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Ferritin

Stores iron in a soluble, non-toxic, readily available form. Important for iron homeostasis. Iron is taken up in the ferrous form and deposited as ferric hydroxides after oxidation.

AlphaFold DB , UniProt , Accession A0A096MPD7, Species PAPAN (Papio anubis, Olive baboon), Gene FTH1, Length 183 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	78.3	Confident	243 Å²	243	125 Å²	125	100%	1.197	71%	0.708	S	S	*	*				0	103.7	0	-68.5	173.4	-162.4	0	0	106.9	T3	M1-T3 PolarHBondContact O-N 3.24Å
2	T	43.4	Very low	79.9	Confident	143 Å²	143	122.2 Å²	122.2	88%	0.877	69%	0.689	S	S	*	*			trans	-66.9	112.8	176.8	27	0	0	0	0	108.4	A4	T2-A4 PolarHBondContact O-N 3.07Å
3	T	52.9	Low	81.4	Confident	136 Å²	136	113.6 Å²	113.6	83%	0.834	64%	0.64	S	S	*	*			trans	-55.7	109.1	165.5	47.5	0	0	0	0	106.8	M1 S5	M1-T3 PolarHBondContact O-N 3.24Å; T3-S5 PolarHBondContact O-N 3Å; T3-S5 VanDerWaalsContact O-N 3.07Å
4	A	64.4	Low	82.6	Confident	95 Å²	95	110.5 Å²	110.5	79%	0.785	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-56.9	119.4	175.6	0	0	0	0	0	107.6	T2 T6	T2-A4 PolarHBondContact O-N 3.07Å; A4-T6 PolarHBondContact O-N 3.37Å
5	S	81.3	Confident	83.6	Confident	111 Å²	111	112.3 Å²	112.3	78%	0.776	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-58.7	133.2	176.1	58	0	0	0	0	108.6	T3	T3-S5 PolarHBondContact O-N 3Å; T3-S5 VanDerWaalsContact O-N 3.07Å
6	T	88	Confident	84.6	Confident	119 Å²	119	108.9 Å²	108.9	73%	0.73	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-54	143.8	173.8	39.5	0	0	0	0	110.5	A4 Q8	A4-T6 PolarHBondContact O-N 3.37Å; T6-Q8 PolarHBondContact O-N 3.01Å
7	S	97.3	Very high	85.4	Confident	27 Å²	27	102.5 Å²	102.5	19%	0.189	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-56.7	136.9	179.1	-170.6	0	0	0	0	110.6	V9 R10 G78	S7-V9 PolarHBondContact O-N 3.37Å; S7-V9 VanDerWaalsContact O-N 3.09Å; S7-R10 VanDerWaalsContact O-CB 3.31Å; S7-R10 WeakPolarHBondContact O-CB 3.18Å; S7-R10 PolarHBondContact O-N 3.37Å; S7-G78 VanDerWaalsContact CB-O 3.25Å; S7-G78 WeakPolarHBondContact CB-O 3.35Å
8	Q	97.9	Very high	86.1	Confident	195 Å²	195	98.4 Å²	98.4	91%	0.911	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.5	-177.5	67.7	-175.4	-8	0	0	114.2	T6	T6-Q8 PolarHBondContact O-N 3.01Å
9	V	98.3	Very high	86.8	Confident	82 Å²	82	95.4 Å²	95.4	50%	0.497	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-4	179.5	-56.8	0	0	0	0	113.2	S7 Q11	S7-V9 PolarHBondContact O-N 3.37Å; S7-V9 VanDerWaalsContact O-N 3.09Å; V9-Q11 PolarHBondContact O-N 3.19Å
10	R	98.4	Very high	87.4	Confident	63 Å²	63	91.1 Å²	91.1	24%	0.238	51%	0.507	C	S	.	.			trans	-76.3	117.2	-173.3	-168.6	-176.8	-167.6	105.7	-5.6	110.6	S7 Y13 H14 E18	S7-R10 VanDerWaalsContact O-CB 3.31Å; S7-R10 WeakPolarHBondContact O-CB 3.18Å; S7-R10 PolarHBondContact O-N 3.37Å; R10-Y13 PolarHBondContact NE-O 2.68Å; R10-Y13 PolarHBondContact NH2-O 2.77Å; R10-H14 PolarHBondContact NH2-O 2.71Å; R10-E18 IonicContact CZ-OE2 2.99Å; R10-E18 IonicContact NH1-OE1 3.73Å; R10-E18 IonicContact NH1-OE2 3.71Å; R10-E18 PolarHBondContact NH1-OE2 2.85Å; R10-E18 IonicContact NH2-OE2 2.7Å; R10-E18 PolarHBondContact NH2-OE2 2.78Å
11	Q	98.3	Very high	88	Confident	161 Å²	161	86.7 Å²	86.7	75%	0.752	48%	0.483	S	S	*	.			trans	-143	132.7	174.7	-172.1	175.9	0.9	0	0	110.4	V9 Y13 R77	V9-Q11 PolarHBondContact O-N 3.19Å; Q11-Y13 PolarHBondContact O-N 3.44Å; Q11-R77 PolarHBondContact O-NH2 2.9Å; Q11-R77 VanDerWaalsContact O-NH2 3.1Å
12	N	98.3	Very high	90.7	Very high	91 Å²	91	76.1 Å²	76.1	49%	0.487	43%	0.431	S	S	.	.	S	Bend	trans	48.6	40.7	-179	-162.1	39.5	0	0	0	114.1	R77 N126 D127	N12-R77 PolarHBondContact O-NH2 3.36Å; N12-N126 PolarHBondContact ND2-O 3.39Å; N12-D127 VanDerWaalsContact O-OD2 3.09Å
13	Y	98.6	Very high	93.4	Very high	11 Å²	11	76.5 Å²	76.5	4%	0.043	42%	0.416	C	S	.	.			trans	-125.2	101.4	-178.2	-167.5	-129.3	0	0	0	109.5	R10 Q11 E18 I21 Q74 R77 L130	R10-Y13 PolarHBondContact NE-O 2.68Å; R10-Y13 PolarHBondContact NH2-O 2.77Å; Q11-Y13 PolarHBondContact O-N 3.44Å; Y13-E18 HydrophobicContact CD1-CB 4.38Å; Y13-E18 HydrophobicContact CE1-CB 3.68Å; Y13-E18 HydrophobicContact CE1-CG 4.22Å; Y13-E18 WeakPolarHBondContact OH-CA 3.2Å; Y13-I21 WeakPolarHBondContact OH-CG1 3.31Å; Y13-Q74 VanDerWaalsContact CE1-OE1 3.3Å; Y13-Q74 PolarHBondContact OH-OE1 3.3Å; Y13-R77 HydrophobicContact CD1-CB 3.66Å; Y13-R77 HydrophobicContact CD2-CB 3.99Å; Y13-R77 HydrophobicContact CD2-CG 4.32Å; Y13-R77 HydrophobicContact CE1-CB 3.8Å; Y13-R77 HydrophobicContact CE2-CB 4.14Å; Y13-R77 HydrophobicContact CE2-CG 4.34Å; Y13-R77 HydrophobicContact CG-CB 3.76Å; Y13-L130 HydrophobicContact CE2-CD2 4.33Å
14	H	98.6	Very high	95.6	Very high	70 Å²	70	70.1 Å²	70.1	32%	0.324	38%	0.377	S	S	.	.			trans	-73.3	147.9	-174.2	-166.1	-85.8	0	0	0	111.3	R10 D16 S17 E18 K125	R10-H14 PolarHBondContact NH2-O 2.71Å; H14-D16 VanDerWaalsContact C-N 3.26Å; H14-D16 IonicContact CE1-OD1 3.8Å; H14-D16 PolarHBondContact CE1-OD1 2.88Å; H14-D16 IonicContact CE1-OD2 3.57Å; H14-D16 PolarHBondContact CE1-OD2 3.09Å; H14-D16 WeakPolarHBondContact ND1-CB 3.48Å; H14-D16 PolarHBondContact ND1-N 3.47Å; H14-D16 IonicContact ND1-OD1 3.56Å; H14-D16 IonicContact ND1-OD2 3.97Å; H14-D16 PolarHBondContact ND1-OD2 3.08Å; H14-D16 PolarHBondContact O-N 3.47Å; H14-S17 WeakPolarHBondContact O-CB 3.25Å; H14-S17 PolarHBondContact O-N 3.31Å; H14-S17 VanDerWaalsContact O-N 3.13Å; H14-E18 PolarHBondContact O-N 2.97Å; H14-E18 VanDerWaalsContact O-N 3.08Å; H14-K125 HydrophobicContact CB-CB 4.22Å; H14-K125 HydrophobicContact CB-CD 4.21Å; H14-K125 HydrophobicContact CB-CG 4.03Å; H14-K125 PolarHBondContact CE1-NZ 3.41Å; H14-K125 PolarHBondContact NE2-NZ 3.41Å
15	Q	98.3	Very high	97.2	Very high	137 Å²	137	65.7 Å²	65.7	64%	0.64	34%	0.34	S	S	*	.	H	α-helix	trans	-60.4	-35.5	179.8	67.2	-176.8	8	0	0	112.6	S17 E18 A19	Q15-S17 VanDerWaalsContact C-N 3.33Å; Q15-S17 PolarHBondContact O-N 3.49Å; Q15-E18 WeakPolarHBondContact O-CB 3.4Å; Q15-E18 PolarHBondContact O-N 2.91Å; Q15-A19 WeakPolarHBondContact O-CB 3.25Å; Q15-A19 PolarHBondContact O-N 3.28Å
16	D	98.6	Very high	98	Very high	59 Å²	59	62.3 Å²	62.3	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-40.9	175.4	-55.1	-9	0	0	0	111.5	H14 A19 A20 L121 K125	H14-D16 VanDerWaalsContact C-N 3.26Å; H14-D16 IonicContact CE1-OD1 3.8Å; H14-D16 PolarHBondContact CE1-OD1 2.88Å; H14-D16 IonicContact CE1-OD2 3.57Å; H14-D16 PolarHBondContact CE1-OD2 3.09Å; H14-D16 WeakPolarHBondContact ND1-CB 3.48Å; H14-D16 PolarHBondContact ND1-N 3.47Å; H14-D16 IonicContact ND1-OD1 3.56Å; H14-D16 IonicContact ND1-OD2 3.97Å; H14-D16 PolarHBondContact ND1-OD2 3.08Å; H14-D16 PolarHBondContact O-N 3.47Å; D16-A19 PolarHBondContact O-N 3.38Å; D16-A20 VanDerWaalsContact O-CB 3.29Å; D16-A20 WeakPolarHBondContact O-CB 3.46Å; D16-A20 PolarHBondContact O-N 3.13Å; D16-L121 HydrophobicContact CB-CD1 4.17Å; D16-L121 HydrophobicContact CB-CD2 4.22Å; D16-K125 WeakPolarHBondContact OD2-CE 3.29Å; D16-K125 IonicContact OD2-NZ 3.98Å; D16-K125 PolarHBondContact OD2-NZ 3.33Å
17	S	98.6	Very high	98.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-43	176.4	-52.7	0	0	0	0	111	H14 Q15 A19 A20 I21	H14-S17 WeakPolarHBondContact O-CB 3.25Å; H14-S17 PolarHBondContact O-N 3.31Å; H14-S17 VanDerWaalsContact O-N 3.13Å; Q15-S17 VanDerWaalsContact C-N 3.33Å; Q15-S17 PolarHBondContact O-N 3.49Å; S17-A19 PolarHBondContact O-N 2.99Å; S17-A20 PolarHBondContact O-N 3.34Å; S17-I21 WeakPolarHBondContact O-CG1 3.44Å; S17-I21 PolarHBondContact O-N 3.15Å
18	E	98.8	Very high	98.6	Very high	29 Å²	29	57.4 Å²	57.4	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-46	173.8	174.5	177	-164.8	0	0	112.3	R10 Y13 H14 Q15 A20 I21 N22 Q74 G79 R80	R10-E18 IonicContact CZ-OE2 2.99Å; R10-E18 IonicContact NH1-OE1 3.73Å; R10-E18 IonicContact NH1-OE2 3.71Å; R10-E18 PolarHBondContact NH1-OE2 2.85Å; R10-E18 IonicContact NH2-OE2 2.7Å; R10-E18 PolarHBondContact NH2-OE2 2.78Å; Y13-E18 HydrophobicContact CD1-CB 4.38Å; Y13-E18 HydrophobicContact CE1-CB 3.68Å; Y13-E18 HydrophobicContact CE1-CG 4.22Å; Y13-E18 WeakPolarHBondContact OH-CA 3.2Å; H14-E18 PolarHBondContact O-N 2.97Å; H14-E18 VanDerWaalsContact O-N 3.08Å; Q15-E18 WeakPolarHBondContact O-CB 3.4Å; Q15-E18 PolarHBondContact O-N 2.91Å; E18-A20 VanDerWaalsContact C-N 3.33Å; E18-I21 PolarHBondContact O-N 3.08Å; E18-N22 PolarHBondContact O-N 3.14Å; E18-N22 VanDerWaalsContact O-N 3.15Å; E18-N22 PolarHBondContact O-ND2 3.15Å; E18-Q74 PolarHBondContact O-NE2 2.85Å; E18-G79 WeakPolarHBondContact OE1-CA 3.47Å; E18-R80 PolarHBondContact OE1-N 2.82Å
19	A	98.8	Very high	98.7	Very high	40 Å²	40	48.7 Å²	48.7	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-65.7	-37.6	176.9	0	0	0	0	0	111.9	Q15 D16 S17 N22 R23	Q15-A19 WeakPolarHBondContact O-CB 3.25Å; Q15-A19 PolarHBondContact O-N 3.28Å; D16-A19 PolarHBondContact O-N 3.38Å; S17-A19 PolarHBondContact O-N 2.99Å; A19-N22 PolarHBondContact O-N 3.46Å; A19-R23 PolarHBondContact O-N 3.32Å; A19-R23 VanDerWaalsContact O-N 3.15Å; A19-R23 PolarHBondContact O-NH1 2.56Å
20	A	98.8	Very high	98.7	Very high	9 Å²	9	47 Å²	47	7%	0.074	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-38.8	177.5	0	0	0	0	0	112.2	D16 S17 E18 N22 R23 Q24 L118 L121	D16-A20 VanDerWaalsContact O-CB 3.29Å; D16-A20 WeakPolarHBondContact O-CB 3.46Å; D16-A20 PolarHBondContact O-N 3.13Å; S17-A20 PolarHBondContact O-N 3.34Å; E18-A20 VanDerWaalsContact C-N 3.33Å; A20-N22 VanDerWaalsContact C-N 3.33Å; A20-N22 PolarHBondContact O-N 3.38Å; A20-R23 WeakPolarHBondContact O-CB 3.41Å; A20-R23 PolarHBondContact O-N 3.45Å; A20-R23 VanDerWaalsContact O-N 3.14Å; A20-Q24 PolarHBondContact O-N 3.43Å; A20-L118 HydrophobicContact CB-CD1 3.5Å; A20-L118 VanDerWaalsContact CB-CD1 3.5Å; A20-L121 HydrophobicContact CB-CD2 3.68Å
21	I	98.9	Very high	98.7	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-41.1	172.1	-71.5	-71.8	0	0	0	111.3	Y13 S17 E18 R23 Q24 I25 L70 L73 Q74 L118 L130	Y13-I21 WeakPolarHBondContact OH-CG1 3.31Å; S17-I21 WeakPolarHBondContact O-CG1 3.44Å; S17-I21 PolarHBondContact O-N 3.15Å; E18-I21 PolarHBondContact O-N 3.08Å; I21-R23 VanDerWaalsContact C-N 3.29Å; I21-R23 PolarHBondContact O-N 3.36Å; I21-Q24 PolarHBondContact O-N 2.99Å; I21-I25 HydrophobicContact CG2-CD1 3.83Å; I21-I25 HydrophobicContact CG2-CG1 4.37Å; I21-I25 WeakPolarHBondContact O-CB 3.47Å; I21-I25 WeakPolarHBondContact O-CD1 3.47Å; I21-I25 VanDerWaalsContact O-CG1 3.24Å; I21-I25 WeakPolarHBondContact O-CG1 3.36Å; I21-I25 PolarHBondContact O-N 2.88Å; I21-L70 HydrophobicContact CD1-CD2 3.82Å; I21-L73 HydrophobicContact CD1-CD2 3.99Å; I21-Q74 HydrophobicContact CG2-CB 3.97Å; I21-Q74 HydrophobicContact CG2-CG 4.34Å; I21-L118 HydrophobicContact CD1-CD1 4.39Å; I21-L118 HydrophobicContact CD1-CD2 3.78Å; I21-L118 HydrophobicContact CG1-CD1 4.45Å; I21-L130 HydrophobicContact CD1-CD1 4.08Å
22	N	98.9	Very high	98.7	Very high	21 Å²	21	37 Å²	37	11%	0.112	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-36.1	174.9	-73.9	-32.9	0	0	0	112.8	E18 A19 A20 N26 Q74 R80 I81 F82	E18-N22 PolarHBondContact O-N 3.14Å; E18-N22 VanDerWaalsContact O-N 3.15Å; E18-N22 PolarHBondContact O-ND2 3.15Å; A19-N22 PolarHBondContact O-N 3.46Å; A20-N22 VanDerWaalsContact C-N 3.33Å; A20-N22 PolarHBondContact O-N 3.38Å; N22-N26 PolarHBondContact O-N 3.14Å; N22-Q74 PolarHBondContact ND2-NE2 2.89Å; N22-Q74 PolarHBondContact OD1-NE2 3Å; N22-R80 PolarHBondContact ND2-O 3.13Å; N22-R80 PolarHBondContact OD1-O 3.37Å; N22-I81 WeakPolarHBondContact OD1-CA 3.36Å; N22-F82 PolarHBondContact OD1-N 2.9Å
23	R	98.9	Very high	98.8	Very high	151 Å²	151	37.9 Å²	37.9	57%	0.57	18%	0.18	S	C	*	.	H	α-helix	trans	-68.8	-44.4	173.8	-69.6	-171.5	-63.4	-85	3.7	111.7	A19 A20 I21 I25 N26 L27	A19-R23 PolarHBondContact O-N 3.32Å; A19-R23 VanDerWaalsContact O-N 3.15Å; A19-R23 PolarHBondContact O-NH1 2.56Å; A20-R23 WeakPolarHBondContact O-CB 3.41Å; A20-R23 PolarHBondContact O-N 3.45Å; A20-R23 VanDerWaalsContact O-N 3.14Å; I21-R23 VanDerWaalsContact C-N 3.29Å; I21-R23 PolarHBondContact O-N 3.36Å; R23-I25 VanDerWaalsContact C-N 3.34Å; R23-I25 PolarHBondContact O-N 3.15Å; R23-N26 PolarHBondContact O-N 3.42Å; R23-N26 VanDerWaalsContact O-N 3.14Å; R23-L27 PolarHBondContact O-N 2.98Å
24	Q	98.9	Very high	98.8	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-62.3	-41.9	177.8	-168.4	66.4	30.7	0	0	111.2	A20 I21 N26 L27 E28 L70 S114 L115 L118	A20-Q24 PolarHBondContact O-N 3.43Å; I21-Q24 PolarHBondContact O-N 2.99Å; Q24-N26 VanDerWaalsContact C-N 3.27Å; Q24-N26 PolarHBondContact O-N 3.44Å; Q24-L27 WeakPolarHBondContact O-CA 3.47Å; Q24-L27 WeakPolarHBondContact O-CB 3.35Å; Q24-L27 PolarHBondContact O-N 3.44Å; Q24-E28 PolarHBondContact NE2-OE1 2.91Å; Q24-E28 WeakPolarHBondContact O-CG 3.5Å; Q24-E28 PolarHBondContact O-N 3.3Å; Q24-L70 HydrophobicContact CB-CD1 3.89Å; Q24-L70 HydrophobicContact CG-CD1 3.48Å; Q24-L70 VanDerWaalsContact CG-CD1 3.48Å; Q24-S114 VanDerWaalsContact OE1-CB 3.3Å; Q24-S114 PolarHBondContact OE1-OG 3.33Å; Q24-L115 HydrophobicContact CG-CD2 4.07Å; Q24-L118 HydrophobicContact CB-CD2 4.25Å; Q24-L118 HydrophobicContact CG-CD2 4.32Å
25	I	98.9	Very high	98.8	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-53	-45.9	173	-73.5	162.6	0	0	0	111	I21 R23 L27 L29 L70 M71 L83	I21-I25 HydrophobicContact CG2-CD1 3.83Å; I21-I25 HydrophobicContact CG2-CG1 4.37Å; I21-I25 WeakPolarHBondContact O-CB 3.47Å; I21-I25 WeakPolarHBondContact O-CD1 3.47Å; I21-I25 VanDerWaalsContact O-CG1 3.24Å; I21-I25 WeakPolarHBondContact O-CG1 3.36Å; I21-I25 PolarHBondContact O-N 2.88Å; R23-I25 VanDerWaalsContact C-N 3.34Å; R23-I25 PolarHBondContact O-N 3.15Å; I25-L27 VanDerWaalsContact C-N 3.33Å; I25-L29 HydrophobicContact CG2-CD1 4.02Å; I25-L29 WeakPolarHBondContact O-CB 3.47Å; I25-L29 WeakPolarHBondContact O-CG 3.44Å; I25-L29 PolarHBondContact O-N 3.41Å; I25-L29 VanDerWaalsContact O-N 3.11Å; I25-L70 HydrophobicContact CD1-CB 4.13Å; I25-L70 HydrophobicContact CG1-CB 3.45Å; I25-L70 VanDerWaalsContact CG1-CB 3.45Å; I25-L70 HydrophobicContact CG1-CD1 4.12Å; I25-L70 HydrophobicContact CG1-CG 4.43Å; I25-M71 HydrophobicContact CD1-CG 3.83Å; I25-M71 HydrophobicContact CG1-CG 4.16Å; I25-M71 HydrophobicContact CG2-CE 3.44Å; I25-M71 VanDerWaalsContact CG2-CE 3.44Å; I25-M71 HydrophobicContact CG2-CG 4.03Å; I25-L83 HydrophobicContact CG2-CD2 4.28Å
26	N	98.9	Very high	98.8	Very high	40 Å²	40	30.5 Å²	30.5	21%	0.214	15%	0.148	C	C	.	.	H	α-helix	trans	-68.3	-33.7	178.7	-175.7	-106.4	0	0	0	112.2	N22 R23 Q24 L29 Y30 Q84 D85	N22-N26 PolarHBondContact O-N 3.14Å; R23-N26 PolarHBondContact O-N 3.42Å; R23-N26 VanDerWaalsContact O-N 3.14Å; Q24-N26 VanDerWaalsContact C-N 3.27Å; Q24-N26 PolarHBondContact O-N 3.44Å; N26-L29 PolarHBondContact O-N 2.85Å; N26-Y30 WeakPolarHBondContact O-CB 3.45Å; N26-Y30 PolarHBondContact O-N 2.87Å; N26-Q84 PolarHBondContact ND2-O 2.85Å; N26-D85 PolarHBondContact ND2-O 2.7Å
27	L	98.8	Very high	98.8	Very high	42 Å²	42	29 Å²	29	22%	0.22	14%	0.142	C	C	.	.	H	α-helix	trans	-67.7	-43.4	176.3	-173.9	59.7	0	0	0	112.3	R23 Q24 I25 L29 Y30 A31 V111	R23-L27 PolarHBondContact O-N 2.98Å; Q24-L27 WeakPolarHBondContact O-CA 3.47Å; Q24-L27 WeakPolarHBondContact O-CB 3.35Å; Q24-L27 PolarHBondContact O-N 3.44Å; I25-L27 VanDerWaalsContact C-N 3.33Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.36Å; L27-Y30 HydrophobicContact CD1-CD1 4.27Å; L27-Y30 WeakPolarHBondContact O-CB 3.43Å; L27-Y30 PolarHBondContact O-N 3.22Å; L27-Y30 VanDerWaalsContact O-N 3.16Å; L27-A31 PolarHBondContact O-N 3.06Å; L27-V111 HydrophobicContact CD2-CG2 4.39Å; L27-V111 HydrophobicContact CG-CG2 4.19Å
28	E	98.9	Very high	98.8	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.7	-38.3	174.7	-52.8	-47.8	179.3	0	0	111.2	Q24 Y30 A31 S32 H66 A67 L70 V111	Q24-E28 PolarHBondContact NE2-OE1 2.91Å; Q24-E28 WeakPolarHBondContact O-CG 3.5Å; Q24-E28 PolarHBondContact O-N 3.3Å; E28-Y30 VanDerWaalsContact C-N 3.32Å; E28-Y30 PolarHBondContact O-N 2.87Å; E28-A31 PolarHBondContact O-N 3.1Å; E28-S32 WeakPolarHBondContact O-CB 3.44Å; E28-S32 PolarHBondContact O-N 2.95Å; E28-H66 HydrophobicContact CB-CB 4.32Å; E28-H66 HydrophobicContact CG-CB 4.02Å; E28-A67 HydrophobicContact CB-CB 3.8Å; E28-L70 HydrophobicContact CG-CD1 3.73Å; E28-V111 VanDerWaalsContact OE2-CG1 3.29Å; E28-V111 WeakPolarHBondContact OE2-CG1 3.32Å
29	L	98.9	Very high	98.8	Very high	13 Å²	13	27.9 Å²	27.9	7%	0.068	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-36.2	174	-71.3	173.4	0	0	0	112.5	I25 N26 L27 Y33 A67 M71 I86	I25-L29 HydrophobicContact CG2-CD1 4.02Å; I25-L29 WeakPolarHBondContact O-CB 3.47Å; I25-L29 WeakPolarHBondContact O-CG 3.44Å; I25-L29 PolarHBondContact O-N 3.41Å; I25-L29 VanDerWaalsContact O-N 3.11Å; N26-L29 PolarHBondContact O-N 2.85Å; L27-L29 VanDerWaalsContact C-N 3.31Å; L27-L29 PolarHBondContact O-N 3.36Å; L29-Y33 WeakPolarHBondContact O-CB 3.32Å; L29-Y33 PolarHBondContact O-N 3.18Å; L29-Y33 VanDerWaalsContact O-N 3.09Å; L29-A67 HydrophobicContact CD2-CB 3.7Å; L29-A67 HydrophobicContact CG-CB 3.75Å; L29-M71 HydrophobicContact CD1-CE 3.96Å; L29-I86 HydrophobicContact CB-CD1 3.84Å; L29-I86 HydrophobicContact CB-CG1 4.03Å; L29-I86 HydrophobicContact CD1-CD1 4.2Å; L29-I86 HydrophobicContact CD1-CG1 4.48Å; L29-I86 HydrophobicContact CG-CD1 4.43Å
30	Y	98.8	Very high	98.8	Very high	46 Å²	46	32.8 Å²	32.8	18%	0.18	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-45.9	172.9	172.1	-104	0	0	0	111	N26 L27 E28 S32 Y33 V34 K87 L107	N26-Y30 WeakPolarHBondContact O-CB 3.45Å; N26-Y30 PolarHBondContact O-N 2.87Å; L27-Y30 HydrophobicContact CD1-CD1 4.27Å; L27-Y30 WeakPolarHBondContact O-CB 3.43Å; L27-Y30 PolarHBondContact O-N 3.22Å; L27-Y30 VanDerWaalsContact O-N 3.16Å; E28-Y30 VanDerWaalsContact C-N 3.32Å; E28-Y30 PolarHBondContact O-N 2.87Å; Y30-S32 PolarHBondContact O-N 2.99Å; Y30-Y33 PolarHBondContact O-N 2.88Å; Y30-V34 HydrophobicContact CD1-CG2 4.21Å; Y30-V34 HydrophobicContact CD2-CG2 4.25Å; Y30-V34 HydrophobicContact CE1-CG2 3.73Å; Y30-V34 HydrophobicContact CE2-CG2 3.77Å; Y30-V34 HydrophobicContact CG-CG2 4.46Å; Y30-V34 VanDerWaalsContact CZ-CG2 3.48Å; Y30-V34 WeakPolarHBondContact O-CG2 3.19Å; Y30-V34 PolarHBondContact O-N 3.36Å; Y30-K87 HydrophobicContact CD2-CB 4.32Å; Y30-K87 WeakPolarHBondContact CD2-O 3.39Å; Y30-K87 HydrophobicContact CE2-CB 4.37Å; Y30-L107 HydrophobicContact CD1-CD1 4.24Å; Y30-L107 HydrophobicContact CE1-CD1 4.06Å
31	A	98.8	Very high	98.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.8	-47.1	177	0	0	0	0	0	111.5	L27 E28 Y33 V34 Y35 E63 L107 V111	L27-A31 PolarHBondContact O-N 3.06Å; E28-A31 PolarHBondContact O-N 3.1Å; A31-Y33 VanDerWaalsContact C-N 3.26Å; A31-Y33 PolarHBondContact O-N 3.01Å; A31-V34 PolarHBondContact O-N 2.85Å; A31-V34 VanDerWaalsContact O-N 3.17Å; A31-Y35 WeakPolarHBondContact O-CD2 3.37Å; A31-Y35 PolarHBondContact O-N 3.31Å; A31-E63 HydrophobicContact CB-CB 4.4Å; A31-E63 HydrophobicContact CB-CG 3.99Å; A31-L107 HydrophobicContact CB-CD1 4.19Å; A31-L107 HydrophobicContact CB-CD2 3.98Å; A31-L107 HydrophobicContact CB-CG 4.26Å; A31-V111 HydrophobicContact CB-CG2 4.23Å
32	S	98.9	Very high	98.8	Very high	15 Å²	15	33.2 Å²	33.2	11%	0.105	15%	0.148	C	C	.	.	H	α-helix	trans	-53.6	-43.1	172	177.7	0	0	0	0	112.1	E28 Y30 L36 S60	E28-S32 WeakPolarHBondContact O-CB 3.44Å; E28-S32 PolarHBondContact O-N 2.95Å; Y30-S32 PolarHBondContact O-N 2.99Å; S32-L36 WeakPolarHBondContact O-CB 3.4Å; S32-L36 PolarHBondContact O-N 3.25Å; S32-S60 WeakPolarHBondContact CB-O 3.05Å; S32-S60 WeakPolarHBondContact O-CB 3.31Å; S32-S60 PolarHBondContact O-OG 2.92Å; S32-S60 PolarHBondContact OG-O 3.34Å; S32-S60 PolarHBondContact OG-OG 3.31Å
33	Y	98.8	Very high	98.8	Very high	109 Å²	109	37.2 Å²	37.2	43%	0.427	17%	0.169	S	C	.	.	H	α-helix	trans	-72.7	-33.7	-179.5	-165.5	-153.7	0	0	0	113.5	L29 Y30 A31 L36 S37 I86	L29-Y33 WeakPolarHBondContact O-CB 3.32Å; L29-Y33 PolarHBondContact O-N 3.18Å; L29-Y33 VanDerWaalsContact O-N 3.09Å; Y30-Y33 PolarHBondContact O-N 2.88Å; A31-Y33 VanDerWaalsContact C-N 3.26Å; A31-Y33 PolarHBondContact O-N 3.01Å; Y33-L36 HydrophobicContact CD2-CB 4.49Å; Y33-L36 HydrophobicContact CD2-CD2 4.2Å; Y33-L36 HydrophobicContact CE2-CD2 4.49Å; Y33-L36 PolarHBondContact O-N 3.44Å; Y33-S37 PolarHBondContact O-N 2.91Å; Y33-S37 VanDerWaalsContact O-N 3.08Å; Y33-I86 HydrophobicContact CD1-CG2 3.84Å; Y33-I86 HydrophobicContact CG-CG2 4.36Å
34	V	98.8	Very high	98.8	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.036	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-49	171.9	171.4	0	0	0	0	110.6	Y30 A31 L36 S37 M38 P89 W94 L107	Y30-V34 HydrophobicContact CD1-CG2 4.21Å; Y30-V34 HydrophobicContact CD2-CG2 4.25Å; Y30-V34 HydrophobicContact CE1-CG2 3.73Å; Y30-V34 HydrophobicContact CE2-CG2 3.77Å; Y30-V34 HydrophobicContact CG-CG2 4.46Å; Y30-V34 VanDerWaalsContact CZ-CG2 3.48Å; Y30-V34 WeakPolarHBondContact O-CG2 3.19Å; Y30-V34 PolarHBondContact O-N 3.36Å; A31-V34 PolarHBondContact O-N 2.85Å; A31-V34 VanDerWaalsContact O-N 3.17Å; V34-L36 VanDerWaalsContact C-N 3.28Å; V34-L36 PolarHBondContact O-N 2.88Å; V34-S37 WeakPolarHBondContact O-CB 3.47Å; V34-S37 PolarHBondContact O-N 3.02Å; V34-S37 VanDerWaalsContact O-N 3.1Å; V34-M38 HydrophobicContact CG1-CE 3.76Å; V34-M38 HydrophobicContact CG1-SD 4.4Å; V34-M38 PolarHBondContact O-N 3.29Å; V34-P89 HydrophobicContact CB-CG 4.47Å; V34-P89 HydrophobicContact CG2-CB 4.05Å; V34-P89 HydrophobicContact CG2-CG 3.99Å; V34-W94 HydrophobicContact CG1-CH2 3.72Å; V34-W94 HydrophobicContact CG1-CZ2 4.12Å; V34-L107 HydrophobicContact CB-CD2 3.98Å; V34-L107 HydrophobicContact CG1-CD2 3.85Å
35	Y	98.8	Very high	98.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-36.1	176.6	-78.9	-52.6	0	0	0	112.9	A31 S37 M38 S39 F56 Q59 E63 A104 L107 E108	A31-Y35 WeakPolarHBondContact O-CD2 3.37Å; A31-Y35 PolarHBondContact O-N 3.31Å; Y35-S37 VanDerWaalsContact C-N 3.34Å; Y35-S37 PolarHBondContact O-N 3.39Å; Y35-M38 HydrophobicContact CD1-SD 3.97Å; Y35-M38 HydrophobicContact CE1-SD 4.31Å; Y35-M38 PolarHBondContact O-N 2.82Å; Y35-S39 WeakPolarHBondContact O-CB 3.46Å; Y35-S39 PolarHBondContact O-N 3.45Å; Y35-F56 AromaticContact CD1-CD1 3.54Å; Y35-F56 HydrophobicContact CD1-CD1 3.54Å; Y35-F56 HydrophobicContact CD1-CE1 4.2Å; Y35-F56 HydrophobicContact CD1-CG 4.42Å; Y35-F56 AromaticContact CE1-CD1 3.79Å; Y35-F56 HydrophobicContact CE1-CD1 3.79Å; Y35-F56 HydrophobicContact CE1-CE1 4.05Å; Y35-Q59 HydrophobicContact CD1-CB 4Å; Y35-Q59 HydrophobicContact CD2-CB 3.93Å; Y35-Q59 HydrophobicContact CE1-CB 4.12Å; Y35-Q59 HydrophobicContact CE2-CB 4.06Å; Y35-Q59 HydrophobicContact CG-CB 3.9Å; Y35-E63 HydrophobicContact CD2-CG 3.84Å; Y35-E63 HydrophobicContact CE2-CG 3.88Å; Y35-A104 HydrophobicContact CE1-CB 3.69Å; Y35-L107 HydrophobicContact CD2-CD2 4.46Å; Y35-L107 HydrophobicContact CE2-CD2 4.11Å; Y35-E108 VanDerWaalsContact CE2-OE1 3.24Å; Y35-E108 WeakPolarHBondContact CE2-OE1 3.36Å; Y35-E108 WeakPolarHBondContact OH-CG 3.43Å; Y35-E108 PolarHBondContact OH-OE1 3.48Å
36	L	98.8	Very high	98.7	Very high	56 Å²	56	46.5 Å²	46.5	29%	0.293	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-45.1	173.4	-167.9	66.5	0	0	0	111.1	S32 Y33 V34 S39 Y40 L57	S32-L36 WeakPolarHBondContact O-CB 3.4Å; S32-L36 PolarHBondContact O-N 3.25Å; Y33-L36 HydrophobicContact CD2-CB 4.49Å; Y33-L36 HydrophobicContact CD2-CD2 4.2Å; Y33-L36 HydrophobicContact CE2-CD2 4.49Å; Y33-L36 PolarHBondContact O-N 3.44Å; V34-L36 VanDerWaalsContact C-N 3.28Å; V34-L36 PolarHBondContact O-N 2.88Å; L36-S39 WeakPolarHBondContact O-CB 3.41Å; L36-S39 PolarHBondContact O-N 3.5Å; L36-Y40 HydrophobicContact CD1-CD2 4Å; L36-Y40 HydrophobicContact CD1-CE2 3.64Å; L36-Y40 HydrophobicContact CG-CD2 4.12Å; L36-Y40 HydrophobicContact CG-CE2 4.15Å; L36-Y40 WeakPolarHBondContact O-CD2 3.5Å; L36-Y40 PolarHBondContact O-N 3.17Å; L36-Y40 VanDerWaalsContact O-N 3.14Å; L36-L57 HydrophobicContact CD1-CD1 3.95Å
37	S	98.8	Very high	98.7	Very high	27 Å²	27	46.1 Å²	46.1	19%	0.189	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-45.6	175.8	178.6	0	0	0	0	111.9	Y33 V34 Y35 S39 Y40 Y41 W94	Y33-S37 PolarHBondContact O-N 2.91Å; Y33-S37 VanDerWaalsContact O-N 3.08Å; V34-S37 WeakPolarHBondContact O-CB 3.47Å; V34-S37 PolarHBondContact O-N 3.02Å; V34-S37 VanDerWaalsContact O-N 3.1Å; Y35-S37 VanDerWaalsContact C-N 3.34Å; Y35-S37 PolarHBondContact O-N 3.39Å; S37-S39 PolarHBondContact O-N 2.91Å; S37-Y40 PolarHBondContact O-N 2.93Å; S37-Y41 PolarHBondContact O-N 3.09Å; S37-W94 PolarHBondContact OG-NE1 3.19Å
38	M	98.8	Very high	98.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-46	175.8	-68.4	174.9	176.3	0	0	111.5	V34 Y35 Y40 Y41 F42 F56 W94 C103 A104	V34-M38 HydrophobicContact CG1-CE 3.76Å; V34-M38 HydrophobicContact CG1-SD 4.4Å; V34-M38 PolarHBondContact O-N 3.29Å; Y35-M38 HydrophobicContact CD1-SD 3.97Å; Y35-M38 HydrophobicContact CE1-SD 4.31Å; Y35-M38 PolarHBondContact O-N 2.82Å; M38-Y40 PolarHBondContact O-N 3.19Å; M38-Y41 WeakPolarHBondContact O-CB 3.45Å; M38-Y41 PolarHBondContact O-N 3.4Å; M38-F42 WeakPolarHBondContact O-CD2 3.24Å; M38-F42 PolarHBondContact O-N 3.44Å; M38-F56 HydrophobicContact CB-CB 4.12Å; M38-F56 HydrophobicContact CB-CD1 4.36Å; M38-F56 HydrophobicContact CB-CD2 3.92Å; M38-F56 HydrophobicContact CB-CE2 4.39Å; M38-F56 HydrophobicContact CB-CG 3.89Å; M38-F56 HydrophobicContact SD-CD1 4.1Å; M38-F56 HydrophobicContact SD-CE1 3.96Å; M38-F56 HydrophobicContact SD-CZ 4.29Å; M38-W94 HydrophobicContact CE-CD2 4.25Å; M38-W94 HydrophobicContact CE-CE3 3.67Å; M38-W94 HydrophobicContact CE-CH2 3.64Å; M38-W94 HydrophobicContact CE-CZ2 4.2Å; M38-W94 HydrophobicContact CE-CZ3 3.34Å; M38-W94 HydrophobicContact CG-CD2 3.63Å; M38-W94 VanDerWaalsContact CG-CE2 3.49Å; M38-W94 HydrophobicContact CG-CE3 4.04Å; M38-W94 HydrophobicContact CG-CG 4.11Å; M38-W94 HydrophobicContact CG-CH2 4.2Å; M38-W94 HydrophobicContact CG-CZ2 3.79Å; M38-W94 HydrophobicContact CG-CZ3 4.31Å; M38-C103 HydrophobicContact CE-CB 3.68Å; M38-A104 HydrophobicContact CE-CB 4.38Å; M38-A104 HydrophobicContact SD-CB 4.34Å
39	S	98.8	Very high	98.6	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-55.4	-51.7	179	178	0	0	0	0	112.3	Y35 L36 S37 Y41 F42 D43 A53 L57	Y35-S39 WeakPolarHBondContact O-CB 3.46Å; Y35-S39 PolarHBondContact O-N 3.45Å; L36-S39 WeakPolarHBondContact O-CB 3.41Å; L36-S39 PolarHBondContact O-N 3.5Å; S37-S39 PolarHBondContact O-N 2.91Å; S39-Y41 VanDerWaalsContact C-N 3.27Å; S39-Y41 PolarHBondContact O-N 3.22Å; S39-F42 PolarHBondContact O-N 3.16Å; S39-D43 PolarHBondContact O-N 2.88Å; S39-A53 WeakPolarHBondContact CB-O 3.49Å; S39-A53 WeakPolarHBondContact O-CB 3.45Å; S39-A53 PolarHBondContact OG-O 3.33Å; S39-L57 WeakPolarHBondContact OG-CB 3.45Å
40	Y	98.6	Very high	98.5	Very high	144 Å²	144	54.6 Å²	54.6	57%	0.565	27%	0.271	S	S	*	.	H	α-helix	trans	-72.9	-17.7	-178.5	-81.2	-82.4	0	0	0	113.8	L36 S37 M38	L36-Y40 HydrophobicContact CD1-CD2 4Å; L36-Y40 HydrophobicContact CD1-CE2 3.64Å; L36-Y40 HydrophobicContact CG-CD2 4.12Å; L36-Y40 HydrophobicContact CG-CE2 4.15Å; L36-Y40 WeakPolarHBondContact O-CD2 3.5Å; L36-Y40 PolarHBondContact O-N 3.17Å; L36-Y40 VanDerWaalsContact O-N 3.14Å; S37-Y40 PolarHBondContact O-N 2.93Å; M38-Y40 PolarHBondContact O-N 3.19Å
41	Y	98.8	Very high	98.5	Very high	18 Å²	18	53.5 Å²	53.5	7%	0.071	27%	0.269	C	S	.	.	H	α-helix	trans	-66.6	-46.3	166.9	168.5	-93.3	0	0	0	111.8	S37 M38 S39 D43 R44 V47 D93 W94 E95	S37-Y41 PolarHBondContact O-N 3.09Å; M38-Y41 WeakPolarHBondContact O-CB 3.45Å; M38-Y41 PolarHBondContact O-N 3.4Å; S39-Y41 VanDerWaalsContact C-N 3.27Å; S39-Y41 PolarHBondContact O-N 3.22Å; Y41-D43 PolarHBondContact O-N 3.45Å; Y41-R44 WeakPolarHBondContact O-CB 3.45Å; Y41-R44 WeakPolarHBondContact O-CD 3.4Å; Y41-R44 WeakPolarHBondContact O-CG 3.31Å; Y41-R44 PolarHBondContact O-N 2.9Å; Y41-V47 HydrophobicContact CD1-CG1 4.38Å; Y41-V47 HydrophobicContact CD2-CG2 4.5Å; Y41-V47 HydrophobicContact CE1-CG1 3.88Å; Y41-V47 HydrophobicContact CE1-CG2 4.01Å; Y41-V47 HydrophobicContact CE2-CG2 3.94Å; Y41-D93 WeakPolarHBondContact CE2-OD1 3.49Å; Y41-W94 VanDerWaalsContact CB-CD1 3.48Å; Y41-W94 HydrophobicContact CD1-CB 3.78Å; Y41-W94 HydrophobicContact CD1-CG 4.42Å; Y41-W94 HydrophobicContact CD2-CB 4.3Å; Y41-W94 HydrophobicContact CE1-CB 4Å; Y41-W94 HydrophobicContact CG-CB 3.96Å; Y41-W94 AromaticContact CG-CD1 3.72Å; Y41-W94 HydrophobicContact CG-CG 4.25Å; Y41-E95 WeakPolarHBondContact OH-CA 3.47Å; Y41-E95 PolarHBondContact OH-N 2.98Å; Y41-E95 PolarHBondContact OH-O 3.1Å
42	F	98.6	Very high	98.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-72.1	-16.7	179.6	-69.3	-71.5	0	0	0	114	M38 S39 V47 A48 L49 F52 A53 F56 A100	M38-F42 WeakPolarHBondContact O-CD2 3.24Å; M38-F42 PolarHBondContact O-N 3.44Å; S39-F42 PolarHBondContact O-N 3.16Å; F42-V47 HydrophobicContact CD1-CG1 3.6Å; F42-V47 HydrophobicContact CE1-CG1 4.18Å; F42-V47 HydrophobicContact CG-CG1 4.46Å; F42-A48 PolarHBondContact O-N 3.26Å; F42-L49 HydrophobicContact CB-CB 4.46Å; F42-L49 HydrophobicContact CD1-CB 3.95Å; F42-L49 HydrophobicContact CD1-CD1 3.98Å; F42-L49 HydrophobicContact CD1-CG 4.42Å; F42-L49 HydrophobicContact CE1-CD1 4.1Å; F42-L49 PolarHBondContact O-N 2.99Å; F42-L49 VanDerWaalsContact O-N 3.08Å; F42-F52 HydrophobicContact CB-CB 4.02Å; F42-F52 HydrophobicContact CD1-CB 3.82Å; F42-F52 HydrophobicContact CD1-CG 4.28Å; F42-F52 HydrophobicContact CD2-CB 3.9Å; F42-F52 HydrophobicContact CE1-CB 4.3Å; F42-F52 HydrophobicContact CE1-CD1 4.28Å; F42-F52 HydrophobicContact CE1-CG 4.33Å; F42-F52 HydrophobicContact CE2-CB 4.42Å; F42-F52 HydrophobicContact CE2-CD1 4.38Å; F42-F52 HydrophobicContact CG-CB 3.62Å; F42-F52 HydrophobicContact CG-CG 4.49Å; F42-F52 HydrophobicContact CZ-CD1 4.18Å; F42-A53 HydrophobicContact CB-CB 3.86Å; F42-F56 AromaticContact CD2-CD2 3.71Å; F42-F56 HydrophobicContact CD2-CD2 3.71Å; F42-F56 AromaticContact CD2-CE2 3.84Å; F42-F56 HydrophobicContact CD2-CE2 3.84Å; F42-F56 AromaticContact CE2-CD2 3.7Å; F42-F56 HydrophobicContact CE2-CD2 3.7Å; F42-F56 AromaticContact CE2-CE2 3.36Å; F42-F56 HydrophobicContact CE2-CE2 3.36Å; F42-F56 HydrophobicContact CE2-CZ 4.48Å; F42-F56 HydrophobicContact CZ-CE2 4.2Å; F42-A100 HydrophobicContact CE2-CB 3.59Å; F42-A100 HydrophobicContact CZ-CB 3.55Å
43	D	98.6	Very high	98.5	Very high	104 Å²	104	53.1 Å²	53.1	56%	0.556	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-8.6	175	-162.2	52.8	0	0	0	113.7	S39 Y41 A53	S39-D43 PolarHBondContact O-N 2.88Å; Y41-D43 PolarHBondContact O-N 3.45Å; D43-A53 HydrophobicContact CB-CB 4.3Å
44	R	98.8	Very high	98.5	Very high	87 Å²	87	51.7 Å²	51.7	33%	0.328	26%	0.262	S	S	.	.	S	Bend	trans	-63.2	150.2	174.6	-68.8	162.3	50.9	179.1	-3.8	111.5	Y41 D46 V47 A48 D93	Y41-R44 WeakPolarHBondContact O-CB 3.45Å; Y41-R44 WeakPolarHBondContact O-CD 3.4Å; Y41-R44 WeakPolarHBondContact O-CG 3.31Å; Y41-R44 PolarHBondContact O-N 2.9Å; R44-D46 VanDerWaalsContact C-N 3.26Å; R44-D46 WeakPolarHBondContact CB-OD1 3.37Å; R44-D46 IonicContact CZ-OD1 3.29Å; R44-D46 IonicContact CZ-OD2 2.86Å; R44-D46 IonicContact NE-OD1 3.89Å; R44-D46 PolarHBondContact NE-OD1 3.46Å; R44-D46 IonicContact NE-OD2 3.19Å; R44-D46 VanDerWaalsContact NH2-CG 3.32Å; R44-D46 IonicContact NH2-OD1 3.47Å; R44-D46 PolarHBondContact NH2-OD1 3.28Å; R44-D46 IonicContact NH2-OD2 3.39Å; R44-D46 PolarHBondContact NH2-OD2 3.11Å; R44-D46 PolarHBondContact O-N 3Å; R44-V47 HydrophobicContact CB-CG2 4.32Å; R44-V47 PolarHBondContact O-N 3.45Å; R44-A48 WeakPolarHBondContact O-CA 3.45Å; R44-A48 PolarHBondContact O-N 2.85Å; R44-D93 IonicContact NH1-OD2 3.85Å
45	D	98.4	Very high	98.5	Very high	157 Å²	157	52.5 Å²	52.5	84%	0.84	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.2	179.9	64.1	-66.6	0	0	0	113.6
46	D	97.9	Very high	98.5	Very high	106 Å²	106	52.5 Å²	52.5	57%	0.567	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-2.4	177.7	64.9	-19.9	0	0	0	114.3	R44	R44-D46 VanDerWaalsContact C-N 3.26Å; R44-D46 WeakPolarHBondContact CB-OD1 3.37Å; R44-D46 IonicContact CZ-OD1 3.29Å; R44-D46 IonicContact CZ-OD2 2.86Å; R44-D46 IonicContact NE-OD1 3.89Å; R44-D46 PolarHBondContact NE-OD1 3.46Å; R44-D46 IonicContact NE-OD2 3.19Å; R44-D46 VanDerWaalsContact NH2-CG 3.32Å; R44-D46 IonicContact NH2-OD1 3.47Å; R44-D46 PolarHBondContact NH2-OD1 3.28Å; R44-D46 IonicContact NH2-OD2 3.39Å; R44-D46 PolarHBondContact NH2-OD2 3.11Å; R44-D46 PolarHBondContact O-N 3Å
47	V	98.1	Very high	98.5	Very high	32 Å²	32	52.5 Å²	52.5	19%	0.194	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-52.9	173.9	-175.1	0	0	0	0	111	Y41 F42 R44 L49	Y41-V47 HydrophobicContact CD1-CG1 4.38Å; Y41-V47 HydrophobicContact CD2-CG2 4.5Å; Y41-V47 HydrophobicContact CE1-CG1 3.88Å; Y41-V47 HydrophobicContact CE1-CG2 4.01Å; Y41-V47 HydrophobicContact CE2-CG2 3.94Å; F42-V47 HydrophobicContact CD1-CG1 3.6Å; F42-V47 HydrophobicContact CE1-CG1 4.18Å; F42-V47 HydrophobicContact CG-CG1 4.46Å; R44-V47 HydrophobicContact CB-CG2 4.32Å; R44-V47 PolarHBondContact O-N 3.45Å; V47-L49 PolarHBondContact O-N 2.86Å
48	A	97.9	Very high	98.4	Very high	70 Å²	70	55.9 Å²	55.9	58%	0.579	28%	0.277	S	S	*	.			trans	55.1	40	167.8	0	0	0	0	0	117.1	F42 R44	F42-A48 PolarHBondContact O-N 3.26Å; R44-A48 WeakPolarHBondContact O-CA 3.45Å; R44-A48 PolarHBondContact O-N 2.85Å
49	L	98	Very high	98.4	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.079	28%	0.28	C	S	.	.			trans	-105.2	84.2	176.4	-63.9	178	0	0	0	111.2	F42 V47 N51 F52 A53 E168 D172	F42-L49 HydrophobicContact CB-CB 4.46Å; F42-L49 HydrophobicContact CD1-CB 3.95Å; F42-L49 HydrophobicContact CD1-CD1 3.98Å; F42-L49 HydrophobicContact CD1-CG 4.42Å; F42-L49 HydrophobicContact CE1-CD1 4.1Å; F42-L49 PolarHBondContact O-N 2.99Å; F42-L49 VanDerWaalsContact O-N 3.08Å; V47-L49 PolarHBondContact O-N 2.86Å; L49-N51 PolarHBondContact O-N 3.24Å; L49-F52 HydrophobicContact CB-CB 4.02Å; L49-F52 HydrophobicContact CB-CD2 3.93Å; L49-F52 HydrophobicContact CB-CG 4.33Å; L49-F52 HydrophobicContact CD1-CD2 3.93Å; L49-F52 HydrophobicContact CD1-CE2 4.19Å; L49-F52 HydrophobicContact CG-CD2 4.47Å; L49-F52 WeakPolarHBondContact O-CB 3.36Å; L49-F52 PolarHBondContact O-N 2.87Å; L49-A53 PolarHBondContact O-N 3.11Å; L49-E168 HydrophobicContact CD1-CB 4.04Å; L49-D172 HydrophobicContact CD2-CB 4.19Å
50	K	98	Very high	98.4	Very high	149 Å²	149	56.4 Å²	56.4	65%	0.648	28%	0.28	S	S	*	.	H	α-helix	trans	-58.8	-38.6	-169.8	-173.5	-179.4	178.8	-175.2	0	114.7	A53 K54	K50-A53 PolarHBondContact O-N 2.98Å; K50-K54 WeakPolarHBondContact O-CB 3.35Å; K50-K54 PolarHBondContact O-N 3.35Å
51	N	98.4	Very high	98.4	Very high	23 Å²	23	54.7 Å²	54.7	12%	0.123	28%	0.276	C	S	.	.	H	α-helix	trans	-80.5	-28.3	-176.8	-61.1	-27.4	0	0	0	111.4	L49 Y55 D172 L176 G177	L49-N51 PolarHBondContact O-N 3.24Å; N51-Y55 VanDerWaalsContact O-CB 3.23Å; N51-Y55 WeakPolarHBondContact O-CB 3.43Å; N51-Y55 PolarHBondContact O-N 3.28Å; N51-D172 VanDerWaalsContact CA-OD1 3.3Å; N51-D172 WeakPolarHBondContact CA-OD1 3.22Å; N51-D172 VanDerWaalsContact CB-O 3.29Å; N51-D172 WeakPolarHBondContact CB-O 3.44Å; N51-D172 VanDerWaalsContact CB-OD1 3.26Å; N51-D172 WeakPolarHBondContact CB-OD1 3.48Å; N51-D172 PolarHBondContact N-OD1 2.95Å; N51-D172 PolarHBondContact ND2-O 3.11Å; N51-L176 HydrophobicContact CB-CB 3.74Å; N51-G177 VanDerWaalsContact ND2-CA 3.34Å; N51-G177 WeakPolarHBondContact ND2-CA 3.26Å
52	F	98.4	Very high	98.4	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-48.3	163.2	-84.5	-92.3	0	0	0	111.8	F42 L49 K54 Y55 F56 M101 L156 F171 D172 L176	F42-F52 HydrophobicContact CB-CB 4.02Å; F42-F52 HydrophobicContact CD1-CB 3.82Å; F42-F52 HydrophobicContact CD1-CG 4.28Å; F42-F52 HydrophobicContact CD2-CB 3.9Å; F42-F52 HydrophobicContact CE1-CB 4.3Å; F42-F52 HydrophobicContact CE1-CD1 4.28Å; F42-F52 HydrophobicContact CE1-CG 4.33Å; F42-F52 HydrophobicContact CE2-CB 4.42Å; F42-F52 HydrophobicContact CE2-CD1 4.38Å; F42-F52 HydrophobicContact CG-CB 3.62Å; F42-F52 HydrophobicContact CG-CG 4.49Å; F42-F52 HydrophobicContact CZ-CD1 4.18Å; L49-F52 HydrophobicContact CB-CB 4.02Å; L49-F52 HydrophobicContact CB-CD2 3.93Å; L49-F52 HydrophobicContact CB-CG 4.33Å; L49-F52 HydrophobicContact CD1-CD2 3.93Å; L49-F52 HydrophobicContact CD1-CE2 4.19Å; L49-F52 HydrophobicContact CG-CD2 4.47Å; L49-F52 WeakPolarHBondContact O-CB 3.36Å; L49-F52 PolarHBondContact O-N 2.87Å; F52-K54 VanDerWaalsContact C-N 3.3Å; F52-K54 PolarHBondContact O-N 2.78Å; F52-Y55 PolarHBondContact O-N 3.44Å; F52-F56 AromaticContact CD1-CE2 3.91Å; F52-F56 HydrophobicContact CD1-CE2 3.91Å; F52-F56 VanDerWaalsContact O-CD2 3.27Å; F52-F56 WeakPolarHBondContact O-CD2 3.4Å; F52-F56 PolarHBondContact O-N 3.02Å; F52-M101 HydrophobicContact CD1-CE 3.83Å; F52-M101 HydrophobicContact CE1-CE 3.57Å; F52-M101 HydrophobicContact CE1-CG 4.11Å; F52-L156 HydrophobicContact CE1-CD1 4.44Å; F52-L156 HydrophobicContact CZ-CD1 4.21Å; F52-L156 HydrophobicContact CZ-CD2 4.3Å; F52-F171 HydrophobicContact CE1-CD1 4.36Å; F52-F171 HydrophobicContact CE1-CE1 4.37Å; F52-F171 AromaticContact CE2-CD1 3.67Å; F52-F171 HydrophobicContact CE2-CD1 3.67Å; F52-F171 HydrophobicContact CE2-CE1 4.38Å; F52-F171 AromaticContact CZ-CD1 3.4Å; F52-F171 HydrophobicContact CZ-CD1 3.4Å; F52-F171 VanDerWaalsContact CZ-CD1 3.4Å; F52-F171 AromaticContact CZ-CE1 3.82Å; F52-F171 HydrophobicContact CZ-CE1 3.82Å; F52-F171 HydrophobicContact CZ-CG 4.42Å; F52-D172 HydrophobicContact CD2-CB 3.87Å; F52-D172 HydrophobicContact CE2-CB 4.01Å; F52-D172 PolarHBondContact N-OD1 3.29Å; F52-L176 HydrophobicContact CB-CD1 4.21Å; F52-L176 HydrophobicContact CD1-CD1 3.7Å; F52-L176 HydrophobicContact CD2-CD1 3.59Å; F52-L176 HydrophobicContact CE1-CD1 3.92Å; F52-L176 HydrophobicContact CE2-CD1 3.82Å; F52-L176 HydrophobicContact CG-CD1 3.54Å; F52-L176 HydrophobicContact CZ-CD1 3.99Å
53	A	98.6	Very high	98.4	Very high	7 Å²	7	57.1 Å²	57.1	6%	0.058	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-46.1	177.6	0	0	0	0	0	111.4	S39 F42 D43 L49 K50 L57	S39-A53 WeakPolarHBondContact CB-O 3.49Å; S39-A53 WeakPolarHBondContact O-CB 3.45Å; S39-A53 PolarHBondContact OG-O 3.33Å; F42-A53 HydrophobicContact CB-CB 3.86Å; D43-A53 HydrophobicContact CB-CB 4.3Å; L49-A53 PolarHBondContact O-N 3.11Å; K50-A53 PolarHBondContact O-N 2.98Å; A53-L57 WeakPolarHBondContact O-CB 3.38Å; A53-L57 PolarHBondContact O-N 3.32Å
54	K	98.4	Very high	98.4	Very high	78 Å²	78	57.3 Å²	57.3	34%	0.339	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-45.3	176.9	-178.9	178.9	173.2	174.6	0	112.9	K50 F52 L57 H58 D180	K50-K54 WeakPolarHBondContact O-CB 3.35Å; K50-K54 PolarHBondContact O-N 3.35Å; F52-K54 VanDerWaalsContact C-N 3.3Å; F52-K54 PolarHBondContact O-N 2.78Å; K54-L57 PolarHBondContact O-N 3.4Å; K54-H58 PolarHBondContact O-N 2.97Å; K54-D180 IonicContact NZ-OD1 3.38Å; K54-D180 PolarHBondContact NZ-OD1 2.63Å; K54-D180 IonicContact NZ-OD2 3.68Å; K54-D180 PolarHBondContact NZ-OD2 2.88Å
55	Y	98.6	Very high	98.4	Very high	23 Å²	23	59.4 Å²	59.4	9%	0.09	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-53.2	178.6	174.8	-97.3	0	0	0	111	N51 F52 L57 H58 Q59 M101 E148 L149 L176	N51-Y55 VanDerWaalsContact O-CB 3.23Å; N51-Y55 WeakPolarHBondContact O-CB 3.43Å; N51-Y55 PolarHBondContact O-N 3.28Å; F52-Y55 PolarHBondContact O-N 3.44Å; Y55-L57 VanDerWaalsContact C-N 3.31Å; Y55-L57 PolarHBondContact O-N 3.32Å; Y55-H58 WeakPolarHBondContact O-CB 3.47Å; Y55-H58 PolarHBondContact O-N 3.48Å; Y55-H58 VanDerWaalsContact O-N 3.14Å; Y55-Q59 HydrophobicContact CD1-CG 4.39Å; Y55-Q59 HydrophobicContact CE1-CG 4Å; Y55-Q59 HydrophobicContact CE2-CG 4.46Å; Y55-Q59 WeakPolarHBondContact O-CG 3.39Å; Y55-Q59 PolarHBondContact O-N 3.44Å; Y55-M101 HydrophobicContact CD1-CE 3.78Å; Y55-M101 HydrophobicContact CE1-CE 3.74Å; Y55-M101 HydrophobicContact CE1-SD 4.1Å; Y55-E148 VanDerWaalsContact CE2-OE1 3.25Å; Y55-E148 WeakPolarHBondContact CE2-OE1 3.25Å; Y55-E148 PolarHBondContact OH-OE1 3.15Å; Y55-L149 HydrophobicContact CE1-CD2 4.24Å; Y55-L176 HydrophobicContact CD2-CD2 3.91Å; Y55-L176 HydrophobicContact CE2-CD2 4.39Å; Y55-L176 HydrophobicContact CG-CD2 4.07Å
56	F	98.6	Very high	98.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.8	-28.7	179.5	-67.8	-55.3	0	0	0	113	Y35 M38 F42 F52 H58 Q59 S60 A100 M101 A104	Y35-F56 AromaticContact CD1-CD1 3.54Å; Y35-F56 HydrophobicContact CD1-CD1 3.54Å; Y35-F56 HydrophobicContact CD1-CE1 4.2Å; Y35-F56 HydrophobicContact CD1-CG 4.42Å; Y35-F56 AromaticContact CE1-CD1 3.79Å; Y35-F56 HydrophobicContact CE1-CD1 3.79Å; Y35-F56 HydrophobicContact CE1-CE1 4.05Å; M38-F56 HydrophobicContact CB-CB 4.12Å; M38-F56 HydrophobicContact CB-CD1 4.36Å; M38-F56 HydrophobicContact CB-CD2 3.92Å; M38-F56 HydrophobicContact CB-CE2 4.39Å; M38-F56 HydrophobicContact CB-CG 3.89Å; M38-F56 HydrophobicContact SD-CD1 4.1Å; M38-F56 HydrophobicContact SD-CE1 3.96Å; M38-F56 HydrophobicContact SD-CZ 4.29Å; F42-F56 AromaticContact CD2-CD2 3.71Å; F42-F56 HydrophobicContact CD2-CD2 3.71Å; F42-F56 AromaticContact CD2-CE2 3.84Å; F42-F56 HydrophobicContact CD2-CE2 3.84Å; F42-F56 AromaticContact CE2-CD2 3.7Å; F42-F56 HydrophobicContact CE2-CD2 3.7Å; F42-F56 AromaticContact CE2-CE2 3.36Å; F42-F56 HydrophobicContact CE2-CE2 3.36Å; F42-F56 HydrophobicContact CE2-CZ 4.48Å; F42-F56 HydrophobicContact CZ-CE2 4.2Å; F52-F56 AromaticContact CD1-CE2 3.91Å; F52-F56 HydrophobicContact CD1-CE2 3.91Å; F52-F56 VanDerWaalsContact O-CD2 3.27Å; F52-F56 WeakPolarHBondContact O-CD2 3.4Å; F52-F56 PolarHBondContact O-N 3.02Å; F56-H58 VanDerWaalsContact C-N 3.34Å; F56-Q59 PolarHBondContact O-N 3.16Å; F56-S60 WeakPolarHBondContact O-CB 3.39Å; F56-S60 PolarHBondContact O-N 2.89Å; F56-A100 HydrophobicContact CE2-CB 3.99Å; F56-A100 HydrophobicContact CZ-CB 3.97Å; F56-M101 HydrophobicContact CE1-CE 4.38Å; F56-M101 HydrophobicContact CE1-SD 4.17Å; F56-M101 HydrophobicContact CE2-CE 4.34Å; F56-M101 HydrophobicContact CZ-CE 3.83Å; F56-M101 HydrophobicContact CZ-CG 4.23Å; F56-M101 HydrophobicContact CZ-SD 3.8Å; F56-A104 HydrophobicContact CE1-CB 4.1Å
57	L	98.8	Very high	98.5	Very high	56 Å²	56	47.7 Å²	47.7	29%	0.293	23%	0.232	S	C	.	.	H	α-helix	trans	-65	-40.9	171.9	-172.8	59.8	0	0	0	111.4	L36 S39 A53 K54 Y55 S60 H61	L36-L57 HydrophobicContact CD1-CD1 3.95Å; S39-L57 WeakPolarHBondContact OG-CB 3.45Å; A53-L57 WeakPolarHBondContact O-CB 3.38Å; A53-L57 PolarHBondContact O-N 3.32Å; K54-L57 PolarHBondContact O-N 3.4Å; Y55-L57 VanDerWaalsContact C-N 3.31Å; Y55-L57 PolarHBondContact O-N 3.32Å; L57-S60 WeakPolarHBondContact O-CB 3.35Å; L57-S60 PolarHBondContact O-N 3.04Å; L57-H61 PolarHBondContact O-N 3.18Å; L57-H61 VanDerWaalsContact O-N 3.15Å
58	H	98.3	Very high	98.5	Very high	98 Å²	98	49.6 Å²	49.6	45%	0.454	24%	0.239	S	C	.	.	H	α-helix	trans	-62.5	-49.8	175.5	178.3	53.8	0	0	0	111.1	K54 Y55 F56 S60 H61 E62	K54-H58 PolarHBondContact O-N 2.97Å; Y55-H58 WeakPolarHBondContact O-CB 3.47Å; Y55-H58 PolarHBondContact O-N 3.48Å; Y55-H58 VanDerWaalsContact O-N 3.14Å; F56-H58 VanDerWaalsContact C-N 3.34Å; H58-S60 VanDerWaalsContact C-N 3.28Å; H58-S60 PolarHBondContact O-N 2.83Å; H58-H61 WeakPolarHBondContact O-CB 3.46Å; H58-H61 PolarHBondContact O-N 3.11Å; H58-E62 IonicContact CE1-OE1 2.64Å; H58-E62 PolarHBondContact CE1-OE1 3.35Å; H58-E62 IonicContact NE2-OE1 2.83Å; H58-E62 PolarHBondContact NE2-OE1 3.31Å; H58-E62 IonicContact NE2-OE2 3.11Å; H58-E62 PolarHBondContact O-N 3.1Å
59	Q	98.6	Very high	98.5	Very high	13 Å²	13	48.8 Å²	48.8	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-39.6	175.4	-65.1	-58.4	-64.9	0	0	112.1	Y35 Y55 F56 H61 E62 E63	Y35-Q59 HydrophobicContact CD1-CB 4Å; Y35-Q59 HydrophobicContact CD2-CB 3.93Å; Y35-Q59 HydrophobicContact CE1-CB 4.12Å; Y35-Q59 HydrophobicContact CE2-CB 4.06Å; Y35-Q59 HydrophobicContact CG-CB 3.9Å; Y55-Q59 HydrophobicContact CD1-CG 4.39Å; Y55-Q59 HydrophobicContact CE1-CG 4Å; Y55-Q59 HydrophobicContact CE2-CG 4.46Å; Y55-Q59 WeakPolarHBondContact O-CG 3.39Å; Y55-Q59 PolarHBondContact O-N 3.44Å; F56-Q59 PolarHBondContact O-N 3.16Å; Q59-H61 VanDerWaalsContact C-N 3.29Å; Q59-H61 PolarHBondContact O-N 3.46Å; Q59-E62 PolarHBondContact NE2-OE2 3.41Å; Q59-E62 PolarHBondContact O-N 3.33Å; Q59-E63 WeakPolarHBondContact O-CG 3.27Å; Q59-E63 PolarHBondContact O-N 3.05Å
60	S	98.8	Very high	98.6	Very high	4 Å²	4	48 Å²	48	3%	0.028	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-39.5	174.5	-177.7	0	0	0	0	112.9	S32 F56 L57 H58 R64	S32-S60 WeakPolarHBondContact CB-O 3.05Å; S32-S60 WeakPolarHBondContact O-CB 3.31Å; S32-S60 PolarHBondContact O-OG 2.92Å; S32-S60 PolarHBondContact OG-O 3.34Å; S32-S60 PolarHBondContact OG-OG 3.31Å; F56-S60 WeakPolarHBondContact O-CB 3.39Å; F56-S60 PolarHBondContact O-N 2.89Å; L57-S60 WeakPolarHBondContact O-CB 3.35Å; L57-S60 PolarHBondContact O-N 3.04Å; H58-S60 VanDerWaalsContact C-N 3.28Å; H58-S60 PolarHBondContact O-N 2.83Å; S60-R64 PolarHBondContact O-N 3.45Å
61	H	98.7	Very high	98.6	Very high	108 Å²	108	42.6 Å²	42.6	50%	0.5	20%	0.196	S	C	.	.	H	α-helix	trans	-71.9	-41.5	176	-64.7	161.9	0	0	0	112.2	L57 H58 Q59 E63 R64 E65	L57-H61 PolarHBondContact O-N 3.18Å; L57-H61 VanDerWaalsContact O-N 3.15Å; H58-H61 WeakPolarHBondContact O-CB 3.46Å; H58-H61 PolarHBondContact O-N 3.11Å; Q59-H61 VanDerWaalsContact C-N 3.29Å; Q59-H61 PolarHBondContact O-N 3.46Å; H61-E63 PolarHBondContact O-N 3.46Å; H61-R64 WeakPolarHBondContact O-CB 3.48Å; H61-R64 PolarHBondContact O-N 3.11Å; H61-R64 VanDerWaalsContact O-N 3.12Å; H61-E65 PolarHBondContact O-N 3.2Å
62	E	98	Very high	98.6	Very high	67 Å²	67	47.8 Å²	47.8	31%	0.313	22%	0.217	S	C	.	.	H	α-helix	trans	-59.6	-45.8	176.3	-67.4	-168.3	137.6	0	0	111.3	H58 Q59 R64 E65 H66	H58-E62 IonicContact CE1-OE1 2.64Å; H58-E62 PolarHBondContact CE1-OE1 3.35Å; H58-E62 IonicContact NE2-OE1 2.83Å; H58-E62 PolarHBondContact NE2-OE1 3.31Å; H58-E62 IonicContact NE2-OE2 3.11Å; H58-E62 PolarHBondContact O-N 3.1Å; Q59-E62 PolarHBondContact NE2-OE2 3.41Å; Q59-E62 PolarHBondContact O-N 3.33Å; E62-R64 PolarHBondContact O-N 3.04Å; E62-E65 CarbonylContact O-C 3.58Å; E62-E65 WeakPolarHBondContact O-CA 3.44Å; E62-E65 WeakPolarHBondContact O-CB 3.4Å; E62-E65 PolarHBondContact O-N 3.45Å; E62-H66 PolarHBondContact O-CD2 3.07Å; E62-H66 PolarHBondContact O-N 3.09Å
63	E	98.6	Very high	98.7	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-31.5	175.7	-69.8	-48.2	140.5	0	0	113.2	A31 Y35 Q59 H61 E65 H66 A67	A31-E63 HydrophobicContact CB-CB 4.4Å; A31-E63 HydrophobicContact CB-CG 3.99Å; Y35-E63 HydrophobicContact CD2-CG 3.84Å; Y35-E63 HydrophobicContact CE2-CG 3.88Å; Q59-E63 WeakPolarHBondContact O-CG 3.27Å; Q59-E63 PolarHBondContact O-N 3.05Å; H61-E63 PolarHBondContact O-N 3.46Å; E63-E65 VanDerWaalsContact C-N 3.34Å; E63-H66 WeakPolarHBondContact O-CB 3.49Å; E63-H66 PolarHBondContact O-N 3.31Å; E63-H66 IonicContact OE1-CE1 3.98Å; E63-H66 IonicContact OE1-ND1 3.69Å; E63-H66 PolarHBondContact OE1-ND1 3.06Å; E63-H66 IonicContact OE2-CE1 3.54Å; E63-H66 IonicContact OE2-CG 3.15Å; E63-H66 IonicContact OE2-ND1 3.29Å; E63-H66 PolarHBondContact OE2-ND1 3.41Å; E63-A67 PolarHBondContact O-N 2.88Å
64	R	98.8	Very high	98.7	Very high	108 Å²	108	47.5 Å²	47.5	41%	0.408	21%	0.214	S	C	.	.	H	α-helix	trans	-66.1	-40.4	172.2	-179.7	58.4	-178.4	-147.8	-1.8	111.2	S60 H61 E62 H66 A67 E68	S60-R64 PolarHBondContact O-N 3.45Å; H61-R64 WeakPolarHBondContact O-CB 3.48Å; H61-R64 PolarHBondContact O-N 3.11Å; H61-R64 VanDerWaalsContact O-N 3.12Å; E62-R64 PolarHBondContact O-N 3.04Å; R64-H66 VanDerWaalsContact C-N 3.35Å; R64-A67 WeakPolarHBondContact O-CB 3.4Å; R64-A67 PolarHBondContact O-N 3.08Å; R64-E68 IonicContact CZ-OE1 2.99Å; R64-E68 IonicContact NE-OE1 3.81Å; R64-E68 PolarHBondContact NE-OE1 3.31Å; R64-E68 IonicContact NH2-OE1 2.82Å; R64-E68 WeakPolarHBondContact O-CG 3.47Å; R64-E68 PolarHBondContact O-N 3.35Å; R64-E68 VanDerWaalsContact O-N 3.07Å
65	E	98.7	Very high	98.7	Very high	131 Å²	131	48.2 Å²	48.2	61%	0.612	22%	0.222	S	C	*	.	H	α-helix	trans	-65.1	-37.7	174.7	-67.5	-171.6	178.9	0	0	111.9	H61 E62 E63 E68 K69	H61-E65 PolarHBondContact O-N 3.2Å; E62-E65 CarbonylContact O-C 3.58Å; E62-E65 WeakPolarHBondContact O-CA 3.44Å; E62-E65 WeakPolarHBondContact O-CB 3.4Å; E62-E65 PolarHBondContact O-N 3.45Å; E63-E65 VanDerWaalsContact C-N 3.34Å; E65-E68 PolarHBondContact O-N 2.95Å; E65-K69 VanDerWaalsContact O-CB 3.27Å; E65-K69 WeakPolarHBondContact O-CB 3.49Å; E65-K69 PolarHBondContact O-N 3.17Å
66	H	98.8	Very high	98.7	Very high	16 Å²	16	53.2 Å²	53.2	7%	0.074	25%	0.246	C	C	.	.	H	α-helix	trans	-57.4	-49.9	171.9	-64.2	164.6	0	0	0	111.4	E28 E62 E63 R64 E68 K69 L70 Y138 E141	E28-H66 HydrophobicContact CB-CB 4.32Å; E28-H66 HydrophobicContact CG-CB 4.02Å; E62-H66 PolarHBondContact O-CD2 3.07Å; E62-H66 PolarHBondContact O-N 3.09Å; E63-H66 WeakPolarHBondContact O-CB 3.49Å; E63-H66 PolarHBondContact O-N 3.31Å; E63-H66 IonicContact OE1-CE1 3.98Å; E63-H66 IonicContact OE1-ND1 3.69Å; E63-H66 PolarHBondContact OE1-ND1 3.06Å; E63-H66 IonicContact OE2-CE1 3.54Å; E63-H66 IonicContact OE2-CG 3.15Å; E63-H66 IonicContact OE2-ND1 3.29Å; E63-H66 PolarHBondContact OE2-ND1 3.41Å; R64-H66 VanDerWaalsContact C-N 3.35Å; H66-E68 VanDerWaalsContact C-N 3.32Å; H66-E68 PolarHBondContact O-N 3.39Å; H66-K69 WeakPolarHBondContact O-CB 3.29Å; H66-K69 PolarHBondContact O-N 3.28Å; H66-L70 PolarHBondContact O-N 3.05Å; H66-Y138 HydrophobicContact CB-CE1 4.02Å; H66-Y138 PolarHBondContact O-OH 2.99Å; H66-E141 IonicContact CD2-OE2 2.88Å; H66-E141 IonicContact CE1-OE2 3.66Å; H66-E141 IonicContact NE2-OE2 3.59Å; H66-E141 PolarHBondContact NE2-OE2 2.92Å; H66-E141 VanDerWaalsContact NE2-OE2 3.15Å
67	A	98.9	Very high	98.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.6	-45.7	176.3	0	0	0	0	0	112.2	E28 L29 E63 R64 L70 M71	E28-A67 HydrophobicContact CB-CB 3.8Å; L29-A67 HydrophobicContact CD2-CB 3.7Å; L29-A67 HydrophobicContact CG-CB 3.75Å; E63-A67 PolarHBondContact O-N 2.88Å; R64-A67 WeakPolarHBondContact O-CB 3.4Å; R64-A67 PolarHBondContact O-N 3.08Å; A67-L70 PolarHBondContact O-N 3.29Å; A67-M71 WeakPolarHBondContact O-CG 3.49Å; A67-M71 PolarHBondContact O-N 3.31Å
68	E	98.8	Very high	98.7	Very high	73 Å²	73	51.9 Å²	51.9	34%	0.341	24%	0.238	S	C	.	.	H	α-helix	trans	-68.7	-34.5	-179.4	-70.8	-179.8	-171.2	0	0	112.6	R64 E65 H66 M71 K72	R64-E68 IonicContact CZ-OE1 2.99Å; R64-E68 IonicContact NE-OE1 3.81Å; R64-E68 PolarHBondContact NE-OE1 3.31Å; R64-E68 IonicContact NH2-OE1 2.82Å; R64-E68 WeakPolarHBondContact O-CG 3.47Å; R64-E68 PolarHBondContact O-N 3.35Å; R64-E68 VanDerWaalsContact O-N 3.07Å; E65-E68 PolarHBondContact O-N 2.95Å; H66-E68 VanDerWaalsContact C-N 3.32Å; H66-E68 PolarHBondContact O-N 3.39Å; E68-M71 PolarHBondContact O-N 3.42Å; E68-K72 VanDerWaalsContact O-CG 3.31Å; E68-K72 WeakPolarHBondContact O-CG 3.46Å; E68-K72 PolarHBondContact O-N 3.33Å
69	K	98.8	Very high	98.7	Very high	52 Å²	52	47.2 Å²	47.2	23%	0.226	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-41.7	174	-168.3	-169.5	-62.4	163.6	0	110.4	E65 H66 K72 L73 F133 H137 Y138 E141	E65-K69 VanDerWaalsContact O-CB 3.27Å; E65-K69 WeakPolarHBondContact O-CB 3.49Å; E65-K69 PolarHBondContact O-N 3.17Å; H66-K69 WeakPolarHBondContact O-CB 3.29Å; H66-K69 PolarHBondContact O-N 3.28Å; K69-K72 PolarHBondContact O-N 3.22Å; K69-L73 PolarHBondContact O-N 2.87Å; K69-F133 HydrophobicContact CD-CZ 4.45Å; K69-F133 HydrophobicContact CG-CZ 4.03Å; K69-H137 HydrophobicContact CD-CB 3.84Å; K69-Y138 WeakPolarHBondContact CB-OH 3.35Å; K69-Y138 HydrophobicContact CD-CE2 4.07Å; K69-Y138 WeakPolarHBondContact CD-OH 3.32Å; K69-Y138 WeakPolarHBondContact CG-OH 3.21Å; K69-E141 IonicContact NZ-OE2 2.7Å
70	L	98.9	Very high	98.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-41.1	172.1	-67.8	171.4	0	0	0	113	I21 Q24 I25 E28 H66 A67 K72 L73 Q74 F133 Y138	I21-L70 HydrophobicContact CD1-CD2 3.82Å; Q24-L70 HydrophobicContact CB-CD1 3.89Å; Q24-L70 HydrophobicContact CG-CD1 3.48Å; Q24-L70 VanDerWaalsContact CG-CD1 3.48Å; I25-L70 HydrophobicContact CD1-CB 4.13Å; I25-L70 HydrophobicContact CG1-CB 3.45Å; I25-L70 VanDerWaalsContact CG1-CB 3.45Å; I25-L70 HydrophobicContact CG1-CD1 4.12Å; I25-L70 HydrophobicContact CG1-CG 4.43Å; E28-L70 HydrophobicContact CG-CD1 3.73Å; H66-L70 PolarHBondContact O-N 3.05Å; A67-L70 PolarHBondContact O-N 3.29Å; L70-K72 VanDerWaalsContact C-N 3.3Å; L70-K72 PolarHBondContact O-N 3.04Å; L70-L73 WeakPolarHBondContact O-CB 3.33Å; L70-L73 PolarHBondContact O-N 2.88Å; L70-Q74 WeakPolarHBondContact O-CB 3.39Å; L70-Q74 PolarHBondContact O-N 2.95Å; L70-F133 HydrophobicContact CD2-CE1 4.06Å; L70-Y138 HydrophobicContact CD1-CE1 4.27Å; L70-Y138 HydrophobicContact CD2-CE1 4.1Å; L70-Y138 HydrophobicContact CD2-CE2 4.22Å; L70-Y138 WeakPolarHBondContact CD2-OH 3.44Å; L70-Y138 HydrophobicContact CG-CE1 3.96Å; L70-Y138 VanDerWaalsContact CG-OH 3.27Å; L70-Y138 WeakPolarHBondContact CG-OH 3.48Å; L70-Y138 PolarHBondContact N-OH 3.46Å
71	M	98.9	Very high	98.7	Very high	35 Å²	35	54.6 Å²	54.6	17%	0.172	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-40.7	175.2	-70.9	-178.6	-163.4	0	0	111.6	I25 L29 A67 E68 Q74 N75 I81 L83	I25-M71 HydrophobicContact CD1-CG 3.83Å; I25-M71 HydrophobicContact CG1-CG 4.16Å; I25-M71 HydrophobicContact CG2-CE 3.44Å; I25-M71 VanDerWaalsContact CG2-CE 3.44Å; I25-M71 HydrophobicContact CG2-CG 4.03Å; L29-M71 HydrophobicContact CD1-CE 3.96Å; A67-M71 WeakPolarHBondContact O-CG 3.49Å; A67-M71 PolarHBondContact O-N 3.31Å; E68-M71 PolarHBondContact O-N 3.42Å; M71-Q74 PolarHBondContact O-N 3.37Å; M71-N75 PolarHBondContact O-N 3.04Å; M71-N75 PolarHBondContact O-ND2 3.49Å; M71-I81 HydrophobicContact CB-CD1 3.7Å; M71-I81 HydrophobicContact CG-CD1 3.94Å; M71-L83 HydrophobicContact CE-CD2 3.83Å
72	K	98.8	Very high	98.7	Very high	132 Å²	132	55.6 Å²	55.6	57%	0.574	25%	0.25	S	C	*	.	H	α-helix	trans	-62.3	-47.7	174.3	-71.2	168.4	-170.3	169.3	0	110.9	E68 K69 L70 Q74 N75 Q76	E68-K72 VanDerWaalsContact O-CG 3.31Å; E68-K72 WeakPolarHBondContact O-CG 3.46Å; E68-K72 PolarHBondContact O-N 3.33Å; K69-K72 PolarHBondContact O-N 3.22Å; L70-K72 VanDerWaalsContact C-N 3.3Å; L70-K72 PolarHBondContact O-N 3.04Å; K72-Q74 PolarHBondContact O-N 3.3Å; K72-N75 PolarHBondContact O-N 3.03Å; K72-Q76 VanDerWaalsContact O-CG 3.31Å; K72-Q76 WeakPolarHBondContact O-CG 3.48Å; K72-Q76 PolarHBondContact O-N 2.91Å
73	L	98.8	Very high	98.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-57	-47.3	175.7	177.8	70.8	0	0	0	111.9	I21 K69 L70 N75 Q76 R77 L130 F133	I21-L73 HydrophobicContact CD1-CD2 3.99Å; K69-L73 PolarHBondContact O-N 2.87Å; L70-L73 WeakPolarHBondContact O-CB 3.33Å; L70-L73 PolarHBondContact O-N 2.88Å; L73-N75 VanDerWaalsContact C-N 3.27Å; L73-N75 PolarHBondContact O-N 3.28Å; L73-Q76 WeakPolarHBondContact O-CB 3.3Å; L73-Q76 PolarHBondContact O-N 3.29Å; L73-Q76 VanDerWaalsContact O-N 3.11Å; L73-R77 HydrophobicContact CD1-CG 3.97Å; L73-R77 HydrophobicContact CG-CG 4.34Å; L73-R77 WeakPolarHBondContact O-CG 3.25Å; L73-R77 PolarHBondContact O-N 3.22Å; L73-L130 HydrophobicContact CD2-CD1 3.6Å; L73-F133 HydrophobicContact CB-CE1 4.04Å; L73-F133 HydrophobicContact CB-CE2 4.07Å; L73-F133 HydrophobicContact CB-CZ 3.68Å; L73-F133 HydrophobicContact CD1-CD1 4.32Å; L73-F133 HydrophobicContact CD1-CD2 3.85Å; L73-F133 HydrophobicContact CD1-CE1 4.44Å; L73-F133 HydrophobicContact CD1-CE2 4Å; L73-F133 HydrophobicContact CD1-CG 4Å; L73-F133 HydrophobicContact CD1-CZ 4.28Å; L73-F133 HydrophobicContact CD2-CD1 3.35Å; L73-F133 HydrophobicContact CD2-CD2 4.38Å; L73-F133 HydrophobicContact CD2-CE1 3.32Å; L73-F133 HydrophobicContact CD2-CE2 4.36Å; L73-F133 HydrophobicContact CD2-CG 3.89Å; L73-F133 HydrophobicContact CD2-CZ 3.85Å; L73-F133 HydrophobicContact CG-CD1 4.28Å; L73-F133 HydrophobicContact CG-CE1 4.09Å; L73-F133 HydrophobicContact CG-CE2 4.34Å; L73-F133 HydrophobicContact CG-CG 4.47Å; L73-F133 HydrophobicContact CG-CZ 4.11Å
74	Q	98.8	Very high	98.7	Very high	0 Å²	0	64 Å²	64	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-53.9	-46.3	-179.7	-174.9	73.8	-62.9	0	0	111	Y13 E18 I21 N22 L70 M71 K72 G78 G79 I81	Y13-Q74 VanDerWaalsContact CE1-OE1 3.3Å; Y13-Q74 PolarHBondContact OH-OE1 3.3Å; E18-Q74 PolarHBondContact O-NE2 2.85Å; I21-Q74 HydrophobicContact CG2-CB 3.97Å; I21-Q74 HydrophobicContact CG2-CG 4.34Å; N22-Q74 PolarHBondContact ND2-NE2 2.89Å; N22-Q74 PolarHBondContact OD1-NE2 3Å; L70-Q74 WeakPolarHBondContact O-CB 3.39Å; L70-Q74 PolarHBondContact O-N 2.95Å; M71-Q74 PolarHBondContact O-N 3.37Å; K72-Q74 PolarHBondContact O-N 3.3Å; Q74-G78 PolarHBondContact O-N 3.03Å; Q74-G79 WeakPolarHBondContact O-CA 3.33Å; Q74-G79 PolarHBondContact O-N 3.18Å; Q74-I81 HydrophobicContact CB-CG1 4.03Å; Q74-I81 HydrophobicContact CG-CG1 3.7Å
75	N	98.8	Very high	98.7	Very high	94 Å²	94	64.7 Å²	64.7	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-69.7	-40.8	177.7	-71.9	-31.9	0	0	0	112.5	M71 K72 L73 R77 G78	M71-N75 PolarHBondContact O-N 3.04Å; M71-N75 PolarHBondContact O-ND2 3.49Å; K72-N75 PolarHBondContact O-N 3.03Å; L73-N75 VanDerWaalsContact C-N 3.27Å; L73-N75 PolarHBondContact O-N 3.28Å; N75-R77 VanDerWaalsContact C-N 3.28Å; N75-R77 PolarHBondContact O-N 3.11Å; N75-G78 PolarHBondContact O-N 3.01Å
76	Q	98.8	Very high	98.7	Very high	128 Å²	128	61.8 Å²	61.8	60%	0.598	29%	0.292	S	S	*	.	H	α-helix	trans	-57.6	-40.6	176.9	-75.5	172.4	-6.6	0	0	112.1	K72 L73 G78	K72-Q76 VanDerWaalsContact O-CG 3.31Å; K72-Q76 WeakPolarHBondContact O-CG 3.48Å; K72-Q76 PolarHBondContact O-N 2.91Å; L73-Q76 WeakPolarHBondContact O-CB 3.3Å; L73-Q76 PolarHBondContact O-N 3.29Å; L73-Q76 VanDerWaalsContact O-N 3.11Å; Q76-G78 PolarHBondContact O-N 3.45Å
77	R	98.6	Very high	98.7	Very high	25 Å²	25	67.4 Å²	67.4	9%	0.094	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	2.5	179.7	-58.4	-59.1	-59.2	-74.3	-2.7	113.6	Q11 N12 Y13 L73 N75 G79 D127	Q11-R77 PolarHBondContact O-NH2 2.9Å; Q11-R77 VanDerWaalsContact O-NH2 3.1Å; N12-R77 PolarHBondContact O-NH2 3.36Å; Y13-R77 HydrophobicContact CD1-CB 3.66Å; Y13-R77 HydrophobicContact CD2-CB 3.99Å; Y13-R77 HydrophobicContact CD2-CG 4.32Å; Y13-R77 HydrophobicContact CE1-CB 3.8Å; Y13-R77 HydrophobicContact CE2-CB 4.14Å; Y13-R77 HydrophobicContact CE2-CG 4.34Å; Y13-R77 HydrophobicContact CG-CB 3.76Å; L73-R77 HydrophobicContact CD1-CG 3.97Å; L73-R77 HydrophobicContact CG-CG 4.34Å; L73-R77 WeakPolarHBondContact O-CG 3.25Å; L73-R77 PolarHBondContact O-N 3.22Å; N75-R77 VanDerWaalsContact C-N 3.28Å; N75-R77 PolarHBondContact O-N 3.11Å; R77-G79 VanDerWaalsContact C-N 3.31Å; R77-D127 IonicContact CZ-OD1 2.78Å; R77-D127 IonicContact CZ-OD2 3.28Å; R77-D127 IonicContact NH1-OD1 3.73Å; R77-D127 PolarHBondContact NH1-OD1 2.89Å; R77-D127 VanDerWaalsContact NH1-OD1 3.15Å; R77-D127 IonicContact NH1-OD2 2.77Å; R77-D127 PolarHBondContact NH1-OD2 3.4Å; R77-D127 IonicContact NH2-OD1 3.37Å; R77-D127 PolarHBondContact NH2-OD1 2.96Å; R77-D127 IonicContact NH2-OD2 3.01Å; R77-D127 PolarHBondContact NH2-OD2 3.1Å
78	G	98.6	Very high	98.6	Very high	3 Å²	3	73.4 Å²	73.4	3%	0.031	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	18.5	-179.8	0	0	0	0	0	114.3	S7 Q74 N75 Q76 R80	S7-G78 VanDerWaalsContact CB-O 3.25Å; S7-G78 WeakPolarHBondContact CB-O 3.35Å; Q74-G78 PolarHBondContact O-N 3.03Å; N75-G78 PolarHBondContact O-N 3.01Å; Q76-G78 PolarHBondContact O-N 3.45Å; G78-R80 PolarHBondContact O-NH1 3Å; G78-R80 VanDerWaalsContact O-NH1 3.15Å
79	G	98.5	Very high	98.6	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.327	C	S	.	.			trans	-73.5	179.7	169.3	0	0	0	0	0	112.7	E18 Q74 R77	E18-G79 WeakPolarHBondContact OE1-CA 3.47Å; Q74-G79 WeakPolarHBondContact O-CA 3.33Å; Q74-G79 PolarHBondContact O-N 3.18Å; R77-G79 VanDerWaalsContact C-N 3.31Å
80	R	98.6	Very high	98.2	Very high	121 Å²	121	73.5 Å²	73.5	46%	0.457	35%	0.348	S	S	.	.			trans	-127.7	129.6	176.5	-64.4	-64.4	178.4	-86.8	-0.1	109.3	E18 N22 G78 F82	E18-R80 PolarHBondContact OE1-N 2.82Å; N22-R80 PolarHBondContact ND2-O 3.13Å; N22-R80 PolarHBondContact OD1-O 3.37Å; G78-R80 PolarHBondContact O-NH1 3Å; G78-R80 VanDerWaalsContact O-NH1 3.15Å; R80-F82 HydrophobicContact CB-CD2 4.31Å; R80-F82 HydrophobicContact CB-CE2 3.58Å; R80-F82 HydrophobicContact CB-CZ 3.89Å; R80-F82 WeakPolarHBondContact O-CD2 3.11Å
81	I	98.8	Very high	97.8	Very high	51 Å²	51	80 Å²	80	26%	0.262	37%	0.373	S	S	.	.			trans	-79.3	125.9	176.9	-59.8	164	0	0	0	108.5	N22 M71 Q74 L83	N22-I81 WeakPolarHBondContact OD1-CA 3.36Å; M71-I81 HydrophobicContact CB-CD1 3.7Å; M71-I81 HydrophobicContact CG-CD1 3.94Å; Q74-I81 HydrophobicContact CB-CG1 4.03Å; Q74-I81 HydrophobicContact CG-CG1 3.7Å; I81-L83 HydrophobicContact CG2-CD2 3.66Å; I81-L83 HydrophobicContact CG2-CG 3.97Å
82	F	98.3	Very high	97.5	Very high	128 Å²	128	83.8 Å²	83.8	56%	0.561	39%	0.394	S	S	*	.			trans	-122.2	88	173.3	-64.9	-78.6	0	0	0	109	N22 R80 Q84	N22-F82 PolarHBondContact OD1-N 2.9Å; R80-F82 HydrophobicContact CB-CD2 4.31Å; R80-F82 HydrophobicContact CB-CE2 3.58Å; R80-F82 HydrophobicContact CB-CZ 3.89Å; R80-F82 WeakPolarHBondContact O-CD2 3.11Å; F82-Q84 PolarHBondContact O-NE2 2.99Å
83	L	98.5	Very high	97.4	Very high	115 Å²	115	81.4 Å²	81.4	60%	0.602	39%	0.388	S	S	*	.			trans	-62	145.4	179.6	-60.5	179.1	0	0	0	111.1	I25 M71 I81	I25-L83 HydrophobicContact CG2-CD2 4.28Å; M71-L83 HydrophobicContact CE-CD2 3.83Å; I81-L83 HydrophobicContact CG2-CD2 3.66Å; I81-L83 HydrophobicContact CG2-CG 3.97Å
84	Q	98.5	Very high	97.3	Very high	131 Å²	131	81.8 Å²	81.8	61%	0.612	39%	0.389	S	S	*	.			trans	-123.1	168.5	176	-58.7	-57.6	-54.8	0	0	109.5	N26 F82 I86	N26-Q84 PolarHBondContact ND2-O 2.85Å; F82-Q84 PolarHBondContact O-NE2 2.99Å; Q84-I86 PolarHBondContact O-N 3.06Å
85	D	98.7	Very high	97.3	Very high	123 Å²	123	88.7 Å²	88.7	66%	0.658	42%	0.421	S	S	*	.			trans	-53.7	133	172.1	-63.7	-9.7	0	0	0	110.5	N26	N26-D85 PolarHBondContact ND2-O 2.7Å
86	I	98.8	Very high	97.3	Very high	70 Å²	70	84.8 Å²	84.8	36%	0.359	40%	0.401	S	S	.	.			trans	-85.2	115	167.2	-54.5	167.5	0	0	0	105.7	L29 Y33 Q84	L29-I86 HydrophobicContact CB-CD1 3.84Å; L29-I86 HydrophobicContact CB-CG1 4.03Å; L29-I86 HydrophobicContact CD1-CD1 4.2Å; L29-I86 HydrophobicContact CD1-CG1 4.48Å; L29-I86 HydrophobicContact CG-CD1 4.43Å; Y33-I86 HydrophobicContact CD1-CG2 3.84Å; Y33-I86 HydrophobicContact CG-CG2 4.36Å; Q84-I86 PolarHBondContact O-N 3.06Å
87	K	98.3	Very high	97.2	Very high	135 Å²	135	78.7 Å²	78.7	59%	0.587	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-65.7	145.2	178.1	-65.2	-60.5	-179.6	-169.2	0	109.5	Y30	Y30-K87 HydrophobicContact CD2-CB 4.32Å; Y30-K87 WeakPolarHBondContact CD2-O 3.39Å; Y30-K87 HydrophobicContact CE2-CB 4.37Å
88	K	98.2	Very high	97.2	Very high	126 Å²	126	78.2 Å²	78.2	55%	0.548	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-64.1	153.4	170	70.1	163.3	-161.1	152.8	0	109.7	D92	K88-D92 IonicContact NZ-OD2 2.96Å
89	P	97.7	Very high	97.2	Very high	5 Å²	5	80.1 Å²	80.1	3%	0.032	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-56	153.7	169.9	-25.2	37	0	0	0	111.9	V34 Y91 W94	V34-P89 HydrophobicContact CB-CG 4.47Å; V34-P89 HydrophobicContact CG2-CB 4.05Å; V34-P89 HydrophobicContact CG2-CG 3.99Å; P89-Y91 PolarHBondContact O-N 3.43Å; P89-W94 HydrophobicContact CB-CH2 4.31Å; P89-W94 HydrophobicContact CB-CZ2 4.02Å
90	D	90.8	Very high	97.2	Very high	122 Å²	122	80.1 Å²	80.1	65%	0.652	38%	0.382	S	S	*	.	S	Bend	trans	-67.4	-23.7	-179.6	-66.6	-39.3	0	0	0	112.8
91	Y	89.3	Confident	97.2	Very high	137 Å²	137	74.3 Å²	74.3	54%	0.537	36%	0.36	S	S	.	.			trans	-130	143.4	-178.1	-47.9	-77.7	0	0	0	111.2	P89 W94	P89-Y91 PolarHBondContact O-N 3.43Å; Y91-W94 HydrophobicContact CD2-CH2 4.48Å; Y91-W94 HydrophobicContact CD2-CZ3 4.08Å
92	D	93	Very high	97.2	Very high	114 Å²	114	74.9 Å²	74.9	61%	0.61	36%	0.361	S	S	*	.	S	Bend	trans	-101.7	-21.1	171.4	-60.4	-65.4	0	0	0	111.3	K88	K88-D92 IonicContact NZ-OD2 2.96Å
93	D	96.6	Very high	97.2	Very high	82 Å²	82	70.3 Å²	70.3	44%	0.439	35%	0.345	S	S	.	.			trans	-112.8	123.8	173.5	-164.9	-33.2	0	0	0	108.8	Y41 R44 E95	Y41-D93 WeakPolarHBondContact CE2-OD1 3.49Å; R44-D93 IonicContact NH1-OD2 3.85Å; D93-E95 PolarHBondContact OD1-N 3.49Å
94	W	98.1	Very high	97.2	Very high	7 Å²	7	64.8 Å²	64.8	3%	0.027	32%	0.316	C	S	.	.			trans	-99.4	3	-176.6	-61.8	94.2	0	0	0	113.3	V34 S37 M38 Y41 P89 Y91 S96 N99 A100 C103	V34-W94 HydrophobicContact CG1-CH2 3.72Å; V34-W94 HydrophobicContact CG1-CZ2 4.12Å; S37-W94 PolarHBondContact OG-NE1 3.19Å; M38-W94 HydrophobicContact CE-CD2 4.25Å; M38-W94 HydrophobicContact CE-CE3 3.67Å; M38-W94 HydrophobicContact CE-CH2 3.64Å; M38-W94 HydrophobicContact CE-CZ2 4.2Å; M38-W94 HydrophobicContact CE-CZ3 3.34Å; M38-W94 HydrophobicContact CG-CD2 3.63Å; M38-W94 VanDerWaalsContact CG-CE2 3.49Å; M38-W94 HydrophobicContact CG-CE3 4.04Å; M38-W94 HydrophobicContact CG-CG 4.11Å; M38-W94 HydrophobicContact CG-CH2 4.2Å; M38-W94 HydrophobicContact CG-CZ2 3.79Å; M38-W94 HydrophobicContact CG-CZ3 4.31Å; Y41-W94 VanDerWaalsContact CB-CD1 3.48Å; Y41-W94 HydrophobicContact CD1-CB 3.78Å; Y41-W94 HydrophobicContact CD1-CG 4.42Å; Y41-W94 HydrophobicContact CD2-CB 4.3Å; Y41-W94 HydrophobicContact CE1-CB 4Å; Y41-W94 HydrophobicContact CG-CB 3.96Å; Y41-W94 AromaticContact CG-CD1 3.72Å; Y41-W94 HydrophobicContact CG-CG 4.25Å; P89-W94 HydrophobicContact CB-CH2 4.31Å; P89-W94 HydrophobicContact CB-CZ2 4.02Å; Y91-W94 HydrophobicContact CD2-CH2 4.48Å; Y91-W94 HydrophobicContact CD2-CZ3 4.08Å; W94-S96 PolarHBondContact O-N 3.45Å; W94-N99 WeakPolarHBondContact O-CB 3.37Å; W94-N99 PolarHBondContact O-ND2 3.32Å; W94-A100 HydrophobicContact CB-CB 4.31Å; W94-C103 HydrophobicContact CE3-CB 4.29Å; W94-C103 HydrophobicContact CZ3-CB 3.92Å
95	E	97.8	Very high	97.2	Very high	145 Å²	145	59.8 Å²	59.8	68%	0.678	29%	0.293	S	S	*	.			trans	65.5	-54.1	173.2	-51.4	-179	171.3	0	0	115.7	Y41 D93 N99	Y41-E95 WeakPolarHBondContact OH-CA 3.47Å; Y41-E95 PolarHBondContact OH-N 2.98Å; Y41-E95 PolarHBondContact OH-O 3.1Å; D93-E95 PolarHBondContact OD1-N 3.49Å; E95-N99 HydrophobicContact CB-CB 4.44Å
96	S	98.2	Very high	97.2	Very high	12 Å²	12	59.3 Å²	59.3	8%	0.084	29%	0.287	C	S	.	.	S	Bend	trans	-158.5	165.4	-175.5	60.8	0	0	0	0	112.6	W94 L98 N99 A100 E168	W94-S96 PolarHBondContact O-N 3.45Å; S96-L98 VanDerWaalsContact C-N 3.3Å; S96-L98 PolarHBondContact O-N 3.31Å; S96-N99 PolarHBondContact O-N 3.41Å; S96-N99 WeakPolarHBondContact OG-CB 3.49Å; S96-N99 PolarHBondContact OG-N 2.99Å; S96-N99 VanDerWaalsContact OG-N 3.16Å; S96-A100 WeakPolarHBondContact O-CB 3.39Å; S96-A100 PolarHBondContact O-N 3.47Å; S96-E168 WeakPolarHBondContact CB-OE1 3.45Å
97	G	97.9	Very high	97.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.3	-42.8	170.8	0	0	0	0	0	112.6	M101 E168	G97-M101 WeakPolarHBondContact O-CB 3.43Å; G97-M101 VanDerWaalsContact O-CG 3.25Å; G97-M101 WeakPolarHBondContact O-CG 3.36Å; G97-M101 PolarHBondContact O-N 3.19Å; G97-M101 VanDerWaalsContact O-N 3.08Å; G97-E168 VanDerWaalsContact CA-OE1 3.29Å; G97-E168 WeakPolarHBondContact CA-OE1 3.48Å; G97-E168 VanDerWaalsContact N-CD 3.28Å; G97-E168 PolarHBondContact N-OE1 3.14Å; G97-E168 PolarHBondContact N-OE2 3.05Å
98	L	98.5	Very high	97.2	Very high	16 Å²	16	50.2 Å²	50.2	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-50.1	176.7	176.9	59.4	0	0	0	112.1	S96 A100 M101 E102 V153 L156 R157 A161 E168	S96-L98 VanDerWaalsContact C-N 3.3Å; S96-L98 PolarHBondContact O-N 3.31Å; L98-A100 PolarHBondContact O-N 2.97Å; L98-M101 PolarHBondContact O-N 2.98Å; L98-E102 HydrophobicContact CD1-CG 4.17Å; L98-E102 WeakPolarHBondContact CD1-OE1 3.47Å; L98-E102 WeakPolarHBondContact O-CG 3.46Å; L98-E102 PolarHBondContact O-N 2.72Å; L98-V153 HydrophobicContact CD1-CG1 4.11Å; L98-L156 HydrophobicContact CB-CB 4.37Å; L98-L156 HydrophobicContact CD1-CB 3.87Å; L98-R157 HydrophobicContact CD1-CG 3.76Å; L98-R157 HydrophobicContact CD2-CG 3.88Å; L98-A161 HydrophobicContact CB-CB 4.26Å; L98-A161 VanDerWaalsContact CD2-O 3.26Å; L98-A161 WeakPolarHBondContact CD2-O 3.34Å; L98-E168 PolarHBondContact N-OE1 2.89Å
99	N	98.5	Very high	97.3	Very high	42 Å²	42	49.2 Å²	49.2	23%	0.225	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-43	-178.7	-177.2	60.8	0	0	0	111.4	W94 E95 S96 M101 E102 C103	W94-N99 WeakPolarHBondContact O-CB 3.37Å; W94-N99 PolarHBondContact O-ND2 3.32Å; E95-N99 HydrophobicContact CB-CB 4.44Å; S96-N99 PolarHBondContact O-N 3.41Å; S96-N99 WeakPolarHBondContact OG-CB 3.49Å; S96-N99 PolarHBondContact OG-N 2.99Å; S96-N99 VanDerWaalsContact OG-N 3.16Å; N99-M101 PolarHBondContact O-N 3.36Å; N99-E102 PolarHBondContact O-N 3.12Å; N99-C103 PolarHBondContact O-N 3.33Å; N99-C103 PolarHBondContact O-SG 2.96Å; N99-C103 VanDerWaalsContact O-SG 3.37Å
100	A	98.5	Very high	97.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-43.9	175.9	0	0	0	0	0	112.6	F42 F56 W94 S96 L98 E102 C103 A104	F42-A100 HydrophobicContact CE2-CB 3.59Å; F42-A100 HydrophobicContact CZ-CB 3.55Å; F56-A100 HydrophobicContact CE2-CB 3.99Å; F56-A100 HydrophobicContact CZ-CB 3.97Å; W94-A100 HydrophobicContact CB-CB 4.31Å; S96-A100 WeakPolarHBondContact O-CB 3.39Å; S96-A100 PolarHBondContact O-N 3.47Å; L98-A100 PolarHBondContact O-N 2.97Å; A100-E102 VanDerWaalsContact C-N 3.35Å; A100-E102 PolarHBondContact O-N 2.72Å; A100-C103 PolarHBondContact O-N 2.77Å; A100-A104 WeakPolarHBondContact O-CB 3.24Å; A100-A104 PolarHBondContact O-N 2.95Å
101	M	98.6	Very high	97.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-35.3	176.9	-71.1	-71.6	-179.1	0	0	112.6	F52 Y55 F56 G97 L98 N99 L105 L149 H152 V153 L156 F171 L176	F52-M101 HydrophobicContact CD1-CE 3.83Å; F52-M101 HydrophobicContact CE1-CE 3.57Å; F52-M101 HydrophobicContact CE1-CG 4.11Å; Y55-M101 HydrophobicContact CD1-CE 3.78Å; Y55-M101 HydrophobicContact CE1-CE 3.74Å; Y55-M101 HydrophobicContact CE1-SD 4.1Å; F56-M101 HydrophobicContact CE1-CE 4.38Å; F56-M101 HydrophobicContact CE1-SD 4.17Å; F56-M101 HydrophobicContact CE2-CE 4.34Å; F56-M101 HydrophobicContact CZ-CE 3.83Å; F56-M101 HydrophobicContact CZ-CG 4.23Å; F56-M101 HydrophobicContact CZ-SD 3.8Å; G97-M101 WeakPolarHBondContact O-CB 3.43Å; G97-M101 VanDerWaalsContact O-CG 3.25Å; G97-M101 WeakPolarHBondContact O-CG 3.36Å; G97-M101 PolarHBondContact O-N 3.19Å; G97-M101 VanDerWaalsContact O-N 3.08Å; L98-M101 PolarHBondContact O-N 2.98Å; N99-M101 PolarHBondContact O-N 3.36Å; M101-L105 WeakPolarHBondContact O-CB 3.48Å; M101-L105 PolarHBondContact O-N 3.37Å; M101-L149 HydrophobicContact SD-CD2 3.7Å; M101-H152 HydrophobicContact CG-CB 4.47Å; M101-H152 HydrophobicContact SD-CB 4.05Å; M101-V153 HydrophobicContact CB-CG2 3.76Å; M101-L156 HydrophobicContact CB-CD1 4.39Å; M101-L156 HydrophobicContact CG-CD1 3.96Å; M101-F171 HydrophobicContact CE-CE1 4.44Å; M101-L176 HydrophobicContact CE-CD1 4.01Å; M101-L176 HydrophobicContact CE-CD2 4.3Å
102	E	98.7	Very high	98.1	Very high	62 Å²	62	41.6 Å²	41.6	29%	0.29	21%	0.209	S	C	.	.	H	α-helix	trans	-69.2	-41.9	174.7	-71.5	-177.8	-179.8	0	0	112.2	L98 N99 A100 L105 H106 V153 R157	L98-E102 HydrophobicContact CD1-CG 4.17Å; L98-E102 WeakPolarHBondContact CD1-OE1 3.47Å; L98-E102 WeakPolarHBondContact O-CG 3.46Å; L98-E102 PolarHBondContact O-N 2.72Å; N99-E102 PolarHBondContact O-N 3.12Å; A100-E102 VanDerWaalsContact C-N 3.35Å; A100-E102 PolarHBondContact O-N 2.72Å; E102-L105 PolarHBondContact O-N 2.89Å; E102-H106 PolarHBondContact O-N 3.37Å; E102-V153 HydrophobicContact CG-CB 4.49Å; E102-V153 HydrophobicContact CG-CG1 3.8Å; E102-V153 HydrophobicContact CG-CG2 3.8Å; E102-R157 VanDerWaalsContact CD-NH2 3.27Å; E102-R157 IonicContact OE1-CZ 3.86Å; E102-R157 IonicContact OE1-NE 2.59Å; E102-R157 PolarHBondContact OE1-NE 3.37Å; E102-R157 IonicContact OE1-NH2 2.65Å; E102-R157 PolarHBondContact OE1-NH2 2.94Å; E102-R157 IonicContact OE2-NH2 3.84Å
103	C	98.6	Very high	98.4	Very high	32 Å²	32	40.8 Å²	40.8	22%	0.216	20%	0.202	C	C	.	.	H	α-helix	trans	-62.4	-44.6	173.1	-70.5	0	0	0	0	111.6	M38 W94 N99 A100 H106 L107	M38-C103 HydrophobicContact CE-CB 3.68Å; W94-C103 HydrophobicContact CE3-CB 4.29Å; W94-C103 HydrophobicContact CZ3-CB 3.92Å; N99-C103 PolarHBondContact O-N 3.33Å; N99-C103 PolarHBondContact O-SG 2.96Å; N99-C103 VanDerWaalsContact O-SG 3.37Å; A100-C103 PolarHBondContact O-N 2.77Å; C103-H106 PolarHBondContact O-N 2.88Å; C103-L107 WeakPolarHBondContact O-CB 3.42Å; C103-L107 PolarHBondContact O-N 3.27Å
104	A	98.6	Very high	98.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-47	174.5	0	0	0	0	0	111.4	Y35 M38 F56 A100 H106 L107 E108 L149	Y35-A104 HydrophobicContact CE1-CB 3.69Å; M38-A104 HydrophobicContact CE-CB 4.38Å; M38-A104 HydrophobicContact SD-CB 4.34Å; F56-A104 HydrophobicContact CE1-CB 4.1Å; A100-A104 WeakPolarHBondContact O-CB 3.24Å; A100-A104 PolarHBondContact O-N 2.95Å; A104-H106 PolarHBondContact O-N 3.24Å; A104-L107 WeakPolarHBondContact O-CB 3.47Å; A104-L107 PolarHBondContact O-N 3.46Å; A104-L107 VanDerWaalsContact O-N 3.12Å; A104-E108 PolarHBondContact O-N 2.91Å; A104-L149 HydrophobicContact CB-CD1 4.16Å; A104-L149 HydrophobicContact CB-CD2 3.93Å
105	L	98.8	Very high	98.6	Very high	25 Å²	25	38.2 Å²	38.2	13%	0.131	19%	0.191	C	C	.	.	H	α-helix	trans	-59.1	-36.4	176.4	178.9	60.7	0	0	0	112.4	M101 E102 K109 I146 L149 V153	M101-L105 WeakPolarHBondContact O-CB 3.48Å; M101-L105 PolarHBondContact O-N 3.37Å; E102-L105 PolarHBondContact O-N 2.89Å; L105-K109 WeakPolarHBondContact O-CG 3.27Å; L105-K109 PolarHBondContact O-N 2.73Å; L105-I146 HydrophobicContact CD1-CB 4.45Å; L105-I146 HydrophobicContact CD1-CG2 3.9Å; L105-I146 WeakPolarHBondContact CD1-O 3.36Å; L105-L149 HydrophobicContact CB-CB 4.12Å; L105-L149 HydrophobicContact CD1-CB 3.99Å; L105-V153 HydrophobicContact CD2-CG2 4.41Å
106	H	98.6	Very high	98.6	Very high	114 Å²	114	35 Å²	35	53%	0.528	18%	0.178	S	C	.	.	H	α-helix	trans	-70.7	-43.7	175.5	-174.5	61.1	0	0	0	112	E102 C103 A104 E108 K109 N110	E102-H106 PolarHBondContact O-N 3.37Å; C103-H106 PolarHBondContact O-N 2.88Å; A104-H106 PolarHBondContact O-N 3.24Å; H106-E108 PolarHBondContact O-N 3.4Å; H106-K109 PolarHBondContact O-N 3.19Å; H106-N110 PolarHBondContact CD2-ND2 3.39Å; H106-N110 VanDerWaalsContact CD2-ND2 3.32Å; H106-N110 PolarHBondContact NE2-ND2 2.92Å; H106-N110 VanDerWaalsContact O-CG 3.27Å; H106-N110 PolarHBondContact O-N 3.25Å; H106-N110 PolarHBondContact O-ND2 3Å
107	L	98.5	Very high	98.6	Very high	14 Å²	14	40 Å²	40	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-55.5	-50.8	174.6	175	65.8	0	0	0	111	Y30 A31 V34 Y35 C103 A104 K109 N110 V111	Y30-L107 HydrophobicContact CD1-CD1 4.24Å; Y30-L107 HydrophobicContact CE1-CD1 4.06Å; A31-L107 HydrophobicContact CB-CD1 4.19Å; A31-L107 HydrophobicContact CB-CD2 3.98Å; A31-L107 HydrophobicContact CB-CG 4.26Å; V34-L107 HydrophobicContact CB-CD2 3.98Å; V34-L107 HydrophobicContact CG1-CD2 3.85Å; Y35-L107 HydrophobicContact CD2-CD2 4.46Å; Y35-L107 HydrophobicContact CE2-CD2 4.11Å; C103-L107 WeakPolarHBondContact O-CB 3.42Å; C103-L107 PolarHBondContact O-N 3.27Å; A104-L107 WeakPolarHBondContact O-CB 3.47Å; A104-L107 PolarHBondContact O-N 3.46Å; A104-L107 VanDerWaalsContact O-N 3.12Å; L107-K109 VanDerWaalsContact C-N 3.29Å; L107-K109 PolarHBondContact O-N 3.12Å; L107-N110 WeakPolarHBondContact O-CA 3.33Å; L107-N110 WeakPolarHBondContact O-CB 3.41Å; L107-N110 PolarHBondContact O-N 2.89Å; L107-V111 HydrophobicContact CD1-CG2 4.34Å; L107-V111 WeakPolarHBondContact O-CG2 3.34Å; L107-V111 PolarHBondContact O-N 2.86Å
108	E	98.7	Very high	98.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-36.5	-180	-72.2	-48.6	138.5	0	0	113.4	Y35 A104 H106 N110 N112 Q142 A145 I146 L149	Y35-E108 VanDerWaalsContact CE2-OE1 3.24Å; Y35-E108 WeakPolarHBondContact CE2-OE1 3.36Å; Y35-E108 WeakPolarHBondContact OH-CG 3.43Å; Y35-E108 PolarHBondContact OH-OE1 3.48Å; A104-E108 PolarHBondContact O-N 2.91Å; H106-E108 PolarHBondContact O-N 3.4Å; E108-N110 VanDerWaalsContact C-N 3.34Å; E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.21Å; E108-Q142 PolarHBondContact O-NE2 2.89Å; E108-Q142 VanDerWaalsContact O-NE2 3.11Å; E108-Q142 PolarHBondContact OE2-NE2 2.59Å; E108-A145 HydrophobicContact CG-CB 4.48Å; E108-I146 HydrophobicContact CB-CG1 3.74Å; E108-L149 HydrophobicContact CB-CD1 4.27Å; E108-L149 HydrophobicContact CG-CD1 3.45Å; E108-L149 VanDerWaalsContact CG-CD1 3.45Å
109	K	98.7	Very high	98.7	Very high	105 Å²	105	41.2 Å²	41.2	46%	0.457	21%	0.206	S	C	.	.	H	α-helix	trans	-67.3	-36.3	174.4	-75.6	174.6	178.6	176.5	0	111.9	L105 H106 L107 Q113 I146	L105-K109 WeakPolarHBondContact O-CG 3.27Å; L105-K109 PolarHBondContact O-N 2.73Å; H106-K109 PolarHBondContact O-N 3.19Å; L107-K109 VanDerWaalsContact C-N 3.29Å; L107-K109 PolarHBondContact O-N 3.12Å; K109-Q113 WeakPolarHBondContact O-CB 3.38Å; K109-Q113 PolarHBondContact O-N 3.29Å; K109-I146 HydrophobicContact CG-CD1 4.02Å; K109-I146 HydrophobicContact CG-CG1 4.24Å; K109-I146 HydrophobicContact CG-CG2 4.33Å
110	N	98.6	Very high	98.7	Very high	77 Å²	77	44.9 Å²	44.9	41%	0.412	22%	0.22	S	C	.	.	H	α-helix	trans	-70.2	-43.2	176.6	-66.8	-20.6	0	0	0	111.4	H106 L107 E108 Q113 S114	H106-N110 PolarHBondContact CD2-ND2 3.39Å; H106-N110 VanDerWaalsContact CD2-ND2 3.32Å; H106-N110 PolarHBondContact NE2-ND2 2.92Å; H106-N110 VanDerWaalsContact O-CG 3.27Å; H106-N110 PolarHBondContact O-N 3.25Å; H106-N110 PolarHBondContact O-ND2 3Å; L107-N110 WeakPolarHBondContact O-CA 3.33Å; L107-N110 WeakPolarHBondContact O-CB 3.41Å; L107-N110 PolarHBondContact O-N 2.89Å; E108-N110 VanDerWaalsContact C-N 3.34Å; N110-Q113 PolarHBondContact O-N 3.15Å; N110-S114 PolarHBondContact O-N 3.47Å
111	V	98.7	Very high	98.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-49.4	172.6	173.4	0	0	0	0	110.1	L27 E28 A31 L107 Q113 S114 L115	L27-V111 HydrophobicContact CD2-CG2 4.39Å; L27-V111 HydrophobicContact CG-CG2 4.19Å; E28-V111 VanDerWaalsContact OE2-CG1 3.29Å; E28-V111 WeakPolarHBondContact OE2-CG1 3.32Å; A31-V111 HydrophobicContact CB-CG2 4.23Å; L107-V111 HydrophobicContact CD1-CG2 4.34Å; L107-V111 WeakPolarHBondContact O-CG2 3.34Å; L107-V111 PolarHBondContact O-N 2.86Å; V111-Q113 PolarHBondContact O-N 3.23Å; V111-S114 WeakPolarHBondContact O-CB 3.31Å; V111-S114 PolarHBondContact O-N 2.89Å; V111-S114 VanDerWaalsContact O-N 3.16Å; V111-L115 HydrophobicContact CG1-CD1 4.05Å; V111-L115 WeakPolarHBondContact O-CG 3.32Å; V111-L115 PolarHBondContact O-N 2.98Å
112	N	98.8	Very high	98.7	Very high	27 Å²	27	46.6 Å²	46.6	14%	0.144	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-40.9	178.2	-172.4	43.9	0	0	0	112.6	E108 S114 L115 L116 Q142 I146	E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.21Å; N112-S114 VanDerWaalsContact C-N 3.32Å; N112-S114 PolarHBondContact O-N 2.85Å; N112-L115 WeakPolarHBondContact O-CB 3.17Å; N112-L115 PolarHBondContact O-N 2.99Å; N112-L116 WeakPolarHBondContact O-CG 3.44Å; N112-L116 PolarHBondContact O-N 3.28Å; N112-Q142 HydrophobicContact CB-CB 3.98Å; N112-Q142 HydrophobicContact CB-CG 3.94Å; N112-I146 HydrophobicContact CB-CD1 3.93Å
113	Q	98.8	Very high	98.7	Very high	96 Å²	96	46.9 Å²	46.9	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-42	175.8	-177	57.1	45.8	0	0	111.6	K109 N110 V111 L115 L116 E117	K109-Q113 WeakPolarHBondContact O-CB 3.38Å; K109-Q113 PolarHBondContact O-N 3.29Å; N110-Q113 PolarHBondContact O-N 3.15Å; V111-Q113 PolarHBondContact O-N 3.23Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; Q113-L115 PolarHBondContact O-N 2.7Å; Q113-L116 PolarHBondContact O-N 3.39Å; Q113-E117 PolarHBondContact NE2-OE1 3.24Å; Q113-E117 WeakPolarHBondContact O-CG 3.18Å; Q113-E117 PolarHBondContact O-N 3.38Å
114	S	98.8	Very high	98.7	Very high	35 Å²	35	49.8 Å²	49.8	25%	0.245	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-39.5	174.2	-174	0	0	0	0	112.2	Q24 N110 V111 N112 E117 L118	Q24-S114 VanDerWaalsContact OE1-CB 3.3Å; Q24-S114 PolarHBondContact OE1-OG 3.33Å; N110-S114 PolarHBondContact O-N 3.47Å; V111-S114 WeakPolarHBondContact O-CB 3.31Å; V111-S114 PolarHBondContact O-N 2.89Å; V111-S114 VanDerWaalsContact O-N 3.16Å; N112-S114 VanDerWaalsContact C-N 3.32Å; N112-S114 PolarHBondContact O-N 2.85Å; S114-E117 PolarHBondContact O-N 3.21Å; S114-L118 WeakPolarHBondContact O-CB 3.42Å; S114-L118 PolarHBondContact O-N 3.26Å
115	L	98.8	Very high	98.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.5	-39.7	175.2	-72.1	163.6	0	0	0	112.6	Q24 V111 N112 Q113 E117 L118 H119 I134 Y138 L139 Q142	Q24-L115 HydrophobicContact CG-CD2 4.07Å; V111-L115 HydrophobicContact CG1-CD1 4.05Å; V111-L115 WeakPolarHBondContact O-CG 3.32Å; V111-L115 PolarHBondContact O-N 2.98Å; N112-L115 WeakPolarHBondContact O-CB 3.17Å; N112-L115 PolarHBondContact O-N 2.99Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; Q113-L115 PolarHBondContact O-N 2.7Å; L115-E117 VanDerWaalsContact C-N 3.34Å; L115-L118 PolarHBondContact O-N 3.18Å; L115-H119 WeakPolarHBondContact O-CB 3.35Å; L115-H119 PolarHBondContact O-N 2.86Å; L115-I134 HydrophobicContact CD2-CG2 4.42Å; L115-Y138 HydrophobicContact CD1-CD1 4.39Å; L115-Y138 HydrophobicContact CD1-CG 4.5Å; L115-Y138 HydrophobicContact CD2-CD1 4.03Å; L115-Y138 HydrophobicContact CD2-CG 4.04Å; L115-L139 HydrophobicContact CB-CD2 3.89Å; L115-Q142 HydrophobicContact CD1-CG 3.53Å
116	L	98.8	Very high	98.7	Very high	77 Å²	77	57.8 Å²	57.8	40%	0.403	29%	0.288	S	S	.	.	H	α-helix	trans	-63.5	-40.2	174.7	-68.9	173.1	0	0	0	111.6	N112 Q113 H119 K120 L139	N112-L116 WeakPolarHBondContact O-CG 3.44Å; N112-L116 PolarHBondContact O-N 3.28Å; Q113-L116 PolarHBondContact O-N 3.39Å; L116-H119 PolarHBondContact O-N 3.43Å; L116-K120 WeakPolarHBondContact O-CB 3.45Å; L116-K120 PolarHBondContact O-N 3.19Å; L116-L139 HydrophobicContact CD2-CD2 3.96Å; L116-L139 HydrophobicContact CG-CD2 4.4Å
117	E	98.9	Very high	98.7	Very high	117 Å²	117	52.5 Å²	52.5	55%	0.547	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-39.3	175.3	-72.5	171.5	-162.1	0	0	112.1	Q113 S114 L115 K120 L121	Q113-E117 PolarHBondContact NE2-OE1 3.24Å; Q113-E117 WeakPolarHBondContact O-CG 3.18Å; Q113-E117 PolarHBondContact O-N 3.38Å; S114-E117 PolarHBondContact O-N 3.21Å; L115-E117 VanDerWaalsContact C-N 3.34Å; E117-K120 PolarHBondContact O-N 3.27Å; E117-L121 WeakPolarHBondContact O-CB 3.4Å; E117-L121 PolarHBondContact O-N 3.34Å
118	L	98.8	Very high	98.8	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-42.6	174	176.6	62	0	0	0	111.6	A20 I21 Q24 S114 L115 L121 A122 I134	A20-L118 HydrophobicContact CB-CD1 3.5Å; A20-L118 VanDerWaalsContact CB-CD1 3.5Å; I21-L118 HydrophobicContact CD1-CD1 4.39Å; I21-L118 HydrophobicContact CD1-CD2 3.78Å; I21-L118 HydrophobicContact CG1-CD1 4.45Å; Q24-L118 HydrophobicContact CB-CD2 4.25Å; Q24-L118 HydrophobicContact CG-CD2 4.32Å; S114-L118 WeakPolarHBondContact O-CB 3.42Å; S114-L118 PolarHBondContact O-N 3.26Å; L115-L118 PolarHBondContact O-N 3.18Å; L118-L121 WeakPolarHBondContact O-CB 3.1Å; L118-L121 PolarHBondContact O-N 3.2Å; L118-A122 PolarHBondContact O-N 3.36Å; L118-I134 HydrophobicContact CB-CD1 4.43Å; L118-I134 HydrophobicContact CD2-CD1 3.9Å; L118-I134 HydrophobicContact CD2-CG1 4.37Å; L118-I134 HydrophobicContact CG-CD1 3.65Å
119	H	98.8	Very high	98.8	Very high	36 Å²	36	60.7 Å²	60.7	17%	0.167	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-44	175.4	-178.3	-77.4	0	0	0	111.6	L115 L116 L121 A122 T123 I134 E135	L115-H119 WeakPolarHBondContact O-CB 3.35Å; L115-H119 PolarHBondContact O-N 2.86Å; L116-H119 PolarHBondContact O-N 3.43Å; H119-L121 VanDerWaalsContact C-N 3.31Å; H119-L121 PolarHBondContact O-N 3.38Å; H119-A122 WeakPolarHBondContact O-CB 3.45Å; H119-A122 PolarHBondContact O-N 3.27Å; H119-T123 PolarHBondContact O-N 2.98Å; H119-T123 PolarHBondContact O-OG1 2.95Å; H119-T123 VanDerWaalsContact O-OG1 3.06Å; H119-I134 HydrophobicContact CB-CD1 4.31Å; H119-I134 HydrophobicContact CB-CG2 4.12Å; H119-E135 IonicContact CD2-OE1 3.61Å; H119-E135 IonicContact CE1-OE1 3.31Å; H119-E135 IonicContact NE2-OE1 3.19Å; H119-E135 PolarHBondContact NE2-OE1 2.68Å
120	K	98.8	Very high	98.8	Very high	118 Å²	118	55.7 Å²	55.7	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-57.4	-45.3	172.7	175.4	171.5	170.3	40.5	0	111.3	L116 E117 A122 T123 D124	L116-K120 WeakPolarHBondContact O-CB 3.45Å; L116-K120 PolarHBondContact O-N 3.19Å; E117-K120 PolarHBondContact O-N 3.27Å; K120-A122 PolarHBondContact O-N 3.37Å; K120-T123 WeakPolarHBondContact O-CB 3.39Å; K120-T123 PolarHBondContact O-N 3.02Å; K120-D124 IonicContact NZ-OD1 3.14Å; K120-D124 PolarHBondContact NZ-OD1 2.94Å; K120-D124 IonicContact NZ-OD2 2.68Å; K120-D124 PolarHBondContact NZ-OD2 3.14Å; K120-D124 WeakPolarHBondContact O-CB 3.4Å; K120-D124 VanDerWaalsContact O-CG 3.25Å; K120-D124 PolarHBondContact O-N 3.32Å
121	L	98.8	Very high	98.8	Very high	37 Å²	37	52.7 Å²	52.7	19%	0.194	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-44.4	176.4	175.6	64.3	0	0	0	111.5	D16 A20 E117 L118 H119 T123 D124 K125	D16-L121 HydrophobicContact CB-CD1 4.17Å; D16-L121 HydrophobicContact CB-CD2 4.22Å; A20-L121 HydrophobicContact CB-CD2 3.68Å; E117-L121 WeakPolarHBondContact O-CB 3.4Å; E117-L121 PolarHBondContact O-N 3.34Å; L118-L121 WeakPolarHBondContact O-CB 3.1Å; L118-L121 PolarHBondContact O-N 3.2Å; H119-L121 VanDerWaalsContact C-N 3.31Å; H119-L121 PolarHBondContact O-N 3.38Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 3.33Å; L121-D124 PolarHBondContact O-N 3.5Å; L121-K125 HydrophobicContact CD1-CG 4.09Å; L121-K125 WeakPolarHBondContact O-CB 3.36Å; L121-K125 VanDerWaalsContact O-CG 3.25Å; L121-K125 WeakPolarHBondContact O-CG 3.45Å; L121-K125 PolarHBondContact O-N 3.15Å
122	A	98.8	Very high	98.8	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-43.8	175.6	0	0	0	0	0	111.6	L118 H119 K120 K125 N126 D127 L130 C131	L118-A122 PolarHBondContact O-N 3.36Å; H119-A122 WeakPolarHBondContact O-CB 3.45Å; H119-A122 PolarHBondContact O-N 3.27Å; K120-A122 PolarHBondContact O-N 3.37Å; A122-K125 CarbonylContact O-C 3.52Å; A122-K125 PolarHBondContact O-N 3Å; A122-N126 PolarHBondContact O-N 2.83Å; A122-N126 VanDerWaalsContact O-N 3.09Å; A122-D127 PolarHBondContact O-N 3.29Å; A122-L130 HydrophobicContact CB-CB 3.97Å; A122-L130 HydrophobicContact CB-CD2 3.72Å; A122-L130 HydrophobicContact CB-CG 3.75Å; A122-C131 VanDerWaalsContact CB-SG 3.58Å
123	T	98.7	Very high	98.8	Very high	68 Å²	68	56.6 Å²	56.6	42%	0.417	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-50.2	175.7	-60.6	0	0	0	0	111.5	H119 K120 L121 K125 N126 C131	H119-T123 PolarHBondContact O-N 2.98Å; H119-T123 PolarHBondContact O-OG1 2.95Å; H119-T123 VanDerWaalsContact O-OG1 3.06Å; K120-T123 WeakPolarHBondContact O-CB 3.39Å; K120-T123 PolarHBondContact O-N 3.02Å; L121-T123 VanDerWaalsContact C-N 3.31Å; L121-T123 PolarHBondContact O-N 3.33Å; T123-K125 PolarHBondContact O-N 3.03Å; T123-N126 PolarHBondContact O-N 2.97Å; T123-C131 PolarHBondContact OG1-SG 2.89Å; T123-C131 VanDerWaalsContact OG1-SG 3.41Å
124	D	98.8	Very high	98.8	Very high	93 Å²	93	52 Å²	52	50%	0.497	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-26.4	-180	-69	-18.5	0	0	0	112	K120 L121	K120-D124 IonicContact NZ-OD1 3.14Å; K120-D124 PolarHBondContact NZ-OD1 2.94Å; K120-D124 IonicContact NZ-OD2 2.68Å; K120-D124 PolarHBondContact NZ-OD2 3.14Å; K120-D124 WeakPolarHBondContact O-CB 3.4Å; K120-D124 VanDerWaalsContact O-CG 3.25Å; K120-D124 PolarHBondContact O-N 3.32Å; L121-D124 PolarHBondContact O-N 3.5Å
125	K	98.6	Very high	98.8	Very high	65 Å²	65	54.5 Å²	54.5	28%	0.283	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.9	174.8	-60.6	-59.3	-177.9	167.7	0	114	H14 D16 L121 A122 T123	H14-K125 HydrophobicContact CB-CB 4.22Å; H14-K125 HydrophobicContact CB-CD 4.21Å; H14-K125 HydrophobicContact CB-CG 4.03Å; H14-K125 PolarHBondContact CE1-NZ 3.41Å; H14-K125 PolarHBondContact NE2-NZ 3.41Å; D16-K125 WeakPolarHBondContact OD2-CE 3.29Å; D16-K125 IonicContact OD2-NZ 3.98Å; D16-K125 PolarHBondContact OD2-NZ 3.33Å; L121-K125 HydrophobicContact CD1-CG 4.09Å; L121-K125 WeakPolarHBondContact O-CB 3.36Å; L121-K125 VanDerWaalsContact O-CG 3.25Å; L121-K125 WeakPolarHBondContact O-CG 3.45Å; L121-K125 PolarHBondContact O-N 3.15Å; A122-K125 CarbonylContact O-C 3.52Å; A122-K125 PolarHBondContact O-N 3Å; T123-K125 PolarHBondContact O-N 3.03Å
126	N	98.6	Very high	98.7	Very high	128 Å²	128	57.8 Å²	57.8	68%	0.684	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	43.7	-177	-50.3	-80.3	0	0	0	113	N12 A122 T123 P128	N12-N126 PolarHBondContact ND2-O 3.39Å; A122-N126 PolarHBondContact O-N 2.83Å; A122-N126 VanDerWaalsContact O-N 3.09Å; T123-N126 PolarHBondContact O-N 2.97Å; N126-P128 VanDerWaalsContact C-CD 3.48Å; N126-P128 WeakPolarHBondContact O-CD 3.46Å
127	D	98.8	Very high	98.7	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.016	30%	0.295	C	S	.	.			trans	-101.8	83	173.4	-170	-12.8	0	0	0	111	N12 R77 A122 H129 L130 C131	N12-D127 VanDerWaalsContact O-OD2 3.09Å; R77-D127 IonicContact CZ-OD1 2.78Å; R77-D127 IonicContact CZ-OD2 3.28Å; R77-D127 IonicContact NH1-OD1 3.73Å; R77-D127 PolarHBondContact NH1-OD1 2.89Å; R77-D127 VanDerWaalsContact NH1-OD1 3.15Å; R77-D127 IonicContact NH1-OD2 2.77Å; R77-D127 PolarHBondContact NH1-OD2 3.4Å; R77-D127 IonicContact NH2-OD1 3.37Å; R77-D127 PolarHBondContact NH2-OD1 2.96Å; R77-D127 IonicContact NH2-OD2 3.01Å; R77-D127 PolarHBondContact NH2-OD2 3.1Å; A122-D127 PolarHBondContact O-N 3.29Å; D127-H129 VanDerWaalsContact C-N 3.27Å; D127-H129 PolarHBondContact O-N 3.47Å; D127-H129 PolarHBondContact OD1-N 3.37Å; D127-L130 HydrophobicContact CB-CB 4.06Å; D127-L130 VanDerWaalsContact CG-CB 3.45Å; D127-L130 PolarHBondContact O-N 2.9Å; D127-L130 PolarHBondContact OD1-N 3.29Å; D127-L130 VanDerWaalsContact OD1-N 3.1Å; D127-L130 WeakPolarHBondContact OD2-CB 3.27Å; D127-C131 PolarHBondContact O-N 3Å; D127-C131 VanDerWaalsContact O-N 3.11Å; D127-C131 PolarHBondContact O-SG 3.16Å; D127-C131 VanDerWaalsContact O-SG 3.35Å
128	P	98.8	Very high	98.7	Very high	93 Å²	93	51.9 Å²	51.9	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-66.1	-28.5	-175.4	27.4	-36.3	0	0	0	113	N126 C131 D132	N126-P128 VanDerWaalsContact C-CD 3.48Å; N126-P128 WeakPolarHBondContact O-CD 3.46Å; P128-C131 PolarHBondContact O-N 3Å; P128-D132 WeakPolarHBondContact O-CB 3.46Å; P128-D132 PolarHBondContact O-N 3.45Å
129	H	98.8	Very high	98.7	Very high	93 Å²	93	52.9 Å²	52.9	43%	0.431	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-40.7	176.4	175.9	-68.7	0	0	0	110.8	D127 F133	D127-H129 VanDerWaalsContact C-N 3.27Å; D127-H129 PolarHBondContact O-N 3.47Å; D127-H129 PolarHBondContact OD1-N 3.37Å; H129-F133 VanDerWaalsContact O-CB 3.3Å; H129-F133 WeakPolarHBondContact O-CB 3.25Å; H129-F133 PolarHBondContact O-N 2.83Å
130	L	98.8	Very high	98.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-38.9	176.7	-178.3	58.9	0	0	0	111.4	Y13 I21 L73 A122 D127 F133 I134	Y13-L130 HydrophobicContact CE2-CD2 4.33Å; I21-L130 HydrophobicContact CD1-CD1 4.08Å; L73-L130 HydrophobicContact CD2-CD1 3.6Å; A122-L130 HydrophobicContact CB-CB 3.97Å; A122-L130 HydrophobicContact CB-CD2 3.72Å; A122-L130 HydrophobicContact CB-CG 3.75Å; D127-L130 HydrophobicContact CB-CB 4.06Å; D127-L130 VanDerWaalsContact CG-CB 3.45Å; D127-L130 PolarHBondContact O-N 2.9Å; D127-L130 PolarHBondContact OD1-N 3.29Å; D127-L130 VanDerWaalsContact OD1-N 3.1Å; D127-L130 WeakPolarHBondContact OD2-CB 3.27Å; L130-F133 PolarHBondContact O-N 3.08Å; L130-I134 HydrophobicContact CD1-CD1 3.95Å; L130-I134 HydrophobicContact CD1-CG1 4.23Å; L130-I134 HydrophobicContact CG-CD1 3.87Å; L130-I134 WeakPolarHBondContact O-CD1 3.49Å; L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.46Å; L130-I134 PolarHBondContact O-N 3.47Å; L130-I134 VanDerWaalsContact O-N 3.11Å
131	C	98.9	Very high	98.4	Very high	13 Å²	13	53.7 Å²	53.7	9%	0.088	28%	0.283	C	S	.	.	H	α-helix	trans	-56.6	-54.4	172.8	-63.4	0	0	0	0	111.5	A122 T123 D127 P128 F133 I134 E135	A122-C131 VanDerWaalsContact CB-SG 3.58Å; T123-C131 PolarHBondContact OG1-SG 2.89Å; T123-C131 VanDerWaalsContact OG1-SG 3.41Å; D127-C131 PolarHBondContact O-N 3Å; D127-C131 VanDerWaalsContact O-N 3.11Å; D127-C131 PolarHBondContact O-SG 3.16Å; D127-C131 VanDerWaalsContact O-SG 3.35Å; P128-C131 PolarHBondContact O-N 3Å; C131-F133 VanDerWaalsContact C-N 3.33Å; C131-F133 PolarHBondContact O-N 2.64Å; C131-I134 PolarHBondContact O-N 3.34Å; C131-E135 WeakPolarHBondContact O-CG 3.39Å; C131-E135 PolarHBondContact O-N 3.43Å
132	D	98.8	Very high	98.4	Very high	91 Å²	91	52 Å²	52	49%	0.487	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-41.3	-180	177.1	73.2	0	0	0	112.5	P128 I134 E135 T136	P128-D132 WeakPolarHBondContact O-CB 3.46Å; P128-D132 PolarHBondContact O-N 3.45Å; D132-I134 PolarHBondContact O-N 3.04Å; D132-E135 PolarHBondContact O-N 2.92Å; D132-T136 VanDerWaalsContact O-CB 3.25Å; D132-T136 WeakPolarHBondContact O-CB 3.4Å; D132-T136 PolarHBondContact O-N 2.93Å; D132-T136 PolarHBondContact O-OG1 2.68Å
133	F	98.8	Very high	98.4	Very high	19 Å²	19	56.4 Å²	56.4	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-43.8	176.8	178.5	-89.2	0	0	0	112.3	K69 L70 L73 H129 L130 C131 H137 Y138	K69-F133 HydrophobicContact CD-CZ 4.45Å; K69-F133 HydrophobicContact CG-CZ 4.03Å; L70-F133 HydrophobicContact CD2-CE1 4.06Å; L73-F133 HydrophobicContact CB-CE1 4.04Å; L73-F133 HydrophobicContact CB-CE2 4.07Å; L73-F133 HydrophobicContact CB-CZ 3.68Å; L73-F133 HydrophobicContact CD1-CD1 4.32Å; L73-F133 HydrophobicContact CD1-CD2 3.85Å; L73-F133 HydrophobicContact CD1-CE1 4.44Å; L73-F133 HydrophobicContact CD1-CE2 4Å; L73-F133 HydrophobicContact CD1-CG 4Å; L73-F133 HydrophobicContact CD1-CZ 4.28Å; L73-F133 HydrophobicContact CD2-CD1 3.35Å; L73-F133 HydrophobicContact CD2-CD2 4.38Å; L73-F133 HydrophobicContact CD2-CE1 3.32Å; L73-F133 HydrophobicContact CD2-CE2 4.36Å; L73-F133 HydrophobicContact CD2-CG 3.89Å; L73-F133 HydrophobicContact CD2-CZ 3.85Å; L73-F133 HydrophobicContact CG-CD1 4.28Å; L73-F133 HydrophobicContact CG-CE1 4.09Å; L73-F133 HydrophobicContact CG-CE2 4.34Å; L73-F133 HydrophobicContact CG-CG 4.47Å; L73-F133 HydrophobicContact CG-CZ 4.11Å; H129-F133 VanDerWaalsContact O-CB 3.3Å; H129-F133 WeakPolarHBondContact O-CB 3.25Å; H129-F133 PolarHBondContact O-N 2.83Å; L130-F133 PolarHBondContact O-N 3.08Å; C131-F133 VanDerWaalsContact C-N 3.33Å; C131-F133 PolarHBondContact O-N 2.64Å; F133-H137 AromaticContact CD2-CD2 3.58Å; F133-H137 AromaticContact CE2-CD2 3.73Å; F133-H137 WeakPolarHBondContact O-CB 3.29Å; F133-H137 PolarHBondContact O-CD2 2.88Å; F133-H137 PolarHBondContact O-N 3.3Å; F133-H137 VanDerWaalsContact O-N 3.13Å; F133-Y138 HydrophobicContact CD1-CD2 4.48Å; F133-Y138 AromaticContact CD1-CE2 3.97Å; F133-Y138 HydrophobicContact CD1-CE2 3.97Å; F133-Y138 HydrophobicContact CE1-CD2 4.21Å; F133-Y138 AromaticContact CE1-CE2 3.31Å; F133-Y138 HydrophobicContact CE1-CE2 3.31Å; F133-Y138 AromaticContact CE1-CZ 3.99Å; F133-Y138 AromaticContact CZ-CE2 3.86Å; F133-Y138 HydrophobicContact CZ-CE2 3.86Å
134	I	98.8	Very high	98.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-42.1	178.9	-65.9	160.8	0	0	0	110.6	L115 L118 H119 L130 C131 D132 Y138 L139	L115-I134 HydrophobicContact CD2-CG2 4.42Å; L118-I134 HydrophobicContact CB-CD1 4.43Å; L118-I134 HydrophobicContact CD2-CD1 3.9Å; L118-I134 HydrophobicContact CD2-CG1 4.37Å; L118-I134 HydrophobicContact CG-CD1 3.65Å; H119-I134 HydrophobicContact CB-CD1 4.31Å; H119-I134 HydrophobicContact CB-CG2 4.12Å; L130-I134 HydrophobicContact CD1-CD1 3.95Å; L130-I134 HydrophobicContact CD1-CG1 4.23Å; L130-I134 HydrophobicContact CG-CD1 3.87Å; L130-I134 WeakPolarHBondContact O-CD1 3.49Å; L130-I134 VanDerWaalsContact O-CG1 3.26Å; L130-I134 WeakPolarHBondContact O-CG1 3.46Å; L130-I134 PolarHBondContact O-N 3.47Å; L130-I134 VanDerWaalsContact O-N 3.11Å; C131-I134 PolarHBondContact O-N 3.34Å; D132-I134 PolarHBondContact O-N 3.04Å; I134-Y138 WeakPolarHBondContact O-CB 3.26Å; I134-Y138 PolarHBondContact O-N 2.92Å; I134-Y138 VanDerWaalsContact O-N 3.1Å; I134-L139 HydrophobicContact CG2-CD1 4.07Å; I134-L139 HydrophobicContact CG2-CD2 4.26Å; I134-L139 HydrophobicContact CG2-CG 3.84Å; I134-L139 PolarHBondContact O-N 3.27Å
135	E	98.6	Very high	98.3	Very high	86 Å²	86	56.7 Å²	56.7	40%	0.402	30%	0.296	S	S	.	.	I	π-helix	trans	-61.7	-48.8	176.7	-71.9	168.5	-154	0	0	111.9	H119 C131 D132 L139 N140	H119-E135 IonicContact CD2-OE1 3.61Å; H119-E135 IonicContact CE1-OE1 3.31Å; H119-E135 IonicContact NE2-OE1 3.19Å; H119-E135 PolarHBondContact NE2-OE1 2.68Å; C131-E135 WeakPolarHBondContact O-CG 3.39Å; C131-E135 PolarHBondContact O-N 3.43Å; D132-E135 PolarHBondContact O-N 2.92Å; E135-L139 HydrophobicContact CG-CD1 4.17Å; E135-N140 PolarHBondContact O-ND2 3.24Å
136	T	98.1	Very high	98.3	Very high	70 Å²	70	55.1 Å²	55.1	43%	0.429	29%	0.29	S	S	.	.	I	π-helix	trans	-68.6	-43.2	-173.8	-63.3	0	0	0	0	112	D132	D132-T136 VanDerWaalsContact O-CB 3.25Å; D132-T136 WeakPolarHBondContact O-CB 3.4Å; D132-T136 PolarHBondContact O-N 2.93Å; D132-T136 PolarHBondContact O-OG1 2.68Å
137	H	97.8	Very high	98.3	Very high	70 Å²	70	54.7 Å²	54.7	32%	0.324	28%	0.282	S	S	.	.	I	π-helix	trans	-110.4	-5.5	-165.6	-63.4	-59.7	0	0	0	115.5	K69 F133	K69-H137 HydrophobicContact CD-CB 3.84Å; F133-H137 AromaticContact CD2-CD2 3.58Å; F133-H137 AromaticContact CE2-CD2 3.73Å; F133-H137 WeakPolarHBondContact O-CB 3.29Å; F133-H137 PolarHBondContact O-CD2 2.88Å; F133-H137 PolarHBondContact O-N 3.3Å; F133-H137 VanDerWaalsContact O-N 3.13Å
138	Y	98.5	Very high	98.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-135.4	-56.4	-175.7	-60.9	-100.4	0	0	0	112	H66 K69 L70 L115 F133 I134 N140 E141 Q142	H66-Y138 HydrophobicContact CB-CE1 4.02Å; H66-Y138 PolarHBondContact O-OH 2.99Å; K69-Y138 WeakPolarHBondContact CB-OH 3.35Å; K69-Y138 HydrophobicContact CD-CE2 4.07Å; K69-Y138 WeakPolarHBondContact CD-OH 3.32Å; K69-Y138 WeakPolarHBondContact CG-OH 3.21Å; L70-Y138 HydrophobicContact CD1-CE1 4.27Å; L70-Y138 HydrophobicContact CD2-CE1 4.1Å; L70-Y138 HydrophobicContact CD2-CE2 4.22Å; L70-Y138 WeakPolarHBondContact CD2-OH 3.44Å; L70-Y138 HydrophobicContact CG-CE1 3.96Å; L70-Y138 VanDerWaalsContact CG-OH 3.27Å; L70-Y138 WeakPolarHBondContact CG-OH 3.48Å; L70-Y138 PolarHBondContact N-OH 3.46Å; L115-Y138 HydrophobicContact CD1-CD1 4.39Å; L115-Y138 HydrophobicContact CD1-CG 4.5Å; L115-Y138 HydrophobicContact CD2-CD1 4.03Å; L115-Y138 HydrophobicContact CD2-CG 4.04Å; F133-Y138 HydrophobicContact CD1-CD2 4.48Å; F133-Y138 AromaticContact CD1-CE2 3.97Å; F133-Y138 HydrophobicContact CD1-CE2 3.97Å; F133-Y138 HydrophobicContact CE1-CD2 4.21Å; F133-Y138 AromaticContact CE1-CE2 3.31Å; F133-Y138 HydrophobicContact CE1-CE2 3.31Å; F133-Y138 AromaticContact CE1-CZ 3.99Å; F133-Y138 AromaticContact CZ-CE2 3.86Å; F133-Y138 HydrophobicContact CZ-CE2 3.86Å; I134-Y138 WeakPolarHBondContact O-CB 3.26Å; I134-Y138 PolarHBondContact O-N 2.92Å; I134-Y138 VanDerWaalsContact O-N 3.1Å; Y138-N140 VanDerWaalsContact C-N 3.3Å; Y138-N140 PolarHBondContact O-N 3.3Å; Y138-E141 PolarHBondContact O-N 3.45Å; Y138-Q142 PolarHBondContact O-N 3.12Å
139	L	98.4	Very high	98.3	Very high	28 Å²	28	54 Å²	54	15%	0.147	27%	0.27	C	S	.	.	I	π-helix	trans	-61.4	-37.2	-171.9	-64.9	179.3	0	0	0	113.2	L115 L116 I134 E135 V143	L115-L139 HydrophobicContact CB-CD2 3.89Å; L116-L139 HydrophobicContact CD2-CD2 3.96Å; L116-L139 HydrophobicContact CG-CD2 4.4Å; I134-L139 HydrophobicContact CG2-CD1 4.07Å; I134-L139 HydrophobicContact CG2-CD2 4.26Å; I134-L139 HydrophobicContact CG2-CG 3.84Å; I134-L139 PolarHBondContact O-N 3.27Å; E135-L139 HydrophobicContact CG-CD1 4.17Å; L139-V143 WeakPolarHBondContact O-CG2 3.49Å; L139-V143 PolarHBondContact O-N 3.33Å
140	N	96.6	Very high	98.3	Very high	99 Å²	99	50.4 Å²	50.4	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-35.5	175	-72.8	-48.2	0	0	0	112.8	E135 Y138 K144	E135-N140 PolarHBondContact O-ND2 3.24Å; Y138-N140 VanDerWaalsContact C-N 3.3Å; Y138-N140 PolarHBondContact O-N 3.3Å; N140-K144 WeakPolarHBondContact O-CG 3.31Å; N140-K144 PolarHBondContact O-N 3.22Å
141	E	96.7	Very high	98.3	Very high	71 Å²	71	53.6 Å²	53.6	33%	0.332	28%	0.276	S	S	.	.	H	α-helix	trans	-70.7	-47.3	178.1	-69.5	175.4	-176.4	0	0	109.8	H66 K69 Y138 V143 K144 A145	H66-E141 IonicContact CD2-OE2 2.88Å; H66-E141 IonicContact CE1-OE2 3.66Å; H66-E141 IonicContact NE2-OE2 3.59Å; H66-E141 PolarHBondContact NE2-OE2 2.92Å; H66-E141 VanDerWaalsContact NE2-OE2 3.15Å; K69-E141 IonicContact NZ-OE2 2.7Å; Y138-E141 PolarHBondContact O-N 3.45Å; E141-V143 VanDerWaalsContact C-N 3.34Å; E141-V143 PolarHBondContact O-N 2.82Å; E141-K144 WeakPolarHBondContact O-CB 3.46Å; E141-K144 PolarHBondContact O-N 3.44Å; E141-A145 PolarHBondContact O-N 3.29Å
142	Q	97.7	Very high	98.2	Very high	2 Å²	2	54 Å²	54	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-54.7	-45.5	175.7	-70.8	-47.2	103.7	0	0	113	E108 N112 L115 Y138 K144 A145 I146	E108-Q142 PolarHBondContact O-NE2 2.89Å; E108-Q142 VanDerWaalsContact O-NE2 3.11Å; E108-Q142 PolarHBondContact OE2-NE2 2.59Å; N112-Q142 HydrophobicContact CB-CB 3.98Å; N112-Q142 HydrophobicContact CB-CG 3.94Å; L115-Q142 HydrophobicContact CD1-CG 3.53Å; Y138-Q142 PolarHBondContact O-N 3.12Å; Q142-K144 VanDerWaalsContact C-N 3.28Å; Q142-K144 PolarHBondContact O-N 3.05Å; Q142-A145 PolarHBondContact O-N 3.43Å; Q142-I146 VanDerWaalsContact O-CB 3.31Å; Q142-I146 WeakPolarHBondContact O-CB 3.42Å; Q142-I146 WeakPolarHBondContact O-CD1 3.46Å; Q142-I146 WeakPolarHBondContact O-CG1 3.46Å; Q142-I146 PolarHBondContact O-N 3.14Å
143	V	98.4	Very high	98.2	Very high	92 Å²	92	49.9 Å²	49.9	56%	0.558	26%	0.255	S	S	*	.	H	α-helix	trans	-64	-36.4	-179.2	171.5	0	0	0	0	111.3	L139 E141 K147	L139-V143 WeakPolarHBondContact O-CG2 3.49Å; L139-V143 PolarHBondContact O-N 3.33Å; E141-V143 VanDerWaalsContact C-N 3.34Å; E141-V143 PolarHBondContact O-N 2.82Å; V143-K147 VanDerWaalsContact O-CB 3.31Å; V143-K147 WeakPolarHBondContact O-CB 3.45Å; V143-K147 PolarHBondContact O-N 3.08Å; V143-K147 VanDerWaalsContact O-N 3.14Å
144	K	97.8	Very high	98.2	Very high	150 Å²	150	52 Å²	52	65%	0.652	27%	0.269	S	S	*	.	H	α-helix	trans	-69	-49.1	175.7	-69.5	174.8	-176.1	178	0	111.2	N140 E141 Q142 I146 K147 E148	N140-K144 WeakPolarHBondContact O-CG 3.31Å; N140-K144 PolarHBondContact O-N 3.22Å; E141-K144 WeakPolarHBondContact O-CB 3.46Å; E141-K144 PolarHBondContact O-N 3.44Å; Q142-K144 VanDerWaalsContact C-N 3.28Å; Q142-K144 PolarHBondContact O-N 3.05Å; K144-I146 PolarHBondContact O-N 3.02Å; K144-K147 WeakPolarHBondContact O-CB 3.46Å; K144-K147 PolarHBondContact O-N 3.34Å; K144-K147 VanDerWaalsContact O-N 3.12Å; K144-E148 WeakPolarHBondContact O-CB 3.4Å; K144-E148 PolarHBondContact O-N 2.97Å
145	A	97.9	Very high	98.2	Very high	18 Å²	18	55.5 Å²	55.5	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-46.9	178.6	0	0	0	0	0	111.9	E108 E141 Q142 K147 E148 L149	E108-A145 HydrophobicContact CG-CB 4.48Å; E141-A145 PolarHBondContact O-N 3.29Å; Q142-A145 PolarHBondContact O-N 3.43Å; A145-K147 VanDerWaalsContact C-N 3.27Å; A145-K147 PolarHBondContact O-N 3.25Å; A145-E148 PolarHBondContact O-N 3.38Å; A145-L149 WeakPolarHBondContact O-CB 3.19Å; A145-L149 WeakPolarHBondContact O-CG 3.43Å; A145-L149 PolarHBondContact O-N 3.06Å
146	I	98.6	Very high	98.2	Very high	32 Å²	32	51.4 Å²	51.4	16%	0.164	27%	0.269	C	S	.	.	H	α-helix	trans	-60.1	-38.8	176.5	-69.7	167.3	0	0	0	111.3	L105 E108 K109 N112 Q142 K144 G150	L105-I146 HydrophobicContact CD1-CB 4.45Å; L105-I146 HydrophobicContact CD1-CG2 3.9Å; L105-I146 WeakPolarHBondContact CD1-O 3.36Å; E108-I146 HydrophobicContact CB-CG1 3.74Å; K109-I146 HydrophobicContact CG-CD1 4.02Å; K109-I146 HydrophobicContact CG-CG1 4.24Å; K109-I146 HydrophobicContact CG-CG2 4.33Å; N112-I146 HydrophobicContact CB-CD1 3.93Å; Q142-I146 VanDerWaalsContact O-CB 3.31Å; Q142-I146 WeakPolarHBondContact O-CB 3.42Å; Q142-I146 WeakPolarHBondContact O-CD1 3.46Å; Q142-I146 WeakPolarHBondContact O-CG1 3.46Å; Q142-I146 PolarHBondContact O-N 3.14Å; K144-I146 PolarHBondContact O-N 3.02Å; I146-G150 PolarHBondContact O-N 3.3Å
147	K	98.7	Very high	98.2	Very high	118 Å²	118	55 Å²	55	51%	0.513	27%	0.274	S	S	.	.	H	α-helix	trans	-68.8	-44.9	178.2	176.9	58.9	175.3	72	0	111.5	V143 K144 A145 G150 D151	V143-K147 VanDerWaalsContact O-CB 3.31Å; V143-K147 WeakPolarHBondContact O-CB 3.45Å; V143-K147 PolarHBondContact O-N 3.08Å; V143-K147 VanDerWaalsContact O-N 3.14Å; K144-K147 WeakPolarHBondContact O-CB 3.46Å; K144-K147 PolarHBondContact O-N 3.34Å; K144-K147 VanDerWaalsContact O-N 3.12Å; A145-K147 VanDerWaalsContact C-N 3.27Å; A145-K147 PolarHBondContact O-N 3.25Å; K147-G150 PolarHBondContact O-N 2.83Å; K147-D151 IonicContact NZ-OD1 2.54Å; K147-D151 PolarHBondContact NZ-OD1 3.23Å; K147-D151 IonicContact NZ-OD2 2.78Å; K147-D151 PolarHBondContact NZ-OD2 3.28Å; K147-D151 PolarHBondContact O-N 3.31Å
148	E	98.4	Very high	98.2	Very high	81 Å²	81	59.7 Å²	59.7	38%	0.379	29%	0.294	S	S	.	.	H	α-helix	trans	-60.2	-52.8	178	-177.9	-177.9	109.6	0	0	111.4	Y55 K144 A145 G150 D151 H152	Y55-E148 VanDerWaalsContact CE2-OE1 3.25Å; Y55-E148 WeakPolarHBondContact CE2-OE1 3.25Å; Y55-E148 PolarHBondContact OH-OE1 3.15Å; K144-E148 WeakPolarHBondContact O-CB 3.4Å; K144-E148 PolarHBondContact O-N 2.97Å; A145-E148 PolarHBondContact O-N 3.38Å; E148-G150 VanDerWaalsContact C-N 3.27Å; E148-G150 PolarHBondContact O-N 3.41Å; E148-D151 WeakPolarHBondContact O-CA 3.44Å; E148-D151 WeakPolarHBondContact O-CB 3.23Å; E148-D151 PolarHBondContact O-N 3.42Å; E148-H152 PolarHBondContact O-N 3.46Å; E148-H152 IonicContact OE1-NE2 3.15Å
149	L	98.7	Very high	98.2	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-38.8	176.7	-71.3	167.1	0	0	0	111.6	Y55 M101 A104 L105 E108 A145 D151 H152 V153	Y55-L149 HydrophobicContact CE1-CD2 4.24Å; M101-L149 HydrophobicContact SD-CD2 3.7Å; A104-L149 HydrophobicContact CB-CD1 4.16Å; A104-L149 HydrophobicContact CB-CD2 3.93Å; L105-L149 HydrophobicContact CB-CB 4.12Å; L105-L149 HydrophobicContact CD1-CB 3.99Å; E108-L149 HydrophobicContact CB-CD1 4.27Å; E108-L149 HydrophobicContact CG-CD1 3.45Å; E108-L149 VanDerWaalsContact CG-CD1 3.45Å; A145-L149 WeakPolarHBondContact O-CB 3.19Å; A145-L149 WeakPolarHBondContact O-CG 3.43Å; A145-L149 PolarHBondContact O-N 3.06Å; L149-D151 VanDerWaalsContact C-N 3.32Å; L149-D151 PolarHBondContact O-N 3.26Å; L149-H152 PolarHBondContact O-N 3.04Å; L149-V153 WeakPolarHBondContact O-CG2 3.34Å; L149-V153 PolarHBondContact O-N 2.85Å
150	G	98.6	Very high	98.1	Very high	18 Å²	18	63.1 Å²	63.1	19%	0.186	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-37.5	173.7	0	0	0	0	0	113.6	I146 K147 E148 T154	I146-G150 PolarHBondContact O-N 3.3Å; K147-G150 PolarHBondContact O-N 2.83Å; E148-G150 VanDerWaalsContact C-N 3.27Å; E148-G150 PolarHBondContact O-N 3.41Å; G150-T154 WeakPolarHBondContact O-CB 3.39Å; G150-T154 PolarHBondContact O-N 3.32Å; G150-T154 PolarHBondContact O-OG1 2.95Å
151	D	98.7	Very high	98.2	Very high	68 Å²	68	58.7 Å²	58.7	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-69.6	-41.6	174.6	-70.7	-17.8	0	0	0	111.6	K147 E148 L149 T154 N155	K147-D151 IonicContact NZ-OD1 2.54Å; K147-D151 PolarHBondContact NZ-OD1 3.23Å; K147-D151 IonicContact NZ-OD2 2.78Å; K147-D151 PolarHBondContact NZ-OD2 3.28Å; K147-D151 PolarHBondContact O-N 3.31Å; E148-D151 WeakPolarHBondContact O-CA 3.44Å; E148-D151 WeakPolarHBondContact O-CB 3.23Å; E148-D151 PolarHBondContact O-N 3.42Å; L149-D151 VanDerWaalsContact C-N 3.32Å; L149-D151 PolarHBondContact O-N 3.26Å; D151-T154 PolarHBondContact O-N 3.05Å; D151-N155 PolarHBondContact O-N 3.37Å; D151-N155 PolarHBondContact O-ND2 3.03Å
152	H	98.5	Very high	98	Very high	20 Å²	20	58.3 Å²	58.3	9%	0.093	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-52	176.3	-66.8	-13.4	0	0	0	111.5	M101 E148 L149 T154 N155 L156 F171	M101-H152 HydrophobicContact CG-CB 4.47Å; M101-H152 HydrophobicContact SD-CB 4.05Å; E148-H152 PolarHBondContact O-N 3.46Å; E148-H152 IonicContact OE1-NE2 3.15Å; L149-H152 PolarHBondContact O-N 3.04Å; H152-T154 VanDerWaalsContact C-N 3.29Å; H152-T154 PolarHBondContact O-N 2.96Å; H152-N155 PolarHBondContact O-N 3.47Å; H152-L156 WeakPolarHBondContact O-CG 3.45Å; H152-L156 PolarHBondContact O-N 2.98Å; H152-F171 HydrophobicContact CB-CE1 4.49Å; H152-F171 HydrophobicContact CB-CE2 4.48Å; H152-F171 HydrophobicContact CB-CZ 3.68Å; H152-F171 AromaticContact CG-CZ 3.69Å; H152-F171 AromaticContact ND1-CZ 3.62Å
153	V	98.7	Very high	98	Very high	6 Å²	6	66 Å²	66	4%	0.036	33%	0.334	C	S	.	.	H	α-helix	trans	-56	-44.1	175.3	170.4	0	0	0	0	111.2	L98 M101 E102 L105 L149 N155 R157	L98-V153 HydrophobicContact CD1-CG1 4.11Å; M101-V153 HydrophobicContact CB-CG2 3.76Å; E102-V153 HydrophobicContact CG-CB 4.49Å; E102-V153 HydrophobicContact CG-CG1 3.8Å; E102-V153 HydrophobicContact CG-CG2 3.8Å; L105-V153 HydrophobicContact CD2-CG2 4.41Å; L149-V153 WeakPolarHBondContact O-CG2 3.34Å; L149-V153 PolarHBondContact O-N 2.85Å; V153-N155 PolarHBondContact O-N 3.2Å; V153-R157 HydrophobicContact CG1-CG 4.48Å; V153-R157 WeakPolarHBondContact O-CB 3.46Å; V153-R157 WeakPolarHBondContact O-CG 3.46Å; V153-R157 PolarHBondContact O-N 3.06Å
154	T	98.7	Very high	97.7	Very high	62 Å²	62	64 Å²	64	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-43.2	-179.8	-63.2	0	0	0	0	112.1	G150 D151 H152 K158	G150-T154 WeakPolarHBondContact O-CB 3.39Å; G150-T154 PolarHBondContact O-N 3.32Å; G150-T154 PolarHBondContact O-OG1 2.95Å; D151-T154 PolarHBondContact O-N 3.05Å; H152-T154 VanDerWaalsContact C-N 3.29Å; H152-T154 PolarHBondContact O-N 2.96Å; T154-K158 HydrophobicContact CG2-CD 4.15Å; T154-K158 WeakPolarHBondContact O-CB 3.49Å; T154-K158 VanDerWaalsContact O-CG 3.31Å; T154-K158 WeakPolarHBondContact O-CG 3.31Å; T154-K158 PolarHBondContact O-N 3.01Å; T154-K158 VanDerWaalsContact O-N 3.12Å
155	N	98.4	Very high	97	Very high	74 Å²	74	60 Å²	60	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-48.1	178.9	-78.8	-63.1	0	0	0	111.5	D151 H152 V153 R157 K158 M159 F171	D151-N155 PolarHBondContact O-N 3.37Å; D151-N155 PolarHBondContact O-ND2 3.03Å; H152-N155 PolarHBondContact O-N 3.47Å; V153-N155 PolarHBondContact O-N 3.2Å; N155-R157 VanDerWaalsContact C-N 3.34Å; N155-R157 PolarHBondContact O-N 2.77Å; N155-K158 PolarHBondContact O-N 2.85Å; N155-K158 VanDerWaalsContact O-N 3.11Å; N155-M159 WeakPolarHBondContact O-CB 3.36Å; N155-M159 VanDerWaalsContact O-CG 3.22Å; N155-M159 WeakPolarHBondContact O-CG 3.26Å; N155-M159 PolarHBondContact O-N 2.59Å; N155-F171 HydrophobicContact CB-CD2 4.29Å; N155-F171 HydrophobicContact CB-CE2 3.91Å
156	L	98.3	Very high	96.8	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-56.8	-46.5	178.5	-75	167.2	0	0	0	111.9	F52 L98 M101 H152 K158 M159 G160 A161 E168 F171	F52-L156 HydrophobicContact CE1-CD1 4.44Å; F52-L156 HydrophobicContact CZ-CD1 4.21Å; F52-L156 HydrophobicContact CZ-CD2 4.3Å; L98-L156 HydrophobicContact CB-CB 4.37Å; L98-L156 HydrophobicContact CD1-CB 3.87Å; M101-L156 HydrophobicContact CB-CD1 4.39Å; M101-L156 HydrophobicContact CG-CD1 3.96Å; H152-L156 WeakPolarHBondContact O-CG 3.45Å; H152-L156 PolarHBondContact O-N 2.98Å; L156-K158 PolarHBondContact O-N 3.32Å; L156-M159 PolarHBondContact O-N 3Å; L156-G160 PolarHBondContact O-N 3.12Å; L156-A161 HydrophobicContact CB-CB 4.26Å; L156-A161 HydrophobicContact CD2-CB 4.3Å; L156-A161 WeakPolarHBondContact O-CB 3.29Å; L156-A161 PolarHBondContact O-N 2.54Å; L156-E168 HydrophobicContact CD2-CG 4.21Å; L156-F171 HydrophobicContact CD1-CD1 4.41Å; L156-F171 HydrophobicContact CD1-CE1 4.24Å; L156-F171 HydrophobicContact CD1-CZ 4.36Å; L156-F171 HydrophobicContact CD2-CB 3.75Å; L156-F171 HydrophobicContact CD2-CD1 3.92Å; L156-F171 HydrophobicContact CD2-CD2 3.89Å; L156-F171 HydrophobicContact CD2-CE2 4.49Å; L156-F171 HydrophobicContact CD2-CG 3.56Å; L156-F171 HydrophobicContact CG-CD1 4.25Å; L156-F171 HydrophobicContact CG-CD2 3.93Å; L156-F171 HydrophobicContact CG-CE1 4.36Å; L156-F171 HydrophobicContact CG-CE2 4.07Å; L156-F171 HydrophobicContact CG-CG 4.02Å; L156-F171 HydrophobicContact CG-CZ 4.28Å
157	R	98.3	Very high	96.8	Very high	145 Å²	145	63.5 Å²	63.5	55%	0.547	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-45.3	174.8	-73.5	177.2	178.3	179.9	-5	112.4	L98 E102 V153 N155 M159 G160	L98-R157 HydrophobicContact CD1-CG 3.76Å; L98-R157 HydrophobicContact CD2-CG 3.88Å; E102-R157 VanDerWaalsContact CD-NH2 3.27Å; E102-R157 IonicContact OE1-CZ 3.86Å; E102-R157 IonicContact OE1-NE 2.59Å; E102-R157 PolarHBondContact OE1-NE 3.37Å; E102-R157 IonicContact OE1-NH2 2.65Å; E102-R157 PolarHBondContact OE1-NH2 2.94Å; E102-R157 IonicContact OE2-NH2 3.84Å; V153-R157 HydrophobicContact CG1-CG 4.48Å; V153-R157 WeakPolarHBondContact O-CB 3.46Å; V153-R157 WeakPolarHBondContact O-CG 3.46Å; V153-R157 PolarHBondContact O-N 3.06Å; N155-R157 VanDerWaalsContact C-N 3.34Å; N155-R157 PolarHBondContact O-N 2.77Å; R157-M159 VanDerWaalsContact C-N 3.29Å; R157-M159 PolarHBondContact O-N 2.65Å; R157-G160 PolarHBondContact O-N 2.79Å; R157-G160 VanDerWaalsContact O-N 3.11Å
158	K	98	Very high	96.7	Very high	169 Å²	169	59 Å²	59	74%	0.735	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-29.4	-180	-76.5	178.6	179.5	177.4	0	113.1	T154 N155 L156 G160	T154-K158 HydrophobicContact CG2-CD 4.15Å; T154-K158 WeakPolarHBondContact O-CB 3.49Å; T154-K158 VanDerWaalsContact O-CG 3.31Å; T154-K158 WeakPolarHBondContact O-CG 3.31Å; T154-K158 PolarHBondContact O-N 3.01Å; T154-K158 VanDerWaalsContact O-N 3.12Å; N155-K158 PolarHBondContact O-N 2.85Å; N155-K158 VanDerWaalsContact O-N 3.11Å; L156-K158 PolarHBondContact O-N 3.32Å; K158-G160 PolarHBondContact O-N 2.78Å
159	M	97.9	Very high	96.7	Very high	71 Å²	71	61 Å²	61	35%	0.35	33%	0.328	S	S	.	.	H	α-helix	trans	-77.1	-9.9	174.7	-66.6	169.2	71.7	0	0	112.5	N155 L156 R157 A167 L170 F171	N155-M159 WeakPolarHBondContact O-CB 3.36Å; N155-M159 VanDerWaalsContact O-CG 3.22Å; N155-M159 WeakPolarHBondContact O-CG 3.26Å; N155-M159 PolarHBondContact O-N 2.59Å; L156-M159 PolarHBondContact O-N 3Å; R157-M159 VanDerWaalsContact C-N 3.29Å; R157-M159 PolarHBondContact O-N 2.65Å; M159-A167 HydrophobicContact CB-CB 3.67Å; M159-A167 WeakPolarHBondContact CE-O 3.16Å; M159-L170 HydrophobicContact CE-CB 3.93Å; M159-F171 HydrophobicContact CE-CB 4.28Å; M159-F171 HydrophobicContact SD-CB 4.43Å; M159-F171 HydrophobicContact SD-CD2 4.22Å
160	G	97.1	Very high	96.6	Very high	29 Å²	29	64.4 Å²	64.4	30%	0.299	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	27.8	178.1	0	0	0	0	0	114	L156 R157 K158 E163 S164	L156-G160 PolarHBondContact O-N 3.12Å; R157-G160 PolarHBondContact O-N 2.79Å; R157-G160 VanDerWaalsContact O-N 3.11Å; K158-G160 PolarHBondContact O-N 2.78Å; G160-E163 PolarHBondContact O-N 3.49Å; G160-S164 WeakPolarHBondContact O-CB 3.3Å; G160-S164 PolarHBondContact O-N 3.48Å
161	A	97.2	Very high	96.6	Very high	6 Å²	6	63.6 Å²	63.6	5%	0.05	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	148.4	169.5	0	0	0	0	0	110.9	L98 L156 A167 E168	L98-A161 HydrophobicContact CB-CB 4.26Å; L98-A161 VanDerWaalsContact CD2-O 3.26Å; L98-A161 WeakPolarHBondContact CD2-O 3.34Å; L156-A161 HydrophobicContact CB-CB 4.26Å; L156-A161 HydrophobicContact CD2-CB 4.3Å; L156-A161 WeakPolarHBondContact O-CB 3.29Å; L156-A161 PolarHBondContact O-N 2.54Å; A161-A167 HydrophobicContact CB-CB 4.02Å; A161-E168 HydrophobicContact CB-CG 3.81Å
162	P	94.3	Very high	96.5	Very high	63 Å²	63	60.4 Å²	60.4	41%	0.409	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.2	-7.3	-0.7	35.5	-36.1	0	0	0	114.4	S164	P162-S164 VanDerWaalsContact C-N 3.29Å; P162-S164 PolarHBondContact O-N 3.1Å
163	E	95.9	Very high	96.4	Very high	163 Å²	163	63.3 Å²	63.3	76%	0.762	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-31.8	-172.6	-63	79.4	-173.2	0	0	113.2	G160 G165	G160-E163 PolarHBondContact O-N 3.49Å; E163-G165 PolarHBondContact O-N 3.24Å
164	S	93.8	Very high	96.3	Very high	50 Å²	50	69.1 Å²	69.1	35%	0.35	36%	0.359	S	S	.	.	S	Bend	trans	-87.2	96.5	173.1	-177.2	0	0	0	0	110	G160 P162 L166 A167	G160-S164 WeakPolarHBondContact O-CB 3.3Å; G160-S164 PolarHBondContact O-N 3.48Å; P162-S164 VanDerWaalsContact C-N 3.29Å; P162-S164 PolarHBondContact O-N 3.1Å; S164-L166 PolarHBondContact O-N 3.25Å; S164-A167 WeakPolarHBondContact O-CB 3.43Å; S164-A167 PolarHBondContact O-N 2.8Å
165	G	82	Confident	96.2	Very high	66 Å²	66	68.9 Å²	68.9	68%	0.68	36%	0.358	S	S	*	.	H	α-helix	trans	-58.5	-22.3	-179.7	0	0	0	0	0	114.9	E163 A167	E163-G165 PolarHBondContact O-N 3.24Å; G165-A167 VanDerWaalsContact C-N 3.33Å
166	L	95.1	Very high	96.1	Very high	122 Å²	122	65.7 Å²	65.7	64%	0.639	34%	0.341	S	S	*	.	H	α-helix	trans	-75.1	-21.8	173.3	-73.5	173.9	0	0	0	113.1	S164 L170	S164-L166 PolarHBondContact O-N 3.25Å; L166-L170 WeakPolarHBondContact O-CB 3.29Å; L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 2.96Å
167	A	97.7	Very high	95.6	Very high	3 Å²	3	66.5 Å²	66.5	3%	0.025	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-54.8	-176	0	0	0	0	0	111.4	M159 A161 S164 G165 Y169 L170 F171	M159-A167 HydrophobicContact CB-CB 3.67Å; M159-A167 WeakPolarHBondContact CE-O 3.16Å; A161-A167 HydrophobicContact CB-CB 4.02Å; S164-A167 WeakPolarHBondContact O-CB 3.43Å; S164-A167 PolarHBondContact O-N 2.8Å; G165-A167 VanDerWaalsContact C-N 3.33Å; A167-Y169 PolarHBondContact O-N 2.85Å; A167-L170 PolarHBondContact O-N 2.83Å; A167-F171 WeakPolarHBondContact O-CB 3.18Å; A167-F171 PolarHBondContact O-N 3.48Å
168	E	97	Very high	94.4	Very high	24 Å²	24	64.4 Å²	64.4	11%	0.112	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-35.9	-178	-55.8	-161.2	150.2	0	0	111.7	L49 S96 G97 L98 L156 A161 F171 D172	L49-E168 HydrophobicContact CD1-CB 4.04Å; S96-E168 WeakPolarHBondContact CB-OE1 3.45Å; G97-E168 VanDerWaalsContact CA-OE1 3.29Å; G97-E168 WeakPolarHBondContact CA-OE1 3.48Å; G97-E168 VanDerWaalsContact N-CD 3.28Å; G97-E168 PolarHBondContact N-OE1 3.14Å; G97-E168 PolarHBondContact N-OE2 3.05Å; L98-E168 PolarHBondContact N-OE1 2.89Å; L156-E168 HydrophobicContact CD2-CG 4.21Å; A161-E168 HydrophobicContact CB-CG 3.81Å; E168-F171 PolarHBondContact O-N 3.23Å; E168-D172 VanDerWaalsContact O-CB 3.29Å; E168-D172 WeakPolarHBondContact O-CB 3.38Å; E168-D172 PolarHBondContact O-N 3.49Å
169	Y	97.6	Very high	92.6	Very high	122 Å²	122	59.6 Å²	59.6	48%	0.478	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-47.6	174.5	178.2	-94.8	0	0	0	112.3	A167 F171 D172 K173	A167-Y169 PolarHBondContact O-N 2.85Å; Y169-F171 VanDerWaalsContact C-N 3.34Å; Y169-D172 PolarHBondContact O-N 3.39Å; Y169-K173 HydrophobicContact CE1-CG 4.34Å; Y169-K173 WeakPolarHBondContact O-CG 3.32Å; Y169-K173 PolarHBondContact O-N 2.98Å
170	L	97.7	Very high	90.2	Very high	72 Å²	72	60.5 Å²	60.5	38%	0.377	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-37.6	178.2	-71.3	173.8	0	0	0	111.5	M159 L166 A167 K173 H174	M159-L170 HydrophobicContact CE-CB 3.93Å; L166-L170 WeakPolarHBondContact O-CB 3.29Å; L166-L170 VanDerWaalsContact O-CG 3.28Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 2.96Å; A167-L170 PolarHBondContact O-N 2.83Å; L170-K173 PolarHBondContact O-N 3.43Å; L170-H174 WeakPolarHBondContact O-CB 3.28Å; L170-H174 PolarHBondContact O-CD2 3.11Å; L170-H174 VanDerWaalsContact O-CD2 3.28Å; L170-H174 PolarHBondContact O-N 3.37Å
171	F	97.8	Very high	87.6	Confident	1 Å²	1	65.6 Å²	65.6	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-45	176.2	-173.1	-86.6	0	0	0	111.8	F52 M101 H152 N155 L156 M159 A167 E168 Y169 K173 H174 T175 L176	F52-F171 HydrophobicContact CE1-CD1 4.36Å; F52-F171 HydrophobicContact CE1-CE1 4.37Å; F52-F171 AromaticContact CE2-CD1 3.67Å; F52-F171 HydrophobicContact CE2-CD1 3.67Å; F52-F171 HydrophobicContact CE2-CE1 4.38Å; F52-F171 AromaticContact CZ-CD1 3.4Å; F52-F171 HydrophobicContact CZ-CD1 3.4Å; F52-F171 VanDerWaalsContact CZ-CD1 3.4Å; F52-F171 AromaticContact CZ-CE1 3.82Å; F52-F171 HydrophobicContact CZ-CE1 3.82Å; F52-F171 HydrophobicContact CZ-CG 4.42Å; M101-F171 HydrophobicContact CE-CE1 4.44Å; H152-F171 HydrophobicContact CB-CE1 4.49Å; H152-F171 HydrophobicContact CB-CE2 4.48Å; H152-F171 HydrophobicContact CB-CZ 3.68Å; H152-F171 AromaticContact CG-CZ 3.69Å; H152-F171 AromaticContact ND1-CZ 3.62Å; N155-F171 HydrophobicContact CB-CD2 4.29Å; N155-F171 HydrophobicContact CB-CE2 3.91Å; L156-F171 HydrophobicContact CD1-CD1 4.41Å; L156-F171 HydrophobicContact CD1-CE1 4.24Å; L156-F171 HydrophobicContact CD1-CZ 4.36Å; L156-F171 HydrophobicContact CD2-CB 3.75Å; L156-F171 HydrophobicContact CD2-CD1 3.92Å; L156-F171 HydrophobicContact CD2-CD2 3.89Å; L156-F171 HydrophobicContact CD2-CE2 4.49Å; L156-F171 HydrophobicContact CD2-CG 3.56Å; L156-F171 HydrophobicContact CG-CD1 4.25Å; L156-F171 HydrophobicContact CG-CD2 3.93Å; L156-F171 HydrophobicContact CG-CE1 4.36Å; L156-F171 HydrophobicContact CG-CE2 4.07Å; L156-F171 HydrophobicContact CG-CG 4.02Å; L156-F171 HydrophobicContact CG-CZ 4.28Å; M159-F171 HydrophobicContact CE-CB 4.28Å; M159-F171 HydrophobicContact SD-CB 4.43Å; M159-F171 HydrophobicContact SD-CD2 4.22Å; A167-F171 WeakPolarHBondContact O-CB 3.18Å; A167-F171 PolarHBondContact O-N 3.48Å; E168-F171 PolarHBondContact O-N 3.23Å; Y169-F171 VanDerWaalsContact C-N 3.34Å; F171-K173 PolarHBondContact O-N 2.89Å; F171-H174 PolarHBondContact O-N 2.91Å; F171-T175 HydrophobicContact CD2-CG2 4.41Å; F171-T175 HydrophobicContact CE1-CG2 4.21Å; F171-T175 HydrophobicContact CE2-CG2 3.71Å; F171-T175 HydrophobicContact CZ-CG2 3.6Å; F171-T175 WeakPolarHBondContact O-CB 3.44Å; F171-T175 PolarHBondContact O-N 3.45Å; F171-L176 HydrophobicContact CD1-CD1 4.2Å; F171-L176 HydrophobicContact CD1-CG 4.07Å; F171-L176 HydrophobicContact CE1-CD1 3.93Å; F171-L176 HydrophobicContact CE1-CD2 4Å; F171-L176 HydrophobicContact CE1-CG 3.69Å; F171-L176 PolarHBondContact O-N 3.3Å
172	D	97.6	Very high	84.8	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	40%	0.403	C	S	.	.	H	α-helix	trans	-53.2	-43.2	174.1	178.4	83.4	0	0	0	111	L49 N51 F52 E168 Y169 G177	L49-D172 HydrophobicContact CD2-CB 4.19Å; N51-D172 VanDerWaalsContact CA-OD1 3.3Å; N51-D172 WeakPolarHBondContact CA-OD1 3.22Å; N51-D172 VanDerWaalsContact CB-O 3.29Å; N51-D172 WeakPolarHBondContact CB-O 3.44Å; N51-D172 VanDerWaalsContact CB-OD1 3.26Å; N51-D172 WeakPolarHBondContact CB-OD1 3.48Å; N51-D172 PolarHBondContact N-OD1 2.95Å; N51-D172 PolarHBondContact ND2-O 3.11Å; F52-D172 HydrophobicContact CD2-CB 3.87Å; F52-D172 HydrophobicContact CE2-CB 4.01Å; F52-D172 PolarHBondContact N-OD1 3.29Å; E168-D172 VanDerWaalsContact O-CB 3.29Å; E168-D172 WeakPolarHBondContact O-CB 3.38Å; E168-D172 PolarHBondContact O-N 3.49Å; Y169-D172 PolarHBondContact O-N 3.39Å; D172-G177 PolarHBondContact O-N 3.29Å; D172-G177 VanDerWaalsContact O-N 3.1Å
173	K	96.4	Very high	82	Confident	80 Å²	80	79.2 Å²	79.2	35%	0.348	44%	0.439	S	S	.	.	H	α-helix	trans	-79.4	-43.2	-178.6	-59.8	-53.9	172.4	-141.3	0	114.4	Y169 L170 F171 G177	Y169-K173 HydrophobicContact CE1-CG 4.34Å; Y169-K173 WeakPolarHBondContact O-CG 3.32Å; Y169-K173 PolarHBondContact O-N 2.98Å; L170-K173 PolarHBondContact O-N 3.43Å; F171-K173 PolarHBondContact O-N 2.89Å; K173-G177 WeakPolarHBondContact O-CA 3.37Å
174	H	95.6	Very high	81.3	Confident	128 Å²	128	75.1 Å²	75.1	59%	0.593	42%	0.422	S	S	*	.	H	α-helix	trans	-97.7	-22.6	-168.1	-69.7	-65.3	0	0	0	114.5	L170 F171	L170-H174 WeakPolarHBondContact O-CB 3.28Å; L170-H174 PolarHBondContact O-CD2 3.11Å; L170-H174 VanDerWaalsContact O-CD2 3.28Å; L170-H174 PolarHBondContact O-N 3.37Å; F171-H174 PolarHBondContact O-N 2.91Å
175	T	96.2	Very high	80.6	Confident	58 Å²	58	76.4 Å²	76.4	36%	0.356	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-48.9	179.1	-56.2	0	0	0	0	110.6	F171	F171-T175 HydrophobicContact CD2-CG2 4.41Å; F171-T175 HydrophobicContact CE1-CG2 4.21Å; F171-T175 HydrophobicContact CE2-CG2 3.71Å; F171-T175 HydrophobicContact CZ-CG2 3.6Å; F171-T175 WeakPolarHBondContact O-CB 3.44Å; F171-T175 PolarHBondContact O-N 3.45Å
176	L	96.5	Very high	80.6	Confident	7 Å²	7	76.9 Å²	76.9	4%	0.037	41%	0.412	C	S	.	.	S	Bend	trans	-88.8	-13.3	-179.2	-56.7	-176.6	0	0	0	113.5	N51 F52 Y55 M101 F171 S179	N51-L176 HydrophobicContact CB-CB 3.74Å; F52-L176 HydrophobicContact CB-CD1 4.21Å; F52-L176 HydrophobicContact CD1-CD1 3.7Å; F52-L176 HydrophobicContact CD2-CD1 3.59Å; F52-L176 HydrophobicContact CE1-CD1 3.92Å; F52-L176 HydrophobicContact CE2-CD1 3.82Å; F52-L176 HydrophobicContact CG-CD1 3.54Å; F52-L176 HydrophobicContact CZ-CD1 3.99Å; Y55-L176 HydrophobicContact CD2-CD2 3.91Å; Y55-L176 HydrophobicContact CE2-CD2 4.39Å; Y55-L176 HydrophobicContact CG-CD2 4.07Å; M101-L176 HydrophobicContact CE-CD1 4.01Å; M101-L176 HydrophobicContact CE-CD2 4.3Å; F171-L176 HydrophobicContact CD1-CD1 4.2Å; F171-L176 HydrophobicContact CD1-CG 4.07Å; F171-L176 HydrophobicContact CE1-CD1 3.93Å; F171-L176 HydrophobicContact CE1-CD2 4Å; F171-L176 HydrophobicContact CE1-CG 3.69Å; F171-L176 PolarHBondContact O-N 3.3Å; L176-S179 PolarHBondContact O-OG 3.28Å
177	G	88.4	Confident	79.7	Confident	17 Å²	17	74.3 Å²	74.3	18%	0.175	40%	0.399	C	S	.	.	S	Bend	trans	-79.3	-20.4	179.8	0	0	0	0	0	114.7	N51 D172 K173 S179	N51-G177 VanDerWaalsContact ND2-CA 3.34Å; N51-G177 WeakPolarHBondContact ND2-CA 3.26Å; D172-G177 PolarHBondContact O-N 3.29Å; D172-G177 VanDerWaalsContact O-N 3.1Å; K173-G177 WeakPolarHBondContact O-CA 3.37Å; G177-S179 VanDerWaalsContact C-N 3.31Å; G177-S179 PolarHBondContact O-N 3.11Å
178	D	72.3	Confident	78.6	Confident	100 Å²	100	78.8 Å²	78.8	54%	0.535	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-81.8	-8.5	-176.4	-78.2	-15.8	0	0	0	113.4	D180 N181	D178-D180 PolarHBondContact O-N 2.88Å; D178-N181 PolarHBondContact O-N 3Å; D178-N181 VanDerWaalsContact O-N 3.11Å
179	S	59.6	Low	77.4	Confident	69 Å²	69	82.4 Å²	82.4	48%	0.483	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-63.2	-9.4	178	66	0	0	0	0	113.9	L176 G177	L176-S179 PolarHBondContact O-OG 3.28Å; G177-S179 VanDerWaalsContact C-N 3.31Å; G177-S179 PolarHBondContact O-N 3.11Å
180	D	48.9	Very low	75.9	Confident	89 Å²	89	79.6 Å²	79.6	48%	0.476	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-81.7	-10.8	175.3	-87.8	-45.2	0	0	0	114.6	K54 D178	K54-D180 IonicContact NZ-OD1 3.38Å; K54-D180 PolarHBondContact NZ-OD1 2.63Å; K54-D180 IonicContact NZ-OD2 3.68Å; K54-D180 PolarHBondContact NZ-OD2 2.88Å; D178-D180 PolarHBondContact O-N 2.88Å
181	N	42.5	Very low	74.2	Confident	136 Å²	136	80.2 Å²	80.2	73%	0.727	45%	0.445	S	S	*	.	S	Bend	trans	-95.4	-0.3	-175.6	-73.4	-36.1	0	0	0	114.4	D178	D178-N181 PolarHBondContact O-N 3Å; D178-N181 VanDerWaalsContact O-N 3.11Å
182	E	38.3	Very low	72.3	Confident	190 Å²	190	86.8 Å²	86.8	89%	0.888	48%	0.482	S	S	*	.			trans	-120.5	14.1	-176.6	-67.1	-164.4	160.6	0	0	115.2
183	S	35	Very low	70	Confident	166 Å²	166	94.5 Å²	94.5	100%	1.161	53%	0.525	S	S	*	.			trans	-95.9	0	170.7	54.6	0	0	0	0	113.8

Retrieved 183 of 183 residues in 40 ms (Link to these results)

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