#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lze s GLN 11 N 0.00 2.91 0.31 -1.24 -1.52 -1.26 -5.06 119.66 113.80 3lze s GLN 11 Ca 0.00 -0.81 -0.28 0.00 -1.95 0.00 0.00 55.36 52.32 3lze s GLN 11 Cb 0.00 -2.37 -0.09 0.00 -0.22 0.00 0.00 33.01 30.32 3lze s GLN 11 CO 0.00 -0.03 1.06 0.42 -0.25 0.00 0.00 175.29 176.49 3lze s ILE 12 N 0.87 3.63 0.04 1.08 1.01 -1.26 -1.97 121.20 124.60 3lze s ILE 12 Ca -0.06 1.53 -0.00 0.00 0.00 0.00 0.00 60.65 62.12 3lze s ILE 12 Cb -0.15 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.35 3lze s ILE 12 CO -0.03 0.28 -0.04 0.00 0.00 0.00 0.00 174.94 175.16 3lze s ALA 13 N -1.30 0.40 -0.11 9.38 0.00 -0.18 -4.89 121.76 125.07 3lze s ALA 13 Ca 0.47 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.52 3lze s ALA 13 Cb -0.28 0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.04 3lze s ALA 13 CO 0.36 -0.25 -0.20 -2.00 0.00 0.00 0.00 175.76 173.67 3lze s GLU 14 N -2.76 2.73 -0.06 0.00 2.12 -1.26 -1.92 118.70 117.56 3lze s GLU 14 Ca -0.03 -0.76 -0.02 0.00 0.36 0.00 0.00 54.97 54.52 3lze s GLU 14 Cb -0.01 -2.17 -0.04 0.00 0.26 0.00 0.00 34.13 32.17 3lze s GLU 14 CO -0.05 0.05 0.05 -0.51 -0.54 0.00 0.00 175.26 174.25 3lze s LEU 15 N 0.67 3.80 -0.06 2.70 1.43 -0.20 -4.95 118.68 122.07 3lze s LEU 15 Ca -0.12 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.19 3lze s LEU 15 Cb -0.16 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3lze s LEU 15 CO 0.02 0.34 -0.15 -0.22 0.23 0.00 0.00 176.35 176.57 3lze s LEU 16 N -1.25 1.78 -0.10 1.79 2.96 -1.26 -1.26 118.68 121.34 3lze s LEU 16 Ca 0.17 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.77 3lze s LEU 16 Cb -0.12 -0.95 0.00 0.00 0.50 0.00 0.00 46.19 45.63 3lze s LEU 16 CO 0.07 0.08 -0.22 0.68 -1.32 0.00 0.00 176.35 175.65 3lze s VAL 17 N 0.46 1.89 -0.21 1.68 -7.23 -0.20 -5.02 120.40 111.77 3lze s VAL 17 Ca -0.13 -0.92 -0.21 0.00 -1.81 0.00 0.00 61.98 58.92 3lze s VAL 17 Cb -0.15 -1.64 0.06 0.00 0.56 0.00 0.00 36.38 35.20 3lze s VAL 17 CO 0.04 0.52 0.59 -1.83 -0.31 0.00 0.00 175.10 174.11 3lze s GLU 18 N 0.44 0.70 -0.21 4.82 -1.05 -1.26 -1.77 118.70 120.36 3lze s GLU 18 Ca -0.17 0.77 -0.28 0.00 -0.15 0.00 0.00 54.97 55.14 3lze s GLU 18 Cb -0.17 0.34 0.14 0.00 -0.44 0.00 0.00 34.13 34.00 3lze s GLU 18 CO 0.07 -0.10 1.07 0.45 0.95 0.00 0.00 175.26 177.71 3lze s SER 19 N 0.21 -0.34 0.53 0.83 0.15 -1.26 -5.01 113.70 108.82 3lze s SER 19 Ca -0.01 0.47 0.35 0.00 0.70 0.00 0.00 55.95 57.46 3lze s SER 19 Cb -0.04 0.41 1.92 0.00 -1.71 0.00 0.00 66.02 66.61 3lze s SER 19 CO 0.01 -0.24 2.08 -0.65 1.20 0.00 0.00 173.24 175.65 3lze h PRO 20 N 2.98 0.00 0.00 5.44 0.11 -2.01 -2.55 132.00 135.96 3lze h PRO 20 Ca -0.20 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.84 3lze h PRO 20 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3lze h PRO 20 CO 0.24 0.00 -0.33 -0.07 -0.21 0.00 0.00 178.00 177.63 3lze h LEU 21 N 0.00 0.00 -5.96 2.35 3.38 -1.97 -3.35 115.31 109.75 3lze h LEU 21 Ca 0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.24 3lze h LEU 21 Cb 0.03 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.69 3lze h LEU 21 CO 0.00 0.33 2.67 0.49 0.09 0.00 0.00 178.44 182.02 3lze n PHE 22 N -3.44 2.96 -4.28 1.13 3.72 -0.96 -4.87 117.46 111.72 3lze n PHE 22 Ca 0.00 -2.89 -0.22 0.00 -0.05 0.00 0.00 57.45 54.29 3lze n PHE 22 Cb 0.51 -2.17 -0.12 0.00 -0.94 0.00 0.00 39.48 36.75 3lze n PHE 22 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3lze s SER 23 N 1.59 2.26 -0.06 4.37 0.01 -1.26 -1.02 113.70 119.59 3lze s SER 23 Ca 0.49 -0.65 -0.02 0.00 1.31 0.00 0.00 55.95 57.07 3lze s SER 23 Cb 0.14 -0.12 0.04 0.00 0.21 0.00 0.00 66.02 66.29 3lze s SER 23 CO -0.05 0.03 0.10 0.72 0.41 0.00 0.00 173.24 174.45 3lze s PHE 24 N -1.16 -0.05 -0.53 2.43 -0.12 -0.61 -4.59 117.98 113.35 3lze s PHE 24 Ca 0.04 0.40 -0.18 0.00 -0.05 0.00 0.00 56.93 57.13 3lze s PHE 24 Cb -0.10 -0.34 0.08 0.00 -0.63 0.00 0.00 43.02 42.03 3lze s PHE 24 CO 0.03 -0.21 0.60 -0.80 -0.05 0.00 0.00 175.22 174.80 3lze s ASN 25 N 2.01 6.20 0.15 1.98 0.01 -1.26 -1.17 114.94 122.86 3lze s ASN 25 Ca 0.02 -1.20 0.06 0.00 -0.71 0.00 0.00 52.86 51.03 3lze s ASN 25 Cb -0.12 -2.27 -0.04 0.00 0.41 0.00 0.00 41.25 39.23 3lze s ASN 25 CO -0.04 -0.92 -0.13 0.00 -1.51 0.00 0.00 177.10 174.50 3lze s ALA 27 N -2.77 3.92 0.22 0.00 0.00 -0.86 -0.93 121.76 121.34 3lze s ALA 27 Ca 0.15 -0.93 -0.21 0.00 0.00 0.00 0.00 51.96 50.97 3lze s ALA 27 Cb -0.01 -1.87 0.07 0.00 0.00 0.00 0.00 23.12 21.31 3lze s ALA 27 CO 0.03 0.54 0.96 -3.38 0.00 0.00 0.00 175.76 173.92 3lze s HIS 28 N -1.76 0.03 -0.03 0.00 -3.43 -0.57 -1.51 115.29 108.03 3lze s HIS 28 Ca 0.36 -0.47 -0.21 0.00 -0.80 0.00 0.00 55.06 53.94 3lze s HIS 28 Cb -0.11 0.72 0.04 0.00 -1.43 0.00 0.00 32.58 31.80 3lze s HIS 28 CO 0.28 -1.05 0.44 -0.59 -2.00 0.00 0.00 174.74 171.83 3lze s PHE 29 N -2.48 -0.35 -0.11 0.38 -0.12 -1.26 -2.39 117.98 111.65 3lze s PHE 29 Ca 0.18 0.57 -0.11 0.00 -0.05 0.00 0.00 56.93 57.52 3lze s PHE 29 Cb -0.03 0.21 -0.05 0.00 -0.63 0.00 0.00 43.02 42.52 3lze s PHE 29 CO 0.06 -0.47 0.25 0.96 -0.05 0.00 0.00 175.22 175.97 3lze s ILE 30 N -1.29 5.32 -0.08 -4.49 -4.36 -1.26 -4.71 121.20 110.33 3lze s ILE 30 Ca -0.13 0.46 -0.04 0.00 -0.26 0.00 0.00 60.65 60.68 3lze s ILE 30 Cb -0.03 -3.55 0.04 0.00 1.25 0.00 0.00 42.46 40.17 3lze s ILE 30 CO 0.06 0.53 0.19 0.00 0.24 0.00 0.00 174.94 175.95 3lze s ALA 31 N -0.47 -0.39 0.31 2.27 0.00 -1.26 -0.22 121.76 122.00 3lze s ALA 31 Ca 0.17 0.78 -0.06 0.00 0.00 0.00 0.00 51.96 52.85 3lze s ALA 31 Cb -0.13 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.49 3lze s ALA 31 CO 0.06 -0.16 0.48 -0.59 0.00 0.00 0.00 175.76 175.54 3lze s PHE 32 N 1.09 0.82 0.04 0.00 -0.12 -0.35 -4.92 117.98 114.54 3lze s PHE 32 Ca -0.08 -1.12 -0.34 0.00 -0.05 0.00 0.00 56.93 55.34 3lze s PHE 32 Cb -0.10 0.03 -0.13 0.00 -0.63 0.00 0.00 43.02 42.19 3lze s PHE 32 CO -0.06 -1.10 1.69 1.63 -0.05 0.00 0.00 175.22 177.33 3lze n LYS 33 N -0.50 2.09 -1.05 1.99 4.76 -1.26 -0.29 118.16 123.90 3lze n LYS 33 Ca -0.00 0.76 -0.02 0.00 -2.87 0.00 0.00 58.31 56.18 3lze n LYS 33 Cb 0.62 -2.55 -0.01 0.00 -1.84 0.00 0.00 35.03 31.25 3lze n LYS 33 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3lze n GLY 34 N 3.80 0.48 3.29 0.72 0.00 -1.26 -5.00 105.19 107.22 3lze n GLY 34 Ca 0.20 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 3lze n GLY 34 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3lze s PHE 35 N -1.81 -0.48 -0.09 1.61 5.36 0.60 -5.14 117.98 118.03 3lze s PHE 35 Ca 0.00 1.14 -0.04 0.00 -0.96 0.00 0.00 56.93 57.07 3lze s PHE 35 Cb 0.00 0.18 0.05 0.00 -0.34 0.00 0.00 43.02 42.91 3lze s PHE 35 CO 0.00 -0.25 0.18 0.50 -1.46 0.00 0.00 175.22 174.19 3lze s ARG 36 N 0.51 0.08 0.52 10.12 3.00 -1.26 -1.21 118.95 130.71 3lze s ARG 36 Ca -0.02 0.53 0.02 0.00 -1.00 0.00 0.00 55.73 55.25 3lze s ARG 36 Cb -0.04 -0.20 0.02 0.00 0.00 0.00 0.00 34.95 34.73 3lze s ARG 36 CO -0.03 -0.25 0.73 0.00 0.00 0.00 0.00 175.30 175.76 3lze s THR 38 N -2.68 4.22 0.26 0.00 -4.23 -1.26 -4.54 115.64 107.41 3lze s THR 38 Ca 0.55 0.91 -0.31 0.00 -1.18 0.00 0.00 61.69 61.66 3lze s THR 38 Cb -0.10 -3.57 -0.12 0.00 1.34 0.00 0.00 72.50 70.05 3lze s THR 38 CO 0.38 -0.76 1.59 -0.11 -0.54 0.00 0.00 174.62 175.17 3lze n LEU 39 N -2.32 4.01 0.00 4.79 7.94 -1.26 -4.69 117.00 125.46 3lze n LEU 39 Ca 0.07 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.10 3lze n LEU 39 Cb 0.54 -1.55 0.00 0.00 0.53 0.00 0.00 43.42 42.93 3lze n LEU 39 CO 0.51 0.02 0.00 0.00 -1.11 0.00 0.00 177.39 176.82 3lze n HIS 40 N 2.53 0.00 -3.80 1.96 1.44 -1.01 -5.03 115.22 111.32 3lze n HIS 40 Ca 0.11 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.78 3lze n HIS 40 Cb 0.35 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.46 3lze n HIS 40 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 3lze s GLY 41 N -0.03 -0.08 0.01 -1.39 0.00 -1.26 -1.51 107.32 103.06 3lze s GLY 41 Ca 0.00 -0.09 -0.24 0.00 0.00 0.00 0.00 44.72 44.39 3lze s GLY 41 CO 0.00 0.69 0.55 0.30 0.00 0.00 0.00 173.10 174.64 3lze s HIS 42 N -2.89 -0.48 -0.88 1.90 3.76 -0.10 -4.98 115.29 111.62 3lze s HIS 42 Ca 0.15 0.66 -0.18 0.00 -0.15 0.00 0.00 55.06 55.55 3lze s HIS 42 Cb -0.02 0.34 0.14 0.00 1.11 0.00 0.00 32.58 34.15 3lze s HIS 42 CO 0.04 -0.61 1.03 -0.80 -0.85 0.00 0.00 174.74 173.55 3lze s ASN 43 N -1.65 6.61 0.42 1.40 0.01 -1.26 -1.19 114.94 119.29 3lze s ASN 43 Ca -0.08 -2.10 -0.23 0.00 -0.71 0.00 0.00 52.86 49.74 3lze s ASN 43 Cb -0.01 -2.36 -0.09 0.00 0.41 0.00 0.00 41.25 39.20 3lze s ASN 43 CO 0.03 -0.98 1.04 -0.31 -1.51 0.00 0.00 177.10 175.36 3lze s TYR 44 N 2.24 3.20 -0.00 2.20 2.02 -0.31 -4.56 117.35 122.13 3lze s TYR 44 Ca 0.28 1.63 0.04 0.00 -0.37 0.00 0.00 57.07 58.65 3lze s TYR 44 Cb -0.07 -3.08 -0.01 0.00 -0.40 0.00 0.00 41.96 38.39 3lze s TYR 44 CO -0.08 -0.62 -0.12 1.21 -1.57 0.00 0.00 175.55 174.36 3lze s ASN 45 N -1.73 1.47 -0.12 2.29 3.84 -0.47 -1.57 114.94 118.65 3lze s ASN 45 Ca 0.61 -0.25 0.03 0.00 0.21 0.00 0.00 52.86 53.46 3lze s ASN 45 Cb -0.19 -0.16 0.00 0.00 -0.55 0.00 0.00 41.25 40.35 3lze s ASN 45 CO 0.24 0.14 -0.22 -0.69 -2.79 0.00 0.00 177.10 173.78 3lze s VAL 46 N -0.35 2.19 0.15 -5.21 1.01 -0.19 -0.70 120.40 117.30 3lze s VAL 46 Ca 0.04 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.15 3lze s VAL 46 Cb -0.05 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 3lze s VAL 46 CO -0.00 0.55 -0.09 -0.94 0.00 0.00 0.00 175.10 174.62 3lze s SER 47 N 0.57 4.36 -0.06 3.32 1.04 -0.10 -4.58 113.70 118.25 3lze s SER 47 Ca -0.12 -0.49 0.03 0.00 0.48 0.00 0.00 55.95 55.85 3lze s SER 47 Cb -0.17 -0.79 0.01 0.00 0.10 0.00 0.00 66.02 65.17 3lze s SER 47 CO 0.04 0.13 -0.15 -0.22 0.98 0.00 0.00 173.24 174.01 3lze s LEU 48 N -2.61 1.80 -0.03 2.42 2.96 -0.73 -1.29 118.68 121.20 3lze s LEU 48 Ca 0.24 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 53.85 3lze s LEU 48 Cb -0.10 -0.94 -0.01 0.00 0.50 0.00 0.00 46.19 45.64 3lze s LEU 48 CO 0.15 0.09 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.50 3lze s ARG 49 N 0.40 1.64 0.07 1.98 3.52 0.17 -1.03 118.95 125.69 3lze s ARG 49 Ca -0.11 -0.63 -0.03 0.00 -0.13 0.00 0.00 55.73 54.83 3lze s ARG 49 Cb -0.14 -1.49 -0.03 0.00 -1.56 0.00 0.00 34.95 31.73 3lze s ARG 49 CO 0.04 0.31 0.04 -0.48 -0.81 0.00 0.00 175.30 174.40 3lze s LEU 50 N -0.17 2.15 -0.04 -0.88 0.05 -0.39 -0.50 118.68 118.88 3lze s LEU 50 Ca 0.01 -0.92 0.02 0.00 0.05 0.00 0.00 54.13 53.29 3lze s LEU 50 Cb -0.09 0.44 0.01 0.00 -2.05 0.00 0.00 46.19 44.49 3lze s LEU 50 CO 0.01 -0.65 -0.10 -0.13 -0.55 0.00 0.00 176.35 174.94 3lze s ARG 51 N -3.91 1.21 0.24 1.48 0.52 -0.73 -1.03 118.95 116.73 3lze s ARG 51 Ca 0.08 -0.32 -0.08 0.00 -0.52 0.00 0.00 55.73 54.89 3lze s ARG 51 Cb 0.07 -1.08 0.03 0.00 0.52 0.00 0.00 34.95 34.49 3lze s ARG 51 CO -0.09 0.06 0.47 0.41 0.02 0.00 0.00 175.30 176.17 3lze n GLY 52 N 3.58 1.49 3.85 -3.53 0.00 -0.81 -0.85 105.19 108.92 3lze n GLY 52 Ca -0.21 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.27 3lze n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3lze s ASN 53 N -2.29 6.77 0.09 1.61 0.01 -1.26 -1.00 114.94 118.87 3lze s ASN 53 Ca 0.11 1.07 -0.31 0.00 -0.71 0.00 0.00 52.86 53.02 3lze s ASN 53 Cb -0.03 -2.29 -0.09 0.00 0.41 0.00 0.00 41.25 39.26 3lze s ASN 53 CO 0.08 0.01 1.62 -0.63 -1.51 0.00 0.00 177.10 176.67 3lze s ILE 54 N -1.63 2.96 0.60 0.60 1.01 -0.83 -4.38 121.20 119.52 3lze s ILE 54 Ca 0.43 0.51 -0.01 0.00 0.00 0.00 0.00 60.65 61.58 3lze s ILE 54 Cb -0.13 -3.33 0.04 0.00 0.01 0.00 0.00 42.46 39.06 3lze s ILE 54 CO 0.20 0.01 0.85 -1.10 0.00 0.00 0.00 174.94 174.89 3lze s GLN 55 N 2.22 2.41 0.60 2.79 -1.52 -0.40 -4.79 119.66 120.98 3lze s GLN 55 Ca 0.72 -0.66 0.40 0.00 -1.95 0.00 0.00 55.36 53.87 3lze s GLN 55 Cb -0.40 -2.40 2.11 0.00 -0.22 0.00 0.00 33.01 32.10 3lze s GLN 55 CO 0.32 -0.88 2.22 0.78 -0.25 0.00 0.00 175.29 177.48 3lze h GLY 56 N -0.13 0.00 0.84 3.09 0.00 -1.95 0.82 103.07 105.74 3lze h GLY 56 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 3lze h GLY 56 CO 0.54 0.00 -0.09 2.09 0.00 0.00 0.00 176.54 179.07 3lze n ASP 57 N -2.95 0.49 0.00 0.19 5.68 -1.26 -4.94 116.55 113.76 3lze n ASP 57 Ca -0.02 -0.65 0.00 0.00 -0.50 0.00 0.00 54.79 53.61 3lze n ASP 57 Cb 0.10 -0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.01 3lze n ASP 57 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3lze n GLY 58 N 1.25 0.71 3.48 6.12 0.00 0.28 -5.07 105.19 111.97 3lze n GLY 58 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3lze n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lze s TYR 59 N -2.65 2.54 -0.01 1.61 2.02 -1.25 -4.80 117.35 114.81 3lze s TYR 59 Ca 0.00 -0.26 -0.25 0.00 -0.37 0.00 0.00 57.07 56.19 3lze s TYR 59 Cb 0.00 -1.38 -0.18 0.00 -0.40 0.00 0.00 41.96 39.99 3lze s TYR 59 CO 0.00 0.34 1.27 0.28 -1.57 0.00 0.00 175.55 175.87 3lze h VAL 60 N 3.69 1.13 -2.55 0.71 2.07 -1.91 -1.05 116.25 118.33 3lze h VAL 60 Ca -0.49 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.04 3lze h VAL 60 Cb 1.16 1.69 -0.20 0.00 -1.52 0.00 0.00 31.29 32.43 3lze h VAL 60 CO 0.46 0.22 -0.06 -0.51 0.02 0.00 0.00 177.57 177.70 3lze s ILE 61 N -4.47 0.03 0.07 4.57 2.07 -1.26 -4.71 121.20 117.50 3lze s ILE 61 Ca -0.15 -0.24 -0.31 0.00 -1.41 0.00 0.00 60.65 58.55 3lze s ILE 61 Cb 0.02 -0.79 -0.09 0.00 0.13 0.00 0.00 42.46 41.73 3lze s ILE 61 CO 0.62 -0.13 1.79 -0.62 -1.91 0.00 0.00 174.94 174.69 3lze s ASP 62 N -1.16 6.51 0.33 4.50 -1.08 -1.26 -4.90 116.67 119.62 3lze s ASP 62 Ca -0.12 2.60 0.09 0.00 -0.52 0.00 0.00 52.55 54.61 3lze s ASP 62 Cb -0.03 -2.55 0.84 0.00 -1.46 0.00 0.00 42.92 39.71 3lze s ASP 62 CO 0.06 -0.97 1.79 -0.26 0.52 0.00 0.00 175.17 176.31 3lze h PHE 63 N 9.06 0.94 -0.93 -5.34 0.04 -2.00 -2.02 116.94 116.68 3lze h PHE 63 Ca -0.45 0.03 0.14 0.00 2.80 0.00 0.00 57.97 60.49 3lze h PHE 63 Cb 1.21 -0.28 -0.08 0.00 2.20 0.00 0.00 35.95 39.00 3lze h PHE 63 CO 0.83 0.20 0.59 0.66 -0.60 0.00 0.00 178.31 180.00 3lze h SER 64 N 0.67 0.74 -0.21 2.17 4.64 -1.99 -0.19 113.55 119.37 3lze h SER 64 Ca 0.56 0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.81 3lze h SER 64 Cb 1.01 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3lze h SER 64 CO -0.34 0.37 -0.33 0.40 -0.87 0.00 0.00 176.83 176.06 3lze h ILE 65 N 0.78 1.33 -0.51 0.95 2.04 -1.76 -1.05 117.51 119.29 3lze h ILE 65 Ca 0.47 -1.54 0.06 0.00 1.00 0.00 0.00 64.86 64.85 3lze h ILE 65 Cb 0.68 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 38.53 3lze h ILE 65 CO -0.23 0.48 0.22 -0.07 0.00 0.00 0.00 178.15 178.54 3lze h LEU 66 N 0.26 0.27 -0.37 1.44 3.38 -1.36 -1.58 115.31 117.34 3lze h LEU 66 Ca 0.02 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 3lze h LEU 66 Cb 0.91 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 3lze h LEU 66 CO 0.08 0.18 0.08 0.11 0.09 0.00 0.00 178.44 178.98 3lze h LYS 67 N 0.42 0.60 -0.68 1.13 1.57 -0.98 -1.15 116.57 117.49 3lze h LYS 67 Ca 0.24 -0.15 0.07 0.00 -1.87 0.00 0.00 60.65 58.94 3lze h LYS 67 Cb 0.21 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 3lze h LYS 67 CO -0.21 0.65 0.36 1.49 -0.57 0.00 0.00 179.45 181.17 3lze h GLU 68 N 0.46 0.62 0.10 3.15 4.81 -1.02 -1.87 114.58 120.84 3lze h GLU 68 Ca 0.12 -0.04 -0.29 0.00 -0.13 0.00 0.00 59.36 59.02 3lze h GLU 68 Cb 0.32 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3lze h GLU 68 CO 0.00 0.41 -1.39 0.87 -0.73 0.00 0.00 179.01 178.17 3lze h LYS 69 N 0.64 0.22 -0.58 1.92 1.79 -1.17 -2.02 116.57 117.36 3lze h LYS 69 Ca 0.32 -0.38 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 3lze h LYS 69 Cb 0.27 0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 31.03 3lze h LYS 69 CO -0.22 1.11 0.28 0.28 -1.08 0.00 0.00 179.45 179.81 3lze h VAL 70 N 0.06 1.21 -0.48 0.50 2.07 -1.21 -1.97 116.25 116.43 3lze h VAL 70 Ca -0.19 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 66.79 3lze h VAL 70 Cb 1.98 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.22 3lze h VAL 70 CO 0.17 0.24 0.17 -0.09 0.02 0.00 0.00 177.57 178.08 3lze h ARG 71 N 0.80 0.34 -0.08 1.57 2.43 -1.34 -1.22 114.38 116.87 3lze h ARG 71 Ca 0.20 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3lze h ARG 71 Cb 0.13 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3lze h ARG 71 CO -0.02 0.22 0.04 -0.22 -1.51 0.00 0.00 179.97 178.48 3lze h LYS 72 N 0.35 0.12 -0.25 0.20 3.64 -0.96 -0.35 116.57 119.32 3lze h LYS 72 Ca 0.23 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 3lze h LYS 72 Cb 0.23 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3lze h LYS 72 CO -0.23 0.18 0.11 0.28 -2.27 0.00 0.00 179.45 177.52 3lze h VAL 73 N 0.02 1.16 -0.70 2.00 2.07 -1.20 -2.80 116.25 116.80 3lze h VAL 73 Ca 0.03 -0.48 0.08 0.00 0.82 0.00 0.00 66.70 67.15 3lze h VAL 73 Cb 0.10 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.82 3lze h VAL 73 CO -0.00 0.16 0.36 0.00 0.02 0.00 0.00 177.57 178.11 3lze h LYS 75 N 0.63 0.32 -0.28 0.00 1.63 -0.81 0.11 116.57 118.19 3lze h LYS 75 Ca 0.34 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 60.02 3lze h LYS 75 Cb 0.32 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.88 3lze h LYS 75 CO -0.24 0.36 -0.11 1.96 -3.45 0.00 0.00 179.45 177.96 3lze h GLN 76 N 0.31 0.46 0.06 1.90 4.20 -1.22 -3.15 115.11 117.67 3lze h GLN 76 Ca 0.07 -0.13 -0.30 0.00 0.06 0.00 0.00 58.65 58.36 3lze h GLN 76 Cb 0.24 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3lze h GLN 76 CO 0.01 0.58 -1.62 -0.07 -0.67 0.00 0.00 178.83 177.06 3lze h LEU 77 N 0.43 0.20 -9.73 1.46 3.38 -1.29 -3.48 115.31 106.28 3lze h LEU 77 Ca 0.08 -0.34 -0.57 0.00 0.09 0.00 0.00 57.88 57.14 3lze h LEU 77 Cb 0.46 -0.07 0.12 0.00 0.09 0.00 0.00 40.66 41.26 3lze h LEU 77 CO 0.03 1.30 0.40 -0.67 0.09 0.00 0.00 178.44 179.58 3lze n ASP 78 N -3.29 2.25 -3.40 -0.43 4.64 -0.06 -3.01 116.55 113.25 3lze n ASP 78 Ca -0.17 1.13 -0.23 0.00 -1.38 0.00 0.00 54.79 54.14 3lze n ASP 78 Cb 1.04 -1.45 0.07 0.00 -1.04 0.00 0.00 41.12 39.74 3lze n ASP 78 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 3lze n HIS 79 N -0.04 -2.65 -4.12 -0.67 8.25 -0.24 -4.90 115.22 110.86 3lze n HIS 79 Ca 0.07 0.91 -0.08 0.00 -0.26 0.00 0.00 57.72 58.35 3lze n HIS 79 Cb 0.38 -4.83 -0.10 0.00 1.12 0.00 0.00 29.99 26.55 3lze n HIS 79 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3lze s HIS 80 N -3.29 0.68 -0.02 4.41 3.76 -1.16 -4.95 115.29 114.72 3lze s HIS 80 Ca 0.52 -1.07 -0.28 0.00 -0.15 0.00 0.00 55.06 54.08 3lze s HIS 80 Cb -0.23 -0.44 -0.03 0.00 1.11 0.00 0.00 32.58 32.99 3lze s HIS 80 CO 0.65 -0.35 0.91 0.12 -0.85 0.00 0.00 174.74 175.22 3lze s PHE 81 N -3.87 3.63 -0.30 1.40 5.36 0.80 -2.03 117.98 122.97 3lze s PHE 81 Ca 0.11 1.59 -0.22 0.00 -0.96 0.00 0.00 56.93 57.45 3lze s PHE 81 Cb 0.07 -3.05 -0.00 0.00 -0.34 0.00 0.00 43.02 39.70 3lze s PHE 81 CO -0.06 0.00 0.72 0.42 -1.46 0.00 0.00 175.22 174.83 3lze s ILE 82 N 1.01 4.86 -0.25 3.12 1.01 -0.57 -0.68 121.20 129.70 3lze s ILE 82 Ca 0.48 1.06 -0.01 0.00 0.00 0.00 0.00 60.65 62.18 3lze s ILE 82 Cb -0.20 -4.08 0.03 0.00 0.01 0.00 0.00 42.46 38.22 3lze s ILE 82 CO 0.25 -0.19 -0.07 -0.22 0.00 0.00 0.00 174.94 174.71 3lze s LEU 83 N 2.79 3.22 0.51 2.97 2.96 -0.03 -4.76 118.68 126.34 3lze s LEU 83 Ca 0.29 -0.95 -0.21 0.00 -0.22 0.00 0.00 54.13 53.04 3lze s LEU 83 Cb -0.15 -1.65 -0.06 0.00 0.50 0.00 0.00 46.19 44.84 3lze s LEU 83 CO 0.12 -0.14 1.18 -2.16 -1.32 0.00 0.00 176.35 174.03 3lze s PRO 84 N 1.29 3.46 -0.02 0.98 0.04 -1.26 -1.59 135.00 137.89 3lze s PRO 84 Ca -0.01 1.79 0.20 0.00 0.04 0.00 0.00 61.00 63.01 3lze s PRO 84 Cb -0.17 -2.21 -0.22 0.00 0.04 0.00 0.00 34.50 31.94 3lze s PRO 84 CO -0.05 -0.81 0.53 -1.33 0.04 0.00 0.00 177.00 175.39 3lze n MET 85 N -0.94 0.65 -0.08 4.56 2.81 -0.66 -4.53 117.12 118.93 3lze n MET 85 Ca 0.10 0.01 0.08 0.00 -1.81 0.00 0.00 57.70 56.07 3lze n MET 85 Cb 0.49 -1.64 0.11 0.00 -0.71 0.00 0.00 33.22 31.48 3lze n MET 85 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3lze n TYR 86 N -2.61 0.00 -1.99 2.03 4.01 -0.66 -4.98 117.16 112.96 3lze n TYR 86 Ca -0.13 -0.88 -0.41 0.00 -0.16 0.00 0.00 57.90 56.32 3lze n TYR 86 Cb 0.80 -0.13 -0.02 0.00 -0.31 0.00 0.00 39.34 39.68 3lze n TYR 86 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3lze s SER 87 N -2.52 6.62 0.00 7.72 0.15 -1.24 -4.57 113.70 119.85 3lze s SER 87 Ca 0.26 2.73 0.27 0.00 0.70 0.00 0.00 55.95 59.91 3lze s SER 87 Cb 0.23 -2.63 1.12 0.00 -1.71 0.00 0.00 66.02 63.02 3lze s SER 87 CO 0.02 -0.71 1.77 -0.90 1.20 0.00 0.00 173.24 174.63 3lze n ASP 88 N 1.92 1.25 0.00 5.45 5.75 -1.26 -4.19 116.55 125.46 3lze n ASP 88 Ca 0.05 -1.47 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 3lze n ASP 88 Cb 0.40 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 3lze n ASP 88 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 3lze n VAL 89 N -0.01 0.53 -5.27 2.12 0.24 -1.26 -5.00 118.33 109.67 3lze n VAL 89 Ca 0.19 -0.59 -0.31 0.00 -2.04 0.00 0.00 64.34 61.59 3lze n VAL 89 Cb 0.30 0.80 -0.16 0.00 -1.47 0.00 0.00 33.84 33.31 3lze n VAL 89 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3lze s LEU 90 N -0.53 2.08 -0.35 1.34 1.43 -1.26 -3.76 118.68 117.63 3lze s LEU 90 Ca 0.00 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.52 3lze s LEU 90 Cb 0.00 -1.34 0.00 0.00 0.03 0.00 0.00 46.19 44.88 3lze s LEU 90 CO 0.00 0.32 0.21 0.21 0.23 0.00 0.00 176.35 177.32 3lze s ASN 91 N -0.65 5.81 -0.33 2.29 3.84 -0.36 -4.92 114.94 120.62 3lze s ASN 91 Ca 0.10 -0.69 -0.07 0.00 0.21 0.00 0.00 52.86 52.41 3lze s ASN 91 Cb -0.10 -2.07 0.03 0.00 -0.55 0.00 0.00 41.25 38.57 3lze s ASN 91 CO -0.01 -0.30 0.11 -0.63 -2.79 0.00 0.00 177.10 173.48 3lze s ILE 92 N 1.63 3.87 0.01 -5.21 1.01 -1.26 -0.73 121.20 120.53 3lze s ILE 92 Ca 0.04 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.71 3lze s ILE 92 Cb -0.18 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 3lze s ILE 92 CO 0.08 -0.12 -0.07 -1.10 0.00 0.00 0.00 174.94 173.72 3lze s GLN 93 N 1.43 2.51 -0.29 2.79 -0.21 0.82 -4.96 119.66 121.75 3lze s GLN 93 Ca -0.00 -0.76 -0.13 0.00 0.02 0.00 0.00 55.36 54.49 3lze s GLN 93 Cb -0.19 -2.48 -0.04 0.00 1.00 0.00 0.00 33.01 31.31 3lze s GLN 93 CO 0.03 0.59 0.29 -1.21 -2.12 0.00 0.00 175.29 172.88 3lze s GLU 94 N -1.50 3.86 -0.22 2.91 2.02 -1.26 -0.41 118.70 124.10 3lze s GLU 94 Ca 0.18 -0.23 0.01 0.00 0.02 0.00 0.00 54.97 54.94 3lze s GLU 94 Cb -0.11 -3.70 0.05 0.00 0.10 0.00 0.00 34.13 30.47 3lze s GLU 94 CO 0.08 -0.30 -0.08 0.08 0.02 0.00 0.00 175.26 175.06 3lze s VAL 95 N 1.92 1.66 0.00 2.63 1.01 0.01 -4.97 120.40 122.66 3lze s VAL 95 Ca 0.11 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.90 3lze s VAL 95 Cb -0.16 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.39 3lze s VAL 95 CO 0.11 0.02 0.00 0.59 0.00 0.00 0.00 175.10 175.82 3lze n ASN 96 N 4.64 0.00 -1.26 3.32 3.02 -1.26 -0.43 115.26 123.30 3lze n ASN 96 Ca -0.13 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.44 3lze n ASN 96 Cb 0.45 0.00 0.27 0.00 -0.61 0.00 0.00 39.78 39.89 3lze n ASN 96 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3lze n ASP 97 N 6.40 3.95 -4.51 6.41 8.00 -1.26 -4.96 116.55 130.58 3lze n ASP 97 Ca 0.00 -3.21 -0.24 0.00 0.71 0.00 0.00 54.79 52.05 3lze n ASP 97 Cb 0.00 -0.62 -0.09 0.00 -0.02 0.00 0.00 41.12 40.39 3lze n ASP 97 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3lze s ASN 98 N -1.78 3.83 -0.21 -2.24 -0.87 0.43 -0.75 114.94 113.35 3lze s ASN 98 Ca 0.46 -0.92 -0.08 0.00 -1.57 0.00 0.00 52.86 50.75 3lze s ASN 98 Cb 0.38 -0.44 -0.04 0.00 -0.02 0.00 0.00 41.25 41.13 3lze s ASN 98 CO 0.09 0.03 0.09 -0.36 -2.57 0.00 0.00 177.10 174.38 3lze s PHE 99 N -2.43 3.24 -0.19 2.20 0.08 0.46 -0.81 117.98 120.53 3lze s PHE 99 Ca 0.30 0.04 -0.05 0.00 0.12 0.00 0.00 56.93 57.34 3lze s PHE 99 Cb -0.05 -2.17 -0.03 0.00 -0.57 0.00 0.00 43.02 40.20 3lze s PHE 99 CO 0.16 0.04 0.00 0.21 -0.10 0.00 0.00 175.22 175.53 3lze s LYS 100 N 0.80 3.65 -0.13 0.44 2.20 0.45 -1.11 119.74 126.04 3lze s LYS 100 Ca 0.05 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.17 3lze s LYS 100 Cb -0.13 -3.08 -0.01 0.00 -1.51 0.00 0.00 37.83 33.11 3lze s LYS 100 CO 0.02 0.06 -0.17 0.42 -0.36 0.00 0.00 175.35 175.32 3lze s ILE 101 N 0.89 2.62 -0.14 5.43 1.01 0.64 -0.13 121.20 131.52 3lze s ILE 101 Ca 0.01 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 59.88 3lze s ILE 101 Cb -0.14 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.26 3lze s ILE 101 CO 0.02 0.53 -0.20 -0.89 0.00 0.00 0.00 174.94 174.40 3lze s THR 102 N 0.51 2.20 0.51 2.92 2.01 0.09 -0.50 115.64 123.39 3lze s THR 102 Ca -0.11 -0.93 0.01 0.00 0.31 0.00 0.00 61.69 60.96 3lze s THR 102 Cb -0.16 -1.89 0.02 0.00 0.01 0.00 0.00 72.50 70.48 3lze s THR 102 CO 0.04 0.54 0.74 0.00 -0.69 0.00 0.00 174.62 175.26 3lze h GLU 104 N 0.19 0.00 -0.33 0.00 5.08 -1.90 -0.23 114.58 117.39 3lze h GLU 104 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 3lze h GLU 104 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 3lze h GLU 104 CO 0.54 0.04 0.00 -0.40 -1.00 0.00 0.00 179.01 178.20 3lze n ASP 105 N -3.87 1.54 0.00 1.42 5.68 -1.26 -4.90 116.55 115.16 3lze n ASP 105 Ca -0.03 -2.04 0.00 0.00 -0.50 0.00 0.00 54.79 52.23 3lze n ASP 105 Cb 0.13 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 3lze n ASP 105 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 3lze n ASN 106 N 0.26 -4.06 -4.74 -1.12 5.03 -0.10 -5.01 115.26 105.53 3lze n ASN 106 Ca 0.09 0.00 -0.39 0.00 0.87 0.00 0.00 54.58 55.15 3lze n ASN 106 Cb 0.26 -1.98 0.04 0.00 -1.02 0.00 0.00 39.78 37.08 3lze n ASN 106 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3lze n SER 107 N -0.46 2.73 -4.04 6.41 7.64 -1.26 -4.72 113.62 119.91 3lze n SER 107 Ca 0.00 1.01 -0.18 0.00 1.01 0.00 0.00 58.87 60.71 3lze n SER 107 Cb 0.23 -1.57 -0.14 0.00 -1.01 0.00 0.00 64.21 61.72 3lze n SER 107 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3lze s GLU 108 N -2.74 0.71 0.05 1.43 2.12 -1.26 -1.13 118.70 117.89 3lze s GLU 108 Ca 0.69 -0.43 0.03 0.00 0.36 0.00 0.00 54.97 55.61 3lze s GLU 108 Cb -0.43 -0.67 -0.03 0.00 0.26 0.00 0.00 34.13 33.26 3lze s GLU 108 CO 0.51 0.18 -0.09 0.71 -0.54 0.00 0.00 175.26 176.03 3lze s TYR 109 N -0.44 0.82 -0.05 5.30 2.02 0.35 -4.99 117.35 120.35 3lze s TYR 109 Ca 0.01 -0.52 -0.03 0.00 -0.37 0.00 0.00 57.07 56.17 3lze s TYR 109 Cb -0.05 -0.48 0.03 0.00 -0.40 0.00 0.00 41.96 41.06 3lze s TYR 109 CO 0.00 -0.05 0.12 0.45 -1.57 0.00 0.00 175.55 174.50 3lze s SER 110 N -1.74 -0.09 0.03 2.29 0.15 -1.26 -0.26 113.70 112.82 3lze s SER 110 Ca -0.06 0.25 0.03 0.00 0.70 0.00 0.00 55.95 56.86 3lze s SER 110 Cb -0.09 0.16 -0.02 0.00 -1.71 0.00 0.00 66.02 64.37 3lze s SER 110 CO 0.01 -0.12 -0.09 -0.36 1.20 0.00 0.00 173.24 173.88 3lze s PHE 111 N 0.89 0.79 0.18 3.44 0.08 -0.27 -4.99 117.98 118.10 3lze s PHE 111 Ca -0.07 -0.33 -0.33 0.00 0.12 0.00 0.00 56.93 56.33 3lze s PHE 111 Cb -0.09 -0.48 -0.14 0.00 -0.57 0.00 0.00 43.02 41.74 3lze s PHE 111 CO -0.04 -0.02 1.46 -2.30 -0.10 0.00 0.00 175.22 174.22 3lze n PRO 112 N 2.07 1.94 -0.33 0.24 -0.02 -1.26 -0.40 135.00 137.23 3lze n PRO 112 Ca -0.18 0.69 0.17 0.00 -2.02 0.00 0.00 63.50 62.16 3lze n PRO 112 Cb 0.56 -2.39 0.40 0.00 -0.02 0.00 0.00 33.50 32.05 3lze n PRO 112 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3lze h LYS 113 N 4.95 0.58 0.00 -0.52 1.57 -1.23 -0.89 116.57 121.03 3lze h LYS 113 Ca -0.45 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3lze h LYS 113 Cb 1.28 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.46 3lze h LYS 113 CO 0.81 0.38 0.00 0.00 -0.57 0.00 0.00 179.45 180.08 3lze h ARG 114 N 0.60 0.00 -0.00 3.15 2.47 -1.89 -1.28 114.38 117.43 3lze h ARG 114 Ca 0.59 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.31 3lze h ARG 114 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 3lze h ARG 114 CO -0.36 0.00 -0.08 -0.25 0.56 0.00 0.00 179.97 179.84 3lze n ASP 115 N -2.75 0.55 -4.49 7.04 9.92 -0.34 -4.89 116.55 121.59 3lze n ASP 115 Ca 0.01 -0.78 -0.30 0.00 -0.53 0.00 0.00 54.79 53.19 3lze n ASP 115 Cb 0.25 -0.05 -0.11 0.00 -0.64 0.00 0.00 41.12 40.57 3lze n ASP 115 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3lze s VAL 117 N -1.11 1.92 -0.18 0.00 -7.23 0.15 -4.88 120.40 109.07 3lze s VAL 117 Ca 0.18 -1.14 -0.23 0.00 -1.81 0.00 0.00 61.98 58.97 3lze s VAL 117 Cb -0.11 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 34.91 3lze s VAL 117 CO 0.10 0.25 0.74 -1.10 -0.31 0.00 0.00 175.10 174.78 3lze s GLN 118 N 1.28 4.26 -0.02 4.82 -0.21 -1.26 -0.85 119.66 127.69 3lze s GLN 118 Ca -0.01 0.84 0.06 0.00 0.02 0.00 0.00 55.36 56.27 3lze s GLN 118 Cb -0.16 -3.57 -0.01 0.00 1.00 0.00 0.00 33.01 30.26 3lze s GLN 118 CO -0.09 -0.28 -0.18 0.42 -2.12 0.00 0.00 175.29 173.03 3lze s ILE 119 N 2.03 1.46 -1.35 1.08 -1.09 -0.62 -4.97 121.20 117.73 3lze s ILE 119 Ca 0.34 -0.79 -0.11 0.00 -2.23 0.00 0.00 60.65 57.86 3lze s ILE 119 Cb -0.16 -1.22 -0.06 0.00 -1.58 0.00 0.00 42.46 39.45 3lze s ILE 119 CO 0.11 0.41 2.50 -0.81 -1.23 0.00 0.00 174.94 175.92 3lze n PRO 120 N 2.66 2.92 -4.37 2.79 -0.04 -1.26 -1.66 135.00 136.04 3lze n PRO 120 Ca -0.15 -2.11 -0.19 0.00 -0.04 0.00 0.00 63.50 61.01 3lze n PRO 120 Cb 0.54 -2.86 -0.10 0.00 -0.04 0.00 0.00 33.50 31.03 3lze n PRO 120 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3lze s ILE 121 N 2.98 1.25 -0.08 0.52 -4.36 -1.26 -4.91 121.20 115.34 3lze s ILE 121 Ca 0.57 -2.06 0.09 0.00 -0.26 0.00 0.00 60.65 58.99 3lze s ILE 121 Cb 0.15 -2.40 -0.24 0.00 1.25 0.00 0.00 42.46 41.23 3lze s ILE 121 CO -0.04 -0.30 0.51 0.29 0.24 0.00 0.00 174.94 175.63 3lze n LYS 122 N -0.49 0.66 -3.96 0.37 5.02 -1.26 -1.65 118.16 116.86 3lze n LYS 122 Ca -0.05 0.25 -0.13 0.00 -2.02 0.00 0.00 58.31 56.36 3lze n LYS 122 Cb 0.64 -1.74 -0.14 0.00 -0.02 0.00 0.00 35.03 33.77 3lze n LYS 122 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3lze s HIS 123 N -2.57 0.16 -0.02 2.13 3.76 -1.26 -3.73 115.29 113.75 3lze s HIS 123 Ca -0.10 -0.07 -0.03 0.00 -0.15 0.00 0.00 55.06 54.72 3lze s HIS 123 Cb 0.07 -0.11 -0.12 0.00 1.11 0.00 0.00 32.58 33.54 3lze s HIS 123 CO 0.81 -0.02 2.78 -1.13 -0.85 0.00 0.00 174.74 176.33 3lze n SER 124 N 2.92 5.36 -4.88 1.40 3.41 -1.26 -4.60 113.62 115.97 3lze n SER 124 Ca -0.13 -2.48 -0.30 0.00 -0.26 0.00 0.00 58.87 55.69 3lze n SER 124 Cb 0.59 -1.26 -0.01 0.00 -0.26 0.00 0.00 64.21 63.27 3lze n SER 124 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3lze s SER 125 N 1.90 6.36 0.26 4.04 1.04 -1.26 -4.92 113.70 121.12 3lze s SER 125 Ca 0.34 1.26 -0.04 0.00 0.48 0.00 0.00 55.95 57.99 3lze s SER 125 Cb 0.17 -2.39 0.34 0.00 0.10 0.00 0.00 66.02 64.23 3lze s SER 125 CO -0.01 -0.66 1.90 0.74 0.98 0.00 0.00 173.24 176.20 3lze h THR 126 N 0.31 1.15 -0.10 2.02 2.02 -1.95 -1.03 112.91 115.33 3lze h THR 126 Ca -0.46 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.30 3lze h THR 126 Cb 1.19 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3lze h THR 126 CO 0.62 0.23 0.06 -0.33 0.37 0.00 0.00 175.52 176.47 3lze h GLU 127 N 1.24 0.13 -0.10 6.66 3.07 -1.92 0.04 114.58 123.69 3lze h GLU 127 Ca 0.40 -0.01 -0.17 0.00 -0.50 0.00 0.00 59.36 59.08 3lze h GLU 127 Cb 0.04 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3lze h GLU 127 CO -0.13 0.08 -0.67 0.93 -1.40 0.00 0.00 179.01 177.82 3lze h GLU 128 N 0.13 0.42 -0.58 2.33 5.08 -1.75 -1.97 114.58 118.23 3lze h GLU 128 Ca 0.04 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.02 3lze h GLU 128 Cb -0.01 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3lze h GLU 128 CO -0.01 0.94 0.11 0.82 -1.00 0.00 0.00 179.01 179.87 3lze h ILE 129 N 0.30 1.25 -0.25 3.13 2.04 -1.17 -2.19 117.51 120.63 3lze h ILE 129 Ca -0.02 -0.95 0.04 0.00 1.00 0.00 0.00 64.86 64.93 3lze h ILE 129 Cb 1.23 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 3lze h ILE 129 CO 0.12 0.35 0.03 1.23 0.00 0.00 0.00 178.15 179.87 3lze h GLY 130 N 0.85 0.26 0.94 5.37 0.00 -0.80 -0.22 103.07 109.47 3lze h GLY 130 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.53 3lze h GLY 130 CO 0.01 -0.03 0.48 1.41 0.00 0.00 0.00 176.54 178.41 3lze h LEU 131 N 0.11 0.81 -0.00 3.11 3.38 -1.24 -0.12 115.31 121.36 3lze h LEU 131 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3lze h LEU 131 Cb 0.13 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3lze h LEU 131 CO -0.17 0.58 0.00 0.22 0.09 0.00 0.00 178.44 179.16 3lze h TYR 132 N 0.96 0.01 -0.46 1.13 3.20 -1.00 -2.02 116.97 118.78 3lze h TYR 132 Ca 0.29 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 3lze h TYR 132 Cb -0.05 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 3lze h TYR 132 CO -0.03 0.01 0.28 0.82 -1.64 0.00 0.00 178.16 177.60 3lze h ILE 133 N -0.00 1.14 -0.30 1.81 2.04 -0.82 -0.86 117.51 120.53 3lze h ILE 133 Ca 0.00 -0.32 0.07 0.00 1.00 0.00 0.00 64.86 65.61 3lze h ILE 133 Cb 0.01 0.52 -0.07 0.00 -0.74 0.00 0.00 36.82 36.53 3lze h ILE 133 CO -0.00 0.14 -0.22 0.25 0.00 0.00 0.00 178.15 178.32 3lze h LEU 134 N 0.61 -0.72 -0.77 1.44 5.85 -0.93 0.50 115.31 121.30 3lze h LEU 134 Ca 0.17 0.14 0.01 0.00 0.84 0.00 0.00 57.88 59.03 3lze h LEU 134 Cb -0.01 0.35 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 3lze h LEU 134 CO -0.03 -0.25 0.51 -1.13 -0.34 0.00 0.00 178.44 177.20 3lze h ASN 135 N -0.19 0.89 -0.62 1.25 -1.24 -1.14 -2.19 115.58 112.33 3lze h ASN 135 Ca 0.16 -0.03 -0.10 0.00 0.71 0.00 0.00 56.30 57.04 3lze h ASN 135 Cb 0.44 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 3lze h ASN 135 CO -0.41 0.65 0.01 1.56 -1.29 0.00 0.00 177.43 177.94 3lze h GLN 136 N 1.05 1.09 -0.59 6.67 1.08 -0.40 -2.65 115.11 121.36 3lze h GLN 136 Ca 0.28 -0.34 -0.07 0.00 -1.45 0.00 0.00 58.65 57.07 3lze h GLN 136 Cb -0.12 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.19 3lze h GLN 136 CO -0.06 1.05 0.07 -0.07 -0.95 0.00 0.00 178.83 178.87 3lze h LEU 137 N 0.99 0.92 -0.56 1.46 3.38 0.27 -0.11 115.31 121.66 3lze h LEU 137 Ca 0.18 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 3lze h LEU 137 Cb 0.56 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3lze h LEU 137 CO 0.03 0.94 -0.03 0.40 0.09 0.00 0.00 178.44 179.87 3lze h ILE 138 N 0.90 1.27 -0.32 1.22 2.04 -1.39 -0.45 117.51 120.78 3lze h ILE 138 Ca 0.18 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 3lze h ILE 138 Cb 0.43 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 3lze h ILE 138 CO 0.01 0.42 0.18 -0.33 0.00 0.00 0.00 178.15 178.43 3lze h GLU 139 N 0.89 0.44 -0.27 2.37 5.08 -1.16 -0.66 114.58 121.28 3lze h GLU 139 Ca 0.15 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 3lze h GLU 139 Cb 0.59 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3lze h GLU 139 CO 0.04 0.36 -0.04 0.93 -1.00 0.00 0.00 179.01 179.30 3lze h GLU 140 N 0.39 0.50 -0.10 2.33 4.39 -0.90 -3.07 114.58 118.13 3lze h GLU 140 Ca 0.11 -0.18 -0.16 0.00 0.34 0.00 0.00 59.36 59.47 3lze h GLU 140 Cb 0.05 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 3lze h GLU 140 CO -0.02 0.69 -0.62 0.82 -1.16 0.00 0.00 179.01 178.72 3lze h ILE 141 N 0.27 1.37 -0.17 3.13 2.04 -1.17 -3.50 117.51 119.48 3lze h ILE 141 Ca 0.07 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 63.95 3lze h ILE 141 Cb 0.49 1.98 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 3lze h ILE 141 CO 0.02 0.59 0.00 -0.67 0.00 0.00 0.00 178.15 178.10 3lze n ASP 142 N -3.88 -0.42 0.01 1.72 2.03 -0.27 -4.67 116.55 111.07 3lze n ASP 142 Ca -0.03 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.15 3lze n ASP 142 Cb 0.64 -0.13 -0.08 0.00 -0.72 0.00 0.00 41.12 40.82 3lze n ASP 142 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3lze h LEU 143 N 0.00 0.01 -0.90 -2.67 5.85 -1.80 -0.14 115.31 115.66 3lze h LEU 143 Ca 0.00 -0.26 0.11 0.00 0.84 0.00 0.00 57.88 58.57 3lze h LEU 143 Cb 0.00 -0.00 -0.08 0.00 0.37 0.00 0.00 40.66 40.95 3lze h LEU 143 CO 0.00 0.27 0.54 -0.65 -0.34 0.00 0.00 178.44 178.26 3lze h PRO 144 N -0.24 0.85 -0.89 5.25 0.11 -1.94 -1.12 132.00 134.02 3lze h PRO 144 Ca 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 3lze h PRO 144 Cb 0.26 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 31.14 3lze h PRO 144 CO 0.00 0.56 0.50 0.35 -0.21 0.00 0.00 178.00 179.20 3lze h PHE 145 N 0.87 1.21 -0.59 0.65 3.57 -1.69 -1.78 116.94 119.17 3lze h PHE 145 Ca 0.44 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.95 3lze h PHE 145 Cb 0.42 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 3lze h PHE 145 CO -0.04 0.82 0.36 -0.07 -2.23 0.00 0.00 178.31 177.15 3lze h LEU 146 N 1.24 0.58 -1.25 0.59 3.38 0.11 -2.68 115.31 117.29 3lze h LEU 146 Ca 0.31 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.21 3lze h LEU 146 Cb 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3lze h LEU 146 CO -0.05 0.40 -0.36 0.11 0.09 0.00 0.00 178.44 178.63 3lze h LYS 147 N 0.71 0.00 0.00 1.13 1.57 -0.85 -1.16 116.57 117.97 3lze h LYS 147 Ca 0.24 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.97 3lze h LYS 147 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 3lze h LYS 147 CO -0.10 0.36 -0.24 1.79 -0.57 0.00 0.00 179.45 180.68 3lze h THR 148 N 0.00 1.00 -0.01 -0.16 1.35 -1.00 -2.25 112.91 111.84 3lze h THR 148 Ca -0.00 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 3lze h THR 148 Cb 0.70 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 3lze h THR 148 CO 0.05 0.23 -0.01 0.54 -0.25 0.00 0.00 175.52 176.08 3lze n ARG 149 N -4.01 1.51 -1.03 4.72 5.12 -0.53 -4.93 116.66 117.51 3lze n ARG 149 Ca -0.02 -0.78 -0.01 0.00 -1.93 0.00 0.00 57.85 55.11 3lze n ARG 149 Cb 0.31 -1.48 -0.00 0.00 -1.16 0.00 0.00 32.46 30.12 3lze n ARG 149 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 3lze n SER 150 N -0.06 -3.79 -4.71 0.55 3.41 -0.85 -4.41 113.62 103.76 3lze n SER 150 Ca 0.20 0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.41 3lze n SER 150 Cb 0.31 -1.39 -0.03 0.00 -0.26 0.00 0.00 64.21 62.84 3lze n SER 150 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3lze s VAL 151 N -1.82 2.63 -0.12 -3.33 1.01 -0.67 -4.20 120.40 113.89 3lze s VAL 151 Ca 0.00 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.31 3lze s VAL 151 Cb 0.00 -3.20 0.02 0.00 0.00 0.00 0.00 36.38 33.20 3lze s VAL 151 CO 0.00 0.01 0.77 -0.46 0.00 0.00 0.00 175.10 175.43 3lze n ASN 152 N 4.73 1.58 -3.67 3.32 0.23 -0.03 -4.48 115.26 116.94 3lze n ASN 152 Ca 0.15 -1.51 -0.10 0.00 -0.53 0.00 0.00 54.58 52.60 3lze n ASN 152 Cb 0.38 -0.01 -0.09 0.00 -2.08 0.00 0.00 39.78 37.99 3lze n ASN 152 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 3lze s TYR 153 N -0.53 -0.82 -0.02 -2.53 5.04 -1.22 -1.60 117.35 115.67 3lze s TYR 153 Ca 0.02 1.73 0.02 0.00 -2.44 0.00 0.00 57.07 56.40 3lze s TYR 153 Cb 0.01 0.42 0.01 0.00 0.35 0.00 0.00 41.96 42.75 3lze s TYR 153 CO 0.02 -0.42 -0.07 -1.64 -1.34 0.00 0.00 175.55 172.09 3lze s MET 154 N 1.25 0.83 -0.09 4.97 -1.94 -0.89 -1.78 119.30 121.66 3lze s MET 154 Ca -0.08 -0.25 -0.05 0.00 -1.71 0.00 0.00 55.69 53.61 3lze s MET 154 Cb -0.06 -0.80 0.04 0.00 2.01 0.00 0.00 34.83 36.03 3lze s MET 154 CO -0.13 0.08 0.21 -2.00 -0.01 0.00 0.00 175.02 173.17 3lze s GLU 155 N 0.26 0.17 -0.09 2.03 2.12 0.34 -0.85 118.70 122.68 3lze s GLU 155 Ca -0.04 0.46 0.03 0.00 0.36 0.00 0.00 54.97 55.78 3lze s GLU 155 Cb -0.08 -0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.17 3lze s GLU 155 CO 0.00 -0.15 -0.17 0.08 -0.54 0.00 0.00 175.26 174.48 3lze s VAL 156 N 1.14 2.77 -0.15 3.70 1.01 -0.10 -0.66 120.40 128.12 3lze s VAL 156 Ca -0.09 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 3lze s VAL 156 Cb -0.10 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 3lze s VAL 156 CO -0.07 0.56 -0.07 -0.89 0.00 0.00 0.00 175.10 174.62 3lze s THR 157 N -0.10 3.53 -0.12 3.92 2.01 -0.41 -1.17 115.64 123.31 3lze s THR 157 Ca -0.03 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 61.50 3lze s THR 157 Cb -0.14 -2.53 -0.01 0.00 0.01 0.00 0.00 72.50 69.83 3lze s THR 157 CO 0.04 0.50 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.61 3lze s VAL 158 N 0.43 2.70 -0.14 3.82 1.01 0.08 -0.92 120.40 127.37 3lze s VAL 158 Ca -0.06 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.10 3lze s VAL 158 Cb -0.15 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 3lze s VAL 158 CO 0.04 0.54 -0.04 -0.94 0.00 0.00 0.00 175.10 174.69 3lze s SER 159 N 0.31 4.77 0.12 3.32 1.04 0.12 -0.74 113.70 122.64 3lze s SER 159 Ca -0.13 -0.10 -0.07 0.00 0.48 0.00 0.00 55.95 56.13 3lze s SER 159 Cb -0.16 -1.67 -0.10 0.00 0.10 0.00 0.00 66.02 64.19 3lze s SER 159 CO 0.07 0.21 1.31 -0.33 0.98 0.00 0.00 173.24 175.48 3lze h GLU 160 N 6.39 0.54 -3.50 4.02 5.08 -1.71 -1.24 114.58 124.16 3lze h GLU 160 Ca -0.35 -0.52 -0.04 0.00 -1.00 0.00 0.00 59.36 57.45 3lze h GLU 160 Cb 1.19 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 30.47 3lze h GLU 160 CO 0.61 1.15 -0.07 -1.54 -1.00 0.00 0.00 179.01 178.16 3lze s SER 161 N -7.11 -0.15 0.58 1.42 1.04 -1.25 -4.14 113.70 104.10 3lze s SER 161 Ca -0.07 -0.71 0.28 0.00 0.48 0.00 0.00 55.95 55.93 3lze s SER 161 Cb 0.09 0.57 1.52 0.00 0.10 0.00 0.00 66.02 68.30 3lze s SER 161 CO 0.88 -1.08 1.97 -0.65 0.98 0.00 0.00 173.24 175.34 3lze h PRO 162 N 2.26 0.00 -0.05 4.02 0.11 -1.91 -2.86 132.00 133.56 3lze h PRO 162 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3lze h PRO 162 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3lze h PRO 162 CO 0.37 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.03 3lze n SER 163 N -3.82 2.30 -3.56 -2.05 3.41 -1.26 -4.85 113.62 103.79 3lze n SER 163 Ca 0.07 -1.77 -0.18 0.00 -0.26 0.00 0.00 58.87 56.73 3lze n SER 163 Cb 0.57 -0.02 -0.14 0.00 -0.26 0.00 0.00 64.21 64.36 3lze n SER 163 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3lze s GLN 164 N -1.96 0.15 0.07 4.33 -0.21 -1.08 -5.12 119.66 115.85 3lze s GLN 164 Ca 0.33 0.33 0.05 0.00 0.02 0.00 0.00 55.36 56.09 3lze s GLN 164 Cb 0.20 -0.90 -0.03 0.00 1.00 0.00 0.00 33.01 33.28 3lze s GLN 164 CO 0.31 -0.54 -0.14 0.15 -2.12 0.00 0.00 175.29 172.95 3lze s LYS 165 N 2.32 0.83 -0.00 2.91 1.02 -1.26 -2.05 119.74 123.50 3lze s LYS 165 Ca 0.05 -0.97 0.06 0.00 0.02 0.00 0.00 55.97 55.13 3lze s LYS 165 Cb -0.15 -0.82 -0.02 0.00 -0.52 0.00 0.00 37.83 36.32 3lze s LYS 165 CO -0.10 0.18 -0.20 0.00 -0.92 0.00 0.00 175.35 174.31 3lze s ALA 166 N -1.34 1.66 -0.08 5.17 0.00 0.08 -4.97 121.76 122.28 3lze s ALA 166 Ca -0.01 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.08 3lze s ALA 166 Cb -0.10 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.64 3lze s ALA 166 CO 0.02 0.40 -0.14 0.99 0.00 0.00 0.00 175.76 177.03 3lze s THR 167 N -0.54 1.29 0.10 0.00 2.01 -1.26 -0.74 115.64 116.50 3lze s THR 167 Ca 0.07 -0.56 0.06 0.00 0.31 0.00 0.00 61.69 61.57 3lze s THR 167 Cb -0.08 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 3lze s THR 167 CO -0.00 0.39 -0.14 0.68 -0.69 0.00 0.00 174.62 174.86 3lze s VAL 168 N 0.72 1.24 0.17 3.82 -7.23 -0.31 -4.99 120.40 113.81 3lze s VAL 168 Ca -0.13 -1.51 -0.01 0.00 -1.81 0.00 0.00 61.98 58.51 3lze s VAL 168 Cb -0.16 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 3lze s VAL 168 CO 0.03 -0.31 0.10 -1.38 -0.31 0.00 0.00 175.10 173.24 3lze s HIS 169 N -1.69 0.98 -0.05 2.82 -3.43 -1.26 -0.92 115.29 111.74 3lze s HIS 169 Ca 0.04 -1.28 -0.03 0.00 -0.80 0.00 0.00 55.06 52.99 3lze s HIS 169 Cb -0.07 -0.49 0.03 0.00 -1.43 0.00 0.00 32.58 30.61 3lze s HIS 169 CO 0.03 -0.59 0.11 0.50 -2.00 0.00 0.00 174.74 172.79 3lze s ARG 170 N -4.10 0.08 -0.13 -0.38 3.52 -0.03 -4.99 118.95 112.92 3lze s ARG 170 Ca 0.31 0.25 -0.26 0.00 -0.13 0.00 0.00 55.73 55.90 3lze s ARG 170 Cb 0.07 -0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.34 3lze s ARG 170 CO 0.07 -0.11 0.85 -0.80 -0.81 0.00 0.00 175.30 174.50 3lze s ASN 171 N 0.71 7.05 0.00 -2.12 0.01 -1.26 -2.10 114.94 117.22 3lze s ASN 171 Ca -0.05 1.28 0.00 0.00 -0.71 0.00 0.00 52.86 53.37 3lze s ASN 171 Cb -0.07 -2.47 0.00 0.00 0.41 0.00 0.00 41.25 39.11 3lze s ASN 171 CO -0.03 -0.35 0.31 2.30 -1.51 0.00 0.00 177.10 177.82