A0A087WWH0_HUMAN Loading...

Large ribosomal subunit protein uL22

AlphaFold DB , UniProt , Accession A0A087WWH0, Species HUMAN (Homo sapiens, Human), Gene RPL17, Length 131 aa.

						>A0A087WWH0_HUMAN|A0A087WWH0|RPL17
MVRYSLDPENPTKSCKSRGSNLRVHFKNTRETAQAIKGMHIRKATKYLKDVTLQKQCVPFRRYNGGVGRCAQAKQWGWTQGRWPKKSAEFLLHMLKNAESNAELKGLDVDSLVIEHIQVNKAPKMRRRTYR
					

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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	59.6	Low	85.9	Confident	242 Å²	242	117 Å²	117	100%	1.192	59%	0.587	S	S	*	*				0	128.1	0	-159.3	178	-133.1	0	0	108.3
2	V	71.3	Confident	86.3	Confident	89 Å²	89	115.8 Å²	115.8	54%	0.539	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-81.7	126	-177.9	179.3	0	0	0	0	109.2
3	R	85.5	Confident	86.7	Confident	237 Å²	237	118.5 Å²	118.5	89%	0.894	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-78.1	139.7	178.7	-66	-177.9	179.8	171.7	-1.3	110.5
4	Y	91.9	Very high	87.1	Confident	87 Å²	87	112 Å²	112	34%	0.341	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-77.3	156.1	167.1	-66	-92.7	0	0	0	108.7	K16 R18	Y4-K16 HydrophobicContact CD2-CD 3.69Å; Y4-K16 HydrophobicContact CE1-CB 4.34Å; Y4-K16 HydrophobicContact CE2-CB 4.2Å; Y4-K16 HydrophobicContact CE2-CD 3.64Å; Y4-K16 HydrophobicContact CE2-CG 4.5Å; Y4-K16 HydrophobicContact CG-CD 4.21Å; Y4-R18 HydrophobicContact CE1-CB 4.1Å
5	S	91.6	Very high	87.5	Confident	80 Å²	80	106.7 Å²	106.7	56%	0.559	54%	0.544	S	S	*	.	S	Bend	trans	-76.2	-27.1	176.7	52.1	0	0	0	0	113.3	H116 Q118	S5-H116 PolarHBondContact OG-CE1 3.08Å; S5-Q118 PolarHBondContact OG-OE1 3.35Å
6	L	92.4	Very high	87.9	Confident	78 Å²	78	104.6 Å²	104.6	41%	0.408	53%	0.53	S	S	.	.	S	Bend	trans	-127.2	132.7	179.1	-172.7	74.6	0	0	0	108.4	H116	L6-H116 HydrophobicContact CD2-CB 3.63Å
7	D	90.1	Very high	88.2	Confident	115 Å²	115	100.3 Å²	100.3	62%	0.615	51%	0.511	S	S	*	.			trans	-97.9	139	168.1	-75.9	-53.7	0	0	0	109.9	K16	D7-K16 IonicContact OD1-NZ 2.68Å; D7-K16 PolarHBondContact OD1-NZ 3.4Å
8	P	91.5	Very high	88.6	Confident	22 Å²	22	101.5 Å²	101.5	14%	0.143	51%	0.509	C	S	.	.			trans	-66.5	145	177.1	29	-34.1	0	0	0	109.3	N10 S14	P8-N10 PolarHBondContact O-N 3.3Å; P8-S14 VanDerWaalsContact CB-OG 3.28Å; P8-S14 WeakPolarHBondContact CB-OG 3.26Å
9	E	90.4	Very high	88.7	Confident	192 Å²	192	98.1 Å²	98.1	90%	0.897	50%	0.502	S	S	*	.	S	Bend	trans	-56.1	-41.3	175.3	-173.1	177.5	-171.5	0	0	111.4
10	N	91.4	Very high	88.9	Confident	64 Å²	64	96.4 Å²	96.4	34%	0.342	50%	0.499	S	S	.	.			trans	-119.5	102.5	174.4	-167.2	-27.1	0	0	0	112.2	P8 T12 K13 S14	P8-N10 PolarHBondContact O-N 3.3Å; N10-T12 VanDerWaalsContact C-N 3.31Å; N10-T12 PolarHBondContact O-N 2.8Å; N10-T12 PolarHBondContact OD1-N 2.72Å; N10-T12 VanDerWaalsContact OD1-N 3.09Å; N10-T12 PolarHBondContact OD1-OG1 3.34Å; N10-K13 HydrophobicContact CB-CB 4.28Å; N10-K13 PolarHBondContact O-N 3.39Å; N10-K13 PolarHBondContact OD1-N 3.29Å; N10-S14 VanDerWaalsContact O-CB 3.26Å; N10-S14 WeakPolarHBondContact O-CB 3.28Å; N10-S14 PolarHBondContact O-N 3.09Å; N10-S14 PolarHBondContact O-OG 2.68Å
11	P	89.3	Confident	89.1	Confident	81 Å²	81	98 Å²	98	53%	0.526	51%	0.508	S	S	.	.	S	Bend	trans	-64.7	-27.1	-179.8	-24.2	34.4	0	0	0	115.4	K105	P11-K105 PolarHBondContact O-NZ 3.4Å
12	T	90.3	Very high	90.7	Very high	103 Å²	103	89.9 Å²	89.9	63%	0.632	47%	0.47	S	S	*	.	S	Bend	trans	-77	-36.4	-179.3	62.4	0	0	0	0	110.9	N10 S14	N10-T12 VanDerWaalsContact C-N 3.31Å; N10-T12 PolarHBondContact O-N 2.8Å; N10-T12 PolarHBondContact OD1-N 2.72Å; N10-T12 VanDerWaalsContact OD1-N 3.09Å; N10-T12 PolarHBondContact OD1-OG1 3.34Å; T12-S14 VanDerWaalsContact C-N 3.33Å
13	K	92	Very high	91.7	Very high	150 Å²	150	93.3 Å²	93.3	65%	0.652	47%	0.473	S	S	*	.	S	Bend	trans	-87.4	6.1	177.4	-64.2	-170.7	177.4	-176.4	0	114.8	N10	N10-K13 HydrophobicContact CB-CB 4.28Å; N10-K13 PolarHBondContact O-N 3.39Å; N10-K13 PolarHBondContact OD1-N 3.29Å
14	S	92.6	Very high	92.2	Very high	28 Å²	28	83.6 Å²	83.6	20%	0.196	44%	0.44	C	S	.	.			trans	-125.3	142.2	-174.9	-57.4	0	0	0	0	112.3	P8 N10 T12 K105	P8-S14 VanDerWaalsContact CB-OG 3.28Å; P8-S14 WeakPolarHBondContact CB-OG 3.26Å; N10-S14 VanDerWaalsContact O-CB 3.26Å; N10-S14 WeakPolarHBondContact O-CB 3.28Å; N10-S14 PolarHBondContact O-N 3.09Å; N10-S14 PolarHBondContact O-OG 2.68Å; T12-S14 VanDerWaalsContact C-N 3.33Å; S14-K105 PolarHBondContact O-NZ 3.21Å
15	C	93.3	Very high	92.3	Very high	32 Å²	32	84.4 Å²	84.4	22%	0.216	45%	0.446	C	S	.	.			trans	-108.4	156	170.1	65.3	0	0	0	0	110.8	N101 A102	C15-N101 HydrophobicContact CB-CB 4.24Å; C15-A102 HydrophobicContact CB-CB 4.17Å
16	K	93.1	Very high	92.6	Very high	74 Å²	74	82.8 Å²	82.8	32%	0.322	43%	0.429	S	S	.	.			trans	-126.5	142.3	177.1	-61.1	-175.8	-179.7	-176.9	0	108.9	Y4 D7 N101	Y4-K16 HydrophobicContact CD2-CD 3.69Å; Y4-K16 HydrophobicContact CE1-CB 4.34Å; Y4-K16 HydrophobicContact CE2-CB 4.2Å; Y4-K16 HydrophobicContact CE2-CD 3.64Å; Y4-K16 HydrophobicContact CE2-CG 4.5Å; Y4-K16 HydrophobicContact CG-CD 4.21Å; D7-K16 IonicContact OD1-NZ 2.68Å; D7-K16 PolarHBondContact OD1-NZ 3.4Å; K16-N101 PolarHBondContact O-ND2 2.76Å
17	S	94	Very high	92.8	Very high	31 Å²	31	83.9 Å²	83.9	22%	0.217	43%	0.431	C	S	.	.			trans	-138.2	151.6	170.7	72.7	0	0	0	0	110.2	M94	S17-M94 WeakPolarHBondContact OG-CG 3.33Å; S17-M94 PolarHBondContact OG-O 3.13Å
18	R	93.9	Very high	93.1	Very high	122 Å²	122	80.2 Å²	80.2	46%	0.46	41%	0.411	S	S	.	.			trans	-152.7	138.2	-175.4	-174.3	-178.4	68.2	119.4	1.5	111.6	Y4 S20	Y4-R18 HydrophobicContact CE1-CB 4.1Å; R18-S20 PolarHBondContact NH1-OG 2.92Å
19	G	92.2	Very high	93.4	Very high	37 Å²	37	79.6 Å²	79.6	38%	0.381	41%	0.407	S	S	.	.			trans	-114.3	141.4	163.1	0	0	0	0	0	110.9
20	S	92.7	Very high	93.8	Very high	64 Å²	64	72.1 Å²	72.1	45%	0.448	37%	0.371	S	S	.	.			trans	-121.4	145	178.4	-61.1	0	0	0	0	110.8	R18 L22	R18-S20 PolarHBondContact NH1-OG 2.92Å; S20-L22 PolarHBondContact O-N 3.44Å; S20-L22 VanDerWaalsContact O-N 3.15Å
21	N	92	Very high	94.1	Very high	129 Å²	129	69.3 Å²	69.3	69%	0.69	36%	0.356	S	S	*	.	S	Bend	trans	50.7	37.7	178.3	-62.1	-32.8	0	0	0	114.2	R23	N21-R23 PolarHBondContact O-N 3.44Å
22	L	92.8	Very high	94.5	Very high	73 Å²	73	65.5 Å²	65.5	38%	0.382	33%	0.33	S	S	.	.			trans	-65.1	133.8	-178.2	-60.1	177.6	0	0	0	111.3	S20 V24 F90	S20-L22 PolarHBondContact O-N 3.44Å; S20-L22 VanDerWaalsContact O-N 3.15Å; L22-V24 HydrophobicContact CB-CG2 3.92Å; L22-V24 PolarHBondContact O-N 2.99Å; L22-F90 HydrophobicContact CD2-CD1 4.35Å; L22-F90 HydrophobicContact CD2-CE1 4.43Å
23	R	92.8	Very high	94.8	Very high	161 Å²	161	60.7 Å²	60.7	61%	0.608	30%	0.301	S	S	*	.	S	Bend	trans	-83.8	60.2	-179.8	-165.2	161.3	170.9	-173.3	-13.2	112.1	N21 K86	N21-R23 PolarHBondContact O-N 3.44Å; R23-K86 WeakPolarHBondContact O-CE 3.13Å; R23-K86 PolarHBondContact O-NZ 3.07Å
24	V	95.2	Very high	95	Very high	32 Å²	32	57.5 Å²	57.5	19%	0.194	29%	0.289	C	S	.	.	S	Bend	trans	-127.2	160.8	-179.6	-64.8	0	0	0	0	111.4	L22 F26 T29 K86 F90	L22-V24 HydrophobicContact CB-CG2 3.92Å; L22-V24 PolarHBondContact O-N 2.99Å; V24-F26 PolarHBondContact O-N 3.21Å; V24-T29 HydrophobicContact CG2-CG2 4.31Å; V24-T29 VanDerWaalsContact CG2-OG1 3.26Å; V24-T29 WeakPolarHBondContact CG2-OG1 3.39Å; V24-K86 HydrophobicContact CG1-CD 4.46Å; V24-K86 HydrophobicContact CG1-CG 4.25Å; V24-F90 HydrophobicContact CG1-CB 4.23Å; V24-F90 HydrophobicContact CG1-CD1 4.41Å; V24-F90 HydrophobicContact CG1-CD2 3.1Å; V24-F90 HydrophobicContact CG1-CE2 3.42Å; V24-F90 VanDerWaalsContact CG1-CE2 3.42Å; V24-F90 HydrophobicContact CG1-CG 3.66Å; V24-F90 HydrophobicContact CG1-CZ 4.2Å
25	H	95.6	Very high	95.2	Very high	105 Å²	105	56.8 Å²	56.8	49%	0.486	28%	0.284	S	S	.	.			trans	-75.1	112.4	176.6	-171.3	-103.7	0	0	0	110.3	K27 N28 T29	H25-K27 VanDerWaalsContact C-N 3.34Å; H25-K27 PolarHBondContact O-N 3.19Å; H25-N28 HydrophobicContact CB-CB 4.28Å; H25-N28 PolarHBondContact ND1-N 3.39Å; H25-N28 PolarHBondContact ND1-OD1 2.8Å; H25-N28 PolarHBondContact O-N 3.11Å; H25-N28 VanDerWaalsContact O-N 3.12Å; H25-T29 PolarHBondContact O-N 3.04Å; H25-T29 PolarHBondContact O-OG1 2.7Å
26	F	96.7	Very high	95.3	Very high	45 Å²	45	55.2 Å²	55.2	20%	0.197	27%	0.274	C	S	.	.	H	α-helix	trans	-48.8	-50	-175.3	167.8	-102.6	0	0	0	113.7	V24 N28 T29 R30 Y63 V119 N120 K121	V24-F26 PolarHBondContact O-N 3.21Å; F26-N28 VanDerWaalsContact C-N 3.32Å; F26-N28 PolarHBondContact O-N 3.25Å; F26-T29 PolarHBondContact O-N 2.52Å; F26-R30 WeakPolarHBondContact O-CB 3.07Å; F26-R30 PolarHBondContact O-N 3.45Å; F26-Y63 HydrophobicContact CE1-CE2 4.05Å; F26-Y63 AromaticContact CE1-CZ 3.96Å; F26-Y63 WeakPolarHBondContact CE1-OH 3.34Å; F26-V119 HydrophobicContact CD2-CG1 3.88Å; F26-V119 HydrophobicContact CE2-CG1 3.87Å; F26-V119 WeakPolarHBondContact CE2-O 2.9Å; F26-N120 WeakPolarHBondContact CD2-O 3.4Å; F26-N120 VanDerWaalsContact CE2-C 3.41Å; F26-K121 HydrophobicContact CD1-CD 4.45Å; F26-K121 HydrophobicContact CD1-CG 3.78Å; F26-K121 HydrophobicContact CD2-CB 4.45Å; F26-K121 HydrophobicContact CD2-CG 3.81Å; F26-K121 HydrophobicContact CE1-CD 4.18Å; F26-K121 VanDerWaalsContact CE1-CE 3.48Å; F26-K121 HydrophobicContact CE1-CG 3.61Å; F26-K121 HydrophobicContact CE2-CB 4.43Å; F26-K121 HydrophobicContact CE2-CG 3.65Å; F26-K121 HydrophobicContact CG-CG 3.88Å; F26-K121 HydrophobicContact CZ-CD 4.42Å; F26-K121 HydrophobicContact CZ-CG 3.55Å
27	K	97.4	Very high	95.5	Very high	101 Å²	101	56.3 Å²	56.3	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-38.7	-175.5	-62.6	-179.7	174.8	-178.6	0	111.9	H25 R30 E31 Y63	H25-K27 VanDerWaalsContact C-N 3.34Å; H25-K27 PolarHBondContact O-N 3.19Å; K27-R30 PolarHBondContact O-N 3.01Å; K27-E31 WeakPolarHBondContact O-CG 3.27Å; K27-E31 PolarHBondContact O-N 3.19Å; K27-Y63 HydrophobicContact CB-CD1 4.37Å; K27-Y63 HydrophobicContact CB-CD2 3.73Å; K27-Y63 HydrophobicContact CB-CE2 4.39Å; K27-Y63 HydrophobicContact CB-CG 3.72Å; K27-Y63 HydrophobicContact CD-CD1 3.71Å; K27-Y63 HydrophobicContact CD-CE1 4.3Å; K27-Y63 HydrophobicContact CD-CG 3.86Å; K27-Y63 HydrophobicContact CG-CD1 3.8Å; K27-Y63 HydrophobicContact CG-CD2 3.88Å; K27-Y63 HydrophobicContact CG-CE1 4.13Å; K27-Y63 HydrophobicContact CG-CE2 4.2Å; K27-Y63 HydrophobicContact CG-CG 3.66Å
28	N	97.2	Very high	95.5	Very high	38 Å²	38	57.4 Å²	57.4	20%	0.203	30%	0.295	C	S	.	.	H	α-helix	trans	-69.3	-46.2	-179.8	-63.7	6.9	0	0	0	109.9	H25 F26 R30 E31 T32 F60 P84	H25-N28 HydrophobicContact CB-CB 4.28Å; H25-N28 PolarHBondContact ND1-N 3.39Å; H25-N28 PolarHBondContact ND1-OD1 2.8Å; H25-N28 PolarHBondContact O-N 3.11Å; H25-N28 VanDerWaalsContact O-N 3.12Å; F26-N28 VanDerWaalsContact C-N 3.32Å; F26-N28 PolarHBondContact O-N 3.25Å; N28-R30 PolarHBondContact O-N 2.92Å; N28-E31 PolarHBondContact O-N 3.17Å; N28-T32 WeakPolarHBondContact O-CG2 3.45Å; N28-T32 PolarHBondContact O-N 3.46Å; N28-T32 PolarHBondContact O-OG1 3.37Å; N28-F60 HydrophobicContact CB-CZ 4.42Å; N28-P84 HydrophobicContact CB-CB 3.88Å
29	T	97.4	Very high	95.7	Very high	10 Å²	10	52.7 Å²	52.7	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-34.7	179.1	-52.9	0	0	0	0	111.8	V24 H25 F26 T32 A33 S87 V119	V24-T29 HydrophobicContact CG2-CG2 4.31Å; V24-T29 VanDerWaalsContact CG2-OG1 3.26Å; V24-T29 WeakPolarHBondContact CG2-OG1 3.39Å; H25-T29 PolarHBondContact O-N 3.04Å; H25-T29 PolarHBondContact O-OG1 2.7Å; F26-T29 PolarHBondContact O-N 2.52Å; T29-T32 VanDerWaalsContact C-OG1 3.3Å; T29-T32 WeakPolarHBondContact CA-OG1 3.5Å; T29-T32 PolarHBondContact O-OG1 2.72Å; T29-A33 WeakPolarHBondContact O-CB 3.48Å; T29-A33 PolarHBondContact O-N 3.21Å; T29-S87 PolarHBondContact N-OG 3.46Å; T29-S87 PolarHBondContact OG1-OG 3.21Å; T29-V119 HydrophobicContact CG2-CG1 4.27Å; T29-V119 HydrophobicContact CG2-CG2 4.42Å
30	R	97.8	Very high	95.9	Very high	35 Å²	35	55.5 Å²	55.5	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-63.6	-49.2	175.3	-173.8	-86.9	175.9	169.7	-8.1	111.9	F26 K27 N28 A33 Q34 Y63 V119	F26-R30 WeakPolarHBondContact O-CB 3.07Å; F26-R30 PolarHBondContact O-N 3.45Å; K27-R30 PolarHBondContact O-N 3.01Å; N28-R30 PolarHBondContact O-N 2.92Å; R30-A33 PolarHBondContact O-N 3.44Å; R30-Q34 WeakPolarHBondContact O-CB 3.48Å; R30-Q34 PolarHBondContact O-N 3.38Å; R30-Y63 HydrophobicContact CB-CE2 4.27Å; R30-Y63 HydrophobicContact CG-CE2 4.15Å; R30-V119 HydrophobicContact CB-CB 4.35Å; R30-V119 HydrophobicContact CB-CG1 4.41Å
31	E	97.6	Very high	96	Very high	5 Å²	5	52.8 Å²	52.8	2%	0.023	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-39.8	-179.6	-58.4	-56.7	133.6	0	0	111.1	K27 N28 Q34 A35 V58 F60 R61 R62 Y63	K27-E31 WeakPolarHBondContact O-CG 3.27Å; K27-E31 PolarHBondContact O-N 3.19Å; N28-E31 PolarHBondContact O-N 3.17Å; E31-Q34 PolarHBondContact O-N 3.03Å; E31-A35 PolarHBondContact O-N 3.28Å; E31-A35 VanDerWaalsContact O-N 3.1Å; E31-V58 HydrophobicContact CB-CG1 4.23Å; E31-F60 HydrophobicContact CB-CD1 4.32Å; E31-F60 HydrophobicContact CB-CD2 4.44Å; E31-F60 HydrophobicContact CB-CE1 4.42Å; E31-F60 HydrophobicContact CB-CG 4.33Å; E31-F60 HydrophobicContact CG-CB 4.42Å; E31-F60 HydrophobicContact CG-CD1 3.79Å; E31-F60 HydrophobicContact CG-CE1 4.16Å; E31-F60 HydrophobicContact CG-CG 4.05Å; E31-R61 PolarHBondContact OE2-N 2.9Å; E31-R62 PolarHBondContact OE1-N 3.42Å; E31-R62 PolarHBondContact OE2-N 3.01Å; E31-Y63 WeakPolarHBondContact OE1-CD2 3.5Å; E31-Y63 PolarHBondContact OE1-N 3.33Å
32	T	97.3	Very high	96.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-43.6	175.3	50.7	0	0	0	0	112.8	N28 T29 Q34 A35 I36 V58 P84 L91	N28-T32 WeakPolarHBondContact O-CG2 3.45Å; N28-T32 PolarHBondContact O-N 3.46Å; N28-T32 PolarHBondContact O-OG1 3.37Å; T29-T32 VanDerWaalsContact C-OG1 3.3Å; T29-T32 WeakPolarHBondContact CA-OG1 3.5Å; T29-T32 PolarHBondContact O-OG1 2.72Å; T32-Q34 VanDerWaalsContact C-N 3.35Å; T32-A35 PolarHBondContact O-N 3.22Å; T32-I36 PolarHBondContact O-N 2.74Å; T32-V58 HydrophobicContact CG2-CB 4.35Å; T32-V58 HydrophobicContact CG2-CG1 3.9Å; T32-V58 HydrophobicContact CG2-CG2 3.81Å; T32-P84 HydrophobicContact CG2-CB 4.21Å; T32-P84 HydrophobicContact CG2-CG 3.16Å; T32-L91 VanDerWaalsContact OG1-CD1 3.27Å; T32-L91 WeakPolarHBondContact OG1-CD1 3.49Å
33	A	97.1	Very high	96.3	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-42.3	179.6	0	0	0	0	0	110.7	T29 R30 A35 I36 K37 L91 I117 V119	T29-A33 WeakPolarHBondContact O-CB 3.48Å; T29-A33 PolarHBondContact O-N 3.21Å; R30-A33 PolarHBondContact O-N 3.44Å; A33-A35 PolarHBondContact O-N 3.33Å; A33-I36 WeakPolarHBondContact O-CG1 3.42Å; A33-I36 PolarHBondContact O-N 3.43Å; A33-K37 PolarHBondContact O-N 2.61Å; A33-L91 HydrophobicContact CB-CD1 4.29Å; A33-L91 HydrophobicContact CB-CD2 4.42Å; A33-I117 HydrophobicContact CB-CD1 3.54Å; A33-I117 HydrophobicContact CB-CG1 3.95Å; A33-I117 WeakPolarHBondContact O-CG2 3.19Å; A33-V119 HydrophobicContact CB-CG2 3.49Å; A33-V119 VanDerWaalsContact CB-CG2 3.49Å
34	Q	96.8	Very high	96.5	Very high	83 Å²	83	49.2 Å²	49.2	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-33.7	177.5	-169.6	64.6	45	0	0	112.2	R30 E31 T32 I36 K37	R30-Q34 WeakPolarHBondContact O-CB 3.48Å; R30-Q34 PolarHBondContact O-N 3.38Å; E31-Q34 PolarHBondContact O-N 3.03Å; T32-Q34 VanDerWaalsContact C-N 3.35Å; Q34-I36 VanDerWaalsContact C-N 3.31Å; Q34-I36 PolarHBondContact O-N 2.9Å; Q34-K37 WeakPolarHBondContact O-CB 3.46Å; Q34-K37 PolarHBondContact O-N 3.04Å
35	A	96.1	Very high	96.5	Very high	13 Å²	13	48.8 Å²	48.8	11%	0.107	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-28.7	179.9	0	0	0	0	0	113.5	E31 T32 A33 M39 Y47 V58	E31-A35 PolarHBondContact O-N 3.28Å; E31-A35 VanDerWaalsContact O-N 3.1Å; T32-A35 PolarHBondContact O-N 3.22Å; A33-A35 PolarHBondContact O-N 3.33Å; A35-M39 WeakPolarHBondContact O-CE 3.45Å; A35-Y47 HydrophobicContact CB-CE1 4.04Å; A35-V58 HydrophobicContact CB-CG1 4.43Å
36	I	96.8	Very high	96.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-92.4	-4.6	179.1	61.5	172	0	0	0	113.7	T32 A33 Q34 G38 M39 A44 Y47 L48 L91 I114 I117	T32-I36 PolarHBondContact O-N 2.74Å; A33-I36 WeakPolarHBondContact O-CG1 3.42Å; A33-I36 PolarHBondContact O-N 3.43Å; Q34-I36 VanDerWaalsContact C-N 3.31Å; Q34-I36 PolarHBondContact O-N 2.9Å; I36-G38 PolarHBondContact O-N 3.14Å; I36-M39 HydrophobicContact CG2-SD 4.5Å; I36-M39 WeakPolarHBondContact O-CB 3.5Å; I36-M39 PolarHBondContact O-N 3.31Å; I36-A44 HydrophobicContact CB-CB 4.13Å; I36-A44 HydrophobicContact CG2-CB 4.19Å; I36-Y47 HydrophobicContact CG2-CD1 3.73Å; I36-Y47 HydrophobicContact CG2-CE1 4.07Å; I36-L48 HydrophobicContact CD1-CD1 4.28Å; I36-L48 HydrophobicContact CG2-CD1 4.39Å; I36-L48 HydrophobicContact CG2-CD2 3.98Å; I36-L48 HydrophobicContact CG2-CG 4.05Å; I36-L91 HydrophobicContact CD1-CD1 4.21Å; I36-I114 HydrophobicContact CB-CD1 4.29Å; I36-I114 HydrophobicContact CD1-CD1 4.19Å; I36-I114 HydrophobicContact CG1-CD1 4.39Å; I36-I117 HydrophobicContact CD1-CD1 3.83Å; I36-I117 HydrophobicContact CG1-CD1 4.05Å
37	K	96.1	Very high	96.6	Very high	97 Å²	97	48.7 Å²	48.7	42%	0.422	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	131.1	177.9	-169.2	-178.2	178.8	-176.8	0	109.9	A33 Q34 M39 E115 I117	A33-K37 PolarHBondContact O-N 2.61Å; Q34-K37 WeakPolarHBondContact O-CB 3.46Å; Q34-K37 PolarHBondContact O-N 3.04Å; K37-M39 VanDerWaalsContact C-N 3.33Å; K37-E115 WeakPolarHBondContact CE-O 3.49Å; K37-I117 HydrophobicContact CB-CG2 3.83Å; K37-I117 HydrophobicContact CD-CG2 4.35Å; K37-I117 HydrophobicContact CG-CG2 4.07Å
38	G	95.1	Very high	96.6	Very high	54 Å²	54	43.9 Å²	43.9	56%	0.557	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	5	-179	0	0	0	0	0	114.7	I36 I114	I36-G38 PolarHBondContact O-N 3.14Å; G38-I114 WeakPolarHBondContact CA-O 3.05Å; G38-I114 PolarHBondContact N-O 3.17Å
39	M	96.5	Very high	96.7	Very high	22 Å²	22	47.6 Å²	47.6	11%	0.108	23%	0.226	C	C	.	.			trans	-89.6	149.8	175.4	-65.4	-172.3	-177.1	0	0	111.9	A35 I36 K37 K43 A44 W76 I114	A35-M39 WeakPolarHBondContact O-CE 3.45Å; I36-M39 HydrophobicContact CG2-SD 4.5Å; I36-M39 WeakPolarHBondContact O-CB 3.5Å; I36-M39 PolarHBondContact O-N 3.31Å; K37-M39 VanDerWaalsContact C-N 3.33Å; M39-K43 HydrophobicContact SD-CG 4.43Å; M39-A44 HydrophobicContact CB-CB 4.09Å; M39-A44 HydrophobicContact SD-CB 4.48Å; M39-W76 HydrophobicContact CE-CH2 3.47Å; M39-W76 VanDerWaalsContact CE-CH2 3.47Å; M39-W76 HydrophobicContact CE-CZ2 4.47Å; M39-W76 HydrophobicContact CE-CZ3 4.09Å; M39-I114 PolarHBondContact O-N 3.37Å
40	H	96.5	Very high	96.7	Very high	97 Å²	97	48.4 Å²	48.4	45%	0.449	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-59.8	142.6	160.4	-71.3	-80.8	0	0	0	110.5	R42 K43 A44 L112 V113	H40-R42 VanDerWaalsContact C-N 3.31Å; H40-R42 PolarHBondContact O-N 2.76Å; H40-K43 HydrophobicContact CB-CB 4.43Å; H40-K43 WeakPolarHBondContact O-CB 3.37Å; H40-K43 PolarHBondContact O-N 2.89Å; H40-A44 PolarHBondContact O-N 3.37Å; H40-L112 WeakPolarHBondContact CA-O 3.32Å; H40-V113 WeakPolarHBondContact CE1-CG2 3.15Å; H40-V113 WeakPolarHBondContact ND1-CG2 3.36Å
41	I	94.8	Very high	96.7	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.036	22%	0.224	C	C	.	.	H	α-helix	trans	-55.7	-45.5	-175.9	-70.7	-171.6	0	0	0	111.6	K43 A44 T45 E99 L112 I114	I41-K43 VanDerWaalsContact C-N 3.33Å; I41-K43 PolarHBondContact O-N 3.46Å; I41-A44 PolarHBondContact O-N 3.03Å; I41-A44 VanDerWaalsContact O-N 3.17Å; I41-T45 WeakPolarHBondContact O-CB 3.45Å; I41-T45 PolarHBondContact O-N 3.28Å; I41-T45 PolarHBondContact O-OG1 3.03Å; I41-T45 VanDerWaalsContact O-OG1 3.09Å; I41-E99 HydrophobicContact CD1-CG 4.46Å; I41-E99 HydrophobicContact CG2-CG 3.75Å; I41-E99 WeakPolarHBondContact CG2-OE1 3.04Å; I41-L112 HydrophobicContact CB-CB 4.41Å; I41-L112 HydrophobicContact CD1-CB 3.46Å; I41-L112 VanDerWaalsContact CD1-CB 3.46Å; I41-L112 HydrophobicContact CD1-CD1 3.66Å; I41-L112 HydrophobicContact CD1-CG 4.2Å; I41-L112 HydrophobicContact CG1-CB 3.81Å; I41-L112 PolarHBondContact N-O 3.3Å; I41-I114 HydrophobicContact CG1-CG1 4.14Å
42	R	94.4	Very high	96.6	Very high	150 Å²	150	48 Å²	48	57%	0.566	23%	0.232	S	C	*	.	H	α-helix	trans	-56.9	-43.5	176.8	-75	-177.9	163.8	170.9	-4	113.2	H40 K46 D110	H40-R42 VanDerWaalsContact C-N 3.31Å; H40-R42 PolarHBondContact O-N 2.76Å; R42-K46 WeakPolarHBondContact O-CB 3.4Å; R42-K46 PolarHBondContact O-N 3.11Å; R42-D110 IonicContact CZ-OD1 3.14Å; R42-D110 IonicContact CZ-OD2 2.79Å; R42-D110 IonicContact NE-OD1 2.76Å; R42-D110 PolarHBondContact NE-OD1 2.85Å; R42-D110 VanDerWaalsContact NE-OD1 3.14Å; R42-D110 IonicContact NH1-OD1 3.33Å; R42-D110 PolarHBondContact NH1-OD1 3.27Å; R42-D110 IonicContact NH1-OD2 2.74Å; R42-D110 PolarHBondContact NH1-OD2 3Å; R42-D110 IonicContact NH2-OD1 2.98Å; R42-D110 PolarHBondContact NH2-OD1 2.91Å; R42-D110 IonicContact NH2-OD2 2.61Å; R42-D110 PolarHBondContact NH2-OD2 2.98Å
43	K	96.4	Very high	96.6	Very high	137 Å²	137	53.1 Å²	53.1	60%	0.596	26%	0.259	S	S	*	.	H	α-helix	trans	-67.2	-42.7	177.8	-174.8	176.6	180	177	0	111	M39 H40 I41 K46 Y47	M39-K43 HydrophobicContact SD-CG 4.43Å; H40-K43 HydrophobicContact CB-CB 4.43Å; H40-K43 WeakPolarHBondContact O-CB 3.37Å; H40-K43 PolarHBondContact O-N 2.89Å; I41-K43 VanDerWaalsContact C-N 3.33Å; I41-K43 PolarHBondContact O-N 3.46Å; K43-K46 PolarHBondContact O-N 2.97Å; K43-Y47 WeakPolarHBondContact O-CB 3.47Å; K43-Y47 PolarHBondContact O-N 3.32Å
44	A	96.9	Very high	96.6	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-45.3	176.5	0	0	0	0	0	111.7	I36 M39 H40 I41 K46 Y47 L48 L95 I114	I36-A44 HydrophobicContact CB-CB 4.13Å; I36-A44 HydrophobicContact CG2-CB 4.19Å; M39-A44 HydrophobicContact CB-CB 4.09Å; M39-A44 HydrophobicContact SD-CB 4.48Å; H40-A44 PolarHBondContact O-N 3.37Å; I41-A44 PolarHBondContact O-N 3.03Å; I41-A44 VanDerWaalsContact O-N 3.17Å; A44-K46 PolarHBondContact O-N 3.38Å; A44-Y47 PolarHBondContact O-N 2.92Å; A44-L48 WeakPolarHBondContact O-CB 3.49Å; A44-L48 VanDerWaalsContact O-CG 3.31Å; A44-L48 WeakPolarHBondContact O-CG 3.35Å; A44-L48 PolarHBondContact O-N 3.34Å; A44-L95 HydrophobicContact CB-CD1 3.92Å; A44-I114 HydrophobicContact CB-CD1 3.6Å
45	T	96.6	Very high	96.6	Very high	23 Å²	23	61.4 Å²	61.4	14%	0.141	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-44.5	177.1	-64.2	0	0	0	0	111.4	I41 K49 L92	I41-T45 WeakPolarHBondContact O-CB 3.45Å; I41-T45 PolarHBondContact O-N 3.28Å; I41-T45 PolarHBondContact O-OG1 3.03Å; I41-T45 VanDerWaalsContact O-OG1 3.09Å; T45-K49 HydrophobicContact CG2-CD 4.46Å; T45-K49 WeakPolarHBondContact O-CG 3.49Å; T45-K49 PolarHBondContact O-N 3.02Å; T45-K49 VanDerWaalsContact O-N 3.1Å; T45-L92 HydrophobicContact CG2-CD2 3.83Å
46	K	97.5	Very high	96.6	Very high	141 Å²	141	63.2 Å²	63.2	61%	0.613	30%	0.301	S	S	*	.	H	α-helix	trans	-61.2	-48.9	174.2	-176.9	176.1	-179.7	178.5	0	111.5	R42 K43 A44 L48 K49 D50	R42-K46 WeakPolarHBondContact O-CB 3.4Å; R42-K46 PolarHBondContact O-N 3.11Å; K43-K46 PolarHBondContact O-N 2.97Å; A44-K46 PolarHBondContact O-N 3.38Å; K46-L48 PolarHBondContact O-N 3.21Å; K46-K49 PolarHBondContact O-N 3.1Å; K46-D50 PolarHBondContact O-N 2.95Å
47	Y	97.5	Very high	96.6	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.027	30%	0.301	C	S	.	.	H	α-helix	trans	-58	-46.3	178.9	170.5	-109.4	0	0	0	112.3	A35 I36 K43 A44 K49 D50 V51 Q56 C57 V58 W76	A35-Y47 HydrophobicContact CB-CE1 4.04Å; I36-Y47 HydrophobicContact CG2-CD1 3.73Å; I36-Y47 HydrophobicContact CG2-CE1 4.07Å; K43-Y47 WeakPolarHBondContact O-CB 3.47Å; K43-Y47 PolarHBondContact O-N 3.32Å; A44-Y47 PolarHBondContact O-N 2.92Å; Y47-K49 VanDerWaalsContact C-N 3.33Å; Y47-K49 PolarHBondContact O-N 2.98Å; Y47-D50 WeakPolarHBondContact O-CB 3.31Å; Y47-D50 PolarHBondContact O-N 3.21Å; Y47-D50 VanDerWaalsContact O-N 3.14Å; Y47-V51 HydrophobicContact CD1-CG2 4.45Å; Y47-V51 HydrophobicContact CD2-CG2 4.33Å; Y47-V51 HydrophobicContact CE1-CG2 4.08Å; Y47-V51 HydrophobicContact CE2-CG2 3.92Å; Y47-V51 VanDerWaalsContact O-CG2 3.31Å; Y47-V51 WeakPolarHBondContact O-CG2 3.48Å; Y47-V51 PolarHBondContact O-N 3.44Å; Y47-Q56 HydrophobicContact CD2-CB 4.18Å; Y47-Q56 VanDerWaalsContact CD2-OE1 3.31Å; Y47-Q56 HydrophobicContact CE2-CB 4.01Å; Y47-C57 PolarHBondContact OH-O 3.29Å; Y47-C57 VanDerWaalsContact OH-O 3.1Å; Y47-V58 WeakPolarHBondContact OH-CA 3.31Å; Y47-W76 HydrophobicContact CD2-CZ2 4.3Å; Y47-W76 AromaticContact CE2-CZ2 3.6Å; Y47-W76 HydrophobicContact CE2-CZ2 3.6Å; Y47-W76 AromaticContact CZ-CZ2 3.78Å
48	L	97.3	Very high	96.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-34.7	179.3	-68.8	174.3	0	0	0	112.5	I36 A44 K46 V51 T52 A88 L91 L92 L95	I36-L48 HydrophobicContact CD1-CD1 4.28Å; I36-L48 HydrophobicContact CG2-CD1 4.39Å; I36-L48 HydrophobicContact CG2-CD2 3.98Å; I36-L48 HydrophobicContact CG2-CG 4.05Å; A44-L48 WeakPolarHBondContact O-CB 3.49Å; A44-L48 VanDerWaalsContact O-CG 3.31Å; A44-L48 WeakPolarHBondContact O-CG 3.35Å; A44-L48 PolarHBondContact O-N 3.34Å; K46-L48 PolarHBondContact O-N 3.21Å; L48-V51 PolarHBondContact O-N 2.83Å; L48-T52 PolarHBondContact O-N 3.34Å; L48-T52 VanDerWaalsContact O-N 3.16Å; L48-A88 HydrophobicContact CD2-CB 4.15Å; L48-L91 HydrophobicContact CD1-CB 3.71Å; L48-L91 HydrophobicContact CD2-CB 4.45Å; L48-L91 HydrophobicContact CD2-CD1 4.32Å; L48-L92 HydrophobicContact CB-CD1 4.2Å; L48-L92 HydrophobicContact CB-CD2 3.69Å; L48-L92 HydrophobicContact CB-CG 3.72Å; L48-L92 HydrophobicContact CD1-CD2 4.11Å; L48-L92 HydrophobicContact CD1-CG 4.1Å; L48-L95 HydrophobicContact CD1-CD1 3.74Å
49	K	97.8	Very high	96.7	Very high	117 Å²	117	56.3 Å²	56.3	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-66.1	-38.9	171	-71.8	175.3	-179.5	179.7	0	111.7	T45 K46 Y47 V51 T52 L53 L92	T45-K49 HydrophobicContact CG2-CD 4.46Å; T45-K49 WeakPolarHBondContact O-CG 3.49Å; T45-K49 PolarHBondContact O-N 3.02Å; T45-K49 VanDerWaalsContact O-N 3.1Å; K46-K49 PolarHBondContact O-N 3.1Å; Y47-K49 VanDerWaalsContact C-N 3.33Å; Y47-K49 PolarHBondContact O-N 2.98Å; K49-V51 VanDerWaalsContact C-N 3.29Å; K49-V51 PolarHBondContact O-N 2.84Å; K49-T52 PolarHBondContact O-N 3.5Å; K49-T52 PolarHBondContact O-OG1 3.12Å; K49-L53 WeakPolarHBondContact O-CG 3.43Å; K49-L53 PolarHBondContact O-N 3.48Å; K49-L53 VanDerWaalsContact O-N 3.17Å; K49-L92 HydrophobicContact CG-CD1 4.07Å; K49-L92 HydrophobicContact CG-CD2 4.23Å
50	D	97.8	Very high	96.8	Very high	26 Å²	26	55.3 Å²	55.3	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-33.6	175	-73.6	-17.7	0	0	0	111.9	K46 Y47 L53 Q54 K55 Q56	K46-D50 PolarHBondContact O-N 2.95Å; Y47-D50 WeakPolarHBondContact O-CB 3.31Å; Y47-D50 PolarHBondContact O-N 3.21Å; Y47-D50 VanDerWaalsContact O-N 3.14Å; D50-L53 CarbonylContact O-C 3.48Å; D50-L53 PolarHBondContact O-N 3.35Å; D50-Q54 PolarHBondContact O-N 2.82Å; D50-K55 HydrophobicContact CB-CB 4.12Å; D50-K55 PolarHBondContact O-N 3.1Å; D50-Q56 HydrophobicContact CB-CB 4.08Å; D50-Q56 HydrophobicContact CB-CG 3.94Å; D50-Q56 PolarHBondContact O-N 3.34Å; D50-Q56 PolarHBondContact OD2-NE2 3.48Å
51	V	97.4	Very high	96.6	Very high	0 Å²	0	57 Å²	57	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-40.1	174.2	173	0	0	0	0	111.6	Y47 L48 K49 L53 Q54 Q56 V58 A88	Y47-V51 HydrophobicContact CD1-CG2 4.45Å; Y47-V51 HydrophobicContact CD2-CG2 4.33Å; Y47-V51 HydrophobicContact CE1-CG2 4.08Å; Y47-V51 HydrophobicContact CE2-CG2 3.92Å; Y47-V51 VanDerWaalsContact O-CG2 3.31Å; Y47-V51 WeakPolarHBondContact O-CG2 3.48Å; Y47-V51 PolarHBondContact O-N 3.44Å; L48-V51 PolarHBondContact O-N 2.83Å; K49-V51 VanDerWaalsContact C-N 3.29Å; K49-V51 PolarHBondContact O-N 2.84Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.19Å; V51-Q54 PolarHBondContact O-N 3.47Å; V51-Q56 WeakPolarHBondContact CA-O 3.31Å; V51-Q56 WeakPolarHBondContact CG2-O 3.5Å; V51-V58 HydrophobicContact CB-CG2 4.42Å; V51-V58 HydrophobicContact CG1-CG2 3.74Å; V51-V58 HydrophobicContact CG2-CG2 3.72Å; V51-A88 HydrophobicContact CB-CB 4.41Å; V51-A88 HydrophobicContact CG1-CB 4.07Å
52	T	96.7	Very high	96.7	Very high	31 Å²	31	64.2 Å²	64.2	19%	0.19	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-31	177.2	59.3	0	0	0	0	112.2	L48 K49 Q54 K85 A88 E89	L48-T52 PolarHBondContact O-N 3.34Å; L48-T52 VanDerWaalsContact O-N 3.16Å; K49-T52 PolarHBondContact O-N 3.5Å; K49-T52 PolarHBondContact O-OG1 3.12Å; T52-Q54 VanDerWaalsContact C-N 3.31Å; T52-K85 HydrophobicContact CG2-CG 4.26Å; T52-A88 HydrophobicContact CG2-CB 3.89Å; T52-E89 HydrophobicContact CG2-CG 3.98Å
53	L	97.3	Very high	96.8	Very high	108 Å²	108	59.9 Å²	59.9	57%	0.565	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	3.3	174.1	-62	177.1	0	0	0	114	K49 D50 V51 K55	K49-L53 WeakPolarHBondContact O-CG 3.43Å; K49-L53 PolarHBondContact O-N 3.48Å; K49-L53 VanDerWaalsContact O-N 3.17Å; D50-L53 CarbonylContact O-C 3.48Å; D50-L53 PolarHBondContact O-N 3.35Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.19Å; L53-K55 HydrophobicContact CB-CD 4.34Å; L53-K55 HydrophobicContact CB-CG 4.11Å; L53-K55 PolarHBondContact O-N 3.29Å; L53-K55 VanDerWaalsContact O-N 3.16Å
54	Q	96	Very high	96.7	Very high	125 Å²	125	55.7 Å²	55.7	58%	0.584	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.9	-178.5	-51.5	-178.8	15.3	0	0	115.9	D50 V51 T52 Q72 W83	D50-Q54 PolarHBondContact O-N 2.82Å; V51-Q54 PolarHBondContact O-N 3.47Å; T52-Q54 VanDerWaalsContact C-N 3.31Å; Q54-Q72 PolarHBondContact O-NE2 2.97Å; Q54-W83 VanDerWaalsContact CA-CD1 3.42Å; Q54-W83 HydrophobicContact CB-CD2 4.22Å; Q54-W83 HydrophobicContact CB-CG 4.02Å; Q54-W83 HydrophobicContact CG-CB 4Å; Q54-W83 HydrophobicContact CG-CD2 4.34Å; Q54-W83 HydrophobicContact CG-CG 3.94Å; Q54-W83 PolarHBondContact O-NE1 3.1Å
55	K	96.4	Very high	96.5	Very high	134 Å²	134	59.3 Å²	59.3	58%	0.583	29%	0.286	S	S	*	.	S	Bend	trans	-76.8	-32.8	178	-65.1	-177.2	179.1	-178.6	0	112.5	D50 L53 Q72	D50-K55 HydrophobicContact CB-CB 4.12Å; D50-K55 PolarHBondContact O-N 3.1Å; L53-K55 HydrophobicContact CB-CD 4.34Å; L53-K55 HydrophobicContact CB-CG 4.11Å; L53-K55 PolarHBondContact O-N 3.29Å; L53-K55 VanDerWaalsContact O-N 3.16Å; K55-Q72 PolarHBondContact O-NE2 3.46Å
56	Q	96.1	Very high	96.4	Very high	52 Å²	52	61.8 Å²	61.8	24%	0.243	32%	0.316	C	S	.	.	S	Bend	trans	-130.7	137.2	176.8	-65.2	-167.5	44.4	0	0	110.5	Y47 D50 V51 Q72 Q75 W83	Y47-Q56 HydrophobicContact CD2-CB 4.18Å; Y47-Q56 VanDerWaalsContact CD2-OE1 3.31Å; Y47-Q56 HydrophobicContact CE2-CB 4.01Å; D50-Q56 HydrophobicContact CB-CB 4.08Å; D50-Q56 HydrophobicContact CB-CG 3.94Å; D50-Q56 PolarHBondContact O-N 3.34Å; D50-Q56 PolarHBondContact OD2-NE2 3.48Å; V51-Q56 WeakPolarHBondContact CA-O 3.31Å; V51-Q56 WeakPolarHBondContact CG2-O 3.5Å; Q56-Q72 VanDerWaalsContact C-OE1 3.23Å; Q56-Q75 VanDerWaalsContact OE1-NE2 3.14Å; Q56-W83 PolarHBondContact O-NE1 3.43Å
57	C	97	Very high	96.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-92.9	154.2	-179.8	82.6	0	0	0	0	111.8	Y47 Q72 A73 W76 W83	Y47-C57 PolarHBondContact OH-O 3.29Å; Y47-C57 VanDerWaalsContact OH-O 3.1Å; C57-Q72 HydrophobicContact CB-CB 3.92Å; C57-A73 VanDerWaalsContact SG-CA 3.51Å; C57-A73 PolarHBondContact SG-N 2.9Å; C57-W76 PolarHBondContact O-NE1 2.96Å; C57-W83 HydrophobicContact CB-CZ2 4.12Å
58	V	97.3	Very high	96.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.2	170.1	176.3	0	0	0	0	108.1	E31 T32 A35 Y47 V51 F60 G81 R82 P84	E31-V58 HydrophobicContact CB-CG1 4.23Å; T32-V58 HydrophobicContact CG2-CB 4.35Å; T32-V58 HydrophobicContact CG2-CG1 3.9Å; T32-V58 HydrophobicContact CG2-CG2 3.81Å; A35-V58 HydrophobicContact CB-CG1 4.43Å; Y47-V58 WeakPolarHBondContact OH-CA 3.31Å; V51-V58 HydrophobicContact CB-CG2 4.42Å; V51-V58 HydrophobicContact CG1-CG2 3.74Å; V51-V58 HydrophobicContact CG2-CG2 3.72Å; V58-F60 HydrophobicContact CB-CE2 4.19Å; V58-F60 HydrophobicContact CG1-CD2 4.43Å; V58-F60 HydrophobicContact CG1-CE2 4.12Å; V58-F60 VanDerWaalsContact O-CD2 3.29Å; V58-F60 WeakPolarHBondContact O-CD2 3.34Å; V58-F60 PolarHBondContact O-N 3.17Å; V58-G81 WeakPolarHBondContact O-CA 3.42Å; V58-R82 WeakPolarHBondContact CB-O 3.49Å; V58-R82 PolarHBondContact N-O 3.28Å; V58-R82 PolarHBondContact O-N 3.28Å; V58-R82 VanDerWaalsContact O-N 3.11Å; V58-P84 HydrophobicContact CB-CG 4.39Å; V58-P84 HydrophobicContact CG2-CG 4.16Å
59	P	97.3	Very high	96.1	Very high	6 Å²	6	67.5 Å²	67.5	4%	0.039	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.4	176.6	30.3	-33.2	0	0	0	109.5	W76 W78	P59-W76 HydrophobicContact CB-CB 3.93Å; P59-W76 HydrophobicContact CB-CG 3.97Å; P59-W76 HydrophobicContact CG-CB 3.99Å; P59-W76 HydrophobicContact CG-CD2 4Å; P59-W76 HydrophobicContact CG-CG 3.64Å; P59-W78 HydrophobicContact CB-CB 4.42Å
60	F	97.1	Very high	95.9	Very high	1 Å²	1	63 Å²	63	0%	0.004	33%	0.332	C	S	.	.			trans	-96.8	107.4	175.2	-81.3	-117.6	0	0	0	108.2	N28 E31 V58 Y63 N64 V67 W78 Q80 R82 P84	N28-F60 HydrophobicContact CB-CZ 4.42Å; E31-F60 HydrophobicContact CB-CD1 4.32Å; E31-F60 HydrophobicContact CB-CD2 4.44Å; E31-F60 HydrophobicContact CB-CE1 4.42Å; E31-F60 HydrophobicContact CB-CG 4.33Å; E31-F60 HydrophobicContact CG-CB 4.42Å; E31-F60 HydrophobicContact CG-CD1 3.79Å; E31-F60 HydrophobicContact CG-CE1 4.16Å; E31-F60 HydrophobicContact CG-CG 4.05Å; V58-F60 HydrophobicContact CB-CE2 4.19Å; V58-F60 HydrophobicContact CG1-CD2 4.43Å; V58-F60 HydrophobicContact CG1-CE2 4.12Å; V58-F60 VanDerWaalsContact O-CD2 3.29Å; V58-F60 WeakPolarHBondContact O-CD2 3.34Å; V58-F60 PolarHBondContact O-N 3.17Å; F60-Y63 WeakPolarHBondContact CD1-O 3.49Å; F60-N64 HydrophobicContact CB-CB 4.16Å; F60-N64 VanDerWaalsContact O-CB 3.31Å; F60-N64 WeakPolarHBondContact O-CB 3.42Å; F60-V67 HydrophobicContact CB-CG1 4.3Å; F60-V67 HydrophobicContact CB-CG2 4.27Å; F60-V67 HydrophobicContact CD1-CG2 4.11Å; F60-V67 HydrophobicContact CG-CG1 4.46Å; F60-V67 HydrophobicContact CG-CG2 4.31Å; F60-W78 PolarHBondContact O-NE1 2.94Å; F60-Q80 PolarHBondContact N-O 3.15Å; F60-Q80 VanDerWaalsContact N-O 3.1Å; F60-R82 HydrophobicContact CD2-CB 4.16Å; F60-R82 HydrophobicContact CD2-CG 4.35Å; F60-R82 HydrophobicContact CE2-CB 3.59Å; F60-R82 HydrophobicContact CE2-CG 4.14Å; F60-R82 HydrophobicContact CZ-CB 4.02Å; F60-R82 HydrophobicContact CZ-CG 4.43Å; F60-P84 HydrophobicContact CE2-CG 4.4Å; F60-P84 HydrophobicContact CZ-CG 4.29Å
61	R	94	Very high	95.8	Very high	133 Å²	133	66.3 Å²	66.3	50%	0.502	36%	0.363	S	S	.	.	S	Bend	trans	-101.4	-49.1	-174.7	-66.4	-178.6	176.3	179.6	-1.8	113.1	E31 W76 W78	E31-R61 PolarHBondContact OE2-N 2.9Å; R61-W76 PolarHBondContact NH2-O 2.98Å; R61-W78 HydrophobicContact CG-CD2 4.31Å
62	R	95.5	Very high	95.7	Very high	158 Å²	158	69.3 Å²	69.3	60%	0.596	38%	0.377	S	S	*	.	S	Bend	trans	-92.8	-42.6	-178.1	-175.1	-176.2	-74.8	178.2	-4.3	112.5	E31 N64	E31-R62 PolarHBondContact OE1-N 3.42Å; E31-R62 PolarHBondContact OE2-N 3.01Å; R62-N64 PolarHBondContact O-N 3.49Å
63	Y	96	Very high	95.6	Very high	59 Å²	59	67.8 Å²	67.8	23%	0.231	37%	0.368	C	S	.	.	S	Bend	trans	-102.8	58.3	-176.8	-63.3	-60.1	0	0	0	111.6	F26 K27 R30 E31 F60	F26-Y63 HydrophobicContact CE1-CE2 4.05Å; F26-Y63 AromaticContact CE1-CZ 3.96Å; F26-Y63 WeakPolarHBondContact CE1-OH 3.34Å; K27-Y63 HydrophobicContact CB-CD1 4.37Å; K27-Y63 HydrophobicContact CB-CD2 3.73Å; K27-Y63 HydrophobicContact CB-CE2 4.39Å; K27-Y63 HydrophobicContact CB-CG 3.72Å; K27-Y63 HydrophobicContact CD-CD1 3.71Å; K27-Y63 HydrophobicContact CD-CE1 4.3Å; K27-Y63 HydrophobicContact CD-CG 3.86Å; K27-Y63 HydrophobicContact CG-CD1 3.8Å; K27-Y63 HydrophobicContact CG-CD2 3.88Å; K27-Y63 HydrophobicContact CG-CE1 4.13Å; K27-Y63 HydrophobicContact CG-CE2 4.2Å; K27-Y63 HydrophobicContact CG-CG 3.66Å; R30-Y63 HydrophobicContact CB-CE2 4.27Å; R30-Y63 HydrophobicContact CG-CE2 4.15Å; E31-Y63 WeakPolarHBondContact OE1-CD2 3.5Å; E31-Y63 PolarHBondContact OE1-N 3.33Å; F60-Y63 WeakPolarHBondContact CD1-O 3.49Å
64	N	94.7	Very high	95.5	Very high	49 Å²	49	71.1 Å²	71.1	26%	0.262	38%	0.378	S	S	.	.			trans	-105.6	8.1	-170.5	66.9	-27.1	0	0	0	115.3	F60 R62 G66 V67 Q80	F60-N64 HydrophobicContact CB-CB 4.16Å; F60-N64 VanDerWaalsContact O-CB 3.31Å; F60-N64 WeakPolarHBondContact O-CB 3.42Å; R62-N64 PolarHBondContact O-N 3.49Å; N64-G66 PolarHBondContact O-N 3.26Å; N64-V67 HydrophobicContact CB-CG2 4.43Å; N64-V67 WeakPolarHBondContact O-CB 3.46Å; N64-V67 WeakPolarHBondContact O-CG2 3.08Å; N64-V67 PolarHBondContact O-N 3.22Å; N64-V67 VanDerWaalsContact O-N 3.07Å; N64-Q80 PolarHBondContact ND2-OE1 3.45Å
65	G	94.3	Very high	95.4	Very high	75 Å²	75	70.3 Å²	70.3	77%	0.773	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	119.3	175.8	0	0	0	0	0	112.2	V67	G65-V67 VanDerWaalsContact C-N 3.28Å; G65-V67 PolarHBondContact O-N 2.94Å
66	G	92.5	Very high	95.2	Very high	75 Å²	75	67 Å²	67	77%	0.773	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	19	-177.5	0	0	0	0	0	114.6	N64 R82	N64-G66 PolarHBondContact O-N 3.26Å; G66-R82 PolarHBondContact O-NH2 2.88Å
67	V	95.2	Very high	95.1	Very high	9 Å²	9	67.8 Å²	67.8	6%	0.055	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-83.9	126.9	174.1	-179.2	0	0	0	0	110	F60 N64 G65 Q80 R82	F60-V67 HydrophobicContact CB-CG1 4.3Å; F60-V67 HydrophobicContact CB-CG2 4.27Å; F60-V67 HydrophobicContact CD1-CG2 4.11Å; F60-V67 HydrophobicContact CG-CG1 4.46Å; F60-V67 HydrophobicContact CG-CG2 4.31Å; N64-V67 HydrophobicContact CB-CG2 4.43Å; N64-V67 WeakPolarHBondContact O-CB 3.46Å; N64-V67 WeakPolarHBondContact O-CG2 3.08Å; N64-V67 PolarHBondContact O-N 3.22Å; N64-V67 VanDerWaalsContact O-N 3.07Å; G65-V67 VanDerWaalsContact C-N 3.28Å; G65-V67 PolarHBondContact O-N 2.94Å; V67-Q80 HydrophobicContact CB-CB 4.3Å; V67-Q80 HydrophobicContact CG1-CB 3.96Å; V67-Q80 PolarHBondContact O-NE2 3.17Å; V67-R82 HydrophobicContact CG1-CG 3.69Å
68	G	94.7	Very high	95	Very high	46 Å²	46	72.3 Å²	72.3	47%	0.474	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-64	154.8	175	0	0	0	0	0	112.4	G81	G68-G81 PolarHBondContact O-N 3.04Å
69	R	96.2	Very high	94.9	Very high	214 Å²	214	76.1 Å²	76.1	81%	0.808	42%	0.42	S	S	*	.	B	Isolated β-bridge	trans	-76.6	144.7	173.5	-65	-179.9	-179.8	177.8	0.8	109.9	T79 Q80	R69-T79 CarbonylContact C-O 3.59Å; R69-T79 WeakPolarHBondContact CA-O 3.39Å; R69-Q80 HydrophobicContact CG-CG 4.35Å
70	C	94	Very high	94.9	Very high	22 Å²	22	77.6 Å²	77.6	15%	0.149	43%	0.427	C	S	.	.			trans	-136.6	132	179.4	-178	0	0	0	0	109.6	Q72 A73 T79 W83	C70-Q72 PolarHBondContact O-N 3.32Å; C70-A73 VanDerWaalsContact O-CB 3.28Å; C70-A73 WeakPolarHBondContact O-CB 3.27Å; C70-A73 PolarHBondContact O-N 2.99Å; C70-T79 PolarHBondContact N-O 3.24Å; C70-W83 VanDerWaalsContact SG-CH2 3.59Å; C70-W83 VanDerWaalsContact SG-CZ2 3.6Å
71	A	95.6	Very high	94.9	Very high	95 Å²	95	77.8 Å²	77.8	79%	0.785	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-59.5	-34.7	177.9	0	0	0	0	0	112.4	A73 K74	A71-A73 PolarHBondContact O-N 2.83Å; A71-K74 VanDerWaalsContact O-CB 3.24Å; A71-K74 WeakPolarHBondContact O-CB 3.5Å; A71-K74 PolarHBondContact O-N 2.82Å; A71-K74 VanDerWaalsContact O-N 3.15Å
72	Q	95.7	Very high	95	Very high	63 Å²	63	76.3 Å²	76.3	29%	0.294	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-63.1	-21.6	177.6	-61.4	176.6	-0.2	0	0	112.7	Q54 K55 Q56 C57 C70 K74 Q75 W83	Q54-Q72 PolarHBondContact O-NE2 2.97Å; K55-Q72 PolarHBondContact O-NE2 3.46Å; Q56-Q72 VanDerWaalsContact C-OE1 3.23Å; C57-Q72 HydrophobicContact CB-CB 3.92Å; C70-Q72 PolarHBondContact O-N 3.32Å; Q72-K74 PolarHBondContact O-N 3.09Å; Q72-Q75 WeakPolarHBondContact O-CG 3.44Å; Q72-Q75 PolarHBondContact O-N 2.9Å; Q72-W83 VanDerWaalsContact OE1-CZ2 3.23Å
73	A	94.8	Very high	95.1	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-68.3	-18.3	179.2	0	0	0	0	0	112.3	C57 C70 A71 Q75 W76 W78	C57-A73 VanDerWaalsContact SG-CA 3.51Å; C57-A73 PolarHBondContact SG-N 2.9Å; C70-A73 VanDerWaalsContact O-CB 3.28Å; C70-A73 WeakPolarHBondContact O-CB 3.27Å; C70-A73 PolarHBondContact O-N 2.99Å; A71-A73 PolarHBondContact O-N 2.83Å; A73-Q75 PolarHBondContact O-N 3.31Å; A73-W76 WeakPolarHBondContact O-CB 3.31Å; A73-W76 PolarHBondContact O-N 3.48Å; A73-W78 CarbonylContact C-O 3.52Å; A73-W78 VanDerWaalsContact CB-O 3.31Å; A73-W78 WeakPolarHBondContact CB-O 3.44Å; A73-W78 PolarHBondContact O-N 3.22Å
74	K	94.9	Very high	95.1	Very high	178 Å²	178	70.6 Å²	70.6	77%	0.774	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-56.8	-33.2	177.8	-170.1	178.1	179.8	-177.9	0	112.4	A71 Q72 W76 G77 W78	A71-K74 VanDerWaalsContact O-CB 3.24Å; A71-K74 WeakPolarHBondContact O-CB 3.5Å; A71-K74 PolarHBondContact O-N 2.82Å; A71-K74 VanDerWaalsContact O-N 3.15Å; Q72-K74 PolarHBondContact O-N 3.09Å; K74-W76 PolarHBondContact O-N 3.14Å; K74-W76 VanDerWaalsContact O-N 3.12Å; K74-G77 PolarHBondContact O-N 3.14Å; K74-W78 PolarHBondContact N-O 3.4Å
75	Q	93.3	Very high	95.3	Very high	108 Å²	108	74 Å²	74	51%	0.505	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-60.6	-23.8	177	83	-179.3	6.5	0	0	113.1	Q56 Q72 A73	Q56-Q75 VanDerWaalsContact OE1-NE2 3.14Å; Q72-Q75 WeakPolarHBondContact O-CG 3.44Å; Q72-Q75 PolarHBondContact O-N 2.9Å; A73-Q75 PolarHBondContact O-N 3.31Å
76	W	93	Very high	95.4	Very high	63 Å²	63	75.5 Å²	75.5	24%	0.239	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-100.3	9.6	-179.6	-58.2	111.2	0	0	0	113.2	M39 Y47 C57 P59 R61 A73 K74 W78	M39-W76 HydrophobicContact CE-CH2 3.47Å; M39-W76 VanDerWaalsContact CE-CH2 3.47Å; M39-W76 HydrophobicContact CE-CZ2 4.47Å; M39-W76 HydrophobicContact CE-CZ3 4.09Å; Y47-W76 HydrophobicContact CD2-CZ2 4.3Å; Y47-W76 AromaticContact CE2-CZ2 3.6Å; Y47-W76 HydrophobicContact CE2-CZ2 3.6Å; Y47-W76 AromaticContact CZ-CZ2 3.78Å; C57-W76 PolarHBondContact O-NE1 2.96Å; P59-W76 HydrophobicContact CB-CB 3.93Å; P59-W76 HydrophobicContact CB-CG 3.97Å; P59-W76 HydrophobicContact CG-CB 3.99Å; P59-W76 HydrophobicContact CG-CD2 4Å; P59-W76 HydrophobicContact CG-CG 3.64Å; R61-W76 PolarHBondContact NH2-O 2.98Å; A73-W76 WeakPolarHBondContact O-CB 3.31Å; A73-W76 PolarHBondContact O-N 3.48Å; K74-W76 PolarHBondContact O-N 3.14Å; K74-W76 VanDerWaalsContact O-N 3.12Å; W76-W78 HydrophobicContact CB-CB 4.48Å; W76-W78 PolarHBondContact O-N 3.29Å
77	G	94.4	Very high	95.6	Very high	69 Å²	69	72 Å²	72	71%	0.711	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	29.9	-171.8	0	0	0	0	0	112.7	K74	K74-G77 PolarHBondContact O-N 3.14Å
78	W	95.5	Very high	95.7	Very high	96 Å²	96	71.6 Å²	71.6	36%	0.364	36%	0.362	S	S	.	.			trans	-132.2	166.2	-174.2	-154.4	-114.2	0	0	0	111.8	P59 F60 R61 A73 K74 W76 Q80	P59-W78 HydrophobicContact CB-CB 4.42Å; F60-W78 PolarHBondContact O-NE1 2.94Å; R61-W78 HydrophobicContact CG-CD2 4.31Å; A73-W78 CarbonylContact C-O 3.52Å; A73-W78 VanDerWaalsContact CB-O 3.31Å; A73-W78 WeakPolarHBondContact CB-O 3.44Å; A73-W78 PolarHBondContact O-N 3.22Å; K74-W78 PolarHBondContact N-O 3.4Å; W76-W78 HydrophobicContact CB-CB 4.48Å; W76-W78 PolarHBondContact O-N 3.29Å; W78-Q80 VanDerWaalsContact CD1-O 3.27Å
79	T	95.3	Very high	95.8	Very high	79 Å²	79	72.9 Å²	72.9	49%	0.485	36%	0.355	S	S	.	.	S	Bend	trans	-107.1	-30.4	-176.1	56.7	0	0	0	0	113.2	R69 C70	R69-T79 CarbonylContact C-O 3.59Å; R69-T79 WeakPolarHBondContact CA-O 3.39Å; C70-T79 PolarHBondContact N-O 3.24Å
80	Q	96.2	Very high	95.8	Very high	38 Å²	38	66.1 Å²	66.1	18%	0.178	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-107.4	129.8	-172.1	-71.1	175.4	-42.7	0	0	112	F60 N64 V67 R69 W78	F60-Q80 PolarHBondContact N-O 3.15Å; F60-Q80 VanDerWaalsContact N-O 3.1Å; N64-Q80 PolarHBondContact ND2-OE1 3.45Å; V67-Q80 HydrophobicContact CB-CB 4.3Å; V67-Q80 HydrophobicContact CG1-CB 3.96Å; V67-Q80 PolarHBondContact O-NE2 3.17Å; R69-Q80 HydrophobicContact CG-CG 4.35Å; W78-Q80 VanDerWaalsContact CD1-O 3.27Å
81	G	96.4	Very high	95.9	Very high	5 Å²	5	65.4 Å²	65.4	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	159.4	-179.7	0	0	0	0	0	112.9	V58 G68	V58-G81 WeakPolarHBondContact O-CA 3.42Å; G68-G81 PolarHBondContact O-N 3.04Å
82	R	96.8	Very high	95.9	Very high	102 Å²	102	62.4 Å²	62.4	39%	0.385	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	172	174.4	-60.1	-175.8	169.4	178.1	-0.6	110.8	V58 F60 G66 V67 P84	V58-R82 WeakPolarHBondContact CB-O 3.49Å; V58-R82 PolarHBondContact N-O 3.28Å; V58-R82 PolarHBondContact O-N 3.28Å; V58-R82 VanDerWaalsContact O-N 3.11Å; F60-R82 HydrophobicContact CD2-CB 4.16Å; F60-R82 HydrophobicContact CD2-CG 4.35Å; F60-R82 HydrophobicContact CE2-CB 3.59Å; F60-R82 HydrophobicContact CE2-CG 4.14Å; F60-R82 HydrophobicContact CZ-CB 4.02Å; F60-R82 HydrophobicContact CZ-CG 4.43Å; G66-R82 PolarHBondContact O-NH2 2.88Å; V67-R82 HydrophobicContact CG1-CG 3.69Å; R82-P84 WeakPolarHBondContact O-CD 3.49Å
83	W	97.6	Very high	95.9	Very high	85 Å²	85	65.8 Å²	65.8	32%	0.322	31%	0.313	S	S	.	.			trans	-113.7	76.8	174.4	-55.6	-85.9	0	0	0	111.5	Q54 Q56 C57 C70 Q72 K85	Q54-W83 VanDerWaalsContact CA-CD1 3.42Å; Q54-W83 HydrophobicContact CB-CD2 4.22Å; Q54-W83 HydrophobicContact CB-CG 4.02Å; Q54-W83 HydrophobicContact CG-CB 4Å; Q54-W83 HydrophobicContact CG-CD2 4.34Å; Q54-W83 HydrophobicContact CG-CG 3.94Å; Q54-W83 PolarHBondContact O-NE1 3.1Å; Q56-W83 PolarHBondContact O-NE1 3.43Å; C57-W83 HydrophobicContact CB-CZ2 4.12Å; C70-W83 VanDerWaalsContact SG-CH2 3.59Å; C70-W83 VanDerWaalsContact SG-CZ2 3.6Å; Q72-W83 VanDerWaalsContact OE1-CZ2 3.23Å; W83-K85 VanDerWaalsContact C-N 3.27Å; W83-K85 PolarHBondContact O-N 3.49Å
84	P	97.1	Very high	95.9	Very high	11 Å²	11	67.9 Å²	67.9	7%	0.071	32%	0.323	C	S	.	.			trans	-73.7	77.7	-179.7	32.4	-38.2	0	0	0	111.8	N28 T32 V58 F60 R82 K86 S87 A88	N28-P84 HydrophobicContact CB-CB 3.88Å; T32-P84 HydrophobicContact CG2-CB 4.21Å; T32-P84 HydrophobicContact CG2-CG 3.16Å; V58-P84 HydrophobicContact CB-CG 4.39Å; V58-P84 HydrophobicContact CG2-CG 4.16Å; F60-P84 HydrophobicContact CE2-CG 4.4Å; F60-P84 HydrophobicContact CZ-CG 4.29Å; R82-P84 WeakPolarHBondContact O-CD 3.49Å; P84-K86 PolarHBondContact O-N 3.1Å; P84-S87 PolarHBondContact O-N 3.21Å; P84-S87 VanDerWaalsContact O-N 3.08Å; P84-A88 PolarHBondContact O-N 2.92Å
85	K	97.3	Very high	96	Very high	120 Å²	120	59.8 Å²	59.8	52%	0.522	29%	0.288	S	S	.	.	H	α-helix	trans	-46.9	-52.9	-176.9	-179.4	173.8	176.2	176.5	0	113.3	T52 W83 S87 A88 E89	T52-K85 HydrophobicContact CG2-CG 4.26Å; W83-K85 VanDerWaalsContact C-N 3.27Å; W83-K85 PolarHBondContact O-N 3.49Å; K85-S87 PolarHBondContact O-N 2.91Å; K85-A88 PolarHBondContact O-N 3.11Å; K85-A88 VanDerWaalsContact O-N 3.13Å; K85-E89 WeakPolarHBondContact CE-OE1 3.21Å; K85-E89 HydrophobicContact CG-CG 4.48Å; K85-E89 WeakPolarHBondContact CG-OE1 3.24Å; K85-E89 WeakPolarHBondContact O-CG 3.42Å; K85-E89 PolarHBondContact O-N 3.41Å
86	K	97.1	Very high	96.1	Very high	107 Å²	107	61.1 Å²	61.1	47%	0.465	29%	0.292	S	S	.	.	H	α-helix	trans	-58	-45.8	-179.5	-167.2	178.5	-168.5	-179.2	0	112.2	R23 V24 P84 A88 E89 F90	R23-K86 WeakPolarHBondContact O-CE 3.13Å; R23-K86 PolarHBondContact O-NZ 3.07Å; V24-K86 HydrophobicContact CG1-CD 4.46Å; V24-K86 HydrophobicContact CG1-CG 4.25Å; P84-K86 PolarHBondContact O-N 3.1Å; K86-A88 VanDerWaalsContact C-N 3.33Å; K86-A88 PolarHBondContact O-N 2.92Å; K86-E89 PolarHBondContact O-N 3.36Å; K86-F90 HydrophobicContact CG-CD2 4.08Å; K86-F90 HydrophobicContact CG-CE2 4.01Å; K86-F90 VanDerWaalsContact O-CD2 3.26Å; K86-F90 WeakPolarHBondContact O-CD2 3.28Å; K86-F90 PolarHBondContact O-N 2.92Å
87	S	96.8	Very high	96.1	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-37.9	179.1	-65.6	0	0	0	0	111.9	T29 P84 K85 L91	T29-S87 PolarHBondContact N-OG 3.46Å; T29-S87 PolarHBondContact OG1-OG 3.21Å; P84-S87 PolarHBondContact O-N 3.21Å; P84-S87 VanDerWaalsContact O-N 3.08Å; K85-S87 PolarHBondContact O-N 2.91Å; S87-L91 WeakPolarHBondContact O-CG 3.32Å; S87-L91 PolarHBondContact O-N 3.29Å; S87-L91 VanDerWaalsContact O-N 3.11Å
88	A	97.3	Very high	96.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-44.1	177.6	0	0	0	0	0	112.3	L48 V51 T52 P84 K85 K86 F90 L91 L92	L48-A88 HydrophobicContact CD2-CB 4.15Å; V51-A88 HydrophobicContact CB-CB 4.41Å; V51-A88 HydrophobicContact CG1-CB 4.07Å; T52-A88 HydrophobicContact CG2-CB 3.89Å; P84-A88 PolarHBondContact O-N 2.92Å; K85-A88 PolarHBondContact O-N 3.11Å; K85-A88 VanDerWaalsContact O-N 3.13Å; K86-A88 VanDerWaalsContact C-N 3.33Å; K86-A88 PolarHBondContact O-N 2.92Å; A88-F90 PolarHBondContact O-N 3.41Å; A88-L91 PolarHBondContact O-N 3.21Å; A88-L92 WeakPolarHBondContact O-CG 3.45Å; A88-L92 PolarHBondContact O-N 3.44Å
89	E	96.6	Very high	96.1	Very high	73 Å²	73	56.2 Å²	56.2	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-58.5	-46.5	175.7	-71.9	167.7	173.2	0	0	111.8	T52 K85 K86 L91 L92 H93	T52-E89 HydrophobicContact CG2-CG 3.98Å; K85-E89 WeakPolarHBondContact CE-OE1 3.21Å; K85-E89 HydrophobicContact CG-CG 4.48Å; K85-E89 WeakPolarHBondContact CG-OE1 3.24Å; K85-E89 WeakPolarHBondContact O-CG 3.42Å; K85-E89 PolarHBondContact O-N 3.41Å; K86-E89 PolarHBondContact O-N 3.36Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.02Å; E89-L92 WeakPolarHBondContact O-CB 3.43Å; E89-L92 PolarHBondContact O-N 3.38Å; E89-H93 PolarHBondContact O-CD2 3.14Å; E89-H93 PolarHBondContact O-N 3.3Å; E89-H93 VanDerWaalsContact O-N 3.1Å
90	F	95.6	Very high	96.1	Very high	73 Å²	73	54.7 Å²	54.7	32%	0.32	25%	0.254	S	S	.	.	H	α-helix	trans	-63	-38.5	176.9	-88	-79	0	0	0	112.9	L22 V24 K86 A88 H93 M94	L22-F90 HydrophobicContact CD2-CD1 4.35Å; L22-F90 HydrophobicContact CD2-CE1 4.43Å; V24-F90 HydrophobicContact CG1-CB 4.23Å; V24-F90 HydrophobicContact CG1-CD1 4.41Å; V24-F90 HydrophobicContact CG1-CD2 3.1Å; V24-F90 HydrophobicContact CG1-CE2 3.42Å; V24-F90 VanDerWaalsContact CG1-CE2 3.42Å; V24-F90 HydrophobicContact CG1-CG 3.66Å; V24-F90 HydrophobicContact CG1-CZ 4.2Å; K86-F90 HydrophobicContact CG-CD2 4.08Å; K86-F90 HydrophobicContact CG-CE2 4.01Å; K86-F90 VanDerWaalsContact O-CD2 3.26Å; K86-F90 WeakPolarHBondContact O-CD2 3.28Å; K86-F90 PolarHBondContact O-N 2.92Å; A88-F90 PolarHBondContact O-N 3.41Å; F90-H93 PolarHBondContact O-N 2.88Å; F90-M94 PolarHBondContact O-N 3.42Å; F90-M94 VanDerWaalsContact O-N 3.11Å
91	L	96.2	Very high	96	Very high	6 Å²	6	55.3 Å²	55.3	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-37	175.8	-73.2	174.9	0	0	0	111.9	T32 A33 I36 L48 S87 A88 E89 H93 M94 L95 I117	T32-L91 VanDerWaalsContact OG1-CD1 3.27Å; T32-L91 WeakPolarHBondContact OG1-CD1 3.49Å; A33-L91 HydrophobicContact CB-CD1 4.29Å; A33-L91 HydrophobicContact CB-CD2 4.42Å; I36-L91 HydrophobicContact CD1-CD1 4.21Å; L48-L91 HydrophobicContact CD1-CB 3.71Å; L48-L91 HydrophobicContact CD2-CB 4.45Å; L48-L91 HydrophobicContact CD2-CD1 4.32Å; S87-L91 WeakPolarHBondContact O-CG 3.32Å; S87-L91 PolarHBondContact O-N 3.29Å; S87-L91 VanDerWaalsContact O-N 3.11Å; A88-L91 PolarHBondContact O-N 3.21Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.02Å; L91-H93 VanDerWaalsContact C-N 3.35Å; L91-H93 PolarHBondContact O-N 3.49Å; L91-M94 HydrophobicContact CD2-CE 3.56Å; L91-M94 WeakPolarHBondContact O-CB 3.39Å; L91-M94 PolarHBondContact O-N 3.12Å; L91-M94 VanDerWaalsContact O-N 3.14Å; L91-L95 WeakPolarHBondContact O-CG 3.17Å; L91-L95 PolarHBondContact O-N 3.35Å; L91-I117 HydrophobicContact CD2-CD1 4.29Å
92	L	96.8	Very high	95.8	Very high	33 Å²	33	55.1 Å²	55.1	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-45.1	173.2	-76.6	168.8	0	0	0	111.8	T45 L48 K49 A88 E89 M94 L95 K96	T45-L92 HydrophobicContact CG2-CD2 3.83Å; L48-L92 HydrophobicContact CB-CD1 4.2Å; L48-L92 HydrophobicContact CB-CD2 3.69Å; L48-L92 HydrophobicContact CB-CG 3.72Å; L48-L92 HydrophobicContact CD1-CD2 4.11Å; L48-L92 HydrophobicContact CD1-CG 4.1Å; K49-L92 HydrophobicContact CG-CD1 4.07Å; K49-L92 HydrophobicContact CG-CD2 4.23Å; A88-L92 WeakPolarHBondContact O-CG 3.45Å; A88-L92 PolarHBondContact O-N 3.44Å; E89-L92 WeakPolarHBondContact O-CB 3.43Å; E89-L92 PolarHBondContact O-N 3.38Å; L92-M94 VanDerWaalsContact C-N 3.28Å; L92-M94 PolarHBondContact O-N 3.17Å; L92-L95 PolarHBondContact O-N 3.13Å; L92-K96 PolarHBondContact O-N 3.1Å
93	H	95.6	Very high	95.7	Very high	133 Å²	133	56.1 Å²	56.1	62%	0.616	27%	0.265	S	S	*	.	H	α-helix	trans	-61.2	-37.7	174.8	-70.5	-65.8	0	0	0	112.4	E89 F90 L91 N97	E89-H93 PolarHBondContact O-CD2 3.14Å; E89-H93 PolarHBondContact O-N 3.3Å; E89-H93 VanDerWaalsContact O-N 3.1Å; F90-H93 PolarHBondContact O-N 2.88Å; L91-H93 VanDerWaalsContact C-N 3.35Å; L91-H93 PolarHBondContact O-N 3.49Å; H93-N97 PolarHBondContact O-N 3.03Å; H93-N97 VanDerWaalsContact O-N 3.14Å
94	M	94.7	Very high	95.5	Very high	44 Å²	44	59.2 Å²	59.2	22%	0.217	29%	0.288	C	S	.	.	H	α-helix	trans	-70.3	-35.7	178.3	-167.9	175.4	74.9	0	0	112.8	S17 F90 L91 L92 A98 I117	S17-M94 WeakPolarHBondContact OG-CG 3.33Å; S17-M94 PolarHBondContact OG-O 3.13Å; F90-M94 PolarHBondContact O-N 3.42Å; F90-M94 VanDerWaalsContact O-N 3.11Å; L91-M94 HydrophobicContact CD2-CE 3.56Å; L91-M94 WeakPolarHBondContact O-CB 3.39Å; L91-M94 PolarHBondContact O-N 3.12Å; L91-M94 VanDerWaalsContact O-N 3.14Å; L92-M94 VanDerWaalsContact C-N 3.28Å; L92-M94 PolarHBondContact O-N 3.17Å; M94-A98 PolarHBondContact O-N 3.24Å; M94-A98 VanDerWaalsContact O-N 3.11Å; M94-I117 HydrophobicContact CE-CD1 4.11Å
95	L	95.5	Very high	95.3	Very high	8 Å²	8	63.9 Å²	63.9	4%	0.042	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-43.8	173.7	-69.3	-179.6	0	0	0	111.4	A44 L48 L91 L92 N97 A98 E99 I114	A44-L95 HydrophobicContact CB-CD1 3.92Å; L48-L95 HydrophobicContact CD1-CD1 3.74Å; L91-L95 WeakPolarHBondContact O-CG 3.17Å; L91-L95 PolarHBondContact O-N 3.35Å; L92-L95 PolarHBondContact O-N 3.13Å; L95-N97 VanDerWaalsContact C-N 3.25Å; L95-N97 PolarHBondContact O-N 3.48Å; L95-A98 CarbonylContact O-C 3.03Å; L95-A98 WeakPolarHBondContact O-CA 3.29Å; L95-A98 WeakPolarHBondContact O-CB 3.49Å; L95-A98 PolarHBondContact O-N 3.03Å; L95-E99 WeakPolarHBondContact O-CG 3.31Å; L95-E99 PolarHBondContact O-N 3.15Å; L95-I114 HydrophobicContact CD1-CD1 4.43Å; L95-I114 HydrophobicContact CD2-CD1 3.58Å; L95-I114 HydrophobicContact CD2-CG1 4.15Å
96	K	95.6	Very high	95.1	Very high	137 Å²	137	61.4 Å²	61.4	60%	0.596	32%	0.316	S	S	*	.	H	α-helix	trans	-57.3	-40.2	174.8	-173.8	176.1	-179.3	179	0	112.1	L92 A98 E99 S100	L92-K96 PolarHBondContact O-N 3.1Å; K96-A98 VanDerWaalsContact C-N 3.34Å; K96-E99 PolarHBondContact O-N 2.83Å; K96-S100 PolarHBondContact O-N 3.21Å; K96-S100 PolarHBondContact O-OG 3.11Å
97	N	94.7	Very high	94.9	Very high	73 Å²	73	58 Å²	58	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-37	174.3	-171.4	15.6	0	0	0	112.3	H93 L95 N101	H93-N97 PolarHBondContact O-N 3.03Å; H93-N97 VanDerWaalsContact O-N 3.14Å; L95-N97 VanDerWaalsContact C-N 3.25Å; L95-N97 PolarHBondContact O-N 3.48Å; N97-N101 WeakPolarHBondContact O-CB 3.21Å; N97-N101 PolarHBondContact O-N 3.41Å; N97-N101 PolarHBondContact O-ND2 3.22Å
98	A	94.1	Very high	94.7	Very high	8 Å²	8	62.2 Å²	62.2	7%	0.066	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-40.9	174.4	0	0	0	0	0	112	M94 L95 K96 N101 A102	M94-A98 PolarHBondContact O-N 3.24Å; M94-A98 VanDerWaalsContact O-N 3.11Å; L95-A98 CarbonylContact O-C 3.03Å; L95-A98 WeakPolarHBondContact O-CA 3.29Å; L95-A98 WeakPolarHBondContact O-CB 3.49Å; L95-A98 PolarHBondContact O-N 3.03Å; K96-A98 VanDerWaalsContact C-N 3.34Å; A98-N101 PolarHBondContact O-N 3.11Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 3.19Å
99	E	94.3	Very high	94.3	Very high	43 Å²	43	63.4 Å²	63.4	20%	0.201	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-52.2	173.8	-67.9	171.8	164.1	0	0	110.6	I41 L95 K96 N101 A102 E103 V109	I41-E99 HydrophobicContact CD1-CG 4.46Å; I41-E99 HydrophobicContact CG2-CG 3.75Å; I41-E99 WeakPolarHBondContact CG2-OE1 3.04Å; L95-E99 WeakPolarHBondContact O-CG 3.31Å; L95-E99 PolarHBondContact O-N 3.15Å; K96-E99 PolarHBondContact O-N 2.83Å; E99-N101 VanDerWaalsContact C-N 3.29Å; E99-N101 PolarHBondContact O-N 3.41Å; E99-A102 WeakPolarHBondContact O-CA 3.45Å; E99-A102 WeakPolarHBondContact O-CB 3.26Å; E99-A102 PolarHBondContact O-N 3.49Å; E99-E103 PolarHBondContact O-N 3.39Å; E99-V109 HydrophobicContact CB-CG1 4.13Å; E99-V109 HydrophobicContact CG-CG1 3.85Å
100	S	95.1	Very high	94	Very high	48 Å²	48	63.2 Å²	63.2	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-37.7	177.6	-59.5	0	0	0	0	113	K96 A102 L104	K96-S100 PolarHBondContact O-N 3.21Å; K96-S100 PolarHBondContact O-OG 3.11Å; S100-A102 VanDerWaalsContact C-N 3.3Å; S100-A102 PolarHBondContact O-N 2.92Å; S100-L104 VanDerWaalsContact O-CG 3.31Å; S100-L104 WeakPolarHBondContact O-CG 3.48Å; S100-L104 PolarHBondContact O-N 3.22Å; S100-L104 VanDerWaalsContact O-N 3.1Å
101	N	93.9	Very high	93.8	Very high	51 Å²	51	63.2 Å²	63.2	27%	0.273	34%	0.342	S	S	.	.	H	α-helix	trans	-68.8	-29.2	175.3	-71.5	-18	0	0	0	113	C15 K16 N97 A98 E99 K105	C15-N101 HydrophobicContact CB-CB 4.24Å; K16-N101 PolarHBondContact O-ND2 2.76Å; N97-N101 WeakPolarHBondContact O-CB 3.21Å; N97-N101 PolarHBondContact O-N 3.41Å; N97-N101 PolarHBondContact O-ND2 3.22Å; A98-N101 PolarHBondContact O-N 3.11Å; E99-N101 VanDerWaalsContact C-N 3.29Å; E99-N101 PolarHBondContact O-N 3.41Å; N101-K105 WeakPolarHBondContact O-CG 3.44Å; N101-K105 PolarHBondContact O-N 3.46Å
102	A	94.1	Very high	93.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-76.4	-40.8	176.5	0	0	0	0	0	111.5	C15 A98 E99 S100 L104 K105 G106 L107 L112	C15-A102 HydrophobicContact CB-CB 4.17Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 3.19Å; E99-A102 WeakPolarHBondContact O-CA 3.45Å; E99-A102 WeakPolarHBondContact O-CB 3.26Å; E99-A102 PolarHBondContact O-N 3.49Å; S100-A102 VanDerWaalsContact C-N 3.3Å; S100-A102 PolarHBondContact O-N 2.92Å; A102-L104 VanDerWaalsContact C-N 3.33Å; A102-L104 PolarHBondContact O-N 3.1Å; A102-K105 CarbonylContact O-C 3.56Å; A102-K105 WeakPolarHBondContact O-CA 3.42Å; A102-K105 WeakPolarHBondContact O-CB 3.4Å; A102-K105 PolarHBondContact O-N 3.04Å; A102-G106 PolarHBondContact O-N 2.94Å; A102-L107 HydrophobicContact CB-CB 4.19Å; A102-L107 HydrophobicContact CB-CD1 4.36Å; A102-L107 PolarHBondContact O-N 3.3Å; A102-L112 HydrophobicContact CB-CD1 3.41Å; A102-L112 VanDerWaalsContact CB-CD1 3.41Å; A102-L112 HydrophobicContact CB-CD2 4.31Å; A102-L112 HydrophobicContact CB-CG 4.45Å
103	E	93.6	Very high	93.6	Very high	124 Å²	124	65.8 Å²	65.8	58%	0.579	36%	0.359	S	S	*	.	H	α-helix	trans	-57.8	-45.8	172.9	-71.4	175.1	171.7	0	0	111.3	E99 K105 G106 V109	E99-E103 PolarHBondContact O-N 3.39Å; E103-K105 PolarHBondContact O-N 3.49Å; E103-G106 PolarHBondContact O-N 3.15Å; E103-V109 HydrophobicContact CG-CG2 3.52Å
104	L	94.1	Very high	93.7	Very high	150 Å²	150	60.4 Å²	60.4	79%	0.785	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.2	175.9	-72.5	174.4	0	0	0	113.4	S100 A102	S100-L104 VanDerWaalsContact O-CG 3.31Å; S100-L104 WeakPolarHBondContact O-CG 3.48Å; S100-L104 PolarHBondContact O-N 3.22Å; S100-L104 VanDerWaalsContact O-N 3.1Å; A102-L104 VanDerWaalsContact C-N 3.33Å; A102-L104 PolarHBondContact O-N 3.1Å
105	K	92.4	Very high	93.7	Very high	108 Å²	108	64 Å²	64	47%	0.47	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.7	175.3	-73.3	-175.3	173.2	-156.7	0	113.3	P11 S14 N101 A102 E103 L107	P11-K105 PolarHBondContact O-NZ 3.4Å; S14-K105 PolarHBondContact O-NZ 3.21Å; N101-K105 WeakPolarHBondContact O-CG 3.44Å; N101-K105 PolarHBondContact O-N 3.46Å; A102-K105 CarbonylContact O-C 3.56Å; A102-K105 WeakPolarHBondContact O-CA 3.42Å; A102-K105 WeakPolarHBondContact O-CB 3.4Å; A102-K105 PolarHBondContact O-N 3.04Å; E103-K105 PolarHBondContact O-N 3.49Å; K105-L107 VanDerWaalsContact C-N 3.26Å; K105-L107 HydrophobicContact CB-CD1 4.14Å; K105-L107 HydrophobicContact CB-CG 3.97Å; K105-L107 HydrophobicContact CD-CD1 4.3Å; K105-L107 PolarHBondContact O-N 3.26Å
106	G	92.6	Very high	93.7	Very high	69 Å²	69	67.3 Å²	67.3	71%	0.711	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	23.8	-174.8	0	0	0	0	0	113.6	A102 E103	A102-G106 PolarHBondContact O-N 2.94Å; E103-G106 PolarHBondContact O-N 3.15Å
107	L	93.2	Very high	93.7	Very high	36 Å²	36	61.9 Å²	61.9	19%	0.188	34%	0.343	C	S	.	.			trans	-82.8	145.1	175.4	-60.3	173.7	0	0	0	110	A102 K105 V109	A102-L107 HydrophobicContact CB-CB 4.19Å; A102-L107 HydrophobicContact CB-CD1 4.36Å; A102-L107 PolarHBondContact O-N 3.3Å; K105-L107 VanDerWaalsContact C-N 3.26Å; K105-L107 HydrophobicContact CB-CD1 4.14Å; K105-L107 HydrophobicContact CB-CG 3.97Å; K105-L107 HydrophobicContact CD-CD1 4.3Å; K105-L107 PolarHBondContact O-N 3.26Å; L107-V109 PolarHBondContact O-N 3.46Å
108	D	92.6	Very high	93.7	Very high	89 Å²	89	63 Å²	63	48%	0.476	35%	0.345	S	S	.	.			trans	-68.4	116.7	170.3	168.3	38	0	0	0	110	D110 S111 L112	D108-D110 PolarHBondContact O-N 3.16Å; D108-D110 WeakPolarHBondContact OD1-CB 3.37Å; D108-D110 PolarHBondContact OD1-N 3.17Å; D108-D110 VanDerWaalsContact OD1-N 3.11Å; D108-S111 PolarHBondContact O-OG 3.18Å; D108-S111 VanDerWaalsContact OD2-CB 3.27Å; D108-S111 WeakPolarHBondContact OD2-CB 3.43Å; D108-S111 PolarHBondContact OD2-N 2.84Å; D108-S111 PolarHBondContact OD2-OG 3.04Å; D108-L112 WeakPolarHBondContact O-CG 3.26Å
109	V	89.9	Confident	93.8	Very high	26 Å²	26	64.4 Å²	64.4	16%	0.158	35%	0.353	C	S	.	.	S	Bend	trans	-66.6	-26	-176.9	-177.8	0	0	0	0	111.6	E99 E103 L107 L112	E99-V109 HydrophobicContact CB-CG1 4.13Å; E99-V109 HydrophobicContact CG-CG1 3.85Å; E103-V109 HydrophobicContact CG-CG2 3.52Å; L107-V109 PolarHBondContact O-N 3.46Å; V109-L112 HydrophobicContact CB-CD1 4.41Å; V109-L112 HydrophobicContact CG1-CD1 4.25Å; V109-L112 PolarHBondContact O-N 3.16Å
110	D	89.3	Confident	93.9	Very high	69 Å²	69	67.7 Å²	67.7	37%	0.369	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-32.3	-170.9	-66.3	-5.4	0	0	0	112.4	R42 D108 L112	R42-D110 IonicContact CZ-OD1 3.14Å; R42-D110 IonicContact CZ-OD2 2.79Å; R42-D110 IonicContact NE-OD1 2.76Å; R42-D110 PolarHBondContact NE-OD1 2.85Å; R42-D110 VanDerWaalsContact NE-OD1 3.14Å; R42-D110 IonicContact NH1-OD1 3.33Å; R42-D110 PolarHBondContact NH1-OD1 3.27Å; R42-D110 IonicContact NH1-OD2 2.74Å; R42-D110 PolarHBondContact NH1-OD2 3Å; R42-D110 IonicContact NH2-OD1 2.98Å; R42-D110 PolarHBondContact NH2-OD1 2.91Å; R42-D110 IonicContact NH2-OD2 2.61Å; R42-D110 PolarHBondContact NH2-OD2 2.98Å; D108-D110 PolarHBondContact O-N 3.16Å; D108-D110 WeakPolarHBondContact OD1-CB 3.37Å; D108-D110 PolarHBondContact OD1-N 3.17Å; D108-D110 VanDerWaalsContact OD1-N 3.11Å; D110-L112 VanDerWaalsContact C-N 3.35Å
111	S	91.5	Very high	93.9	Very high	73 Å²	73	72.8 Å²	72.8	51%	0.51	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.7	177.1	52.1	0	0	0	0	114	D108 V113	D108-S111 PolarHBondContact O-OG 3.18Å; D108-S111 VanDerWaalsContact OD2-CB 3.27Å; D108-S111 WeakPolarHBondContact OD2-CB 3.43Å; D108-S111 PolarHBondContact OD2-N 2.84Å; D108-S111 PolarHBondContact OD2-OG 3.04Å; S111-V113 PolarHBondContact O-N 3.46Å
112	L	93.8	Very high	93.9	Very high	20 Å²	20	72.7 Å²	72.7	11%	0.105	40%	0.395	C	S	.	.			trans	-65.7	132.4	-179.1	-65.6	173	0	0	0	112.9	H40 I41 A102 D108 V109 D110	H40-L112 WeakPolarHBondContact CA-O 3.32Å; I41-L112 HydrophobicContact CB-CB 4.41Å; I41-L112 HydrophobicContact CD1-CB 3.46Å; I41-L112 VanDerWaalsContact CD1-CB 3.46Å; I41-L112 HydrophobicContact CD1-CD1 3.66Å; I41-L112 HydrophobicContact CD1-CG 4.2Å; I41-L112 HydrophobicContact CG1-CB 3.81Å; I41-L112 PolarHBondContact N-O 3.3Å; A102-L112 HydrophobicContact CB-CD1 3.41Å; A102-L112 VanDerWaalsContact CB-CD1 3.41Å; A102-L112 HydrophobicContact CB-CD2 4.31Å; A102-L112 HydrophobicContact CB-CG 4.45Å; D108-L112 WeakPolarHBondContact O-CG 3.26Å; V109-L112 HydrophobicContact CB-CD1 4.41Å; V109-L112 HydrophobicContact CG1-CD1 4.25Å; V109-L112 PolarHBondContact O-N 3.16Å; D110-L112 VanDerWaalsContact C-N 3.35Å
113	V	95.8	Very high	94	Very high	73 Å²	73	78 Å²	78	44%	0.442	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-120.3	139.9	176.4	178.5	0	0	0	0	110	H40 S111 E115	H40-V113 WeakPolarHBondContact CE1-CG2 3.15Å; H40-V113 WeakPolarHBondContact ND1-CG2 3.36Å; S111-V113 PolarHBondContact O-N 3.46Å; V113-E115 PolarHBondContact O-N 2.8Å; V113-E115 VanDerWaalsContact O-N 3.13Å
114	I	96	Very high	94	Very high	19 Å²	19	81.5 Å²	81.5	10%	0.097	44%	0.442	C	S	.	.			trans	-80.9	91.6	175.1	-55.8	166.2	0	0	0	108.9	I36 G38 M39 I41 A44 L95 I117	I36-I114 HydrophobicContact CB-CD1 4.29Å; I36-I114 HydrophobicContact CD1-CD1 4.19Å; I36-I114 HydrophobicContact CG1-CD1 4.39Å; G38-I114 WeakPolarHBondContact CA-O 3.05Å; G38-I114 PolarHBondContact N-O 3.17Å; M39-I114 PolarHBondContact O-N 3.37Å; I41-I114 HydrophobicContact CG1-CG1 4.14Å; A44-I114 HydrophobicContact CB-CD1 3.6Å; L95-I114 HydrophobicContact CD1-CD1 4.43Å; L95-I114 HydrophobicContact CD2-CD1 3.58Å; L95-I114 HydrophobicContact CD2-CG1 4.15Å; I114-I117 HydrophobicContact CG2-CB 4.41Å
115	E	95.1	Very high	94	Very high	120 Å²	120	81.2 Å²	81.2	56%	0.561	44%	0.439	S	S	*	.			trans	-72.5	-52.6	179.3	-172.5	-171.6	172.1	0	0	112	K37 V113	K37-E115 WeakPolarHBondContact CE-O 3.49Å; V113-E115 PolarHBondContact O-N 2.8Å; V113-E115 VanDerWaalsContact O-N 3.13Å
116	H	95.4	Very high	94.1	Very high	77 Å²	77	87.8 Å²	87.8	36%	0.356	46%	0.461	S	S	.	.			trans	-123.9	132.4	-174	-179.5	-97.9	0	0	0	111.9	S5 L6	S5-H116 PolarHBondContact OG-CE1 3.08Å; L6-H116 HydrophobicContact CD2-CB 3.63Å
117	I	95.9	Very high	94.2	Very high	24 Å²	24	93.7 Å²	93.7	12%	0.123	46%	0.461	C	S	.	.			trans	-141	132.7	172.3	-166.1	164.7	0	0	0	109.4	A33 I36 K37 L91 M94 I114	A33-I117 HydrophobicContact CB-CD1 3.54Å; A33-I117 HydrophobicContact CB-CG1 3.95Å; A33-I117 WeakPolarHBondContact O-CG2 3.19Å; I36-I117 HydrophobicContact CD1-CD1 3.83Å; I36-I117 HydrophobicContact CG1-CD1 4.05Å; K37-I117 HydrophobicContact CB-CG2 3.83Å; K37-I117 HydrophobicContact CD-CG2 4.35Å; K37-I117 HydrophobicContact CG-CG2 4.07Å; L91-I117 HydrophobicContact CD2-CD1 4.29Å; M94-I117 HydrophobicContact CE-CD1 4.11Å; I114-I117 HydrophobicContact CG2-CB 4.41Å
118	Q	94.9	Very high	94.3	Very high	95 Å²	95	102.6 Å²	102.6	44%	0.444	49%	0.492	S	S	.	.			trans	-133.3	138.1	-180	177.6	175	-11.4	0	0	110.2	S5 N120	S5-Q118 PolarHBondContact OG-OE1 3.35Å; Q118-N120 VanDerWaalsContact NE2-CG 3.33Å; Q118-N120 PolarHBondContact NE2-ND2 3.27Å; Q118-N120 PolarHBondContact NE2-OD1 2.94Å
119	V	96.5	Very high	94.5	Very high	39 Å²	39	104.4 Å²	104.4	24%	0.236	51%	0.507	C	S	.	.			trans	-124	118.7	175.5	-175.7	0	0	0	0	108.4	F26 T29 R30 A33	F26-V119 HydrophobicContact CD2-CG1 3.88Å; F26-V119 HydrophobicContact CE2-CG1 3.87Å; F26-V119 WeakPolarHBondContact CE2-O 2.9Å; T29-V119 HydrophobicContact CG2-CG1 4.27Å; T29-V119 HydrophobicContact CG2-CG2 4.42Å; R30-V119 HydrophobicContact CB-CB 4.35Å; R30-V119 HydrophobicContact CB-CG1 4.41Å; A33-V119 HydrophobicContact CB-CG2 3.49Å; A33-V119 VanDerWaalsContact CB-CG2 3.49Å
120	N	95.5	Very high	94.7	Very high	112 Å²	112	113 Å²	113	60%	0.599	54%	0.538	S	S	*	.			trans	-106.7	155.3	179	-68	-26.6	0	0	0	111.3	F26 Q118	F26-N120 WeakPolarHBondContact CD2-O 3.4Å; F26-N120 VanDerWaalsContact CE2-C 3.41Å; Q118-N120 VanDerWaalsContact NE2-CG 3.33Å; Q118-N120 PolarHBondContact NE2-ND2 3.27Å; Q118-N120 PolarHBondContact NE2-OD1 2.94Å
121	K	95.3	Very high	94.8	Very high	155 Å²	155	124.7 Å²	124.7	67%	0.674	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-74.2	127	172.8	-68.9	178.5	-177.6	169.4	0	109	F26	F26-K121 HydrophobicContact CD1-CD 4.45Å; F26-K121 HydrophobicContact CD1-CG 3.78Å; F26-K121 HydrophobicContact CD2-CB 4.45Å; F26-K121 HydrophobicContact CD2-CG 3.81Å; F26-K121 HydrophobicContact CE1-CD 4.18Å; F26-K121 VanDerWaalsContact CE1-CE 3.48Å; F26-K121 HydrophobicContact CE1-CG 3.61Å; F26-K121 HydrophobicContact CE2-CB 4.43Å; F26-K121 HydrophobicContact CE2-CG 3.65Å; F26-K121 HydrophobicContact CG-CG 3.88Å; F26-K121 HydrophobicContact CZ-CD 4.42Å; F26-K121 HydrophobicContact CZ-CG 3.55Å
122	A	94.3	Very high	95	Very high	49 Å²	49	127.3 Å²	127.3	41%	0.405	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-83.8	161.5	169.8	0	0	0	0	0	110.9	K124	A122-K124 PolarHBondContact O-N 2.79Å
123	P	95.4	Very high	95.1	Very high	110 Å²	110	132.9 Å²	132.9	71%	0.714	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-51.8	133.6	169.8	-26.1	35.3	0	0	0	111.5
124	K	94.2	Very high	95	Very high	198 Å²	198	136.3 Å²	136.3	86%	0.861	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-76.7	130.8	-179.2	-65.7	-179.8	-177.2	175	0	110.2	A122	A122-K124 PolarHBondContact O-N 2.79Å
125	M	94.1	Very high	95	Very high	145 Å²	145	143.2 Å²	143.2	71%	0.714	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-76	139.9	168	-57.8	-177.1	86.7	0	0	109.8
126	R	94.1	Very high	95	Very high	246 Å²	246	144.6 Å²	144.6	93%	0.928	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-92.3	140.9	178.8	-65.6	-177.3	178.8	-178.7	-0.9	110.7
127	R	94.9	Very high	94.9	Very high	192 Å²	192	149.1 Å²	149.1	73%	0.725	67%	0.67	S	S	*	*			trans	-144.8	159.8	171.5	-64	-175.8	179.4	-169.2	-8.7	108.4
128	R	96.3	Very high	94.9	Very high	223 Å²	223	158.1 Å²	158.1	84%	0.842	71%	0.709	S	S	*	*			trans	-105	148.8	176.3	-66.8	-177.6	179.8	176	0.3	110.5
129	T	96.1	Very high	94.9	Very high	127 Å²	127	162.9 Å²	162.9	78%	0.779	73%	0.729	S	S	*	*			trans	-136.5	122.5	171.7	-55.3	0	0	0	0	106.5
130	Y	95.1	Very high	94.7	Very high	208 Å²	208	173.3 Å²	173.3	82%	0.816	77%	0.77	S	S	*	*			trans	-78.5	140.4	172.5	-59.1	-75	0	0	0	108.6
131	R	91.4	Very high	94.6	Very high	314 Å²	314	178.8 Å²	178.8	100%	1.185	79%	0.786	S	S	*	*			trans	-113.8	0	176.6	-73.1	-169.9	178.9	-170.9	-0.2	109.1

Retrieved 131 of 131 residues in 76.8 ms (Link to these results)

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