#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 0.00 -4.33 6.12 7.64 -1.26 -4.88 113.62 116.90 2jza n SER 2 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.55 2jza n SER 2 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 2jza n SER 2 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jza n GLN 3 N 0.00 1.67 -3.87 1.43 1.13 -1.26 -4.82 117.38 111.66 2jza n GLN 3 Ca 0.00 -2.36 -0.34 0.00 -1.94 0.00 0.00 57.00 52.36 2jza n GLN 3 Cb 0.00 -3.51 -0.13 0.00 0.11 0.00 0.00 30.24 26.71 2jza n GLN 3 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 2jza s TRP 4 N 9.10 3.54 -0.21 1.08 0.52 -1.26 -2.59 118.94 129.13 2jza s TRP 4 Ca 0.65 -2.78 -0.29 0.00 0.02 0.00 0.00 56.10 53.69 2jza s TRP 4 Cb 0.04 -3.06 -0.00 0.00 -1.15 0.00 0.00 33.47 29.29 2jza s TRP 4 CO 0.13 -0.90 1.19 0.99 0.02 0.00 0.00 176.95 178.37 2jza s THR 5 N 0.60 4.40 -0.25 2.01 2.01 -0.56 -4.74 115.64 119.12 2jza s THR 5 Ca 0.12 1.68 -0.29 0.00 0.31 0.00 0.00 61.69 63.52 2jza s THR 5 Cb -0.22 -4.14 -0.02 0.00 0.01 0.00 0.00 72.50 68.13 2jza s THR 5 CO -0.04 -0.20 1.69 -0.89 -0.69 0.00 0.00 174.62 174.48 2jza s THR 6 N 3.50 3.59 -0.07 -0.82 2.01 -1.26 -2.36 115.64 120.24 2jza s THR 6 Ca 0.51 0.65 -0.05 0.00 0.31 0.00 0.00 61.69 63.11 2jza s THR 6 Cb -0.19 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 2jza s THR 6 CO 0.13 -0.33 -0.09 0.52 -0.69 0.00 0.00 174.62 174.15 2jza n VAL 7 N 6.77 0.68 -4.29 3.82 0.31 0.11 -5.00 118.33 120.73 2jza n VAL 7 Ca 0.20 0.36 -0.16 0.00 -0.01 0.00 0.00 64.34 64.74 2jza n VAL 7 Cb 0.46 -1.92 -0.10 0.00 -0.91 0.00 0.00 33.84 31.36 2jza n VAL 7 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jza n LYS 9 N -0.39 1.36 0.00 0.00 3.00 -1.26 -0.94 118.16 119.93 2jza n LYS 9 Ca -0.03 -0.53 0.00 0.00 -0.00 0.00 0.00 58.31 57.75 2jza n LYS 9 Cb 0.65 -1.39 0.00 0.00 0.00 0.00 0.00 35.03 34.29 2jza n LYS 9 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2jza n LEU 10 N -0.28 0.00 0.09 3.14 7.94 -1.25 -4.26 117.00 122.37 2jza n LEU 10 Ca 0.17 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 55.00 2jza n LEU 10 Cb 0.21 0.00 0.05 0.00 0.53 0.00 0.00 43.42 44.21 2jza n LEU 10 CO 0.13 0.00 0.35 -0.78 -1.11 0.00 0.00 177.39 175.99 2jza h ASP 11 N 0.00 0.24 -0.17 1.96 3.58 -1.90 -2.45 116.42 117.67 2jza h ASP 11 Ca 0.00 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2jza h ASP 11 Cb 0.00 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2jza h ASP 11 CO 0.00 0.91 0.00 -0.90 -2.88 0.00 0.00 179.24 176.37 2jza n ASP 12 N -3.75 0.93 -4.71 2.28 5.75 -1.26 -4.74 116.55 111.05 2jza n ASP 12 Ca -0.03 -1.99 -0.39 0.00 -0.01 0.00 0.00 54.79 52.37 2jza n ASP 12 Cb 0.72 -0.12 -0.06 0.00 -1.03 0.00 0.00 41.12 40.64 2jza n ASP 12 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2jza s ILE 13 N -1.77 5.14 0.03 2.12 -1.09 -0.93 -5.02 121.20 119.68 2jza s ILE 13 Ca 0.12 1.07 -0.30 0.00 -2.23 0.00 0.00 60.65 59.31 2jza s ILE 13 Cb 0.06 -3.87 -0.06 0.00 -1.58 0.00 0.00 42.46 37.01 2jza s ILE 13 CO 0.08 0.28 1.42 -0.76 -1.23 0.00 0.00 174.94 174.73 2jza s LEU 14 N 0.86 4.33 0.10 2.97 1.43 -1.26 -4.96 118.68 122.14 2jza s LEU 14 Ca 0.28 2.18 -0.31 0.00 -1.03 0.00 0.00 54.13 55.25 2jza s LEU 14 Cb -0.16 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.41 2jza s LEU 14 CO 0.12 -0.72 1.60 -2.16 0.23 0.00 0.00 176.35 175.42 2jza s PRO 15 N 2.20 4.21 0.00 1.29 0.04 -1.26 -2.57 135.00 138.91 2jza s PRO 15 Ca 0.65 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.99 2jza s PRO 15 Cb -0.33 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 30.77 2jza s PRO 15 CO 0.28 -0.67 0.00 0.41 0.04 0.00 0.00 177.00 177.05 2jza n GLY 16 N 3.88 0.66 3.55 0.56 0.00 0.31 -4.90 105.19 109.25 2jza n GLY 16 Ca 0.15 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.07 0.00 -0.08 2.61 2.01 -0.81 -4.93 115.64 112.36 2jza s THR 17 Ca 0.00 -1.47 -0.11 0.00 0.31 0.00 0.00 61.69 60.42 2jza s THR 17 Cb 0.00 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 70.09 2jza s THR 17 CO 0.00 0.00 0.28 -0.83 -0.69 0.00 0.00 174.62 173.38 2jza s GLY 18 N -3.11 -0.18 0.03 4.40 0.00 -1.26 0.54 107.32 107.74 2jza s GLY 18 Ca 0.26 0.63 0.03 0.00 0.00 0.00 0.00 44.72 45.64 2jza s GLY 18 CO 0.14 0.50 -0.09 -1.34 0.00 0.00 0.00 173.10 172.30 2jza s VAL 19 N -0.28 0.68 -0.37 1.40 -7.23 -0.83 -4.28 120.40 109.48 2jza s VAL 19 Ca -0.04 -0.89 -0.29 0.00 -1.81 0.00 0.00 61.98 58.95 2jza s VAL 19 Cb -0.03 -0.67 0.01 0.00 0.56 0.00 0.00 36.38 36.24 2jza s VAL 19 CO 0.01 -0.17 1.36 0.00 -0.31 0.00 0.00 175.10 175.99 2jza s ALA 21 N 4.98 3.29 -0.57 0.00 0.00 0.21 -4.98 121.76 124.70 2jza s ALA 21 Ca 0.59 -1.08 -0.27 0.00 0.00 0.00 0.00 51.96 51.19 2jza s ALA 21 Cb -0.14 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.52 2jza s ALA 21 CO 0.29 -1.94 1.62 -1.17 0.00 0.00 0.00 175.76 174.56 2jza s LEU 22 N 3.23 3.35 0.38 0.00 1.98 -1.26 -2.90 118.68 123.46 2jza s LEU 22 Ca 0.28 0.35 0.01 0.00 -2.89 0.00 0.00 54.13 51.88 2jza s LEU 22 Cb -0.13 -2.85 -0.02 0.00 0.66 0.00 0.00 46.19 43.85 2jza s LEU 22 CO 0.21 -1.98 0.58 -0.69 -1.89 0.00 0.00 176.35 172.58 2jza s VAL 23 N 7.30 4.75 0.20 1.68 1.01 -0.19 -5.00 120.40 130.14 2jza s VAL 23 Ca 0.60 -0.49 -0.19 0.00 0.00 0.00 0.00 61.98 61.90 2jza s VAL 23 Cb -0.13 -3.74 0.16 0.00 0.00 0.00 0.00 36.38 32.68 2jza s VAL 23 CO 0.23 -0.48 1.59 -0.33 0.00 0.00 0.00 175.10 176.11 2jza h GLU 24 N 0.65 -0.12 0.00 2.72 5.08 -2.03 -3.00 114.58 117.88 2jza h GLU 24 Ca -0.49 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 2jza h GLU 24 Cb 1.23 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.45 2jza h GLU 24 CO 0.60 -0.08 -0.42 1.04 -1.00 0.00 0.00 179.01 179.15 2jza n GLN 25 N -5.44 0.66 -4.09 2.33 3.00 -1.26 -5.09 117.38 107.49 2jza n GLN 25 Ca 0.05 -2.02 -0.09 0.00 -0.01 0.00 0.00 57.00 54.93 2jza n GLN 25 Cb 0.36 -0.92 -0.10 0.00 0.00 0.00 0.00 30.24 29.57 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 -1.44 0.62 -0.29 -1.09 -1.52 -1.13 -5.09 119.66 109.72 2jza s GLN 26 Ca 0.22 -1.12 0.01 0.00 -1.95 0.00 0.00 55.36 52.51 2jza s GLN 26 Cb 0.21 0.03 0.09 0.00 -0.22 0.00 0.00 33.01 33.11 2jza s GLN 26 CO -0.03 -0.06 0.04 -0.65 -0.25 0.00 0.00 175.29 174.35 2jza s GLN 27 N -3.32 1.13 -0.05 2.91 -0.21 -1.26 -1.02 119.66 117.83 2jza s GLN 27 Ca 0.04 -1.20 0.06 0.00 0.02 0.00 0.00 55.36 54.27 2jza s GLN 27 Cb 0.03 -2.45 -0.01 0.00 1.00 0.00 0.00 33.01 31.58 2jza s GLN 27 CO -0.06 -0.85 -0.24 0.42 -2.12 0.00 0.00 175.29 172.44 2jza s ILE 28 N 1.40 1.93 -0.16 1.08 1.09 -1.14 -4.30 121.20 121.10 2jza s ILE 28 Ca 0.05 -1.00 -0.08 0.00 -1.10 0.00 0.00 60.65 58.52 2jza s ILE 28 Cb -0.18 -1.63 -0.04 0.00 -1.06 0.00 0.00 42.46 39.55 2jza s ILE 28 CO -0.15 0.54 0.12 0.00 -0.10 0.00 0.00 174.94 175.36 2jza s ALA 29 N -0.18 3.74 -0.34 9.38 0.00 0.22 0.65 121.76 135.22 2jza s ALA 29 Ca -0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.21 2jza s ALA 29 Cb -0.13 -2.04 0.05 0.00 0.00 0.00 0.00 23.12 21.00 2jza s ALA 29 CO 0.03 0.37 0.10 0.08 0.00 0.00 0.00 175.76 176.34 2jza s VAL 30 N -0.28 3.56 -0.16 0.00 1.01 0.38 -1.05 120.40 123.86 2jza s VAL 30 Ca 0.11 -1.32 -0.17 0.00 0.00 0.00 0.00 61.98 60.60 2jza s VAL 30 Cb -0.12 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 2jza s VAL 30 CO 0.01 -0.24 0.42 -0.36 0.00 0.00 0.00 175.10 174.92 2jza s PHE 31 N 1.34 3.44 -0.59 5.22 0.08 0.15 -1.96 117.98 125.66 2jza s PHE 31 Ca -0.01 0.73 0.04 0.00 0.12 0.00 0.00 56.93 57.81 2jza s PHE 31 Cb -0.20 -2.51 0.14 0.00 -0.57 0.00 0.00 43.02 39.88 2jza s PHE 31 CO 0.01 0.10 0.35 0.50 -0.10 0.00 0.00 175.22 176.08 2jza s ARG 32 N 0.90 2.17 0.34 0.44 3.52 0.19 -0.49 118.95 126.02 2jza s ARG 32 Ca 0.22 -2.87 0.02 0.00 -0.13 0.00 0.00 55.73 52.96 2jza s ARG 32 Cb -0.15 -3.37 0.60 0.00 -1.56 0.00 0.00 34.95 30.47 2jza s ARG 32 CO 0.08 -1.17 1.99 -1.35 -0.81 0.00 0.00 175.30 174.04 2jza h PRO 33 N 6.13 0.89 -4.92 5.12 0.11 -1.77 0.91 132.00 138.47 2jza h PRO 33 Ca -0.00 -0.05 -0.32 0.00 0.11 0.00 0.00 66.00 65.74 2jza h PRO 33 Cb 0.85 -0.20 -0.15 0.00 0.11 0.00 0.00 31.00 31.61 2jza h PRO 33 CO 0.70 0.59 -0.67 1.03 -0.21 0.00 0.00 178.00 179.44 2jza s ARG 34 N -5.78 1.16 -0.95 1.05 0.52 -1.26 -3.40 118.95 110.30 2jza s ARG 34 Ca -0.10 -1.56 -0.08 0.00 -0.52 0.00 0.00 55.73 53.47 2jza s ARG 34 Cb 0.18 -0.43 -0.14 0.00 0.52 0.00 0.00 34.95 35.09 2jza s ARG 34 CO 0.77 -0.09 2.96 -1.71 0.02 0.00 0.00 175.30 177.26 2jza n ASN 35 N -0.28 6.77 -1.76 0.23 5.15 -1.26 -4.53 115.26 119.58 2jza n ASN 35 Ca -0.07 -2.47 -0.04 0.00 -0.60 0.00 0.00 54.58 51.41 2jza n ASN 35 Cb 0.63 -1.39 -0.01 0.00 -0.53 0.00 0.00 39.78 38.48 2jza n ASN 35 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2jza n ASP 36 N 3.31 0.73 -0.37 1.20 8.00 -1.26 -5.03 116.55 123.13 2jza n ASP 36 Ca 0.60 -1.37 0.14 0.00 0.71 0.00 0.00 54.79 54.87 2jza n ASP 36 Cb 0.43 0.20 0.63 0.00 -0.02 0.00 0.00 41.12 42.35 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 -0.14 1.51 -2.85 -1.24 1.02 -1.26 -4.71 120.64 112.96 2jza n GLU 37 Ca -0.00 -0.73 -0.43 0.00 -0.02 0.00 0.00 57.16 55.97 2jza n GLU 37 Cb 0.10 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.00 3.14 0.29 3.49 1.11 -1.26 -4.98 119.66 119.46 2jza s GLN 38 Ca 0.40 -0.88 0.06 0.00 0.01 0.00 0.00 55.36 54.96 2jza s GLN 38 Cb 0.21 -4.28 -0.06 0.00 -1.01 0.00 0.00 33.01 27.87 2jza s GLN 38 CO 0.34 -1.82 -0.05 0.14 0.01 0.00 0.00 175.29 173.91 2jza s VAL 39 N 4.02 1.65 -0.23 1.09 -7.23 -1.26 -4.35 120.40 114.08 2jza s VAL 39 Ca 0.23 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.27 2jza s VAL 39 Cb -0.16 -2.52 0.07 0.00 0.56 0.00 0.00 36.38 34.33 2jza s VAL 39 CO 0.09 -0.25 0.04 -0.31 -0.31 0.00 0.00 175.10 174.36 2jza s TYR 40 N -3.00 1.33 -0.56 2.82 2.02 0.36 -4.96 117.35 115.36 2jza s TYR 40 Ca 0.31 -1.18 -0.09 0.00 -0.37 0.00 0.00 57.07 55.74 2jza s TYR 40 Cb 0.04 -1.25 0.14 0.00 -0.40 0.00 0.00 41.96 40.50 2jza s TYR 40 CO 0.13 -0.70 0.44 0.00 -1.57 0.00 0.00 175.55 173.84 2jza s ALA 41 N 1.75 3.55 0.19 3.71 0.00 -1.25 0.34 121.76 130.05 2jza s ALA 41 Ca 0.01 -2.82 0.03 0.00 0.00 0.00 0.00 51.96 49.18 2jza s ALA 41 Cb -0.17 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 19.99 2jza s ALA 41 CO -0.13 -2.01 -0.00 0.96 0.00 0.00 0.00 175.76 174.58 2jza s ILE 42 N 0.88 0.83 -0.53 0.00 -4.36 -0.22 -4.41 121.20 113.40 2jza s ILE 42 Ca 0.10 -2.01 -0.06 0.00 -0.26 0.00 0.00 60.65 58.42 2jza s ILE 42 Cb -0.22 -2.19 -0.17 0.00 1.25 0.00 0.00 42.46 41.12 2jza s ILE 42 CO -0.03 -0.43 2.96 -1.20 0.24 0.00 0.00 174.94 176.49 2jza n SER 43 N -0.31 5.57 -3.86 4.36 7.64 -0.25 0.70 113.62 127.48 2jza n SER 43 Ca -0.06 -2.39 -0.42 0.00 1.01 0.00 0.00 58.87 57.02 2jza n SER 43 Cb 0.63 -1.27 0.01 0.00 -1.01 0.00 0.00 64.21 62.57 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 3.05 6.60 0.01 6.43 5.15 -1.26 -4.24 115.26 131.00 2jza n ASN 44 Ca 0.48 -3.50 0.09 0.00 -0.60 0.00 0.00 54.58 51.05 2jza n ASN 44 Cb 0.55 -1.21 -0.12 0.00 -0.53 0.00 0.00 39.78 38.47 2jza n ASN 44 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2jza n ILE 45 N 0.88 0.32 -2.45 -1.44 2.08 -1.26 -4.43 119.36 113.05 2jza n ILE 45 Ca 0.32 -0.55 -0.04 0.00 0.56 0.00 0.00 62.75 63.05 2jza n ILE 45 Cb 0.31 -0.16 -0.03 0.00 -0.75 0.00 0.00 39.64 39.02 2jza n ILE 45 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 2jza n ASP 46 N -2.43 -2.47 0.00 4.38 -0.08 -1.26 -1.75 116.55 112.93 2jza n ASP 46 Ca -0.05 1.17 0.00 0.00 -1.51 0.00 0.00 54.79 54.39 2jza n ASP 46 Cb 0.62 -4.64 0.01 0.00 2.34 0.00 0.00 41.12 39.46 2jza n ASP 46 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2jza n PRO 47 N 1.19 0.01 0.04 -0.67 -0.02 -1.26 -0.89 135.00 133.41 2jza n PRO 47 Ca -0.26 0.05 0.11 0.00 -2.02 0.00 0.00 63.50 61.39 2jza n PRO 47 Cb 0.40 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.44 2jza n PRO 47 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2jza n PHE 48 N -1.05 0.38 0.00 6.00 7.35 -1.26 -4.60 117.46 124.27 2jza n PHE 48 Ca 0.00 0.11 0.00 0.00 -0.76 0.00 0.00 57.45 56.80 2jza n PHE 48 Cb 0.00 -0.52 0.00 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 -1.85 1.58 0.00 3.13 0.00 -0.06 -5.03 120.51 118.27 2jza n ALA 49 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2jza n ALA 49 Cb 0.45 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.04 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 -1.37 0.00 -1.26 0.00 3.00 -0.51 -4.80 117.38 112.45 2jza n GLN 50 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 2jza n GLN 50 Cb 0.26 -1.75 0.13 0.00 0.00 0.00 0.00 30.24 28.88 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jza n ALA 51 N 0.18 5.01 -3.85 -1.58 0.00 -1.26 -4.87 120.51 114.14 2jza n ALA 51 Ca 0.00 -3.37 -0.32 0.00 0.00 0.00 0.00 53.44 49.75 2jza n ALA 51 Cb 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 19.45 18.58 2jza n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2jza n SER 52 N -0.98 -3.30 0.00 0.00 3.41 -0.72 -4.59 113.62 107.44 2jza n SER 52 Ca 0.44 -1.07 0.13 0.00 -0.26 0.00 0.00 58.87 58.11 2jza n SER 52 Cb 0.99 -2.94 0.72 0.00 -0.26 0.00 0.00 64.21 62.72 2jza n SER 52 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2jza n VAL 53 N -4.41 0.07 -0.27 -3.33 0.24 -1.21 -1.89 118.33 107.53 2jza n VAL 53 Ca -0.17 0.02 -0.02 0.00 -2.04 0.00 0.00 64.34 62.12 2jza n VAL 53 Cb 0.62 -0.61 0.21 0.00 -1.47 0.00 0.00 33.84 32.59 2jza n VAL 53 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2jza n LEU 54 N -1.10 4.46 0.00 1.34 4.77 -1.26 -4.14 117.00 121.07 2jza n LEU 54 Ca 0.17 -2.30 0.00 0.00 -0.03 0.00 0.00 56.01 53.85 2jza n LEU 54 Cb 0.13 -0.65 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 2jza n LEU 54 CO 0.16 0.61 0.00 -1.54 -1.33 0.00 0.00 177.39 175.29 2jza n SER 55 N 0.08 0.00 -3.25 -1.43 3.41 -0.79 -4.89 113.62 106.75 2jza n SER 55 Ca 0.24 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.48 2jza n SER 55 Cb 0.98 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.90 2jza n SER 55 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jza n ARG 56 N -1.42 3.71 0.00 4.33 1.74 -1.11 -4.27 116.66 119.64 2jza n ARG 56 Ca 0.00 -2.29 0.00 0.00 -0.77 0.00 0.00 57.85 54.79 2jza n ARG 56 Cb 0.00 -2.73 0.00 0.00 -1.02 0.00 0.00 32.46 28.71 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jza n GLY 57 N 3.26 1.90 3.05 -0.13 0.00 -1.26 -4.94 105.19 107.07 2jza n GLY 57 Ca 0.75 0.05 -0.32 0.00 0.00 0.00 0.00 46.02 46.50 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 2.01 2.27 -0.66 -0.61 -1.09 -1.18 -5.02 121.20 116.91 2jza s ILE 58 Ca 0.00 -2.00 -0.25 0.00 -2.23 0.00 0.00 60.65 56.17 2jza s ILE 58 Cb 0.00 -2.52 0.05 0.00 -1.58 0.00 0.00 42.46 38.41 2jza s ILE 58 CO 0.00 -0.33 1.11 -0.69 -1.23 0.00 0.00 174.94 173.79 2jza s VAL 59 N 1.00 4.07 -0.22 2.92 1.01 -1.26 -0.47 120.40 127.45 2jza s VAL 59 Ca 0.02 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2jza s VAL 59 Cb -0.20 -4.75 0.03 0.00 0.00 0.00 0.00 36.38 31.46 2jza s VAL 59 CO -0.06 -1.54 -0.13 0.00 0.00 0.00 0.00 175.10 173.37 2jza s ALA 60 N 4.78 2.52 -0.54 5.51 0.00 -0.01 -5.00 121.76 129.02 2jza s ALA 60 Ca 0.31 -1.42 -0.27 0.00 0.00 0.00 0.00 51.96 50.57 2jza s ALA 60 Cb -0.12 -1.45 -0.01 0.00 0.00 0.00 0.00 23.12 21.54 2jza s ALA 60 CO 0.15 -0.69 1.68 -2.00 0.00 0.00 0.00 175.76 174.90 2jza s GLU 61 N 1.26 3.01 0.07 0.00 2.12 -1.26 -1.79 118.70 122.12 2jza s GLU 61 Ca 0.00 0.69 -0.33 0.00 0.36 0.00 0.00 54.97 55.69 2jza s GLU 61 Cb -0.16 -4.25 -0.18 0.00 0.26 0.00 0.00 34.13 29.80 2jza s GLU 61 CO -0.08 -2.27 1.61 1.25 -0.54 0.00 0.00 175.26 175.23 2jza h HIS 62 N 13.06 -0.95 0.00 5.30 -0.00 -1.71 -3.45 115.15 127.40 2jza h HIS 62 Ca -0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.08 2jza h HIS 62 Cb 1.14 0.33 0.00 0.00 -0.00 0.00 0.00 27.41 28.88 2jza h HIS 62 CO 1.03 -0.56 0.00 1.04 -0.00 0.00 0.00 177.93 179.43 2jza n GLN 63 N -5.51 0.00 0.00 5.26 6.02 -1.26 -4.95 117.38 116.94 2jza n GLN 63 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.86 2jza n GLN 63 Cb 0.40 0.00 0.00 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 -2.82 0.21 -4.57 1.08 2.03 -1.26 -5.07 116.55 106.15 2jza n ASP 64 Ca 0.00 -0.58 -0.27 0.00 0.52 0.00 0.00 54.79 54.46 2jza n ASP 64 Cb 0.00 0.68 -0.10 0.00 -0.72 0.00 0.00 41.12 40.98 2jza n ASP 64 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jza s ASP 65 N -0.68 3.48 -0.30 1.67 -1.08 -1.26 -5.12 116.67 113.38 2jza s ASP 65 Ca 0.00 -1.43 -0.05 0.00 -0.52 0.00 0.00 52.55 50.55 2jza s ASP 65 Cb 0.00 -0.14 0.03 0.00 -1.46 0.00 0.00 42.92 41.35 2jza s ASP 65 CO 0.00 -0.57 0.05 -0.76 0.52 0.00 0.00 175.17 174.41 2jza s LEU 66 N -3.67 3.90 0.34 -1.34 1.43 -1.26 -1.94 118.68 116.13 2jza s LEU 66 Ca 0.31 -0.97 0.06 0.00 -1.03 0.00 0.00 54.13 52.49 2jza s LEU 66 Cb 0.08 -1.81 -0.07 0.00 0.03 0.00 0.00 46.19 44.42 2jza s LEU 66 CO 0.15 -0.24 0.00 0.26 0.23 0.00 0.00 176.35 176.75 2jza s TRP 67 N 1.40 2.14 0.03 0.29 0.52 -0.74 -1.30 118.94 121.28 2jza s TRP 67 Ca -0.01 -0.77 0.04 0.00 0.02 0.00 0.00 56.10 55.38 2jza s TRP 67 Cb -0.18 -1.38 -0.02 0.00 -1.15 0.00 0.00 33.47 30.74 2jza s TRP 67 CO 0.01 0.25 -0.12 0.54 0.02 0.00 0.00 176.95 177.65 2jza s VAL 68 N -3.01 0.90 -0.20 4.03 0.11 0.11 -0.83 120.40 121.51 2jza s VAL 68 Ca 0.34 -0.83 -0.08 0.00 -2.93 0.00 0.00 61.98 58.48 2jza s VAL 68 Cb 0.07 -0.82 -0.04 0.00 -1.53 0.00 0.00 36.38 34.06 2jza s VAL 68 CO 0.15 -0.00 0.07 0.00 -3.33 0.00 0.00 175.10 171.99 2jza s ALA 69 N -0.75 3.38 -0.06 1.54 0.00 0.39 -0.94 121.76 125.31 2jza s ALA 69 Ca 0.00 -0.83 -0.19 0.00 0.00 0.00 0.00 51.96 50.94 2jza s ALA 69 Cb -0.07 -1.99 -0.05 0.00 0.00 0.00 0.00 23.12 21.02 2jza s ALA 69 CO 0.01 0.02 0.52 0.45 0.00 0.00 0.00 175.76 176.76 2jza s SER 70 N 0.67 6.81 0.41 0.00 0.15 -1.24 -3.13 113.70 117.36 2jza s SER 70 Ca 0.04 0.97 0.29 0.00 0.70 0.00 0.00 55.95 57.94 2jza s SER 70 Cb -0.13 -2.31 1.19 0.00 -1.71 0.00 0.00 66.02 63.06 2jza s SER 70 CO 0.02 0.07 1.85 1.55 1.20 0.00 0.00 173.24 177.93 2jza h PRO 71 N 6.10 0.00 0.00 5.44 0.13 -1.93 -3.08 132.00 138.67 2jza h PRO 71 Ca -0.44 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.54 2jza h PRO 71 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2jza h PRO 71 CO 0.72 0.00 -0.99 -0.07 -0.23 0.00 0.00 178.00 177.43 2jza h LEU 72 N 0.00 0.00 -7.49 1.56 3.38 -1.93 -3.44 115.31 107.39 2jza h LEU 72 Ca 0.00 -0.38 -0.62 0.00 0.09 0.00 0.00 57.88 56.97 2jza h LEU 72 Cb 0.43 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.78 2jza h LEU 72 CO 0.00 1.26 -0.75 -1.59 0.09 0.00 0.00 178.44 177.44 2jza s LYS 73 N -2.31 1.27 -1.02 1.13 -2.85 -1.22 -5.04 119.74 109.69 2jza s LYS 73 Ca -0.24 -1.31 -0.24 0.00 -1.00 0.00 0.00 55.97 53.18 2jza s LYS 73 Cb 0.04 -2.60 -0.16 0.00 -2.06 0.00 0.00 37.83 33.06 2jza s LYS 73 CO 0.48 -0.84 1.95 1.63 0.10 0.00 0.00 175.35 178.68 2jza n LYS 74 N 4.59 1.10 -4.18 1.78 5.02 -1.16 -3.79 118.16 121.51 2jza n LYS 74 Ca -0.03 -2.09 -0.18 0.00 -2.02 0.00 0.00 58.31 53.99 2jza n LYS 74 Cb 0.43 -3.59 -0.12 0.00 -0.02 0.00 0.00 35.03 31.73 2jza n LYS 74 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2jza s GLN 75 N 6.83 0.86 -0.84 1.97 -0.21 -1.26 -4.95 119.66 122.05 2jza s GLN 75 Ca 0.70 -1.02 -0.20 0.00 0.02 0.00 0.00 55.36 54.86 2jza s GLN 75 Cb 0.01 -0.81 0.11 0.00 1.00 0.00 0.00 33.01 33.33 2jza s GLN 75 CO 0.16 0.17 1.08 -1.01 -2.12 0.00 0.00 175.29 173.57 2jza s HIS 76 N -1.55 2.96 -0.17 0.91 3.76 -1.22 -3.71 115.29 116.27 2jza s HIS 76 Ca 0.01 -1.11 -0.29 0.00 -0.15 0.00 0.00 55.06 53.51 2jza s HIS 76 Cb -0.08 -4.29 -0.00 0.00 1.11 0.00 0.00 32.58 29.31 2jza s HIS 76 CO 0.02 -1.55 1.08 -0.06 -0.85 0.00 0.00 174.74 173.39 2jza s PHE 77 N 3.17 3.29 -0.17 1.40 0.40 -0.11 -2.51 117.98 123.45 2jza s PHE 77 Ca 0.29 1.40 -0.29 0.00 -0.60 0.00 0.00 56.93 57.73 2jza s PHE 77 Cb -0.09 -3.30 -0.00 0.00 0.51 0.00 0.00 43.02 40.14 2jza s PHE 77 CO -0.03 -0.69 1.02 0.50 0.70 0.00 0.00 175.22 176.72 2jza s ARG 78 N 2.85 4.34 0.31 0.44 3.52 0.09 0.06 118.95 130.55 2jza s ARG 78 Ca 0.48 1.37 0.26 0.00 -0.13 0.00 0.00 55.73 57.71 2jza s ARG 78 Cb -0.18 -3.59 0.89 0.00 -1.56 0.00 0.00 34.95 30.51 2jza s ARG 78 CO 0.12 -0.48 1.76 -0.07 -0.81 0.00 0.00 175.30 175.83 2jza h LEU 79 N 8.75 0.00 -3.19 -0.88 3.38 -1.53 -0.23 115.31 121.61 2jza h LEU 79 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2jza h LEU 79 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2jza h LEU 79 CO 0.92 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.45 2jza n TYR 80 N -2.50 1.13 0.09 1.13 9.36 -1.26 -4.75 117.16 120.37 2jza n TYR 80 Ca 0.03 -0.71 0.00 0.00 3.32 0.00 0.00 57.90 60.55 2jza n TYR 80 Cb 0.36 -0.26 0.00 0.00 -0.63 0.00 0.00 39.34 38.81 2jza n TYR 80 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2jza n ASP 81 N 0.28 -0.91 0.00 2.98 -0.08 -1.10 -5.06 116.55 112.67 2jza n ASP 81 Ca 0.21 0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.82 2jza n ASP 81 Cb 0.83 1.01 0.00 0.00 2.34 0.00 0.00 41.12 45.31 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jza n GLY 82 N 0.31 0.80 3.78 0.27 0.00 -0.12 -4.70 105.19 105.54 2jza n GLY 82 Ca 0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2jza n GLY 82 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jza s PHE 83 N -0.65 2.77 -0.43 1.61 5.36 -1.26 -4.52 117.98 120.85 2jza s PHE 83 Ca 0.00 1.54 0.05 0.00 -0.96 0.00 0.00 56.93 57.56 2jza s PHE 83 Cb 0.00 -3.14 0.67 0.00 -0.34 0.00 0.00 43.02 40.22 2jza s PHE 83 CO 0.00 -1.44 1.90 0.00 -1.46 0.00 0.00 175.22 174.22 2jza n LEU 85 N -1.06 0.00 0.24 0.00 7.94 -1.05 -3.03 117.00 120.04 2jza n LEU 85 Ca 0.58 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.60 2jza n LEU 85 Cb 1.64 0.00 0.47 0.00 0.53 0.00 0.00 43.42 46.05 2jza n LEU 85 CO 0.58 0.00 0.86 -0.33 -1.11 0.00 0.00 177.39 177.39 2jza h GLU 86 N 0.00 0.00 0.00 1.96 5.08 -1.94 -3.47 114.58 116.21 2jza h GLU 86 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jza h GLU 86 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jza h GLU 86 CO 0.00 0.11 0.00 -3.47 -1.00 0.00 0.00 179.01 174.65 2jza n ASP 87 N -3.21 0.00 0.00 1.42 -0.08 -1.17 -5.12 116.55 108.40 2jza n ASP 87 Ca 0.01 -0.07 0.00 0.00 -1.51 0.00 0.00 54.79 53.22 2jza n ASP 87 Cb 0.42 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.88 2jza n ASP 87 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jza n GLY 88 N 0.00 6.37 0.00 0.27 0.00 -1.26 -2.95 105.19 107.62 2jza n GLY 88 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2jza n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jza n ALA 89 N -3.00 0.00 -3.44 4.61 0.00 -1.26 -4.90 120.51 112.52 2jza n ALA 89 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2jza n ALA 89 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2jza n ALA 89 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jza s TYR 90 N 0.00 -0.46 -0.40 0.00 2.02 -1.26 -5.10 117.35 112.15 2jza s TYR 90 Ca 0.00 0.34 -0.29 0.00 -0.37 0.00 0.00 57.07 56.75 2jza s TYR 90 Cb 0.00 -0.27 -0.08 0.00 -0.40 0.00 0.00 41.96 41.21 2jza s TYR 90 CO 0.00 -0.68 2.33 0.43 -1.57 0.00 0.00 175.55 176.05 2jza n SER 91 N 5.33 2.49 -4.92 2.29 7.64 -1.26 -4.94 113.62 120.24 2jza n SER 91 Ca -0.04 -0.03 -0.27 0.00 1.01 0.00 0.00 58.87 59.54 2jza n SER 91 Cb 0.49 -1.47 -0.03 0.00 -1.01 0.00 0.00 64.21 62.20 2jza n SER 91 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2jza s VAL 92 N 9.68 5.11 -0.26 0.44 -7.23 -1.26 -5.08 120.40 121.79 2jza s VAL 92 Ca 1.04 -0.22 -0.10 0.00 -1.81 0.00 0.00 61.98 60.88 2jza s VAL 92 Cb -0.44 -3.77 -0.05 0.00 0.56 0.00 0.00 36.38 32.69 2jza s VAL 92 CO 0.35 -0.34 0.15 0.00 -0.31 0.00 0.00 175.10 174.96 2jza s ALA 93 N -2.08 3.47 -0.75 1.32 0.00 -1.26 -4.84 121.76 117.62 2jza s ALA 93 Ca 0.41 -1.04 -0.18 0.00 0.00 0.00 0.00 51.96 51.15 2jza s ALA 93 Cb -0.10 -2.34 0.14 0.00 0.00 0.00 0.00 23.12 20.81 2jza s ALA 93 CO 0.31 -0.44 0.85 0.00 0.00 0.00 0.00 175.76 176.48 2jza s ALA 94 N 1.53 3.56 0.79 0.00 0.00 -1.26 -1.09 121.76 125.28 2jza s ALA 94 Ca 0.07 -2.64 -0.11 0.00 0.00 0.00 0.00 51.96 49.27 2jza s ALA 94 Cb -0.15 -3.68 0.06 0.00 0.00 0.00 0.00 23.12 19.35 2jza s ALA 94 CO 0.08 -2.53 1.10 0.71 0.00 0.00 0.00 175.76 175.12 2jza s TYR 95 N 2.10 2.89 -0.02 0.00 2.02 -1.26 -5.03 117.35 118.05 2jza s TYR 95 Ca 0.19 1.15 -0.24 0.00 -0.37 0.00 0.00 57.07 57.81 2jza s TYR 95 Cb -0.15 -3.11 -0.04 0.00 -0.40 0.00 0.00 41.96 38.26 2jza s TYR 95 CO -0.02 -1.70 0.72 0.34 -1.57 0.00 0.00 175.55 173.32 2jza s ASP 96 N -3.94 7.08 0.03 2.29 2.15 -1.26 -4.87 116.67 118.14 2jza s ASP 96 Ca 0.60 1.29 0.06 0.00 0.43 0.00 0.00 52.55 54.93 2jza s ASP 96 Cb -0.14 -2.43 -0.02 0.00 -0.30 0.00 0.00 42.92 40.03 2jza s ASP 96 CO 0.54 -0.05 -0.16 0.42 -0.17 0.00 0.00 175.17 175.75 2jza s THR 97 N 0.38 1.30 0.04 1.71 -4.23 -1.26 0.23 115.64 113.80 2jza s THR 97 Ca 0.37 -1.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.91 2jza s THR 97 Cb -0.19 -1.14 -0.02 0.00 1.34 0.00 0.00 72.50 72.48 2jza s THR 97 CO 0.20 0.12 -0.08 0.00 -0.54 0.00 0.00 174.62 174.32 2jza s GLN 98 N -1.02 0.55 -0.47 3.99 -2.07 0.97 -4.99 119.66 116.62 2jza s GLN 98 Ca 0.04 -0.71 -0.12 0.00 -1.82 0.00 0.00 55.36 52.75 2jza s GLN 98 Cb -0.08 -0.36 0.09 0.00 -1.09 0.00 0.00 33.01 31.57 2jza s GLN 98 CO 0.01 0.07 0.36 0.08 -1.32 0.00 0.00 175.29 174.49 2jza s VAL 99 N -1.22 4.71 -1.30 3.63 1.01 -1.26 -0.29 120.40 125.69 2jza s VAL 99 Ca -0.08 -1.39 -0.16 0.00 0.00 0.00 0.00 61.98 60.35 2jza s VAL 99 Cb -0.09 -3.93 0.10 0.00 0.00 0.00 0.00 36.38 32.46 2jza s VAL 99 CO 0.00 -0.65 1.73 0.41 0.00 0.00 0.00 175.10 176.60 2jza n THR 100 N 5.06 4.00 0.00 3.92 -1.04 0.64 -4.60 114.28 122.25 2jza n THR 100 Ca -0.11 -4.16 0.00 0.00 -2.04 0.00 0.00 64.05 57.74 2jza n THR 100 Cb 0.42 -2.42 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 2jza n THR 100 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2jza n ASN 101 N 7.02 0.00 0.00 8.00 3.02 -1.26 -3.20 115.26 128.84 2jza n ASN 101 Ca 0.45 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.00 2jza n ASN 101 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 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 0.00 -0.24 3.83 7.41 0.00 -1.26 -5.12 105.19 109.81 2jza n GLY 102 Ca 0.00 0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.82 6.81 -0.20 1.61 2.20 -1.19 -3.87 114.94 116.48 2jza s ASN 103 Ca 0.00 1.61 -0.07 0.00 -0.94 0.00 0.00 52.86 53.47 2jza s ASN 103 Cb 0.00 -2.52 -0.04 0.00 -2.00 0.00 0.00 41.25 36.70 2jza s ASN 103 CO 0.00 -0.44 0.05 -0.69 -2.94 0.00 0.00 177.10 173.09 2jza s VAL 104 N -2.34 4.56 -0.04 3.54 1.01 -0.12 -0.26 120.40 126.75 2jza s VAL 104 Ca 0.60 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.54 2jza s VAL 104 Cb -0.09 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.20 2jza s VAL 104 CO 0.20 0.43 -0.25 -1.10 0.00 0.00 0.00 175.10 174.39 2jza s GLN 105 N 0.69 2.31 0.11 2.72 -0.21 0.61 -0.71 119.66 125.18 2jza s GLN 105 Ca 0.03 -0.89 0.08 0.00 0.02 0.00 0.00 55.36 54.59 2jza s GLN 105 Cb -0.13 -2.06 -0.04 0.00 1.00 0.00 0.00 33.01 31.77 2jza s GLN 105 CO 0.02 0.44 -0.12 0.96 -2.12 0.00 0.00 175.29 174.47 2jza s ILE 106 N -0.33 3.23 -0.58 1.08 -0.00 -1.00 -0.02 121.20 123.58 2jza s ILE 106 Ca 0.02 -1.33 -0.25 0.00 -0.00 0.00 0.00 60.65 59.09 2jza s ILE 106 Cb -0.12 -2.50 0.04 0.00 -0.00 0.00 0.00 42.46 39.88 2jza s ILE 106 CO 0.02 0.11 1.01 -0.55 -0.00 0.00 0.00 174.94 175.52 2jza s SER 107 N -2.19 6.34 0.32 4.36 0.15 0.13 -1.50 113.70 121.32 2jza s SER 107 Ca 0.20 -0.33 -0.21 0.00 0.70 0.00 0.00 55.95 56.32 2jza s SER 107 Cb -0.11 -2.46 -0.10 0.00 -1.71 0.00 0.00 66.02 61.64 2jza s SER 107 CO 0.13 -1.32 0.84 0.27 1.20 0.00 0.00 173.24 174.35 2jza s ILE 108 N 4.24 4.46 0.11 6.45 -4.36 -1.07 -4.38 121.20 126.64 2jza s ILE 108 Ca 0.32 1.39 0.03 0.00 -0.26 0.00 0.00 60.65 62.13 2jza s ILE 108 Cb -0.12 -3.77 -0.04 0.00 1.25 0.00 0.00 42.46 39.78 2jza s ILE 108 CO 0.19 -0.03 0.15 0.00 0.24 0.00 0.00 174.94 175.49 2jza s ALA 109 N -1.82 3.71 0.84 2.27 0.00 -1.26 -4.94 121.76 120.56 2jza s ALA 109 Ca 0.52 -1.03 -0.12 0.00 0.00 0.00 0.00 51.96 51.33 2jza s ALA 109 Cb -0.14 -1.54 0.12 0.00 0.00 0.00 0.00 23.12 21.56 2jza s ALA 109 CO 0.19 0.68 1.20 0.16 0.00 0.00 0.00 175.76 177.99 2jza s ASP 110 N -2.70 4.11 0.41 0.00 -4.77 -1.26 -5.02 116.67 107.45 2jza s ASP 110 Ca 0.32 0.56 0.00 0.00 -3.30 0.00 0.00 52.55 50.12 2jza s ASP 110 Cb -0.12 -0.93 0.00 0.00 -1.09 0.00 0.00 42.92 40.78 2jza s ASP 110 CO 0.24 -2.12 0.00 -0.24 0.70 0.00 0.00 175.17 173.75 2jza n SER 111 N -3.40 -2.71 -2.27 2.11 2.88 -1.26 -5.13 113.62 103.83 2jza n SER 111 Ca 0.10 0.76 -0.04 0.00 -1.33 0.00 0.00 58.87 58.36 2jza n SER 111 Cb 0.60 2.61 -0.03 0.00 -0.75 0.00 0.00 64.21 66.64 2jza n SER 111 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2jza n ASP 112 N -3.47 -1.14 -3.60 -3.46 2.03 -1.26 -5.10 116.55 100.55 2jza n ASP 112 Ca 0.00 1.01 -0.16 0.00 0.52 0.00 0.00 54.79 56.16 2jza n ASP 112 Cb 0.00 -4.12 -0.07 0.00 -0.72 0.00 0.00 41.12 36.21 2jza n ASP 112 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2jza s VAL 113 N -0.48 0.02 0.05 5.18 0.11 -1.26 -5.13 120.40 118.88 2jza s VAL 113 Ca -0.20 -0.13 -0.31 0.00 -2.93 0.00 0.00 61.98 58.41 2jza s VAL 113 Cb 0.01 -0.88 -0.07 0.00 -1.53 0.00 0.00 36.38 33.91 2jza s VAL 113 CO 0.55 -0.07 1.44 0.00 -3.33 0.00 0.00 175.10 173.69 2jza s ALA 114 N -1.13 3.60 0.66 1.54 0.00 -1.26 -4.99 121.76 120.19 2jza s ALA 114 Ca -0.11 1.02 -0.15 0.00 0.00 0.00 0.00 51.96 52.72 2jza s ALA 114 Cb -0.02 -3.59 -0.00 0.00 0.00 0.00 0.00 23.12 19.51 2jza s ALA 114 CO 0.08 -0.85 1.10 0.14 0.00 0.00 0.00 175.76 176.23 2jza s VAL 115 N 2.02 3.30 -0.09 0.00 -7.23 -1.26 -4.98 120.40 112.17 2jza s VAL 115 Ca 0.66 0.60 -0.30 0.00 -1.81 0.00 0.00 61.98 61.13 2jza s VAL 115 Cb -0.35 -3.12 -0.02 0.00 0.56 0.00 0.00 36.38 33.45 2jza s VAL 115 CO 0.29 -0.38 1.09 -0.62 -0.31 0.00 0.00 175.10 175.16 2jza s ASP 116 N -2.65 7.16 0.17 4.85 2.15 -1.26 -4.98 116.67 122.11 2jza s ASP 116 Ca 0.66 1.65 -0.32 0.00 0.43 0.00 0.00 52.55 54.98 2jza s ASP 116 Cb -0.20 -2.56 -0.11 0.00 -0.30 0.00 0.00 42.92 39.75 2jza s ASP 116 CO 0.42 -0.51 1.74 0.54 -0.17 0.00 0.00 175.17 177.19 2jza s ASN 117 N 1.26 6.42 0.00 -0.34 6.03 -1.26 -4.88 114.94 122.17 2jza s ASN 117 Ca 0.51 2.79 0.02 0.00 -1.03 0.00 0.00 52.86 55.16 2jza s ASN 117 Cb -0.21 -2.59 0.01 0.00 -3.03 0.00 0.00 41.25 35.43 2jza s ASN 117 CO 0.19 -0.97 0.48 -0.24 -2.03 0.00 0.00 177.10 174.53 2jza n SER 118 N 4.66 0.97 -4.07 3.54 2.88 -1.26 -4.90 113.62 115.44 2jza n SER 118 Ca 0.16 -0.99 -0.34 0.00 -1.33 0.00 0.00 58.87 56.38 2jza n SER 118 Cb 0.37 0.19 -0.12 0.00 -0.75 0.00 0.00 64.21 63.90 2jza n SER 118 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2jza s GLN 119 N -0.38 2.02 -0.08 -1.46 1.11 -1.26 -5.08 119.66 114.53 2jza s GLN 119 Ca 0.02 -2.13 -0.30 0.00 0.01 0.00 0.00 55.36 52.97 2jza s GLN 119 Cb 0.02 -3.50 -0.02 0.00 -1.01 0.00 0.00 33.01 28.50 2jza s GLN 119 CO 0.04 -1.07 1.11 -2.14 0.01 0.00 0.00 175.29 173.23 2jza s PRO 120 N 0.58 4.39 -0.49 2.91 0.02 -1.26 -5.01 135.00 136.13 2jza s PRO 120 Ca 0.12 1.54 -0.17 0.00 0.02 0.00 0.00 61.00 62.50 2jza s PRO 120 Cb -0.22 -3.55 0.06 0.00 0.02 0.00 0.00 34.50 30.82 2jza s PRO 120 CO -0.04 -0.38 0.51 -0.51 -0.33 0.00 0.00 177.00 176.25 2jza s LEU 121 N 2.11 5.27 -0.14 -5.54 1.43 -1.26 -4.91 118.68 115.64 2jza s LEU 121 Ca 0.52 -1.10 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 2jza s LEU 121 Cb -0.22 -2.32 0.47 0.00 0.03 0.00 0.00 46.19 44.15 2jza s LEU 121 CO 0.20 -0.77 1.24 -0.81 0.23 0.00 0.00 176.35 176.44 2jza n PRO 122 N 5.71 3.18 -2.66 1.29 -0.04 -1.26 -4.91 135.00 136.32 2jza n PRO 122 Ca -0.09 -1.82 -0.36 0.00 -0.04 0.00 0.00 63.50 61.18 2jza n PRO 122 Cb 0.45 -1.93 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 2jza n PRO 122 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2jza s LEU 123 N -1.61 4.19 0.24 1.53 0.05 -1.26 -5.05 118.68 116.77 2jza s LEU 123 Ca 0.32 1.93 0.02 0.00 0.05 0.00 0.00 54.13 56.44 2jza s LEU 123 Cb 0.24 -4.16 -0.05 0.00 -2.05 0.00 0.00 46.19 40.18 2jza s LEU 123 CO 0.09 -0.32 0.07 -1.83 -0.55 0.00 0.00 176.35 173.81 2jza s GLU 124 N -2.40 1.34 -0.50 1.48 4.04 -1.26 -5.09 118.70 116.31 2jza s GLU 124 Ca 0.55 -1.71 0.06 0.00 0.04 0.00 0.00 54.97 53.92 2jza s GLU 124 Cb -0.20 -0.30 0.22 0.00 0.02 0.00 0.00 34.13 33.87 2jza s GLU 124 CO 0.25 -0.24 0.79 0.72 -1.84 0.00 0.00 175.26 174.94 2jza n HIS 125 N -0.41 -3.46 -2.46 4.83 8.25 -1.26 -5.12 115.22 115.59 2jza n HIS 125 Ca -0.02 -1.65 -0.43 0.00 -0.26 0.00 0.00 57.72 55.36 2jza n HIS 125 Cb 0.65 1.46 -0.02 0.00 1.12 0.00 0.00 29.99 33.20 2jza n HIS 125 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jza s HIS 126 N 0.72 2.67 -0.12 4.41 -3.43 -1.26 -5.00 115.29 113.28 2jza s HIS 126 Ca 0.31 0.81 -0.05 0.00 -0.80 0.00 0.00 55.06 55.34 2jza s HIS 126 Cb 0.12 -4.11 -0.04 0.00 -1.43 0.00 0.00 32.58 27.12 2jza s HIS 126 CO -0.15 -1.61 0.06 -1.58 -2.00 0.00 0.00 174.74 169.45 2jza s HIS 127 N 4.64 3.31 0.10 0.38 2.46 -1.26 -5.07 115.29 119.84 2jza s HIS 127 Ca 0.55 0.25 -0.31 0.00 0.47 0.00 0.00 55.06 56.02 2jza s HIS 127 Cb -0.13 -1.91 -0.07 0.00 -0.13 0.00 0.00 32.58 30.34 2jza s HIS 127 CO 0.27 0.45 1.25 -1.01 -2.47 0.00 0.00 174.74 173.23 2jza s HIS 128 N -0.56 3.38 -0.21 3.88 3.76 -1.26 -4.93 115.29 119.35 2jza s HIS 128 Ca 0.11 1.23 -0.18 0.00 -0.15 0.00 0.00 55.06 56.06 2jza s HIS 128 Cb -0.12 -3.50 -0.19 0.00 1.11 0.00 0.00 32.58 29.88 2jza s HIS 128 CO 0.02 -1.58 0.16 0.72 -0.85 0.00 0.00 174.74 173.21 2jza n HIS 129 N 3.66 0.91 0.00 1.40 8.25 -1.26 -5.34 115.22 122.85 2jza n HIS 129 Ca 0.09 0.36 0.00 0.00 -0.26 0.00 0.00 57.72 57.90 2jza n HIS 129 Cb 0.45 -1.10 0.00 0.00 1.12 0.00 0.00 29.99 30.46 2jza n HIS 129 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59