	Very high	94.7	Very high	28 Å²	28	60 Å²	60	23%	0.231	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-79.9	-11.7	177.7	0	0	0	0	0	113.5	L38 L43 I212 P213 G214	L38-A216 HydrophobicContact CD1-CB 4.24Å; L43-A216 HydrophobicContact CD1-CB 3.55Å; I212-A216 HydrophobicContact CG2-CB 3.69Å; P213-A216 VanDerWaalsContact O-CB 3.29Å; P213-A216 WeakPolarHBondContact O-CB 3.37Å; P213-A216 PolarHBondContact O-N 3.37Å; G214-A216 PolarHBondContact O-N 3.44Å
217	F	91.2	Very high	94.7	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	156.6	-178.7	-62.3	-96	0	0	0	111.9	N36 F37 L38 I212 G214 R215 P219 K220 P221 V225	N36-F217 HydrophobicContact CB-CB 4.08Å; N36-F217 HydrophobicContact CB-CD1 4.01Å; N36-F217 HydrophobicContact CB-CG 4.28Å; F37-F217 CarbonylContact O-C 3.58Å; F37-F217 VanDerWaalsContact O-CA 3.27Å; F37-F217 WeakPolarHBondContact O-CA 3.24Å; L38-F217 HydrophobicContact CB-CD1 4.07Å; L38-F217 HydrophobicContact CB-CE1 3.91Å; L38-F217 HydrophobicContact CD1-CD1 4.13Å; L38-F217 HydrophobicContact CD1-CE1 3.92Å; L38-F217 HydrophobicContact CD1-CE2 4.43Å; L38-F217 HydrophobicContact CD1-CG 4.47Å; L38-F217 HydrophobicContact CD1-CZ 4.08Å; L38-F217 HydrophobicContact CD2-CE1 4.41Å; L38-F217 HydrophobicContact CG-CE1 4.31Å; I212-F217 HydrophobicContact CB-CE2 3.92Å; I212-F217 HydrophobicContact CB-CZ 4.2Å; I212-F217 HydrophobicContact CD1-CZ 4.21Å; I212-F217 HydrophobicContact CG2-CD2 4.32Å; I212-F217 HydrophobicContact CG2-CE2 3.44Å; I212-F217 VanDerWaalsContact CG2-CE2 3.44Å; I212-F217 HydrophobicContact CG2-CZ 3.92Å; G214-F217 PolarHBondContact O-N 3.31Å; G214-F217 VanDerWaalsContact O-N 3.07Å; R215-F217 VanDerWaalsContact C-N 3.29Å; F217-P219 CarbonylContact C-O 3.55Å; F217-P219 CarbonylContact O-C 3.58Å; F217-K220 PolarHBondContact O-N 2.97Å; F217-P221 HydrophobicContact CB-CG 4.34Å; F217-P221 HydrophobicContact CD2-CG 4.25Å; F217-P221 HydrophobicContact CG-CG 4.45Å; F217-V225 HydrophobicContact CD2-CG2 4.08Å; F217-V225 HydrophobicContact CE1-CG2 4.37Å; F217-V225 HydrophobicContact CE2-CB 3.67Å; F217-V225 HydrophobicContact CE2-CG1 4.37Å; F217-V225 HydrophobicContact CE2-CG2 3.39Å; F217-V225 HydrophobicContact CZ-CB 3.65Å; F217-V225 HydrophobicContact CZ-CG1 3.83Å; F217-V225 HydrophobicContact CZ-CG2 3.58Å
218	V	87.7	Confident	94.7	Very high	73 Å²	73	52 Å²	52	44%	0.442	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.7	175.4	-176.1	0	0	0	0	109.4	F37 L39	F37-V218 WeakPolarHBondContact CB-O 3.23Å; F37-V218 WeakPolarHBondContact CD2-O 3.27Å; F37-V218 WeakPolarHBondContact CG-O 3.2Å; F37-V218 PolarHBondContact N-O 3.31Å; F37-V218 PolarHBondContact O-N 3.03Å; L39-V218 HydrophobicContact CD1-CB 4.07Å; L39-V218 HydrophobicContact CD1-CG2 3.87Å; L39-V218 HydrophobicContact CG-CG2 4.42Å
219	P	87.4	Confident	94.8	Very high	61 Å²	61	49.7 Å²	49.7	40%	0.396	25%	0.252	S	S	.	.	S	Bend	cis	-59.9	160.3	-12.7	28.6	-36.2	0	0	0	111.9	A29 Q35 N36 F217 P221	A29-P219 HydrophobicContact CB-CG 3.87Å; Q35-P219 WeakPolarHBondContact O-CD 3.23Å; N36-P219 PolarHBondContact OD1-O 3.19Å; F217-P219 CarbonylContact C-O 3.55Å; F217-P219 CarbonylContact O-C 3.58Å; P219-P221 VanDerWaalsContact O-CD 3.29Å; P219-P221 WeakPolarHBondContact O-CD 3.42Å
220	K	89.5	Confident	94.8	Very high	153 Å²	153	47.2 Å²	47.2	67%	0.665	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-70	119.5	176.7	173.9	-179.3	174.8	-166.1	0	109.2	R215 F217	R215-K220 HydrophobicContact CB-CD 4.48Å; F217-K220 PolarHBondContact O-N 2.97Å
221	P	90.3	Very high	94.8	Very high	10 Å²	10	47 Å²	47	7%	0.065	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-67.6	158.8	169.8	28.5	-35.7	0	0	0	111.5	F144 G214 F217 P219 V223 V225	F144-P221 HydrophobicContact CE2-CB 3.98Å; F144-P221 HydrophobicContact CZ-CB 4.28Å; G214-P221 WeakPolarHBondContact O-CD 3.44Å; F217-P221 HydrophobicContact CB-CG 4.34Å; F217-P221 HydrophobicContact CD2-CG 4.25Å; F217-P221 HydrophobicContact CG-CG 4.45Å; P219-P221 VanDerWaalsContact O-CD 3.29Å; P219-P221 WeakPolarHBondContact O-CD 3.42Å; P221-V223 WeakPolarHBondContact CG-O 3.35Å; P221-V223 PolarHBondContact O-N 3.5Å; P221-V225 HydrophobicContact CG-CG2 4.4Å
222	E	91.6	Very high	94.8	Very high	201 Å²	201	44.7 Å²	44.7	94%	0.939	23%	0.226	S	C	*	.	S	Bend	trans	-67.8	-21.4	176.5	-63.1	-180	173	0	0	113.1
223	V	94.5	Very high	94.9	Very high	58 Å²	58	46.4 Å²	46.4	35%	0.352	23%	0.234	S	C	.	.	S	Bend	trans	-126.4	155.2	-175.9	-62.5	0	0	0	0	111.1	F144 Q177 P221	F144-V223 HydrophobicContact CE2-CG2 4.24Å; Q177-V223 HydrophobicContact CB-CG2 3.97Å; Q177-V223 HydrophobicContact CG-CG2 3.78Å; P221-V223 WeakPolarHBondContact CG-O 3.35Å; P221-V223 PolarHBondContact O-N 3.5Å
224	D	97.1	Very high	94.9	Very high	62 Å²	62	47.5 Å²	47.5	33%	0.332	24%	0.237	S	C	.	.			trans	-67.1	163.8	169.4	-66.5	-28.5	0	0	0	111.5	K178 T211 P213 G214	K178-D224 HydrophobicContact CB-CB 4.11Å; K178-D224 WeakPolarHBondContact CB-O 3.32Å; K178-D224 HydrophobicContact CD-CB 3.99Å; K178-D224 PolarHBondContact N-O 3.4Å; T211-D224 HydrophobicContact CG2-CB 3.72Å; P213-D224 WeakPolarHBondContact CA-OD1 3.29Å; G214-D224 PolarHBondContact N-OD1 2.88Å
225	V	97.4	Very high	95.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.3	-174.7	-178.7	0	0	0	0	110	F144 T175 F176 T211 I212 F217 P221	F144-V225 HydrophobicContact CE1-CG2 4.06Å; F144-V225 HydrophobicContact CZ-CG2 3.73Å; T175-V225 HydrophobicContact CG2-CG1 4.28Å; F176-V225 CarbonylContact O-C 3.52Å; F176-V225 WeakPolarHBondContact O-CA 2.83Å; F176-V225 WeakPolarHBondContact O-CG1 3.05Å; T211-V225 CarbonylContact C-O 3.42Å; T211-V225 WeakPolarHBondContact CA-O 3.38Å; I212-V225 HydrophobicContact CB-CB 4.47Å; I212-V225 PolarHBondContact N-O 3.43Å; I212-V225 PolarHBondContact O-N 3.36Å; F217-V225 HydrophobicContact CD2-CG2 4.08Å; F217-V225 HydrophobicContact CE1-CG2 4.37Å; F217-V225 HydrophobicContact CE2-CB 3.67Å; F217-V225 HydrophobicContact CE2-CG1 4.37Å; F217-V225 HydrophobicContact CE2-CG2 3.39Å; F217-V225 HydrophobicContact CZ-CB 3.65Å; F217-V225 HydrophobicContact CZ-CG1 3.83Å; F217-V225 HydrophobicContact CZ-CG2 3.58Å; P221-V225 HydrophobicContact CG-CG2 4.4Å
226	G	97.8	Very high	95.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.4	174.5	0	0	0	0	0	111.6	T175 F176	T175-G226 WeakPolarHBondContact CA-O 3.25Å; F176-G226 PolarHBondContact N-O 3.3Å; F176-G226 PolarHBondContact O-N 2.62Å
227	V	98.3	Very high	95.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.2	171	-176.7	0	0	0	0	108.5	I47 T173 T175 H208 I209 F210 I212	I47-V227 HydrophobicContact CG1-CG2 4.17Å; T173-V227 HydrophobicContact CG2-CG1 3.95Å; T175-V227 HydrophobicContact CG2-CG2 4.34Å; H208-V227 PolarHBondContact CD2-O 3.47Å; I209-V227 HydrophobicContact CB-CG1 4.45Å; I209-V227 PolarHBondContact N-O 2.94Å; F210-V227 HydrophobicContact CD1-CB 4.15Å; F210-V227 HydrophobicContact CD1-CG2 4.28Å; F210-V227 HydrophobicContact CD2-CG2 4.36Å; F210-V227 HydrophobicContact CE1-CB 3.99Å; F210-V227 HydrophobicContact CE1-CG1 4.09Å; F210-V227 HydrophobicContact CE1-CG2 3.87Å; F210-V227 HydrophobicContact CE2-CG2 3.98Å; F210-V227 HydrophobicContact CZ-CB 4.35Å; F210-V227 HydrophobicContact CZ-CG2 3.71Å; F210-V227 PolarHBondContact O-N 3.26Å; I212-V227 HydrophobicContact CD1-CG2 3.8Å; I212-V227 HydrophobicContact CG1-CG2 4.17Å
228	V	98.6	Very high	95.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.6	-176.3	-172.7	0	0	0	0	109.7	L174 F176 A181 L184 T185 V206 R207 F230	L174-V228 PolarHBondContact N-O 2.76Å; L174-V228 PolarHBondContact O-N 3.38Å; F176-V228 HydrophobicContact CD2-CB 4.12Å; F176-V228 HydrophobicContact CD2-CG2 3.87Å; F176-V228 HydrophobicContact CE2-CB 4.12Å; F176-V228 HydrophobicContact CE2-CG2 4.36Å; A181-V228 HydrophobicContact CB-CG2 3.49Å; A181-V228 VanDerWaalsContact CB-CG2 3.49Å; L184-V228 HydrophobicContact CD1-CG2 4.39Å; T185-V228 HydrophobicContact CG2-CG1 4.43Å; V206-V228 HydrophobicContact CG1-CG1 3.5Å; V206-V228 VanDerWaalsContact CG1-CG1 3.5Å; R207-V228 CarbonylContact O-C 3.52Å; R207-V228 WeakPolarHBondContact O-CA 3.27Å; R207-V228 WeakPolarHBondContact O-CG1 3.49Å; V228-F230 HydrophobicContact CB-CE2 3.77Å; V228-F230 HydrophobicContact CB-CZ 4.17Å; V228-F230 HydrophobicContact CG1-CD2 4.09Å; V228-F230 HydrophobicContact CG1-CE1 4.26Å; V228-F230 HydrophobicContact CG1-CE2 3.43Å; V228-F230 VanDerWaalsContact CG1-CE2 3.43Å; V228-F230 HydrophobicContact CG1-CZ 3.54Å
229	H	98.6	Very high	96.4	Very high	17 Å²	17	50.7 Å²	50.7	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.7	173.6	-171.5	84.9	0	0	0	110.2	A51 M172 T173 R207 I209 T231	A51-H229 PolarHBondContact O-CE1 3.48Å; M172-H229 CarbonylContact O-C 3.56Å; M172-H229 VanDerWaalsContact O-CA 3.31Å; M172-H229 WeakPolarHBondContact O-CA 3.37Å; M172-H229 PolarHBondContact O-ND1 2.82Å; T173-H229 PolarHBondContact OG1-ND1 3.25Å; R207-H229 PolarHBondContact N-O 2.61Å; R207-H229 PolarHBondContact O-N 2.95Å; I209-H229 HydrophobicContact CD1-CB 3.63Å; I209-H229 HydrophobicContact CG1-CB 3.78Å; H229-T231 PolarHBondContact NE2-OG1 3.43Å
230	F	98.7	Very high	96.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.6	179.5	-56.6	-106.3	0	0	0	109.3	I151 M172 L174 F176 L184 A200 C204 N205 V206 V228	I151-F230 HydrophobicContact CD1-CD1 4.33Å; I151-F230 HydrophobicContact CD1-CE1 4.02Å; I151-F230 HydrophobicContact CD1-CE2 4.31Å; I151-F230 HydrophobicContact CD1-CZ 4Å; I151-F230 HydrophobicContact CG1-CE1 4.16Å; I151-F230 HydrophobicContact CG1-CZ 4.07Å; M172-F230 HydrophobicContact CB-CB 4.19Å; M172-F230 HydrophobicContact CB-CD2 4.21Å; M172-F230 HydrophobicContact CE-CB 3.81Å; M172-F230 HydrophobicContact CE-CG 4.32Å; M172-F230 PolarHBondContact N-O 3.41Å; M172-F230 PolarHBondContact O-N 3.03Å; L174-F230 HydrophobicContact CD1-CE2 4.34Å; F176-F230 AromaticContact CE2-CE2 3.81Å; F176-F230 HydrophobicContact CE2-CE2 3.81Å; F176-F230 AromaticContact CE2-CZ 3.92Å; F176-F230 HydrophobicContact CE2-CZ 3.92Å; F176-F230 HydrophobicContact CZ-CE2 4.25Å; F176-F230 HydrophobicContact CZ-CZ 4.16Å; L184-F230 HydrophobicContact CD1-CZ 3.93Å; L184-F230 HydrophobicContact CD2-CE1 3.93Å; L184-F230 HydrophobicContact CD2-CZ 3.99Å; L184-F230 HydrophobicContact CG-CZ 4.47Å; A200-F230 HydrophobicContact CB-CE1 4.3Å; C204-F230 HydrophobicContact CB-CB 4.47Å; C204-F230 HydrophobicContact CB-CD1 4.33Å; N205-F230 WeakPolarHBondContact O-CA 3.49Å; V206-F230 HydrophobicContact CB-CD1 4.35Å; V206-F230 HydrophobicContact CB-CE1 4.47Å; V206-F230 HydrophobicContact CG1-CD1 3.82Å; V206-F230 HydrophobicContact CG1-CE1 3.58Å; V206-F230 HydrophobicContact CG1-CZ 4.1Å; V206-F230 HydrophobicContact CG2-CD1 3.82Å; V206-F230 HydrophobicContact CG2-CE1 4.08Å; V228-F230 HydrophobicContact CB-CE2 3.77Å; V228-F230 HydrophobicContact CB-CZ 4.17Å; V228-F230 HydrophobicContact CG1-CD2 4.09Å; V228-F230 HydrophobicContact CG1-CE1 4.26Å; V228-F230 HydrophobicContact CG1-CE2 3.43Å; V228-F230 VanDerWaalsContact CG1-CE2 3.43Å; V228-F230 HydrophobicContact CG1-CZ 3.54Å
231	T	98.4	Very high	97.3	Very high	21 Å²	21	45.4 Å²	45.4	13%	0.129	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116.6	167.5	-49.5	0	0	0	0	107.5	P133 Q171 C204 N205 H229 L233	P133-T231 HydrophobicContact CG-CG2 4.26Å; Q171-T231 HydrophobicContact CG-CG2 4.28Å; Q171-T231 PolarHBondContact NE2-OG1 3.13Å; C204-T231 CarbonylContact C-O 3.14Å; C204-T231 VanDerWaalsContact CA-O 3.3Å; C204-T231 WeakPolarHBondContact CA-O 3.41Å; N205-T231 PolarHBondContact N-O 3.42Å; N205-T231 PolarHBondContact O-N 3.25Å; H229-T231 PolarHBondContact NE2-OG1 3.43Å; T231-L233 PolarHBondContact O-N 2.78Å
232	P	98.8	Very high	97.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	139.3	173.1	-25.5	34.4	0	0	0	111.1	W129 I158 F165 R169 T170	W129-P232 HydrophobicContact CH2-CB 4.04Å; W129-P232 HydrophobicContact CZ2-CB 3.96Å; I158-P232 HydrophobicContact CD1-CG 4.13Å; I158-P232 HydrophobicContact CG1-CB 4.49Å; I158-P232 HydrophobicContact CG1-CG 4.13Å; I158-P232 HydrophobicContact CG2-CB 4.08Å; F165-P232 HydrophobicContact CD1-CG 4.04Å; F165-P232 HydrophobicContact CE1-CG 3.95Å; R169-P232 HydrophobicContact CB-CB 3.95Å; R169-P232 HydrophobicContact CB-CG 4.26Å; R169-P232 WeakPolarHBondContact CD-O 3.34Å; R169-P232 HydrophobicContact CG-CB 4.08Å; R169-P232 PolarHBondContact NH1-O 3.28Å; T170-P232 WeakPolarHBondContact O-CD 3.32Å
233	L	98.7	Very high	98	Very high	37 Å²	37	40.2 Å²	40.2	19%	0.194	20%	0.203	C	C	.	.			trans	-74.8	150.7	176.9	-63.8	172.9	0	0	0	109.7	W129 L203 N205 T231 Q235 K237	W129-L233 PolarHBondContact NE1-O 3.41Å; L203-L233 WeakPolarHBondContact O-CG 3.45Å; L203-L233 PolarHBondContact O-N 3.21Å; N205-L233 HydrophobicContact CB-CD2 4.24Å; T231-L233 PolarHBondContact O-N 2.78Å; L233-Q235 WeakPolarHBondContact CB-O 3.42Å; L233-K237 HydrophobicContact CD1-CD 4.44Å; L233-K237 HydrophobicContact CD1-CG 4Å
234	I	98.3	Very high	98.2	Very high	70 Å²	70	37.7 Å²	37.7	36%	0.359	19%	0.188	S	C	.	.	S	Bend	trans	-61.9	-64.3	168.9	-67.6	175.5	0	0	0	108.4	W129 E130	W129-I234 VanDerWaalsContact CD1-O 3.25Å; W129-I234 PolarHBondContact NE1-O 3.36Å; E130-I234 WeakPolarHBondContact OE2-CG2 3.29Å
235	Q	97.9	Very high	98.3	Very high	132 Å²	132	34.8 Å²	34.8	62%	0.617	17%	0.172	S	C	*	.	S	Bend	trans	-99.8	122.5	171.2	-166.6	174.2	20.6	0	0	110.3	L233 E239	L233-Q235 WeakPolarHBondContact CB-O 3.42Å; Q235-E239 VanDerWaalsContact CG-OE1 3.28Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.36Å; Q235-E239 PolarHBondContact NE2-OE1 2.95Å
236	P	98.1	Very high	98.4	Very high	31 Å²	31	36.2 Å²	36.2	20%	0.201	18%	0.179	C	C	.	.			trans	-66.5	148.2	172.2	31.6	-35.1	0	0	0	109.7	Y202 L203 I238 E239	Y202-P236 CarbonylContact O-C 3.54Å; Y202-P236 WeakPolarHBondContact O-CA 3.43Å; L203-P236 HydrophobicContact CD2-CB 4.03Å; P236-I238 PolarHBondContact O-N 3.11Å; P236-E239 HydrophobicContact CG-CG 3.98Å
237	K	98.5	Very high	98.4	Very high	96 Å²	96	37.9 Å²	37.9	42%	0.417	19%	0.186	S	C	.	.	S	Bend	trans	-73	-13	-178.9	-60.8	177.7	-176.9	156.5	0	113.2	Q201 Y202 L233 I297 K301	Q201-K237 WeakPolarHBondContact O-CD 3.48Å; Q201-K237 WeakPolarHBondContact O-CE 3.45Å; Q201-K237 PolarHBondContact O-NZ 2.99Å; Y202-K237 PolarHBondContact O-N 3.04Å; L233-K237 HydrophobicContact CD1-CD 4.44Å; L233-K237 HydrophobicContact CD1-CG 4Å; K237-I297 HydrophobicContact CB-CG2 3.5Å; K237-I297 HydrophobicContact CD-CB 4.28Å; K237-I297 HydrophobicContact CD-CD1 3.65Å; K237-I297 HydrophobicContact CD-CG2 3.74Å; K237-I297 HydrophobicContact CG-CG2 4.27Å; K237-K301 WeakPolarHBondContact O-CD 3.46Å
238	I	98.6	Very high	98.4	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	19%	0.186	C	C	.	.	S	Bend	trans	-137.2	118.6	176.5	-51.6	174	0	0	0	106.8	Y202 P236 Q240 V245 I297 F300 K301 C304	Y202-I238 HydrophobicContact CD2-CB 3.77Å; Y202-I238 HydrophobicContact CD2-CD1 4.39Å; Y202-I238 HydrophobicContact CD2-CG1 4.2Å; Y202-I238 HydrophobicContact CE2-CB 4.32Å; Y202-I238 HydrophobicContact CG-CB 4.41Å; Y202-I238 HydrophobicContact CG-CD1 4.21Å; Y202-I238 HydrophobicContact CG-CG1 4.36Å; P236-I238 PolarHBondContact O-N 3.11Å; I238-Q240 HydrophobicContact CG2-CB 4.2Å; I238-Q240 HydrophobicContact CG2-CG 4.25Å; I238-Q240 PolarHBondContact O-N 3.31Å; I238-V245 HydrophobicContact CD1-CG1 4.09Å; I238-V245 HydrophobicContact CG2-CG2 3.84Å; I238-I297 HydrophobicContact CD1-CG2 4.31Å; I238-I297 HydrophobicContact CG1-CG2 4.22Å; I238-F300 HydrophobicContact CD1-CB 3.72Å; I238-K301 HydrophobicContact CG1-CB 4.04Å; I238-C304 HydrophobicContact CG2-CB 3.93Å
239	E	97.3	Very high	98.4	Very high	113 Å²	113	37.9 Å²	37.9	53%	0.528	19%	0.186	S	C	.	.			trans	-100.7	64.8	-177.9	-69.3	177.5	174.3	0	0	110.1	Q235 P236	Q235-E239 VanDerWaalsContact CG-OE1 3.28Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.36Å; Q235-E239 PolarHBondContact NE2-OE1 2.95Å; P236-E239 HydrophobicContact CG-CG 3.98Å
240	Q	98.3	Very high	98.3	Very high	37 Å²	37	41.2 Å²	41.2	17%	0.173	20%	0.202	C	C	.	.	S	Bend	trans	-135.2	157	177.4	-69.1	-61.5	-26	0	0	110	I238 F242 L244 V245 C304	I238-Q240 HydrophobicContact CG2-CB 4.2Å; I238-Q240 HydrophobicContact CG2-CG 4.25Å; I238-Q240 PolarHBondContact O-N 3.31Å; Q240-F242 PolarHBondContact O-N 3.38Å; Q240-L244 HydrophobicContact CB-CD2 4.23Å; Q240-V245 HydrophobicContact CB-CG2 3.88Å; Q240-C304 HydrophobicContact CB-CB 4.38Å; Q240-C304 HydrophobicContact CG-CB 3.98Å
241	P	98.2	Very high	98.3	Very high	66 Å²	66	41.9 Å²	41.9	43%	0.429	21%	0.205	S	C	.	.			trans	-53.1	137.1	177.8	-26.4	34.7	0	0	0	111.9	K243 L244 V245	P241-K243 PolarHBondContact O-N 3.01Å; P241-K243 VanDerWaalsContact O-N 3.12Å; P241-L244 HydrophobicContact CB-CB 4.44Å; P241-L244 WeakPolarHBondContact O-CA 3.26Å; P241-L244 WeakPolarHBondContact O-CB 3.48Å; P241-L244 PolarHBondContact O-N 2.99Å; P241-V245 PolarHBondContact O-N 3.39Å
242	F	98.4	Very high	98.2	Very high	8 Å²	8	41 Å²	41	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-49.4	-45.3	-175.4	-178.5	-91.2	0	0	0	113	I152 L155 E156 M199 Y202 L203 Q240 L244 V245 E246	I152-F242 HydrophobicContact CG2-CZ 4.36Å; L155-F242 HydrophobicContact CB-CE2 3.88Å; L155-F242 HydrophobicContact CB-CZ 4.42Å; E156-F242 HydrophobicContact CB-CD1 3.82Å; E156-F242 HydrophobicContact CB-CD2 4.08Å; E156-F242 HydrophobicContact CB-CE1 3.84Å; E156-F242 HydrophobicContact CB-CE2 4.09Å; E156-F242 HydrophobicContact CB-CG 3.95Å; E156-F242 HydrophobicContact CB-CZ 3.97Å; E156-F242 HydrophobicContact CG-CB 4.33Å; E156-F242 HydrophobicContact CG-CD1 3.8Å; E156-F242 HydrophobicContact CG-CE1 4.26Å; E156-F242 HydrophobicContact CG-CG 3.98Å; M199-F242 HydrophobicContact CE-CD2 3.97Å; M199-F242 HydrophobicContact CE-CE1 4.06Å; M199-F242 HydrophobicContact CE-CE2 3.39Å; M199-F242 HydrophobicContact CE-CZ 3.44Å; M199-F242 VanDerWaalsContact CE-CZ 3.44Å; Y202-F242 VanDerWaalsContact OH-CD2 3.24Å; Y202-F242 WeakPolarHBondContact OH-CD2 3.24Å; L203-F242 HydrophobicContact CD1-CD2 4.31Å; L203-F242 HydrophobicContact CD1-CE2 4.31Å; Q240-F242 PolarHBondContact O-N 3.38Å; F242-L244 VanDerWaalsContact C-N 3.31Å; F242-L244 PolarHBondContact O-N 2.97Å; F242-V245 PolarHBondContact O-N 3.35Å; F242-E246 HydrophobicContact CE1-CB 4.3Å; F242-E246 WeakPolarHBondContact O-CB 3.37Å; F242-E246 PolarHBondContact O-N 3.47Å
243	K	98.3	Very high	98.1	Very high	94 Å²	94	41.7 Å²	41.7	41%	0.409	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-31.6	-179.8	-65	-56.3	-170	-143.9	0	113.4	E156 P241 E246 K247 F318	E156-K243 WeakPolarHBondContact OE1-CE 3.36Å; E156-K243 IonicContact OE1-NZ 3.22Å; E156-K243 PolarHBondContact OE1-NZ 3.08Å; E156-K243 IonicContact OE2-NZ 3.82Å; E156-K243 PolarHBondContact OE2-NZ 2.96Å; P241-K243 PolarHBondContact O-N 3.01Å; P241-K243 VanDerWaalsContact O-N 3.12Å; K243-E246 IonicContact NZ-OE2 3.62Å; K243-K247 VanDerWaalsContact O-CB 3.29Å; K243-K247 WeakPolarHBondContact O-CB 3.36Å; K243-K247 PolarHBondContact O-N 2.87Å; K243-F318 HydrophobicContact CB-CZ 4Å
244	L	98.6	Very high	97.9	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-68	-50.7	174.4	-173.3	159	0	0	0	110.5	Q240 P241 F242 E246 K247 V248 C304 Y307 R308 F318	Q240-L244 HydrophobicContact CB-CD2 4.23Å; P241-L244 HydrophobicContact CB-CB 4.44Å; P241-L244 WeakPolarHBondContact O-CA 3.26Å; P241-L244 WeakPolarHBondContact O-CB 3.48Å; P241-L244 PolarHBondContact O-N 2.99Å; F242-L244 VanDerWaalsContact C-N 3.31Å; F242-L244 PolarHBondContact O-N 2.97Å; L244-E246 VanDerWaalsContact C-N 3.31Å; L244-E246 PolarHBondContact O-N 2.8Å; L244-K247 PolarHBondContact O-N 3.5Å; L244-V248 HydrophobicContact CD2-CG2 4.16Å; L244-V248 WeakPolarHBondContact O-CG2 3.18Å; L244-V248 PolarHBondContact O-N 3.15Å; L244-C304 HydrophobicContact CD2-CB 3.75Å; L244-Y307 HydrophobicContact CD1-CD1 4.49Å; L244-Y307 HydrophobicContact CD2-CD1 4.15Å; L244-Y307 HydrophobicContact CG-CD1 4.07Å; L244-Y307 HydrophobicContact CG-CE1 4.49Å; L244-R308 HydrophobicContact CD1-CB 3.79Å; L244-R308 HydrophobicContact CD1-CG 4.24Å; L244-F318 HydrophobicContact CB-CE2 4.15Å
245	V	98.8	Very high	97.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-46.6	176.9	-175.9	0	0	0	0	110.2	M199 Y202 I238 Q240 P241 F242 K247 V248 V249	M199-V245 HydrophobicContact CE-CG1 4.49Å; M199-V245 HydrophobicContact SD-CG1 4.06Å; Y202-V245 HydrophobicContact CD1-CG1 4.33Å; Y202-V245 HydrophobicContact CE1-CG1 3.96Å; Y202-V245 HydrophobicContact CE2-CG1 4.46Å; Y202-V245 HydrophobicContact CE2-CG2 4.43Å; I238-V245 HydrophobicContact CD1-CG1 4.09Å; I238-V245 HydrophobicContact CG2-CG2 3.84Å; Q240-V245 HydrophobicContact CB-CG2 3.88Å; P241-V245 PolarHBondContact O-N 3.39Å; F242-V245 PolarHBondContact O-N 3.35Å; V245-K247 VanDerWaalsContact C-N 3.35Å; V245-K247 PolarHBondContact O-N 3.21Å; V245-V248 PolarHBondContact O-N 2.79Å; V245-V249 HydrophobicContact CG1-CG2 4.06Å; V245-V249 WeakPolarHBondContact O-CB 3.49Å; V245-V249 WeakPolarHBondContact O-CG2 3.11Å; V245-V249 PolarHBondContact O-N 3.31Å
246	E	98.4	Very high	97.4	Very high	31 Å²	31	41.2 Å²	41.2	15%	0.145	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-45.5	177.7	-175.5	170.7	-140.5	0	0	111.8	R195 M199 F242 K243 L244 Q250	R195-E246 IonicContact CZ-OE1 2.86Å; R195-E246 IonicContact NH1-OE1 3.77Å; R195-E246 PolarHBondContact NH1-OE1 3.41Å; M199-E246 HydrophobicContact CE-CB 3.76Å; M199-E246 HydrophobicContact CE-CG 4.36Å; M199-E246 HydrophobicContact SD-CB 4.37Å; F242-E246 HydrophobicContact CE1-CB 4.3Å; F242-E246 WeakPolarHBondContact O-CB 3.37Å; F242-E246 PolarHBondContact O-N 3.47Å; K243-E246 IonicContact NZ-OE2 3.62Å; L244-E246 VanDerWaalsContact C-N 3.31Å; L244-E246 PolarHBondContact O-N 2.8Å; E246-Q250 WeakPolarHBondContact O-CB 3.1Å; E246-Q250 PolarHBondContact O-N 3.22Å
247	K	98.3	Very high	97.1	Very high	34 Å²	34	50 Å²	50	15%	0.148	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-48.8	179.1	-173	178.3	-176.2	-179.1	0	111.4	K243 L244 V245 N251 L267 Y307 L317 F318 Y320	K243-K247 VanDerWaalsContact O-CB 3.29Å; K243-K247 WeakPolarHBondContact O-CB 3.36Å; K243-K247 PolarHBondContact O-N 2.87Å; L244-K247 PolarHBondContact O-N 3.5Å; V245-K247 VanDerWaalsContact C-N 3.35Å; V245-K247 PolarHBondContact O-N 3.21Å; K247-N251 PolarHBondContact O-N 3.03Å; K247-N251 VanDerWaalsContact O-N 3.15Å; K247-N251 PolarHBondContact O-ND2 2.73Å; K247-L267 HydrophobicContact CD-CD2 4.3Å; K247-L267 HydrophobicContact CG-CD2 3.91Å; K247-Y307 HydrophobicContact CD-CE1 4.43Å; K247-Y307 PolarHBondContact NZ-OH 3.31Å; K247-L317 PolarHBondContact NZ-O 3Å; K247-F318 HydrophobicContact CD-CD2 4.27Å; K247-F318 HydrophobicContact CD-CE2 4.2Å; K247-F318 VanDerWaalsContact NZ-C 3.33Å; K247-F318 PolarHBondContact NZ-O 2.99Å; K247-Y320 WeakPolarHBondContact CE-O 3.06Å; K247-Y320 PolarHBondContact NZ-O 3.21Å
248	V	98.6	Very high	97	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-51.5	179.2	174.2	0	0	0	0	110.5	L244 V245 Q250 N251 V252 L264 L267 F300 L303 Y307	L244-V248 HydrophobicContact CD2-CG2 4.16Å; L244-V248 WeakPolarHBondContact O-CG2 3.18Å; L244-V248 PolarHBondContact O-N 3.15Å; V245-V248 PolarHBondContact O-N 2.79Å; V248-Q250 VanDerWaalsContact C-N 3.34Å; V248-Q250 PolarHBondContact O-N 3.08Å; V248-N251 PolarHBondContact O-N 3.02Å; V248-V252 WeakPolarHBondContact O-CG2 3.32Å; V248-V252 PolarHBondContact O-N 2.73Å; V248-L264 HydrophobicContact CG1-CD2 4.31Å; V248-L267 HydrophobicContact CG2-CD1 4.27Å; V248-F300 HydrophobicContact CG1-CD1 4.5Å; V248-L303 HydrophobicContact CG1-CB 4.08Å; V248-Y307 HydrophobicContact CG2-CD1 3.53Å; V248-Y307 HydrophobicContact CG2-CE1 4.15Å; V248-Y307 HydrophobicContact CG2-CG 4.03Å
249	V	98.2	Very high	97	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-41.3	-178.3	178.1	0	0	0	0	111.3	R195 V198 M199 V245 V252 F253 F300	R195-V249 HydrophobicContact CB-CG1 4.08Å; R195-V249 HydrophobicContact CG-CG1 3.79Å; V198-V249 HydrophobicContact CB-CG1 3.89Å; V198-V249 HydrophobicContact CB-CG2 4.21Å; V198-V249 HydrophobicContact CG1-CG1 4.31Å; V198-V249 HydrophobicContact CG1-CG2 3.71Å; V198-V249 HydrophobicContact CG2-CG1 4.13Å; M199-V249 HydrophobicContact SD-CB 4.24Å; M199-V249 HydrophobicContact SD-CG1 4.46Å; M199-V249 HydrophobicContact SD-CG2 4.17Å; V245-V249 HydrophobicContact CG1-CG2 4.06Å; V245-V249 WeakPolarHBondContact O-CB 3.49Å; V245-V249 WeakPolarHBondContact O-CG2 3.11Å; V245-V249 PolarHBondContact O-N 3.31Å; V249-V252 PolarHBondContact O-N 3.26Å; V249-F253 HydrophobicContact CG1-CD2 3.82Å; V249-F253 HydrophobicContact CG1-CE2 4.09Å; V249-F253 WeakPolarHBondContact O-CD2 3.46Å; V249-F253 PolarHBondContact O-N 3.49Å; V249-F253 VanDerWaalsContact O-N 3.07Å; V249-F300 HydrophobicContact CB-CE1 4.23Å; V249-F300 HydrophobicContact CG1-CE1 4.38Å; V249-F300 HydrophobicContact CG2-CD1 3.63Å; V249-F300 HydrophobicContact CG2-CE1 3.76Å; V249-F300 HydrophobicContact CG2-CG 4.27Å
250	Q	97.3	Very high	97	Very high	87 Å²	87	52.1 Å²	52.1	41%	0.407	23%	0.227	S	C	.	.	H	α-helix	trans	-60.6	-46.7	178.3	177.5	176.6	-18.2	0	0	111.9	E246 V248 F253 Q254	E246-Q250 WeakPolarHBondContact O-CB 3.1Å; E246-Q250 PolarHBondContact O-N 3.22Å; V248-Q250 VanDerWaalsContact C-N 3.34Å; V248-Q250 PolarHBondContact O-N 3.08Å; Q250-F253 PolarHBondContact O-N 2.83Å; Q250-Q254 PolarHBondContact O-N 3.44Å; Q250-Q254 VanDerWaalsContact O-N 3.14Å
251	N	97.9	Very high	97	Very high	14 Å²	14	52.6 Å²	52.6	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-41.4	179.8	-80.7	-74.7	0	0	0	111.6	K247 V248 F253 Q254 G263 M266 L267	K247-N251 PolarHBondContact O-N 3.03Å; K247-N251 VanDerWaalsContact O-N 3.15Å; K247-N251 PolarHBondContact O-ND2 2.73Å; V248-N251 PolarHBondContact O-N 3.02Å; N251-F253 PolarHBondContact O-N 2.74Å; N251-Q254 WeakPolarHBondContact O-CB 3.06Å; N251-Q254 PolarHBondContact O-N 2.97Å; N251-G263 CarbonylContact O-C 3.52Å; N251-G263 WeakPolarHBondContact O-CA 2.89Å; N251-M266 VanDerWaalsContact OD1-CB 3.31Å; N251-M266 WeakPolarHBondContact OD1-CB 3.34Å; N251-L267 HydrophobicContact CB-CD2 4.08Å; N251-L267 HydrophobicContact CB-CG 4.19Å; N251-L267 WeakPolarHBondContact ND2-CD2 3.4Å
252	V	97.3	Very high	96.9	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-57.4	-46.8	174.5	168	0	0	0	0	111.9	V248 V249 Q254 L264 P292 L295 F300	V248-V252 WeakPolarHBondContact O-CG2 3.32Å; V248-V252 PolarHBondContact O-N 2.73Å; V249-V252 PolarHBondContact O-N 3.26Å; V252-Q254 PolarHBondContact O-N 2.71Å; V252-L264 HydrophobicContact CG2-CD1 4.49Å; V252-L264 HydrophobicContact CG2-CD2 3.39Å; V252-L264 HydrophobicContact CG2-CG 3.75Å; V252-P292 HydrophobicContact CG1-CB 3.85Å; V252-P292 HydrophobicContact CG1-CG 4.24Å; V252-P292 WeakPolarHBondContact O-CG 3.38Å; V252-L295 HydrophobicContact CG1-CD1 3.59Å; V252-F300 HydrophobicContact CB-CE1 3.97Å; V252-F300 HydrophobicContact CB-CZ 4.24Å; V252-F300 HydrophobicContact CG1-CE1 3.92Å; V252-F300 HydrophobicContact CG1-CZ 3.72Å; V252-F300 HydrophobicContact CG2-CE1 3.91Å
253	F	96.8	Very high	96.9	Very high	16 Å²	16	57 Å²	57	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-83.8	-3.2	-175.6	-80.9	-76.5	0	0	0	115.2	R193 R195 V198 V249 Q250 N251 F255 R256 P292 R293 F300	R193-F253 HydrophobicContact CG-CE1 4.32Å; R193-F253 HydrophobicContact CG-CZ 3.97Å; R195-F253 HydrophobicContact CB-CB 4.5Å; R195-F253 HydrophobicContact CB-CD2 4.39Å; V198-F253 HydrophobicContact CG2-CE2 3.75Å; V198-F253 HydrophobicContact CG2-CZ 4.29Å; V249-F253 HydrophobicContact CG1-CD2 3.82Å; V249-F253 HydrophobicContact CG1-CE2 4.09Å; V249-F253 WeakPolarHBondContact O-CD2 3.46Å; V249-F253 PolarHBondContact O-N 3.49Å; V249-F253 VanDerWaalsContact O-N 3.07Å; Q250-F253 PolarHBondContact O-N 2.83Å; N251-F253 PolarHBondContact O-N 2.74Å; F253-F255 VanDerWaalsContact C-N 3.3Å; F253-F255 PolarHBondContact O-N 3.46Å; F253-R256 WeakPolarHBondContact O-CG 3.16Å; F253-P292 HydrophobicContact CD1-CB 3.74Å; F253-P292 HydrophobicContact CE1-CB 3.8Å; F253-P292 HydrophobicContact CG-CB 4.31Å; F253-P292 HydrophobicContact CZ-CB 4.39Å; F253-P292 WeakPolarHBondContact CZ-O 3.22Å; F253-R293 HydrophobicContact CE1-CG 4.33Å; F253-F300 HydrophobicContact CD2-CZ 4.31Å; F253-F300 HydrophobicContact CE2-CE2 4.11Å; F253-F300 AromaticContact CE2-CZ 3.63Å; F253-F300 HydrophobicContact CE2-CZ 3.63Å; F253-F300 HydrophobicContact CZ-CZ 4.41Å
254	Q	94.2	Very high	96.8	Very high	69 Å²	69	52.5 Å²	52.5	32%	0.322	22%	0.218	S	C	.	.	H	α-helix	trans	-59.4	-40.5	177.7	-177.2	176	-8.9	0	0	112.1	Q250 N251 V252 F322	Q250-Q254 PolarHBondContact O-N 3.44Å; Q250-Q254 VanDerWaalsContact O-N 3.14Å; N251-Q254 WeakPolarHBondContact O-CB 3.06Å; N251-Q254 PolarHBondContact O-N 2.97Å; V252-Q254 PolarHBondContact O-N 2.71Å; Q254-F322 VanDerWaalsContact NE2-CZ 3.29Å
255	F	94.2	Very high	96.8	Very high	75 Å²	75	52.4 Å²	52.4	33%	0.329	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	69.3	-178	-53.9	-61.2	0	0	0	112.1	F253 R257 K258 R262 M266	F253-F255 VanDerWaalsContact C-N 3.3Å; F253-F255 PolarHBondContact O-N 3.46Å; F255-R257 PolarHBondContact O-N 3.07Å; F255-K258 HydrophobicContact CB-CB 3.93Å; F255-K258 HydrophobicContact CB-CG 4.06Å; F255-K258 PolarHBondContact O-N 3.35Å; F255-R262 HydrophobicContact CD2-CB 4.31Å; F255-M266 HydrophobicContact CE2-CG 3.86Å; F255-M266 HydrophobicContact CE2-SD 4.29Å
256	R	90.9	Very high	96.7	Very high	86 Å²	86	53.7 Å²	53.7	33%	0.325	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-26.4	-174.8	-62.3	178.3	63.9	74.1	-4.9	116	K191 R193 F253	K191-R256 PolarHBondContact O-NH2 3.36Å; R193-R256 PolarHBondContact O-NH1 3.22Å; R193-R256 PolarHBondContact O-NH2 3.38Å; F253-R256 WeakPolarHBondContact O-CG 3.16Å
257	R	93.3	Very high	96.7	Very high	216 Å²	216	52.2 Å²	52.2	82%	0.815	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-4.7	-177.1	-62.1	-176.8	-176.6	174.6	1.3	113.6	F255 R291	F255-R257 PolarHBondContact O-N 3.07Å; R257-R291 PolarHBondContact O-NH1 3.3Å
258	K	96.3	Very high	96.7	Very high	131 Å²	131	50.6 Å²	50.6	57%	0.57	21%	0.21	S	C	*	.	S	Bend	trans	-104.1	168.4	177.9	-59.2	-63.5	-174.6	176.8	0	109.9	F255 R262 P292	F255-K258 HydrophobicContact CB-CB 3.93Å; F255-K258 HydrophobicContact CB-CG 4.06Å; F255-K258 PolarHBondContact O-N 3.35Å; K258-R262 HydrophobicContact CB-CB 4.15Å; K258-R262 HydrophobicContact CB-CG 4.21Å; K258-P292 WeakPolarHBondContact O-CD 3.35Å
259	Y	97.9	Very high	96.6	Very high	124 Å²	124	52 Å²	52	49%	0.486	22%	0.22	S	C	.	.			trans	-65	149.7	171	-56.5	-32	0	0	0	111.2	H261 R262 P288 T289 L290 R291	Y259-H261 PolarHBondContact O-N 3.03Å; Y259-R262 WeakPolarHBondContact O-CB 3.33Å; Y259-R262 PolarHBondContact O-N 3.3Å; Y259-P288 WeakPolarHBondContact CB-O 3.37Å; Y259-T289 WeakPolarHBondContact CD1-O 3.39Å; Y259-T289 HydrophobicContact CD2-CG2 4.41Å; Y259-T289 WeakPolarHBondContact CE1-O 3.22Å; Y259-T289 HydrophobicContact CE2-CG2 4.29Å; Y259-L290 CarbonylContact C-O 3.55Å; Y259-R291 HydrophobicContact CD1-CG 4.43Å
260	C	96.8	Very high	96.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-31.2	-175	61	0	0	0	0	112.2	R262 G263 L264 L290 L295	C260-R262 PolarHBondContact O-N 2.97Å; C260-R262 VanDerWaalsContact O-N 3.14Å; C260-G263 PolarHBondContact O-N 3.4Å; C260-L264 HydrophobicContact CB-CD1 4.36Å; C260-L264 PolarHBondContact O-N 3.43Å; C260-L290 WeakPolarHBondContact CB-O 3.1Å; C260-L290 PolarHBondContact N-O 3.14Å; C260-L290 PolarHBondContact SG-O 2.78Å; C260-L295 HydrophobicContact CB-CD1 3.77Å
261	H	97.6	Very high	96.3	Very high	47 Å²	47	56.8 Å²	56.8	22%	0.218	26%	0.26	C	S	.	.	H	α-helix	trans	-47.8	-40.8	170.9	178.6	-66.9	0	0	0	112.6	Y259 G263 G265 L281 P288	Y259-H261 PolarHBondContact O-N 3.03Å; H261-G263 VanDerWaalsContact C-N 3.34Å; H261-G263 PolarHBondContact O-N 2.88Å; H261-G265 PolarHBondContact O-N 3.15Å; H261-L281 HydrophobicContact CB-CD1 3.95Å; H261-P288 HydrophobicContact CB-CB 4.26Å; H261-P288 WeakPolarHBondContact CB-O 3.23Å
262	R	97.3	Very high	96.2	Very high	165 Å²	165	60.4 Å²	60.4	62%	0.623	28%	0.276	S	S	*	.	H	α-helix	trans	-67.3	-35.1	179.9	-67.4	-65	-173.8	176.6	-0.7	112.8	F255 K258 Y259 C260	F255-R262 HydrophobicContact CD2-CB 4.31Å; K258-R262 HydrophobicContact CB-CB 4.15Å; K258-R262 HydrophobicContact CB-CG 4.21Å; Y259-R262 WeakPolarHBondContact O-CB 3.33Å; Y259-R262 PolarHBondContact O-N 3.3Å; C260-R262 PolarHBondContact O-N 2.97Å; C260-R262 VanDerWaalsContact O-N 3.14Å
263	G	97.3	Very high	96.2	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-75	-49.2	176	0	0	0	0	0	111.6	N251 C260 H261 G265 M266	N251-G263 CarbonylContact O-C 3.52Å; N251-G263 WeakPolarHBondContact O-CA 2.89Å; C260-G263 PolarHBondContact O-N 3.4Å; H261-G263 VanDerWaalsContact C-N 3.34Å; H261-G263 PolarHBondContact O-N 2.88Å; G263-G265 VanDerWaalsContact C-N 3.27Å; G263-G265 PolarHBondContact O-N 2.95Å; G263-M266 WeakPolarHBondContact O-CB 3.22Å; G263-M266 PolarHBondContact O-N 3.02Å
264	L	97.9	Very high	96.1	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.9	-36	179.9	-71.7	167.1	0	0	0	112.7	V248 V252 C260 M266 L267 T277 L280 L281 L303	V248-L264 HydrophobicContact CG1-CD2 4.31Å; V252-L264 HydrophobicContact CG2-CD1 4.49Å; V252-L264 HydrophobicContact CG2-CD2 3.39Å; V252-L264 HydrophobicContact CG2-CG 3.75Å; C260-L264 HydrophobicContact CB-CD1 4.36Å; C260-L264 PolarHBondContact O-N 3.43Å; L264-M266 PolarHBondContact O-N 3.24Å; L264-M266 VanDerWaalsContact O-N 3.07Å; L264-L267 HydrophobicContact CD2-CD1 4.01Å; L264-L267 WeakPolarHBondContact O-CB 3.4Å; L264-L267 WeakPolarHBondContact O-CG 3.41Å; L264-L267 PolarHBondContact O-N 3.1Å; L264-T277 HydrophobicContact CB-CG2 4.12Å; L264-L280 HydrophobicContact CB-CD2 4.4Å; L264-L280 HydrophobicContact CD2-CD2 4.07Å; L264-L281 HydrophobicContact CD1-CD1 4.34Å; L264-L281 HydrophobicContact CD1-CD2 3.59Å; L264-L281 HydrophobicContact CD1-CG 4.05Å; L264-L303 HydrophobicContact CD1-CD1 4.33Å; L264-L303 HydrophobicContact CD1-CD2 3.84Å; L264-L303 HydrophobicContact CD2-CD1 4.24Å; L264-L303 HydrophobicContact CD2-CD2 4.13Å
265	G	97.6	Very high	96.3	Very high	2 Å²	2	72.2 Å²	72.2	2%	0.021	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-62.5	-16.4	176	0	0	0	0	0	114.9	H261 G263 L267 F268 R273 T277	H261-G265 PolarHBondContact O-N 3.15Å; G263-G265 VanDerWaalsContact C-N 3.27Å; G263-G265 PolarHBondContact O-N 2.95Å; G265-L267 PolarHBondContact O-N 3.43Å; G265-F268 PolarHBondContact O-N 3.38Å; G265-R273 VanDerWaalsContact O-CD 3.28Å; G265-R273 WeakPolarHBondContact O-CD 3.38Å; G265-R273 VanDerWaalsContact O-CG 3.29Å; G265-R273 WeakPolarHBondContact O-CG 3.33Å; G265-R273 PolarHBondContact O-NE 2.7Å; G265-T277 WeakPolarHBondContact CA-OG1 3.49Å
266	M	97.4	Very high	96.5	Very high	27 Å²	27	69.7 Å²	69.7	13%	0.133	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-75.5	-3.8	173.5	-56.3	-61.4	90.7	0	0	112.9	N251 F255 G263 L264 F268 Y320 F322	N251-M266 VanDerWaalsContact OD1-CB 3.31Å; N251-M266 WeakPolarHBondContact OD1-CB 3.34Å; F255-M266 HydrophobicContact CE2-CG 3.86Å; F255-M266 HydrophobicContact CE2-SD 4.29Å; G263-M266 WeakPolarHBondContact O-CB 3.22Å; G263-M266 PolarHBondContact O-N 3.02Å; L264-M266 PolarHBondContact O-N 3.24Å; L264-M266 VanDerWaalsContact O-N 3.07Å; M266-F268 VanDerWaalsContact C-N 3.3Å; M266-Y320 WeakPolarHBondContact O-CE1 3.08Å; M266-F322 HydrophobicContact CB-CB 4.49Å; M266-F322 HydrophobicContact CB-CD1 3.78Å; M266-F322 HydrophobicContact CB-CE1 4.17Å; M266-F322 HydrophobicContact CB-CG 4.05Å; M266-F322 HydrophobicContact CG-CD1 4.48Å; M266-F322 HydrophobicContact CG-CG 4.48Å; M266-F322 HydrophobicContact SD-CD2 3.94Å; M266-F322 HydrophobicContact SD-CE2 4.34Å; M266-F322 HydrophobicContact SD-CG 4.17Å
267	L	97.6	Very high	96.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-78.5	-14.2	169.9	-64.6	170.9	0	0	0	113	K247 V248 N251 L264 G265 L280 Y307 L317 Y320	K247-L267 HydrophobicContact CD-CD2 4.3Å; K247-L267 HydrophobicContact CG-CD2 3.91Å; V248-L267 HydrophobicContact CG2-CD1 4.27Å; N251-L267 HydrophobicContact CB-CD2 4.08Å; N251-L267 HydrophobicContact CB-CG 4.19Å; N251-L267 WeakPolarHBondContact ND2-CD2 3.4Å; L264-L267 HydrophobicContact CD2-CD1 4.01Å; L264-L267 WeakPolarHBondContact O-CB 3.4Å; L264-L267 WeakPolarHBondContact O-CG 3.41Å; L264-L267 PolarHBondContact O-N 3.1Å; G265-L267 PolarHBondContact O-N 3.43Å; L267-L280 HydrophobicContact CD1-CD2 4.25Å; L267-Y307 HydrophobicContact CB-CE2 3.84Å; L267-Y307 HydrophobicContact CD1-CD2 4.11Å; L267-Y307 HydrophobicContact CD1-CE2 4.11Å; L267-Y307 HydrophobicContact CD1-CG 4.47Å; L267-Y307 HydrophobicContact CD2-CE1 4.36Å; L267-Y307 HydrophobicContact CD2-CE2 4.34Å; L267-Y307 HydrophobicContact CG-CE2 4.33Å; L267-L317 VanDerWaalsContact O-CD1 3.29Å; L267-L317 WeakPolarHBondContact O-CD1 3.26Å; L267-Y320 VanDerWaalsContact O-CD1 3.26Å; L267-Y320 WeakPolarHBondContact O-CD1 3.37Å
268	F	98	Very high	97.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-122.9	143.2	-171.5	-55.6	-76.5	0	0	0	112.1	G265 M266 R273 N276 L280 Y307 M310 L317 Y320	G265-F268 PolarHBondContact O-N 3.38Å; M266-F268 VanDerWaalsContact C-N 3.3Å; F268-R273 PolarHBondContact O-NE 3.19Å; F268-R273 PolarHBondContact O-NH2 3.1Å; F268-N276 HydrophobicContact CB-CB 4.3Å; F268-N276 HydrophobicContact CD1-CB 3.39Å; F268-N276 HydrophobicContact CD2-CB 4.05Å; F268-N276 HydrophobicContact CE1-CB 3.59Å; F268-N276 HydrophobicContact CE2-CB 4.22Å; F268-N276 HydrophobicContact CG-CB 3.65Å; F268-N276 HydrophobicContact CZ-CB 4Å; F268-L280 HydrophobicContact CE2-CB 4.3Å; F268-L280 HydrophobicContact CE2-CD2 3.82Å; F268-L280 HydrophobicContact CZ-CB 4.13Å; F268-L280 HydrophobicContact CZ-CD2 3.91Å; F268-Y307 HydrophobicContact CE1-CD2 4.45Å; F268-Y307 HydrophobicContact CE1-CE2 4.34Å; F268-Y307 HydrophobicContact CZ-CD2 4.24Å; F268-Y307 HydrophobicContact CZ-CE2 4.42Å; F268-M310 HydrophobicContact CE1-SD 3.89Å; F268-M310 HydrophobicContact CZ-SD 3.78Å; F268-L317 HydrophobicContact CD1-CD1 3.55Å; F268-L317 HydrophobicContact CD1-CD2 4.16Å; F268-L317 HydrophobicContact CD1-CG 4.45Å; F268-L317 HydrophobicContact CE1-CD1 4.03Å; F268-L317 HydrophobicContact CE1-CD2 3.78Å; F268-L317 HydrophobicContact CE1-CG 4.47Å; F268-L317 HydrophobicContact CG-CD1 4.48Å; F268-Y320 WeakPolarHBondContact O-CE1 3.3Å; F268-Y320 PolarHBondContact O-OH 3.12Å; F268-Y320 VanDerWaalsContact O-OH 3.09Å
269	P	96.6	Very high	97.2	Very high	32 Å²	32	55.2 Å²	55.2	21%	0.208	27%	0.274	C	S	.	.			trans	-50.9	149.6	171.5	-26.3	34.8	0	0	0	112.8	A271 E272 R273 Y320	P269-A271 PolarHBondContact O-N 3.14Å; P269-A271 VanDerWaalsContact O-N 3.16Å; P269-E272 PolarHBondContact O-N 3.37Å; P269-R273 WeakPolarHBondContact O-CA 3.41Å; P269-R273 VanDerWaalsContact O-CB 3.31Å; P269-R273 WeakPolarHBondContact O-CB 3.45Å; P269-R273 PolarHBondContact O-N 2.91Å; P269-Y320 HydrophobicContact CB-CD2 4.49Å; P269-Y320 HydrophobicContact CB-CE2 4.1Å; P269-Y320 HydrophobicContact CG-CD2 3.87Å; P269-Y320 HydrophobicContact CG-CE2 3.96Å; P269-Y320 HydrophobicContact CG-CG 4.28Å
270	E	95.3	Very high	97.2	Very high	85 Å²	85	49.3 Å²	49.3	40%	0.397	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.8	-175.3	-173	170.2	-169.2	0	0	112.7	E272 E325 R329	E270-E272 PolarHBondContact O-N 3.4Å; E270-E325 WeakPolarHBondContact CB-OE1 3.43Å; E270-E325 PolarHBondContact N-OE1 2.98Å; E270-E325 PolarHBondContact N-OE2 3.41Å; E270-R329 IonicContact OE1-CZ 3.83Å; E270-R329 IonicContact OE1-NH1 2.74Å; E270-R329 PolarHBondContact OE1-NH1 3.35Å; E270-R329 IonicContact OE2-CZ 3.85Å; E270-R329 IonicContact OE2-NH1 2.79Å; E270-R329 PolarHBondContact OE2-NH1 2.96Å
271	A	94.6	Very high	97.3	Very high	102 Å²	102	49.6 Å²	49.6	84%	0.843	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-38.4	-179.4	0	0	0	0	0	113.6	P269	P269-A271 PolarHBondContact O-N 3.14Å; P269-A271 VanDerWaalsContact O-N 3.16Å
272	E	95.4	Very high	97.3	Very high	90 Å²	90	54.8 Å²	54.8	42%	0.421	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	0.2	-173.3	-57.6	174.8	-179.7	0	0	112.4	P269 E270 L274 E275 N276	P269-E272 PolarHBondContact O-N 3.37Å; E270-E272 PolarHBondContact O-N 3.4Å; E272-L274 VanDerWaalsContact C-N 3.32Å; E272-L274 PolarHBondContact O-N 2.9Å; E272-E275 PolarHBondContact O-N 2.9Å; E272-N276 WeakPolarHBondContact CB-ND2 3.13Å; E272-N276 WeakPolarHBondContact O-CB 3.11Å; E272-N276 PolarHBondContact O-N 3.12Å; E272-N276 PolarHBondContact OE2-ND2 3.39Å; E272-N276 VanDerWaalsContact OE2-ND2 3.11Å
273	R	96.8	Very high	97.4	Very high	50 Å²	50	51 Å²	51	19%	0.189	27%	0.268	C	S	.	.	H	α-helix	trans	-55.2	-44.8	-170.3	-178.9	172.2	-62.7	143.3	6.2	113.1	G265 F268 P269 T277 Y320 E325	G265-R273 VanDerWaalsContact O-CD 3.28Å; G265-R273 WeakPolarHBondContact O-CD 3.38Å; G265-R273 VanDerWaalsContact O-CG 3.29Å; G265-R273 WeakPolarHBondContact O-CG 3.33Å; G265-R273 PolarHBondContact O-NE 2.7Å; F268-R273 PolarHBondContact O-NE 3.19Å; F268-R273 PolarHBondContact O-NH2 3.1Å; P269-R273 WeakPolarHBondContact O-CA 3.41Å; P269-R273 VanDerWaalsContact O-CB 3.31Å; P269-R273 WeakPolarHBondContact O-CB 3.45Å; P269-R273 PolarHBondContact O-N 2.91Å; R273-T277 WeakPolarHBondContact O-CB 3.36Å; R273-T277 PolarHBondContact O-N 2.83Å; R273-T277 PolarHBondContact O-OG1 3.06Å; R273-Y320 PolarHBondContact NH2-OH 3.09Å; R273-Y320 VanDerWaalsContact NH2-OH 3.09Å; R273-E325 IonicContact NH2-OE2 2.7Å; R273-E325 PolarHBondContact NH2-OE2 3.32Å
274	L	96.4	Very high	97.4	Very high	139 Å²	139	51.2 Å²	51.2	73%	0.728	27%	0.27	S	S	*	.	H	α-helix	trans	-65	-50.5	-174.7	-178.2	61.9	0	0	0	110.9	E272 G278	E272-L274 VanDerWaalsContact C-N 3.32Å; E272-L274 PolarHBondContact O-N 2.9Å; L274-G278 PolarHBondContact O-N 3.3Å
275	E	97.6	Very high	97.4	Very high	144 Å²	144	58.2 Å²	58.2	67%	0.673	31%	0.308	S	S	*	.	H	α-helix	trans	-64.8	-53.6	-179.3	-176.3	177.4	177.5	0	0	111.4	E272 T277 G278 R279	E272-E275 PolarHBondContact O-N 2.9Å; E275-T277 VanDerWaalsContact C-N 3.34Å; E275-T277 PolarHBondContact O-N 2.92Å; E275-G278 PolarHBondContact O-N 3.39Å; E275-G278 VanDerWaalsContact O-N 3.14Å; E275-R279 WeakPolarHBondContact O-CB 3.34Å; E275-R279 PolarHBondContact O-N 2.8Å
276	N	97.9	Very high	97.5	Very high	23 Å²	23	58.7 Å²	58.7	12%	0.123	31%	0.309	C	S	.	.	H	α-helix	trans	-67.8	-31.9	-175.6	-76.1	-24.6	0	0	0	113.1	F268 E272 L280	F268-N276 HydrophobicContact CB-CB 4.3Å; F268-N276 HydrophobicContact CD1-CB 3.39Å; F268-N276 HydrophobicContact CD2-CB 4.05Å; F268-N276 HydrophobicContact CE1-CB 3.59Å; F268-N276 HydrophobicContact CE2-CB 4.22Å; F268-N276 HydrophobicContact CG-CB 3.65Å; F268-N276 HydrophobicContact CZ-CB 4Å; E272-N276 WeakPolarHBondContact CB-ND2 3.13Å; E272-N276 WeakPolarHBondContact O-CB 3.11Å; E272-N276 PolarHBondContact O-N 3.12Å; E272-N276 PolarHBondContact OE2-ND2 3.39Å; E272-N276 VanDerWaalsContact OE2-ND2 3.11Å; N276-L280 WeakPolarHBondContact O-CB 3.38Å; N276-L280 PolarHBondContact O-N 3.4Å
277	T	98.3	Very high	97.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.5	-40.3	173.4	-50.6	0	0	0	0	111.4	L264 G265 R273 E275 L281	L264-T277 HydrophobicContact CB-CG2 4.12Å; G265-T277 WeakPolarHBondContact CA-OG1 3.49Å; R273-T277 WeakPolarHBondContact O-CB 3.36Å; R273-T277 PolarHBondContact O-N 2.83Å; R273-T277 PolarHBondContact O-OG1 3.06Å; E275-T277 VanDerWaalsContact C-N 3.34Å; E275-T277 PolarHBondContact O-N 2.92Å; T277-L281 HydrophobicContact CG2-CD1 3.96Å; T277-L281 WeakPolarHBondContact O-CD1 3.49Å; T277-L281 WeakPolarHBondContact O-CG 3.49Å; T277-L281 PolarHBondContact O-N 3.2Å; T277-L281 VanDerWaalsContact O-N 3.13Å
278	G	98.1	Very high	97.5	Very high	30 Å²	30	63.8 Å²	63.8	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-54	174.4	0	0	0	0	0	111.1	L274 E275 L280 L281 E282	L274-G278 PolarHBondContact O-N 3.3Å; E275-G278 PolarHBondContact O-N 3.39Å; E275-G278 VanDerWaalsContact O-N 3.14Å; G278-L280 VanDerWaalsContact C-N 3.3Å; G278-L280 PolarHBondContact O-N 3.36Å; G278-L281 PolarHBondContact O-N 3.01Å; G278-L281 VanDerWaalsContact O-N 3.12Å; G278-E282 WeakPolarHBondContact O-CB 3.37Å; G278-E282 PolarHBondContact O-N 2.95Å
279	R	98.2	Very high	97.4	Very high	98 Å²	98	66.9 Å²	66.9	37%	0.37	36%	0.359	S	S	.	.	H	α-helix	trans	-56	-41.8	177	-174.9	177.7	169.6	-157	-8.5	112	E275 L283 M310 E313	E275-R279 WeakPolarHBondContact O-CB 3.34Å; E275-R279 PolarHBondContact O-N 2.8Å; R279-L283 HydrophobicContact CG-CD1 3.74Å; R279-L283 HydrophobicContact CG-CG 4.27Å; R279-L283 VanDerWaalsContact O-CB 3.28Å; R279-L283 WeakPolarHBondContact O-CB 3.46Å; R279-L283 VanDerWaalsContact O-CG 3.23Å; R279-L283 WeakPolarHBondContact O-CG 3.11Å; R279-L283 PolarHBondContact O-N 2.89Å; R279-M310 HydrophobicContact CB-CE 3.92Å; R279-M310 HydrophobicContact CG-CE 3.64Å; R279-E313 IonicContact CZ-OE2 2.61Å; R279-E313 IonicContact NH1-OE2 2.78Å; R279-E313 IonicContact NH2-OE1 3.96Å; R279-E313 IonicContact NH2-OE2 2.82Å; R279-E313 PolarHBondContact NH2-OE2 3.15Å
280	L	98.6	Very high	97.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-46.6	177.1	173.5	62.3	0	0	0	111.9	L264 L267 F268 N276 G278 A284 L303 V306 M310	L264-L280 HydrophobicContact CB-CD2 4.4Å; L264-L280 HydrophobicContact CD2-CD2 4.07Å; L267-L280 HydrophobicContact CD1-CD2 4.25Å; F268-L280 HydrophobicContact CE2-CB 4.3Å; F268-L280 HydrophobicContact CE2-CD2 3.82Å; F268-L280 HydrophobicContact CZ-CB 4.13Å; F268-L280 HydrophobicContact CZ-CD2 3.91Å; N276-L280 WeakPolarHBondContact O-CB 3.38Å; N276-L280 PolarHBondContact O-N 3.4Å; G278-L280 VanDerWaalsContact C-N 3.3Å; G278-L280 PolarHBondContact O-N 3.36Å; L280-A284 WeakPolarHBondContact O-CB 3.01Å; L280-A284 PolarHBondContact O-N 2.78Å; L280-A284 VanDerWaalsContact O-N 3.1Å; L280-L303 HydrophobicContact CD1-CD2 4.25Å; L280-L303 HydrophobicContact CD2-CD2 4.29Å; L280-L303 HydrophobicContact CG-CD2 4.02Å; L280-V306 HydrophobicContact CD1-CB 3.71Å; L280-V306 HydrophobicContact CD1-CG1 3.5Å; L280-M310 HydrophobicContact CB-CE 4.1Å; L280-M310 HydrophobicContact CB-SD 4.2Å; L280-M310 HydrophobicContact CD1-SD 4.34Å
281	L	98.5	Very high	97.6	Very high	6 Å²	6	67.9 Å²	67.9	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-72.5	-38.8	-177.3	-77.2	160.9	0	0	0	112.3	H261 L264 T277 G278 A284 D285 I286 P288 L303	H261-L281 HydrophobicContact CB-CD1 3.95Å; L264-L281 HydrophobicContact CD1-CD1 4.34Å; L264-L281 HydrophobicContact CD1-CD2 3.59Å; L264-L281 HydrophobicContact CD1-CG 4.05Å; T277-L281 HydrophobicContact CG2-CD1 3.96Å; T277-L281 WeakPolarHBondContact O-CD1 3.49Å; T277-L281 WeakPolarHBondContact O-CG 3.49Å; T277-L281 PolarHBondContact O-N 3.2Å; T277-L281 VanDerWaalsContact O-N 3.13Å; G278-L281 PolarHBondContact O-N 3.01Å; G278-L281 VanDerWaalsContact O-N 3.12Å; L281-A284 PolarHBondContact O-N 3.14Å; L281-D285 PolarHBondContact O-N 3Å; L281-D285 VanDerWaalsContact O-N 3.1Å; L281-I286 HydrophobicContact CD2-CB 3.91Å; L281-I286 HydrophobicContact CD2-CG2 3.7Å; L281-I286 PolarHBondContact O-N 2.97Å; L281-P288 HydrophobicContact CD1-CB 3.84Å; L281-L303 HydrophobicContact CD2-CD2 4.41Å
282	E	98.4	Very high	97.7	Very high	156 Å²	156	63.1 Å²	63.1	73%	0.729	32%	0.318	S	S	*	.	H	α-helix	trans	-63.9	-52.4	175.7	-178.3	178.2	-163.4	0	0	111.2	G278 A284 D285	G278-E282 WeakPolarHBondContact O-CB 3.37Å; G278-E282 PolarHBondContact O-N 2.95Å; E282-A284 PolarHBondContact O-N 2.85Å; E282-D285 PolarHBondContact O-N 3.4Å
283	L	98.3	Very high	97.8	Very high	86 Å²	86	62.3 Å²	62.3	45%	0.45	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-24.2	178.2	-69.1	175.9	0	0	0	113.2	R279 V306 M310	R279-L283 HydrophobicContact CG-CD1 3.74Å; R279-L283 HydrophobicContact CG-CG 4.27Å; R279-L283 VanDerWaalsContact O-CB 3.28Å; R279-L283 WeakPolarHBondContact O-CB 3.46Å; R279-L283 VanDerWaalsContact O-CG 3.23Å; R279-L283 WeakPolarHBondContact O-CG 3.11Å; R279-L283 PolarHBondContact O-N 2.89Å; L283-V306 HydrophobicContact CB-CB 4.5Å; L283-V306 HydrophobicContact CB-CG1 3.74Å; L283-V306 HydrophobicContact CB-CG2 3.84Å; L283-V306 HydrophobicContact CD1-CG1 3.96Å; L283-M310 HydrophobicContact CD1-CE 4.46Å
284	A	98.3	Very high	97.8	Very high	6 Å²	6	64.3 Å²	64.3	5%	0.05	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.1	175.9	0	0	0	0	0	113.3	L280 L281 E282 I286 S302 L303 V306	L280-A284 WeakPolarHBondContact O-CB 3.01Å; L280-A284 PolarHBondContact O-N 2.78Å; L280-A284 VanDerWaalsContact O-N 3.1Å; L281-A284 PolarHBondContact O-N 3.14Å; E282-A284 PolarHBondContact O-N 2.85Å; A284-I286 HydrophobicContact CB-CD1 3.78Å; A284-I286 HydrophobicContact CB-CG1 4.25Å; A284-I286 WeakPolarHBondContact O-CG1 3.48Å; A284-S302 WeakPolarHBondContact O-CB 3.47Å; A284-L303 HydrophobicContact CB-CD2 4.04Å; A284-L303 HydrophobicContact CB-CG 4.44Å; A284-V306 HydrophobicContact CB-CG2 4.1Å
285	D	98.3	Very high	97.9	Very high	147 Å²	147	57.7 Å²	57.7	79%	0.786	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	54.4	-174.5	-169.8	32.3	0	0	0	113	L281 E282	L281-D285 PolarHBondContact O-N 3Å; L281-D285 VanDerWaalsContact O-N 3.1Å; E282-D285 PolarHBondContact O-N 3.4Å
286	I	98.3	Very high	97.9	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.056	26%	0.262	C	S	.	.			trans	-127	127.2	-176.1	-68.5	165.2	0	0	0	111	L281 A284 P288 L290 L295 H299 L303	L281-I286 HydrophobicContact CD2-CB 3.91Å; L281-I286 HydrophobicContact CD2-CG2 3.7Å; L281-I286 PolarHBondContact O-N 2.97Å; A284-I286 HydrophobicContact CB-CD1 3.78Å; A284-I286 HydrophobicContact CB-CG1 4.25Å; A284-I286 WeakPolarHBondContact O-CG1 3.48Å; I286-P288 WeakPolarHBondContact O-CD 3.14Å; I286-L290 HydrophobicContact CG2-CD1 4.19Å; I286-L295 HydrophobicContact CG2-CD2 3.84Å; I286-H299 HydrophobicContact CD1-CB 3.76Å; I286-H299 WeakPolarHBondContact CD1-O 3.46Å; I286-H299 HydrophobicContact CG1-CB 4.22Å; I286-L303 HydrophobicContact CD1-CD1 3.89Å; I286-L303 HydrophobicContact CD1-CD2 3.78Å; I286-L303 HydrophobicContact CD1-CG 3.46Å; I286-L303 VanDerWaalsContact CD1-CG 3.46Å
287	D	98	Very high	97.9	Very high	78 Å²	78	51.7 Å²	51.7	42%	0.417	26%	0.262	S	S	.	.			trans	-58.1	118.5	172.3	169.5	4.9	0	0	0	110.7	T289 L290	D287-T289 VanDerWaalsContact CG-OG1 3.24Å; D287-T289 PolarHBondContact O-N 2.87Å; D287-T289 VanDerWaalsContact O-N 3.08Å; D287-T289 WeakPolarHBondContact OD1-CA 3.23Å; D287-T289 WeakPolarHBondContact OD1-CB 3.28Å; D287-T289 PolarHBondContact OD1-N 2.96Å; D287-T289 PolarHBondContact OD1-OG1 3.46Å; D287-T289 PolarHBondContact OD2-OG1 3.23Å; D287-L290 HydrophobicContact CB-CD1 4.27Å; D287-L290 HydrophobicContact CB-CG 3.96Å; D287-L290 WeakPolarHBondContact O-CG 3.18Å; D287-L290 PolarHBondContact O-N 3.34Å; D287-L290 VanDerWaalsContact O-N 3.15Å
288	P	97	Very high	97.9	Very high	57 Å²	57	55.2 Å²	55.2	37%	0.37	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.2	-176.4	27	-36.3	0	0	0	113.5	Y259 H261 L281 I286	Y259-P288 WeakPolarHBondContact CB-O 3.37Å; H261-P288 HydrophobicContact CB-CB 4.26Å; H261-P288 WeakPolarHBondContact CB-O 3.23Å; L281-P288 HydrophobicContact CD1-CB 3.84Å; I286-P288 WeakPolarHBondContact O-CD 3.14Å
289	T	97.1	Very high	98	Very high	64 Å²	64	56.2 Å²	56.2	39%	0.393	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.5	-178.4	77.3	0	0	0	0	113.6	Y259 D287 R291	Y259-T289 WeakPolarHBondContact CD1-O 3.39Å; Y259-T289 HydrophobicContact CD2-CG2 4.41Å; Y259-T289 WeakPolarHBondContact CE1-O 3.22Å; Y259-T289 HydrophobicContact CE2-CG2 4.29Å; D287-T289 VanDerWaalsContact CG-OG1 3.24Å; D287-T289 PolarHBondContact O-N 2.87Å; D287-T289 VanDerWaalsContact O-N 3.08Å; D287-T289 WeakPolarHBondContact OD1-CA 3.23Å; D287-T289 WeakPolarHBondContact OD1-CB 3.28Å; D287-T289 PolarHBondContact OD1-N 2.96Å; D287-T289 PolarHBondContact OD1-OG1 3.46Å; D287-T289 PolarHBondContact OD2-OG1 3.23Å; T289-R291 PolarHBondContact O-N 2.98Å
290	L	97.9	Very high	98	Very high	32 Å²	32	51.5 Å²	51.5	17%	0.168	27%	0.265	C	S	.	.			trans	-60.1	139.1	173.7	-69.8	177.8	0	0	0	111	Y259 C260 I286 D287 Q294 L295	Y259-L290 CarbonylContact C-O 3.55Å; C260-L290 WeakPolarHBondContact CB-O 3.1Å; C260-L290 PolarHBondContact N-O 3.14Å; C260-L290 PolarHBondContact SG-O 2.78Å; I286-L290 HydrophobicContact CG2-CD1 4.19Å; D287-L290 HydrophobicContact CB-CD1 4.27Å; D287-L290 HydrophobicContact CB-CG 3.96Å; D287-L290 WeakPolarHBondContact O-CG 3.18Å; D287-L290 PolarHBondContact O-N 3.34Å; D287-L290 VanDerWaalsContact O-N 3.15Å; L290-Q294 HydrophobicContact CD2-CB 4.18Å; L290-L295 HydrophobicContact CB-CD2 4.2Å; L290-L295 HydrophobicContact CD1-CD2 3.9Å
291	R	97.3	Very high	98	Very high	107 Å²	107	55.4 Å²	55.4	40%	0.404	28%	0.282	S	S	.	.			trans	-81.2	152.4	171.2	-61.8	-172.5	178.3	-146.4	1.9	109.8	R257 Y259 T289 R293 Q294	R257-R291 PolarHBondContact O-NH1 3.3Å; Y259-R291 HydrophobicContact CD1-CG 4.43Å; T289-R291 PolarHBondContact O-N 2.98Å; R291-R293 PolarHBondContact O-N 3.03Å; R291-Q294 VanDerWaalsContact CB-OE1 3.31Å; R291-Q294 WeakPolarHBondContact O-CB 3.29Å; R291-Q294 PolarHBondContact O-N 3.16Å
292	P	97.4	Very high	98	Very high	1 Å²	1	57 Å²	57	1%	0.006	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-48.8	-35.9	-178	-34.1	37.9	0	0	0	115.6	V252 F253 K258 Q294 L295	V252-P292 HydrophobicContact CG1-CB 3.85Å; V252-P292 HydrophobicContact CG1-CG 4.24Å; V252-P292 WeakPolarHBondContact O-CG 3.38Å; F253-P292 HydrophobicContact CD1-CB 3.74Å; F253-P292 HydrophobicContact CE1-CB 3.8Å; F253-P292 HydrophobicContact CG-CB 4.31Å; F253-P292 HydrophobicContact CZ-CB 4.39Å; F253-P292 WeakPolarHBondContact CZ-O 3.22Å; K258-P292 WeakPolarHBondContact O-CD 3.35Å; P292-Q294 VanDerWaalsContact C-N 3.29Å; P292-Q294 PolarHBondContact O-N 2.89Å; P292-L295 PolarHBondContact O-N 3.38Å
293	R	97.1	Very high	98	Very high	74 Å²	74	49.5 Å²	49.5	28%	0.279	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-72.4	-21.6	-179.7	-59.9	-174.6	-59.7	-164.3	-1.8	113.6	G189 S190 K191 R193 F253 R291 L295	G189-R293 PolarHBondContact N-O 3.25Å; S190-R293 WeakPolarHBondContact O-CD 3.39Å; K191-R293 WeakPolarHBondContact O-CD 3.49Å; K191-R293 PolarHBondContact O-NH1 2.87Å; R193-R293 HydrophobicContact CB-CB 4.04Å; R193-R293 HydrophobicContact CB-CG 4.09Å; F253-R293 HydrophobicContact CE1-CG 4.33Å; R291-R293 PolarHBondContact O-N 3.03Å; R293-L295 VanDerWaalsContact C-N 3.33Å
294	Q	97.8	Very high	98.1	Very high	92 Å²	92	45.4 Å²	45.4	43%	0.43	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-83.7	-11.4	178.5	-63.6	169.6	-75.1	0	0	112.2	T188 L290 R291 P292 S296	T188-Q294 WeakPolarHBondContact CG2-O 3.23Å; L290-Q294 HydrophobicContact CD2-CB 4.18Å; R291-Q294 VanDerWaalsContact CB-OE1 3.31Å; R291-Q294 WeakPolarHBondContact O-CB 3.29Å; R291-Q294 PolarHBondContact O-N 3.16Å; P292-Q294 VanDerWaalsContact C-N 3.29Å; P292-Q294 PolarHBondContact O-N 2.89Å; Q294-S296 PolarHBondContact O-N 3.12Å
295	L	98.1	Very high	98.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.			trans	-74.2	121.7	176.4	-64	172.3	0	0	0	110.9	R193 V252 C260 I286 L290 P292 R293 H299 F300	R193-L295 PolarHBondContact NE-O 2.86Å; V252-L295 HydrophobicContact CG1-CD1 3.59Å; C260-L295 HydrophobicContact CB-CD1 3.77Å; I286-L295 HydrophobicContact CG2-CD2 3.84Å; L290-L295 HydrophobicContact CB-CD2 4.2Å; L290-L295 HydrophobicContact CD1-CD2 3.9Å; P292-L295 PolarHBondContact O-N 3.38Å; R293-L295 VanDerWaalsContact C-N 3.33Å; L295-H299 HydrophobicContact CB-CB 4.29Å; L295-H299 HydrophobicContact CD2-CB 3.91Å; L295-F300 HydrophobicContact CB-CD2 4.34Å; L295-F300 HydrophobicContact CB-CE2 3.71Å; L295-F300 HydrophobicContact CB-CZ 4.11Å; L295-F300 HydrophobicContact CD1-CZ 4.2Å
296	S	98.2	Very high	98.1	Very high	20 Å²	20	41.9 Å²	41.9	14%	0.14	22%	0.215	C	C	.	.			trans	-76.8	172.9	174.8	68.9	0	0	0	0	110.8	Q294 S298 H299 F300	Q294-S296 PolarHBondContact O-N 3.12Å; S296-S298 VanDerWaalsContact C-N 3.29Å; S296-S298 PolarHBondContact OG-N 3.14Å; S296-S298 PolarHBondContact OG-OG 3.05Å; S296-H299 PolarHBondContact N-ND1 2.94Å; S296-H299 PolarHBondContact O-N 3.31Å; S296-H299 VanDerWaalsContact OG-CG 3.27Å; S296-H299 PolarHBondContact OG-N 2.9Å; S296-H299 VanDerWaalsContact OG-N 3.08Å; S296-H299 PolarHBondContact OG-ND1 3.07Å; S296-F300 WeakPolarHBondContact O-CD2 3.33Å; S296-F300 PolarHBondContact O-N 3.13Å
297	I	98.1	Very high	98.1	Very high	21 Å²	21	41.4 Å²	41.4	11%	0.108	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-33.4	173.2	-59.1	175.3	0	0	0	111	Q201 K237 I238 F300 K301	Q201-I297 HydrophobicContact CB-CD1 3.61Å; K237-I297 HydrophobicContact CB-CG2 3.5Å; K237-I297 HydrophobicContact CD-CB 4.28Å; K237-I297 HydrophobicContact CD-CD1 3.65Å; K237-I297 HydrophobicContact CD-CG2 3.74Å; K237-I297 HydrophobicContact CG-CG2 4.27Å; I238-I297 HydrophobicContact CD1-CG2 4.31Å; I238-I297 HydrophobicContact CG1-CG2 4.22Å; I297-F300 PolarHBondContact O-N 3.36Å; I297-K301 PolarHBondContact O-N 2.93Å
298	S	98.2	Very high	98.1	Very high	74 Å²	74	41.7 Å²	41.7	52%	0.517	21%	0.208	S	C	.	.	H	α-helix	trans	-63.4	-40.2	174.5	55.4	0	0	0	0	111.9	S296 F300 K301 S302	S296-S298 VanDerWaalsContact C-N 3.29Å; S296-S298 PolarHBondContact OG-N 3.14Å; S296-S298 PolarHBondContact OG-OG 3.05Å; S298-F300 VanDerWaalsContact C-N 3.33Å; S298-F300 PolarHBondContact O-N 3.19Å; S298-K301 WeakPolarHBondContact O-CB 3.31Å; S298-K301 PolarHBondContact O-N 2.57Å; S298-K301 VanDerWaalsContact O-N 3.13Å; S298-S302 PolarHBondContact O-N 2.95Å; S298-S302 PolarHBondContact O-OG 2.98Å
299	H	98.6	Very high	98.2	Very high	50 Å²	50	45.4 Å²	45.4	23%	0.231	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-42.4	173.1	-62.2	163.2	0	0	0	111.7	I286 L295 S296 K301 S302 L303	I286-H299 HydrophobicContact CD1-CB 3.76Å; I286-H299 WeakPolarHBondContact CD1-O 3.46Å; I286-H299 HydrophobicContact CG1-CB 4.22Å; L295-H299 HydrophobicContact CB-CB 4.29Å; L295-H299 HydrophobicContact CD2-CB 3.91Å; S296-H299 PolarHBondContact N-ND1 2.94Å; S296-H299 PolarHBondContact O-N 3.31Å; S296-H299 VanDerWaalsContact OG-CG 3.27Å; S296-H299 PolarHBondContact OG-N 2.9Å; S296-H299 VanDerWaalsContact OG-N 3.08Å; S296-H299 PolarHBondContact OG-ND1 3.07Å; H299-K301 VanDerWaalsContact C-N 3.32Å; H299-K301 PolarHBondContact O-N 3.35Å; H299-S302 PolarHBondContact O-N 3.32Å; H299-L303 WeakPolarHBondContact O-CB 3.28Å; H299-L303 VanDerWaalsContact O-CG 3.26Å; H299-L303 WeakPolarHBondContact O-CG 3.29Å; H299-L303 PolarHBondContact O-N 3.31Å
300	F	98.7	Very high	98.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-34.1	175.1	-78	-71	0	0	0	112.9	V198 I238 V248 V249 V252 F253 L295 S296 I297 S298 L303 C304	V198-F300 HydrophobicContact CB-CD2 4.41Å; V198-F300 HydrophobicContact CB-CE2 4.44Å; V198-F300 HydrophobicContact CG1-CB 4.25Å; V198-F300 HydrophobicContact CG1-CD1 4.49Å; V198-F300 HydrophobicContact CG1-CD2 3.69Å; V198-F300 HydrophobicContact CG1-CE2 4.17Å; V198-F300 HydrophobicContact CG1-CG 3.89Å; V198-F300 HydrophobicContact CG2-CD2 3.77Å; V198-F300 HydrophobicContact CG2-CE2 3.42Å; V198-F300 VanDerWaalsContact CG2-CE2 3.42Å; V198-F300 HydrophobicContact CG2-CZ 3.99Å; I238-F300 HydrophobicContact CD1-CB 3.72Å; V248-F300 HydrophobicContact CG1-CD1 4.5Å; V249-F300 HydrophobicContact CB-CE1 4.23Å; V249-F300 HydrophobicContact CG1-CE1 4.38Å; V249-F300 HydrophobicContact CG2-CD1 3.63Å; V249-F300 HydrophobicContact CG2-CE1 3.76Å; V249-F300 HydrophobicContact CG2-CG 4.27Å; V252-F300 HydrophobicContact CB-CE1 3.97Å; V252-F300 HydrophobicContact CB-CZ 4.24Å; V252-F300 HydrophobicContact CG1-CE1 3.92Å; V252-F300 HydrophobicContact CG1-CZ 3.72Å; V252-F300 HydrophobicContact CG2-CE1 3.91Å; F253-F300 HydrophobicContact CD2-CZ 4.31Å; F253-F300 HydrophobicContact CE2-CE2 4.11Å; F253-F300 AromaticContact CE2-CZ 3.63Å; F253-F300 HydrophobicContact CE2-CZ 3.63Å; F253-F300 HydrophobicContact CZ-CZ 4.41Å; L295-F300 HydrophobicContact CB-CD2 4.34Å; L295-F300 HydrophobicContact CB-CE2 3.71Å; L295-F300 HydrophobicContact CB-CZ 4.11Å; L295-F300 HydrophobicContact CD1-CZ 4.2Å; S296-F300 WeakPolarHBondContact O-CD2 3.33Å; S296-F300 PolarHBondContact O-N 3.13Å; I297-F300 PolarHBondContact O-N 3.36Å; S298-F300 VanDerWaalsContact C-N 3.33Å; S298-F300 PolarHBondContact O-N 3.19Å; F300-L303 HydrophobicContact CD1-CD1 4.34Å; F300-C304 WeakPolarHBondContact O-CB 3.41Å; F300-C304 PolarHBondContact O-N 3.03Å; F300-C304 PolarHBondContact O-SG 2.93Å
301	K	98.8	Very high	98.2	Very high	82 Å²	82	42 Å²	42	36%	0.357	19%	0.194	S	C	.	.	H	α-helix	trans	-57.7	-56.3	172.3	-176.8	-177.9	174.5	171.9	0	110.2	K237 I238 I297 S298 H299 L303 C304 E305	K237-K301 WeakPolarHBondContact O-CD 3.46Å; I238-K301 HydrophobicContact CG1-CB 4.04Å; I297-K301 PolarHBondContact O-N 2.93Å; S298-K301 WeakPolarHBondContact O-CB 3.31Å; S298-K301 PolarHBondContact O-N 2.57Å; S298-K301 VanDerWaalsContact O-N 3.13Å; H299-K301 VanDerWaalsContact C-N 3.32Å; H299-K301 PolarHBondContact O-N 3.35Å; K301-L303 VanDerWaalsContact C-N 3.35Å; K301-L303 PolarHBondContact O-N 3.28Å; K301-C304 PolarHBondContact O-N 3.32Å; K301-C304 VanDerWaalsContact O-N 3.14Å; K301-E305 WeakPolarHBondContact CE-OE1 3.49Å; K301-E305 WeakPolarHBondContact CG-OE1 3.29Å; K301-E305 IonicContact NZ-OE1 3.34Å; K301-E305 WeakPolarHBondContact O-CG 3.41Å; K301-E305 PolarHBondContact O-N 3.05Å
302	S	98.7	Very high	98.2	Very high	38 Å²	38	41.5 Å²	41.5	27%	0.266	20%	0.2	S	C	.	.	H	α-helix	trans	-57.7	-45.4	179.4	-50.2	0	0	0	0	112.2	A284 S298 H299 C304 E305 V306	A284-S302 WeakPolarHBondContact O-CB 3.47Å; S298-S302 PolarHBondContact O-N 2.95Å; S298-S302 PolarHBondContact O-OG 2.98Å; H299-S302 PolarHBondContact O-N 3.32Å; S302-C304 VanDerWaalsContact C-N 3.35Å; S302-C304 PolarHBondContact O-N 3.37Å; S302-E305 PolarHBondContact O-N 3.14Å; S302-V306 VanDerWaalsContact O-CG2 3.3Å; S302-V306 WeakPolarHBondContact O-CG2 3.47Å; S302-V306 PolarHBondContact O-N 2.93Å
303	L	98.8	Very high	98.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-43.2	177.1	-72.3	167.6	0	0	0	112.4	V248 L264 L280 L281 A284 I286 H299 F300 K301 Y307	V248-L303 HydrophobicContact CG1-CB 4.08Å; L264-L303 HydrophobicContact CD1-CD1 4.33Å; L264-L303 HydrophobicContact CD1-CD2 3.84Å; L264-L303 HydrophobicContact CD2-CD1 4.24Å; L264-L303 HydrophobicContact CD2-CD2 4.13Å; L280-L303 HydrophobicContact CD1-CD2 4.25Å; L280-L303 HydrophobicContact CD2-CD2 4.29Å; L280-L303 HydrophobicContact CG-CD2 4.02Å; L281-L303 HydrophobicContact CD2-CD2 4.41Å; A284-L303 HydrophobicContact CB-CD2 4.04Å; A284-L303 HydrophobicContact CB-CG 4.44Å; I286-L303 HydrophobicContact CD1-CD1 3.89Å; I286-L303 HydrophobicContact CD1-CD2 3.78Å; I286-L303 HydrophobicContact CD1-CG 3.46Å; I286-L303 VanDerWaalsContact CD1-CG 3.46Å; H299-L303 WeakPolarHBondContact O-CB 3.28Å; H299-L303 VanDerWaalsContact O-CG 3.26Å; H299-L303 WeakPolarHBondContact O-CG 3.29Å; H299-L303 PolarHBondContact O-N 3.31Å; F300-L303 HydrophobicContact CD1-CD1 4.34Å; K301-L303 VanDerWaalsContact C-N 3.35Å; K301-L303 PolarHBondContact O-N 3.28Å; L303-Y307 WeakPolarHBondContact O-CB 3.39Å; L303-Y307 PolarHBondContact O-N 3.42Å
304	C	98.8	Very high	98	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70.7	-38.2	-179.3	-65.9	0	0	0	0	111.8	I238 Q240 L244 F300 K301 S302 R308	I238-C304 HydrophobicContact CG2-CB 3.93Å; Q240-C304 HydrophobicContact CB-CB 4.38Å; Q240-C304 HydrophobicContact CG-CB 3.98Å; L244-C304 HydrophobicContact CD2-CB 3.75Å; F300-C304 WeakPolarHBondContact O-CB 3.41Å; F300-C304 PolarHBondContact O-N 3.03Å; F300-C304 PolarHBondContact O-SG 2.93Å; K301-C304 PolarHBondContact O-N 3.32Å; K301-C304 VanDerWaalsContact O-N 3.14Å; S302-C304 VanDerWaalsContact C-N 3.35Å; S302-C304 PolarHBondContact O-N 3.37Å; C304-R308 VanDerWaalsContact O-CB 3.23Å; C304-R308 WeakPolarHBondContact O-CB 3.26Å; C304-R308 PolarHBondContact O-N 3.11Å
305	E	98.6	Very high	97.8	Very high	75 Å²	75	46.8 Å²	46.8	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-65.3	-44.6	176.7	-73	171.6	174.3	0	0	112	K301 S302 R309	K301-E305 WeakPolarHBondContact CE-OE1 3.49Å; K301-E305 WeakPolarHBondContact CG-OE1 3.29Å; K301-E305 IonicContact NZ-OE1 3.34Å; K301-E305 WeakPolarHBondContact O-CG 3.41Å; K301-E305 PolarHBondContact O-N 3.05Å; S302-E305 PolarHBondContact O-N 3.14Å; E305-R309 PolarHBondContact O-N 2.99Å
306	V	98.6	Very high	97.5	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.024	27%	0.272	C	S	.	.	H	α-helix	trans	-67.4	-47.9	176.1	177.3	0	0	0	0	110.8	L280 L283 A284 S302 R308 R309 M310	L280-V306 HydrophobicContact CD1-CB 3.71Å; L280-V306 HydrophobicContact CD1-CG1 3.5Å; L283-V306 HydrophobicContact CB-CB 4.5Å; L283-V306 HydrophobicContact CB-CG1 3.74Å; L283-V306 HydrophobicContact CB-CG2 3.84Å; L283-V306 HydrophobicContact CD1-CG1 3.96Å; A284-V306 HydrophobicContact CB-CG2 4.1Å; S302-V306 VanDerWaalsContact O-CG2 3.3Å; S302-V306 WeakPolarHBondContact O-CG2 3.47Å; S302-V306 PolarHBondContact O-N 2.93Å; V306-R308 PolarHBondContact O-N 2.89Å; V306-R309 PolarHBondContact O-N 3.35Å; V306-R309 VanDerWaalsContact O-N 3.16Å; V306-M310 HydrophobicContact CG1-CE 4.19Å; V306-M310 HydrophobicContact CG1-SD 4.31Å; V306-M310 PolarHBondContact O-N 3.11Å
307	Y	98.6	Very high	97.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-34.8	179	-176	-114.4	0	0	0	111.8	L244 K247 V248 L267 F268 L303 M310 C311 L317	L244-Y307 HydrophobicContact CD1-CD1 4.49Å; L244-Y307 HydrophobicContact CD2-CD1 4.15Å; L244-Y307 HydrophobicContact CG-CD1 4.07Å; L244-Y307 HydrophobicContact CG-CE1 4.49Å; K247-Y307 HydrophobicContact CD-CE1 4.43Å; K247-Y307 PolarHBondContact NZ-OH 3.31Å; V248-Y307 HydrophobicContact CG2-CD1 3.53Å; V248-Y307 HydrophobicContact CG2-CE1 4.15Å; V248-Y307 HydrophobicContact CG2-CG 4.03Å; L267-Y307 HydrophobicContact CB-CE2 3.84Å; L267-Y307 HydrophobicContact CD1-CD2 4.11Å; L267-Y307 HydrophobicContact CD1-CE2 4.11Å; L267-Y307 HydrophobicContact CD1-CG 4.47Å; L267-Y307 HydrophobicContact CD2-CE1 4.36Å; L267-Y307 HydrophobicContact CD2-CE2 4.34Å; L267-Y307 HydrophobicContact CG-CE2 4.33Å; F268-Y307 HydrophobicContact CE1-CD2 4.45Å; F268-Y307 HydrophobicContact CE1-CE2 4.34Å; F268-Y307 HydrophobicContact CZ-CD2 4.24Å; F268-Y307 HydrophobicContact CZ-CE2 4.42Å; L303-Y307 WeakPolarHBondContact O-CB 3.39Å; L303-Y307 PolarHBondContact O-N 3.42Å; Y307-M310 PolarHBondContact O-N 2.83Å; Y307-C311 VanDerWaalsContact CZ-SG 3.58Å; Y307-C311 PolarHBondContact O-N 2.94Å; Y307-C311 PolarHBondContact O-SG 3.23Å; Y307-C311 VanDerWaalsContact O-SG 3.36Å; Y307-L317 HydrophobicContact CD2-CD2 4.3Å; Y307-L317 HydrophobicContact CE2-CD2 3.74Å; Y307-L317 HydrophobicContact CE2-CG 3.87Å; Y307-L317 PolarHBondContact OH-O 3.02Å; Y307-L317 VanDerWaalsContact OH-O 3.11Å
308	R	98.4	Very high	97.3	Very high	85 Å²	85	56.8 Å²	56.8	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-59.8	-50	173.8	176.7	57.5	-173.7	-89.8	3.8	111.6	L244 C304 V306 M310 C311 D312	L244-R308 HydrophobicContact CD1-CB 3.79Å; L244-R308 HydrophobicContact CD1-CG 4.24Å; C304-R308 VanDerWaalsContact O-CB 3.23Å; C304-R308 WeakPolarHBondContact O-CB 3.26Å; C304-R308 PolarHBondContact O-N 3.11Å; V306-R308 PolarHBondContact O-N 2.89Å; R308-M310 VanDerWaalsContact C-N 3.28Å; R308-M310 PolarHBondContact O-N 2.96Å; R308-C311 CarbonylContact O-C 3.6Å; R308-C311 WeakPolarHBondContact O-CB 3.31Å; R308-C311 PolarHBondContact O-N 3.36Å; R308-D312 IonicContact CZ-OD1 3.89Å; R308-D312 IonicContact NE-OD1 2.62Å; R308-D312 PolarHBondContact NE-OD1 3.05Å; R308-D312 IonicContact NE-OD2 3.94Å; R308-D312 PolarHBondContact NE-OD2 3.31Å; R308-D312 IonicContact NH2-OD1 3.27Å; R308-D312 VanDerWaalsContact O-CG 3.3Å; R308-D312 PolarHBondContact O-N 2.55Å
309	R	98.2	Very high	97.2	Very high	135 Å²	135	57.3 Å²	57.3	51%	0.509	29%	0.29	S	S	.	.	H	α-helix	trans	-57.9	-42.2	176.8	-70.7	-174.4	-71.8	169.1	-3.4	111.9	E305 V306 C311 D312 E313	E305-R309 PolarHBondContact O-N 2.99Å; V306-R309 PolarHBondContact O-N 3.35Å; V306-R309 VanDerWaalsContact O-N 3.16Å; R309-C311 VanDerWaalsContact C-N 3.32Å; R309-C311 PolarHBondContact O-N 3.11Å; R309-D312 PolarHBondContact O-N 3.09Å; R309-D312 VanDerWaalsContact O-N 3.14Å; R309-E313 PolarHBondContact O-N 2.68Å
310	M	98.1	Very high	97.1	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-37.7	174.9	-68.1	177.4	159.9	0	0	112.6	F268 R279 L280 L283 V306 Y307 R308 D312 E313 D314 L317	F268-M310 HydrophobicContact CE1-SD 3.89Å; F268-M310 HydrophobicContact CZ-SD 3.78Å; R279-M310 HydrophobicContact CB-CE 3.92Å; R279-M310 HydrophobicContact CG-CE 3.64Å; L280-M310 HydrophobicContact CB-CE 4.1Å; L280-M310 HydrophobicContact CB-SD 4.2Å; L280-M310 HydrophobicContact CD1-SD 4.34Å; L283-M310 HydrophobicContact CD1-CE 4.46Å; V306-M310 HydrophobicContact CG1-CE 4.19Å; V306-M310 HydrophobicContact CG1-SD 4.31Å; V306-M310 PolarHBondContact O-N 3.11Å; Y307-M310 PolarHBondContact O-N 2.83Å; R308-M310 VanDerWaalsContact C-N 3.28Å; R308-M310 PolarHBondContact O-N 2.96Å; M310-D312 VanDerWaalsContact C-N 3.35Å; M310-E313 PolarHBondContact O-N 3.29Å; M310-D314 PolarHBondContact O-N 3.09Å; M310-L317 HydrophobicContact CB-CD2 3.79Å
311	C	97.6	Very high	96.9	Very high	13 Å²	13	60.2 Å²	60.2	9%	0.088	31%	0.305	C	S	.	.	H	α-helix	trans	-71.5	-27.6	173.9	-69.1	0	0	0	0	113.5	Y307 R308 R309 D314 P315 F318	Y307-C311 VanDerWaalsContact CZ-SG 3.58Å; Y307-C311 PolarHBondContact O-N 2.94Å; Y307-C311 PolarHBondContact O-SG 3.23Å; Y307-C311 VanDerWaalsContact O-SG 3.36Å; R308-C311 CarbonylContact O-C 3.6Å; R308-C311 WeakPolarHBondContact O-CB 3.31Å; R308-C311 PolarHBondContact O-N 3.36Å; R309-C311 VanDerWaalsContact C-N 3.32Å; R309-C311 PolarHBondContact O-N 3.11Å; C311-D314 CarbonylContact O-C 3.18Å; C311-D314 VanDerWaalsContact O-O 3.08Å; C311-P315 WeakPolarHBondContact O-CA 3.48Å; C311-F318 HydrophobicContact CB-CB 4.38Å
312	D	96.6	Very high	96.6	Very high	97 Å²	97	57.2 Å²	57.2	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-74.1	-32	174	-60.4	-33.2	0	0	0	110.6	R308 R309 M310	R308-D312 IonicContact CZ-OD1 3.89Å; R308-D312 IonicContact NE-OD1 2.62Å; R308-D312 PolarHBondContact NE-OD1 3.05Å; R308-D312 IonicContact NE-OD2 3.94Å; R308-D312 PolarHBondContact NE-OD2 3.31Å; R308-D312 IonicContact NH2-OD1 3.27Å; R308-D312 VanDerWaalsContact O-CG 3.3Å; R308-D312 PolarHBondContact O-N 2.55Å; R309-D312 PolarHBondContact O-N 3.09Å; R309-D312 VanDerWaalsContact O-N 3.14Å; M310-D312 VanDerWaalsContact C-N 3.35Å
313	E	96.8	Very high	96.2	Very high	124 Å²	124	62.2 Å²	62.2	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-72.5	-42.8	171.7	-71.8	172.1	-158.5	0	0	112.4	R279 R309 M310	R279-E313 IonicContact CZ-OE2 2.61Å; R279-E313 IonicContact NH1-OE2 2.78Å; R279-E313 IonicContact NH2-OE1 3.96Å; R279-E313 IonicContact NH2-OE2 2.82Å; R279-E313 PolarHBondContact NH2-OE2 3.15Å; R309-E313 PolarHBondContact O-N 2.68Å; M310-E313 PolarHBondContact O-N 3.29Å
314	D	95.1	Very high	95.9	Very high	53 Å²	53	66.5 Å²	66.5	28%	0.283	33%	0.325	S	S	.	.			trans	-123.8	98.8	174.7	174.9	17.5	0	0	0	111.4	M310 C311 Q316 L317	M310-D314 PolarHBondContact O-N 3.09Å; C311-D314 CarbonylContact O-C 3.18Å; C311-D314 VanDerWaalsContact O-O 3.08Å; D314-Q316 PolarHBondContact O-N 3.27Å; D314-Q316 VanDerWaalsContact O-N 3.12Å; D314-Q316 WeakPolarHBondContact OD1-CB 3.33Å; D314-Q316 PolarHBondContact OD1-N 3.03Å; D314-L317 HydrophobicContact CB-CB 4.29Å; D314-L317 WeakPolarHBondContact O-CB 3.33Å; D314-L317 PolarHBondContact O-N 3.18Å; D314-L317 VanDerWaalsContact O-N 3.09Å
315	P	91.8	Very high	95.6	Very high	101 Å²	101	68.8 Å²	68.8	66%	0.656	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.3	178.9	-26.6	35.7	0	0	0	114.7	C311 L317	C311-P315 WeakPolarHBondContact O-CA 3.48Å; P315-L317 VanDerWaalsContact C-N 3.28Å; P315-L317 PolarHBondContact O-N 3.4Å
316	Q	93.4	Very high	95.2	Very high	154 Å²	154	68.9 Å²	68.9	72%	0.72	34%	0.338	S	S	*	.	H	α-helix	trans	-74	-23.7	179.7	-56.9	-172.3	11.6	0	0	111.9	D314 F318 A319 Y320	D314-Q316 PolarHBondContact O-N 3.27Å; D314-Q316 VanDerWaalsContact O-N 3.12Å; D314-Q316 WeakPolarHBondContact OD1-CB 3.33Å; D314-Q316 PolarHBondContact OD1-N 3.03Å; Q316-F318 VanDerWaalsContact C-N 3.31Å; Q316-F318 PolarHBondContact O-N 3.06Å; Q316-A319 PolarHBondContact O-N 3.42Å; Q316-A319 VanDerWaalsContact O-N 3.11Å; Q316-Y320 PolarHBondContact O-N 2.93Å
317	L	95.3	Very high	94.8	Very high	6 Å²	6	76 Å²	76	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-63	-35.9	-174.6	-171.5	63	0	0	0	113	K247 L267 F268 Y307 M310 D314 P315 A319 Y320	K247-L317 PolarHBondContact NZ-O 3Å; L267-L317 VanDerWaalsContact O-CD1 3.29Å; L267-L317 WeakPolarHBondContact O-CD1 3.26Å; F268-L317 HydrophobicContact CD1-CD1 3.55Å; F268-L317 HydrophobicContact CD1-CD2 4.16Å; F268-L317 HydrophobicContact CD1-CG 4.45Å; F268-L317 HydrophobicContact CE1-CD1 4.03Å; F268-L317 HydrophobicContact CE1-CD2 3.78Å; F268-L317 HydrophobicContact CE1-CG 4.47Å; F268-L317 HydrophobicContact CG-CD1 4.48Å; Y307-L317 HydrophobicContact CD2-CD2 4.3Å; Y307-L317 HydrophobicContact CE2-CD2 3.74Å; Y307-L317 HydrophobicContact CE2-CG 3.87Å; Y307-L317 PolarHBondContact OH-O 3.02Å; Y307-L317 VanDerWaalsContact OH-O 3.11Å; M310-L317 HydrophobicContact CB-CD2 3.79Å; D314-L317 HydrophobicContact CB-CB 4.29Å; D314-L317 WeakPolarHBondContact O-CB 3.33Å; D314-L317 PolarHBondContact O-N 3.18Å; D314-L317 VanDerWaalsContact O-N 3.09Å; P315-L317 VanDerWaalsContact C-N 3.28Å; P315-L317 PolarHBondContact O-N 3.4Å; L317-A319 VanDerWaalsContact C-N 3.34Å; L317-Y320 WeakPolarHBondContact O-CB 3.35Å; L317-Y320 PolarHBondContact O-N 3.49Å
318	F	96.3	Very high	94.4	Very high	92 Å²	92	81.4 Å²	81.4	40%	0.404	39%	0.39	S	S	.	.	H	α-helix	trans	-69.9	-32.7	177.7	-173.5	-110.7	0	0	0	112.3	K243 L244 K247 C311 Q316	K243-F318 HydrophobicContact CB-CZ 4Å; L244-F318 HydrophobicContact CB-CE2 4.15Å; K247-F318 HydrophobicContact CD-CD2 4.27Å; K247-F318 HydrophobicContact CD-CE2 4.2Å; K247-F318 VanDerWaalsContact NZ-C 3.33Å; K247-F318 PolarHBondContact NZ-O 2.99Å; C311-F318 HydrophobicContact CB-CB 4.38Å; Q316-F318 VanDerWaalsContact C-N 3.31Å; Q316-F318 PolarHBondContact O-N 3.06Å
319	A	95.4	Very high	93.9	Very high	85 Å²	85	83.8 Å²	83.8	70%	0.702	40%	0.399	S	S	*	.	H	α-helix	trans	-80.7	-19.6	176	0	0	0	0	0	113	Q316 L317 N321	Q316-A319 PolarHBondContact O-N 3.42Å; Q316-A319 VanDerWaalsContact O-N 3.11Å; L317-A319 VanDerWaalsContact C-N 3.34Å; A319-N321 PolarHBondContact O-N 3.47Å
320	Y	96.4	Very high	93.4	Very high	36 Å²	36	85 Å²	85	14%	0.141	41%	0.407	C	S	.	.			trans	-55.6	133.9	-178.3	171.1	-101.2	0	0	0	112.8	K247 M266 L267 F268 P269 R273 Q316 L317 F322 E325	K247-Y320 WeakPolarHBondContact CE-O 3.06Å; K247-Y320 PolarHBondContact NZ-O 3.21Å; M266-Y320 WeakPolarHBondContact O-CE1 3.08Å; L267-Y320 VanDerWaalsContact O-CD1 3.26Å; L267-Y320 WeakPolarHBondContact O-CD1 3.37Å; F268-Y320 WeakPolarHBondContact O-CE1 3.3Å; F268-Y320 PolarHBondContact O-OH 3.12Å; F268-Y320 VanDerWaalsContact O-OH 3.09Å; P269-Y320 HydrophobicContact CB-CD2 4.49Å; P269-Y320 HydrophobicContact CB-CE2 4.1Å; P269-Y320 HydrophobicContact CG-CD2 3.87Å; P269-Y320 HydrophobicContact CG-CE2 3.96Å; P269-Y320 HydrophobicContact CG-CG 4.28Å; R273-Y320 PolarHBondContact NH2-OH 3.09Å; R273-Y320 VanDerWaalsContact NH2-OH 3.09Å; Q316-Y320 PolarHBondContact O-N 2.93Å; L317-Y320 WeakPolarHBondContact O-CB 3.35Å; L317-Y320 PolarHBondContact O-N 3.49Å; Y320-F322 HydrophobicContact CE1-CB 3.98Å; Y320-F322 WeakPolarHBondContact OH-CA 3.47Å; Y320-F322 WeakPolarHBondContact OH-CB 3.34Å; Y320-E325 HydrophobicContact CE2-CB 4.32Å; Y320-E325 PolarHBondContact OH-OE2 3.48Å
321	N	94.9	Very high	93	Very high	74 Å²	74	88.2 Å²	88.2	40%	0.396	42%	0.424	S	S	.	.			trans	-134.8	107.9	177.6	-178.2	-14.1	0	0	0	110.3	A319 R323 E324 E325	A319-N321 PolarHBondContact O-N 3.47Å; N321-R323 PolarHBondContact O-N 2.93Å; N321-R323 WeakPolarHBondContact OD1-CB 3.22Å; N321-R323 PolarHBondContact OD1-N 2.74Å; N321-E324 HydrophobicContact CB-CG 4.44Å; N321-E324 PolarHBondContact O-N 3.19Å; N321-E325 PolarHBondContact O-N 3.16Å
322	F	92.6	Very high	92.5	Very high	19 Å²	19	94 Å²	94	8%	0.083	45%	0.448	C	S	.	.	H	α-helix	trans	-57.1	-23.9	-178.5	78.8	-86.2	0	0	0	114.2	Q254 M266 Y320 L326	Q254-F322 VanDerWaalsContact NE2-CZ 3.29Å; M266-F322 HydrophobicContact CB-CB 4.49Å; M266-F322 HydrophobicContact CB-CD1 3.78Å; M266-F322 HydrophobicContact CB-CE1 4.17Å; M266-F322 HydrophobicContact CB-CG 4.05Å; M266-F322 HydrophobicContact CG-CD1 4.48Å; M266-F322 HydrophobicContact CG-CG 4.48Å; M266-F322 HydrophobicContact SD-CD2 3.94Å; M266-F322 HydrophobicContact SD-CE2 4.34Å; M266-F322 HydrophobicContact SD-CG 4.17Å; Y320-F322 HydrophobicContact CE1-CB 3.98Å; Y320-F322 WeakPolarHBondContact OH-CA 3.47Å; Y320-F322 WeakPolarHBondContact OH-CB 3.34Å; F322-L326 HydrophobicContact CD2-CD1 3.71Å; F322-L326 HydrophobicContact CE2-CD1 4.05Å; F322-L326 WeakPolarHBondContact O-CB 3.42Å; F322-L326 VanDerWaalsContact O-CG 3.26Å; F322-L326 WeakPolarHBondContact O-CG 3.36Å; F322-L326 PolarHBondContact O-N 3.4Å
323	R	90.8	Very high	92	Very high	144 Å²	144	95.8 Å²	95.8	54%	0.543	45%	0.451	S	S	.	.	H	α-helix	trans	-70.4	-35.8	179.1	-61.3	-177.1	-178.9	-179.4	0	112	N321 R327	N321-R323 PolarHBondContact O-N 2.93Å; N321-R323 WeakPolarHBondContact OD1-CB 3.22Å; N321-R323 PolarHBondContact OD1-N 2.74Å; R323-R327 WeakPolarHBondContact O-CB 3.46Å; R323-R327 PolarHBondContact O-N 2.79Å
324	E	91.8	Very high	91.4	Very high	89 Å²	89	96.2 Å²	96.2	42%	0.416	45%	0.451	S	S	.	.	H	α-helix	trans	-70.2	-42.2	176.6	-67.3	-53.5	136.6	0	0	110.8	N321 L326 R327 Q328	N321-E324 HydrophobicContact CB-CG 4.44Å; N321-E324 PolarHBondContact O-N 3.19Å; E324-L326 PolarHBondContact O-N 3.4Å; E324-R327 WeakPolarHBondContact O-CB 3.4Å; E324-R327 PolarHBondContact O-N 3.38Å; E324-R327 VanDerWaalsContact O-N 3.13Å; E324-Q328 WeakPolarHBondContact O-CG 3.44Å; E324-Q328 PolarHBondContact O-N 3.38Å
325	E	92.6	Very high	90.9	Very high	48 Å²	48	98.7 Å²	98.7	22%	0.224	46%	0.461	C	S	.	.	H	α-helix	trans	-57.6	-47.3	173.1	-176.5	-177	-139.9	0	0	111.4	E270 R273 Y320 N321 R327 Q328 R329	E270-E325 WeakPolarHBondContact CB-OE1 3.43Å; E270-E325 PolarHBondContact N-OE1 2.98Å; E270-E325 PolarHBondContact N-OE2 3.41Å; R273-E325 IonicContact NH2-OE2 2.7Å; R273-E325 PolarHBondContact NH2-OE2 3.32Å; Y320-E325 HydrophobicContact CE2-CB 4.32Å; Y320-E325 PolarHBondContact OH-OE2 3.48Å; N321-E325 PolarHBondContact O-N 3.16Å; E325-R327 VanDerWaalsContact C-N 3.31Å; E325-R327 PolarHBondContact O-N 2.92Å; E325-Q328 PolarHBondContact O-N 3.13Å; E325-R329 WeakPolarHBondContact O-CB 3.44Å; E325-R329 PolarHBondContact O-N 3.27Å
326	L	89.4	Confident	90.2	Very high	77 Å²	77	101.4 Å²	101.4	40%	0.403	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-37.9	176	-73.9	173.3	0	0	0	112.7	F322 E324 K330	F322-L326 HydrophobicContact CD2-CD1 3.71Å; F322-L326 HydrophobicContact CE2-CD1 4.05Å; F322-L326 WeakPolarHBondContact O-CB 3.42Å; F322-L326 VanDerWaalsContact O-CG 3.26Å; F322-L326 WeakPolarHBondContact O-CG 3.36Å; F322-L326 PolarHBondContact O-N 3.4Å; E324-L326 PolarHBondContact O-N 3.4Å; L326-K330 WeakPolarHBondContact O-CG 3.41Å; L326-K330 PolarHBondContact O-N 2.99Å; L326-K330 VanDerWaalsContact O-N 3.13Å
327	R	91.1	Very high	89.3	Confident	155 Å²	155	99 Å²	99	59%	0.585	45%	0.451	S	S	*	.	H	α-helix	trans	-65.6	-49.3	177.8	-176.6	-177.4	178.4	-176.8	-0.4	110.8	R323 E324 E325 R329 K330 I331	R323-R327 WeakPolarHBondContact O-CB 3.46Å; R323-R327 PolarHBondContact O-N 2.79Å; E324-R327 WeakPolarHBondContact O-CB 3.4Å; E324-R327 PolarHBondContact O-N 3.38Å; E324-R327 VanDerWaalsContact O-N 3.13Å; E325-R327 VanDerWaalsContact C-N 3.31Å; E325-R327 PolarHBondContact O-N 2.92Å; R327-R329 VanDerWaalsContact C-N 3.31Å; R327-R329 PolarHBondContact O-N 3.45Å; R327-K330 PolarHBondContact O-N 3.07Å; R327-K330 VanDerWaalsContact O-N 3.17Å; R327-I331 HydrophobicContact CG-CD1 4.2Å; R327-I331 WeakPolarHBondContact O-CG1 3.38Å; R327-I331 PolarHBondContact O-N 3.17Å; R327-I331 VanDerWaalsContact O-N 3.07Å
328	Q	89.8	Confident	88.3	Confident	113 Å²	113	102.4 Å²	102.4	53%	0.528	47%	0.469	S	S	.	.	H	α-helix	trans	-60.2	-41.1	178.3	-70.1	176.1	-1.4	0	0	111.8	E324 E325 K330 I331 K332	E324-Q328 WeakPolarHBondContact O-CG 3.44Å; E324-Q328 PolarHBondContact O-N 3.38Å; E325-Q328 PolarHBondContact O-N 3.13Å; Q328-K330 PolarHBondContact O-N 3.13Å; Q328-I331 PolarHBondContact O-N 3.43Å; Q328-K332 WeakPolarHBondContact O-CG 3.41Å; Q328-K332 PolarHBondContact O-N 2.96Å
329	R	89.1	Confident	87.1	Confident	135 Å²	135	102.5 Å²	102.5	51%	0.509	47%	0.474	S	S	.	.	H	α-helix	trans	-62.2	-40.2	175.6	-178	177.2	167.5	-179.8	-0.3	112.7	E270 E325 R327 K333	E270-R329 IonicContact OE1-CZ 3.83Å; E270-R329 IonicContact OE1-NH1 2.74Å; E270-R329 PolarHBondContact OE1-NH1 3.35Å; E270-R329 IonicContact OE2-CZ 3.85Å; E270-R329 IonicContact OE2-NH1 2.79Å; E270-R329 PolarHBondContact OE2-NH1 2.96Å; E325-R329 WeakPolarHBondContact O-CB 3.44Å; E325-R329 PolarHBondContact O-N 3.27Å; R327-R329 VanDerWaalsContact C-N 3.31Å; R327-R329 PolarHBondContact O-N 3.45Å; R329-K333 WeakPolarHBondContact O-CB 3.47Å; R329-K333 PolarHBondContact O-N 2.95Å
330	K	87.7	Confident	85.8	Confident	160 Å²	160	101.1 Å²	101.1	70%	0.696	46%	0.462	S	S	*	.	H	α-helix	trans	-64.4	-40.5	175.9	-76.6	179.7	179.4	-176.6	0	111.9	L326 R327 Q328 K333 K334	L326-K330 WeakPolarHBondContact O-CG 3.41Å; L326-K330 PolarHBondContact O-N 2.99Å; L326-K330 VanDerWaalsContact O-N 3.13Å; R327-K330 PolarHBondContact O-N 3.07Å; R327-K330 VanDerWaalsContact O-N 3.17Å; Q328-K330 PolarHBondContact O-N 3.13Å; K330-K333 PolarHBondContact O-N 2.95Å; K330-K334 PolarHBondContact O-N 3Å
331	I	89.3	Confident	84.4	Confident	78 Å²	78	105.7 Å²	105.7	40%	0.4	48%	0.483	S	S	.	.	H	α-helix	trans	-62	-53.7	176.1	-66.6	166.6	0	0	0	109.9	R327 Q328 K333 K334 E335	R327-I331 HydrophobicContact CG-CD1 4.2Å; R327-I331 WeakPolarHBondContact O-CG1 3.38Å; R327-I331 PolarHBondContact O-N 3.17Å; R327-I331 VanDerWaalsContact O-N 3.07Å; Q328-I331 PolarHBondContact O-N 3.43Å; I331-K333 PolarHBondContact O-N 3.06Å; I331-K334 WeakPolarHBondContact O-CA 3.48Å; I331-K334 WeakPolarHBondContact O-CB 3.41Å; I331-K334 PolarHBondContact O-N 3.19Å; I331-E335 HydrophobicContact CG2-CG 4.45Å; I331-E335 WeakPolarHBondContact CG2-OE1 3.36Å; I331-E335 PolarHBondContact O-N 3.41Å
332	K	86.8	Confident	83	Confident	134 Å²	134	106.1 Å²	106.1	58%	0.583	49%	0.491	S	S	*	.	H	α-helix	trans	-56.8	-36.3	177.4	-71.4	-178.1	179.7	-178.2	0	113.3	Q328 K336	Q328-K332 WeakPolarHBondContact O-CG 3.41Å; Q328-K332 PolarHBondContact O-N 2.96Å; K332-K336 WeakPolarHBondContact O-CG 3.36Å; K332-K336 PolarHBondContact O-N 3.14Å; K332-K336 VanDerWaalsContact O-N 3.14Å
333	K	85.3	Confident	81.4	Confident	135 Å²	135	114.7 Å²	114.7	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-69.7	-35.4	176.8	-168.4	178.6	-179.3	-178.5	0	111.9	R329 K330 I331 Q337	R329-K333 WeakPolarHBondContact O-CB 3.47Å; R329-K333 PolarHBondContact O-N 2.95Å; K330-K333 PolarHBondContact O-N 2.95Å; I331-K333 PolarHBondContact O-N 3.06Å; K333-Q337 WeakPolarHBondContact O-CG 3.24Å; K333-Q337 PolarHBondContact O-N 3.21Å
334	K	84.3	Confident	79.7	Confident	133 Å²	133	118.7 Å²	118.7	58%	0.578	54%	0.54	S	S	*	.	H	α-helix	trans	-70.2	-46.5	177	-169.7	-177.4	175.3	-170	0	111.1	K330 I331 K336 Q337 D338	K330-K334 PolarHBondContact O-N 3Å; I331-K334 WeakPolarHBondContact O-CA 3.48Å; I331-K334 WeakPolarHBondContact O-CB 3.41Å; I331-K334 PolarHBondContact O-N 3.19Å; K334-K336 PolarHBondContact O-N 2.92Å; K334-Q337 WeakPolarHBondContact O-CA 3.33Å; K334-Q337 WeakPolarHBondContact O-CB 3.48Å; K334-Q337 PolarHBondContact O-N 3Å; K334-D338 PolarHBondContact O-N 3.41Å
335	E	84	Confident	77.6	Confident	105 Å²	105	124.7 Å²	124.7	49%	0.491	57%	0.574	S	S	.	*	H	α-helix	trans	-55.9	-48.5	175.1	-70	166.3	172.4	0	0	111.4	I331 Q337 D338 D339	I331-E335 HydrophobicContact CG2-CG 4.45Å; I331-E335 WeakPolarHBondContact CG2-OE1 3.36Å; I331-E335 PolarHBondContact O-N 3.41Å; E335-Q337 PolarHBondContact O-N 3.22Å; E335-D338 PolarHBondContact O-N 3.5Å; E335-D338 VanDerWaalsContact O-N 3.13Å; E335-D339 PolarHBondContact O-N 3.13Å
336	K	77.8	Confident	76.9	Confident	158 Å²	158	128.6 Å²	128.6	69%	0.687	59%	0.591	S	S	*	*	H	α-helix	trans	-60.6	-29.9	175	-74.6	-175.7	178.7	-168.1	0	114.1	K332 K334 A340	K332-K336 WeakPolarHBondContact O-CG 3.36Å; K332-K336 PolarHBondContact O-N 3.14Å; K332-K336 VanDerWaalsContact O-N 3.14Å; K334-K336 PolarHBondContact O-N 2.92Å; K336-A340 VanDerWaalsContact O-CB 3.24Å; K336-A340 WeakPolarHBondContact O-CB 3.43Å; K336-A340 PolarHBondContact O-N 3.21Å
337	Q	74.4	Confident	76.2	Confident	104 Å²	104	131.3 Å²	131.3	49%	0.486	60%	0.601	S	S	.	*	H	α-helix	trans	-78.3	-34.1	176.8	-79.1	179.6	-4.9	0	0	112.3	K333 K334 E335 K341	K333-Q337 WeakPolarHBondContact O-CG 3.24Å; K333-Q337 PolarHBondContact O-N 3.21Å; K334-Q337 WeakPolarHBondContact O-CA 3.33Å; K334-Q337 WeakPolarHBondContact O-CB 3.48Å; K334-Q337 PolarHBondContact O-N 3Å; E335-Q337 PolarHBondContact O-N 3.22Å; Q337-K341 WeakPolarHBondContact O-CG 3.33Å; Q337-K341 PolarHBondContact O-N 3.28Å
338	D	75.1	Confident	75.4	Confident	76 Å²	76	129.9 Å²	129.9	41%	0.406	60%	0.602	S	S	.	*	H	α-helix	trans	-75.6	-40.5	178.1	-67.5	-23.2	0	0	0	110.5	K334 E335 A340 K341 S342	K334-D338 PolarHBondContact O-N 3.41Å; E335-D338 PolarHBondContact O-N 3.5Å; E335-D338 VanDerWaalsContact O-N 3.13Å; D338-A340 PolarHBondContact O-N 3.18Å; D338-K341 PolarHBondContact O-N 3.14Å; D338-S342 PolarHBondContact O-N 2.87Å
339	D	70.9	Confident	74.5	Confident	95 Å²	95	130.9 Å²	130.9	51%	0.508	61%	0.606	S	S	.	*	H	α-helix	trans	-59.4	-48.4	170.8	-72.7	-18.8	0	0	0	111.2	E335 K341 S342 Y343	E335-D339 PolarHBondContact O-N 3.13Å; D339-K341 PolarHBondContact O-N 3.02Å; D339-K341 VanDerWaalsContact O-N 3.14Å; D339-S342 WeakPolarHBondContact O-CB 3.13Å; D339-S342 PolarHBondContact O-N 3.18Å; D339-Y343 WeakPolarHBondContact O-CD2 3.47Å; D339-Y343 PolarHBondContact O-N 3.44Å
340	A	67.4	Low	73.6	Confident	55 Å²	55	130.7 Å²	130.7	46%	0.455	61%	0.612	S	S	.	*	H	α-helix	trans	-63.5	-20.4	178.9	0	0	0	0	0	114.1	K336 D338	K336-A340 VanDerWaalsContact O-CB 3.24Å; K336-A340 WeakPolarHBondContact O-CB 3.43Å; K336-A340 PolarHBondContact O-N 3.21Å; D338-A340 PolarHBondContact O-N 3.18Å
341	K	67.4	Low	72.7	Confident	133 Å²	133	128.7 Å²	128.7	58%	0.578	61%	0.607	S	S	*	*	H	α-helix	trans	-84.4	-33.5	171.6	-74.7	171.8	-177.7	175	0	112	Q337 D338 D339 Y343 R344	Q337-K341 WeakPolarHBondContact O-CG 3.33Å; Q337-K341 PolarHBondContact O-N 3.28Å; D338-K341 PolarHBondContact O-N 3.14Å; D339-K341 PolarHBondContact O-N 3.02Å; D339-K341 VanDerWaalsContact O-N 3.14Å; K341-Y343 VanDerWaalsContact C-N 3.28Å; K341-Y343 PolarHBondContact O-N 3.01Å; K341-R344 PolarHBondContact O-N 3.21Å
342	S	65.1	Low	71.5	Confident	82 Å²	82	132.4 Å²	132.4	57%	0.573	62%	0.622	S	S	*	*	H	α-helix	trans	-67.3	-26.5	176.2	-168.6	0	0	0	0	113.3	D338 D339 R344	D338-S342 PolarHBondContact O-N 2.87Å; D339-S342 WeakPolarHBondContact O-CB 3.13Å; D339-S342 PolarHBondContact O-N 3.18Å; S342-R344 VanDerWaalsContact C-N 3.34Å
343	Y	58.9	Low	70.3	Confident	199 Å²	199	132.2 Å²	132.2	78%	0.78	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	3.1	174.3	-70.5	-75.4	0	0	0	114.1	D339 K341	D339-Y343 WeakPolarHBondContact O-CD2 3.47Å; D339-Y343 PolarHBondContact O-N 3.44Å; K341-Y343 VanDerWaalsContact C-N 3.28Å; K341-Y343 PolarHBondContact O-N 3.01Å
344	R	56.4	Low	69.1	Low	228 Å²	228	132 Å²	132	86%	0.86	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	4.3	177.3	-76.8	-175.8	177.4	-166.1	-0.8	113.4	K341 S342	K341-R344 PolarHBondContact O-N 3.21Å; S342-R344 VanDerWaalsContact C-N 3.34Å
345	L	47	Very low	67.7	Low	216 Å²	216	131.9 Å²	131.9	100%	1.131	63%	0.632	S	S	*	*			trans	-106.1	0	164.4	-75.2	160	0	0	0	107.4

Retrieved 345 of 345 residues in 70.7 ms (Link to these results)

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