#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j3j n MET 2 N 0.00 2.84 -0.18 0.03 0.00 -1.26 -4.90 117.12 113.66 1j3j n MET 2 Ca 0.00 -2.35 0.09 0.00 0.00 0.00 0.00 57.70 55.44 1j3j n MET 2 Cb 0.00 -3.09 0.17 0.00 0.00 0.00 0.00 33.22 30.30 1j3j n MET 2 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1j3j n GLU 3 N 5.53 1.58 -3.77 0.03 1.02 -1.26 -4.90 120.64 118.87 1j3j n GLU 3 Ca 0.58 -2.68 -0.36 0.00 -0.02 0.00 0.00 57.16 54.67 1j3j n GLU 3 Cb 0.34 -1.57 -0.11 0.00 -0.02 0.00 0.00 31.44 30.08 1j3j n GLU 3 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1j3j s GLN 4 N -2.90 2.15 0.07 3.49 -2.07 -1.26 -5.00 119.66 114.13 1j3j s GLN 4 Ca 0.34 -2.07 -0.05 0.00 -1.82 0.00 0.00 55.36 51.76 1j3j s GLN 4 Cb 0.30 -3.60 0.08 0.00 -1.09 0.00 0.00 33.01 28.69 1j3j s GLN 4 CO 0.03 -1.10 0.46 0.28 -1.32 0.00 0.00 175.29 173.64 1j3j n VAL 5 N 4.18 -0.15 -0.06 3.63 0.31 -1.26 -1.54 118.33 123.44 1j3j n VAL 5 Ca 0.01 0.70 -0.14 0.00 -0.01 0.00 0.00 64.34 64.90 1j3j n VAL 5 Cb 0.40 -0.93 -0.09 0.00 -0.91 0.00 0.00 33.84 32.32 1j3j n VAL 5 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1j3j h ASP 7 N -0.49 0.17 -0.15 0.00 3.32 -1.77 -2.72 116.42 114.77 1j3j h ASP 7 Ca 0.06 -0.36 0.02 0.00 0.02 0.00 0.00 57.03 56.77 1j3j h ASP 7 Cb 0.64 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.11 1j3j h ASP 7 CO -0.50 0.49 -0.27 0.58 -1.72 0.00 0.00 179.24 177.83 1j3j h VAL 8 N -0.16 0.00 -0.14 -1.35 2.07 -0.66 -3.10 116.25 112.92 1j3j h VAL 8 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1j3j h VAL 8 Cb 0.42 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1j3j h VAL 8 CO 0.01 0.00 0.00 0.49 0.02 0.00 0.00 177.57 178.09 1j3j n PHE 9 N -3.97 0.18 -3.30 1.57 3.72 0.51 -4.77 117.46 111.40 1j3j n PHE 9 Ca -0.02 -0.09 -0.16 0.00 -0.05 0.00 0.00 57.45 57.13 1j3j n PHE 9 Cb 0.17 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.78 1j3j n PHE 9 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1j3j n ASP 10 N 0.07 -5.56 -4.67 4.37 8.00 -1.05 -4.74 116.55 112.97 1j3j n ASP 10 Ca 0.15 -0.70 -0.36 0.00 0.71 0.00 0.00 54.79 54.59 1j3j n ASP 10 Cb 0.26 -5.16 -0.09 0.00 -0.02 0.00 0.00 41.12 36.11 1j3j n ASP 10 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1j3j s ILE 11 N -3.39 5.35 0.20 0.53 1.01 -1.10 -1.91 121.20 121.89 1j3j s ILE 11 Ca 0.35 0.25 0.10 0.00 0.00 0.00 0.00 60.65 61.35 1j3j s ILE 11 Cb -0.05 -3.52 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 1j3j s ILE 11 CO 0.74 0.35 -0.19 -0.31 0.00 0.00 0.00 174.94 175.53 1j3j s TYR 12 N 0.97 1.99 0.01 3.97 2.02 0.29 -1.21 117.35 125.38 1j3j s TYR 12 Ca 0.09 -0.44 0.08 0.00 -0.37 0.00 0.00 57.07 56.44 1j3j s TYR 12 Cb -0.13 -0.94 -0.02 0.00 -0.40 0.00 0.00 41.96 40.46 1j3j s TYR 12 CO 0.04 0.45 -0.26 0.00 -1.57 0.00 0.00 175.55 174.21 1j3j s ALA 13 N -2.26 2.17 -0.03 3.71 0.00 -0.29 0.79 121.76 125.85 1j3j s ALA 13 Ca 0.21 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1j3j s ALA 13 Cb -0.05 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.59 1j3j s ALA 13 CO 0.09 0.52 0.01 -1.50 0.00 0.00 0.00 175.76 174.88 1j3j s ILE 14 N -0.69 0.17 0.30 0.00 2.07 -1.01 -0.05 121.20 121.99 1j3j s ILE 14 Ca 0.11 0.12 -0.00 0.00 -1.41 0.00 0.00 60.65 59.46 1j3j s ILE 14 Cb -0.10 -0.28 -0.02 0.00 0.13 0.00 0.00 42.46 42.19 1j3j s ILE 14 CO 0.00 0.16 0.36 0.00 -1.91 0.00 0.00 174.94 173.55 1j3j s ALA 16 N -3.47 -0.40 0.09 0.00 0.00 -1.26 -1.07 121.76 115.66 1j3j s ALA 16 Ca 0.34 0.71 0.08 0.00 0.00 0.00 0.00 51.96 53.09 1j3j s ALA 16 Cb 0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 1j3j s ALA 16 CO 0.20 -0.73 -0.22 0.00 0.00 0.00 0.00 175.76 175.01 1j3j s LYS 19 N -3.39 3.73 -0.12 0.00 1.02 -0.57 -0.96 119.74 119.46 1j3j s LYS 19 Ca 0.12 0.26 -0.07 0.00 0.02 0.00 0.00 55.97 56.30 1j3j s LYS 19 Cb -0.01 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.73 1j3j s LYS 19 CO 0.08 0.11 0.14 0.08 -0.92 0.00 0.00 175.35 174.84 1j3j s VAL 20 N -2.18 5.47 -0.09 3.17 1.01 -1.26 -2.20 120.40 124.32 1j3j s VAL 20 Ca 0.48 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 62.52 1j3j s VAL 20 Cb -0.11 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1j3j s VAL 20 CO 0.29 0.62 0.31 -1.83 0.00 0.00 0.00 175.10 174.49 1j3j s GLU 21 N -1.03 3.95 -0.18 2.72 -1.05 -1.18 -4.89 118.70 117.04 1j3j s GLU 21 Ca 0.15 0.18 -0.03 0.00 -0.15 0.00 0.00 54.97 55.13 1j3j s GLU 21 Cb -0.12 -3.30 -0.01 0.00 -0.44 0.00 0.00 34.13 30.26 1j3j s GLU 21 CO 0.04 0.53 -0.07 -1.12 0.95 0.00 0.00 175.26 175.58 1j3j s SER 22 N -0.44 4.24 0.26 0.83 0.01 -1.26 -4.90 113.70 112.45 1j3j s SER 22 Ca 0.19 -0.35 -0.01 0.00 1.31 0.00 0.00 55.95 57.09 1j3j s SER 22 Cb -0.14 -1.70 0.57 0.00 0.21 0.00 0.00 66.02 64.96 1j3j s SER 22 CO 0.08 0.06 1.69 0.11 0.41 0.00 0.00 173.24 175.59 1j3j h LYS 23 N 7.51 0.32 -0.81 12.44 1.79 -1.97 -2.43 116.57 133.41 1j3j h LYS 23 Ca -0.36 -0.02 0.13 0.00 -2.18 0.00 0.00 60.65 58.22 1j3j h LYS 23 Cb 1.18 -0.07 -0.09 0.00 -1.58 0.00 0.00 32.23 31.67 1j3j h LYS 23 CO 0.59 0.21 0.42 -0.97 -1.08 0.00 0.00 179.45 178.63 1j3j h ASN 24 N 0.33 0.52 -2.12 0.86 -0.73 -2.05 -3.40 115.58 108.99 1j3j h ASN 24 Ca 0.47 0.08 0.04 0.00 1.87 0.00 0.00 56.30 58.77 1j3j h ASN 24 Cb 0.84 -0.01 -0.22 0.00 0.27 0.00 0.00 38.32 39.21 1j3j h ASN 24 CO -0.52 0.25 -0.18 -0.70 -0.37 0.00 0.00 177.43 175.91 1j3j s GLU 25 N -6.00 0.53 0.09 6.67 2.56 -0.93 -5.09 118.70 116.53 1j3j s GLU 25 Ca -0.12 1.37 -0.00 0.00 0.00 0.00 0.00 54.97 56.21 1j3j s GLU 25 Cb 0.21 0.76 -0.25 0.00 2.00 0.00 0.00 34.13 36.84 1j3j s GLU 25 CO 0.78 -0.21 1.19 0.78 -0.56 0.00 0.00 175.26 177.24 1j3j h GLY 26 N 8.02 0.21 -1.26 -1.50 0.00 -1.76 -3.35 103.07 103.42 1j3j h GLY 26 Ca -0.18 -0.53 -0.52 0.00 0.00 0.00 0.00 47.33 46.11 1j3j h GLY 26 CO 0.11 0.46 -0.46 0.28 0.00 0.00 0.00 176.54 176.93 1j3j n LYS 27 N -3.48 0.52 -3.28 4.80 5.02 -1.26 -4.40 118.16 116.10 1j3j n LYS 27 Ca -0.06 -3.35 -0.10 0.00 -2.02 0.00 0.00 58.31 52.79 1j3j n LYS 27 Cb 0.99 2.10 0.02 0.00 -0.02 0.00 0.00 35.03 38.12 1j3j n LYS 27 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1j3j n LYS 28 N -0.81 -1.52 -1.53 1.97 4.76 -1.26 -4.91 118.16 114.86 1j3j n LYS 28 Ca -0.02 1.14 -0.40 0.00 -2.87 0.00 0.00 58.31 56.17 1j3j n LYS 28 Cb 0.60 -5.10 0.02 0.00 -1.84 0.00 0.00 35.03 28.71 1j3j n LYS 28 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1j3j n ASN 29 N -2.29 -0.04 0.11 4.39 3.02 -1.26 -4.92 115.26 114.27 1j3j n ASN 29 Ca -0.07 0.89 -0.16 0.00 -0.03 0.00 0.00 54.58 55.21 1j3j n ASN 29 Cb 0.56 -1.24 -0.14 0.00 -0.61 0.00 0.00 39.78 38.35 1j3j n ASN 29 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1j3j h GLU 30 N 0.85 0.28 -4.36 3.52 5.08 -2.03 -3.44 114.58 114.49 1j3j h GLU 30 Ca -0.44 -0.48 -0.50 0.00 -1.00 0.00 0.00 59.36 56.95 1j3j h GLU 30 Cb 1.38 0.18 -0.34 0.00 0.50 0.00 0.00 28.75 30.46 1j3j h GLU 30 CO 0.52 1.23 -0.80 0.08 -1.00 0.00 0.00 179.01 179.03 1j3j s VAL 31 N -2.65 0.98 0.29 3.13 1.01 -1.26 -5.14 120.40 116.75 1j3j s VAL 31 Ca -0.04 -0.35 0.09 0.00 0.00 0.00 0.00 61.98 61.68 1j3j s VAL 31 Cb 0.07 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1j3j s VAL 31 CO 0.89 0.33 0.03 -0.36 0.00 0.00 0.00 175.10 175.99 1j3j s PHE 32 N 0.98 2.70 0.09 5.22 0.08 -1.26 -5.03 117.98 120.75 1j3j s PHE 32 Ca -0.09 -0.27 -0.26 0.00 0.12 0.00 0.00 56.93 56.44 1j3j s PHE 32 Cb -0.15 -1.31 0.09 0.00 -0.57 0.00 0.00 43.02 41.08 1j3j s PHE 32 CO 0.00 0.55 1.15 0.54 -0.10 0.00 0.00 175.22 177.36 1j3j s ASN 33 N -3.72 -0.02 0.41 1.36 2.20 -1.26 -5.02 114.94 108.89 1j3j s ASN 33 Ca 0.33 -0.41 0.16 0.00 -0.94 0.00 0.00 52.86 52.00 1j3j s ASN 33 Cb -0.05 0.33 1.05 0.00 -2.00 0.00 0.00 41.25 40.58 1j3j s ASN 33 CO 0.21 -0.65 1.85 0.78 -2.94 0.00 0.00 177.10 176.34 1j3j h ASN 34 N 2.00 0.45 0.49 3.54 2.35 -2.00 0.39 115.58 122.79 1j3j h ASN 34 Ca -0.26 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.54 1j3j h ASN 34 Cb 1.21 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.54 1j3j h ASN 34 CO 0.32 0.18 0.00 0.22 -1.65 0.00 0.00 177.43 176.50 1j3j h TYR 35 N 0.45 0.00 -0.98 1.19 3.20 -1.96 -3.01 116.97 115.86 1j3j h TYR 35 Ca 0.47 0.00 0.22 0.00 3.14 0.00 0.00 58.73 62.56 1j3j h TYR 35 Cb 1.12 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 39.30 1j3j h TYR 35 CO -0.00 0.00 0.62 1.15 -1.64 0.00 0.00 178.16 178.29 1j3j h THR 36 N 0.00 0.64 -2.81 1.81 2.02 -1.31 -3.26 112.91 110.00 1j3j h THR 36 Ca 0.00 -0.19 -0.74 0.00 0.77 0.00 0.00 66.41 66.25 1j3j h THR 36 Cb 0.24 0.05 -0.21 0.00 -1.74 0.00 0.00 68.15 66.49 1j3j h THR 36 CO 0.00 0.10 0.76 -0.36 0.37 0.00 0.00 175.52 176.39 1j3j s PHE 37 N -5.62 3.53 0.00 3.16 0.08 -1.14 -4.22 117.98 113.77 1j3j s PHE 37 Ca -0.10 -1.91 0.00 0.00 0.12 0.00 0.00 56.93 55.04 1j3j s PHE 37 Cb 0.24 -4.13 0.00 0.00 -0.57 0.00 0.00 43.02 38.57 1j3j s PHE 37 CO 0.79 -1.28 0.13 2.89 -0.10 0.00 0.00 175.22 177.65 1j3j n ARG 38 N 5.19 1.10 -1.79 0.44 1.85 -0.91 -4.74 116.66 117.80 1j3j n ARG 38 Ca 0.25 -0.13 -0.42 0.00 -1.00 0.00 0.00 57.85 56.55 1j3j n ARG 38 Cb 0.45 -0.51 -0.03 0.00 -1.05 0.00 0.00 32.46 31.33 1j3j n ARG 38 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1j3j s GLY 39 N -0.19 1.48 -0.22 2.89 0.00 -0.13 -1.51 107.32 109.64 1j3j s GLY 39 Ca 0.00 1.21 -0.09 0.00 0.00 0.00 0.00 44.72 45.84 1j3j s GLY 39 CO 0.00 3.28 -0.27 1.04 0.00 0.00 0.00 173.10 177.15 1j3j n LEU 40 N 7.14 1.73 -3.74 0.66 4.77 -0.53 -1.76 117.00 125.27 1j3j n LEU 40 Ca 0.19 0.21 -0.09 0.00 -0.03 0.00 0.00 56.01 56.29 1j3j n LEU 40 Cb 0.41 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.82 1j3j n LEU 40 CO 0.66 0.51 0.35 -0.83 -1.33 0.00 0.00 177.39 176.74 1j3j s GLY 41 N -5.48 -0.14 -0.11 -0.72 0.00 -1.14 -4.38 107.32 95.35 1j3j s GLY 41 Ca -0.30 -0.17 -0.04 0.00 0.00 0.00 0.00 44.72 44.21 1j3j s GLY 41 CO 0.39 -0.16 0.20 0.21 0.00 0.00 0.00 173.10 173.75 1j3j s ASN 42 N -2.88 0.69 -1.10 1.64 2.47 0.58 -2.24 114.94 114.10 1j3j s ASN 42 Ca 0.09 0.36 -0.18 0.00 0.42 0.00 0.00 52.86 53.55 1j3j s ASN 42 Cb -0.03 0.44 -0.02 0.00 -1.45 0.00 0.00 41.25 40.20 1j3j s ASN 42 CO -0.01 -0.25 0.81 0.29 -3.72 0.00 0.00 177.10 174.22 1j3j n LYS 43 N 5.33 -1.35 -0.12 0.43 5.02 -1.26 -1.85 118.16 124.36 1j3j n LYS 43 Ca -0.05 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 1j3j n LYS 43 Cb 0.50 -4.35 0.00 0.00 -0.02 0.00 0.00 35.03 31.16 1j3j n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1j3j n GLY 44 N -1.62 1.86 3.41 0.72 0.00 -1.26 -4.97 105.19 103.32 1j3j n GLY 44 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1j3j n GLY 44 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j3j s VAL 45 N -2.46 0.49 0.37 1.61 -7.23 -0.77 -4.67 120.40 107.74 1j3j s VAL 45 Ca 0.00 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.90 1j3j s VAL 45 Cb 0.00 -2.48 -0.10 0.00 0.56 0.00 0.00 36.38 34.36 1j3j s VAL 45 CO 0.00 0.00 1.32 -0.76 -0.31 0.00 0.00 175.10 175.35 1j3j s LEU 46 N -3.47 4.30 0.56 1.32 1.43 -1.26 0.21 118.68 121.78 1j3j s LEU 46 Ca 0.32 2.70 0.27 0.00 -1.03 0.00 0.00 54.13 56.39 1j3j s LEU 46 Cb 0.04 -3.79 1.64 0.00 0.03 0.00 0.00 46.19 44.12 1j3j s LEU 46 CO 0.17 -0.73 2.19 -0.65 0.23 0.00 0.00 176.35 177.56 1j3j h PRO 47 N 2.97 0.00 -0.56 1.29 0.11 -1.84 -2.02 132.00 131.96 1j3j h PRO 47 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1j3j h PRO 47 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1j3j h PRO 47 CO 0.64 0.04 0.00 -2.67 -0.21 0.00 0.00 178.00 175.80 1j3j n TRP 48 N -3.88 0.82 0.00 0.65 2.14 -1.26 -4.63 117.44 111.28 1j3j n TRP 48 Ca -0.03 -0.52 0.00 0.00 2.07 0.00 0.00 57.50 59.02 1j3j n TRP 48 Cb 0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 31.31 30.59 1j3j n TRP 48 CO 0.00 0.00 0.00 1.17 2.07 0.00 0.00 177.69 180.93 1j3j n LYS 49 N 1.08 0.00 -3.63 -2.67 4.81 -0.76 -4.70 118.16 112.28 1j3j n LYS 49 Ca 0.19 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.48 1j3j n LYS 49 Cb 0.58 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.56 1j3j n LYS 49 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j3j s ASN 51 N -1.26 0.97 0.41 0.00 3.84 -1.26 -4.95 114.94 112.68 1j3j s ASN 51 Ca -0.12 -0.24 0.11 0.00 0.21 0.00 0.00 52.86 52.81 1j3j s ASN 51 Cb -0.02 0.75 0.86 0.00 -0.55 0.00 0.00 41.25 42.28 1j3j s ASN 51 CO 0.07 -0.34 1.95 0.77 -2.79 0.00 0.00 177.10 176.77 1j3j h SER 52 N 8.24 0.19 -0.19 -4.21 4.64 -1.99 -1.51 113.55 118.72 1j3j h SER 52 Ca -0.16 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.09 1j3j h SER 52 Cb 1.13 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 1j3j h SER 52 CO 0.29 0.32 -0.05 0.25 -0.87 0.00 0.00 176.83 176.77 1j3j h LEU 53 N 0.20 0.37 -1.29 5.97 5.85 -1.95 -1.36 115.31 123.10 1j3j h LEU 53 Ca 0.04 -0.38 -0.07 0.00 0.84 0.00 0.00 57.88 58.31 1j3j h LEU 53 Cb 0.31 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1j3j h LEU 53 CO 0.02 0.66 -0.34 -0.78 -0.34 0.00 0.00 178.44 177.66 1j3j h ASP 54 N 0.08 0.03 -0.19 1.25 3.58 -1.97 -0.92 116.42 118.28 1j3j h ASP 54 Ca 0.05 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 1j3j h ASP 54 Cb 0.50 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 1j3j h ASP 54 CO 0.02 0.36 0.07 -0.03 -2.88 0.00 0.00 179.24 176.78 1j3j h MET 55 N 0.02 0.29 -0.72 0.28 4.05 -1.07 0.14 114.93 117.91 1j3j h MET 55 Ca 0.00 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.32 1j3j h MET 55 Cb 0.61 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.34 1j3j h MET 55 CO 0.04 0.37 0.29 -0.22 0.23 0.00 0.00 176.91 177.63 1j3j h LYS 56 N 0.14 1.08 0.25 0.39 3.64 -0.85 -0.61 116.57 120.60 1j3j h LYS 56 Ca 0.06 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1j3j h LYS 56 Cb 0.20 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1j3j h LYS 56 CO -0.00 0.88 -0.12 -0.92 -2.27 0.00 0.00 179.45 177.02 1j3j h TYR 57 N 1.03 -0.31 -0.25 1.91 3.20 -0.92 0.70 116.97 122.34 1j3j h TYR 57 Ca 0.24 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.16 1j3j h TYR 57 Cb 0.21 0.10 -0.07 0.00 1.54 0.00 0.00 36.73 38.51 1j3j h TYR 57 CO 0.02 -0.05 -0.19 0.35 -1.64 0.00 0.00 178.16 176.64 1j3j h PHE 58 N -0.54 -0.50 -0.15 -3.82 3.57 -0.61 -0.22 116.94 114.67 1j3j h PHE 58 Ca -0.03 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1j3j h PHE 58 Cb 0.40 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 1j3j h PHE 58 CO -0.00 -0.27 0.08 -0.09 -2.23 0.00 0.00 178.31 175.80 1j3j h ARG 59 N -0.19 0.22 -0.81 1.11 2.43 -1.06 -1.50 114.38 114.58 1j3j h ARG 59 Ca 0.14 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1j3j h ARG 59 Cb 0.40 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 1j3j h ARG 59 CO -0.36 0.24 0.54 0.00 -1.51 0.00 0.00 179.97 178.88 1j3j h ALA 60 N 0.96 1.46 -0.09 2.80 0.00 -0.46 -1.76 119.26 122.16 1j3j h ALA 60 Ca 0.05 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1j3j h ALA 60 Cb 0.09 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.58 1j3j h ALA 60 CO -0.01 0.49 -0.55 0.28 0.00 0.00 0.00 179.25 179.46 1j3j h VAL 61 N 1.06 1.37 0.00 0.00 2.07 -0.92 -2.59 116.25 117.24 1j3j h VAL 61 Ca 0.31 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.95 1j3j h VAL 61 Cb -0.06 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1j3j h VAL 61 CO -0.08 0.57 0.00 0.71 0.02 0.00 0.00 177.57 178.79 1j3j h THR 62 N 0.13 0.00 0.00 2.57 1.35 -1.12 -3.27 112.91 112.57 1j3j h THR 62 Ca -0.04 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 1j3j h THR 62 Cb 1.20 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1j3j h THR 62 CO 0.11 0.00 -0.80 0.35 -0.25 0.00 0.00 175.52 174.93 1j3j n THR 63 N -2.81 0.00 -2.07 6.82 -2.24 -0.68 -4.41 114.28 108.90 1j3j n THR 63 Ca 0.03 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 1j3j n THR 63 Cb 0.39 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.53 1j3j n THR 63 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1j3j s TYR 64 N -2.51 3.12 -0.05 4.78 5.04 -0.98 -4.82 117.35 121.94 1j3j s TYR 64 Ca 0.05 0.96 -0.03 0.00 -2.44 0.00 0.00 57.07 55.61 1j3j s TYR 64 Cb 0.12 -3.77 0.02 0.00 0.35 0.00 0.00 41.96 38.67 1j3j s TYR 64 CO 0.64 -2.63 0.13 0.08 -1.34 0.00 0.00 175.55 172.43 1j3j s VAL 65 N 0.49 -0.02 -0.33 3.14 1.01 -1.26 -4.86 120.40 118.56 1j3j s VAL 65 Ca 0.62 0.07 0.03 0.00 0.00 0.00 0.00 61.98 62.70 1j3j s VAL 65 Cb -0.40 -0.20 0.09 0.00 0.00 0.00 0.00 36.38 35.87 1j3j s VAL 65 CO 0.37 0.03 0.04 0.21 0.00 0.00 0.00 175.10 175.75 1j3j s ASN 66 N 0.51 4.78 0.20 3.32 3.84 -1.26 -5.00 114.94 121.33 1j3j s ASN 66 Ca -0.04 -1.95 -0.07 0.00 0.21 0.00 0.00 52.86 51.01 1j3j s ASN 66 Cb -0.05 -1.64 0.13 0.00 -0.55 0.00 0.00 41.25 39.14 1j3j s ASN 66 CO -0.02 -0.36 1.66 -0.33 -2.79 0.00 0.00 177.10 175.26 1j3j h GLU 67 N 7.72 1.00 -0.27 0.43 5.08 -1.99 -3.00 114.58 123.55 1j3j h GLU 67 Ca -0.09 -0.32 0.08 0.00 -1.00 0.00 0.00 59.36 58.03 1j3j h GLU 67 Cb 1.03 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1j3j h GLU 67 CO 0.53 0.99 0.29 0.66 -1.00 0.00 0.00 179.01 180.48 1j3j h SER 68 N 0.91 0.00 -0.55 1.42 4.64 -2.06 0.26 113.55 118.17 1j3j h SER 68 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1j3j h SER 68 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1j3j h SER 68 CO 0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.28 1j3j n LYS 69 N -3.78 4.62 0.05 4.77 5.02 -1.13 -4.47 118.16 123.23 1j3j n LYS 69 Ca 0.04 -2.96 -0.03 0.00 -2.02 0.00 0.00 58.31 53.34 1j3j n LYS 69 Cb 0.43 -2.21 -0.08 0.00 -0.02 0.00 0.00 35.03 33.16 1j3j n LYS 69 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1j3j h TYR 70 N 3.78 0.00 0.00 2.13 3.20 -0.57 -3.36 116.97 122.15 1j3j h TYR 70 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1j3j h TYR 70 Cb 1.87 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1j3j h TYR 70 CO 1.02 0.72 -0.30 0.39 -1.64 0.00 0.00 178.16 178.35 1j3j n GLU 71 N -3.06 0.06 0.22 1.82 1.02 -1.26 -0.21 120.64 119.23 1j3j n GLU 71 Ca -0.07 0.03 0.10 0.00 -0.02 0.00 0.00 57.16 57.19 1j3j n GLU 71 Cb 0.88 -1.54 0.44 0.00 -0.02 0.00 0.00 31.44 31.20 1j3j n GLU 71 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1j3j h LYS 72 N 0.00 0.00 0.07 3.49 1.57 -1.87 0.16 116.57 119.99 1j3j h LYS 72 Ca 0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 1j3j h LYS 72 Cb 0.55 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.82 1j3j h LYS 72 CO 0.00 0.22 -2.08 1.28 -0.57 0.00 0.00 179.45 178.29 1j3j n LEU 73 N -3.35 2.60 0.14 2.94 4.77 -0.97 -3.89 117.00 119.24 1j3j n LEU 73 Ca 0.00 0.15 0.03 0.00 -0.03 0.00 0.00 56.01 56.16 1j3j n LEU 73 Cb 0.44 -1.03 0.40 0.00 -2.33 0.00 0.00 43.42 40.90 1j3j n LEU 73 CO 0.33 0.79 0.86 0.50 -1.33 0.00 0.00 177.39 178.55 1j3j h LYS 74 N -0.14 0.17 0.09 3.23 3.64 -0.46 -2.44 116.57 120.65 1j3j h LYS 74 Ca -0.48 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1j3j h LYS 74 Cb 1.89 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.68 1j3j h LYS 74 CO -0.03 0.35 -0.06 -0.92 -2.27 0.00 0.00 179.45 176.53 1j3j h TYR 75 N 0.16 -0.15 -0.44 1.91 3.20 -0.84 -1.79 116.97 119.03 1j3j h TYR 75 Ca 0.03 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.77 1j3j h TYR 75 Cb 0.41 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 1j3j h TYR 75 CO 0.00 -0.08 -0.22 0.87 -1.64 0.00 0.00 178.16 177.09 1j3j h LYS 76 N -0.14 0.90 0.31 1.82 1.57 -1.67 -0.72 116.57 118.64 1j3j h LYS 76 Ca -0.01 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1j3j h LYS 76 Cb 0.11 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1j3j h LYS 76 CO 0.01 1.03 -0.33 0.00 -0.57 0.00 0.00 179.45 179.59 1j3j h ARG 77 N 0.78 -0.65 -0.83 3.15 3.08 -1.53 2.15 114.38 120.53 1j3j h ARG 77 Ca 0.10 0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.29 1j3j h ARG 77 Cb 0.78 0.15 -0.07 0.00 0.08 0.00 0.00 29.97 30.90 1j3j h ARG 77 CO 0.06 -0.43 0.47 0.00 -1.07 0.00 0.00 179.97 179.00 1j3j h LYS 79 N 0.79 0.00 0.00 0.00 3.64 0.51 -3.33 116.57 118.18 1j3j h LYS 79 Ca 0.40 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.50 1j3j h LYS 79 Cb 0.38 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 1j3j h LYS 79 CO -0.25 0.00 -1.94 0.98 -2.27 0.00 0.00 179.45 175.97 1j3j n TYR 80 N -2.54 0.00 0.00 1.91 9.36 0.71 -5.00 117.16 121.60 1j3j n TYR 80 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1j3j n TYR 80 Cb 0.19 -0.78 0.00 0.00 -0.63 0.00 0.00 39.34 38.12 1j3j n TYR 80 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1j3j n LEU 81 N -4.26 0.00 0.00 2.98 4.77 -0.52 -5.08 117.00 114.89 1j3j n LEU 81 Ca -0.38 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1j3j n LEU 81 Cb 0.74 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 1j3j n LEU 81 CO 0.09 0.00 0.00 1.17 -1.33 0.00 0.00 177.39 177.32 1j3j n LYS 97 N 0.00 0.00 -1.65 3.23 3.00 -1.26 -5.11 118.16 116.37 1j3j n LYS 97 Ca 0.00 0.00 -0.60 0.00 -0.00 0.00 0.00 58.31 57.71 1j3j n LYS 97 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 34.95 1j3j n LYS 97 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1j3j n LEU 98 N 0.00 1.89 -4.51 3.14 7.94 -1.26 -4.98 117.00 119.21 1j3j n LEU 98 Ca 0.00 1.01 -0.25 0.00 -1.11 0.00 0.00 56.01 55.66 1j3j n LEU 98 Cb 0.00 -1.06 -0.10 0.00 0.53 0.00 0.00 43.42 42.79 1j3j n LEU 98 CO 0.00 -0.60 -0.40 -1.10 -1.11 0.00 0.00 177.39 174.18 1j3j s GLN 99 N 3.90 1.75 0.43 1.96 -0.21 -1.26 -4.86 119.66 121.37 1j3j s GLN 99 Ca 1.03 -1.88 0.02 0.00 0.02 0.00 0.00 55.36 54.56 1j3j s GLN 99 Cb -1.21 -1.64 -0.00 0.00 1.00 0.00 0.00 33.01 31.15 1j3j s GLN 99 CO 0.69 0.17 0.63 -0.80 -2.12 0.00 0.00 175.29 173.85 1j3j s ASN 100 N -3.56 5.83 -0.12 5.90 0.01 -1.26 -1.95 114.94 119.79 1j3j s ASN 100 Ca 0.31 0.15 -0.04 0.00 -0.71 0.00 0.00 52.86 52.57 1j3j s ASN 100 Cb 0.01 -1.41 -0.04 0.00 0.41 0.00 0.00 41.25 40.22 1j3j s ASN 100 CO 0.15 -0.66 0.03 -0.69 -1.51 0.00 0.00 177.10 174.43 1j3j s VAL 101 N -2.47 4.57 -0.42 1.60 1.01 0.33 -0.86 120.40 124.17 1j3j s VAL 101 Ca 0.48 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.36 1j3j s VAL 101 Cb -0.10 -2.97 0.12 0.00 0.00 0.00 0.00 36.38 33.42 1j3j s VAL 101 CO 0.36 0.57 0.15 0.68 0.00 0.00 0.00 175.10 176.86 1j3j s VAL 102 N -0.52 2.22 -0.06 2.92 -7.23 -0.92 0.77 120.40 117.58 1j3j s VAL 102 Ca 0.10 -2.69 -0.28 0.00 -1.81 0.00 0.00 61.98 57.30 1j3j s VAL 102 Cb -0.12 -2.60 -0.03 0.00 0.56 0.00 0.00 36.38 34.20 1j3j s VAL 102 CO 0.02 -0.71 0.90 -0.69 -0.31 0.00 0.00 175.10 174.31 1j3j s VAL 103 N 0.43 4.89 0.33 1.32 1.01 -0.10 -2.55 120.40 125.73 1j3j s VAL 103 Ca 0.14 1.86 0.07 0.00 0.00 0.00 0.00 61.98 64.05 1j3j s VAL 103 Cb -0.22 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 31.90 1j3j s VAL 103 CO -0.05 0.12 0.26 1.15 0.00 0.00 0.00 175.10 176.58 1j3j n MET 104 N 4.32 0.42 -3.16 2.72 0.00 -1.11 -1.14 117.12 119.16 1j3j n MET 104 Ca 0.05 -3.29 -0.19 0.00 0.00 0.00 0.00 57.70 54.27 1j3j n MET 104 Cb 0.50 2.59 0.02 0.00 0.00 0.00 0.00 33.22 36.33 1j3j n MET 104 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1j3j s GLY 105 N -3.31 1.94 -0.02 3.17 0.00 -0.72 -1.72 107.32 106.67 1j3j s GLY 105 Ca 0.37 -1.82 -0.24 0.00 0.00 0.00 0.00 44.72 43.03 1j3j s GLY 105 CO 0.26 -1.61 1.12 -0.09 0.00 0.00 0.00 173.10 172.78 1j3j h ARG 106 N 0.58 -0.25 -0.68 2.90 2.43 -1.94 0.68 114.38 118.09 1j3j h ARG 106 Ca -0.37 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 58.96 1j3j h ARG 106 Cb 1.28 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.85 1j3j h ARG 106 CO 0.47 0.13 0.46 1.15 -1.51 0.00 0.00 179.97 180.66 1j3j h THR 107 N -0.73 0.80 0.13 0.20 2.02 -1.96 0.24 112.91 113.61 1j3j h THR 107 Ca -0.03 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1j3j h THR 107 Cb 0.50 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1j3j h THR 107 CO 0.04 0.06 -0.06 -1.13 0.37 0.00 0.00 175.52 174.80 1j3j h ASN 108 N 0.33 -0.15 -0.22 4.18 -1.24 -1.86 -2.82 115.58 113.80 1j3j h ASN 108 Ca 0.33 -0.39 0.02 0.00 0.71 0.00 0.00 56.30 56.98 1j3j h ASN 108 Cb 0.82 0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.90 1j3j h ASN 108 CO -0.09 0.36 0.15 -0.25 -1.29 0.00 0.00 177.43 176.31 1j3j h TRP 109 N -0.72 0.18 0.00 0.67 2.91 0.17 -1.09 115.95 118.07 1j3j h TRP 109 Ca -0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.01 1j3j h TRP 109 Cb 0.53 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 29.11 1j3j h TRP 109 CO 0.08 0.11 0.00 0.93 -1.03 0.00 0.00 178.44 178.53 1j3j h GLU 110 N 0.19 0.00 0.03 2.65 5.08 -0.57 -3.16 114.58 118.80 1j3j h GLU 110 Ca 0.09 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.21 1j3j h GLU 110 Cb 0.13 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1j3j h GLU 110 CO -0.02 0.00 -1.15 0.66 -1.00 0.00 0.00 179.01 177.50 1j3j h SER 111 N 0.00 0.09 -3.24 1.42 4.64 -0.93 -3.45 113.55 112.08 1j3j h SER 111 Ca 0.00 -0.10 -0.54 0.00 -0.47 0.00 0.00 61.79 60.68 1j3j h SER 111 Cb 0.72 -0.03 0.08 0.00 -0.31 0.00 0.00 62.40 62.87 1j3j h SER 111 CO 0.00 1.08 0.88 -0.38 -0.87 0.00 0.00 176.83 177.54 1j3j n ILE 112 N -3.35 0.99 -0.24 0.95 5.41 -1.15 -4.96 119.36 117.00 1j3j n ILE 112 Ca -0.04 -0.25 -0.21 0.00 1.00 0.00 0.00 62.75 63.25 1j3j n ILE 112 Cb 0.97 -1.95 0.20 0.00 -0.71 0.00 0.00 39.64 38.16 1j3j n ILE 112 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1j3j n PRO 113 N 2.21 -3.39 0.02 0.38 -0.02 -1.26 -4.91 135.00 128.02 1j3j n PRO 113 Ca 0.09 -1.00 -0.02 0.00 -2.02 0.00 0.00 63.50 60.55 1j3j n PRO 113 Cb 0.36 -1.43 -0.01 0.00 -0.02 0.00 0.00 33.50 32.40 1j3j n PRO 113 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1j3j h LYS 114 N 0.00 -0.13 -0.32 -0.52 6.56 -1.94 -3.28 116.57 116.94 1j3j h LYS 114 Ca -0.27 0.01 0.09 0.00 -1.06 0.00 0.00 60.65 59.42 1j3j h LYS 114 Cb 0.91 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.59 1j3j h LYS 114 CO 0.16 -0.09 0.31 0.87 -2.06 0.00 0.00 179.45 178.64 1j3j h LYS 115 N -0.85 0.00 -0.17 3.15 1.57 -1.99 -2.23 116.57 116.05 1j3j h LYS 115 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j3j h LYS 115 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1j3j h LYS 115 CO 0.02 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.09 1j3j n PHE 116 N -3.92 0.21 -4.77 -1.35 3.72 -1.25 -4.88 117.46 105.22 1j3j n PHE 116 Ca 0.05 -0.10 -0.33 0.00 -0.05 0.00 0.00 57.45 57.02 1j3j n PHE 116 Cb 0.47 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.86 1j3j n PHE 116 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1j3j s LYS 117 N -1.79 3.30 0.98 -1.08 1.02 -0.84 -3.27 119.74 118.05 1j3j s LYS 117 Ca 0.33 -0.68 -0.16 0.00 0.02 0.00 0.00 55.97 55.49 1j3j s LYS 117 Cb 0.18 -2.62 0.19 0.00 -0.52 0.00 0.00 37.83 35.07 1j3j s LYS 117 CO 0.28 0.27 1.24 -1.25 -0.92 0.00 0.00 175.35 174.97 1j3j s PRO 118 N 0.22 0.51 -0.04 -1.68 0.04 -1.26 -5.00 135.00 127.80 1j3j s PRO 118 Ca -0.08 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 60.46 1j3j s PRO 118 Cb -0.15 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 1j3j s PRO 118 CO 0.05 -2.53 1.37 -0.51 0.04 0.00 0.00 177.00 175.42 1j3j s LEU 119 N -6.07 4.29 0.42 -3.56 1.43 -1.20 -4.95 118.68 109.04 1j3j s LEU 119 Ca 0.71 2.02 -0.26 0.00 -1.03 0.00 0.00 54.13 55.57 1j3j s LEU 119 Cb -0.07 -3.55 -0.09 0.00 0.03 0.00 0.00 46.19 42.51 1j3j s LEU 119 CO 0.53 -0.72 1.38 -0.94 0.23 0.00 0.00 176.35 176.83 1j3j s SER 120 N 1.97 6.11 -1.54 2.29 1.04 -1.26 -3.15 113.70 119.15 1j3j s SER 120 Ca 0.62 2.82 0.00 0.00 0.48 0.00 0.00 55.95 59.87 1j3j s SER 120 Cb -0.29 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.18 1j3j s SER 120 CO 0.24 -1.01 0.00 0.59 0.98 0.00 0.00 173.24 174.05 1j3j n ASN 121 N 0.01 -5.10 -3.89 7.02 5.03 -1.26 -4.96 115.26 112.12 1j3j n ASN 121 Ca 0.04 0.06 -0.11 0.00 0.87 0.00 0.00 54.58 55.43 1j3j n ASN 121 Cb 0.42 -4.17 -0.13 0.00 -1.02 0.00 0.00 39.78 34.88 1j3j n ASN 121 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1j3j s ARG 122 N -4.64 0.14 -0.83 3.52 0.52 -1.19 -4.20 118.95 112.27 1j3j s ARG 122 Ca 0.00 -0.13 -0.21 0.00 -0.52 0.00 0.00 55.73 54.87 1j3j s ARG 122 Cb 0.00 0.06 0.09 0.00 0.52 0.00 0.00 34.95 35.62 1j3j s ARG 122 CO 0.00 -0.02 1.11 0.42 0.02 0.00 0.00 175.30 176.83 1j3j s ILE 123 N -0.41 4.41 -0.01 1.52 1.01 -0.04 -4.77 121.20 122.91 1j3j s ILE 123 Ca -0.05 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 1j3j s ILE 123 Cb -0.03 -4.79 -0.06 0.00 0.01 0.00 0.00 42.46 37.60 1j3j s ILE 123 CO -0.00 -1.56 1.48 0.20 0.00 0.00 0.00 174.94 175.06 1j3j s ASN 124 N 3.84 6.78 0.26 3.58 0.02 -1.26 -2.16 114.94 126.01 1j3j s ASN 124 Ca 0.30 2.16 0.12 0.00 -1.02 0.00 0.00 52.86 54.42 1j3j s ASN 124 Cb -0.09 -2.55 -0.05 0.00 0.02 0.00 0.00 41.25 38.58 1j3j s ASN 124 CO -0.01 -0.79 -0.20 -0.69 0.02 0.00 0.00 177.10 175.43 1j3j s VAL 125 N 2.86 2.47 -0.05 1.60 1.01 -1.06 -3.07 120.40 124.17 1j3j s VAL 125 Ca 0.67 -2.33 -0.04 0.00 0.00 0.00 0.00 61.98 60.27 1j3j s VAL 125 Cb -0.32 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 33.79 1j3j s VAL 125 CO 0.27 -0.35 0.13 -0.63 0.00 0.00 0.00 175.10 174.52 1j3j s ILE 126 N -2.35 -0.00 -0.36 2.22 1.01 -0.92 -2.76 121.20 118.04 1j3j s ILE 126 Ca 0.28 0.01 -0.14 0.00 0.00 0.00 0.00 60.65 60.80 1j3j s ILE 126 Cb -0.06 -0.19 -0.01 0.00 0.01 0.00 0.00 42.46 42.22 1j3j s ILE 126 CO 0.14 0.00 0.29 -0.22 0.00 0.00 0.00 174.94 175.15 1j3j s LEU 127 N 0.13 4.64 0.27 2.97 2.96 -0.70 -0.49 118.68 128.46 1j3j s LEU 127 Ca -0.01 -0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 53.29 1j3j s LEU 127 Cb -0.01 -2.20 0.00 0.00 0.50 0.00 0.00 46.19 44.48 1j3j s LEU 127 CO -0.00 -0.32 0.52 -0.55 -1.32 0.00 0.00 176.35 174.68 1j3j s SER 128 N 1.72 0.02 0.00 3.68 0.15 -0.40 -3.82 113.70 115.06 1j3j s SER 128 Ca 0.07 -0.98 0.00 0.00 0.70 0.00 0.00 55.95 55.74 1j3j s SER 128 Cb -0.18 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 1j3j s SER 128 CO 0.11 -1.21 0.20 0.54 1.20 0.00 0.00 173.24 174.08 1j3j n ARG 129 N -0.42 0.54 0.00 5.44 1.74 -1.26 -3.94 116.66 118.76 1j3j n ARG 129 Ca -0.02 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1j3j n ARG 129 Cb 0.61 -0.65 0.00 0.00 -1.02 0.00 0.00 32.46 31.41 1j3j n ARG 129 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1j3j n THR 130 N -0.14 0.00 -2.43 0.55 -2.24 -1.26 -5.08 114.28 103.68 1j3j n THR 130 Ca 0.00 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 1j3j n THR 130 Cb 0.09 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.28 1j3j n THR 130 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1j3j s LEU 131 N -0.53 4.45 -0.52 3.22 1.43 -1.26 -4.99 118.68 120.48 1j3j s LEU 131 Ca 0.00 2.14 -0.25 0.00 -1.03 0.00 0.00 54.13 54.99 1j3j s LEU 131 Cb 0.00 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.65 1j3j s LEU 131 CO 0.00 -0.33 0.96 -0.54 0.23 0.00 0.00 176.35 176.67 1j3j s LYS 132 N -0.09 3.43 0.39 1.70 1.02 -1.26 -4.88 119.74 120.04 1j3j s LYS 132 Ca 0.52 -0.04 0.09 0.00 0.02 0.00 0.00 55.97 56.56 1j3j s LYS 132 Cb -0.31 -4.00 0.86 0.00 -0.52 0.00 0.00 37.83 33.86 1j3j s LYS 132 CO 0.35 -1.40 1.95 0.87 -0.92 0.00 0.00 175.35 176.21 1j3j h LYS 133 N 9.24 0.60 -0.79 1.68 1.57 -1.95 0.80 116.57 127.71 1j3j h LYS 133 Ca -0.25 -0.04 0.16 0.00 -1.87 0.00 0.00 60.65 58.65 1j3j h LYS 133 Cb 1.07 -0.14 -0.10 0.00 0.08 0.00 0.00 32.23 33.14 1j3j h LYS 133 CO 1.07 0.40 0.32 0.93 -0.57 0.00 0.00 179.45 181.61 1j3j h GLU 134 N 0.62 0.43 -0.29 3.15 3.07 -1.98 -3.10 114.58 116.48 1j3j h GLU 134 Ca 0.32 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 59.09 1j3j h GLU 134 Cb 0.42 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 1j3j h GLU 134 CO -0.11 0.29 -0.08 -0.44 -1.40 0.00 0.00 179.01 177.27 1j3j h ASP 135 N 0.44 0.46 -1.23 1.42 3.32 -1.24 -3.47 116.42 116.12 1j3j h ASP 135 Ca 0.45 -0.10 -0.47 0.00 0.02 0.00 0.00 57.03 56.92 1j3j h ASP 135 Cb 0.72 -0.12 0.04 0.00 0.22 0.00 0.00 39.33 40.19 1j3j h ASP 135 CO -0.43 0.58 -0.07 -0.36 -1.72 0.00 0.00 179.24 177.24 1j3j s PHE 136 N -4.82 1.68 1.20 4.55 0.08 -1.17 -5.13 117.98 114.38 1j3j s PHE 136 Ca -0.07 -0.56 -0.18 0.00 0.12 0.00 0.00 56.93 56.24 1j3j s PHE 136 Cb 0.15 -2.42 0.28 0.00 -0.57 0.00 0.00 43.02 40.47 1j3j s PHE 136 CO 0.77 -1.17 1.07 -0.51 -0.10 0.00 0.00 175.22 175.28 1j3j s ASP 137 N -4.63 0.88 -0.15 1.36 1.01 -1.26 -4.98 116.67 108.91 1j3j s ASP 137 Ca 0.62 0.82 0.00 0.00 0.71 0.00 0.00 52.55 54.70 1j3j s ASP 137 Cb -0.06 -1.20 -0.23 0.00 1.01 0.00 0.00 42.92 42.44 1j3j s ASP 137 CO 0.39 -4.17 0.25 -1.84 0.21 0.00 0.00 175.17 170.02 1j3j n GLU 138 N -4.82 0.71 0.00 8.23 0.28 -1.26 -3.33 120.64 120.45 1j3j n GLU 138 Ca 0.11 0.22 0.07 0.00 -0.16 0.00 0.00 57.16 57.40 1j3j n GLU 138 Cb 0.59 -1.66 0.40 0.00 1.43 0.00 0.00 31.44 32.20 1j3j n GLU 138 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1j3j n ASP 139 N -3.30 0.00 -2.29 -1.84 8.00 -1.26 -3.73 116.55 112.13 1j3j n ASP 139 Ca -0.33 -0.42 -0.29 0.00 0.71 0.00 0.00 54.79 54.47 1j3j n ASP 139 Cb 1.04 -0.00 0.03 0.00 -0.02 0.00 0.00 41.12 42.17 1j3j n ASP 139 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1j3j n VAL 140 N -1.00 2.86 -1.34 2.53 0.31 -1.21 -4.26 118.33 116.22 1j3j n VAL 140 Ca 0.10 -4.10 -0.39 0.00 -0.01 0.00 0.00 64.34 59.95 1j3j n VAL 140 Cb 0.05 -1.18 0.02 0.00 -0.91 0.00 0.00 33.84 31.81 1j3j n VAL 140 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1j3j n TYR 141 N -0.69 -1.96 -4.39 3.52 4.01 -1.17 -4.73 117.16 111.75 1j3j n TYR 141 Ca 0.48 0.47 -0.20 0.00 -0.16 0.00 0.00 57.90 58.49 1j3j n TYR 141 Cb 0.75 -1.80 -0.10 0.00 -0.31 0.00 0.00 39.34 37.88 1j3j n TYR 141 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1j3j s ILE 142 N -1.86 1.68 -0.04 -0.72 1.01 -1.26 -2.17 121.20 117.84 1j3j s ILE 142 Ca 0.62 -2.17 -0.09 0.00 0.00 0.00 0.00 60.65 59.01 1j3j s ILE 142 Cb -0.49 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 39.73 1j3j s ILE 142 CO 0.61 -0.44 0.21 0.27 0.00 0.00 0.00 174.94 175.60 1j3j s ILE 143 N -3.00 0.04 0.11 2.92 -4.36 0.36 -4.85 121.20 112.43 1j3j s ILE 143 Ca 0.26 -0.34 0.08 0.00 -0.26 0.00 0.00 60.65 60.40 1j3j s ILE 143 Cb 0.02 -0.41 -0.16 0.00 1.25 0.00 0.00 42.46 43.15 1j3j s ILE 143 CO 0.10 -0.18 1.34 0.78 0.24 0.00 0.00 174.94 177.21 1j3j h ASN 144 N 4.89 0.00 -5.11 4.36 2.35 -1.85 -1.04 115.58 119.18 1j3j h ASN 144 Ca -0.28 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.41 1j3j h ASN 144 Cb 1.19 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 39.43 1j3j h ASN 144 CO 0.39 0.91 -0.15 -0.75 -1.65 0.00 0.00 177.43 176.17 1j3j s LYS 145 N -2.85 1.03 0.06 0.81 2.20 -1.26 -4.54 119.74 115.20 1j3j s LYS 145 Ca 0.01 -0.80 -0.12 0.00 -0.36 0.00 0.00 55.97 54.69 1j3j s LYS 145 Cb 0.10 0.44 -0.03 0.00 -1.51 0.00 0.00 37.83 36.83 1j3j s LYS 145 CO 0.81 -0.39 1.21 0.28 -0.36 0.00 0.00 175.35 176.90 1j3j h VAL 146 N 2.46 0.00 0.00 4.02 2.07 -1.98 0.14 116.25 122.95 1j3j h VAL 146 Ca -0.34 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1j3j h VAL 146 Cb 1.24 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1j3j h VAL 146 CO 0.49 0.00 0.38 -0.33 0.02 0.00 0.00 177.57 178.13 1j3j h GLU 147 N -0.02 0.00 0.00 1.57 5.08 -2.02 0.40 114.58 119.58 1j3j h GLU 147 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1j3j h GLU 147 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1j3j h GLU 147 CO -0.35 0.00 0.00 -0.44 -1.00 0.00 0.00 179.01 177.22 1j3j h ASP 148 N 0.00 0.00 0.10 1.42 3.32 -1.13 -3.24 116.42 116.89 1j3j h ASP 148 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1j3j h ASP 148 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1j3j h ASP 148 CO 0.00 0.00 -0.05 0.25 -1.72 0.00 0.00 179.24 177.72 1j3j h LEU 149 N 0.00 -0.11 -0.98 1.55 5.85 -0.18 -2.71 115.31 118.73 1j3j h LEU 149 Ca 0.00 -0.36 0.31 0.00 0.84 0.00 0.00 57.88 58.67 1j3j h LEU 149 Cb 0.71 0.03 -0.15 0.00 0.37 0.00 0.00 40.66 41.62 1j3j h LEU 149 CO 0.00 0.32 0.47 0.40 -0.34 0.00 0.00 178.44 179.29 1j3j h ILE 150 N -0.56 0.26 0.47 4.05 1.08 -1.68 0.41 117.51 121.54 1j3j h ILE 150 Ca -0.01 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 1j3j h ILE 150 Cb 0.46 -0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.20 1j3j h ILE 150 CO 0.02 0.05 -0.23 0.58 -0.69 0.00 0.00 178.15 177.88 1j3j h VAL 151 N 0.25 0.53 0.00 1.67 2.07 -1.63 -2.16 116.25 116.97 1j3j h VAL 151 Ca 0.70 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 68.08 1j3j h VAL 151 Cb 1.60 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1j3j h VAL 151 CO -0.65 0.03 0.06 0.25 0.02 0.00 0.00 177.57 177.28 1j3j h LEU 152 N -0.72 0.00 0.11 2.57 5.85 -0.64 -1.68 115.31 120.79 1j3j h LEU 152 Ca -0.06 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.51 1j3j h LEU 152 Cb 0.53 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.58 1j3j h LEU 152 CO 0.11 0.00 -0.64 -0.07 -0.34 0.00 0.00 178.44 177.49 1j3j h LEU 153 N 0.00 0.38 -0.32 2.25 3.38 -0.92 -2.72 115.31 117.36 1j3j h LEU 153 Ca 0.00 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.02 1j3j h LEU 153 Cb 0.13 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1j3j h LEU 153 CO 0.00 1.30 0.00 0.61 0.09 0.00 0.00 178.44 180.44 1j3j n GLY 154 N 1.62 -0.60 0.10 0.83 0.00 -0.64 -2.11 105.19 104.39 1j3j n GLY 154 Ca -0.13 0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 1j3j n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j3j n LYS 155 N -1.67 0.68 -1.87 1.61 5.02 -1.17 -5.03 118.16 115.73 1j3j n LYS 155 Ca -0.00 0.10 -0.30 0.00 -2.02 0.00 0.00 58.31 56.09 1j3j n LYS 155 Cb 0.01 -1.43 0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1j3j n LYS 155 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1j3j s LEU 156 N -6.06 2.86 -0.43 -0.35 1.43 -0.90 -5.06 118.68 110.17 1j3j s LEU 156 Ca -0.25 1.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.96 1j3j s LEU 156 Cb 0.07 -3.89 0.12 0.00 0.03 0.00 0.00 46.19 42.52 1j3j s LEU 156 CO 0.54 -1.41 0.21 0.20 0.23 0.00 0.00 176.35 176.12 1j3j s ASN 157 N -4.35 5.09 0.21 2.29 0.01 -1.26 -4.93 114.94 112.00 1j3j s ASN 157 Ca 0.59 -2.25 0.03 0.00 -0.71 0.00 0.00 52.86 50.52 1j3j s ASN 157 Cb -0.11 -1.78 -0.05 0.00 0.41 0.00 0.00 41.25 39.72 1j3j s ASN 157 CO 0.52 -0.46 -0.01 -0.72 -1.51 0.00 0.00 177.10 174.91 1j3j s TYR 158 N 0.81 1.46 -0.12 2.20 1.13 -1.26 -4.45 117.35 117.11 1j3j s TYR 158 Ca 0.11 -0.93 -0.06 0.00 -1.41 0.00 0.00 57.07 54.77 1j3j s TYR 158 Cb -0.22 -0.83 -0.02 0.00 -1.10 0.00 0.00 41.96 39.79 1j3j s TYR 158 CO -0.05 -0.07 -0.12 -0.92 -2.51 0.00 0.00 175.55 171.88 1j3j h TYR 159 N 2.55 0.00 -3.67 -3.49 3.20 -1.74 -3.48 116.97 110.34 1j3j h TYR 159 Ca -0.38 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.34 1j3j h TYR 159 Cb 1.22 0.00 -0.21 0.00 1.54 0.00 0.00 36.73 39.28 1j3j h TYR 159 CO 0.57 0.00 -0.56 0.15 -1.64 0.00 0.00 178.16 176.68 1j3j s LYS 160 N -2.00 0.41 -0.28 1.82 1.02 -1.26 -4.99 119.74 114.46 1j3j s LYS 160 Ca -0.10 -0.45 -0.09 0.00 0.02 0.00 0.00 55.97 55.35 1j3j s LYS 160 Cb 0.01 0.17 -0.02 0.00 -0.52 0.00 0.00 37.83 37.47 1j3j s LYS 160 CO 0.15 -0.09 0.13 0.00 -0.92 0.00 0.00 175.35 174.62 1j3j s PHE 162 N 1.64 3.04 -0.68 0.00 0.08 0.23 0.10 117.98 122.39 1j3j s PHE 162 Ca 0.06 -0.56 -0.23 0.00 0.12 0.00 0.00 56.93 56.31 1j3j s PHE 162 Cb -0.16 -2.18 0.07 0.00 -0.57 0.00 0.00 43.02 40.18 1j3j s PHE 162 CO 0.06 -0.39 1.01 0.42 -0.10 0.00 0.00 175.22 176.22 1j3j s ILE 163 N 1.48 4.28 -0.84 0.64 -1.09 0.24 -0.92 121.20 124.98 1j3j s ILE 163 Ca 0.06 -0.35 0.05 0.00 -2.23 0.00 0.00 60.65 58.18 1j3j s ILE 163 Cb -0.15 -4.72 0.27 0.00 -1.58 0.00 0.00 42.46 36.28 1j3j s ILE 163 CO 0.01 -1.51 0.93 2.30 -1.23 0.00 0.00 174.94 175.45 1j3j n ILE 164 N 5.96 0.87 0.00 2.92 -5.35 -0.30 -2.41 119.36 121.06 1j3j n ILE 164 Ca -0.02 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 1j3j n ILE 164 Cb 0.46 -0.39 0.00 0.00 -1.74 0.00 0.00 39.64 37.97 1j3j n ILE 164 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j3j n GLY 165 N 0.25 -3.14 0.00 3.28 0.00 -1.26 -4.95 105.19 99.38 1j3j n GLY 165 Ca 0.09 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.96 1j3j n GLY 165 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j3j n GLY 166 N -0.18 1.52 0.31 -0.02 0.00 -1.26 -1.75 105.19 103.81 1j3j n GLY 166 Ca 0.00 -1.70 -0.10 0.00 0.00 0.00 0.00 46.02 44.22 1j3j n GLY 166 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1j3j h SER 167 N 0.00 -1.09 -0.75 1.61 0.87 -1.96 0.41 113.55 112.64 1j3j h SER 167 Ca 0.00 0.12 0.17 0.00 -1.23 0.00 0.00 61.79 60.86 1j3j h SER 167 Cb 0.00 0.42 -0.12 0.00 -0.44 0.00 0.00 62.40 62.25 1j3j h SER 167 CO 0.00 -0.33 0.08 0.58 -0.53 0.00 0.00 176.83 176.63 1j3j h VAL 168 N -0.41 0.40 -0.32 2.23 2.07 -1.96 0.11 116.25 118.37 1j3j h VAL 168 Ca 0.01 -0.06 -0.09 0.00 0.82 0.00 0.00 66.70 67.38 1j3j h VAL 168 Cb 0.46 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1j3j h VAL 168 CO -0.25 0.03 -0.19 0.58 0.02 0.00 0.00 177.57 177.76 1j3j h VAL 169 N 0.16 1.26 0.10 2.57 2.07 -1.70 -2.95 116.25 117.76 1j3j h VAL 169 Ca 0.42 -1.21 -0.00 0.00 0.82 0.00 0.00 66.70 66.73 1j3j h VAL 169 Cb 0.75 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1j3j h VAL 169 CO -0.61 0.39 -0.05 1.88 0.02 0.00 0.00 177.57 179.21 1j3j h TYR 170 N 0.52 -0.12 -0.33 1.57 0.05 0.22 -2.91 116.97 115.97 1j3j h TYR 170 Ca 0.08 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.91 1j3j h TYR 170 Cb 0.63 0.04 -0.08 0.00 1.01 0.00 0.00 36.73 38.33 1j3j h TYR 170 CO 0.02 0.20 -0.50 0.37 -1.05 0.00 0.00 178.16 177.21 1j3j h GLN 171 N -0.46 -0.40 -0.80 4.88 5.75 -0.97 -0.91 115.11 122.20 1j3j h GLN 171 Ca -0.01 0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 1j3j h GLN 171 Cb 0.38 0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.99 1j3j h GLN 171 CO 0.02 -0.27 0.35 1.05 -2.65 0.00 0.00 178.83 177.33 1j3j h GLU 172 N -0.42 1.17 0.00 1.69 4.11 -1.62 -0.16 114.58 119.35 1j3j h GLU 172 Ca 0.09 -0.19 -0.04 0.00 0.07 0.00 0.00 59.36 59.29 1j3j h GLU 172 Cb 0.61 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1j3j h GLU 172 CO -0.54 0.92 -0.18 0.74 0.07 0.00 0.00 179.01 180.02 1j3j h PHE 173 N 1.14 0.00 0.12 2.06 0.04 -1.26 -0.40 116.94 118.64 1j3j h PHE 173 Ca 0.27 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.83 1j3j h PHE 173 Cb 0.17 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.33 1j3j h PHE 173 CO 0.02 0.18 -0.99 -0.07 -0.60 0.00 0.00 178.31 176.85 1j3j h LEU 174 N 0.00 0.39 0.57 1.54 3.38 -0.71 -0.94 115.31 119.54 1j3j h LEU 174 Ca -0.00 -0.90 -0.02 0.00 0.09 0.00 0.00 57.88 57.04 1j3j h LEU 174 Cb 0.39 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1j3j h LEU 174 CO 0.02 1.45 -0.38 -0.33 0.09 0.00 0.00 178.44 179.30 1j3j h GLU 175 N -0.42 -0.88 0.00 1.13 5.08 -0.82 0.47 114.58 119.15 1j3j h GLU 175 Ca -0.20 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1j3j h GLU 175 Cb 1.63 0.20 0.00 0.00 0.50 0.00 0.00 28.75 31.08 1j3j h GLU 175 CO 0.09 -0.58 0.00 1.63 -1.00 0.00 0.00 179.01 179.15 1j3j n LYS 176 N -5.51 0.04 -2.87 2.33 5.02 -0.18 -4.86 118.16 112.14 1j3j n LYS 176 Ca -0.12 0.51 -0.11 0.00 -2.02 0.00 0.00 58.31 56.57 1j3j n LYS 176 Cb 0.40 -1.63 0.06 0.00 -0.02 0.00 0.00 35.03 33.83 1j3j n LYS 176 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1j3j n LYS 177 N -1.72 -3.50 -0.00 1.97 5.02 0.16 -4.97 118.16 115.11 1j3j n LYS 177 Ca -0.00 0.58 0.08 0.00 -2.02 0.00 0.00 58.31 56.95 1j3j n LYS 177 Cb 0.03 -4.66 -0.10 0.00 -0.02 0.00 0.00 35.03 30.27 1j3j n LYS 177 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1j3j n LEU 178 N -2.97 0.73 -4.67 -0.35 4.77 -0.37 -4.59 117.00 109.56 1j3j n LEU 178 Ca -0.15 -0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 54.97 1j3j n LEU 178 Cb 0.60 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 1j3j n LEU 178 CO 0.41 0.18 0.77 -0.63 -1.33 0.00 0.00 177.39 176.79 1j3j s ILE 179 N -2.73 4.78 -0.11 -0.08 -1.09 -1.24 -4.18 121.20 116.55 1j3j s ILE 179 Ca 0.05 1.88 -0.03 0.00 -2.23 0.00 0.00 60.65 60.32 1j3j s ILE 179 Cb 0.13 -4.25 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 1j3j s ILE 179 CO 0.72 -0.06 -0.07 0.50 -1.23 0.00 0.00 174.94 174.81 1j3j h LYS 180 N 7.33 0.00 -5.32 2.79 3.64 -1.43 -3.44 116.57 120.14 1j3j h LYS 180 Ca -0.26 0.00 -0.40 0.00 -1.27 0.00 0.00 60.65 58.72 1j3j h LYS 180 Cb 1.11 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 32.72 1j3j h LYS 180 CO 0.89 0.00 -0.77 0.15 -2.27 0.00 0.00 179.45 177.45 1j3j s LYS 181 N -1.80 0.87 -0.29 1.90 1.02 -1.26 -1.60 119.74 118.58 1j3j s LYS 181 Ca -0.05 -1.04 0.03 0.00 0.02 0.00 0.00 55.97 54.93 1j3j s LYS 181 Cb 0.01 -0.81 0.08 0.00 -0.52 0.00 0.00 37.83 36.58 1j3j s LYS 181 CO 0.08 0.17 -0.04 0.42 -0.92 0.00 0.00 175.35 175.07 1j3j s ILE 182 N -1.58 2.11 -1.13 2.17 1.01 -0.23 -1.13 121.20 122.42 1j3j s ILE 182 Ca 0.01 -1.87 -0.20 0.00 0.00 0.00 0.00 60.65 58.60 1j3j s ILE 182 Cb -0.08 -2.37 0.08 0.00 0.01 0.00 0.00 42.46 40.10 1j3j s ILE 182 CO 0.02 -0.28 1.51 -0.31 0.00 0.00 0.00 174.94 175.88 1j3j s TYR 183 N 1.07 2.80 -0.21 3.97 1.51 0.93 -1.75 117.35 125.66 1j3j s TYR 183 Ca -0.00 -1.33 -0.22 0.00 -1.01 0.00 0.00 57.07 54.50 1j3j s TYR 183 Cb -0.19 -4.62 -0.02 0.00 -0.11 0.00 0.00 41.96 37.02 1j3j s TYR 183 CO -0.07 -1.77 0.71 0.12 -1.11 0.00 0.00 175.55 173.42 1j3j s PHE 184 N 4.04 3.35 -0.21 2.71 2.19 -0.63 -1.60 117.98 127.84 1j3j s PHE 184 Ca 0.47 1.01 -0.09 0.00 0.33 0.00 0.00 56.93 58.65 1j3j s PHE 184 Cb 0.00 -2.90 -0.04 0.00 -1.31 0.00 0.00 43.02 38.77 1j3j s PHE 184 CO -0.03 -0.26 0.10 0.99 1.83 0.00 0.00 175.22 177.85 1j3j s THR 185 N 2.24 4.95 -0.48 0.12 2.01 -0.23 -0.51 115.64 123.74 1j3j s THR 185 Ca 0.31 0.03 -0.16 0.00 0.31 0.00 0.00 61.69 62.18 1j3j s THR 185 Cb -0.16 -3.27 0.07 0.00 0.01 0.00 0.00 72.50 69.15 1j3j s THR 185 CO 0.10 0.41 0.45 -0.13 -0.69 0.00 0.00 174.62 174.76 1j3j s ARG 186 N 0.74 3.01 -0.45 4.92 0.52 -0.13 -1.10 118.95 126.46 1j3j s ARG 186 Ca 0.05 -1.25 -0.26 0.00 -0.52 0.00 0.00 55.73 53.75 1j3j s ARG 186 Cb -0.13 -4.13 0.03 0.00 0.52 0.00 0.00 34.95 31.24 1j3j s ARG 186 CO 0.02 -1.08 0.94 0.42 0.02 0.00 0.00 175.30 175.62 1j3j s ILE 187 N 1.87 4.47 -1.30 1.52 -1.09 0.34 -2.89 121.20 124.12 1j3j s ILE 187 Ca 0.07 0.87 -0.08 0.00 -2.23 0.00 0.00 60.65 59.27 1j3j s ILE 187 Cb -0.23 -4.43 0.15 0.00 -1.58 0.00 0.00 42.46 36.37 1j3j s ILE 187 CO 0.08 -0.80 2.07 -3.20 -1.23 0.00 0.00 174.94 171.86 1j3j n ASN 188 N 7.16 6.28 -3.45 3.58 5.15 -0.82 -3.73 115.26 129.44 1j3j n ASN 188 Ca 0.07 -3.13 -0.12 0.00 -0.60 0.00 0.00 54.58 50.81 1j3j n ASN 188 Cb 0.48 -1.43 -0.02 0.00 -0.53 0.00 0.00 39.78 38.28 1j3j n ASN 188 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1j3j s SER 189 N 0.61 -0.53 -0.14 1.20 1.04 -1.26 -4.43 113.70 110.19 1j3j s SER 189 Ca 0.45 0.06 -0.08 0.00 0.48 0.00 0.00 55.95 56.86 1j3j s SER 189 Cb 0.13 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.75 1j3j s SER 189 CO -0.03 -0.86 0.13 -0.89 0.98 0.00 0.00 173.24 172.57 1j3j s THR 190 N -3.39 5.44 0.20 2.02 2.01 -1.26 -1.51 115.64 119.15 1j3j s THR 190 Ca 0.01 0.19 -0.02 0.00 0.31 0.00 0.00 61.69 62.18 1j3j s THR 190 Cb -0.01 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 1j3j s THR 190 CO -0.10 0.57 0.16 -0.31 -0.69 0.00 0.00 174.62 174.24 1j3j s TYR 191 N -0.63 1.09 0.15 4.92 1.51 -0.93 -4.96 117.35 118.50 1j3j s TYR 191 Ca 0.13 -1.32 -0.30 0.00 -1.01 0.00 0.00 57.07 54.57 1j3j s TYR 191 Cb -0.12 -0.50 -0.07 0.00 -0.11 0.00 0.00 41.96 41.17 1j3j s TYR 191 CO 0.02 -0.66 1.01 -2.00 -1.11 0.00 0.00 175.55 172.81 1j3j s GLU 192 N -4.15 4.68 0.05 -0.62 2.12 -1.26 -3.12 118.70 116.41 1j3j s GLU 192 Ca 0.37 1.56 0.01 0.00 0.36 0.00 0.00 54.97 57.27 1j3j s GLU 192 Cb 0.06 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 1j3j s GLU 192 CO 0.11 0.21 -0.06 0.00 -0.54 0.00 0.00 175.26 174.98 1j3j n ASP 194 N 1.00 1.91 -4.11 0.00 5.68 -0.95 -5.00 116.55 115.08 1j3j n ASP 194 Ca -0.20 -0.05 -0.25 0.00 -0.50 0.00 0.00 54.79 53.80 1j3j n ASP 194 Cb 0.57 0.48 -0.16 0.00 -1.14 0.00 0.00 41.12 40.87 1j3j n ASP 194 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1j3j s VAL 195 N -0.87 1.28 0.23 2.12 -7.23 -1.07 -5.04 120.40 109.83 1j3j s VAL 195 Ca 0.00 -0.64 0.05 0.00 -1.81 0.00 0.00 61.98 59.58 1j3j s VAL 195 Cb 0.00 -1.10 -0.05 0.00 0.56 0.00 0.00 36.38 35.79 1j3j s VAL 195 CO 0.00 0.37 -0.05 -0.36 -0.31 0.00 0.00 175.10 174.76 1j3j s PHE 196 N 0.02 1.66 0.34 2.82 0.40 -1.26 -1.46 117.98 120.50 1j3j s PHE 196 Ca -0.02 -0.80 -0.18 0.00 -0.60 0.00 0.00 56.93 55.33 1j3j s PHE 196 Cb -0.10 -0.93 -0.10 0.00 0.51 0.00 0.00 43.02 42.40 1j3j s PHE 196 CO 0.01 0.11 0.81 0.12 0.70 0.00 0.00 175.22 176.98 1j3j s PHE 197 N -3.24 3.41 0.15 0.36 2.19 -0.57 -4.71 117.98 115.57 1j3j s PHE 197 Ca 0.27 1.38 -0.30 0.00 0.33 0.00 0.00 56.93 58.61 1j3j s PHE 197 Cb 0.04 -2.66 -0.08 0.00 -1.31 0.00 0.00 43.02 39.02 1j3j s PHE 197 CO 0.08 0.07 1.26 -2.14 1.83 0.00 0.00 175.22 176.33 1j3j s PRO 198 N -2.86 4.42 -0.26 10.12 0.02 -1.26 -4.92 135.00 140.26 1j3j s PRO 198 Ca 0.55 1.94 -0.34 0.00 0.02 0.00 0.00 61.00 63.17 1j3j s PRO 198 Cb -0.11 -3.25 -0.11 0.00 0.02 0.00 0.00 34.50 31.05 1j3j s PRO 198 CO 0.17 -0.24 2.09 -1.91 -0.33 0.00 0.00 177.00 176.79 1j3j n GLU 199 N 3.13 1.51 -2.24 5.54 2.13 -1.26 -4.88 120.64 124.57 1j3j n GLU 199 Ca 0.07 0.47 -0.41 0.00 0.66 0.00 0.00 57.16 57.95 1j3j n GLU 199 Cb 0.44 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.49 1j3j n GLU 199 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1j3j s ILE 200 N 6.48 3.25 -0.54 6.31 1.01 -1.26 -4.95 121.20 131.50 1j3j s ILE 200 Ca 1.03 1.04 -0.28 0.00 0.00 0.00 0.00 60.65 62.44 1j3j s ILE 200 Cb -0.74 -3.67 0.02 0.00 0.01 0.00 0.00 42.46 38.09 1j3j s ILE 200 CO 0.48 0.16 1.30 0.21 0.00 0.00 0.00 174.94 177.10 1j3j s ASN 201 N 0.25 6.34 0.63 3.58 3.84 -1.26 -4.88 114.94 123.44 1j3j s ASN 201 Ca 0.56 0.32 0.24 0.00 0.21 0.00 0.00 52.86 54.18 1j3j s ASN 201 Cb -0.36 -2.55 1.19 0.00 -0.55 0.00 0.00 41.25 38.99 1j3j s ASN 201 CO 0.39 -1.53 1.66 -0.33 -2.79 0.00 0.00 177.10 174.49 1j3j h GLU 202 N 10.23 0.00 -0.00 0.43 5.08 -1.93 0.37 114.58 128.76 1j3j h GLU 202 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1j3j h GLU 202 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1j3j h GLU 202 CO 1.16 0.00 -0.48 0.09 -1.00 0.00 0.00 179.01 178.78 1j3j n ASN 203 N -3.12 0.79 -0.07 1.42 3.02 -1.26 -4.10 115.26 111.94 1j3j n ASN 203 Ca 0.05 -0.59 -0.07 0.00 -0.03 0.00 0.00 54.58 53.94 1j3j n ASN 203 Cb 0.74 0.31 -0.11 0.00 -0.61 0.00 0.00 39.78 40.11 1j3j n ASN 203 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1j3j n GLU 204 N -1.17 1.61 -4.32 3.52 1.02 0.12 -4.87 120.64 116.55 1j3j n GLU 204 Ca 0.07 -0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 57.03 1j3j n GLU 204 Cb 0.35 -1.37 -0.14 0.00 -0.02 0.00 0.00 31.44 30.26 1j3j n GLU 204 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1j3j s TYR 205 N -2.35 0.96 0.01 -0.32 2.02 -0.50 -1.70 117.35 115.47 1j3j s TYR 205 Ca -0.08 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.35 1j3j s TYR 205 Cb 0.04 -0.59 -0.01 0.00 -0.40 0.00 0.00 41.96 41.00 1j3j s TYR 205 CO 0.59 -0.00 -0.03 1.14 -1.57 0.00 0.00 175.55 175.68 1j3j s GLN 206 N -0.78 0.25 -0.17 -0.62 -2.07 0.10 -4.33 119.66 112.03 1j3j s GLN 206 Ca 0.01 -0.38 -0.29 0.00 -1.82 0.00 0.00 55.36 52.88 1j3j s GLN 206 Cb -0.06 -0.04 -0.02 0.00 -1.09 0.00 0.00 33.01 31.80 1j3j s GLN 206 CO 0.00 -0.00 1.35 0.42 -1.32 0.00 0.00 175.29 175.74 1j3j s ILE 207 N -0.81 4.12 -0.36 3.63 1.01 -1.26 0.72 121.20 128.25 1j3j s ILE 207 Ca -0.08 1.34 0.16 0.00 0.00 0.00 0.00 60.65 62.08 1j3j s ILE 207 Cb -0.06 -3.92 -0.22 0.00 0.01 0.00 0.00 42.46 38.27 1j3j s ILE 207 CO -0.00 -0.18 0.51 2.30 0.00 0.00 0.00 174.94 177.57 1j3j n ILE 208 N 5.57 0.00 -3.76 2.92 -5.35 0.12 -4.94 119.36 113.93 1j3j n ILE 208 Ca 0.15 -0.26 -0.13 0.00 -0.27 0.00 0.00 62.75 62.24 1j3j n ILE 208 Cb 0.45 0.53 -0.08 0.00 -1.74 0.00 0.00 39.64 38.79 1j3j n ILE 208 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1j3j s SER 209 N -3.27 -0.17 -0.06 7.28 0.01 -1.21 -5.00 113.70 111.27 1j3j s SER 209 Ca -0.00 -0.02 -0.03 0.00 1.31 0.00 0.00 55.95 57.21 1j3j s SER 209 Cb 0.11 0.33 0.04 0.00 0.21 0.00 0.00 66.02 66.72 1j3j s SER 209 CO 0.68 -0.52 0.12 0.68 0.41 0.00 0.00 173.24 174.61 1j3j s VAL 210 N -1.82 -0.18 0.24 3.43 -7.23 -1.26 -1.67 120.40 111.91 1j3j s VAL 210 Ca -0.10 0.35 -0.04 0.00 -1.81 0.00 0.00 61.98 60.37 1j3j s VAL 210 Cb -0.03 -0.23 0.06 0.00 0.56 0.00 0.00 36.38 36.73 1j3j s VAL 210 CO 0.01 0.14 0.31 -1.54 -0.31 0.00 0.00 175.10 173.72 1j3j n SER 211 N 5.09 -0.10 -4.83 4.85 3.41 -0.35 -5.02 113.62 116.67 1j3j n SER 211 Ca -0.09 -1.07 -0.30 0.00 -0.26 0.00 0.00 58.87 57.16 1j3j n SER 211 Cb 0.50 -0.24 0.09 0.00 -0.26 0.00 0.00 64.21 64.30 1j3j n SER 211 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1j3j s ASP 212 N -2.17 4.51 -0.10 4.04 2.15 -1.26 -4.80 116.67 119.04 1j3j s ASP 212 Ca 0.18 1.14 -0.04 0.00 0.43 0.00 0.00 52.55 54.26 1j3j s ASP 212 Cb -0.01 -1.83 -0.04 0.00 -0.30 0.00 0.00 42.92 40.74 1j3j s ASP 212 CO 0.13 -1.94 0.07 -0.69 -0.17 0.00 0.00 175.17 172.57 1j3j s VAL 213 N -3.27 4.90 0.25 1.11 1.01 -1.26 -4.44 120.40 118.70 1j3j s VAL 213 Ca 0.61 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.60 1j3j s VAL 213 Cb -0.13 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 1j3j s VAL 213 CO 0.53 0.61 0.03 -0.31 0.00 0.00 0.00 175.10 175.96 1j3j s TYR 214 N -0.92 1.61 -0.08 5.22 2.02 0.11 -4.96 117.35 120.37 1j3j s TYR 214 Ca 0.14 -1.00 0.05 0.00 -0.37 0.00 0.00 57.07 55.89 1j3j s TYR 214 Cb -0.12 -0.96 -0.01 0.00 -0.40 0.00 0.00 41.96 40.48 1j3j s TYR 214 CO 0.03 -0.11 -0.24 0.99 -1.57 0.00 0.00 175.55 174.65 1j3j s THR 215 N -3.49 2.04 -0.21 -0.71 2.01 -1.26 -0.61 115.64 113.41 1j3j s THR 215 Ca 0.32 -1.04 -0.13 0.00 0.31 0.00 0.00 61.69 61.15 1j3j s THR 215 Cb 0.07 -1.74 0.07 0.00 0.01 0.00 0.00 72.50 70.90 1j3j s THR 215 CO 0.11 0.56 0.53 -0.55 -0.69 0.00 0.00 174.62 174.58 1j3j s SER 216 N 0.06 -0.68 -1.47 3.53 0.15 0.20 -4.91 113.70 110.59 1j3j s SER 216 Ca -0.10 1.14 -0.10 0.00 0.70 0.00 0.00 55.95 57.59 1j3j s SER 216 Cb -0.16 1.04 0.06 0.00 -1.71 0.00 0.00 66.02 65.26 1j3j s SER 216 CO 0.06 -0.21 0.96 0.59 1.20 0.00 0.00 173.24 175.84 1j3j n ASN 217 N 4.05 -4.30 -2.33 5.45 4.13 -1.26 -2.37 115.26 118.62 1j3j n ASN 217 Ca -0.21 -0.75 -0.16 0.00 1.68 0.00 0.00 54.58 55.14 1j3j n ASN 217 Cb 0.57 -4.08 0.03 0.00 -1.54 0.00 0.00 39.78 34.76 1j3j n ASN 217 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1j3j n ASN 218 N -2.90 -4.92 -3.55 6.41 5.15 -1.26 -5.01 115.26 109.17 1j3j n ASN 218 Ca -0.03 -0.24 -0.17 0.00 -0.60 0.00 0.00 54.58 53.53 1j3j n ASN 218 Cb 0.56 -3.73 -0.06 0.00 -0.53 0.00 0.00 39.78 36.02 1j3j n ASN 218 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1j3j s THR 219 N -3.04 0.00 0.44 -0.44 -1.32 -1.00 -5.09 115.64 105.20 1j3j s THR 219 Ca 0.26 -0.02 -0.03 0.00 -1.21 0.00 0.00 61.69 60.69 1j3j s THR 219 Cb -0.11 -0.98 -0.03 0.00 -1.51 0.00 0.00 72.50 69.87 1j3j s THR 219 CO 0.32 -0.01 0.70 0.42 -2.21 0.00 0.00 174.62 173.84 1j3j s THR 220 N -1.00 4.71 0.06 5.08 -4.23 -1.26 -0.63 115.64 118.38 1j3j s THR 220 Ca -0.10 -0.15 -0.27 0.00 -1.18 0.00 0.00 61.69 60.00 1j3j s THR 220 Cb -0.01 -3.76 0.09 0.00 1.34 0.00 0.00 72.50 70.15 1j3j s THR 220 CO 0.09 -0.64 0.86 -1.48 -0.54 0.00 0.00 174.62 172.90 1j3j s LEU 221 N -4.60 -0.35 0.22 4.79 2.34 0.22 -1.94 118.68 119.36 1j3j s LEU 221 Ca 0.46 -0.11 -0.13 0.00 0.06 0.00 0.00 54.13 54.41 1j3j s LEU 221 Cb -0.10 2.16 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1j3j s LEU 221 CO 0.41 -0.76 0.45 1.51 -1.06 0.00 0.00 176.35 176.90 1j3j s ASP 222 N -2.64 -0.10 -0.12 1.48 1.47 -1.14 -0.71 116.67 114.91 1j3j s ASP 222 Ca 0.06 -0.83 0.03 0.00 1.18 0.00 0.00 52.55 52.99 1j3j s ASP 222 Cb -0.01 0.56 0.01 0.00 -0.34 0.00 0.00 42.92 43.13 1j3j s ASP 222 CO -0.07 -1.08 -0.22 -0.36 0.68 0.00 0.00 175.17 174.12 1j3j s PHE 223 N -3.98 2.57 0.12 2.11 0.08 -1.26 -0.96 117.98 116.66 1j3j s PHE 223 Ca 0.19 -1.20 0.10 0.00 0.12 0.00 0.00 56.93 56.14 1j3j s PHE 223 Cb 0.00 -1.74 -0.04 0.00 -0.57 0.00 0.00 43.02 40.67 1j3j s PHE 223 CO 0.05 -0.53 -0.25 0.96 -0.10 0.00 0.00 175.22 175.35 1j3j s ILE 224 N 0.64 2.08 -0.20 0.64 -4.36 0.33 -1.21 121.20 119.11 1j3j s ILE 224 Ca -0.12 -1.68 -0.03 0.00 -0.26 0.00 0.00 60.65 58.56 1j3j s ILE 224 Cb -0.16 -1.85 -0.01 0.00 1.25 0.00 0.00 42.46 41.69 1j3j s ILE 224 CO 0.02 0.04 -0.06 -0.63 0.24 0.00 0.00 174.94 174.55 1j3j s ILE 225 N -1.09 3.28 -0.09 8.37 1.01 -0.67 -1.60 121.20 130.40 1j3j s ILE 225 Ca 0.11 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 60.10 1j3j s ILE 225 Cb -0.10 -2.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.85 1j3j s ILE 225 CO 0.05 0.45 0.31 -0.31 0.00 0.00 0.00 174.94 175.44 1j3j s TYR 226 N 1.28 3.59 0.21 3.97 2.02 -0.72 -0.70 117.35 127.01 1j3j s TYR 226 Ca 0.03 0.74 0.11 0.00 -0.37 0.00 0.00 57.07 57.59 1j3j s TYR 226 Cb -0.14 -2.24 -0.05 0.00 -0.40 0.00 0.00 41.96 39.13 1j3j s TYR 226 CO -0.03 0.49 -0.20 0.21 -1.57 0.00 0.00 175.55 174.46 1j3j s LYS 227 N -0.43 1.66 -0.50 -0.62 2.20 0.22 -1.07 119.74 121.22 1j3j s LYS 227 Ca 0.19 -1.54 -0.28 0.00 -0.36 0.00 0.00 55.97 53.98 1j3j s LYS 227 Cb -0.14 -1.88 0.03 0.00 -1.51 0.00 0.00 37.83 34.32 1j3j s LYS 227 CO 0.08 0.39 1.09 0.21 -0.36 0.00 0.00 175.35 176.76 1j3j s LYS 228 N -2.93 3.62 -0.24 4.03 2.47 -0.63 -0.72 119.74 125.35 1j3j s LYS 228 Ca 0.24 0.38 -0.28 0.00 -1.56 0.00 0.00 55.97 54.75 1j3j s LYS 228 Cb -0.07 -3.94 -0.04 0.00 -1.46 0.00 0.00 37.83 32.31 1j3j s LYS 228 CO 0.12 -1.41 2.15 0.95 0.16 0.00 0.00 175.35 177.33 1j3j s THR 229 N 4.37 3.08 0.28 3.43 -4.23 -0.69 -4.62 115.64 117.26 1j3j s THR 229 Ca 0.44 0.08 0.22 0.00 -1.18 0.00 0.00 61.69 61.25 1j3j s THR 229 Cb -0.08 -3.11 0.22 0.00 1.34 0.00 0.00 72.50 70.87 1j3j s THR 229 CO 0.29 -0.07 1.63 0.78 -0.54 0.00 0.00 174.62 176.71 1j3j h ASN 230 N 14.72 0.00 -0.02 3.99 2.35 -1.91 -3.48 115.58 131.23 1j3j h ASN 230 Ca -0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 1j3j h ASN 230 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 1j3j h ASN 230 CO 0.97 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 177.34