#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zjz n ASN 2 N 0.00 -5.86 0.17 4.04 4.13 -1.24 -4.85 115.26 111.65 1zjz n ASN 2 Ca 0.00 0.07 0.14 0.00 1.68 0.00 0.00 54.58 56.47 1zjz n ASN 2 Cb 0.00 -3.66 0.54 0.00 -1.54 0.00 0.00 39.78 35.12 1zjz n ASN 2 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1zjz h ARG 3 N 0.00 0.00 -0.82 3.52 3.08 -1.88 -2.61 114.38 115.67 1zjz h ARG 3 Ca -0.06 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.43 1zjz h ARG 3 Cb 1.04 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 30.67 1zjz h ARG 3 CO 0.09 0.00 -0.71 1.28 -1.07 0.00 0.00 179.97 179.56 1zjz n LEU 4 N -2.49 5.09 -4.66 3.04 4.77 -0.16 -4.54 117.00 118.05 1zjz n LEU 4 Ca 0.02 -4.75 -0.49 0.00 -0.03 0.00 0.00 56.01 50.75 1zjz n LEU 4 Cb 0.26 -0.39 -0.05 0.00 -2.33 0.00 0.00 43.42 40.91 1zjz n LEU 4 CO 0.22 2.08 1.24 -0.67 -1.33 0.00 0.00 177.39 178.93 1zjz n ASP 5 N -0.71 2.84 0.00 -1.43 4.64 -0.99 -1.65 116.55 119.26 1zjz n ASP 5 Ca 0.45 1.06 0.00 0.00 -1.38 0.00 0.00 54.79 54.92 1zjz n ASP 5 Cb 0.93 -1.33 0.00 0.00 -1.04 0.00 0.00 41.12 39.68 1zjz n ASP 5 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1zjz n GLY 6 N 3.62 0.44 3.78 0.27 0.00 -1.26 -4.99 105.19 107.05 1zjz n GLY 6 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 1zjz n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zjz s LYS 7 N -0.59 3.34 -0.16 1.61 -0.14 -0.66 -4.92 119.74 118.22 1zjz s LYS 7 Ca 0.00 1.57 -0.00 0.00 -1.36 0.00 0.00 55.97 56.18 1zjz s LYS 7 Cb 0.00 -2.01 0.04 0.00 -1.68 0.00 0.00 37.83 34.18 1zjz s LYS 7 CO 0.00 -0.85 -0.06 0.08 -0.76 0.00 0.00 175.35 173.76 1zjz s VAL 8 N -1.84 1.15 0.01 3.17 1.01 -1.26 -1.42 120.40 121.22 1zjz s VAL 8 Ca 0.72 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 62.14 1zjz s VAL 8 Cb -0.23 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1zjz s VAL 8 CO 0.28 0.15 -0.23 0.00 0.00 0.00 0.00 175.10 175.31 1zjz s ALA 9 N 1.62 2.36 -0.15 5.51 0.00 0.46 -0.85 121.76 130.71 1zjz s ALA 9 Ca 0.01 -1.16 -0.05 0.00 0.00 0.00 0.00 51.96 50.76 1zjz s ALA 9 Cb -0.15 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.30 1zjz s ALA 9 CO -0.08 0.54 0.01 0.42 0.00 0.00 0.00 175.76 176.65 1zjz s ILE 10 N -0.76 4.29 -0.23 0.00 1.01 -0.34 -0.58 121.20 124.59 1zjz s ILE 10 Ca 0.12 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.55 1zjz s ILE 10 Cb -0.10 -2.89 0.06 0.00 0.01 0.00 0.00 42.46 39.54 1zjz s ILE 10 CO 0.02 0.50 -0.06 -0.63 0.00 0.00 0.00 174.94 174.77 1zjz s ILE 11 N 0.16 1.52 0.34 2.92 1.01 -0.20 -0.48 121.20 126.46 1zjz s ILE 11 Ca 0.01 -1.18 -0.26 0.00 0.00 0.00 0.00 60.65 59.22 1zjz s ILE 11 Cb -0.13 -1.77 -0.10 0.00 0.01 0.00 0.00 42.46 40.48 1zjz s ILE 11 CO 0.02 -0.08 0.99 0.42 0.00 0.00 0.00 174.94 176.29 1zjz s THR 12 N 1.41 4.02 -1.42 2.92 -4.23 -0.66 -1.86 115.64 115.81 1zjz s THR 12 Ca -0.05 1.66 -0.09 0.00 -1.18 0.00 0.00 61.69 62.03 1zjz s THR 12 Cb -0.19 -3.91 0.04 0.00 1.34 0.00 0.00 72.50 69.79 1zjz s THR 12 CO -0.06 0.12 0.98 0.61 -0.54 0.00 0.00 174.62 175.72 1zjz n GLY 13 N 0.54 -0.46 0.88 3.99 0.00 -0.48 -2.64 105.19 107.03 1zjz n GLY 13 Ca 0.03 0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.31 1zjz n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zjz n GLY 14 N -1.70 1.23 0.00 -0.02 0.00 -0.59 -4.06 105.19 100.05 1zjz n GLY 14 Ca -0.06 -0.51 0.10 0.00 0.00 0.00 0.00 46.02 45.56 1zjz n GLY 14 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zjz n THR 15 N 0.83 0.00 -3.95 2.61 -2.24 -1.26 -2.93 114.28 107.34 1zjz n THR 15 Ca 0.16 -0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.84 1zjz n THR 15 Cb 0.41 0.85 -0.10 0.00 -2.10 0.00 0.00 70.33 69.39 1zjz n THR 15 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1zjz s LEU 16 N -3.01 1.94 0.00 3.22 1.43 -1.26 -4.77 118.68 116.23 1zjz s LEU 16 Ca 0.08 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1zjz s LEU 16 Cb 0.16 0.49 0.00 0.00 0.03 0.00 0.00 46.19 46.87 1zjz s LEU 16 CO 0.84 -0.49 0.00 0.61 0.23 0.00 0.00 176.35 177.54 1zjz n GLY 17 N 0.81 3.28 0.11 -3.19 0.00 -1.26 -1.89 105.19 103.05 1zjz n GLY 17 Ca -0.19 -0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 1zjz n GLY 17 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1zjz h ILE 18 N 0.00 0.84 -0.84 -0.61 2.04 -1.91 -1.95 117.51 115.08 1zjz h ILE 18 Ca 0.00 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1zjz h ILE 18 Cb 0.00 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 1zjz h ILE 18 CO 0.00 0.01 0.55 1.23 0.00 0.00 0.00 178.15 179.93 1zjz h GLY 19 N 0.05 1.20 1.05 5.37 0.00 -1.58 -0.47 103.07 108.69 1zjz h GLY 19 Ca 0.10 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 1zjz h GLY 19 CO -0.18 0.39 0.34 -2.00 0.00 0.00 0.00 176.54 175.09 1zjz h LEU 20 N 1.09 1.11 -0.49 3.11 5.85 -1.04 -0.84 115.31 124.10 1zjz h LEU 20 Ca 0.32 -0.16 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 1zjz h LEU 20 Cb -0.06 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.67 1zjz h LEU 20 CO -0.09 0.97 -0.14 0.00 -0.34 0.00 0.00 178.44 178.84 1zjz h ALA 21 N 1.19 0.68 -0.27 1.25 0.00 -0.72 -0.34 119.26 121.04 1zjz h ALA 21 Ca 0.27 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1zjz h ALA 21 Cb 0.20 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1zjz h ALA 21 CO -0.03 0.62 0.05 0.82 0.00 0.00 0.00 179.25 180.71 1zjz h ILE 22 N 0.83 0.86 -0.74 0.00 2.04 -0.88 -1.04 117.51 118.57 1zjz h ILE 22 Ca 0.12 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1zjz h ILE 22 Cb 0.71 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 1zjz h ILE 22 CO 0.05 0.03 0.46 0.00 0.00 0.00 0.00 178.15 178.69 1zjz h ALA 23 N 1.21 0.98 0.06 1.87 0.00 -0.93 0.11 119.26 122.56 1zjz h ALA 23 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1zjz h ALA 23 Cb 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1zjz h ALA 23 CO -0.17 0.23 -0.03 1.15 0.00 0.00 0.00 179.25 180.42 1zjz h THR 24 N 0.88 1.00 -0.19 0.00 2.02 -0.64 -0.91 112.91 115.07 1zjz h THR 24 Ca 0.31 -0.21 -0.12 0.00 0.77 0.00 0.00 66.41 67.15 1zjz h THR 24 Cb 0.06 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1zjz h THR 24 CO -0.13 0.05 -0.41 0.11 0.37 0.00 0.00 175.52 175.52 1zjz h LYS 25 N -0.17 0.45 0.03 6.66 1.79 -1.03 -1.31 116.57 122.99 1zjz h LYS 25 Ca -0.01 -0.22 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 1zjz h LYS 25 Cb 0.15 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1zjz h LYS 25 CO 0.01 0.78 -0.03 0.74 -1.08 0.00 0.00 179.45 179.87 1zjz h PHE 26 N 0.37 -0.08 -0.67 -1.35 0.05 -0.60 -1.06 116.94 113.60 1zjz h PHE 26 Ca 0.03 0.00 0.05 0.00 3.82 0.00 0.00 57.97 61.87 1zjz h PHE 26 Cb 0.87 0.03 -0.05 0.00 2.00 0.00 0.00 35.95 38.80 1zjz h PHE 26 CO 0.03 -0.05 0.39 0.28 -0.18 0.00 0.00 178.31 178.78 1zjz h VAL 27 N -0.07 1.01 -0.83 -0.55 2.07 -1.05 -1.20 116.25 115.64 1zjz h VAL 27 Ca 0.00 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.31 1zjz h VAL 27 Cb 0.07 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.00 1zjz h VAL 27 CO -0.01 0.14 0.54 -0.33 0.02 0.00 0.00 177.57 177.93 1zjz h GLU 28 N 0.74 0.95 -0.18 1.57 5.08 -0.98 -2.46 114.58 119.31 1zjz h GLU 28 Ca 0.29 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1zjz h GLU 28 Cb 0.13 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1zjz h GLU 28 CO -0.15 0.63 0.00 0.39 -1.00 0.00 0.00 179.01 178.87 1zjz n GLU 29 N -4.46 1.49 0.00 2.33 -0.58 -0.42 -4.52 120.64 114.48 1zjz n GLU 29 Ca 0.11 -0.76 0.00 0.00 -0.42 0.00 0.00 57.16 56.09 1zjz n GLU 29 Cb 0.15 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 1zjz n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zjz n GLY 30 N 0.92 0.54 3.81 0.62 0.00 -0.92 -0.99 105.19 109.17 1zjz n GLY 30 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1zjz n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zjz s ALA 31 N -2.00 2.93 0.08 4.61 0.00 -0.51 -4.09 121.76 122.79 1zjz s ALA 31 Ca 0.00 0.41 -0.16 0.00 0.00 0.00 0.00 51.96 52.21 1zjz s ALA 31 Cb 0.00 -3.19 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 1zjz s ALA 31 CO 0.00 -0.30 0.51 0.15 0.00 0.00 0.00 175.76 176.12 1zjz s LYS 32 N -3.62 4.02 -0.02 0.00 -0.14 -0.50 -4.13 119.74 115.35 1zjz s LYS 32 Ca 0.63 0.52 0.02 0.00 -1.36 0.00 0.00 55.97 55.78 1zjz s LYS 32 Cb -0.13 -3.10 0.01 0.00 -1.68 0.00 0.00 37.83 32.93 1zjz s LYS 32 CO 0.25 0.58 -0.05 0.08 -0.76 0.00 0.00 175.35 175.45 1zjz s VAL 33 N -1.26 0.49 -0.24 3.17 1.01 -0.42 -0.40 120.40 122.75 1zjz s VAL 33 Ca 0.31 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1zjz s VAL 33 Cb -0.17 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.75 1zjz s VAL 33 CO 0.18 0.17 -0.03 -0.32 0.00 0.00 0.00 175.10 175.10 1zjz s MET 34 N 0.35 3.23 0.03 2.72 1.75 0.25 -1.31 119.30 126.32 1zjz s MET 34 Ca -0.04 -0.73 -0.03 0.00 -1.25 0.00 0.00 55.69 53.65 1zjz s MET 34 Cb -0.08 -3.05 -0.04 0.00 2.84 0.00 0.00 34.83 34.50 1zjz s MET 34 CO -0.00 -0.27 0.22 0.96 -0.65 0.00 0.00 175.02 175.28 1zjz s ILE 35 N 1.45 5.38 0.20 10.11 -4.36 -0.24 -1.03 121.20 132.71 1zjz s ILE 35 Ca 0.04 -0.17 0.08 0.00 -0.26 0.00 0.00 60.65 60.35 1zjz s ILE 35 Cb -0.15 -3.58 -0.05 0.00 1.25 0.00 0.00 42.46 39.93 1zjz s ILE 35 CO -0.03 0.25 -0.15 0.42 0.24 0.00 0.00 174.94 175.67 1zjz s THR 36 N -1.41 1.78 -0.09 8.37 -4.23 -0.78 -1.17 115.64 118.11 1zjz s THR 36 Ca 0.31 -2.18 -0.30 0.00 -1.18 0.00 0.00 61.69 58.33 1zjz s THR 36 Cb -0.13 -2.03 0.09 0.00 1.34 0.00 0.00 72.50 71.78 1zjz s THR 36 CO 0.22 -0.55 0.81 -0.62 -0.54 0.00 0.00 174.62 173.94 1zjz s ASP 37 N -3.24 -0.54 0.45 3.99 2.15 -1.23 -1.38 116.67 116.88 1zjz s ASP 37 Ca 0.22 0.57 0.20 0.00 0.43 0.00 0.00 52.55 53.96 1zjz s ASP 37 Cb -0.02 0.44 1.09 0.00 -0.30 0.00 0.00 42.92 44.13 1zjz s ASP 37 CO 0.07 -0.51 1.96 0.08 -0.17 0.00 0.00 175.17 176.60 1zjz h ARG 38 N 2.79 0.00 -6.33 4.34 0.11 -1.80 -1.54 114.38 111.94 1zjz h ARG 38 Ca -0.24 0.00 -0.45 0.00 0.10 0.00 0.00 59.98 59.39 1zjz h ARG 38 Cb 1.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1zjz h ARG 38 CO 0.36 0.22 -0.33 -1.01 0.10 0.00 0.00 179.97 179.30 1zjz s HIS 39 N -4.25 3.28 -0.03 4.08 3.76 -1.26 -4.59 115.29 116.29 1zjz s HIS 39 Ca -0.03 -0.05 0.14 0.00 -0.15 0.00 0.00 55.06 54.98 1zjz s HIS 39 Cb 0.14 -1.87 -0.22 0.00 1.11 0.00 0.00 32.58 31.74 1zjz s HIS 39 CO 0.66 0.12 0.29 -1.13 -0.85 0.00 0.00 174.74 173.83 1zjz n SER 40 N -1.62 1.74 0.12 1.40 3.41 -1.26 -4.58 113.62 112.83 1zjz n SER 40 Ca -0.04 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.65 1zjz n SER 40 Cb 0.57 1.59 0.42 0.00 -0.26 0.00 0.00 64.21 66.53 1zjz n SER 40 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1zjz n ASP 41 N -2.04 0.40 0.00 4.04 5.75 -1.26 -1.53 116.55 121.91 1zjz n ASP 41 Ca -0.04 0.66 0.00 0.00 -0.01 0.00 0.00 54.79 55.40 1zjz n ASP 41 Cb 0.42 -0.70 0.00 0.00 -1.03 0.00 0.00 41.12 39.80 1zjz n ASP 41 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1zjz n VAL 42 N -2.04 0.82 -0.07 2.12 0.31 -1.26 -4.77 118.33 113.44 1zjz n VAL 42 Ca -0.01 -0.83 -0.07 0.00 -0.01 0.00 0.00 64.34 63.41 1zjz n VAL 42 Cb 0.07 0.59 -0.02 0.00 -0.91 0.00 0.00 33.84 33.57 1zjz n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1zjz n GLY 43 N -0.41 -0.47 0.27 2.92 0.00 -0.58 -3.55 105.19 103.37 1zjz n GLY 43 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 1zjz n GLY 43 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1zjz h GLU 44 N -0.83 0.84 0.07 1.61 9.09 -1.89 0.94 114.58 124.42 1zjz h GLU 44 Ca 0.00 -0.05 -0.00 0.00 0.05 0.00 0.00 59.36 59.36 1zjz h GLU 44 Cb 0.83 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.74 1zjz h GLU 44 CO 0.00 0.56 -0.04 -0.22 0.05 0.00 0.00 179.01 179.36 1zjz h LYS 45 N 0.87 -0.10 -0.21 1.06 3.64 -1.86 2.01 116.57 121.98 1zjz h LYS 45 Ca 0.28 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1zjz h LYS 45 Cb 0.00 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1zjz h LYS 45 CO -0.10 -0.07 0.05 0.00 -2.27 0.00 0.00 179.45 177.06 1zjz h ALA 46 N 0.83 0.28 -0.31 5.00 0.00 -1.54 1.54 119.26 125.06 1zjz h ALA 46 Ca -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1zjz h ALA 46 Cb 0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1zjz h ALA 46 CO 0.02 -0.07 0.10 0.00 0.00 0.00 0.00 179.25 179.30 1zjz h ALA 47 N 0.86 0.35 -0.19 0.00 0.00 0.11 -1.40 119.26 119.01 1zjz h ALA 47 Ca 0.07 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1zjz h ALA 47 Cb 0.28 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1zjz h ALA 47 CO 0.00 -0.30 0.01 -0.22 0.00 0.00 0.00 179.25 178.74 1zjz h LYS 48 N 0.23 0.26 0.00 0.00 1.63 0.39 -1.27 116.57 117.82 1zjz h LYS 48 Ca 0.14 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1zjz h LYS 48 Cb 0.12 -0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 31.70 1zjz h LYS 48 CO -0.15 0.28 -0.12 0.66 -3.45 0.00 0.00 179.45 176.67 1zjz h SER 49 N 0.26 0.00 0.08 4.20 4.64 0.33 -3.19 113.55 119.87 1zjz h SER 49 Ca 0.06 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.02 1zjz h SER 49 Cb 0.17 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.22 1zjz h SER 49 CO 0.00 0.12 -2.09 0.52 -0.87 0.00 0.00 176.83 174.51 1zjz n VAL 50 N -3.32 1.68 -3.78 0.95 0.31 -0.54 -5.06 118.33 108.56 1zjz n VAL 50 Ca -0.00 -0.57 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1zjz n VAL 50 Cb 0.34 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 1zjz n VAL 50 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1zjz n GLY 51 N 1.99 0.73 3.87 2.92 0.00 -0.81 -5.04 105.19 108.84 1zjz n GLY 51 Ca -0.37 -0.87 -0.31 0.00 0.00 0.00 0.00 46.02 44.47 1zjz n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zjz s THR 52 N -2.22 4.81 0.42 2.61 -4.23 -1.26 -4.25 115.64 111.53 1zjz s THR 52 Ca 0.03 0.63 0.27 0.00 -1.18 0.00 0.00 61.69 61.44 1zjz s THR 52 Cb -0.00 -3.66 0.27 0.00 1.34 0.00 0.00 72.50 70.45 1zjz s THR 52 CO 0.00 -0.26 1.80 -0.65 -0.54 0.00 0.00 174.62 174.97 1zjz h PRO 53 N 1.99 0.00 0.00 3.99 0.11 -1.94 0.60 132.00 136.76 1zjz h PRO 53 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1zjz h PRO 53 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1zjz h PRO 53 CO 0.66 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.20 1zjz n ASP 54 N -2.64 0.39 -0.05 -2.05 8.00 -1.26 -3.87 116.55 115.07 1zjz n ASP 54 Ca -0.02 0.54 -0.05 0.00 0.71 0.00 0.00 54.79 55.98 1zjz n ASP 54 Cb 0.29 -0.64 -0.07 0.00 -0.02 0.00 0.00 41.12 40.67 1zjz n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1zjz n GLN 55 N -1.87 2.34 -3.69 -1.24 6.02 0.20 -4.97 117.38 114.17 1zjz n GLN 55 Ca 0.06 -0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.93 1zjz n GLN 55 Cb 0.36 -1.24 -0.09 0.00 1.02 0.00 0.00 30.24 30.28 1zjz n GLN 55 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 1zjz s ILE 56 N -2.23 -0.01 0.24 5.09 2.07 -0.31 -1.30 121.20 124.76 1zjz s ILE 56 Ca -0.05 0.03 0.02 0.00 -1.41 0.00 0.00 60.65 59.24 1zjz s ILE 56 Cb 0.03 -0.73 -0.05 0.00 0.13 0.00 0.00 42.46 41.83 1zjz s ILE 56 CO 0.38 0.01 0.06 -1.10 -1.91 0.00 0.00 174.94 172.38 1zjz s GLN 57 N 0.87 1.36 -0.02 3.50 -0.21 -0.43 -3.85 119.66 120.88 1zjz s GLN 57 Ca -0.05 -1.72 0.05 0.00 0.02 0.00 0.00 55.36 53.66 1zjz s GLN 57 Cb -0.05 -0.37 -0.03 0.00 1.00 0.00 0.00 33.01 33.55 1zjz s GLN 57 CO -0.07 -0.22 -0.15 0.12 -2.12 0.00 0.00 175.29 172.85 1zjz s PHE 58 N -3.64 2.67 -0.07 0.91 5.36 -1.26 -1.08 117.98 120.87 1zjz s PHE 58 Ca 0.33 -0.18 -0.01 0.00 -0.96 0.00 0.00 56.93 56.11 1zjz s PHE 58 Cb 0.07 -1.58 0.03 0.00 -0.34 0.00 0.00 43.02 41.20 1zjz s PHE 58 CO 0.11 0.21 -0.00 0.12 -1.46 0.00 0.00 175.22 174.20 1zjz s PHE 59 N -0.80 0.70 -0.11 10.12 5.36 -0.32 -4.94 117.98 127.99 1zjz s PHE 59 Ca 0.13 -0.19 -0.30 0.00 -0.96 0.00 0.00 56.93 55.61 1zjz s PHE 59 Cb -0.11 -0.81 -0.02 0.00 -0.34 0.00 0.00 43.02 41.74 1zjz s PHE 59 CO 0.02 -0.33 1.21 -1.14 -1.46 0.00 0.00 175.22 173.52 1zjz s GLN 60 N 1.92 4.30 -0.27 10.12 0.74 -1.26 -3.57 119.66 131.65 1zjz s GLN 60 Ca 0.04 1.64 -0.23 0.00 0.05 0.00 0.00 55.36 56.87 1zjz s GLN 60 Cb -0.12 -3.65 0.07 0.00 1.10 0.00 0.00 33.01 30.41 1zjz s GLN 60 CO -0.05 -0.56 0.71 -1.58 -0.55 0.00 0.00 175.29 173.25 1zjz s HIS 61 N 2.80 -0.85 -0.26 1.67 2.46 -0.58 -4.93 115.29 115.60 1zjz s HIS 61 Ca 0.55 1.96 -0.13 0.00 0.47 0.00 0.00 55.06 57.91 1zjz s HIS 61 Cb -0.23 0.35 -0.04 0.00 -0.13 0.00 0.00 32.58 32.53 1zjz s HIS 61 CO 0.18 -0.41 0.27 0.34 -2.47 0.00 0.00 174.74 172.64 1zjz s ASP 62 N 0.68 6.17 0.49 9.88 3.68 -1.26 -2.21 116.67 134.09 1zjz s ASP 62 Ca -0.02 0.18 0.33 0.00 2.13 0.00 0.00 52.55 55.16 1zjz s ASP 62 Cb -0.05 -2.16 1.73 0.00 -1.45 0.00 0.00 42.92 40.99 1zjz s ASP 62 CO -0.04 -0.07 2.01 0.77 0.13 0.00 0.00 175.17 177.97 1zjz h SER 63 N 7.99 0.00 0.84 -0.34 4.64 -1.94 0.14 113.55 124.88 1zjz h SER 63 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1zjz h SER 63 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1zjz h SER 63 CO 0.62 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.04 1zjz n SER 64 N -2.69 0.03 -4.45 4.97 3.41 -1.26 -4.09 113.62 109.55 1zjz n SER 64 Ca -0.02 0.50 -0.43 0.00 -0.26 0.00 0.00 58.87 58.67 1zjz n SER 64 Cb 0.09 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.49 1zjz n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1zjz s ASP 65 N -3.06 6.18 0.11 4.04 2.15 0.04 -4.85 116.67 121.27 1zjz s ASP 65 Ca 0.11 -1.01 -0.22 0.00 0.43 0.00 0.00 52.55 51.86 1zjz s ASP 65 Cb 0.15 -2.41 -0.10 0.00 -0.30 0.00 0.00 42.92 40.27 1zjz s ASP 65 CO 0.44 -1.40 1.72 -0.08 -0.17 0.00 0.00 175.17 175.68 1zjz h GLU 66 N 9.52 -0.03 -0.29 4.34 4.81 -1.86 -2.71 114.58 128.36 1zjz h GLU 66 Ca -0.29 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.88 1zjz h GLU 66 Cb 1.07 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 1zjz h GLU 66 CO 1.17 -0.02 -0.09 0.22 -0.73 0.00 0.00 179.01 179.56 1zjz h ASP 67 N -0.03 0.44 0.30 1.04 -0.00 -1.97 -2.14 116.42 114.06 1zjz h ASP 67 Ca 0.04 -0.10 0.00 0.00 -0.00 0.00 0.00 57.03 56.97 1zjz h ASP 67 Cb 0.09 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 39.30 1zjz h ASP 67 CO -0.09 0.58 0.00 1.23 -0.00 0.00 0.00 179.24 180.96 1zjz h GLY 68 N 0.87 0.00 1.02 -0.78 0.00 -1.85 -3.06 103.07 99.28 1zjz h GLY 68 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.31 1zjz h GLY 68 CO 0.02 0.00 -0.16 1.49 0.00 0.00 0.00 176.54 177.89 1zjz h TRP 69 N 0.00 0.96 -0.45 5.60 4.06 -1.34 -0.35 115.95 124.43 1zjz h TRP 69 Ca 0.00 -0.23 -0.10 0.00 2.06 0.00 0.00 58.89 60.63 1zjz h TRP 69 Cb 0.15 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.06 1zjz h TRP 69 CO 0.00 0.99 -0.11 1.79 -3.56 0.00 0.00 178.44 177.55 1zjz h THR 70 N 0.66 1.26 -0.37 1.49 1.35 -1.71 -1.27 112.91 114.32 1zjz h THR 70 Ca 0.10 -1.19 -0.11 0.00 -0.55 0.00 0.00 66.41 64.66 1zjz h THR 70 Cb 0.71 1.03 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 1zjz h THR 70 CO 0.05 0.41 -0.22 0.11 -0.25 0.00 0.00 175.52 175.62 1zjz h LYS 71 N 0.74 0.73 -0.07 4.72 1.57 -1.61 0.30 116.57 122.94 1zjz h LYS 71 Ca 0.12 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1zjz h LYS 71 Cb 0.60 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.87 1zjz h LYS 71 CO 0.04 0.89 0.04 1.25 -0.57 0.00 0.00 179.45 181.10 1zjz h LEU 72 N 0.64 0.09 -0.78 2.94 5.85 -0.82 -0.08 115.31 123.15 1zjz h LEU 72 Ca 0.09 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1zjz h LEU 72 Cb 0.72 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.69 1zjz h LEU 72 CO 0.06 0.16 0.43 -0.26 -0.34 0.00 0.00 178.44 178.48 1zjz h PHE 73 N 0.02 1.07 -0.60 1.25 -1.00 -1.02 -1.32 116.94 115.34 1zjz h PHE 73 Ca 0.03 -0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 1zjz h PHE 73 Cb 0.08 -0.34 -0.03 0.00 3.61 0.00 0.00 35.95 39.28 1zjz h PHE 73 CO -0.04 0.75 0.21 -0.44 -1.61 0.00 0.00 178.31 177.17 1zjz h ASP 74 N 1.08 0.85 -0.67 2.17 3.32 -0.26 -0.38 116.42 122.54 1zjz h ASP 74 Ca 0.27 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 1zjz h ASP 74 Cb 0.03 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1zjz h ASP 74 CO -0.04 0.82 0.16 0.00 -1.72 0.00 0.00 179.24 178.46 1zjz h ALA 75 N 1.07 1.00 -0.39 3.45 0.00 -0.82 -0.95 119.26 122.63 1zjz h ALA 75 Ca 0.20 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1zjz h ALA 75 Cb 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1zjz h ALA 75 CO -0.01 0.65 -0.12 1.15 0.00 0.00 0.00 179.25 180.92 1zjz h THR 76 N 1.03 1.28 -0.79 0.00 2.02 -0.98 -1.92 112.91 113.55 1zjz h THR 76 Ca 0.22 -1.22 -0.05 0.00 0.77 0.00 0.00 66.41 66.12 1zjz h THR 76 Cb 0.36 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1zjz h THR 76 CO 0.00 0.41 0.31 -0.08 0.37 0.00 0.00 175.52 176.53 1zjz h GLU 77 N 0.57 1.18 -0.33 6.66 4.81 -0.89 -0.47 114.58 126.11 1zjz h GLU 77 Ca 0.09 -0.22 -0.08 0.00 -0.13 0.00 0.00 59.36 59.02 1zjz h GLU 77 Cb 0.65 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1zjz h GLU 77 CO 0.04 0.96 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.92 1zjz h LYS 78 N 1.15 0.59 -0.09 1.92 3.64 -1.02 -0.17 116.57 122.59 1zjz h LYS 78 Ca 0.26 -0.19 -0.16 0.00 -1.27 0.00 0.00 60.65 59.29 1zjz h LYS 78 Cb 0.23 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1zjz h LYS 78 CO -0.02 0.72 -0.57 0.00 -2.27 0.00 0.00 179.45 177.30 1zjz h ALA 79 N 1.31 0.19 0.00 5.00 0.00 -0.95 -3.42 119.26 121.38 1zjz h ALA 79 Ca 0.09 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1zjz h ALA 79 Cb 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1zjz h ALA 79 CO 0.04 0.43 0.00 1.19 0.00 0.00 0.00 179.25 180.90 1zjz n PHE 80 N -4.18 0.00 0.00 0.00 0.99 -0.22 -5.09 117.46 108.96 1zjz n PHE 80 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1zjz n PHE 80 Cb 0.64 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.12 1zjz n PHE 80 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1zjz n GLY 81 N 0.28 -0.30 3.65 1.37 0.00 -0.08 -4.98 105.19 105.13 1zjz n GLY 81 Ca 0.00 -1.85 -0.45 0.00 0.00 0.00 0.00 46.02 43.71 1zjz n GLY 81 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1zjz n PRO 82 N -0.39 1.86 -2.35 1.61 -0.02 -1.26 -4.04 135.00 130.41 1zjz n PRO 82 Ca 0.00 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.73 1zjz n PRO 82 Cb 0.00 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.17 1zjz n PRO 82 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1zjz s VAL 83 N -0.19 3.53 -0.07 -1.45 1.01 -1.26 -4.60 120.40 117.37 1zjz s VAL 83 Ca 0.68 1.27 0.11 0.00 0.00 0.00 0.00 61.98 64.04 1zjz s VAL 83 Cb -0.68 -3.81 -0.17 0.00 0.00 0.00 0.00 36.38 31.72 1zjz s VAL 83 CO 0.51 0.20 0.27 -1.54 0.00 0.00 0.00 175.10 174.54 1zjz n SER 84 N 2.57 2.22 -3.75 3.32 3.41 -0.03 -4.65 113.62 116.72 1zjz n SER 84 Ca 0.05 -0.09 -0.13 0.00 -0.26 0.00 0.00 58.87 58.44 1zjz n SER 84 Cb 0.44 1.45 -0.13 0.00 -0.26 0.00 0.00 64.21 65.71 1zjz n SER 84 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1zjz s THR 85 N -2.69 -0.04 -0.08 6.66 2.01 -0.68 -1.60 115.64 119.23 1zjz s THR 85 Ca -0.03 0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.12 1zjz s THR 85 Cb 0.07 -0.31 0.02 0.00 0.01 0.00 0.00 72.50 72.29 1zjz s THR 85 CO 0.46 0.05 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.12 1zjz s LEU 86 N 1.03 1.50 -0.33 4.42 2.96 -0.50 -1.19 118.68 126.56 1zjz s LEU 86 Ca -0.08 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1zjz s LEU 86 Cb -0.09 -0.82 0.06 0.00 0.50 0.00 0.00 46.19 45.84 1zjz s LEU 86 CO -0.06 -0.02 0.06 -0.69 -1.32 0.00 0.00 176.35 174.32 1zjz s VAL 87 N 0.98 3.16 -1.01 1.68 1.01 0.36 -0.44 120.40 126.14 1zjz s VAL 87 Ca -0.09 -1.50 -0.20 0.00 0.00 0.00 0.00 61.98 60.20 1zjz s VAL 87 Cb -0.15 -2.90 0.10 0.00 0.00 0.00 0.00 36.38 33.43 1zjz s VAL 87 CO -0.00 -0.25 1.32 0.20 0.00 0.00 0.00 175.10 176.37 1zjz s ASN 88 N 1.39 6.62 -0.04 3.32 0.01 -0.21 -1.65 114.94 124.37 1zjz s ASN 88 Ca -0.02 -1.89 0.13 0.00 -0.71 0.00 0.00 52.86 50.37 1zjz s ASN 88 Cb -0.20 -2.48 -0.19 0.00 0.41 0.00 0.00 41.25 38.78 1zjz s ASN 88 CO -0.01 -1.23 0.23 -3.20 -1.51 0.00 0.00 177.10 171.38 1zjz n ASN 89 N 7.57 1.96 -4.75 -1.22 2.85 -1.24 -1.09 115.26 119.34 1zjz n ASN 89 Ca 0.30 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 54.36 1zjz n ASN 89 Cb 0.49 1.42 -0.01 0.00 1.24 0.00 0.00 39.78 42.92 1zjz n ASN 89 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1zjz n ALA 90 N -2.08 2.43 -3.51 5.20 0.00 -1.08 -4.84 120.51 116.63 1zjz n ALA 90 Ca -0.07 0.36 -0.09 0.00 0.00 0.00 0.00 53.44 53.65 1zjz n ALA 90 Cb 0.48 -2.44 -0.02 0.00 0.00 0.00 0.00 19.45 17.46 1zjz n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1zjz s GLY 91 N 0.27 -0.45 0.21 0.00 0.00 -1.26 -4.69 107.32 101.40 1zjz s GLY 91 Ca 0.60 1.09 0.03 0.00 0.00 0.00 0.00 44.72 46.45 1zjz s GLY 91 CO 0.54 0.39 0.00 -0.26 0.00 0.00 0.00 173.10 173.77 1zjz s ILE 92 N -2.95 0.92 0.03 0.90 -4.36 -1.26 -5.05 121.20 109.42 1zjz s ILE 92 Ca 0.04 -2.02 0.05 0.00 -0.26 0.00 0.00 60.65 58.46 1zjz s ILE 92 Cb -0.01 -2.29 -0.02 0.00 1.25 0.00 0.00 42.46 41.39 1zjz s ILE 92 CO -0.08 -0.36 -0.13 0.00 0.24 0.00 0.00 174.94 174.61 1zjz s ALA 93 N -3.50 1.11 -0.16 2.27 0.00 -1.26 -4.92 121.76 115.30 1zjz s ALA 93 Ca 0.27 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.43 1zjz s ALA 93 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1zjz s ALA 93 CO 0.07 0.21 -0.05 0.08 0.00 0.00 0.00 175.76 176.07 1zjz s VAL 94 N -0.79 3.70 -1.21 0.00 1.01 -1.26 -5.07 120.40 116.78 1zjz s VAL 94 Ca 0.01 -0.42 -0.13 0.00 0.00 0.00 0.00 61.98 61.44 1zjz s VAL 94 Cb -0.07 -2.62 0.18 0.00 0.00 0.00 0.00 36.38 33.87 1zjz s VAL 94 CO 0.01 0.49 1.45 -3.20 0.00 0.00 0.00 175.10 173.85 1zjz n ASN 95 N 3.66 5.24 -3.60 3.32 4.05 -1.26 -4.58 115.26 122.09 1zjz n ASN 95 Ca -0.18 -2.99 -0.16 0.00 0.45 0.00 0.00 54.58 51.71 1zjz n ASN 95 Cb 0.52 -1.56 -0.07 0.00 1.23 0.00 0.00 39.78 39.91 1zjz n ASN 95 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1zjz s LYS 96 N 1.34 0.90 0.89 1.20 -0.14 -0.41 -5.00 119.74 118.53 1zjz s LYS 96 Ca 0.42 0.60 -0.11 0.00 -1.36 0.00 0.00 55.97 55.52 1zjz s LYS 96 Cb -0.02 0.43 0.13 0.00 -1.68 0.00 0.00 37.83 36.69 1zjz s LYS 96 CO -0.00 -0.20 1.11 -1.54 -0.76 0.00 0.00 175.35 173.95 1zjz s SER 97 N -0.38 3.30 0.19 2.83 1.04 -1.25 -1.59 113.70 117.84 1zjz s SER 97 Ca -0.05 1.86 -0.13 0.00 0.48 0.00 0.00 55.95 58.11 1zjz s SER 97 Cb -0.03 -2.44 0.22 0.00 0.10 0.00 0.00 66.02 63.87 1zjz s SER 97 CO 0.05 -2.80 1.68 0.58 0.98 0.00 0.00 173.24 173.73 1zjz h VAL 98 N -1.66 0.59 -0.95 5.02 2.07 -1.91 -1.61 116.25 117.80 1zjz h VAL 98 Ca -0.47 -0.04 0.19 0.00 0.82 0.00 0.00 66.70 67.20 1zjz h VAL 98 Cb 1.27 0.45 -0.11 0.00 -1.52 0.00 0.00 31.29 31.38 1zjz h VAL 98 CO 0.48 0.02 0.54 -0.08 0.02 0.00 0.00 177.57 178.56 1zjz h GLU 99 N 0.13 0.66 -0.47 1.57 4.81 -1.93 -2.59 114.58 116.76 1zjz h GLU 99 Ca 0.27 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1zjz h GLU 99 Cb 0.42 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1zjz h GLU 99 CO -0.44 0.43 0.00 0.39 -0.73 0.00 0.00 179.01 178.66 1zjz n GLU 100 N -4.83 2.52 -2.60 1.92 -0.58 -0.80 -4.93 120.64 111.34 1zjz n GLU 100 Ca 0.22 -2.27 -0.43 0.00 -0.42 0.00 0.00 57.16 54.26 1zjz n GLU 100 Cb 0.56 -1.45 -0.02 0.00 -0.57 0.00 0.00 31.44 29.95 1zjz n GLU 100 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1zjz s THR 101 N -1.16 4.58 0.64 2.62 2.01 -0.67 -4.84 115.64 118.81 1zjz s THR 101 Ca 0.36 1.87 -0.14 0.00 0.31 0.00 0.00 61.69 64.10 1zjz s THR 101 Cb 0.20 -4.20 -0.02 0.00 0.01 0.00 0.00 72.50 68.49 1zjz s THR 101 CO 0.27 -0.04 1.06 0.42 -0.69 0.00 0.00 174.62 175.64 1zjz s THR 102 N 2.39 3.92 0.30 -0.82 -4.23 -1.26 -4.90 115.64 111.04 1zjz s THR 102 Ca 0.50 0.78 -0.00 0.00 -1.18 0.00 0.00 61.69 61.79 1zjz s THR 102 Cb -0.20 -3.39 0.20 0.00 1.34 0.00 0.00 72.50 70.45 1zjz s THR 102 CO 0.17 -0.66 1.89 0.74 -0.54 0.00 0.00 174.62 176.22 1zjz h THR 103 N -0.05 1.21 -0.60 3.99 2.02 -1.99 -0.99 112.91 116.50 1zjz h THR 103 Ca -0.45 -0.62 -0.03 0.00 0.77 0.00 0.00 66.41 66.08 1zjz h THR 103 Cb 1.21 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 1zjz h THR 103 CO 0.57 0.25 0.26 0.00 0.37 0.00 0.00 175.52 176.97 1zjz h ALA 104 N 1.43 0.78 -0.49 6.16 0.00 -1.99 -0.42 119.26 124.73 1zjz h ALA 104 Ca 0.21 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1zjz h ALA 104 Cb 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1zjz h ALA 104 CO -0.02 0.37 0.30 0.93 0.00 0.00 0.00 179.25 180.82 1zjz h GLU 105 N 0.82 0.67 0.06 0.00 5.08 -1.81 -1.35 114.58 118.06 1zjz h GLU 105 Ca 0.20 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1zjz h GLU 105 Cb 0.17 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1zjz h GLU 105 CO -0.02 0.49 -0.22 2.35 -1.00 0.00 0.00 179.01 180.61 1zjz h TRP 106 N 0.66 -0.58 -0.66 4.33 2.91 -0.88 -1.27 115.95 120.46 1zjz h TRP 106 Ca 0.18 0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.15 1zjz h TRP 106 Cb -0.01 0.25 -0.03 0.00 -0.51 0.00 0.00 29.16 28.86 1zjz h TRP 106 CO -0.03 -0.31 0.18 0.00 -1.03 0.00 0.00 178.44 177.25 1zjz h ARG 107 N -0.38 1.04 -0.20 2.65 3.08 -0.98 -1.04 114.38 118.55 1zjz h ARG 107 Ca 0.04 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 1zjz h ARG 107 Cb 0.43 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1zjz h ARG 107 CO -0.16 0.92 0.06 -0.22 -1.07 0.00 0.00 179.97 179.50 1zjz h LYS 108 N 0.97 0.32 -0.43 0.04 3.64 -1.09 -0.53 116.57 119.49 1zjz h LYS 108 Ca 0.21 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1zjz h LYS 108 Cb 0.34 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 1zjz h LYS 108 CO -0.00 0.43 0.06 1.25 -2.27 0.00 0.00 179.45 178.92 1zjz h LEU 109 N 0.15 0.68 -1.43 5.20 6.46 -1.11 -2.70 115.31 122.55 1zjz h LEU 109 Ca 0.06 -0.26 -0.04 0.00 -0.12 0.00 0.00 57.88 57.52 1zjz h LEU 109 Cb 0.25 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1zjz h LEU 109 CO -0.00 0.77 -0.08 -0.07 -0.62 0.00 0.00 178.44 178.44 1zjz h LEU 110 N 0.57 0.26 -0.69 2.25 3.38 -1.11 -0.05 115.31 119.92 1zjz h LEU 110 Ca 0.13 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1zjz h LEU 110 Cb 0.39 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1zjz h LEU 110 CO 0.01 0.37 0.45 0.00 0.09 0.00 0.00 178.44 179.37 1zjz h ALA 111 N 1.66 0.88 0.02 1.53 0.00 -0.77 0.13 119.26 122.71 1zjz h ALA 111 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zjz h ALA 111 Cb 0.31 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1zjz h ALA 111 CO 0.02 0.31 -0.01 0.28 0.00 0.00 0.00 179.25 179.85 1zjz h VAL 112 N 0.94 0.86 0.00 0.00 2.07 -1.33 -1.65 116.25 117.14 1zjz h VAL 112 Ca 0.25 -1.59 -0.09 0.00 0.82 0.00 0.00 66.70 66.09 1zjz h VAL 112 Cb -0.10 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1zjz h VAL 112 CO -0.05 0.29 -0.45 0.78 0.02 0.00 0.00 177.57 178.15 1zjz h ASN 113 N -0.99 0.00 0.00 0.57 4.21 -1.03 -3.10 115.58 115.25 1zjz h ASN 113 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1zjz h ASN 113 Cb 0.49 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.69 1zjz h ASN 113 CO 0.00 0.45 -0.19 -0.11 -1.29 0.00 0.00 177.43 176.30 1zjz n LEU 114 N -3.23 1.08 -0.23 1.61 7.94 -0.32 -4.40 117.00 119.46 1zjz n LEU 114 Ca 0.02 0.15 -0.00 0.00 -1.11 0.00 0.00 56.01 55.07 1zjz n LEU 114 Cb 0.70 -0.38 0.11 0.00 0.53 0.00 0.00 43.42 44.39 1zjz n LEU 114 CO 0.40 -0.62 1.05 0.44 -1.11 0.00 0.00 177.39 177.55 1zjz h ASP 115 N -0.19 0.43 -0.77 1.96 3.32 -0.90 -0.57 116.42 119.71 1zjz h ASP 115 Ca 0.00 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1zjz h ASP 115 Cb 0.19 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 1zjz h ASP 115 CO 0.00 0.26 0.39 1.23 -1.72 0.00 0.00 179.24 179.41 1zjz h GLY 116 N 0.58 1.16 1.16 2.75 0.00 -1.21 0.22 103.07 107.74 1zjz h GLY 116 Ca 0.32 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 1zjz h GLY 116 CO -0.24 0.53 -0.18 -2.08 0.00 0.00 0.00 176.54 174.57 1zjz h VAL 117 N 1.07 1.27 0.19 4.60 2.07 -1.56 -1.30 116.25 122.59 1zjz h VAL 117 Ca 0.27 -1.33 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1zjz h VAL 117 Cb 0.08 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1zjz h VAL 117 CO -0.04 0.46 -0.15 0.15 0.02 0.00 0.00 177.57 178.02 1zjz h PHE 118 N 0.84 -0.38 -0.53 1.57 3.57 -0.61 0.18 116.94 121.58 1zjz h PHE 118 Ca 0.12 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1zjz h PHE 118 Cb 0.74 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 1zjz h PHE 118 CO 0.05 -0.23 0.29 0.74 -2.23 0.00 0.00 178.31 176.93 1zjz h PHE 119 N -0.35 0.53 -0.36 0.41 0.05 -0.47 0.62 116.94 117.38 1zjz h PHE 119 Ca -0.01 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.74 1zjz h PHE 119 Cb 0.31 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 38.08 1zjz h PHE 119 CO -0.11 0.27 -0.00 0.78 -0.18 0.00 0.00 178.31 179.07 1zjz h GLY 120 N 0.56 0.68 0.88 -1.45 0.00 -1.15 -1.96 103.07 100.63 1zjz h GLY 120 Ca 0.23 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1zjz h GLY 120 CO -0.14 0.46 0.06 -0.84 0.00 0.00 0.00 176.54 176.08 1zjz h THR 121 N 0.44 1.17 -0.12 4.70 2.02 -0.69 0.14 112.91 120.57 1zjz h THR 121 Ca 0.10 -0.51 0.03 0.00 0.77 0.00 0.00 66.41 66.80 1zjz h THR 121 Cb 0.46 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1zjz h THR 121 CO 0.02 0.16 -0.05 -0.09 0.37 0.00 0.00 175.52 175.93 1zjz h ARG 122 N 0.12 -0.04 -0.51 6.66 2.43 -0.90 -0.92 114.38 121.22 1zjz h ARG 122 Ca 0.06 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 1zjz h ARG 122 Cb 0.19 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1zjz h ARG 122 CO -0.00 -0.02 -0.05 1.25 -1.51 0.00 0.00 179.97 179.63 1zjz h LEU 123 N -0.04 0.93 -0.62 3.80 5.85 -1.32 -2.32 115.31 121.59 1zjz h LEU 123 Ca 0.07 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.48 1zjz h LEU 123 Cb 0.14 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1zjz h LEU 123 CO -0.15 1.04 0.39 1.23 -0.34 0.00 0.00 178.44 180.61 1zjz h GLY 124 N 0.80 0.89 0.99 3.75 0.00 -0.50 -0.37 103.07 108.63 1zjz h GLY 124 Ca 0.14 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1zjz h GLY 124 CO 0.04 0.25 0.12 -2.22 0.00 0.00 0.00 176.54 174.72 1zjz h ILE 125 N 0.77 1.06 -0.14 2.60 2.04 -1.02 0.61 117.51 123.43 1zjz h ILE 125 Ca 0.25 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.99 1zjz h ILE 125 Cb 0.01 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1zjz h ILE 125 CO -0.10 0.05 0.08 1.56 0.00 0.00 0.00 178.15 179.75 1zjz h GLN 126 N 0.23 0.18 0.03 2.37 4.20 -0.84 -2.71 115.11 118.57 1zjz h GLN 126 Ca 0.06 -0.01 -0.36 0.00 0.06 0.00 0.00 58.65 58.41 1zjz h GLN 126 Cb -0.01 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.67 1zjz h GLN 126 CO -0.01 0.13 -2.18 0.54 -0.67 0.00 0.00 178.83 176.64 1zjz n ARG 127 N -4.51 0.68 0.00 1.46 5.12 -0.20 -4.58 116.66 114.63 1zjz n ARG 127 Ca -0.01 0.16 0.11 0.00 -1.93 0.00 0.00 57.85 56.18 1zjz n ARG 127 Cb 0.09 -1.62 0.02 0.00 -1.16 0.00 0.00 32.46 29.78 1zjz n ARG 127 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1zjz n MET 128 N -3.11 0.94 -1.64 5.56 0.00 0.19 -4.95 117.12 114.10 1zjz n MET 128 Ca -0.33 -0.76 -0.31 0.00 0.00 0.00 0.00 57.70 56.31 1zjz n MET 128 Cb 1.07 -1.48 0.05 0.00 0.00 0.00 0.00 33.22 32.85 1zjz n MET 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 1zjz s LYS 129 N -2.58 2.87 -1.16 3.17 -2.85 -1.03 -4.07 119.74 114.10 1zjz s LYS 129 Ca 0.17 0.82 0.00 0.00 -1.00 0.00 0.00 55.97 55.96 1zjz s LYS 129 Cb 0.18 -1.99 0.00 0.00 -2.06 0.00 0.00 37.83 33.95 1zjz s LYS 129 CO 0.62 -1.11 0.00 0.09 0.10 0.00 0.00 175.35 175.05 1zjz n ASN 130 N -3.12 -3.90 -0.20 0.03 5.03 -0.12 -4.81 115.26 108.17 1zjz n ASN 130 Ca 0.07 0.21 0.02 0.00 0.87 0.00 0.00 54.58 55.75 1zjz n ASN 130 Cb 0.54 -3.37 0.04 0.00 -1.02 0.00 0.00 39.78 35.97 1zjz n ASN 130 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1zjz n LYS 131 N -2.61 1.14 -1.79 3.52 5.02 -1.26 -5.00 118.16 117.18 1zjz n LYS 131 Ca -0.15 -1.19 -0.15 0.00 -2.02 0.00 0.00 58.31 54.80 1zjz n LYS 131 Cb 0.57 -1.09 -0.04 0.00 -0.02 0.00 0.00 35.03 34.45 1zjz n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1zjz n GLY 132 N 0.08 0.81 0.02 0.72 0.00 -1.26 -4.89 105.19 100.65 1zjz n GLY 132 Ca 0.03 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1zjz n GLY 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1zjz n LEU 133 N -1.91 0.39 -3.40 0.99 4.77 -1.26 -4.94 117.00 111.64 1zjz n LEU 133 Ca -0.16 0.23 -0.17 0.00 -0.03 0.00 0.00 56.01 55.88 1zjz n LEU 133 Cb 0.55 -0.32 0.08 0.00 -2.33 0.00 0.00 43.42 41.40 1zjz n LEU 133 CO 0.22 0.04 0.08 0.61 -1.33 0.00 0.00 177.39 177.02 1zjz n GLY 134 N 1.46 -0.55 3.79 -0.72 0.00 -1.26 -4.93 105.19 102.99 1zjz n GLY 134 Ca 0.06 0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 1zjz n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zjz s ALA 135 N -3.38 2.94 -0.12 4.61 0.00 -0.87 -4.89 121.76 120.05 1zjz s ALA 135 Ca 0.11 0.64 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 1zjz s ALA 135 Cb -0.01 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 19.90 1zjz s ALA 135 CO 0.74 -0.29 0.28 0.45 0.00 0.00 0.00 175.76 176.94 1zjz s SER 136 N -1.84 -0.16 -0.20 0.00 0.15 -0.63 -1.43 113.70 109.59 1zjz s SER 136 Ca 0.64 0.61 -0.03 0.00 0.70 0.00 0.00 55.95 57.87 1zjz s SER 136 Cb -0.18 0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 64.67 1zjz s SER 136 CO 0.22 -0.19 -0.05 -0.63 1.20 0.00 0.00 173.24 173.80 1zjz s ILE 137 N 1.58 3.42 -0.32 6.45 1.01 0.25 -1.41 121.20 132.17 1zjz s ILE 137 Ca -0.07 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 60.08 1zjz s ILE 137 Cb -0.10 -2.53 0.07 0.00 0.01 0.00 0.00 42.46 39.90 1zjz s ILE 137 CO -0.09 0.44 0.04 -0.63 0.00 0.00 0.00 174.94 174.70 1zjz s ILE 138 N 1.19 2.88 -0.43 2.92 1.01 0.41 -1.79 121.20 127.39 1zjz s ILE 138 Ca 0.02 -1.66 -0.18 0.00 0.00 0.00 0.00 60.65 58.83 1zjz s ILE 138 Cb -0.14 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 39.57 1zjz s ILE 138 CO -0.01 -0.28 0.51 0.20 0.00 0.00 0.00 174.94 175.36 1zjz s ASN 139 N 1.32 6.23 0.28 3.58 0.01 -0.33 -1.05 114.94 124.98 1zjz s ASN 139 Ca -0.01 -0.60 -0.29 0.00 -0.71 0.00 0.00 52.86 51.24 1zjz s ASN 139 Cb -0.20 -2.26 -0.10 0.00 0.41 0.00 0.00 41.25 39.10 1zjz s ASN 139 CO -0.03 -0.66 1.37 -0.04 -1.51 0.00 0.00 177.10 176.23 1zjz s MET 140 N 2.36 4.31 0.00 -0.60 -1.94 -0.25 -2.41 119.30 120.78 1zjz s MET 140 Ca 0.15 2.24 0.00 0.00 -1.71 0.00 0.00 55.69 56.37 1zjz s MET 140 Cb -0.16 -3.10 0.00 0.00 2.01 0.00 0.00 34.83 33.58 1zjz s MET 140 CO 0.15 -0.31 0.00 0.45 -0.01 0.00 0.00 175.02 175.30 1zjz n SER 141 N 1.68 0.00 -3.59 3.03 2.88 0.13 -4.88 113.62 112.86 1zjz n SER 141 Ca 0.04 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.52 1zjz n SER 141 Cb 0.41 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.85 1zjz n SER 141 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1zjz s SER 142 N 1.00 -0.27 0.57 -3.46 0.15 -1.24 -4.22 113.70 106.22 1zjz s SER 142 Ca 0.00 -0.13 0.32 0.00 0.70 0.00 0.00 55.95 56.84 1zjz s SER 142 Cb 0.00 0.39 1.45 0.00 -1.71 0.00 0.00 66.02 66.15 1zjz s SER 142 CO 0.00 -0.66 1.79 0.16 1.20 0.00 0.00 173.24 175.73 1zjz h ILE 143 N 2.00 0.36 0.00 6.45 3.07 -1.46 -0.64 117.51 127.30 1zjz h ILE 143 Ca -0.22 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.19 1zjz h ILE 143 Cb 1.23 0.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.23 1zjz h ILE 143 CO 0.28 0.00 0.00 -0.62 -1.05 0.00 0.00 178.15 176.76 1zjz n GLU 144 N -3.93 0.44 0.00 0.16 -0.58 -1.26 -1.21 120.64 114.26 1zjz n GLU 144 Ca 0.18 0.05 0.13 0.00 -0.42 0.00 0.00 57.16 57.10 1zjz n GLU 144 Cb 1.05 -1.50 0.30 0.00 -0.57 0.00 0.00 31.44 30.72 1zjz n GLU 144 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zjz n GLY 145 N 0.11 -0.63 0.13 0.62 0.00 -0.24 -4.41 105.19 100.77 1zjz n GLY 145 Ca 0.11 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 1zjz n GLY 145 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1zjz n PHE 146 N -0.71 0.00 -4.34 1.61 3.01 -0.35 -4.48 117.46 112.19 1zjz n PHE 146 Ca 0.11 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.33 1zjz n PHE 146 Cb 0.36 -0.49 -0.12 0.00 -0.01 0.00 0.00 39.48 39.22 1zjz n PHE 146 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1zjz s VAL 147 N -2.25 1.90 0.64 -4.37 -7.23 -0.83 -5.15 120.40 103.10 1zjz s VAL 147 Ca -0.17 -1.84 -0.10 0.00 -1.81 0.00 0.00 61.98 58.06 1zjz s VAL 147 Cb 0.05 -1.83 -0.01 0.00 0.56 0.00 0.00 36.38 35.15 1zjz s VAL 147 CO 0.29 -0.20 1.02 -0.83 -0.31 0.00 0.00 175.10 175.06 1zjz s GLY 148 N -2.45 1.62 -0.04 2.32 0.00 -1.26 -4.36 107.32 103.15 1zjz s GLY 148 Ca 0.14 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.55 1zjz s GLY 148 CO 0.07 -0.02 -0.02 -0.35 0.00 0.00 0.00 173.10 172.78 1zjz s ASP 149 N -4.26 0.74 0.63 1.64 -1.08 -1.26 -5.05 116.67 108.03 1zjz s ASP 149 Ca 0.55 -0.07 0.37 0.00 -0.52 0.00 0.00 52.55 52.88 1zjz s ASP 149 Cb -0.11 -0.33 2.11 0.00 -1.46 0.00 0.00 42.92 43.13 1zjz s ASP 149 CO 0.51 -0.09 2.31 1.55 0.52 0.00 0.00 175.17 179.97 1zjz h PRO 150 N 7.34 0.00 -0.31 4.34 0.13 -1.99 -2.19 132.00 139.33 1zjz h PRO 150 Ca -0.38 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 1zjz h PRO 150 Cb 1.14 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1zjz h PRO 150 CO 0.45 0.00 0.01 0.43 -0.23 0.00 0.00 178.00 178.66 1zjz n SER 151 N -3.49 3.73 -2.63 1.44 7.64 -1.26 -3.74 113.62 115.31 1zjz n SER 151 Ca -0.03 -3.15 -0.09 0.00 1.01 0.00 0.00 58.87 56.60 1zjz n SER 151 Cb 0.08 -0.57 0.03 0.00 -1.01 0.00 0.00 64.21 62.74 1zjz n SER 151 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1zjz n LEU 152 N -0.59 2.27 0.15 -3.43 4.77 -0.82 -1.28 117.00 118.07 1zjz n LEU 152 Ca 0.25 -3.74 -0.14 0.00 -0.03 0.00 0.00 56.01 52.35 1zjz n LEU 152 Cb 0.95 0.26 -0.07 0.00 -2.33 0.00 0.00 43.42 42.23 1zjz n LEU 152 CO 0.18 1.50 0.75 1.23 -1.33 0.00 0.00 177.39 179.72 1zjz h GLY 153 N 2.70 -0.40 1.17 -0.72 0.00 -1.46 0.15 103.07 104.52 1zjz h GLY 153 Ca -0.01 0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.41 1zjz h GLY 153 CO 0.45 -0.17 -0.05 0.00 0.00 0.00 0.00 176.54 176.77 1zjz h ALA 154 N 0.35 0.87 -0.34 3.60 0.00 -1.89 -1.88 119.26 119.97 1zjz h ALA 154 Ca -0.01 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.59 1zjz h ALA 154 Cb 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1zjz h ALA 154 CO -0.01 0.65 0.20 -0.92 0.00 0.00 0.00 179.25 179.17 1zjz h TYR 155 N 0.89 0.37 -0.44 0.00 3.20 -1.76 -0.86 116.97 118.37 1zjz h TYR 155 Ca 0.15 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.10 1zjz h TYR 155 Cb 0.59 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.69 1zjz h TYR 155 CO 0.04 0.21 0.14 -0.91 -1.64 0.00 0.00 178.16 176.00 1zjz h ASN 156 N 0.40 0.12 -0.34 -2.11 -0.26 -0.55 -0.37 115.58 112.48 1zjz h ASN 156 Ca 0.14 0.06 0.06 0.00 -0.56 0.00 0.00 56.30 56.00 1zjz h ASN 156 Cb 0.01 0.05 -0.06 0.00 -1.06 0.00 0.00 38.32 37.26 1zjz h ASN 156 CO -0.07 0.10 -0.01 0.00 -1.06 0.00 0.00 177.43 176.39 1zjz h ALA 157 N 1.30 0.29 -0.76 -0.83 0.00 -0.83 -0.83 119.26 117.61 1zjz h ALA 157 Ca 0.21 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1zjz h ALA 157 Cb 0.22 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1zjz h ALA 157 CO -0.23 -0.41 0.29 0.66 0.00 0.00 0.00 179.25 179.56 1zjz h SER 158 N 0.08 1.05 0.24 0.00 4.64 -0.45 -1.60 113.55 117.52 1zjz h SER 158 Ca 0.17 -0.17 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 1zjz h SER 158 Cb 0.23 -0.27 0.01 0.00 -0.31 0.00 0.00 62.40 62.06 1zjz h SER 158 CO -0.29 0.94 -0.97 0.11 -0.87 0.00 0.00 176.83 175.75 1zjz h LYS 159 N 1.10 0.49 -0.51 4.77 1.79 -0.79 -1.52 116.57 121.91 1zjz h LYS 159 Ca 0.25 -0.53 -0.05 0.00 -2.18 0.00 0.00 60.65 58.14 1zjz h LYS 159 Cb 0.23 0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 1zjz h LYS 159 CO -0.02 1.17 0.11 0.78 -1.08 0.00 0.00 179.45 180.40 1zjz h GLY 160 N 1.01 0.85 0.84 3.86 0.00 -1.08 -1.61 103.07 106.94 1zjz h GLY 160 Ca -0.09 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 1zjz h GLY 160 CO 0.17 0.46 0.01 0.00 0.00 0.00 0.00 176.54 177.19 1zjz h ALA 161 N 1.36 0.05 -0.85 3.60 0.00 -1.11 -2.63 119.26 119.67 1zjz h ALA 161 Ca 0.17 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1zjz h ALA 161 Cb 0.31 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1zjz h ALA 161 CO 0.00 -0.36 0.56 0.28 0.00 0.00 0.00 179.25 179.73 1zjz h VAL 162 N -0.11 1.17 -0.03 0.00 2.07 -1.18 0.43 116.25 118.60 1zjz h VAL 162 Ca 0.01 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.19 1zjz h VAL 162 Cb 0.17 -0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 29.87 1zjz h VAL 162 CO -0.00 0.20 -0.23 -0.09 0.02 0.00 0.00 177.57 177.47 1zjz h ARG 163 N 1.10 -0.33 0.05 1.57 2.43 -1.10 -1.36 114.38 116.73 1zjz h ARG 163 Ca 0.33 0.02 -0.28 0.00 -0.81 0.00 0.00 59.98 59.25 1zjz h ARG 163 Cb -0.04 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1zjz h ARG 163 CO -0.10 -0.22 -1.46 0.82 -1.51 0.00 0.00 179.97 177.50 1zjz h ILE 164 N -0.35 1.19 -0.96 1.20 1.08 -1.28 -3.21 117.51 115.19 1zjz h ILE 164 Ca 0.07 -2.92 0.08 0.00 -0.39 0.00 0.00 64.86 61.70 1zjz h ILE 164 Cb 0.45 2.67 -0.07 0.00 -3.07 0.00 0.00 36.82 36.79 1zjz h ILE 164 CO -0.23 0.76 0.60 0.00 -0.69 0.00 0.00 178.15 178.59 1zjz h MET 165 N 0.03 1.02 -0.34 2.37 -0.00 -0.90 -2.04 114.93 115.06 1zjz h MET 165 Ca -0.20 -0.06 -0.06 0.00 -0.00 0.00 0.00 59.70 59.38 1zjz h MET 165 Cb 1.95 -0.23 -0.02 0.00 -0.00 0.00 0.00 31.60 33.30 1zjz h MET 165 CO 0.12 0.67 -0.03 0.77 -0.00 0.00 0.00 176.91 178.45 1zjz h SER 166 N 1.05 0.52 -0.55 -0.10 0.02 -1.27 -2.03 113.55 111.18 1zjz h SER 166 Ca 0.44 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.26 1zjz h SER 166 Cb 0.28 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1zjz h SER 166 CO -0.21 0.61 0.28 0.11 -1.14 0.00 0.00 176.83 176.48 1zjz h LYS 167 N 0.52 0.79 -0.11 3.45 1.57 -1.38 0.50 116.57 121.90 1zjz h LYS 167 Ca 0.11 -0.11 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1zjz h LYS 167 Cb 0.38 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1zjz h LYS 167 CO 0.02 0.63 -0.14 1.03 -0.57 0.00 0.00 179.45 180.42 1zjz h SER 168 N 0.74 -0.44 -0.64 0.86 0.87 -1.00 -0.65 113.55 113.29 1zjz h SER 168 Ca 0.19 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.83 1zjz h SER 168 Cb 0.10 0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 1zjz h SER 168 CO -0.03 -0.19 0.37 0.00 -0.53 0.00 0.00 176.83 176.46 1zjz h ALA 169 N 0.86 0.82 -0.35 6.23 0.00 -1.20 -0.99 119.26 124.64 1zjz h ALA 169 Ca 0.09 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1zjz h ALA 169 Cb 0.31 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1zjz h ALA 169 CO -0.22 0.31 0.06 0.00 0.00 0.00 0.00 179.25 179.39 1zjz h ALA 170 N 1.19 0.36 -0.24 0.00 0.00 -0.61 -0.93 119.26 119.04 1zjz h ALA 170 Ca 0.23 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1zjz h ALA 170 Cb -0.00 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1zjz h ALA 170 CO -0.04 -0.35 0.07 -0.07 0.00 0.00 0.00 179.25 178.86 1zjz h LEU 171 N 0.17 0.35 -0.56 0.00 3.38 -0.78 -0.88 115.31 116.99 1zjz h LEU 171 Ca 0.17 -0.21 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1zjz h LEU 171 Cb 0.20 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1zjz h LEU 171 CO -0.23 0.47 0.33 -0.78 0.09 0.00 0.00 178.44 178.32 1zjz h ASP 172 N 0.21 0.52 0.00 -0.43 3.58 -0.92 0.51 116.42 119.90 1zjz h ASP 172 Ca 0.08 0.01 -0.11 0.00 0.42 0.00 0.00 57.03 57.43 1zjz h ASP 172 Cb 0.25 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 1zjz h ASP 172 CO -0.00 0.36 -0.33 0.00 -2.88 0.00 0.00 179.24 176.39 1zjz h ALA 174 N 1.25 0.14 -0.22 0.00 0.00 -0.70 -0.60 119.26 119.13 1zjz h ALA 174 Ca 0.05 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1zjz h ALA 174 Cb 0.77 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1zjz h ALA 174 CO 0.06 0.01 -0.09 -0.07 0.00 0.00 0.00 179.25 179.17 1zjz h LEU 175 N -0.19 0.33 -1.50 0.00 3.38 -0.82 -2.35 115.31 114.16 1zjz h LEU 175 Ca 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1zjz h LEU 175 Cb 0.68 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1zjz h LEU 175 CO 0.03 0.46 0.00 0.29 0.09 0.00 0.00 178.44 179.31 1zjz n LYS 176 N -4.27 1.98 -3.71 1.13 5.02 -0.53 -4.96 118.16 112.82 1zjz n LYS 176 Ca 0.00 -1.48 -0.25 0.00 -2.02 0.00 0.00 58.31 54.55 1zjz n LYS 176 Cb 0.26 -1.42 0.06 0.00 -0.02 0.00 0.00 35.03 33.90 1zjz n LYS 176 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1zjz n ASP 177 N 0.71 -4.68 0.08 4.39 8.00 -0.89 -4.89 116.55 119.27 1zjz n ASP 177 Ca 0.17 -0.67 0.13 0.00 0.71 0.00 0.00 54.79 55.12 1zjz n ASP 177 Cb 0.42 -4.50 0.46 0.00 -0.02 0.00 0.00 41.12 37.48 1zjz n ASP 177 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1zjz n TYR 178 N -4.71 0.61 -3.52 1.24 0.53 -0.27 -4.76 117.16 106.29 1zjz n TYR 178 Ca -0.05 0.19 -0.22 0.00 -1.02 0.00 0.00 57.90 56.80 1zjz n TYR 178 Cb 0.57 -0.81 0.08 0.00 -1.03 0.00 0.00 39.34 38.15 1zjz n TYR 178 CO 0.00 0.00 0.00 -3.47 -1.02 0.00 0.00 176.86 172.37 1zjz n ASP 179 N -2.02 -5.74 -3.88 7.72 2.03 -1.26 -0.94 116.55 112.45 1zjz n ASP 179 Ca 0.05 -0.52 -0.22 0.00 0.52 0.00 0.00 54.79 54.63 1zjz n ASP 179 Cb 0.35 -4.80 -0.17 0.00 -0.72 0.00 0.00 41.12 35.79 1zjz n ASP 179 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1zjz s VAL 180 N -3.31 0.62 0.08 5.18 1.01 -1.26 -2.06 120.40 120.67 1zjz s VAL 180 Ca 0.50 -0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.38 1zjz s VAL 180 Cb -0.22 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1zjz s VAL 180 CO 0.69 0.26 0.12 -0.13 0.00 0.00 0.00 175.10 176.04 1zjz s ARG 181 N 1.20 3.03 -0.06 2.72 0.52 -0.52 -4.48 118.95 121.36 1zjz s ARG 181 Ca -0.06 -0.64 0.00 0.00 -0.52 0.00 0.00 55.73 54.50 1zjz s ARG 181 Cb -0.14 -2.80 0.02 0.00 0.52 0.00 0.00 34.95 32.55 1zjz s ARG 181 CO -0.02 0.57 -0.03 0.08 0.02 0.00 0.00 175.30 175.93 1zjz s VAL 182 N -1.46 0.48 0.09 3.52 1.01 -1.26 -0.58 120.40 122.21 1zjz s VAL 182 Ca 0.31 -0.03 -0.02 0.00 0.00 0.00 0.00 61.98 62.24 1zjz s VAL 182 Cb -0.12 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.66 1zjz s VAL 182 CO 0.24 0.24 0.04 0.20 0.00 0.00 0.00 175.10 175.82 1zjz s ASN 183 N 1.37 0.36 0.08 3.32 0.01 -0.74 -0.39 114.94 118.96 1zjz s ASN 183 Ca -0.04 -1.05 0.08 0.00 -0.71 0.00 0.00 52.86 51.14 1zjz s ASN 183 Cb -0.13 0.27 -0.04 0.00 0.41 0.00 0.00 41.25 41.76 1zjz s ASN 183 CO -0.03 -0.68 -0.18 0.42 -1.51 0.00 0.00 177.10 175.13 1zjz s THR 184 N -3.97 2.85 -0.06 1.60 -4.23 -0.46 -1.19 115.64 110.19 1zjz s THR 184 Ca 0.14 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.34 1zjz s THR 184 Cb 0.07 -2.27 -0.02 0.00 1.34 0.00 0.00 72.50 71.63 1zjz s THR 184 CO -0.05 0.20 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.36 1zjz s VAL 185 N -1.06 2.65 -0.52 2.29 1.01 -1.01 -0.66 120.40 123.10 1zjz s VAL 185 Ca 0.17 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1zjz s VAL 185 Cb -0.11 -2.02 0.15 0.00 0.00 0.00 0.00 36.38 34.41 1zjz s VAL 185 CO 0.08 0.57 0.33 -1.00 0.00 0.00 0.00 175.10 175.08 1zjz s HIS 186 N -0.39 2.44 0.41 5.22 3.76 0.41 0.20 115.29 127.34 1zjz s HIS 186 Ca 0.04 -2.77 -0.25 0.00 -0.15 0.00 0.00 55.06 51.93 1zjz s HIS 186 Cb -0.12 -2.09 -0.08 0.00 1.11 0.00 0.00 32.58 31.40 1zjz s HIS 186 CO 0.02 -0.72 1.22 -2.14 -0.85 0.00 0.00 174.74 172.27 1zjz s PRO 187 N -0.28 3.99 0.00 8.40 0.02 -1.26 -2.05 135.00 143.83 1zjz s PRO 187 Ca 0.22 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1zjz s PRO 187 Cb -0.15 -2.69 0.00 0.00 0.02 0.00 0.00 34.50 31.69 1zjz s PRO 187 CO -0.08 -0.40 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 1zjz n GLY 188 N 0.65 -0.87 3.75 0.52 0.00 -0.23 -1.54 105.19 107.46 1zjz n GLY 188 Ca 0.04 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1zjz n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1zjz s TYR 189 N -0.16 2.97 -0.06 1.61 4.12 -1.26 -4.93 117.35 119.64 1zjz s TYR 189 Ca 0.00 0.98 0.01 0.00 0.02 0.00 0.00 57.07 58.08 1zjz s TYR 189 Cb 0.00 -3.86 0.02 0.00 -1.52 0.00 0.00 41.96 36.60 1zjz s TYR 189 CO 0.00 -2.83 -0.05 0.42 0.02 0.00 0.00 175.55 173.11 1zjz s ILE 190 N -0.00 0.69 0.06 2.71 -1.09 -1.26 -0.83 121.20 121.48 1zjz s ILE 190 Ca 0.60 -0.17 -0.31 0.00 -2.23 0.00 0.00 60.65 58.55 1zjz s ILE 190 Cb -0.43 -0.72 -0.06 0.00 -1.58 0.00 0.00 42.46 39.67 1zjz s ILE 190 CO 0.44 0.28 1.26 -0.75 -1.23 0.00 0.00 174.94 174.94 1zjz s LYS 191 N 1.19 4.38 0.19 2.79 2.20 0.20 -4.87 119.74 125.84 1zjz s LYS 191 Ca -0.06 1.85 -0.05 0.00 -0.36 0.00 0.00 55.97 57.35 1zjz s LYS 191 Cb -0.14 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1zjz s LYS 191 CO -0.02 -0.35 0.21 0.95 -0.36 0.00 0.00 175.35 175.79 1zjz s THR 192 N 1.32 0.03 0.39 3.43 -4.23 -1.26 -4.19 115.64 111.12 1zjz s THR 192 Ca 0.60 -1.77 0.13 0.00 -1.18 0.00 0.00 61.69 59.47 1zjz s THR 192 Cb -0.31 -2.27 0.35 0.00 1.34 0.00 0.00 72.50 71.60 1zjz s THR 192 CO 0.28 -0.11 1.87 -0.65 -0.54 0.00 0.00 174.62 175.47 1zjz h PRO 193 N 2.57 0.54 -0.27 3.99 0.11 -1.98 -0.32 132.00 136.63 1zjz h PRO 193 Ca -0.33 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.68 1zjz h PRO 193 Cb 1.24 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1zjz h PRO 193 CO 0.50 0.35 -0.12 -0.07 -0.21 0.00 0.00 178.00 178.45 1zjz h LEU 194 N 0.55 0.43 -0.34 2.35 3.38 -1.97 -2.55 115.31 117.16 1zjz h LEU 194 Ca 0.45 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 58.19 1zjz h LEU 194 Cb 0.91 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1zjz h LEU 194 CO -0.19 0.58 -0.29 0.58 0.09 0.00 0.00 178.44 179.21 1zjz h VAL 195 N 0.42 1.29 0.00 1.22 2.07 -1.62 -3.21 116.25 116.43 1zjz h VAL 195 Ca 0.08 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 1zjz h VAL 195 Cb 0.46 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1zjz h VAL 195 CO 0.03 0.47 -0.03 0.44 0.02 0.00 0.00 177.57 178.50 1zjz h ASP 196 N 0.57 0.00 -0.02 0.57 3.32 -0.73 -0.88 116.42 119.26 1zjz h ASP 196 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1zjz h ASP 196 Cb 0.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1zjz h ASP 196 CO 0.07 0.03 -0.04 0.47 -1.72 0.00 0.00 179.24 178.05 1zjz n ASP 197 N -3.51 2.42 -4.31 6.45 8.00 -1.00 -4.69 116.55 119.92 1zjz n ASP 197 Ca -0.03 -1.78 -0.46 0.00 0.71 0.00 0.00 54.79 53.23 1zjz n ASP 197 Cb 0.13 0.04 -0.05 0.00 -0.02 0.00 0.00 41.12 41.21 1zjz n ASP 197 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1zjz s LEU 198 N -2.05 6.22 0.11 0.64 0.20 -0.33 -5.03 118.68 118.44 1zjz s LEU 198 Ca 0.30 -1.87 -0.33 0.00 0.69 0.00 0.00 54.13 52.92 1zjz s LEU 198 Cb 0.20 -2.20 -0.13 0.00 -0.43 0.00 0.00 46.19 43.63 1zjz s LEU 198 CO 0.34 -0.83 1.70 -2.65 -0.29 0.00 0.00 176.35 174.62 1zjz n PRO 199 N 5.12 2.35 -0.10 0.98 -0.02 -1.26 -2.23 135.00 139.85 1zjz n PRO 199 Ca -0.11 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1zjz n PRO 199 Cb 0.41 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 1zjz n PRO 199 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zjz n GLY 200 N 3.81 1.63 0.05 -1.23 0.00 -1.26 -4.93 105.19 103.27 1zjz n GLY 200 Ca 0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 1zjz n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zjz h ALA 201 N 0.00 -0.00 -0.51 4.61 0.00 -1.74 -1.82 119.26 119.79 1zjz h ALA 201 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1zjz h ALA 201 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1zjz h ALA 201 CO 0.00 -0.29 0.27 1.49 0.00 0.00 0.00 179.25 180.72 1zjz h GLU 202 N -0.42 0.52 -0.60 0.00 4.81 -1.83 -2.32 114.58 114.74 1zjz h GLU 202 Ca -0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1zjz h GLU 202 Cb 0.42 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1zjz h GLU 202 CO 0.00 0.35 0.40 1.49 -0.73 0.00 0.00 179.01 180.51 1zjz h GLU 203 N 0.54 0.80 -0.55 1.92 4.81 -1.92 -1.62 114.58 118.55 1zjz h GLU 203 Ca 0.22 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1zjz h GLU 203 Cb 0.10 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1zjz h GLU 203 CO -0.14 0.53 0.17 0.00 -0.73 0.00 0.00 179.01 178.85 1zjz h ALA 204 N 1.22 0.72 -0.00 2.92 0.00 -0.93 -2.46 119.26 120.73 1zjz h ALA 204 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1zjz h ALA 204 Cb -0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1zjz h ALA 204 CO -0.05 0.39 -0.02 -1.33 0.00 0.00 0.00 179.25 178.24 1zjz n MET 205 N -4.44 0.43 0.00 0.00 2.81 -0.91 -2.36 117.12 112.65 1zjz n MET 205 Ca 0.02 -0.03 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 1zjz n MET 205 Cb 0.20 -1.50 0.22 0.00 -0.71 0.00 0.00 33.22 31.44 1zjz n MET 205 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1zjz n SER 206 N -1.26 0.97 -4.75 7.83 7.64 -0.62 -2.84 113.62 120.58 1zjz n SER 206 Ca 0.14 -0.77 -0.38 0.00 1.01 0.00 0.00 58.87 58.87 1zjz n SER 206 Cb 0.25 0.33 0.03 0.00 -1.01 0.00 0.00 64.21 63.81 1zjz n SER 206 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1zjz s GLN 207 N -2.73 3.25 0.46 1.43 -1.52 -0.99 -4.03 119.66 115.52 1zjz s GLN 207 Ca 0.17 2.20 0.19 0.00 -1.95 0.00 0.00 55.36 55.97 1zjz s GLN 207 Cb 0.18 -2.31 1.12 0.00 -0.22 0.00 0.00 33.01 31.78 1zjz s GLN 207 CO 0.63 -1.09 1.99 0.00 -0.25 0.00 0.00 175.29 176.57 1zjz h ARG 208 N 1.59 0.00 0.00 2.91 2.47 -1.91 0.59 114.38 120.04 1zjz h ARG 208 Ca -0.51 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.21 1zjz h ARG 208 Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.61 1zjz h ARG 208 CO 0.58 0.19 0.00 0.25 0.56 0.00 0.00 179.97 181.55 1zjz n THR 209 N -4.01 1.02 0.00 2.04 -2.24 -1.26 -3.68 114.28 106.15 1zjz n THR 209 Ca -0.02 0.31 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 1zjz n THR 209 Cb 0.27 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 1zjz n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1zjz n LYS 210 N -1.88 0.00 -3.74 -0.78 4.76 0.05 -4.97 118.16 111.60 1zjz n LYS 210 Ca 0.02 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.08 1zjz n LYS 210 Cb 0.17 -0.24 -0.12 0.00 -1.84 0.00 0.00 35.03 33.00 1zjz n LYS 210 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1zjz s THR 211 N -0.69 3.86 0.40 -0.18 2.01 -0.31 -4.36 115.64 116.37 1zjz s THR 211 Ca 0.00 -1.08 0.16 0.00 0.31 0.00 0.00 61.69 61.08 1zjz s THR 211 Cb 0.00 -3.17 0.37 0.00 0.01 0.00 0.00 72.50 69.71 1zjz s THR 211 CO 0.00 -0.16 1.85 -0.65 -0.69 0.00 0.00 174.62 174.97 1zjz h PRO 212 N 8.24 0.45 0.00 4.92 0.11 -1.62 0.46 132.00 144.56 1zjz h PRO 212 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1zjz h PRO 212 Cb 1.09 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1zjz h PRO 212 CO 0.61 0.30 0.00 -1.33 -0.21 0.00 0.00 178.00 177.37 1zjz n MET 213 N -4.54 0.10 -1.24 1.05 2.81 -0.96 -4.87 117.12 109.46 1zjz n MET 213 Ca 0.19 0.22 -0.08 0.00 -1.81 0.00 0.00 57.70 56.22 1zjz n MET 213 Cb 0.66 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.63 1zjz n MET 213 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1zjz n GLY 214 N -0.20 0.99 3.72 3.03 0.00 0.15 -4.96 105.19 107.92 1zjz n GLY 214 Ca 0.05 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 1zjz n GLY 214 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1zjz s HIS 215 N -2.30 -0.28 0.48 1.61 -3.43 -1.26 -4.85 115.29 105.27 1zjz s HIS 215 Ca 0.00 -0.08 0.08 0.00 -0.80 0.00 0.00 55.06 54.26 1zjz s HIS 215 Cb 0.00 0.65 0.03 0.00 -1.43 0.00 0.00 32.58 31.84 1zjz s HIS 215 CO 0.00 -1.04 0.62 0.96 -2.00 0.00 0.00 174.74 173.27 1zjz s ILE 216 N -3.74 2.59 0.00 -5.38 -4.36 -1.26 -4.83 121.20 104.22 1zjz s ILE 216 Ca 0.08 -1.06 -0.00 0.00 -0.26 0.00 0.00 60.65 59.41 1zjz s ILE 216 Cb -0.04 -2.66 0.00 0.00 1.25 0.00 0.00 42.46 41.02 1zjz s ILE 216 CO 0.00 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.80 1zjz n GLY 217 N -1.95 0.46 3.07 6.27 0.00 -0.01 -4.78 105.19 108.24 1zjz n GLY 217 Ca 0.10 -1.91 -0.08 0.00 0.00 0.00 0.00 46.02 44.13 1zjz n GLY 217 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1zjz s GLU 218 N -2.49 0.55 0.35 1.61 -1.05 -1.26 0.63 118.70 117.04 1zjz s GLU 218 Ca 0.00 -1.04 0.12 0.00 -0.15 0.00 0.00 54.97 53.91 1zjz s GLU 218 Cb -0.00 0.10 0.93 0.00 -0.44 0.00 0.00 34.13 34.73 1zjz s GLU 218 CO 0.00 -0.07 1.78 -1.35 0.95 0.00 0.00 175.26 176.56 1zjz h PRO 219 N 3.62 0.54 0.00 -4.83 0.11 -1.90 0.71 132.00 130.26 1zjz h PRO 219 Ca -0.34 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.72 1zjz h PRO 219 Cb 1.17 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1zjz h PRO 219 CO 0.57 0.36 -0.09 -0.91 -0.21 0.00 0.00 178.00 177.73 1zjz h ASN 220 N 0.56 0.00 -0.98 -2.05 2.35 -1.92 -1.01 115.58 112.53 1zjz h ASN 220 Ca 0.58 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 56.40 1zjz h ASN 220 Cb 1.20 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.50 1zjz h ASN 220 CO -0.34 0.09 0.64 0.44 -1.65 0.00 0.00 177.43 176.60 1zjz h ASP 221 N 0.00 1.00 0.65 5.81 3.32 -1.27 -1.25 116.42 124.69 1zjz h ASP 221 Ca -0.00 0.01 -0.27 0.00 0.02 0.00 0.00 57.03 56.79 1zjz h ASP 221 Cb 0.23 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1zjz h ASP 221 CO 0.01 0.63 -1.24 0.40 -1.72 0.00 0.00 179.24 177.32 1zjz h ILE 222 N 1.12 1.49 -0.54 0.35 1.08 -1.34 -3.31 117.51 116.37 1zjz h ILE 222 Ca 0.43 -3.08 0.06 0.00 -0.39 0.00 0.00 64.86 61.88 1zjz h ILE 222 Cb 0.21 2.92 -0.05 0.00 -3.07 0.00 0.00 36.82 36.83 1zjz h ILE 222 CO -0.18 0.90 0.25 0.00 -0.69 0.00 0.00 178.15 178.43 1zjz h ALA 223 N 0.62 0.70 -0.34 1.87 0.00 -0.82 -2.38 119.26 118.90 1zjz h ALA 223 Ca -0.13 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1zjz h ALA 223 Cb 1.96 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 1zjz h ALA 223 CO 0.19 -0.12 -0.24 1.88 0.00 0.00 0.00 179.25 180.97 1zjz h TYR 224 N 0.47 0.75 -0.21 0.00 0.99 -1.34 -0.72 116.97 116.92 1zjz h TYR 224 Ca 0.25 -0.17 -0.10 0.00 2.00 0.00 0.00 58.73 60.72 1zjz h TYR 224 Cb 0.21 -0.18 -0.01 0.00 1.00 0.00 0.00 36.73 37.75 1zjz h TYR 224 CO -0.12 0.84 -0.28 0.97 -0.00 0.00 0.00 178.16 179.57 1zjz h ILE 225 N 0.58 1.27 -0.40 -2.88 6.09 -1.62 -2.65 117.51 117.90 1zjz h ILE 225 Ca 0.08 -1.29 -0.09 0.00 -1.37 0.00 0.00 64.86 62.19 1zjz h ILE 225 Cb 0.72 1.41 -0.02 0.00 0.47 0.00 0.00 36.82 39.40 1zjz h ILE 225 CO 0.06 0.40 -0.12 0.00 -3.07 0.00 0.00 178.15 175.42 1zjz h VAL 227 N 0.65 1.00 -0.26 0.00 2.07 -0.90 -0.38 116.25 118.43 1zjz h VAL 227 Ca 0.11 -0.10 0.05 0.00 0.82 0.00 0.00 66.70 67.58 1zjz h VAL 227 Cb 0.58 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1zjz h VAL 227 CO 0.04 0.05 -0.01 0.22 0.02 0.00 0.00 177.57 177.89 1zjz h TYR 228 N 0.29 -0.04 -0.05 1.57 3.20 -1.22 -0.72 116.97 120.01 1zjz h TYR 228 Ca 0.11 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1zjz h TYR 228 Cb 0.02 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1zjz h TYR 228 CO -0.09 -0.06 -0.37 -0.07 -1.64 0.00 0.00 178.16 175.93 1zjz h LEU 229 N 0.06 0.11 -0.32 2.82 3.38 -1.03 -2.76 115.31 117.58 1zjz h LEU 229 Ca 0.12 -0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.90 1zjz h LEU 229 Cb 0.17 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1zjz h LEU 229 CO -0.22 0.48 -0.75 0.00 0.09 0.00 0.00 178.44 178.04 1zjz h ALA 230 N 1.53 0.64 -2.34 1.53 0.00 -0.79 -3.46 119.26 116.38 1zjz h ALA 230 Ca 0.01 -0.68 -0.51 0.00 0.00 0.00 0.00 54.91 53.73 1zjz h ALA 230 Cb 0.71 -0.12 0.09 0.00 0.00 0.00 0.00 17.79 18.47 1zjz h ALA 230 CO 0.05 0.94 0.36 0.45 0.00 0.00 0.00 179.25 181.05 1zjz s SER 231 N -6.68 5.32 0.00 0.00 0.15 -0.30 -4.84 113.70 107.36 1zjz s SER 231 Ca 0.01 1.69 0.15 0.00 0.70 0.00 0.00 55.95 58.50 1zjz s SER 231 Cb 0.10 -2.51 0.65 0.00 -1.71 0.00 0.00 66.02 62.55 1zjz s SER 231 CO 0.78 -1.48 1.47 0.59 1.20 0.00 0.00 173.24 175.80 1zjz n ASN 232 N -2.96 0.00 0.07 5.45 5.03 -1.26 -2.45 115.26 119.14 1zjz n ASN 232 Ca 0.08 0.46 0.18 0.00 0.87 0.00 0.00 54.58 56.18 1zjz n ASN 232 Cb 0.53 -0.48 0.71 0.00 -1.02 0.00 0.00 39.78 39.52 1zjz n ASN 232 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 1zjz h GLU 233 N 0.00 0.00 -0.70 3.52 5.08 -1.91 -2.50 114.58 118.07 1zjz h GLU 233 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1zjz h GLU 233 Cb 0.25 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.31 1zjz h GLU 233 CO 0.00 0.00 0.31 -1.13 -1.00 0.00 0.00 179.01 177.19 1zjz n SER 234 N -4.27 3.72 0.23 1.42 3.41 -1.03 -4.73 113.62 112.37 1zjz n SER 234 Ca 0.07 -3.51 0.16 0.00 -0.26 0.00 0.00 58.87 55.32 1zjz n SER 234 Cb 0.49 -0.74 0.83 0.00 -0.26 0.00 0.00 64.21 64.53 1zjz n SER 234 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1zjz h LYS 235 N 1.52 0.00 -0.04 4.33 2.10 -1.64 0.07 116.57 122.90 1zjz h LYS 235 Ca 0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 1zjz h LYS 235 Cb 2.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.64 1zjz h LYS 235 CO 0.75 0.00 0.00 0.34 -2.00 0.00 0.00 179.45 178.54 1zjz n PHE 236 N -2.57 0.03 -3.33 0.07 7.35 -1.26 -4.92 117.46 112.82 1zjz n PHE 236 Ca -0.02 -0.02 -0.41 0.00 -0.76 0.00 0.00 57.45 56.25 1zjz n PHE 236 Cb 0.05 -0.00 -0.09 0.00 0.35 0.00 0.00 39.48 39.80 1zjz n PHE 236 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1zjz s ALA 237 N -1.66 3.51 -0.07 3.13 0.00 0.01 -5.04 121.76 121.63 1zjz s ALA 237 Ca 0.24 -1.03 -0.17 0.00 0.00 0.00 0.00 51.96 51.00 1zjz s ALA 237 Cb 0.17 -2.87 0.04 0.00 0.00 0.00 0.00 23.12 20.45 1zjz s ALA 237 CO 0.25 -1.03 0.41 -0.08 0.00 0.00 0.00 175.76 175.32 1zjz s THR 238 N 2.18 0.03 -0.41 0.00 -1.32 -1.26 -4.71 115.64 110.14 1zjz s THR 238 Ca 0.15 -0.23 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1zjz s THR 238 Cb -0.16 -0.67 0.00 0.00 -1.51 0.00 0.00 72.50 70.16 1zjz s THR 238 CO 0.12 -0.13 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 1zjz n GLY 239 N 1.79 0.67 3.58 6.08 0.00 0.48 -4.98 105.19 112.81 1zjz n GLY 239 Ca -0.18 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 1zjz n GLY 239 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zjz s SER 240 N -2.62 4.02 -0.17 1.61 0.01 -1.26 -4.78 113.70 110.51 1zjz s SER 240 Ca 0.00 -0.96 -0.04 0.00 1.31 0.00 0.00 55.95 56.26 1zjz s SER 240 Cb 0.00 -0.50 -0.03 0.00 0.21 0.00 0.00 66.02 65.70 1zjz s SER 240 CO 0.00 -0.10 -0.03 -1.61 0.41 0.00 0.00 173.24 171.91 1zjz s GLU 241 N -3.63 3.64 -0.28 12.44 8.01 -1.26 -1.35 118.70 136.27 1zjz s GLU 241 Ca 0.32 -0.53 0.00 0.00 0.01 0.00 0.00 54.97 54.78 1zjz s GLU 241 Cb -0.02 -2.96 0.05 0.00 -4.31 0.00 0.00 34.13 26.88 1zjz s GLU 241 CO 0.18 0.15 -0.06 -0.06 0.01 0.00 0.00 175.26 175.48 1zjz s PHE 242 N 0.61 3.25 -0.19 1.61 0.40 0.16 -4.99 117.98 118.83 1zjz s PHE 242 Ca -0.02 -2.05 -0.08 0.00 -0.60 0.00 0.00 56.93 54.18 1zjz s PHE 242 Cb -0.14 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.32 1zjz s PHE 242 CO 0.02 -0.83 0.07 0.08 0.70 0.00 0.00 175.22 175.26 1zjz s VAL 243 N 1.19 4.83 -0.38 -0.44 1.01 -1.26 -0.45 120.40 124.89 1zjz s VAL 243 Ca -0.06 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1zjz s VAL 243 Cb -0.20 -3.18 0.13 0.00 0.00 0.00 0.00 36.38 33.14 1zjz s VAL 243 CO -0.03 0.45 0.21 -0.69 0.00 0.00 0.00 175.10 175.04 1zjz s VAL 244 N 0.42 0.74 0.00 2.92 1.01 -0.87 -4.96 120.40 119.66 1zjz s VAL 244 Ca 0.03 -2.02 0.00 0.00 0.00 0.00 0.00 61.98 60.00 1zjz s VAL 244 Cb -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.72 1zjz s VAL 244 CO 0.00 -0.91 0.51 -0.90 0.00 0.00 0.00 175.10 173.80 1zjz n ASP 245 N 3.93 0.00 -0.73 3.32 5.75 -1.26 -1.07 116.55 126.49 1zjz n ASP 245 Ca 0.09 -1.04 -0.10 0.00 -0.01 0.00 0.00 54.79 53.73 1zjz n ASP 245 Cb 0.36 -0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.40 1zjz n ASP 245 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1zjz n GLY 246 N 0.00 1.03 0.86 6.12 0.00 -1.26 -2.11 105.19 109.83 1zjz n GLY 246 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1zjz n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zjz n GLY 247 N -0.83 0.71 0.20 -0.02 0.00 -1.26 -2.27 105.19 101.72 1zjz n GLY 247 Ca -0.10 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 1zjz n GLY 247 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1zjz h TYR 248 N 0.00 -0.16 -0.00 1.61 3.20 -1.62 -1.74 116.97 118.26 1zjz h TYR 248 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1zjz h TYR 248 Cb 0.00 0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.42 1zjz h TYR 248 CO 0.00 -0.17 -0.28 0.25 -1.64 0.00 0.00 178.16 176.32 1zjz n THR 249 N -5.30 0.00 0.28 1.81 -2.24 -1.26 -3.86 114.28 103.70 1zjz n THR 249 Ca 0.05 -0.05 0.15 0.00 -2.27 0.00 0.00 64.05 61.93 1zjz n THR 249 Cb 0.27 0.11 0.46 0.00 -2.10 0.00 0.00 70.33 69.07 1zjz n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zjz h ALA 250 N 3.32 1.00 -0.02 6.98 0.00 -1.73 -3.52 119.26 125.30 1zjz h ALA 250 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zjz h ALA 250 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1zjz h ALA 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25