#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jza n SER 2 N 0.00 0.64 -0.82 6.12 3.41 -1.26 -4.81 113.62 116.91 2jza n SER 2 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.64 2jza n SER 2 Cb 0.00 0.04 0.13 0.00 -0.26 0.00 0.00 64.21 64.13 2jza n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jza n GLN 3 N -1.04 2.11 -3.74 4.33 3.00 -1.26 -4.77 117.38 116.01 2jza n GLN 3 Ca 0.00 -1.03 -0.38 0.00 -0.01 0.00 0.00 57.00 55.58 2jza n GLN 3 Cb 0.07 -1.59 -0.12 0.00 0.00 0.00 0.00 30.24 28.60 2jza n GLN 3 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 2jza s TRP 4 N -1.62 3.26 -0.08 1.08 0.52 -1.26 0.25 118.94 121.09 2jza s TRP 4 Ca 0.18 -1.40 -0.07 0.00 0.02 0.00 0.00 56.10 54.83 2jza s TRP 4 Cb 0.13 -2.31 -0.04 0.00 -1.15 0.00 0.00 33.47 30.09 2jza s TRP 4 CO 0.07 -0.73 0.19 0.95 0.02 0.00 0.00 176.95 177.46 2jza s THR 5 N 1.41 5.42 -0.17 2.01 -4.23 -0.66 -4.87 115.64 114.56 2jza s THR 5 Ca -0.01 0.21 -0.29 0.00 -1.18 0.00 0.00 61.69 60.42 2jza s THR 5 Cb -0.20 -3.47 -0.00 0.00 1.34 0.00 0.00 72.50 70.17 2jza s THR 5 CO 0.03 0.54 1.01 -0.89 -0.54 0.00 0.00 174.62 174.77 2jza s THR 6 N -1.11 4.74 0.00 3.99 2.01 -1.26 -1.99 115.64 122.02 2jza s THR 6 Ca 0.19 2.01 0.00 0.00 0.31 0.00 0.00 61.69 64.20 2jza s THR 6 Cb -0.13 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.08 2jza s THR 6 CO 0.09 -0.08 0.23 0.52 -0.69 0.00 0.00 174.62 174.69 2jza n VAL 7 N 4.91 0.00 0.00 3.82 0.31 0.18 -5.00 118.33 122.55 2jza n VAL 7 Ca 0.10 0.50 0.00 0.00 -0.01 0.00 0.00 64.34 64.93 2jza n VAL 7 Cb 0.48 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 2jza n VAL 7 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jza s LYS 9 N 0.00 0.77 0.12 0.00 1.02 -1.26 -4.51 119.74 115.88 2jza s LYS 9 Ca 0.00 -0.21 0.26 0.00 0.02 0.00 0.00 55.97 56.03 2jza s LYS 9 Cb 0.00 0.34 0.66 0.00 -0.52 0.00 0.00 37.83 38.31 2jza s LYS 9 CO 0.00 -0.23 1.58 -0.11 -0.92 0.00 0.00 175.35 175.67 2jza n LEU 10 N 1.01 0.62 0.01 3.17 7.94 0.32 -3.70 117.00 126.37 2jza n LEU 10 Ca -0.20 0.36 -0.05 0.00 -1.11 0.00 0.00 56.01 55.01 2jza n LEU 10 Cb 0.57 -0.28 -0.11 0.00 0.53 0.00 0.00 43.42 44.13 2jza n LEU 10 CO 0.22 -0.07 -0.31 -0.78 -1.11 0.00 0.00 177.39 175.33 2jza h ASP 11 N 0.00 0.00 1.73 1.96 1.82 -1.94 -3.33 116.42 116.66 2jza h ASP 11 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2jza h ASP 11 Cb 0.68 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.69 2jza h ASP 11 CO 0.00 0.83 -0.15 -0.78 -1.61 0.00 0.00 179.24 177.54 2jza h ASP 12 N 0.00 0.00 -3.01 2.28 3.58 -1.87 -3.44 116.42 113.96 2jza h ASP 12 Ca -0.20 -0.01 -0.57 0.00 0.42 0.00 0.00 57.03 56.67 2jza h ASP 12 Cb 1.81 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.81 2jza h ASP 12 CO 0.07 0.00 0.91 -0.63 -2.88 0.00 0.00 179.24 176.72 2jza s ILE 13 N -3.20 4.29 0.58 2.25 -1.09 -1.25 -5.01 121.20 117.76 2jza s ILE 13 Ca 0.07 1.53 -0.06 0.00 -2.23 0.00 0.00 60.65 59.96 2jza s ILE 13 Cb 0.07 -4.09 -0.00 0.00 -1.58 0.00 0.00 42.46 36.86 2jza s ILE 13 CO 0.67 -0.25 0.90 -0.76 -1.23 0.00 0.00 174.94 174.27 2jza s LEU 14 N 3.73 3.27 0.11 2.97 1.43 -1.26 -5.00 118.68 123.93 2jza s LEU 14 Ca 0.54 0.82 -0.31 0.00 -1.03 0.00 0.00 54.13 54.14 2jza s LEU 14 Cb -0.19 -3.67 -0.10 0.00 0.03 0.00 0.00 46.19 42.26 2jza s LEU 14 CO 0.16 -0.99 1.77 -2.84 0.23 0.00 0.00 176.35 174.68 2jza s PRO 15 N -4.99 4.16 -1.37 1.29 0.02 -1.26 -2.16 135.00 130.69 2jza s PRO 15 Ca 0.53 2.51 -0.09 0.00 0.02 0.00 0.00 61.00 63.98 2jza s PRO 15 Cb -0.11 -3.59 0.02 0.00 0.02 0.00 0.00 34.50 30.84 2jza s PRO 15 CO 0.46 -0.81 1.16 0.41 -0.33 0.00 0.00 177.00 177.90 2jza n GLY 16 N 4.16 -0.54 3.50 0.52 0.00 0.23 -4.98 105.19 108.08 2jza n GLY 16 Ca 0.17 0.25 -0.12 0.00 0.00 0.00 0.00 46.02 46.32 2jza n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jza s THR 17 N -3.32 0.00 0.00 2.61 2.01 -0.92 -4.38 115.64 111.64 2jza s THR 17 Ca 0.57 -1.57 0.00 0.00 0.31 0.00 0.00 61.69 61.00 2jza s THR 17 Cb -0.25 -2.47 0.00 0.00 0.01 0.00 0.00 72.50 69.79 2jza s THR 17 CO 0.74 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.28 2jza n GLY 18 N -0.46 1.92 3.35 4.40 0.00 -1.23 -1.47 105.19 111.70 2jza n GLY 18 Ca -0.00 -0.92 -0.18 0.00 0.00 0.00 0.00 46.02 44.92 2jza n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jza s VAL 19 N -2.00 1.24 -0.05 1.61 -7.23 -1.24 -4.76 120.40 107.97 2jza s VAL 19 Ca 0.00 -2.07 -0.27 0.00 -1.81 0.00 0.00 61.98 57.84 2jza s VAL 19 Cb 0.00 -2.31 -0.03 0.00 0.56 0.00 0.00 36.38 34.60 2jza s VAL 19 CO 0.00 -0.37 0.84 0.00 -0.31 0.00 0.00 175.10 175.26 2jza s ALA 21 N 1.05 3.00 -0.89 0.00 0.00 0.20 -4.97 121.76 120.15 2jza s ALA 21 Ca 0.44 -0.97 -0.16 0.00 0.00 0.00 0.00 51.96 51.27 2jza s ALA 21 Cb -0.19 -1.72 0.18 0.00 0.00 0.00 0.00 23.12 21.39 2jza s ALA 21 CO 0.22 -0.09 0.95 -1.17 0.00 0.00 0.00 175.76 175.67 2jza s LEU 22 N 0.90 5.95 -0.39 0.00 1.98 -1.26 -2.54 118.68 123.33 2jza s LEU 22 Ca 0.01 -2.43 -0.05 0.00 -2.89 0.00 0.00 54.13 48.76 2jza s LEU 22 Cb -0.14 -2.30 0.08 0.00 0.66 0.00 0.00 46.19 44.49 2jza s LEU 22 CO 0.02 -0.79 0.18 -0.69 -1.89 0.00 0.00 176.35 173.18 2jza s VAL 23 N 1.29 3.61 0.00 1.68 1.01 -0.90 -4.95 120.40 122.14 2jza s VAL 23 Ca 0.25 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.61 2jza s VAL 23 Cb -0.07 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.04 2jza s VAL 23 CO -0.09 -0.48 0.00 -0.62 0.00 0.00 0.00 175.10 173.91 2jza n GLU 24 N 4.73 0.00 0.00 2.72 -0.58 -1.26 -0.34 120.64 125.91 2jza n GLU 24 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2jza n GLU 24 Cb 0.42 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.29 2jza n GLU 24 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jza n GLN 25 N 0.00 0.17 -3.88 3.49 -0.00 -1.26 -5.05 117.38 110.85 2jza n GLN 25 Ca 0.00 -0.43 -0.35 0.00 -0.00 0.00 0.00 57.00 56.22 2jza n GLN 25 Cb 0.00 -0.68 -0.09 0.00 -0.00 0.00 0.00 30.24 29.47 2jza n GLN 25 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2jza s GLN 26 N -0.13 4.04 -0.84 2.61 -1.52 0.53 -4.90 119.66 119.46 2jza s GLN 26 Ca 0.00 -0.30 -0.11 0.00 -1.95 0.00 0.00 55.36 53.00 2jza s GLN 26 Cb 0.00 -3.31 0.22 0.00 -0.22 0.00 0.00 33.01 29.70 2jza s GLN 26 CO 0.00 0.25 0.76 -0.65 -0.25 0.00 0.00 175.29 175.40 2jza s GLN 27 N 0.46 3.49 -0.13 2.91 -0.21 -1.26 -2.11 119.66 122.81 2jza s GLN 27 Ca 0.05 -2.63 -0.04 0.00 0.02 0.00 0.00 55.36 52.76 2jza s GLN 27 Cb -0.12 -4.30 -0.04 0.00 1.00 0.00 0.00 33.01 29.55 2jza s GLN 27 CO -0.00 -1.26 0.03 0.42 -2.12 0.00 0.00 175.29 172.36 2jza s ILE 28 N -0.17 4.56 -0.05 1.08 1.01 -1.05 -4.60 121.20 121.97 2jza s ILE 28 Ca 0.20 -0.14 0.05 0.00 0.00 0.00 0.00 60.65 60.77 2jza s ILE 28 Cb -0.12 -2.98 -0.02 0.00 0.01 0.00 0.00 42.46 39.36 2jza s ILE 28 CO -0.08 0.55 -0.22 0.00 0.00 0.00 0.00 174.94 175.20 2jza s ALA 29 N -0.38 2.33 0.08 9.38 0.00 0.19 0.60 121.76 133.96 2jza s ALA 29 Ca 0.08 -1.03 -0.08 0.00 0.00 0.00 0.00 51.96 50.93 2jza s ALA 29 Cb -0.12 -0.76 -0.05 0.00 0.00 0.00 0.00 23.12 22.18 2jza s ALA 29 CO 0.02 0.46 0.36 0.08 0.00 0.00 0.00 175.76 176.68 2jza s VAL 30 N -0.37 5.17 -0.03 0.00 1.01 -0.71 -1.29 120.40 124.18 2jza s VAL 30 Ca 0.03 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 2jza s VAL 30 Cb -0.12 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.67 2jza s VAL 30 CO 0.02 0.23 0.05 0.12 0.00 0.00 0.00 175.10 175.53 2jza s PHE 31 N -1.45 -0.00 -0.62 5.22 5.36 -0.12 -3.53 117.98 122.84 2jza s PHE 31 Ca 0.34 0.20 -0.04 0.00 -0.96 0.00 0.00 56.93 56.48 2jza s PHE 31 Cb -0.13 -0.22 0.16 0.00 -0.34 0.00 0.00 43.02 42.48 2jza s PHE 31 CO 0.19 -0.11 0.44 0.50 -1.46 0.00 0.00 175.22 174.79 2jza s ARG 32 N 1.16 2.59 -0.05 10.12 3.52 -0.54 -0.20 118.95 135.55 2jza s ARG 32 Ca -0.08 -2.48 -0.20 0.00 -0.13 0.00 0.00 55.73 52.84 2jza s ARG 32 Cb -0.13 -3.77 -0.15 0.00 -1.56 0.00 0.00 34.95 29.35 2jza s ARG 32 CO -0.04 -1.18 0.82 -1.00 -0.81 0.00 0.00 175.30 173.10 2jza h PRO 33 N 7.15 -0.23 -0.01 5.12 0.13 -1.90 0.66 132.00 142.92 2jza h PRO 33 Ca -0.02 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2jza h PRO 33 Cb 0.96 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2jza h PRO 33 CO 0.72 0.17 -0.01 0.54 -0.23 0.00 0.00 178.00 179.19 2jza n ARG 34 N -4.93 1.61 -2.21 0.86 1.74 -1.26 -4.47 116.66 108.00 2jza n ARG 34 Ca -0.07 -0.91 -0.19 0.00 -0.77 0.00 0.00 57.85 55.91 2jza n ARG 34 Cb 0.25 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.19 2jza n ARG 34 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2jza n ASN 35 N 0.10 -5.40 -1.34 0.55 5.15 -1.25 -4.98 115.26 108.08 2jza n ASN 35 Ca 0.19 0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.24 2jza n ASN 35 Cb 0.34 -4.47 0.00 0.00 -0.53 0.00 0.00 39.78 35.12 2jza n ASN 35 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2jza n ASP 36 N -1.49 1.18 0.24 1.20 5.75 -1.26 -5.00 116.55 117.17 2jza n ASP 36 Ca -0.22 -0.67 0.08 0.00 -0.01 0.00 0.00 54.79 53.97 2jza n ASP 36 Cb 0.66 0.00 0.59 0.00 -1.03 0.00 0.00 41.12 41.34 2jza n ASP 36 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2jza h GLU 37 N 0.00 0.00 -6.36 0.11 3.07 -1.96 -3.39 114.58 106.04 2jza h GLU 37 Ca 0.00 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.30 2jza h GLU 37 Cb 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 27.82 2jza h GLU 37 CO 0.00 0.16 0.92 -0.65 -1.40 0.00 0.00 179.01 178.03 2jza s GLN 38 N -4.52 3.39 0.23 2.33 1.11 -1.26 -5.01 119.66 115.93 2jza s GLN 38 Ca -0.04 -0.00 0.06 0.00 0.01 0.00 0.00 55.36 55.40 2jza s GLN 38 Cb 0.15 -4.07 -0.04 0.00 -1.01 0.00 0.00 33.01 28.04 2jza s GLN 38 CO 0.66 -1.78 0.18 0.14 0.01 0.00 0.00 175.29 174.50 2jza s VAL 39 N 4.96 4.46 -0.49 1.09 -7.23 -1.26 -4.61 120.40 117.33 2jza s VAL 39 Ca 0.38 -1.31 -0.02 0.00 -1.81 0.00 0.00 61.98 59.21 2jza s VAL 39 Cb -0.09 -3.37 0.13 0.00 0.56 0.00 0.00 36.38 33.61 2jza s VAL 39 CO 0.21 -0.28 0.29 -0.31 -0.31 0.00 0.00 175.10 174.70 2jza s TYR 40 N -2.02 3.52 -0.79 2.82 2.02 0.72 -4.94 117.35 118.68 2jza s TYR 40 Ca 0.32 -2.56 -0.18 0.00 -0.37 0.00 0.00 57.07 54.28 2jza s TYR 40 Cb -0.08 -3.20 0.14 0.00 -0.40 0.00 0.00 41.96 38.42 2jza s TYR 40 CO 0.24 -0.92 0.90 0.00 -1.57 0.00 0.00 175.55 174.21 2jza s ALA 41 N 0.66 3.55 0.13 3.71 0.00 -1.26 -0.94 121.76 127.61 2jza s ALA 41 Ca 0.12 -2.69 0.01 0.00 0.00 0.00 0.00 51.96 49.39 2jza s ALA 41 Cb -0.22 -3.75 -0.00 0.00 0.00 0.00 0.00 23.12 19.15 2jza s ALA 41 CO -0.04 -2.61 0.03 0.44 0.00 0.00 0.00 175.76 173.58 2jza n ILE 42 N 5.15 0.00 -0.73 0.00 -5.35 -0.41 -3.95 119.36 114.07 2jza n ILE 42 Ca 0.10 -0.70 -0.08 0.00 -0.27 0.00 0.00 62.75 61.81 2jza n ILE 42 Cb 0.46 0.21 -0.11 0.00 -1.74 0.00 0.00 39.64 38.46 2jza n ILE 42 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2jza n SER 43 N -1.58 4.34 -1.64 7.28 7.64 -1.10 -0.64 113.62 127.92 2jza n SER 43 Ca -0.03 -2.27 -0.06 0.00 1.01 0.00 0.00 58.87 57.51 2jza n SER 43 Cb 0.18 -1.12 0.01 0.00 -1.01 0.00 0.00 64.21 62.27 2jza n SER 43 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jza n ASN 44 N 2.36 5.72 -4.29 6.43 5.15 -1.26 -4.80 115.26 124.56 2jza n ASN 44 Ca 0.27 -2.63 -0.34 0.00 -0.60 0.00 0.00 54.58 51.29 2jza n ASN 44 Cb 0.68 -1.11 -0.15 0.00 -0.53 0.00 0.00 39.78 38.67 2jza n ASN 44 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2jza s ILE 45 N -0.73 2.98 -0.23 -1.44 -1.09 -1.26 -4.26 121.20 115.17 2jza s ILE 45 Ca 0.12 -0.65 -0.23 0.00 -2.23 0.00 0.00 60.65 57.66 2jza s ILE 45 Cb 0.09 -2.30 -0.01 0.00 -1.58 0.00 0.00 42.46 38.65 2jza s ILE 45 CO -0.00 0.48 0.74 -0.62 -1.23 0.00 0.00 174.94 174.31 2jza s ASP 46 N 1.05 6.74 0.58 3.58 -1.08 -1.26 -4.95 116.67 121.34 2jza s ASP 46 Ca -0.00 0.92 0.28 0.00 -0.52 0.00 0.00 52.55 53.23 2jza s ASP 46 Cb -0.15 -2.39 1.61 0.00 -1.46 0.00 0.00 42.92 40.53 2jza s ASP 46 CO -0.02 -0.42 2.08 -0.65 0.52 0.00 0.00 175.17 176.67 2jza h PRO 47 N 7.68 0.00 0.00 4.34 0.11 -1.97 0.45 132.00 142.61 2jza h PRO 47 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2jza h PRO 47 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2jza h PRO 47 CO 0.82 0.00 0.00 0.34 -0.21 0.00 0.00 178.00 178.95 2jza n PHE 48 N -3.85 0.73 -0.01 0.65 7.35 -1.26 -3.78 117.46 117.28 2jza n PHE 48 Ca 0.03 0.22 -0.02 0.00 -0.76 0.00 0.00 57.45 56.92 2jza n PHE 48 Cb 0.36 -0.87 -0.02 0.00 0.35 0.00 0.00 39.48 39.31 2jza n PHE 48 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jza n ALA 49 N -1.73 1.93 -1.31 3.13 0.00 -0.15 -5.01 120.51 117.37 2jza n ALA 49 Ca 0.05 -0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 2jza n ALA 49 Cb 0.38 0.31 -0.05 0.00 0.00 0.00 0.00 19.45 20.09 2jza n ALA 49 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2jza n GLN 50 N -2.34 -1.08 -4.22 0.00 -0.06 0.14 -4.95 117.38 104.86 2jza n GLN 50 Ca -0.05 0.84 -0.13 0.00 -2.00 0.00 0.00 57.00 55.66 2jza n GLN 50 Cb 0.57 -4.93 -0.10 0.00 -4.06 0.00 0.00 30.24 21.73 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2jza s ALA 51 N -2.24 1.31 -1.26 1.69 0.00 -1.26 -4.98 121.76 115.02 2jza s ALA 51 Ca 0.00 -1.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.01 2jza s ALA 51 Cb 0.00 1.36 0.02 0.00 0.00 0.00 0.00 23.12 24.51 2jza s ALA 51 CO 0.00 -0.58 1.79 -1.54 0.00 0.00 0.00 175.76 175.43 2jza s SER 52 N -3.20 6.30 0.17 0.00 1.04 -1.26 -4.07 113.70 112.68 2jza s SER 52 Ca 0.39 -2.20 0.22 0.00 0.48 0.00 0.00 55.95 54.84 2jza s SER 52 Cb 0.07 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.56 2jza s SER 52 CO 0.14 -1.74 0.97 1.33 0.98 0.00 0.00 173.24 174.91 2jza n VAL 53 N 6.82 0.63 0.34 5.02 0.24 -1.26 -3.89 118.33 126.23 2jza n VAL 53 Ca 0.47 -0.56 0.12 0.00 -2.04 0.00 0.00 64.34 62.33 2jza n VAL 53 Cb 0.46 -0.35 0.14 0.00 -1.47 0.00 0.00 33.84 32.63 2jza n VAL 53 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2jza h LEU 54 N 0.00 0.00 -0.28 1.34 3.38 -1.81 -3.26 115.31 114.68 2jza h LEU 54 Ca -0.02 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jza h LEU 54 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2jza h LEU 54 CO 0.00 0.03 0.00 -1.20 0.09 0.00 0.00 178.44 177.37 2jza n SER 55 N -2.54 0.38 -1.56 -0.43 7.64 -1.25 -3.09 113.62 112.78 2jza n SER 55 Ca 0.03 -2.00 -0.01 0.00 1.01 0.00 0.00 58.87 57.89 2jza n SER 55 Cb 0.50 -0.07 -0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2jza n SER 55 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2jza n ARG 56 N -0.30 0.31 0.00 1.43 1.85 -1.23 -3.19 116.66 115.53 2jza n ARG 56 Ca 0.02 -1.70 0.00 0.00 -1.00 0.00 0.00 57.85 55.17 2jza n ARG 56 Cb 0.07 0.06 0.00 0.00 -1.05 0.00 0.00 32.46 31.54 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jza n GLY 57 N 0.00 1.79 3.65 2.89 0.00 -1.18 -5.06 105.19 107.28 2jza n GLY 57 Ca -0.09 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 43.77 2jza n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jza s ILE 58 N 3.43 5.28 -0.61 -0.61 1.09 -1.18 -4.97 121.20 123.64 2jza s ILE 58 Ca 0.00 0.38 -0.22 0.00 -1.10 0.00 0.00 60.65 59.71 2jza s ILE 58 Cb 0.00 -3.59 0.06 0.00 -1.06 0.00 0.00 42.46 37.87 2jza s ILE 58 CO 0.00 0.28 0.90 -0.69 -0.10 0.00 0.00 174.94 175.33 2jza s VAL 59 N 1.33 4.44 -0.40 2.92 1.01 -1.26 0.11 120.40 128.55 2jza s VAL 59 Ca 0.12 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.72 2jza s VAL 59 Cb -0.14 -4.59 0.04 0.00 0.00 0.00 0.00 36.38 31.69 2jza s VAL 59 CO 0.07 -1.26 0.25 0.00 0.00 0.00 0.00 175.10 174.16 2jza s ALA 60 N 3.76 3.36 -0.31 5.51 0.00 0.58 -4.99 121.76 129.67 2jza s ALA 60 Ca 0.23 -1.81 -0.25 0.00 0.00 0.00 0.00 51.96 50.13 2jza s ALA 60 Cb -0.17 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.24 2jza s ALA 60 CO 0.12 -1.47 0.85 -2.00 0.00 0.00 0.00 175.76 173.26 2jza s GLU 61 N 1.58 3.98 -0.78 0.00 2.12 -1.26 -1.02 118.70 123.32 2jza s GLU 61 Ca 0.03 0.68 -0.11 0.00 0.36 0.00 0.00 54.97 55.93 2jza s GLU 61 Cb -0.20 -3.73 0.20 0.00 0.26 0.00 0.00 34.13 30.66 2jza s GLU 61 CO 0.07 -0.74 0.69 -1.58 -0.54 0.00 0.00 175.26 173.16 2jza s HIS 62 N 3.12 3.67 0.00 5.30 5.65 0.87 -4.91 115.29 128.99 2jza s HIS 62 Ca 0.35 -2.16 0.00 0.00 0.25 0.00 0.00 55.06 53.50 2jza s HIS 62 Cb -0.14 -3.67 0.00 0.00 -1.18 0.00 0.00 32.58 27.59 2jza s HIS 62 CO 0.13 -0.95 0.00 1.04 -0.65 0.00 0.00 174.74 174.31 2jza n GLN 63 N 3.86 0.00 -0.01 2.88 6.02 -1.26 -0.76 117.38 128.11 2jza n GLN 63 Ca 0.12 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.12 2jza n GLN 63 Cb 0.45 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.66 2jza n GLN 63 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2jza n ASP 64 N 2.21 3.55 -4.90 1.08 2.03 -1.26 -5.05 116.55 114.22 2jza n ASP 64 Ca 0.00 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.02 2jza n ASP 64 Cb 0.00 1.10 -0.03 0.00 -0.72 0.00 0.00 41.12 41.47 2jza n ASP 64 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2jza s ASP 65 N -3.02 6.47 -0.25 1.67 1.01 0.06 -5.07 116.67 117.53 2jza s ASP 65 Ca -0.02 0.77 -0.03 0.00 0.71 0.00 0.00 52.55 53.97 2jza s ASP 65 Cb 0.03 -2.17 0.02 0.00 1.01 0.00 0.00 42.92 41.81 2jza s ASP 65 CO 0.26 -0.20 -0.03 -0.76 0.21 0.00 0.00 175.17 174.65 2jza s LEU 66 N -3.49 3.24 0.15 1.23 1.43 -1.26 -0.09 118.68 119.89 2jza s LEU 66 Ca 0.45 -0.74 0.11 0.00 -1.03 0.00 0.00 54.13 52.92 2jza s LEU 66 Cb -0.11 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 2jza s LEU 66 CO 0.29 -0.12 -0.26 0.26 0.23 0.00 0.00 176.35 176.76 2jza s TRP 67 N 1.39 2.32 -0.15 0.29 0.52 -0.18 -3.29 118.94 119.83 2jza s TRP 67 Ca 0.02 -0.37 -0.03 0.00 0.02 0.00 0.00 56.10 55.75 2jza s TRP 67 Cb -0.16 -1.23 -0.02 0.00 -1.15 0.00 0.00 33.47 30.91 2jza s TRP 67 CO -0.03 0.39 -0.07 0.54 0.02 0.00 0.00 176.95 177.80 2jza s VAL 68 N -1.23 3.57 -0.37 4.03 0.11 -0.15 -0.31 120.40 126.06 2jza s VAL 68 Ca 0.16 -0.47 -0.23 0.00 -2.93 0.00 0.00 61.98 58.51 2jza s VAL 68 Cb -0.09 -2.55 0.01 0.00 -1.53 0.00 0.00 36.38 32.21 2jza s VAL 68 CO 0.07 0.50 0.76 0.00 -3.33 0.00 0.00 175.10 173.10 2jza s ALA 69 N 0.44 3.43 -0.09 1.54 0.00 0.12 -2.07 121.76 125.13 2jza s ALA 69 Ca -0.06 -0.70 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 2jza s ALA 69 Cb -0.15 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.57 2jza s ALA 69 CO 0.04 -1.48 1.95 0.45 0.00 0.00 0.00 175.76 176.72 2jza s SER 70 N 1.84 6.16 0.00 0.00 0.15 -0.02 -3.13 113.70 118.71 2jza s SER 70 Ca 0.30 2.22 0.14 0.00 0.70 0.00 0.00 55.95 59.31 2jza s SER 70 Cb -0.13 -2.53 0.62 0.00 -1.71 0.00 0.00 66.02 62.27 2jza s SER 70 CO 0.17 -1.35 1.41 -0.81 1.20 0.00 0.00 173.24 173.86 2jza n PRO 71 N 7.89 0.07 -0.05 5.44 -0.04 -1.26 -0.77 135.00 146.28 2jza n PRO 71 Ca 0.22 0.23 -0.10 0.00 -0.04 0.00 0.00 63.50 63.81 2jza n PRO 71 Cb 0.43 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 2jza n PRO 71 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jza n LEU 72 N -1.43 0.75 -0.33 1.53 4.77 -1.26 -4.73 117.00 116.31 2jza n LEU 72 Ca 0.04 0.13 0.13 0.00 -0.03 0.00 0.00 56.01 56.28 2jza n LEU 72 Cb 0.14 -0.31 0.29 0.00 -2.33 0.00 0.00 43.42 41.22 2jza n LEU 72 CO 0.12 0.16 0.58 0.29 -1.33 0.00 0.00 177.39 177.21 2jza n LYS 73 N -3.47 0.99 -1.05 3.23 4.76 -1.24 -4.93 118.16 116.45 2jza n LYS 73 Ca -0.19 -0.66 -0.02 0.00 -2.87 0.00 0.00 58.31 54.58 2jza n LYS 73 Cb 0.61 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 32.31 2jza n LYS 73 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2jza n LYS 74 N -0.43 -1.35 -3.98 1.97 4.81 0.05 -4.95 118.16 114.28 2jza n LYS 74 Ca 0.12 0.42 -0.30 0.00 -0.87 0.00 0.00 58.31 57.68 2jza n LYS 74 Cb 0.38 -4.47 -0.05 0.00 0.02 0.00 0.00 35.03 30.91 2jza n LYS 74 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 2jza s GLN 75 N -1.60 3.20 -0.39 1.64 -2.07 -1.26 -4.79 119.66 114.39 2jza s GLN 75 Ca 0.00 -0.57 -0.09 0.00 -1.82 0.00 0.00 55.36 52.88 2jza s GLN 75 Cb 0.00 -2.90 0.06 0.00 -1.09 0.00 0.00 33.01 29.08 2jza s GLN 75 CO 0.00 0.58 0.22 -1.01 -1.32 0.00 0.00 175.29 173.76 2jza s HIS 76 N -1.50 3.29 -0.02 9.60 3.76 -1.26 -0.84 115.29 128.32 2jza s HIS 76 Ca 0.33 -1.33 0.03 0.00 -0.15 0.00 0.00 55.06 53.93 2jza s HIS 76 Cb -0.12 -2.69 -0.03 0.00 1.11 0.00 0.00 32.58 30.85 2jza s HIS 76 CO 0.26 -0.77 -0.08 -0.59 -0.85 0.00 0.00 174.74 172.71 2jza s PHE 77 N 1.46 2.87 -0.18 1.40 -0.71 -0.88 -2.96 117.98 118.99 2jza s PHE 77 Ca 0.02 -0.04 -0.24 0.00 -1.04 0.00 0.00 56.93 55.63 2jza s PHE 77 Cb -0.21 -1.64 -0.02 0.00 -1.21 0.00 0.00 43.02 39.94 2jza s PHE 77 CO 0.04 0.34 0.77 0.50 -1.34 0.00 0.00 175.22 175.52 2jza s ARG 78 N -1.14 4.27 0.13 1.99 3.52 -0.59 -0.98 118.95 126.15 2jza s ARG 78 Ca 0.15 0.90 -0.29 0.00 -0.13 0.00 0.00 55.73 56.35 2jza s ARG 78 Cb -0.11 -3.58 -0.06 0.00 -1.56 0.00 0.00 34.95 29.64 2jza s ARG 78 CO 0.05 -0.30 1.59 -0.07 -0.81 0.00 0.00 175.30 175.75 2jza h LEU 79 N 8.29 -1.28 -3.17 -0.88 3.38 -1.90 0.31 115.31 120.06 2jza h LEU 79 Ca -0.30 0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.61 2jza h LEU 79 Cb 1.13 0.51 -0.10 0.00 0.09 0.00 0.00 40.66 42.29 2jza h LEU 79 CO 0.82 -0.43 0.29 0.00 0.09 0.00 0.00 178.44 179.20 2jza n TYR 80 N -5.44 1.13 0.02 1.13 4.11 -1.26 -3.96 117.16 112.89 2jza n TYR 80 Ca -0.05 -1.51 0.00 0.00 -0.00 0.00 0.00 57.90 56.35 2jza n TYR 80 Cb 0.36 -0.74 0.00 0.00 -0.00 0.00 0.00 39.34 38.96 2jza n TYR 80 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 2jza n ASP 81 N 0.43 -0.19 0.00 9.48 2.03 -0.73 -5.04 116.55 122.53 2jza n ASP 81 Ca 0.22 0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.59 2jza n ASP 81 Cb 0.66 0.42 0.00 0.00 -0.72 0.00 0.00 41.12 41.48 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jza n GLY 82 N 0.01 2.81 3.83 0.27 0.00 0.10 -4.72 105.19 107.49 2jza n GLY 82 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2jza n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jza s PHE 83 N -2.69 3.48 -0.76 1.61 0.08 -1.26 -1.46 117.98 116.98 2jza s PHE 83 Ca 0.00 1.30 -0.01 0.00 0.12 0.00 0.00 56.93 58.34 2jza s PHE 83 Cb 0.00 -2.58 0.38 0.00 -0.57 0.00 0.00 43.02 40.25 2jza s PHE 83 CO 0.00 0.19 1.94 0.00 -0.10 0.00 0.00 175.22 177.25 2jza n LEU 85 N -0.64 0.00 -0.05 0.00 7.94 -1.16 -1.72 117.00 121.37 2jza n LEU 85 Ca 0.55 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 55.41 2jza n LEU 85 Cb 0.39 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.24 2jza n LEU 85 CO 0.57 0.00 -0.87 -0.62 -1.11 0.00 0.00 177.39 175.36 2jza n GLU 86 N 0.00 1.57 -3.46 1.96 -0.58 -1.26 -4.68 120.64 114.19 2jza n GLU 86 Ca 0.00 -0.03 -0.35 0.00 -0.42 0.00 0.00 57.16 56.36 2jza n GLU 86 Cb 0.00 -1.33 -0.05 0.00 -0.57 0.00 0.00 31.44 29.48 2jza n GLU 86 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2jza n ASP 87 N -2.37 4.52 -3.60 1.62 2.03 -0.70 -4.97 116.55 113.07 2jza n ASP 87 Ca -0.17 -3.28 -0.41 0.00 0.52 0.00 0.00 54.79 51.46 2jza n ASP 87 Cb 0.80 -0.99 -0.00 0.00 -0.72 0.00 0.00 41.12 40.21 2jza n ASP 87 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jza n GLY 88 N 1.71 4.99 0.05 0.27 0.00 -1.25 -4.60 105.19 106.36 2jza n GLY 88 Ca 0.25 -2.02 -0.02 0.00 0.00 0.00 0.00 46.02 44.23 2jza n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jza h ALA 89 N 5.03 0.00 -1.28 4.61 0.00 -1.93 -3.39 119.26 122.30 2jza h ALA 89 Ca 0.61 -0.07 -0.75 0.00 0.00 0.00 0.00 54.91 54.70 2jza h ALA 89 Cb 0.41 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.06 2jza h ALA 89 CO 1.56 0.02 1.70 0.66 0.00 0.00 0.00 179.25 183.19 2jza n TYR 90 N -4.76 3.76 -2.23 0.00 4.02 -1.26 -4.95 117.16 111.75 2jza n TYR 90 Ca -0.01 -3.03 -0.39 0.00 -0.01 0.00 0.00 57.90 54.46 2jza n TYR 90 Cb 0.06 -2.02 -0.03 0.00 -0.02 0.00 0.00 39.34 37.33 2jza n TYR 90 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2jza s SER 91 N 1.55 5.61 0.59 7.72 0.01 -1.26 -4.77 113.70 123.15 2jza s SER 91 Ca 0.40 0.08 -0.03 0.00 1.31 0.00 0.00 55.95 57.71 2jza s SER 91 Cb 0.04 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.76 2jza s SER 91 CO 0.01 -2.16 0.87 0.68 0.41 0.00 0.00 173.24 173.04 2jza s VAL 92 N 7.81 3.08 -0.10 3.43 -7.23 -0.54 -4.98 120.40 121.88 2jza s VAL 92 Ca 0.56 -0.31 -0.00 0.00 -1.81 0.00 0.00 61.98 60.42 2jza s VAL 92 Cb -0.11 -3.22 -0.03 0.00 0.56 0.00 0.00 36.38 33.58 2jza s VAL 92 CO 0.19 -0.20 -0.08 0.00 -0.31 0.00 0.00 175.10 174.70 2jza s ALA 93 N -2.94 2.89 -0.79 1.32 0.00 -1.26 -4.23 121.76 116.74 2jza s ALA 93 Ca 0.56 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 51.47 2jza s ALA 93 Cb -0.10 -1.27 0.17 0.00 0.00 0.00 0.00 23.12 21.92 2jza s ALA 93 CO 0.42 0.43 0.82 0.00 0.00 0.00 0.00 175.76 177.43 2jza s ALA 94 N -0.32 3.79 0.71 0.00 0.00 -1.26 -2.69 121.76 121.98 2jza s ALA 94 Ca 0.04 -2.97 -0.14 0.00 0.00 0.00 0.00 51.96 48.89 2jza s ALA 94 Cb -0.13 -3.62 0.03 0.00 0.00 0.00 0.00 23.12 19.40 2jza s ALA 94 CO 0.02 -2.43 1.13 0.71 0.00 0.00 0.00 175.76 175.20 2jza s TYR 95 N 1.22 2.39 0.21 0.00 2.02 -1.25 -5.01 117.35 116.93 2jza s TYR 95 Ca 0.19 1.58 -0.22 0.00 -0.37 0.00 0.00 57.07 58.25 2jza s TYR 95 Cb -0.13 -3.24 -0.08 0.00 -0.40 0.00 0.00 41.96 38.11 2jza s TYR 95 CO -0.06 -2.02 0.76 0.34 -1.57 0.00 0.00 175.55 173.00 2jza s ASP 96 N -2.56 7.20 -0.01 2.29 2.15 -1.26 -4.84 116.67 119.63 2jza s ASP 96 Ca 0.68 1.54 0.02 0.00 0.43 0.00 0.00 52.55 55.22 2jza s ASP 96 Cb -0.22 -2.46 -0.00 0.00 -0.30 0.00 0.00 42.92 39.93 2jza s ASP 96 CO 0.46 0.09 -0.07 0.42 -0.17 0.00 0.00 175.17 175.90 2jza s THR 97 N -1.39 0.56 -0.02 1.71 -4.23 -1.26 -0.43 115.64 110.58 2jza s THR 97 Ca 0.41 -0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.64 2jza s THR 97 Cb -0.19 -0.49 -0.04 0.00 1.34 0.00 0.00 72.50 73.12 2jza s THR 97 CO 0.23 0.17 0.06 -1.10 -0.54 0.00 0.00 174.62 173.45 2jza s GLN 98 N 0.03 3.05 -1.11 3.99 -0.21 0.70 -4.97 119.66 121.14 2jza s GLN 98 Ca -0.00 -0.46 -0.08 0.00 0.02 0.00 0.00 55.36 54.84 2jza s GLN 98 Cb -0.05 -2.85 0.28 0.00 1.00 0.00 0.00 33.01 31.39 2jza s GLN 98 CO -0.00 0.66 1.25 0.28 -2.12 0.00 0.00 175.29 175.36 2jza n VAL 99 N 1.41 4.80 0.09 1.09 0.31 -1.26 -2.69 118.33 122.08 2jza n VAL 99 Ca -0.15 -5.53 -0.08 0.00 -0.01 0.00 0.00 64.34 58.58 2jza n VAL 99 Cb 0.53 -2.43 0.01 0.00 -0.91 0.00 0.00 33.84 31.04 2jza n VAL 99 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2jza h THR 100 N 3.60 1.48 0.00 2.52 1.35 -1.96 -3.49 112.91 116.42 2jza h THR 100 Ca 0.19 -2.53 0.00 0.00 -0.55 0.00 0.00 66.41 63.52 2jza h THR 100 Cb 0.79 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.61 2jza h THR 100 CO 1.13 0.74 0.00 -3.20 -0.25 0.00 0.00 175.52 173.94 2jza n ASN 101 N -3.68 1.17 -1.37 5.36 2.85 -1.26 -4.96 115.26 113.35 2jza n ASN 101 Ca -0.03 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.44 2jza n ASN 101 Cb 0.78 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.80 2jza n ASN 101 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jza n GLY 102 N 0.00 2.15 3.25 8.20 0.00 -1.26 -4.78 105.19 112.75 2jza n GLY 102 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2jza n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jza s ASN 103 N 1.68 0.14 -0.15 1.61 2.20 -1.26 -0.53 114.94 118.63 2jza s ASN 103 Ca 0.00 -0.86 0.00 0.00 -0.94 0.00 0.00 52.86 51.06 2jza s ASN 103 Cb 0.00 0.37 -0.00 0.00 -2.00 0.00 0.00 41.25 39.62 2jza s ASN 103 CO 0.00 -0.80 -0.16 -0.69 -2.94 0.00 0.00 177.10 172.52 2jza s VAL 104 N -3.94 2.63 -0.21 3.54 1.01 -1.26 -4.03 120.40 118.13 2jza s VAL 104 Ca 0.14 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 2jza s VAL 104 Cb 0.05 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.34 2jza s VAL 104 CO -0.04 0.52 -0.12 -1.10 0.00 0.00 0.00 175.10 174.35 2jza s GLN 105 N 0.80 2.94 0.17 2.72 -0.21 -1.09 -0.64 119.66 124.34 2jza s GLN 105 Ca -0.06 -0.89 -0.02 0.00 0.02 0.00 0.00 55.36 54.41 2jza s GLN 105 Cb -0.15 -2.79 -0.05 0.00 1.00 0.00 0.00 33.01 31.01 2jza s GLN 105 CO -0.00 -0.30 0.37 0.96 -2.12 0.00 0.00 175.29 174.21 2jza s ILE 106 N 1.31 5.20 -0.16 1.08 -0.00 -0.84 -0.21 121.20 127.58 2jza s ILE 106 Ca 0.02 -0.19 -0.22 0.00 -0.00 0.00 0.00 60.65 60.26 2jza s ILE 106 Cb -0.15 -3.68 -0.03 0.00 -0.00 0.00 0.00 42.46 38.61 2jza s ILE 106 CO -0.08 -0.06 0.68 -0.55 -0.00 0.00 0.00 174.94 174.92 2jza s SER 107 N -2.81 6.81 -0.71 4.36 0.15 0.43 -1.65 113.70 120.28 2jza s SER 107 Ca 0.39 0.98 -0.26 0.00 0.70 0.00 0.00 55.95 57.77 2jza s SER 107 Cb -0.12 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.78 2jza s SER 107 CO 0.27 -0.25 1.93 -0.63 1.20 0.00 0.00 173.24 175.77 2jza s ILE 108 N 1.63 3.36 0.25 6.45 1.01 0.14 -4.57 121.20 129.46 2jza s ILE 108 Ca 0.32 -0.00 -0.28 0.00 0.00 0.00 0.00 60.65 60.69 2jza s ILE 108 Cb -0.16 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.32 2jza s ILE 108 CO 0.12 -0.86 0.91 0.00 0.00 0.00 0.00 174.94 175.12 2jza s ALA 109 N 9.71 3.33 0.26 9.38 0.00 -1.26 -5.02 121.76 138.16 2jza s ALA 109 Ca 0.70 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.92 2jza s ALA 109 Cb -0.11 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 2jza s ALA 109 CO 0.14 0.22 1.09 0.16 0.00 0.00 0.00 175.76 177.36 2jza s ASP 110 N -1.27 7.30 -0.37 0.00 -4.77 -1.26 -5.00 116.67 111.30 2jza s ASP 110 Ca 0.42 2.21 0.04 0.00 -3.30 0.00 0.00 52.55 51.93 2jza s ASP 110 Cb -0.24 -2.62 0.16 0.00 -1.09 0.00 0.00 42.92 39.13 2jza s ASP 110 CO 0.29 -0.13 0.45 -0.44 0.70 0.00 0.00 175.17 176.04 2jza s SER 111 N -0.77 0.32 -0.56 2.11 0.01 -1.26 -5.09 113.70 108.46 2jza s SER 111 Ca 0.45 -1.19 -0.26 0.00 1.31 0.00 0.00 55.95 56.26 2jza s SER 111 Cb -0.31 1.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.90 2jza s SER 111 CO 0.39 -0.25 2.06 -0.62 0.41 0.00 0.00 173.24 175.24 2jza s ASP 112 N 1.71 4.97 0.02 2.44 2.15 -1.26 -4.88 116.67 121.82 2jza s ASP 112 Ca 0.16 0.63 -0.37 0.00 0.43 0.00 0.00 52.55 53.39 2jza s ASP 112 Cb -0.12 -2.52 -0.17 0.00 -0.30 0.00 0.00 42.92 39.82 2jza s ASP 112 CO -0.08 -2.56 1.40 0.52 -0.17 0.00 0.00 175.17 174.28 2jza n VAL 113 N 7.50 0.05 -2.52 1.11 0.31 -1.26 -4.90 118.33 118.62 2jza n VAL 113 Ca 0.26 -0.01 -0.43 0.00 -0.01 0.00 0.00 64.34 64.16 2jza n VAL 113 Cb 0.53 -0.86 -0.02 0.00 -0.91 0.00 0.00 33.84 32.58 2jza n VAL 113 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jza s ALA 114 N 0.96 3.49 -0.24 3.52 0.00 -1.26 -4.99 121.76 123.25 2jza s ALA 114 Ca 0.87 0.11 -0.21 0.00 0.00 0.00 0.00 51.96 52.72 2jza s ALA 114 Cb -0.98 -3.69 -0.02 0.00 0.00 0.00 0.00 23.12 18.42 2jza s ALA 114 CO 0.50 -1.51 0.67 0.14 0.00 0.00 0.00 175.76 175.57 2jza s VAL 115 N 3.86 4.96 0.00 0.00 -7.23 -1.26 -5.04 120.40 115.69 2jza s VAL 115 Ca 0.51 1.24 0.00 0.00 -1.81 0.00 0.00 61.98 61.92 2jza s VAL 115 Cb -0.16 -3.98 0.00 0.00 0.56 0.00 0.00 36.38 32.81 2jza s VAL 115 CO 0.17 0.03 0.00 -0.67 -0.31 0.00 0.00 175.10 174.32 2jza n ASP 116 N 5.59 0.19 -3.45 4.85 2.03 -1.26 -5.12 116.55 119.38 2jza n ASP 116 Ca 0.01 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.06 2jza n ASP 116 Cb 0.49 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.77 2jza n ASP 116 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2jza s ASN 117 N -0.41 2.60 0.02 1.67 6.03 -1.26 -5.07 114.94 118.52 2jza s ASN 117 Ca 0.00 -1.64 0.00 0.00 -1.03 0.00 0.00 52.86 50.19 2jza s ASN 117 Cb 0.00 -0.08 0.00 0.00 -3.03 0.00 0.00 41.25 38.14 2jza s ASN 117 CO 0.00 -0.35 0.00 -1.20 -2.03 0.00 0.00 177.10 173.52 2jza n SER 118 N 4.57 -6.54 -4.11 3.54 7.64 -1.26 -5.00 113.62 112.46 2jza n SER 118 Ca 0.05 1.09 -0.35 0.00 1.01 0.00 0.00 58.87 60.68 2jza n SER 118 Cb 0.41 -3.54 -0.13 0.00 -1.01 0.00 0.00 64.21 59.95 2jza n SER 118 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2jza s GLN 119 N -1.22 1.99 0.38 1.43 0.74 -1.26 -5.10 119.66 116.62 2jza s GLN 119 Ca 0.00 -1.70 -0.26 0.00 0.05 0.00 0.00 55.36 53.45 2jza s GLN 119 Cb 0.00 -3.40 -0.09 0.00 1.10 0.00 0.00 33.01 30.63 2jza s GLN 119 CO 0.00 -0.93 1.18 -1.25 -0.55 0.00 0.00 175.29 173.74 2jza s PRO 120 N 1.11 4.13 -0.38 1.67 0.04 -1.26 -5.02 135.00 135.29 2jza s PRO 120 Ca 0.05 1.88 -0.07 0.00 0.04 0.00 0.00 61.00 62.91 2jza s PRO 120 Cb -0.21 -2.76 0.07 0.00 0.04 0.00 0.00 34.50 31.64 2jza s PRO 120 CO -0.04 -0.26 0.17 -0.51 0.04 0.00 0.00 177.00 176.39 2jza s LEU 121 N -2.34 4.76 -0.84 -3.56 1.43 -1.26 -5.05 118.68 111.82 2jza s LEU 121 Ca 0.55 -1.43 -0.22 0.00 -1.03 0.00 0.00 54.13 52.00 2jza s LEU 121 Cb -0.32 -1.90 0.08 0.00 0.03 0.00 0.00 46.19 44.09 2jza s LEU 121 CO 0.40 -0.44 1.15 -2.16 0.23 0.00 0.00 176.35 175.54 2jza s PRO 122 N 1.36 3.39 -0.52 1.29 0.04 -1.26 -4.96 135.00 134.34 2jza s PRO 122 Ca 0.01 -1.16 0.00 0.00 0.04 0.00 0.00 61.00 59.89 2jza s PRO 122 Cb -0.21 -4.70 0.14 0.00 0.04 0.00 0.00 34.50 29.76 2jza s PRO 122 CO 0.01 -1.92 0.30 -0.51 0.04 0.00 0.00 177.00 174.92 2jza s LEU 123 N 3.93 4.89 -0.10 -3.56 1.02 -1.26 -5.05 118.68 118.54 2jza s LEU 123 Ca 0.32 -2.69 0.04 0.00 0.02 0.00 0.00 54.13 51.82 2jza s LEU 123 Cb -0.08 -1.76 0.00 0.00 0.02 0.00 0.00 46.19 44.37 2jza s LEU 123 CO -0.00 -0.35 -0.24 -1.61 0.02 0.00 0.00 176.35 174.16 2jza s GLU 124 N 0.17 3.04 -0.36 1.70 0.41 -1.26 -5.10 118.70 117.31 2jza s GLU 124 Ca 0.15 -0.88 0.00 0.00 -0.41 0.00 0.00 54.97 53.83 2jza s GLU 124 Cb -0.22 -2.31 0.12 0.00 -1.78 0.00 0.00 34.13 29.93 2jza s GLU 124 CO -0.03 0.16 0.17 -1.58 -0.49 0.00 0.00 175.26 173.49 2jza s HIS 125 N 0.39 1.57 -0.13 1.61 2.46 -1.26 -5.09 115.29 114.84 2jza s HIS 125 Ca -0.18 -1.92 -0.02 0.00 0.47 0.00 0.00 55.06 53.41 2jza s HIS 125 Cb -0.18 -1.61 -0.03 0.00 -0.13 0.00 0.00 32.58 30.64 2jza s HIS 125 CO 0.08 -0.83 -0.05 -3.38 -2.47 0.00 0.00 174.74 168.09 2jza s HIS 126 N 1.09 3.00 -0.16 3.88 -3.43 -1.26 -5.10 115.29 113.32 2jza s HIS 126 Ca 0.14 -0.23 -0.04 0.00 -0.80 0.00 0.00 55.06 54.13 2jza s HIS 126 Cb -0.21 -1.89 0.07 0.00 -1.43 0.00 0.00 32.58 29.13 2jza s HIS 126 CO -0.12 0.06 0.18 -1.58 -2.00 0.00 0.00 174.74 171.27 2jza s HIS 127 N 0.04 -0.15 -0.23 0.38 2.46 -1.26 -5.13 115.29 111.40 2jza s HIS 127 Ca -0.00 0.24 -0.17 0.00 0.47 0.00 0.00 55.06 55.60 2jza s HIS 127 Cb -0.14 -0.39 -0.03 0.00 -0.13 0.00 0.00 32.58 31.89 2jza s HIS 127 CO 0.03 -0.48 0.48 -1.58 -2.47 0.00 0.00 174.74 170.72 2jza s HIS 128 N 2.28 3.31 -0.16 3.88 2.46 -1.26 -4.95 115.29 120.84 2jza s HIS 128 Ca 0.05 0.64 -0.13 0.00 0.47 0.00 0.00 55.06 56.09 2jza s HIS 128 Cb -0.15 -2.65 -0.07 0.00 -0.13 0.00 0.00 32.58 29.58 2jza s HIS 128 CO -0.09 -0.18 -0.13 1.58 -2.47 0.00 0.00 174.74 173.45 2jza n HIS 129 N 5.12 0.80 -0.65 3.88 -0.00 -1.26 -5.37 115.22 117.74 2jza n HIS 129 Ca -0.06 0.35 0.00 0.00 0.46 0.00 0.00 57.72 58.47 2jza n HIS 129 Cb 0.50 -0.81 0.00 0.00 -0.12 0.00 0.00 29.99 29.56 2jza n HIS 129 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41