#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 0.16 -4.53 6.12 2.88 -1.26 -5.01 113.62 111.98 2jza n SER 2 Ca 0.00 -1.15 -0.42 0.00 -1.33 0.00 0.00 58.87 55.97 2jza n SER 2 Cb 0.00 -0.11 -0.03 0.00 -0.75 0.00 0.00 64.21 63.31 2jza n SER 2 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2jza s GLN 3 N -2.97 3.33 -0.07 -1.46 -0.21 -1.26 -5.01 119.66 112.01 2jza s GLN 3 Ca 0.11 -0.20 0.03 0.00 0.02 0.00 0.00 55.36 55.31 2jza s GLN 3 Cb -0.01 -4.08 -0.02 0.00 1.00 0.00 0.00 33.01 29.90 2jza s GLN 3 CO 0.07 -1.68 -0.15 -1.58 -2.12 0.00 0.00 175.29 169.83 2jza s TRP 4 N 4.50 2.72 -0.12 0.91 0.52 -1.26 -2.89 118.94 123.32 2jza s TRP 4 Ca 0.33 -0.34 0.03 0.00 0.02 0.00 0.00 56.10 56.14 2jza s TRP 4 Cb -0.11 -1.69 -0.00 0.00 -1.15 0.00 0.00 33.47 30.52 2jza s TRP 4 CO 0.19 0.04 -0.21 0.99 0.02 0.00 0.00 176.95 177.98 2jza s THR 5 N -0.36 2.27 -0.36 2.01 2.01 -0.50 -4.95 115.64 115.75 2jza s THR 5 Ca 0.04 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 60.81 2jza s THR 5 Cb -0.12 -1.90 0.01 0.00 0.01 0.00 0.00 72.50 70.50 2jza s THR 5 CO 0.02 0.55 1.20 -0.89 -0.69 0.00 0.00 174.62 174.81 2jza s THR 6 N 0.49 4.25 0.00 -0.82 2.01 -1.26 -2.16 115.64 118.15 2jza s THR 6 Ca -0.14 1.38 0.00 0.00 0.31 0.00 0.00 61.69 63.24 2jza s THR 6 Cb -0.17 -4.36 0.00 0.00 0.01 0.00 0.00 72.50 67.98 2jza s THR 6 CO 0.05 -0.64 0.00 0.52 -0.69 0.00 0.00 174.62 173.86 2jza n VAL 7 N 6.35 0.00 -4.10 3.82 0.31 -0.64 -5.02 118.33 119.06 2jza n VAL 7 Ca 0.13 0.23 -0.10 0.00 -0.01 0.00 0.00 64.34 64.59 2jza n VAL 7 Cb 0.47 -0.75 -0.08 0.00 -0.91 0.00 0.00 33.84 32.57 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 -4.07 2.89 0.00 0.00 1.02 -1.26 0.14 119.74 118.46 2jza s LYS 9 Ca 0.29 -0.41 0.17 0.00 0.02 0.00 0.00 55.97 56.03 2jza s LYS 9 Cb 0.04 -2.46 0.79 0.00 -0.52 0.00 0.00 37.83 35.69 2jza s LYS 9 CO 0.08 -0.50 1.51 -0.11 -0.92 0.00 0.00 175.35 175.40 2jza n LEU 10 N -2.29 0.00 0.07 3.17 7.94 0.90 -1.32 117.00 125.47 2jza n LEU 10 Ca 0.04 0.38 0.11 0.00 -1.11 0.00 0.00 56.01 55.42 2jza n LEU 10 Cb 0.58 -0.38 -0.05 0.00 0.53 0.00 0.00 43.42 44.10 2jza n LEU 10 CO 0.49 -0.17 -0.20 -0.67 -1.11 0.00 0.00 177.39 175.73 2jza n ASP 11 N -1.38 0.63 0.07 1.96 2.03 -1.26 -4.06 116.55 114.54 2jza n ASP 11 Ca 0.06 0.24 -0.02 0.00 0.52 0.00 0.00 54.79 55.60 2jza n ASP 11 Cb 0.16 0.83 -0.06 0.00 -0.72 0.00 0.00 41.12 41.33 2jza n ASP 11 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2jza h ASP 12 N 0.00 0.00 -3.16 1.67 3.32 -1.58 -3.45 116.42 113.22 2jza h ASP 12 Ca -0.01 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.45 2jza h ASP 12 Cb 1.03 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.52 2jza h ASP 12 CO 0.00 0.72 -0.14 -0.63 -1.72 0.00 0.00 179.24 177.47 2jza s ILE 13 N -2.84 5.00 0.20 0.35 1.01 -1.16 -5.01 121.20 118.76 2jza s ILE 13 Ca 0.01 0.97 -0.10 0.00 0.00 0.00 0.00 60.65 61.53 2jza s ILE 13 Cb 0.09 -3.79 -0.07 0.00 0.01 0.00 0.00 42.46 38.70 2jza s ILE 13 CO 0.79 0.50 0.52 -0.76 0.00 0.00 0.00 174.94 175.99 2jza s LEU 14 N -0.57 4.21 -0.00 2.97 1.02 -1.26 -4.96 118.68 120.09 2jza s LEU 14 Ca 0.26 0.89 -0.30 0.00 0.02 0.00 0.00 54.13 55.00 2jza s LEU 14 Cb -0.17 -3.54 -0.07 0.00 0.02 0.00 0.00 46.19 42.43 2jza s LEU 14 CO 0.14 -0.02 1.72 -2.84 0.02 0.00 0.00 176.35 175.37 2jza s PRO 15 N -2.63 4.18 0.00 1.29 0.02 -1.26 -3.33 135.00 133.27 2jza s PRO 15 Ca 0.44 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.78 2jza s PRO 15 Cb -0.12 -3.92 0.00 0.00 0.02 0.00 0.00 34.50 30.49 2jza s PRO 15 CO 0.21 -0.84 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 2jza n GLY 16 N 4.18 0.67 3.29 0.52 0.00 0.91 -4.96 105.19 109.80 2jza n GLY 16 Ca 0.17 -0.46 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 2jza n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jza s THR 17 N -2.69 0.00 -0.30 2.61 -4.23 -0.47 -4.98 115.64 105.58 2jza s THR 17 Ca 0.00 -1.92 -0.05 0.00 -1.18 0.00 0.00 61.69 58.54 2jza s THR 17 Cb 0.00 -2.50 0.18 0.00 1.34 0.00 0.00 72.50 71.52 2jza s THR 17 CO 0.00 0.00 0.75 -0.83 -0.54 0.00 0.00 174.62 174.00 2jza s GLY 18 N -3.25 -0.77 -0.04 3.99 0.00 -1.25 0.40 107.32 106.39 2jza s GLY 18 Ca 0.38 2.18 0.04 0.00 0.00 0.00 0.00 44.72 47.33 2jza s GLY 18 CO 0.19 3.48 -0.18 -1.34 0.00 0.00 0.00 173.10 175.26 2jza s VAL 19 N 2.87 1.45 -0.63 1.40 -7.23 -0.88 -4.65 120.40 112.74 2jza s VAL 19 Ca 0.13 -0.74 -0.28 0.00 -1.81 0.00 0.00 61.98 59.28 2jza s VAL 19 Cb -0.13 -1.24 0.03 0.00 0.56 0.00 0.00 36.38 35.59 2jza s VAL 19 CO -0.18 0.42 1.24 0.00 -0.31 0.00 0.00 175.10 176.27 2jza s ALA 21 N 5.28 3.55 -0.39 0.00 0.00 0.11 -4.80 121.76 125.51 2jza s ALA 21 Ca 0.41 -0.17 -0.24 0.00 0.00 0.00 0.00 51.96 51.96 2jza s ALA 21 Cb -0.08 -2.51 0.01 0.00 0.00 0.00 0.00 23.12 20.54 2jza s ALA 21 CO 0.22 0.47 0.83 -1.17 0.00 0.00 0.00 175.76 176.11 2jza s LEU 22 N -2.40 4.10 -0.58 0.00 1.98 -1.26 -0.76 118.68 119.76 2jza s LEU 22 Ca 0.43 0.32 -0.04 0.00 -2.89 0.00 0.00 54.13 51.95 2jza s LEU 22 Cb -0.13 -3.09 0.15 0.00 0.66 0.00 0.00 46.19 43.78 2jza s LEU 22 CO 0.20 -0.82 0.41 -0.69 -1.89 0.00 0.00 176.35 173.56 2jza s VAL 23 N 3.28 3.79 0.00 1.68 1.01 0.80 -4.93 120.40 126.03 2jza s VAL 23 Ca 0.33 -2.66 0.00 0.00 0.00 0.00 0.00 61.98 59.66 2jza s VAL 23 Cb -0.12 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.77 2jza s VAL 23 CO 0.19 -0.84 0.00 -0.62 0.00 0.00 0.00 175.10 173.83 2jza n GLU 24 N 3.85 0.00 0.00 2.72 -0.58 -1.26 -1.61 120.64 123.76 2jza n GLU 24 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 2jza n GLU 24 Cb 0.39 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.26 2jza n GLU 24 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2jza n GLN 25 N 0.00 2.24 -4.47 3.49 6.02 -1.26 -4.94 117.38 118.46 2jza n GLN 25 Ca 0.00 -0.03 -0.23 0.00 -0.01 0.00 0.00 57.00 56.73 2jza n GLN 25 Cb 0.00 -0.27 -0.10 0.00 1.02 0.00 0.00 30.24 30.89 2jza n GLN 25 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jza s GLN 26 N -0.33 1.64 -0.19 -1.09 -1.52 -0.63 -4.83 119.66 112.71 2jza s GLN 26 Ca 0.00 -1.81 -0.07 0.00 -1.95 0.00 0.00 55.36 51.52 2jza s GLN 26 Cb 0.00 -1.44 -0.04 0.00 -0.22 0.00 0.00 33.01 31.31 2jza s GLN 26 CO 0.00 0.14 0.06 -0.65 -0.25 0.00 0.00 175.29 174.59 2jza s GLN 27 N -3.64 3.93 -0.14 2.91 -0.21 -1.26 -0.14 119.66 121.10 2jza s GLN 27 Ca 0.30 -0.37 -0.00 0.00 0.02 0.00 0.00 55.36 55.31 2jza s GLN 27 Cb 0.01 -3.21 0.03 0.00 1.00 0.00 0.00 33.01 30.84 2jza s GLN 27 CO 0.13 0.22 -0.10 0.42 -2.12 0.00 0.00 175.29 173.84 2jza s ILE 28 N 0.51 1.29 -0.16 1.08 1.01 0.06 -4.64 121.20 120.35 2jza s ILE 28 Ca 0.03 -0.51 -0.21 0.00 0.00 0.00 0.00 60.65 59.95 2jza s ILE 28 Cb -0.13 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 2jza s ILE 28 CO 0.01 0.36 0.63 0.00 0.00 0.00 0.00 174.94 175.94 2jza s ALA 29 N 1.59 3.50 -0.40 9.38 0.00 0.13 0.04 121.76 136.00 2jza s ALA 29 Ca 0.04 -0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.74 2jza s ALA 29 Cb -0.13 -2.93 0.07 0.00 0.00 0.00 0.00 23.12 20.13 2jza s ALA 29 CO -0.09 -0.40 0.22 0.08 0.00 0.00 0.00 175.76 175.57 2jza s VAL 30 N 1.55 4.05 -0.11 0.00 1.01 0.85 -1.23 120.40 126.52 2jza s VAL 30 Ca 0.30 -1.41 -0.18 0.00 0.00 0.00 0.00 61.98 60.69 2jza s VAL 30 Cb -0.16 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2jza s VAL 30 CO 0.12 -0.46 0.48 0.12 0.00 0.00 0.00 175.10 175.35 2jza s PHE 31 N 1.39 3.52 -0.31 5.22 5.36 0.88 -2.08 117.98 131.96 2jza s PHE 31 Ca 0.03 0.90 -0.01 0.00 -0.96 0.00 0.00 56.93 56.89 2jza s PHE 31 Cb -0.22 -2.55 0.10 0.00 -0.34 0.00 0.00 43.02 40.01 2jza s PHE 31 CO 0.02 0.18 0.09 0.50 -1.46 0.00 0.00 175.22 174.55 2jza s ARG 32 N 0.58 0.76 0.19 10.12 3.52 0.16 -0.20 118.95 134.08 2jza s ARG 32 Ca 0.26 -1.10 0.03 0.00 -0.13 0.00 0.00 55.73 54.79 2jza s ARG 32 Cb -0.15 -2.06 0.09 0.00 -1.56 0.00 0.00 34.95 31.27 2jza s ARG 32 CO 0.10 -0.97 1.45 -1.00 -0.81 0.00 0.00 175.30 174.07 2jza h PRO 33 N 8.07 0.21 -5.25 5.12 0.13 -1.79 0.29 132.00 138.78 2jza h PRO 33 Ca -0.13 -0.19 -0.44 0.00 -0.87 0.00 0.00 66.00 64.37 2jza h PRO 33 Cb 1.02 0.05 -0.14 0.00 0.13 0.00 0.00 31.00 32.05 2jza h PRO 33 CO 0.47 0.88 -0.65 -0.98 -0.23 0.00 0.00 178.00 177.49 2jza s ARG 34 N -3.42 1.47 -0.07 0.86 1.70 -1.26 -3.56 118.95 114.66 2jza s ARG 34 Ca -0.03 -1.76 0.01 0.00 -0.47 0.00 0.00 55.73 53.48 2jza s ARG 34 Cb 0.11 -0.84 0.14 0.00 -0.57 0.00 0.00 34.95 33.78 2jza s ARG 34 CO 0.82 -0.07 1.02 0.27 -1.08 0.00 0.00 175.30 176.26 2jza n ASN 35 N -0.52 2.70 0.00 -2.89 6.94 -1.26 -4.60 115.26 115.63 2jza n ASN 35 Ca -0.05 -2.26 0.00 0.00 -0.02 0.00 0.00 54.58 52.25 2jza n ASN 35 Cb 0.64 -0.55 0.00 0.00 -2.36 0.00 0.00 39.78 37.51 2jza n ASN 35 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2jza n ASP 36 N 0.16 0.68 0.05 0.53 8.00 -1.26 -5.02 116.55 119.69 2jza n ASP 36 Ca 0.09 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.72 2jza n ASP 36 Cb 0.62 0.00 0.35 0.00 -0.02 0.00 0.00 41.12 42.07 2jza n ASP 36 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2jza n GLU 37 N 0.00 0.17 -2.20 -1.24 1.02 -1.26 -4.75 120.64 112.38 2jza n GLU 37 Ca 0.00 0.09 -0.39 0.00 -0.02 0.00 0.00 57.16 56.84 2jza n GLU 37 Cb 0.00 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 29.74 2jza n GLU 37 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2jza s GLN 38 N -3.08 2.82 0.13 3.49 1.11 -1.26 -4.88 119.66 117.99 2jza s GLN 38 Ca 0.10 0.35 0.06 0.00 0.01 0.00 0.00 55.36 55.88 2jza s GLN 38 Cb 0.15 -4.32 -0.04 0.00 -1.01 0.00 0.00 33.01 27.79 2jza s GLN 38 CO 0.64 -2.53 -0.13 0.14 0.01 0.00 0.00 175.29 173.42 2jza s VAL 39 N 7.96 1.30 -0.28 1.09 -7.23 -1.26 -4.26 120.40 117.72 2jza s VAL 39 Ca 0.57 -1.83 -0.01 0.00 -1.81 0.00 0.00 61.98 58.90 2jza s VAL 39 Cb -0.11 -1.63 0.09 0.00 0.56 0.00 0.00 36.38 35.28 2jza s VAL 39 CO 0.19 -0.52 0.07 -0.31 -0.31 0.00 0.00 175.10 174.22 2jza s TYR 40 N -2.51 1.73 -0.60 2.82 2.02 0.72 -4.97 117.35 116.55 2jza s TYR 40 Ca 0.12 -1.62 -0.13 0.00 -0.37 0.00 0.00 57.07 55.07 2jza s TYR 40 Cb -0.03 -1.62 0.15 0.00 -0.40 0.00 0.00 41.96 40.06 2jza s TYR 40 CO 0.03 -0.82 0.51 0.00 -1.57 0.00 0.00 175.55 173.70 2jza s ALA 41 N 1.61 3.67 0.38 3.71 0.00 -1.26 -0.09 121.76 129.79 2jza s ALA 41 Ca 0.06 -2.78 0.06 0.00 0.00 0.00 0.00 51.96 49.30 2jza s ALA 41 Cb -0.17 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2jza s ALA 41 CO -0.20 -2.05 0.20 0.44 0.00 0.00 0.00 175.76 174.15 2jza n ILE 42 N 4.71 0.00 -1.29 0.00 -5.35 -0.36 -4.35 119.36 112.72 2jza n ILE 42 Ca -0.04 -2.41 -0.38 0.00 -0.27 0.00 0.00 62.75 59.65 2jza n ILE 42 Cb 0.42 1.01 -0.03 0.00 -1.74 0.00 0.00 39.64 39.30 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 -1.59 8.14 -2.41 7.28 7.64 -0.42 0.22 113.62 132.47 2jza n SER 43 Ca -0.00 -2.57 -0.28 0.00 1.01 0.00 0.00 58.87 57.03 2jza n SER 43 Cb 0.61 -1.53 -0.01 0.00 -1.01 0.00 0.00 64.21 62.28 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 3.82 6.79 -4.67 6.43 4.05 -1.26 -4.44 115.26 125.97 2jza n ASN 44 Ca 0.74 -3.35 -0.35 0.00 0.45 0.00 0.00 54.58 52.08 2jza n ASN 44 Cb 0.23 -1.14 -0.09 0.00 1.23 0.00 0.00 39.78 40.01 2jza n ASN 44 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2jza s ILE 45 N -3.02 4.91 -0.22 -1.44 1.09 -1.26 -4.33 121.20 116.93 2jza s ILE 45 Ca 0.52 0.01 -0.27 0.00 -1.10 0.00 0.00 60.65 59.81 2jza s ILE 45 Cb 0.38 -3.20 -0.00 0.00 -1.06 0.00 0.00 42.46 38.57 2jza s ILE 45 CO -0.18 0.48 0.93 -0.62 -0.10 0.00 0.00 174.94 175.44 2jza s ASP 46 N 0.19 6.99 0.62 3.58 -1.08 -0.49 -4.93 116.67 121.55 2jza s ASP 46 Ca 0.05 1.23 0.32 0.00 -0.52 0.00 0.00 52.55 53.63 2jza s ASP 46 Cb -0.12 -2.49 1.83 0.00 -1.46 0.00 0.00 42.92 40.68 2jza s ASP 46 CO 0.00 -0.56 2.15 -0.65 0.52 0.00 0.00 175.17 176.64 2jza h PRO 47 N 7.49 0.00 0.00 4.34 0.11 -1.97 0.37 132.00 142.34 2jza h PRO 47 Ca -0.23 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.87 2jza h PRO 47 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2jza h PRO 47 CO 0.91 0.00 -0.45 0.35 -0.21 0.00 0.00 178.00 178.60 2jza h PHE 48 N 0.00 0.00 0.00 0.65 3.57 -1.95 -3.35 116.94 115.85 2jza h PHE 48 Ca 0.05 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2jza h PHE 48 Cb 0.35 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2jza h PHE 48 CO 0.00 0.04 -1.27 0.00 -2.23 0.00 0.00 178.31 174.85 2jza n ALA 49 N -2.14 2.19 -1.43 2.41 0.00 -0.38 -4.99 120.51 116.17 2jza n ALA 49 Ca 0.02 -0.15 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2jza n ALA 49 Cb 0.55 -0.18 -0.06 0.00 0.00 0.00 0.00 19.45 19.76 2jza n ALA 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jza n GLN 50 N -1.73 -1.17 -4.26 0.00 6.02 0.11 -4.96 117.38 111.41 2jza n GLN 50 Ca -0.01 1.02 -0.14 0.00 -0.01 0.00 0.00 57.00 57.85 2jza n GLN 50 Cb 0.18 -5.21 -0.10 0.00 1.02 0.00 0.00 30.24 26.13 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jza s ALA 51 N -2.49 1.44 -0.16 -1.58 0.00 -1.25 -4.92 121.76 112.80 2jza s ALA 51 Ca 0.00 -1.77 -0.06 0.00 0.00 0.00 0.00 51.96 50.13 2jza s ALA 51 Cb 0.00 1.18 -0.21 0.00 0.00 0.00 0.00 23.12 24.09 2jza s ALA 51 CO 0.00 -0.51 3.47 -1.13 0.00 0.00 0.00 175.76 177.59 2jza n SER 52 N -0.36 5.62 0.25 0.00 3.41 -1.26 -1.40 113.62 119.88 2jza n SER 52 Ca 0.01 -2.58 0.16 0.00 -0.26 0.00 0.00 58.87 56.20 2jza n SER 52 Cb 0.66 -1.40 0.63 0.00 -0.26 0.00 0.00 64.21 63.84 2jza n SER 52 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2jza h VAL 53 N 2.06 0.00 -0.57 -3.33 -1.51 -1.88 -1.84 116.25 109.19 2jza h VAL 53 Ca 0.26 -0.48 -0.02 0.00 -1.23 0.00 0.00 66.70 65.23 2jza h VAL 53 Cb 1.34 1.44 -0.03 0.00 -2.13 0.00 0.00 31.29 31.91 2jza h VAL 53 CO 0.41 0.00 0.28 -0.07 -1.23 0.00 0.00 177.57 176.96 2jza h LEU 54 N 0.00 0.74 -1.17 4.19 3.38 -1.77 -2.57 115.31 118.11 2jza h LEU 54 Ca 0.00 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2jza h LEU 54 Cb 0.51 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2jza h LEU 54 CO 0.00 0.65 -0.18 0.28 0.09 0.00 0.00 178.44 179.29 2jza h SER 55 N 0.77 0.00 -0.54 -0.43 0.02 -1.55 -2.80 113.55 109.02 2jza h SER 55 Ca 0.20 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2jza h SER 55 Cb 0.10 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2jza h SER 55 CO -0.03 0.18 0.01 -1.14 -1.14 0.00 0.00 176.83 174.72 2jza n ARG 56 N -3.34 4.57 0.00 3.45 0.63 -0.99 -4.72 116.66 116.27 2jza n ARG 56 Ca 0.00 -2.92 0.00 0.00 -0.92 0.00 0.00 57.85 54.02 2jza n ARG 56 Cb 0.41 -2.21 0.00 0.00 0.45 0.00 0.00 32.46 31.10 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jza n GLY 57 N 0.54 1.58 3.59 5.14 0.00 -1.06 -4.90 105.19 110.09 2jza n GLY 57 Ca 0.26 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 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 2.12 4.91 -0.29 -0.61 1.09 0.09 -4.88 121.20 123.63 2jza s ILE 58 Ca 0.00 0.77 -0.04 0.00 -1.10 0.00 0.00 60.65 60.29 2jza s ILE 58 Cb 0.00 -4.04 0.03 0.00 -1.06 0.00 0.00 42.46 37.39 2jza s ILE 58 CO 0.00 -0.22 0.02 -0.69 -0.10 0.00 0.00 174.94 173.95 2jza s VAL 59 N 2.67 3.33 0.13 2.92 1.01 -1.26 -0.42 120.40 128.78 2jza s VAL 59 Ca 0.25 -1.05 -0.24 0.00 0.00 0.00 0.00 61.98 60.95 2jza s VAL 59 Cb -0.15 -2.79 0.07 0.00 0.00 0.00 0.00 36.38 33.52 2jza s VAL 59 CO 0.13 0.03 0.63 0.00 0.00 0.00 0.00 175.10 175.89 2jza s ALA 60 N 1.36 -1.63 0.75 5.51 0.00 -1.20 -5.06 121.76 121.49 2jza s ALA 60 Ca -0.01 0.61 -0.11 0.00 0.00 0.00 0.00 51.96 52.45 2jza s ALA 60 Cb -0.18 0.77 0.04 0.00 0.00 0.00 0.00 23.12 23.75 2jza s ALA 60 CO -0.01 -0.73 1.08 -1.21 0.00 0.00 0.00 175.76 174.90 2jza s GLU 61 N -3.46 2.50 -0.38 0.00 8.01 -1.26 -2.56 118.70 121.54 2jza s GLU 61 Ca 0.00 0.69 0.07 0.00 0.01 0.00 0.00 54.97 55.75 2jza s GLU 61 Cb -0.01 -1.96 0.44 0.00 -4.31 0.00 0.00 34.13 28.29 2jza s GLU 61 CO -0.11 -1.34 1.12 1.58 0.01 0.00 0.00 175.26 176.52 2jza n HIS 62 N -3.25 2.98 -1.98 1.61 -0.00 -0.48 -4.86 115.22 109.23 2jza n HIS 62 Ca 0.07 -2.78 -0.17 0.00 0.46 0.00 0.00 57.72 55.30 2jza n HIS 62 Cb 0.56 -0.19 -0.04 0.00 -0.12 0.00 0.00 29.99 30.20 2jza n HIS 62 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2jza n GLN 63 N -0.53 -1.68 0.10 1.57 6.02 -1.26 -4.34 117.38 117.27 2jza n GLN 63 Ca 0.37 0.89 0.00 0.00 -0.01 0.00 0.00 57.00 58.25 2jza n GLN 63 Cb 0.77 -5.37 0.00 0.00 1.02 0.00 0.00 30.24 26.66 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 -1.43 -1.80 -1.93 1.08 2.03 -1.26 -5.17 116.55 108.07 2jza n ASP 64 Ca -0.18 0.44 -0.07 0.00 0.52 0.00 0.00 54.79 55.50 2jza n ASP 64 Cb 0.60 1.91 -0.02 0.00 -0.72 0.00 0.00 41.12 42.89 2jza n ASP 64 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jza n ASP 65 N -2.90 0.34 -4.32 1.67 -0.08 -1.26 -5.13 116.55 104.86 2jza n ASP 65 Ca 0.00 -1.68 -0.39 0.00 -1.51 0.00 0.00 54.79 51.21 2jza n ASP 65 Cb 0.00 0.43 -0.12 0.00 2.34 0.00 0.00 41.12 43.77 2jza n ASP 65 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2jza s LEU 66 N 0.00 4.50 -0.10 -2.67 1.43 -1.26 -1.38 118.68 119.20 2jza s LEU 66 Ca 0.10 -1.08 0.03 0.00 -1.03 0.00 0.00 54.13 52.15 2jza s LEU 66 Cb 0.00 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.30 2jza s LEU 66 CO 0.07 -0.35 -0.20 0.26 0.23 0.00 0.00 176.35 176.36 2jza s TRP 67 N 1.47 2.22 -0.00 0.29 0.52 -1.06 -2.68 118.94 119.69 2jza s TRP 67 Ca -0.00 -0.94 -0.01 0.00 0.02 0.00 0.00 56.10 55.17 2jza s TRP 67 Cb -0.19 -1.53 -0.04 0.00 -1.15 0.00 0.00 33.47 30.56 2jza s TRP 67 CO 0.04 -0.42 0.10 0.54 0.02 0.00 0.00 176.95 177.24 2jza s VAL 68 N 0.57 4.86 -0.21 4.03 0.11 0.20 -3.22 120.40 126.73 2jza s VAL 68 Ca -0.15 -0.37 -0.00 0.00 -2.93 0.00 0.00 61.98 58.53 2jza s VAL 68 Cb -0.17 -3.24 0.02 0.00 -1.53 0.00 0.00 36.38 31.47 2jza s VAL 68 CO 0.05 0.34 -0.12 0.00 -3.33 0.00 0.00 175.10 172.03 2jza s ALA 69 N -1.23 2.54 0.44 1.54 0.00 0.44 -1.49 121.76 124.01 2jza s ALA 69 Ca 0.24 -1.33 -0.23 0.00 0.00 0.00 0.00 51.96 50.64 2jza s ALA 69 Cb -0.12 -1.46 -0.08 0.00 0.00 0.00 0.00 23.12 21.46 2jza s ALA 69 CO 0.15 -0.58 1.08 0.45 0.00 0.00 0.00 175.76 176.87 2jza s SER 70 N 1.32 6.44 0.51 0.00 0.15 -1.23 -0.73 113.70 120.15 2jza s SER 70 Ca 0.02 2.09 0.30 0.00 0.70 0.00 0.00 55.95 59.07 2jza s SER 70 Cb -0.15 -2.58 1.10 0.00 -1.71 0.00 0.00 66.02 62.68 2jza s SER 70 CO -0.08 -0.72 1.89 1.55 1.20 0.00 0.00 173.24 177.08 2jza h PRO 71 N 2.08 0.00 0.00 5.44 0.13 -1.90 -0.95 132.00 136.80 2jza h PRO 71 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jza h PRO 71 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2jza h PRO 71 CO 0.61 0.03 -0.19 1.28 -0.23 0.00 0.00 178.00 179.50 2jza n LEU 72 N -3.13 0.39 -0.22 1.56 7.99 -1.26 -4.65 117.00 117.68 2jza n LEU 72 Ca 0.01 0.11 -0.06 0.00 -0.01 0.00 0.00 56.01 56.06 2jza n LEU 72 Cb 0.37 -0.55 0.08 0.00 -0.11 0.00 0.00 43.42 43.21 2jza n LEU 72 CO 0.29 -0.46 0.94 0.11 -1.51 0.00 0.00 177.39 176.76 2jza h LYS 73 N -0.20 1.06 -0.17 3.23 1.79 -1.98 -3.46 116.57 116.83 2jza h LYS 73 Ca 0.00 -0.26 -0.07 0.00 -2.18 0.00 0.00 60.65 58.14 2jza h LYS 73 Cb 0.19 -0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 30.67 2jza h LYS 73 CO 0.00 0.95 -0.07 1.17 -1.08 0.00 0.00 179.45 180.42 2jza n LYS 74 N -4.23 -1.70 -3.29 3.15 4.81 -0.36 -4.91 118.16 111.62 2jza n LYS 74 Ca 0.05 0.59 -0.32 0.00 -0.87 0.00 0.00 58.31 57.75 2jza n LYS 74 Cb 0.26 -4.92 -0.06 0.00 0.02 0.00 0.00 35.03 30.33 2jza n LYS 74 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2jza s GLN 75 N -2.14 3.89 -0.23 1.64 -1.52 -1.26 -4.61 119.66 115.42 2jza s GLN 75 Ca 0.00 0.44 -0.20 0.00 -1.95 0.00 0.00 55.36 53.65 2jza s GLN 75 Cb 0.00 -2.55 -0.02 0.00 -0.22 0.00 0.00 33.01 30.22 2jza s GLN 75 CO 0.00 0.25 0.61 -1.01 -0.25 0.00 0.00 175.29 174.89 2jza s HIS 76 N -1.89 3.32 0.02 0.91 3.76 -1.25 -3.54 115.29 116.61 2jza s HIS 76 Ca 0.50 0.84 0.07 0.00 -0.15 0.00 0.00 55.06 56.33 2jza s HIS 76 Cb -0.11 -2.80 -0.03 0.00 1.11 0.00 0.00 32.58 30.75 2jza s HIS 76 CO 0.20 -0.25 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.57 2jza s PHE 77 N 2.19 2.48 -0.23 1.40 0.08 -0.55 -0.11 117.98 123.23 2jza s PHE 77 Ca 0.27 -0.31 -0.29 0.00 0.12 0.00 0.00 56.93 56.71 2jza s PHE 77 Cb -0.16 -1.47 0.01 0.00 -0.57 0.00 0.00 43.02 40.83 2jza s PHE 77 CO 0.09 0.16 1.06 1.03 -0.10 0.00 0.00 175.22 177.47 2jza s ARG 78 N -1.16 4.24 0.13 0.44 0.52 -0.93 -0.63 118.95 121.56 2jza s ARG 78 Ca 0.13 1.36 -0.28 0.00 -0.52 0.00 0.00 55.73 56.42 2jza s ARG 78 Cb -0.10 -3.66 -0.05 0.00 0.52 0.00 0.00 34.95 31.66 2jza s ARG 78 CO 0.03 -0.66 1.60 -0.07 0.02 0.00 0.00 175.30 176.22 2jza h LEU 79 N 9.53 -1.06 -1.95 2.53 3.38 -1.86 -0.49 115.31 125.38 2jza h LEU 79 Ca -0.20 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2jza h LEU 79 Cb 1.06 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2jza h LEU 79 CO 0.98 -0.40 0.00 0.00 0.09 0.00 0.00 178.44 179.11 2jza n TYR 80 N -5.42 0.85 0.06 1.13 4.11 -1.26 -4.34 117.16 112.28 2jza n TYR 80 Ca -0.05 -0.33 0.00 0.00 -0.00 0.00 0.00 57.90 57.53 2jza n TYR 80 Cb 0.34 -0.19 0.00 0.00 -0.00 0.00 0.00 39.34 39.49 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 0.44 0.89 0.00 9.48 2.03 -0.75 -4.98 116.55 123.66 2jza n ASP 81 Ca 0.14 0.17 0.00 0.00 0.52 0.00 0.00 54.79 55.62 2jza n ASP 81 Cb 0.57 -0.23 0.00 0.00 -0.72 0.00 0.00 41.12 40.74 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 3.25 2.27 3.91 0.27 0.00 -0.27 -4.39 105.19 110.22 2jza n GLY 82 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.15 3.18 0.36 1.61 0.08 -1.26 -0.84 117.98 118.95 2jza s PHE 83 Ca 0.00 0.75 0.08 0.00 0.12 0.00 0.00 56.93 57.88 2jza s PHE 83 Cb 0.00 -3.01 -0.05 0.00 -0.57 0.00 0.00 43.02 39.39 2jza s PHE 83 CO 0.00 -1.15 0.13 0.00 -0.10 0.00 0.00 175.22 174.10 2jza n LEU 85 N -1.15 0.04 0.13 0.00 7.94 0.85 -4.71 117.00 120.10 2jza n LEU 85 Ca -0.03 0.14 0.12 0.00 -1.11 0.00 0.00 56.01 55.13 2jza n LEU 85 Cb 0.62 -0.51 0.06 0.00 0.53 0.00 0.00 43.42 44.13 2jza n LEU 85 CO 0.44 -0.50 0.27 -0.33 -1.11 0.00 0.00 177.39 176.16 2jza h GLU 86 N -0.02 0.00 0.00 1.96 3.07 -1.95 -3.47 114.58 114.17 2jza h GLU 86 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jza h GLU 86 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 2jza h GLU 86 CO 0.00 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 174.14 2jza n ASP 87 N -2.74 0.00 0.00 1.42 2.03 -1.26 -5.02 116.55 110.98 2jza n ASP 87 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2jza n ASP 87 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 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 5.00 0.86 0.15 0.27 0.00 -1.26 -4.76 105.19 105.46 2jza n GLY 88 Ca 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 1.10 -1.69 4.61 0.00 -2.01 -3.26 119.26 118.00 2jza h ALA 89 Ca 0.00 -0.49 -0.73 0.00 0.00 0.00 0.00 54.91 53.69 2jza h ALA 89 Cb 0.00 -0.09 -0.33 0.00 0.00 0.00 0.00 17.79 17.38 2jza h ALA 89 CO 0.00 0.67 0.39 0.66 0.00 0.00 0.00 179.25 180.98 2jza n TYR 90 N -3.90 3.18 -3.20 0.00 4.01 -1.26 -4.99 117.16 111.00 2jza n TYR 90 Ca -0.01 -3.10 -0.40 0.00 -0.16 0.00 0.00 57.90 54.22 2jza n TYR 90 Cb 0.55 -0.94 -0.07 0.00 -0.31 0.00 0.00 39.34 38.57 2jza n TYR 90 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2jza s SER 91 N -2.13 6.53 0.42 7.72 1.04 -1.23 -4.84 113.70 121.21 2jza s SER 91 Ca 0.42 0.64 0.01 0.00 0.48 0.00 0.00 55.95 57.49 2jza s SER 91 Cb 0.20 -2.30 -0.01 0.00 0.10 0.00 0.00 66.02 64.01 2jza s SER 91 CO -0.10 -0.27 0.64 0.68 0.98 0.00 0.00 173.24 175.16 2jza s VAL 92 N 2.11 4.20 -0.10 5.02 -7.23 -0.02 -4.97 120.40 119.41 2jza s VAL 92 Ca 0.24 -0.52 -0.18 0.00 -1.81 0.00 0.00 61.98 59.71 2jza s VAL 92 Cb -0.16 -3.54 -0.04 0.00 0.56 0.00 0.00 36.38 33.20 2jza s VAL 92 CO 0.09 -0.36 0.49 0.00 -0.31 0.00 0.00 175.10 175.01 2jza s ALA 93 N -2.49 3.49 -0.46 1.32 0.00 -1.26 -4.41 121.76 117.95 2jza s ALA 93 Ca 0.47 -0.16 -0.05 0.00 0.00 0.00 0.00 51.96 52.22 2jza s ALA 93 Cb -0.10 -2.64 0.12 0.00 0.00 0.00 0.00 23.12 20.50 2jza s ALA 93 CO 0.37 0.05 0.28 0.00 0.00 0.00 0.00 175.76 176.47 2jza s ALA 94 N 0.42 3.30 0.47 0.00 0.00 -1.26 -1.30 121.76 123.39 2jza s ALA 94 Ca 0.27 -2.64 -0.20 0.00 0.00 0.00 0.00 51.96 49.39 2jza s ALA 94 Cb -0.16 -2.59 -0.09 0.00 0.00 0.00 0.00 23.12 20.28 2jza s ALA 94 CO 0.11 -1.88 1.00 0.71 0.00 0.00 0.00 175.76 175.70 2jza s TYR 95 N 1.05 3.18 -0.09 0.00 2.02 -1.26 -5.00 117.35 117.25 2jza s TYR 95 Ca 0.09 1.57 -0.30 0.00 -0.37 0.00 0.00 57.07 58.06 2jza s TYR 95 Cb -0.23 -2.94 -0.03 0.00 -0.40 0.00 0.00 41.96 38.36 2jza s TYR 95 CO -0.03 -0.49 1.28 0.34 -1.57 0.00 0.00 175.55 175.08 2jza s ASP 96 N -2.25 6.96 0.24 2.29 -1.08 -1.26 -4.85 116.67 116.71 2jza s ASP 96 Ca 0.64 1.83 0.09 0.00 -0.52 0.00 0.00 52.55 54.58 2jza s ASP 96 Cb -0.12 -2.55 -0.05 0.00 -1.46 0.00 0.00 42.92 38.74 2jza s ASP 96 CO 0.20 -0.70 -0.14 0.42 0.52 0.00 0.00 175.17 175.47 2jza s THR 97 N 2.88 1.91 -0.15 1.71 -4.23 -1.26 -0.55 115.64 115.96 2jza s THR 97 Ca 0.57 -2.25 -0.30 0.00 -1.18 0.00 0.00 61.69 58.54 2jza s THR 97 Cb -0.25 -2.18 0.13 0.00 1.34 0.00 0.00 72.50 71.53 2jza s THR 97 CO 0.20 -0.49 0.99 -1.58 -0.54 0.00 0.00 174.62 173.20 2jza s GLN 98 N -3.62 0.61 -0.50 3.99 0.74 -0.38 -4.99 119.66 115.51 2jza s GLN 98 Ca 0.26 0.09 -0.19 0.00 0.05 0.00 0.00 55.36 55.56 2jza s GLN 98 Cb -0.01 0.28 0.05 0.00 1.10 0.00 0.00 33.01 34.44 2jza s GLN 98 CO 0.10 -0.20 0.62 0.08 -0.55 0.00 0.00 175.29 175.34 2jza s VAL 99 N -1.36 4.87 -0.18 1.34 1.01 -1.25 -1.23 120.40 123.60 2jza s VAL 99 Ca -0.01 -0.41 0.09 0.00 0.00 0.00 0.00 61.98 61.65 2jza s VAL 99 Cb -0.01 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.93 2jza s VAL 99 CO 0.00 -0.77 -0.04 1.07 0.00 0.00 0.00 175.10 175.36 2jza n THR 100 N 5.64 1.12 -2.22 3.92 5.66 -1.08 -4.64 114.28 122.68 2jza n THR 100 Ca -0.06 -0.58 0.04 0.00 -3.05 0.00 0.00 64.05 60.40 2jza n THR 100 Cb 0.46 -0.85 0.08 0.00 -1.55 0.00 0.00 70.33 68.47 2jza n THR 100 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2jza n ASN 101 N -2.80 1.37 0.00 1.09 3.02 -1.26 -4.90 115.26 111.78 2jza n ASN 101 Ca -0.30 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.59 2jza n ASN 101 Cb 0.96 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 2jza n ASN 101 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jza n GLY 102 N -0.11 0.85 3.53 7.41 0.00 -1.26 -5.04 105.19 110.57 2jza n GLY 102 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.01 4.09 -0.38 1.61 2.20 -1.26 -0.07 114.94 118.13 2jza s ASN 103 Ca 0.00 -0.54 -0.18 0.00 -0.94 0.00 0.00 52.86 51.20 2jza s ASN 103 Cb 0.00 -0.65 0.00 0.00 -2.00 0.00 0.00 41.25 38.60 2jza s ASN 103 CO 0.00 0.15 0.49 -0.69 -2.94 0.00 0.00 177.10 174.11 2jza s VAL 104 N -1.35 5.03 -0.03 3.54 1.01 0.12 -2.63 120.40 126.09 2jza s VAL 104 Ca 0.21 0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.34 2jza s VAL 104 Cb -0.10 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2jza s VAL 104 CO 0.12 -0.30 -0.17 -1.10 0.00 0.00 0.00 175.10 173.66 2jza s GLN 105 N 2.34 2.38 0.13 2.72 -0.21 -0.36 -1.62 119.66 125.03 2jza s GLN 105 Ca 0.17 -0.77 0.07 0.00 0.02 0.00 0.00 55.36 54.84 2jza s GLN 105 Cb -0.16 -2.30 -0.04 0.00 1.00 0.00 0.00 33.01 31.51 2jza s GLN 105 CO 0.14 0.60 -0.04 0.96 -2.12 0.00 0.00 175.29 174.83 2jza s ILE 106 N -0.74 3.63 -0.58 1.08 -0.00 -0.92 -1.25 121.20 122.43 2jza s ILE 106 Ca 0.12 -1.28 -0.23 0.00 -0.00 0.00 0.00 60.65 59.25 2jza s ILE 106 Cb -0.10 -2.76 0.05 0.00 -0.00 0.00 0.00 42.46 39.65 2jza s ILE 106 CO 0.01 0.02 0.92 -0.55 -0.00 0.00 0.00 174.94 175.34 2jza s SER 107 N -2.53 6.28 0.19 4.36 0.15 0.29 -1.42 113.70 121.02 2jza s SER 107 Ca 0.25 -0.60 -0.30 0.00 0.70 0.00 0.00 55.95 56.00 2jza s SER 107 Cb -0.10 -2.42 -0.08 0.00 -1.71 0.00 0.00 66.02 61.71 2jza s SER 107 CO 0.17 -1.26 1.14 0.27 1.20 0.00 0.00 173.24 174.76 2jza s ILE 108 N 3.85 3.69 -0.52 6.45 -5.25 -1.14 -4.53 121.20 123.76 2jza s ILE 108 Ca 0.26 1.47 0.03 0.00 -0.99 0.00 0.00 60.65 61.42 2jza s ILE 108 Cb -0.14 -3.94 0.14 0.00 2.95 0.00 0.00 42.46 41.47 2jza s ILE 108 CO 0.16 0.25 0.30 0.00 -1.79 0.00 0.00 174.94 173.86 2jza s ALA 109 N -0.25 2.84 0.19 2.27 0.00 -1.26 -4.93 121.76 120.61 2jza s ALA 109 Ca 0.50 -3.07 -0.30 0.00 0.00 0.00 0.00 51.96 49.10 2jza s ALA 109 Cb -0.31 -2.02 -0.08 0.00 0.00 0.00 0.00 23.12 20.71 2jza s ALA 109 CO 0.36 -2.05 1.05 0.16 0.00 0.00 0.00 175.76 175.29 2jza s ASP 110 N -0.23 7.36 0.00 0.00 -4.77 -1.26 -4.99 116.67 112.78 2jza s ASP 110 Ca 0.20 2.04 0.00 0.00 -3.30 0.00 0.00 52.55 51.49 2jza s ASP 110 Cb -0.20 -2.61 0.00 0.00 -1.09 0.00 0.00 42.92 39.03 2jza s ASP 110 CO -0.04 -0.13 0.00 -1.20 0.70 0.00 0.00 175.17 174.50 2jza n SER 111 N 2.15 0.00 -3.15 2.11 7.64 -1.26 -5.09 113.62 116.02 2jza n SER 111 Ca 0.01 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.95 2jza n SER 111 Cb 0.47 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.66 2jza n SER 111 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jza s ASP 112 N -0.50 -0.32 -0.02 6.43 2.15 -1.26 -5.16 116.67 117.98 2jza s ASP 112 Ca 0.00 0.05 0.00 0.00 0.43 0.00 0.00 52.55 53.03 2jza s ASP 112 Cb 0.00 1.21 0.02 0.00 -0.30 0.00 0.00 42.92 43.85 2jza s ASP 112 CO 0.00 -0.06 0.01 -0.69 -0.17 0.00 0.00 175.17 174.26 2jza s VAL 113 N 2.97 0.02 0.85 1.11 1.01 -1.26 -5.16 120.40 119.94 2jza s VAL 113 Ca 0.27 0.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.25 2jza s VAL 113 Cb -0.02 -0.11 0.10 0.00 0.00 0.00 0.00 36.38 36.36 2jza s VAL 113 CO -0.22 0.08 1.11 0.00 0.00 0.00 0.00 175.10 176.06 2jza s ALA 114 N 0.73 1.98 -0.41 5.51 0.00 -1.26 -4.97 121.76 123.33 2jza s ALA 114 Ca -0.06 -0.29 -0.23 0.00 0.00 0.00 0.00 51.96 51.38 2jza s ALA 114 Cb -0.09 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 19.95 2jza s ALA 114 CO -0.02 -2.01 0.77 0.14 0.00 0.00 0.00 175.76 174.65 2jza s VAL 115 N -3.16 4.70 -0.49 0.00 -7.23 -1.26 -4.95 120.40 108.01 2jza s VAL 115 Ca 0.62 0.59 -0.18 0.00 -1.81 0.00 0.00 61.98 61.20 2jza s VAL 115 Cb -0.15 -4.26 0.06 0.00 0.56 0.00 0.00 36.38 32.58 2jza s VAL 115 CO 0.54 -0.59 0.58 -0.62 -0.31 0.00 0.00 175.10 174.71 2jza s ASP 116 N 2.01 6.21 -0.34 4.85 2.15 -1.26 -4.89 116.67 125.39 2jza s ASP 116 Ca 0.30 -0.95 0.07 0.00 0.43 0.00 0.00 52.55 52.40 2jza s ASP 116 Cb -0.13 -2.27 0.49 0.00 -0.30 0.00 0.00 42.92 40.72 2jza s ASP 116 CO 0.20 -0.83 1.48 -3.20 -0.17 0.00 0.00 175.17 172.65 2jza n ASN 117 N 5.99 3.65 -0.03 -0.34 4.05 -1.26 -4.67 115.26 122.65 2jza n ASN 117 Ca -0.07 -3.79 0.06 0.00 0.45 0.00 0.00 54.58 51.23 2jza n ASN 117 Cb 0.45 -0.62 0.44 0.00 1.23 0.00 0.00 39.78 41.28 2jza n ASN 117 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 2jza h SER 118 N 1.38 0.46 -3.47 1.20 0.02 -2.04 -3.36 113.55 107.74 2jza h SER 118 Ca 0.31 -0.01 -0.61 0.00 -0.84 0.00 0.00 61.79 60.64 2jza h SER 118 Cb 1.54 -0.11 -0.11 0.00 0.14 0.00 0.00 62.40 63.87 2jza h SER 118 CO 0.63 0.32 0.30 -1.10 -1.14 0.00 0.00 176.83 175.84 2jza s GLN 119 N -5.48 3.95 0.56 3.45 1.11 -1.26 -5.04 119.66 116.95 2jza s GLN 119 Ca -0.08 0.49 -0.21 0.00 0.01 0.00 0.00 55.36 55.56 2jza s GLN 119 Cb 0.18 -3.72 -0.04 0.00 -1.01 0.00 0.00 33.01 28.41 2jza s GLN 119 CO 0.74 -0.62 1.37 -2.14 0.01 0.00 0.00 175.29 174.64 2jza s PRO 120 N 2.81 3.05 0.51 2.91 0.02 -1.26 -4.96 135.00 138.08 2jza s PRO 120 Ca 0.30 2.25 -0.22 0.00 0.02 0.00 0.00 61.00 63.34 2jza s PRO 120 Cb -0.14 -2.21 -0.06 0.00 0.02 0.00 0.00 34.50 32.11 2jza s PRO 120 CO 0.12 -1.27 1.30 -0.51 -0.33 0.00 0.00 177.00 176.31 2jza s LEU 121 N -3.63 3.92 0.14 -5.54 1.43 -1.26 -4.91 118.68 108.83 2jza s LEU 121 Ca 0.73 2.63 -0.34 0.00 -1.03 0.00 0.00 54.13 56.12 2jza s LEU 121 Cb -0.41 -4.24 -0.14 0.00 0.03 0.00 0.00 46.19 41.44 2jza s LEU 121 CO 0.48 -1.33 1.58 -2.65 0.23 0.00 0.00 176.35 174.67 2jza n PRO 122 N -0.78 2.11 -0.03 1.29 -0.02 -1.26 -4.94 135.00 131.37 2jza n PRO 122 Ca 0.09 0.76 -0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2jza n PRO 122 Cb 0.46 -2.53 -0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2jza n PRO 122 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2jza h LEU 123 N 6.04 0.00 2.24 2.45 5.85 -2.05 -3.47 115.31 126.37 2jza h LEU 123 Ca -0.45 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.04 2jza h LEU 123 Cb 1.26 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 2jza h LEU 123 CO 0.89 0.29 -0.28 -0.62 -0.34 0.00 0.00 178.44 178.38 2jza n GLU 124 N -3.60 -2.08 -0.74 1.25 4.71 -1.26 -4.77 120.64 114.15 2jza n GLU 124 Ca -0.00 0.58 0.04 0.00 -0.01 0.00 0.00 57.16 57.76 2jza n GLU 124 Cb 0.01 -5.09 0.31 0.00 -1.01 0.00 0.00 31.44 25.65 2jza n GLU 124 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2jza n HIS 125 N -3.01 1.73 0.35 -0.32 8.25 -1.26 -4.52 115.22 116.43 2jza n HIS 125 Ca -0.13 -0.66 -0.14 0.00 -0.26 0.00 0.00 57.72 56.53 2jza n HIS 125 Cb 0.56 -0.46 -0.07 0.00 1.12 0.00 0.00 29.99 31.14 2jza n HIS 125 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2jza h HIS 126 N 2.99 -0.90 -2.65 4.41 6.17 -2.03 -3.49 115.15 119.65 2jza h HIS 126 Ca 0.04 -0.02 0.32 0.00 0.71 0.00 0.00 60.37 61.42 2jza h HIS 126 Cb 1.75 0.31 -0.09 0.00 2.52 0.00 0.00 27.41 31.90 2jza h HIS 126 CO 0.91 -0.54 -0.50 0.72 0.71 0.00 0.00 177.93 179.23 2jza n HIS 127 N -4.56 -2.98 -3.65 5.26 8.25 -1.26 -4.79 115.22 111.48 2jza n HIS 127 Ca -0.11 1.50 -0.37 0.00 -0.26 0.00 0.00 57.72 58.47 2jza n HIS 127 Cb 0.37 -2.70 -0.11 0.00 1.12 0.00 0.00 29.99 28.67 2jza n HIS 127 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2jza s HIS 128 N -2.23 3.23 -1.12 4.41 3.76 -1.26 -5.02 115.29 117.07 2jza s HIS 128 Ca 0.00 0.08 -0.17 0.00 -0.15 0.00 0.00 55.06 54.82 2jza s HIS 128 Cb 0.00 -2.31 0.13 0.00 1.11 0.00 0.00 32.58 31.50 2jza s HIS 128 CO 0.00 -0.10 1.40 -1.01 -0.85 0.00 0.00 174.74 174.18 2jza s HIS 129 N 1.46 3.13 0.00 1.40 3.76 -1.26 -5.31 115.29 118.47 2jza s HIS 129 Ca 0.07 -1.66 0.00 0.00 -0.15 0.00 0.00 55.06 53.32 2jza s HIS 129 Cb -0.15 -4.44 0.00 0.00 1.11 0.00 0.00 32.58 29.11 2jza s HIS 129 CO 0.08 -1.57 0.27 1.58 -0.85 0.00 0.00 174.74 174.25