#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 2.64 -2.69 7.83 7.64 -1.26 -4.95 113.62 122.83 2jza n SER 2 Ca 0.00 -2.68 -0.01 0.00 1.01 0.00 0.00 58.87 57.19 2jza n SER 2 Cb 0.00 0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 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 -0.90 -1.16 -4.21 1.43 6.02 -1.26 -4.77 117.38 112.52 2jza n GLN 3 Ca -0.13 1.36 -0.34 0.00 -0.01 0.00 0.00 57.00 57.88 2jza n GLN 3 Cb 0.48 -4.83 -0.15 0.00 1.02 0.00 0.00 30.24 26.76 2jza n GLN 3 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2jza s TRP 4 N -2.89 2.82 -0.15 1.08 0.52 -1.26 -2.38 118.94 116.68 2jza s TRP 4 Ca 0.03 -1.28 -0.06 0.00 0.02 0.00 0.00 56.10 54.80 2jza s TRP 4 Cb -0.01 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.32 2jza s TRP 4 CO 0.59 -0.64 0.07 0.99 0.02 0.00 0.00 176.95 177.98 2jza s THR 5 N 1.17 4.92 -0.30 2.01 2.01 0.23 -4.88 115.64 120.80 2jza s THR 5 Ca 0.02 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.73 2jza s THR 5 Cb -0.14 -3.17 0.01 0.00 0.01 0.00 0.00 72.50 69.21 2jza s THR 5 CO -0.06 0.52 1.10 -0.89 -0.69 0.00 0.00 174.62 174.60 2jza s THR 6 N -0.20 4.49 -0.04 -0.82 2.01 -1.26 -1.73 115.64 118.09 2jza s THR 6 Ca 0.08 1.73 -0.00 0.00 0.31 0.00 0.00 61.69 63.80 2jza s THR 6 Cb -0.12 -4.37 -0.00 0.00 0.01 0.00 0.00 72.50 68.01 2jza s THR 6 CO 0.01 -0.44 0.03 0.58 -0.69 0.00 0.00 174.62 174.12 2jza h VAL 7 N 5.71 0.00 -0.80 3.82 2.07 -1.09 -3.49 116.25 122.47 2jza h VAL 7 Ca -0.21 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2jza h VAL 7 Cb 1.06 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2jza h VAL 7 CO 1.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.62 2jza s LYS 9 N -0.91 2.99 0.41 0.00 1.02 -1.26 -0.36 119.74 121.62 2jza s LYS 9 Ca 0.00 1.65 0.29 0.00 0.02 0.00 0.00 55.97 57.93 2jza s LYS 9 Cb 0.00 -1.95 1.22 0.00 -0.52 0.00 0.00 37.83 36.58 2jza s LYS 9 CO 0.00 -1.15 1.86 1.25 -0.92 0.00 0.00 175.35 176.39 2jza h LEU 10 N 0.70 0.00 0.00 3.17 5.85 -1.34 -2.59 115.31 121.11 2jza h LEU 10 Ca -0.49 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.09 2jza h LEU 10 Cb 1.27 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 2jza h LEU 10 CO 0.55 0.00 -1.63 -0.67 -0.34 0.00 0.00 178.44 176.35 2jza n ASP 11 N -2.65 0.54 0.08 1.25 2.03 -1.26 -4.19 116.55 112.34 2jza n ASP 11 Ca 0.01 0.23 -0.00 0.00 0.52 0.00 0.00 54.79 55.55 2jza n ASP 11 Cb 0.25 0.74 -0.04 0.00 -0.72 0.00 0.00 41.12 41.34 2jza n ASP 11 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2jza h ASP 12 N 0.00 0.00 -3.61 1.67 3.58 -1.85 -3.42 116.42 112.79 2jza h ASP 12 Ca -0.16 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.71 2jza h ASP 12 Cb 1.47 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 42.44 2jza h ASP 12 CO 0.03 0.63 0.76 -0.63 -2.88 0.00 0.00 179.24 177.14 2jza s ILE 13 N -2.89 4.39 0.49 2.25 1.01 -1.00 -4.97 121.20 120.48 2jza s ILE 13 Ca 0.01 1.14 -0.23 0.00 0.00 0.00 0.00 60.65 61.57 2jza s ILE 13 Cb 0.08 -4.48 -0.07 0.00 0.01 0.00 0.00 42.46 38.01 2jza s ILE 13 CO 0.78 -0.81 1.26 -0.76 0.00 0.00 0.00 174.94 175.42 2jza s LEU 14 N 3.97 3.97 0.52 2.97 1.43 -1.26 -4.95 118.68 125.33 2jza s LEU 14 Ca 0.43 2.54 -0.18 0.00 -1.03 0.00 0.00 54.13 55.89 2jza s LEU 14 Cb -0.09 -4.21 -0.07 0.00 0.03 0.00 0.00 46.19 41.85 2jza s LEU 14 CO 0.26 -1.17 1.01 -2.16 0.23 0.00 0.00 176.35 174.51 2jza s PRO 15 N -2.72 3.77 -1.61 1.29 0.04 -1.26 -3.99 135.00 130.52 2jza s PRO 15 Ca 0.66 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.82 2jza s PRO 15 Cb -0.35 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2jza s PRO 15 CO 0.42 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.44 2jza n GLY 16 N -1.04 -0.08 2.45 0.56 0.00 0.23 -4.94 105.19 102.37 2jza n GLY 16 Ca 0.08 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 2jza n GLY 16 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jza n THR 17 N -3.80 0.00 -3.15 2.61 -2.24 -1.26 -4.86 114.28 101.59 2jza n THR 17 Ca -0.21 -1.64 0.04 0.00 -2.27 0.00 0.00 64.05 59.97 2jza n THR 17 Cb 0.65 0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 69.76 2jza n THR 17 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jza s GLY 18 N -2.70 -1.07 -0.06 3.38 0.00 -1.25 -0.67 107.32 104.95 2jza s GLY 18 Ca 0.27 1.57 -0.02 0.00 0.00 0.00 0.00 44.72 46.54 2jza s GLY 18 CO 0.19 3.60 0.05 -1.34 0.00 0.00 0.00 173.10 175.60 2jza s VAL 19 N 2.86 4.59 -0.24 1.40 -7.23 -1.07 -4.62 120.40 116.09 2jza s VAL 19 Ca 0.15 -0.27 -0.29 0.00 -1.81 0.00 0.00 61.98 59.76 2jza s VAL 19 Cb -0.11 -3.01 -0.01 0.00 0.56 0.00 0.00 36.38 33.81 2jza s VAL 19 CO -0.23 0.51 1.29 0.00 -0.31 0.00 0.00 175.10 176.36 2jza s ALA 21 N 4.02 2.63 -0.90 0.00 0.00 0.10 -4.90 121.76 122.71 2jza s ALA 21 Ca 0.56 -1.11 -0.22 0.00 0.00 0.00 0.00 51.96 51.19 2jza s ALA 21 Cb -0.19 -0.83 0.08 0.00 0.00 0.00 0.00 23.12 22.18 2jza s ALA 21 CO 0.19 0.57 1.23 -1.17 0.00 0.00 0.00 175.76 176.58 2jza s LEU 22 N -1.18 4.20 -0.09 0.00 0.20 -1.26 -1.60 118.68 118.94 2jza s LEU 22 Ca 0.14 -1.49 0.04 0.00 0.69 0.00 0.00 54.13 53.51 2jza s LEU 22 Cb -0.11 -2.48 -0.00 0.00 -0.43 0.00 0.00 46.19 43.17 2jza s LEU 22 CO 0.04 -1.37 -0.24 -0.69 -0.29 0.00 0.00 176.35 173.81 2jza s VAL 23 N 4.04 2.11 -0.96 1.68 1.01 -0.47 -4.58 120.40 123.24 2jza s VAL 23 Ca 0.36 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2jza s VAL 23 Cb -0.05 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.53 2jza s VAL 23 CO -0.04 0.56 0.00 1.21 0.00 0.00 0.00 175.10 176.83 2jza n GLU 24 N 3.40 -1.05 -1.68 2.72 4.07 -1.26 -1.68 120.64 125.16 2jza n GLU 24 Ca -0.19 0.76 -0.04 0.00 -0.06 0.00 0.00 57.16 57.64 2jza n GLU 24 Cb 0.53 -4.80 -0.01 0.00 -0.06 0.00 0.00 31.44 27.10 2jza n GLU 24 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2jza n GLN 25 N -1.90 -0.29 -4.25 5.31 1.13 -1.26 -4.88 117.38 111.24 2jza n GLN 25 Ca -0.09 0.37 -0.14 0.00 -1.94 0.00 0.00 57.00 55.20 2jza n GLN 25 Cb 0.40 -4.07 -0.10 0.00 0.11 0.00 0.00 30.24 26.58 2jza n GLN 25 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2jza s GLN 26 N -3.43 1.20 -0.27 -1.09 -0.44 -0.68 -1.57 119.66 113.37 2jza s GLN 26 Ca 0.00 -1.61 -0.18 0.00 -2.50 0.00 0.00 55.36 51.06 2jza s GLN 26 Cb 0.00 -0.11 -0.02 0.00 -1.64 0.00 0.00 33.01 31.23 2jza s GLN 26 CO 0.00 -0.24 0.54 -0.65 0.50 0.00 0.00 175.29 175.44 2jza s GLN 27 N -4.01 4.02 -0.04 1.67 -1.52 -1.26 -1.36 119.66 117.16 2jza s GLN 27 Ca 0.31 0.31 0.01 0.00 -1.95 0.00 0.00 55.36 54.04 2jza s GLN 27 Cb 0.07 -3.67 0.02 0.00 -0.22 0.00 0.00 33.01 29.21 2jza s GLN 27 CO 0.08 -0.40 -0.03 0.42 -0.25 0.00 0.00 175.29 175.11 2jza s ILE 28 N 2.38 0.42 -0.06 1.08 1.01 -0.63 -4.43 121.20 120.97 2jza s ILE 28 Ca 0.22 -0.05 -0.17 0.00 0.00 0.00 0.00 60.65 60.65 2jza s ILE 28 Cb -0.15 -0.47 -0.05 0.00 0.01 0.00 0.00 42.46 41.80 2jza s ILE 28 CO 0.10 0.20 0.47 0.00 0.00 0.00 0.00 174.94 175.70 2jza s ALA 29 N 0.97 3.56 -0.32 9.38 0.00 0.15 0.02 121.76 135.51 2jza s ALA 29 Ca -0.10 -0.17 -0.06 0.00 0.00 0.00 0.00 51.96 51.63 2jza s ALA 29 Cb -0.14 -2.56 0.03 0.00 0.00 0.00 0.00 23.12 20.45 2jza s ALA 29 CO -0.01 0.21 0.08 0.08 0.00 0.00 0.00 175.76 176.12 2jza s VAL 30 N -0.14 3.69 0.16 0.00 1.01 -0.04 -1.06 120.40 124.01 2jza s VAL 30 Ca 0.26 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 2jza s VAL 30 Cb -0.16 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.11 2jza s VAL 30 CO 0.12 -0.09 0.50 -0.36 0.00 0.00 0.00 175.10 175.27 2jza s PHE 31 N 1.40 3.53 -0.35 5.22 0.40 0.19 -2.59 117.98 125.79 2jza s PHE 31 Ca -0.01 0.90 0.15 0.00 -0.60 0.00 0.00 56.93 57.37 2jza s PHE 31 Cb -0.19 -2.26 0.40 0.00 0.51 0.00 0.00 43.02 41.49 2jza s PHE 31 CO 0.02 0.40 0.85 0.54 0.70 0.00 0.00 175.22 177.73 2jza n ARG 32 N 0.48 1.06 -0.09 0.44 1.74 0.15 -1.39 116.66 119.05 2jza n ARG 32 Ca -0.04 -3.27 -0.10 0.00 -0.77 0.00 0.00 57.85 53.67 2jza n ARG 32 Cb 0.52 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.49 2jza n ARG 32 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2jza h PRO 33 N 2.98 0.43 0.00 5.56 0.11 -1.82 0.67 132.00 139.94 2jza h PRO 33 Ca -0.00 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 2jza h PRO 33 Cb 1.08 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2jza h PRO 33 CO 0.48 0.46 -0.45 0.00 -0.21 0.00 0.00 178.00 178.29 2jza h ARG 34 N 0.31 0.00 -4.82 1.05 3.08 -1.95 -3.37 114.38 108.69 2jza h ARG 34 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2jza h ARG 34 Cb 0.20 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.19 2jza h ARG 34 CO -0.01 0.45 -1.13 -1.71 -1.07 0.00 0.00 179.97 176.51 2jza n ASN 35 N -3.96 -4.19 0.00 7.04 5.15 -1.05 -4.98 115.26 113.28 2jza n ASN 35 Ca -0.02 1.23 0.00 0.00 -0.60 0.00 0.00 54.58 55.20 2jza n ASN 35 Cb 0.48 -4.80 0.00 0.00 -0.53 0.00 0.00 39.78 34.92 2jza n ASN 35 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2jza n ASP 36 N 1.02 0.00 -0.07 1.20 2.03 -1.26 -4.96 116.55 114.51 2jza n ASP 36 Ca -0.17 0.00 0.08 0.00 0.52 0.00 0.00 54.79 55.21 2jza n ASP 36 Cb 0.27 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.59 2jza n ASP 36 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jza n GLU 37 N 0.00 1.65 -2.12 -0.67 1.02 -1.26 -4.92 120.64 114.34 2jza n GLU 37 Ca 0.00 -0.16 -0.40 0.00 -0.02 0.00 0.00 57.16 56.58 2jza n GLU 37 Cb 0.00 -1.27 -0.03 0.00 -0.02 0.00 0.00 31.44 30.12 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 -2.43 2.95 -0.02 3.49 1.11 -1.26 -4.79 119.66 118.71 2jza s GLN 38 Ca 0.08 0.75 0.04 0.00 0.01 0.00 0.00 55.36 56.24 2jza s GLN 38 Cb 0.13 -4.28 -0.03 0.00 -1.01 0.00 0.00 33.01 27.82 2jza s GLN 38 CO 0.62 -2.34 -0.13 0.14 0.01 0.00 0.00 175.29 173.59 2jza s VAL 39 N 7.84 3.16 -0.28 1.09 -7.23 -1.26 -4.55 120.40 119.16 2jza s VAL 39 Ca 0.66 -0.83 0.00 0.00 -1.81 0.00 0.00 61.98 60.00 2jza s VAL 39 Cb -0.14 -2.29 0.08 0.00 0.56 0.00 0.00 36.38 34.59 2jza s VAL 39 CO 0.25 0.49 0.04 -0.31 -0.31 0.00 0.00 175.10 175.25 2jza s TYR 40 N -0.84 2.14 -0.46 2.82 2.02 -0.48 -4.87 117.35 117.68 2jza s TYR 40 Ca 0.14 -1.82 -0.12 0.00 -0.37 0.00 0.00 57.07 54.89 2jza s TYR 40 Cb -0.11 -1.77 0.09 0.00 -0.40 0.00 0.00 41.96 39.77 2jza s TYR 40 CO 0.03 -0.82 0.34 0.00 -1.57 0.00 0.00 175.55 173.53 2jza s ALA 41 N 1.47 3.43 0.07 3.71 0.00 -1.25 0.53 121.76 129.73 2jza s ALA 41 Ca 0.04 -2.23 0.03 0.00 0.00 0.00 0.00 51.96 49.80 2jza s ALA 41 Cb -0.18 -2.88 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 2jza s ALA 41 CO -0.15 -1.75 -0.08 0.96 0.00 0.00 0.00 175.76 174.74 2jza s ILE 42 N 1.51 0.72 -0.75 0.00 -4.36 -0.23 -2.97 121.20 115.11 2jza s ILE 42 Ca 0.04 -1.47 -0.07 0.00 -0.26 0.00 0.00 60.65 58.88 2jza s ILE 42 Cb -0.25 -1.13 -0.16 0.00 1.25 0.00 0.00 42.46 42.18 2jza s ILE 42 CO 0.03 -0.56 3.03 -1.20 0.24 0.00 0.00 174.94 176.49 2jza n SER 43 N 0.80 6.34 -3.84 4.36 7.64 -1.24 0.30 113.62 127.98 2jza n SER 43 Ca -0.18 -2.45 -0.42 0.00 1.01 0.00 0.00 58.87 56.83 2jza n SER 43 Cb 0.57 -1.37 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 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 3.15 5.62 -4.23 6.43 5.15 -1.26 -4.74 115.26 125.39 2jza n ASN 44 Ca 0.55 -3.17 -0.29 0.00 -0.60 0.00 0.00 54.58 51.08 2jza n ASN 44 Cb 0.51 -1.43 -0.16 0.00 -0.53 0.00 0.00 39.78 38.17 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 -0.34 1.75 0.17 -1.44 -1.09 -1.26 -4.52 121.20 114.47 2jza s ILE 45 Ca 0.40 -0.93 -0.31 0.00 -2.23 0.00 0.00 60.65 57.57 2jza s ILE 45 Cb 0.10 -1.47 -0.10 0.00 -1.58 0.00 0.00 42.46 39.41 2jza s ILE 45 CO 0.01 0.50 1.56 -0.62 -1.23 0.00 0.00 174.94 175.16 2jza s ASP 46 N -0.33 6.58 -0.03 3.58 2.15 -0.16 -4.89 116.67 123.57 2jza s ASP 46 Ca 0.03 2.63 0.08 0.00 0.43 0.00 0.00 52.55 55.72 2jza s ASP 46 Cb -0.10 -2.60 0.27 0.00 -0.30 0.00 0.00 42.92 40.19 2jza s ASP 46 CO 0.01 -0.82 1.14 -0.81 -0.17 0.00 0.00 175.17 174.52 2jza n PRO 47 N 3.80 1.93 -0.11 4.34 -0.04 -1.26 -2.10 135.00 141.56 2jza n PRO 47 Ca 0.13 -1.08 -0.18 0.00 -0.04 0.00 0.00 63.50 62.32 2jza n PRO 47 Cb 0.39 -1.40 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2jza n PRO 47 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2jza n PHE 48 N 0.31 0.00 0.09 0.54 7.35 -1.26 -4.75 117.46 119.74 2jza n PHE 48 Ca 0.10 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.80 2jza n PHE 48 Cb 0.36 -0.70 0.01 0.00 0.35 0.00 0.00 39.48 39.49 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 -4.27 2.48 -2.84 3.13 0.00 -1.26 -5.04 120.51 112.70 2jza n ALA 49 Ca -0.33 -0.49 -0.03 0.00 0.00 0.00 0.00 53.44 52.59 2jza n ALA 49 Cb 0.68 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 20.06 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 0.05 -1.65 -3.61 0.00 3.00 -0.89 -5.07 117.38 109.21 2jza n GLN 50 Ca 0.01 1.67 -0.15 0.00 -0.01 0.00 0.00 57.00 58.53 2jza n GLN 50 Cb 0.05 -5.38 -0.06 0.00 0.00 0.00 0.00 30.24 24.85 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2jza s ALA 51 N -2.76 -1.32 -1.19 -1.58 0.00 -1.24 -4.93 121.76 108.74 2jza s ALA 51 Ca 0.10 0.76 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 2jza s ALA 51 Cb -0.03 0.17 0.09 0.00 0.00 0.00 0.00 23.12 23.35 2jza s ALA 51 CO 0.69 -0.39 1.55 -1.54 0.00 0.00 0.00 175.76 176.08 2jza s SER 52 N -1.54 6.80 0.00 0.00 1.04 -1.26 -0.99 113.70 117.75 2jza s SER 52 Ca -0.09 -2.32 0.21 0.00 0.48 0.00 0.00 55.95 54.23 2jza s SER 52 Cb -0.02 -2.52 0.55 0.00 0.10 0.00 0.00 66.02 64.14 2jza s SER 52 CO 0.04 -1.14 1.47 1.33 0.98 0.00 0.00 173.24 175.92 2jza n VAL 53 N 6.02 0.87 -0.50 5.02 0.24 -1.26 -4.06 118.33 124.65 2jza n VAL 53 Ca 0.41 -0.94 0.07 0.00 -2.04 0.00 0.00 64.34 61.84 2jza n VAL 53 Cb 0.47 0.62 0.22 0.00 -1.47 0.00 0.00 33.84 33.68 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 1.49 3.55 -0.00 1.34 4.32 -1.26 -4.02 117.00 122.42 2jza n LEU 54 Ca 0.22 -2.38 -0.02 0.00 -0.02 0.00 0.00 56.01 53.81 2jza n LEU 54 Cb 0.60 -0.39 -0.01 0.00 -1.62 0.00 0.00 43.42 42.00 2jza n LEU 54 CO 0.15 0.74 -0.14 -1.54 -1.22 0.00 0.00 177.39 175.38 2jza n SER 55 N 0.34 0.77 -2.20 -1.43 3.41 -1.26 -4.49 113.62 108.76 2jza n SER 55 Ca 0.17 0.11 -0.17 0.00 -0.26 0.00 0.00 58.87 58.73 2jza n SER 55 Cb 0.65 -0.36 -0.14 0.00 -0.26 0.00 0.00 64.21 64.10 2jza n SER 55 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2jza n ARG 56 N -3.23 2.24 0.00 4.33 1.85 -1.26 -4.61 116.66 115.97 2jza n ARG 56 Ca -0.03 -1.29 0.00 0.00 -1.00 0.00 0.00 57.85 55.53 2jza n ARG 56 Cb 0.11 -2.10 0.00 0.00 -1.05 0.00 0.00 32.46 29.42 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 2.41 0.94 3.28 2.89 0.00 -1.26 -4.85 105.19 108.60 2jza n GLY 57 Ca 0.47 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.13 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 2.06 3.57 -0.45 -0.61 1.01 0.94 -4.89 121.20 122.82 2jza s ILE 58 Ca 0.00 -0.88 -0.26 0.00 0.00 0.00 0.00 60.65 59.50 2jza s ILE 58 Cb 0.00 -2.87 0.03 0.00 0.01 0.00 0.00 42.46 39.63 2jza s ILE 58 CO 0.00 0.07 0.98 -0.69 0.00 0.00 0.00 174.94 175.30 2jza s VAL 59 N 1.42 4.42 -0.29 2.92 1.01 -1.26 0.15 120.40 128.77 2jza s VAL 59 Ca 0.01 0.96 -0.09 0.00 0.00 0.00 0.00 61.98 62.86 2jza s VAL 59 Cb -0.17 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 2jza s VAL 59 CO 0.00 -0.83 0.13 0.00 0.00 0.00 0.00 175.10 174.41 2jza s ALA 60 N 3.89 3.24 -0.26 5.51 0.00 0.25 -4.98 121.76 129.41 2jza s ALA 60 Ca 0.40 -1.32 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 2jza s ALA 60 Cb -0.10 -2.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 2jza s ALA 60 CO 0.26 -0.79 0.32 -2.00 0.00 0.00 0.00 175.76 173.55 2jza s GLU 61 N 1.61 4.03 -0.96 0.00 2.12 -1.26 0.30 118.70 124.54 2jza s GLU 61 Ca 0.05 -0.05 -0.03 0.00 0.36 0.00 0.00 54.97 55.30 2jza s GLU 61 Cb -0.17 -3.63 0.26 0.00 0.26 0.00 0.00 34.13 30.85 2jza s GLU 61 CO 0.06 -0.19 1.01 1.58 -0.54 0.00 0.00 175.26 177.17 2jza n HIS 62 N 5.05 3.97 0.00 5.30 -0.00 0.11 -4.90 115.22 124.74 2jza n HIS 62 Ca -0.10 -3.75 0.00 0.00 0.46 0.00 0.00 57.72 54.32 2jza n HIS 62 Cb 0.51 -1.22 0.00 0.00 -0.12 0.00 0.00 29.99 29.16 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 1.99 0.00 0.00 1.57 1.13 -1.26 -1.57 117.38 119.23 2jza n GLN 63 Ca 0.24 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.30 2jza n GLN 63 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.72 2jza n GLN 63 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2jza n ASP 64 N 1.72 4.52 -4.84 1.08 2.03 -1.26 -5.05 116.55 114.75 2jza n ASP 64 Ca 0.00 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.98 2jza n ASP 64 Cb 0.00 0.78 -0.06 0.00 -0.72 0.00 0.00 41.12 41.12 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 -2.08 6.87 -0.23 1.67 -1.08 -0.61 -5.05 116.67 116.15 2jza s ASP 65 Ca 0.00 1.39 -0.00 0.00 -0.52 0.00 0.00 52.55 53.42 2jza s ASP 65 Cb 0.00 -2.41 0.03 0.00 -1.46 0.00 0.00 42.92 39.08 2jza s ASP 65 CO 0.00 -0.18 -0.10 -0.76 0.52 0.00 0.00 175.17 174.64 2jza s LEU 66 N -2.80 2.98 0.32 -1.34 1.43 -1.26 0.04 118.68 118.05 2jza s LEU 66 Ca 0.53 -0.92 0.10 0.00 -1.03 0.00 0.00 54.13 52.81 2jza s LEU 66 Cb -0.11 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 2jza s LEU 66 CO 0.18 -0.11 -0.05 0.26 0.23 0.00 0.00 176.35 176.86 2jza s TRP 67 N 1.27 2.49 -0.01 0.29 0.52 0.15 -1.16 118.94 122.49 2jza s TRP 67 Ca -0.01 -0.40 0.01 0.00 0.02 0.00 0.00 56.10 55.72 2jza s TRP 67 Cb -0.16 -1.34 0.01 0.00 -1.15 0.00 0.00 33.47 30.82 2jza s TRP 67 CO -0.07 0.56 -0.02 0.54 0.02 0.00 0.00 176.95 177.98 2jza s VAL 68 N -2.51 0.24 -0.10 4.03 0.11 0.20 -0.58 120.40 121.79 2jza s VAL 68 Ca 0.33 -0.08 0.03 0.00 -2.93 0.00 0.00 61.98 59.33 2jza s VAL 68 Cb -0.01 -0.24 -0.01 0.00 -1.53 0.00 0.00 36.38 34.59 2jza s VAL 68 CO 0.18 0.09 -0.19 0.00 -3.33 0.00 0.00 175.10 171.85 2jza s ALA 69 N 0.20 2.39 0.19 1.54 0.00 0.12 -0.78 121.76 125.43 2jza s ALA 69 Ca -0.02 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 50.68 2jza s ALA 69 Cb -0.04 -0.95 -0.09 0.00 0.00 0.00 0.00 23.12 22.04 2jza s ALA 69 CO -0.00 0.33 1.38 0.45 0.00 0.00 0.00 175.76 177.92 2jza s SER 70 N 0.12 6.79 0.34 0.00 0.15 -0.23 -0.04 113.70 120.83 2jza s SER 70 Ca -0.09 2.48 0.08 0.00 0.70 0.00 0.00 55.95 59.12 2jza s SER 70 Cb -0.16 -2.61 0.63 0.00 -1.71 0.00 0.00 66.02 62.18 2jza s SER 70 CO 0.06 -0.62 1.82 1.55 1.20 0.00 0.00 173.24 177.24 2jza h PRO 71 N 5.67 0.24 0.00 5.44 0.13 -1.89 -1.33 132.00 140.25 2jza h PRO 71 Ca -0.44 -0.08 -0.14 0.00 -0.87 0.00 0.00 66.00 64.46 2jza h PRO 71 Cb 1.21 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2jza h PRO 71 CO 0.80 0.49 -1.45 1.28 -0.23 0.00 0.00 178.00 178.89 2jza n LEU 72 N -4.16 1.90 0.21 1.56 4.77 -1.26 -4.59 117.00 115.42 2jza n LEU 72 Ca -0.01 0.32 0.12 0.00 -0.03 0.00 0.00 56.01 56.42 2jza n LEU 72 Cb 0.36 -0.74 0.21 0.00 -2.33 0.00 0.00 43.42 40.92 2jza n LEU 72 CO 0.40 -0.02 0.82 0.11 -1.33 0.00 0.00 177.39 177.37 2jza h LYS 73 N -0.96 0.00 -4.59 3.23 1.57 -1.88 -3.47 116.57 110.47 2jza h LYS 73 Ca -0.22 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.17 2jza h LYS 73 Cb 1.16 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.50 2jza h LYS 73 CO -0.13 0.00 -0.58 1.63 -0.57 0.00 0.00 179.45 179.79 2jza n LYS 74 N -3.04 -4.35 -2.91 3.15 5.02 -0.50 -4.95 118.16 110.59 2jza n LYS 74 Ca 0.04 0.82 -0.40 0.00 -2.02 0.00 0.00 58.31 56.75 2jza n LYS 74 Cb 0.51 -5.63 -0.06 0.00 -0.02 0.00 0.00 35.03 29.83 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 -5.71 4.65 -0.24 1.97 -1.52 -1.26 -4.72 119.66 112.84 2jza s GLN 75 Ca 0.30 1.26 -0.01 0.00 -1.95 0.00 0.00 55.36 54.96 2jza s GLN 75 Cb -0.14 -3.27 0.03 0.00 -0.22 0.00 0.00 33.01 29.40 2jza s GLN 75 CO 0.37 0.54 -0.09 -1.01 -0.25 0.00 0.00 175.29 174.85 2jza s HIS 76 N -1.09 3.03 0.26 0.91 3.76 -1.26 -1.07 115.29 119.84 2jza s HIS 76 Ca 0.38 -1.60 0.04 0.00 -0.15 0.00 0.00 55.06 53.73 2jza s HIS 76 Cb -0.24 -2.03 -0.06 0.00 1.11 0.00 0.00 32.58 31.37 2jza s HIS 76 CO 0.28 -0.74 0.01 -0.06 -0.85 0.00 0.00 174.74 173.38 2jza s PHE 77 N 1.31 1.72 0.34 1.40 0.08 0.04 -0.67 117.98 122.19 2jza s PHE 77 Ca 0.01 -0.92 -0.23 0.00 0.12 0.00 0.00 56.93 55.91 2jza s PHE 77 Cb -0.16 -1.03 -0.10 0.00 -0.57 0.00 0.00 43.02 41.16 2jza s PHE 77 CO -0.06 -0.00 0.90 1.03 -0.10 0.00 0.00 175.22 176.99 2jza s ARG 78 N -3.86 4.39 0.42 0.44 0.52 -1.09 0.61 118.95 120.37 2jza s ARG 78 Ca 0.31 1.15 0.18 0.00 -0.52 0.00 0.00 55.73 56.86 2jza s ARG 78 Cb 0.06 -2.60 0.92 0.00 0.52 0.00 0.00 34.95 33.85 2jza s ARG 78 CO 0.11 0.19 1.87 -0.07 0.02 0.00 0.00 175.30 177.43 2jza h LEU 79 N 2.75 0.00 -4.30 2.53 3.38 -1.45 -3.23 115.31 114.99 2jza h LEU 79 Ca -0.48 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.21 2jza h LEU 79 Cb 1.19 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.57 2jza h LEU 79 CO 0.64 0.30 -0.96 0.00 0.09 0.00 0.00 178.44 178.50 2jza n TYR 80 N -3.82 1.31 0.15 1.13 0.18 -1.26 -4.86 117.16 109.99 2jza n TYR 80 Ca -0.01 -1.81 0.00 0.00 1.88 0.00 0.00 57.90 57.96 2jza n TYR 80 Cb 0.38 -0.25 0.00 0.00 -0.38 0.00 0.00 39.34 39.10 2jza n TYR 80 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 2jza n ASP 81 N -0.49 -1.63 0.00 9.48 2.03 -1.24 -4.98 116.55 119.72 2jza n ASP 81 Ca 0.18 0.55 0.00 0.00 0.52 0.00 0.00 54.79 56.04 2jza n ASP 81 Cb 0.90 1.66 0.00 0.00 -0.72 0.00 0.00 41.12 42.96 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 0.17 1.37 3.82 0.27 0.00 -1.22 -3.78 105.19 105.82 2jza n GLY 82 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.07 3.15 0.32 1.61 0.08 -1.26 -1.63 117.98 118.17 2jza s PHE 83 Ca 0.00 1.41 -0.11 0.00 0.12 0.00 0.00 56.93 58.35 2jza s PHE 83 Cb 0.00 -2.87 -0.07 0.00 -0.57 0.00 0.00 43.02 39.51 2jza s PHE 83 CO 0.00 -1.20 0.68 0.00 -0.10 0.00 0.00 175.22 174.60 2jza h LEU 85 N 1.95 0.00 -2.69 0.00 5.85 -1.25 -3.43 115.31 115.74 2jza h LEU 85 Ca -0.47 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.18 2jza h LEU 85 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 2jza h LEU 85 CO 0.66 0.79 -0.12 -0.62 -0.34 0.00 0.00 178.44 178.81 2jza n GLU 86 N -4.62 1.07 -4.69 1.25 -0.58 -1.26 -5.07 120.64 106.74 2jza n GLU 86 Ca -0.09 -2.04 -0.31 0.00 -0.42 0.00 0.00 57.16 54.31 2jza n GLU 86 Cb 0.27 -1.18 -0.07 0.00 -0.57 0.00 0.00 31.44 29.89 2jza n GLU 86 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2jza n ASP 87 N -0.96 2.61 -0.49 1.62 9.92 -1.26 -5.04 116.55 122.95 2jza n ASP 87 Ca 0.10 -3.30 -0.02 0.00 -0.53 0.00 0.00 54.79 51.04 2jza n ASP 87 Cb 0.62 0.64 -0.02 0.00 -0.64 0.00 0.00 41.12 41.73 2jza n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jza n GLY 88 N -1.18 0.42 0.07 0.44 0.00 -1.26 -4.75 105.19 98.93 2jza n GLY 88 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 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 0.01 -1.90 4.61 0.00 -2.01 -3.46 119.26 116.51 2jza h ALA 89 Ca -0.13 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2jza h ALA 89 Cb 0.78 0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2jza h ALA 89 CO -0.07 0.37 0.00 0.66 0.00 0.00 0.00 179.25 180.22 2jza n TYR 90 N -4.65 0.00 -2.19 0.00 4.01 -1.26 -5.09 117.16 107.98 2jza n TYR 90 Ca -0.06 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.65 2jza n TYR 90 Cb 0.21 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 2jza n TYR 90 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2jza n SER 91 N -1.47 -2.19 -4.93 7.72 7.64 -1.26 -5.08 113.62 114.05 2jza n SER 91 Ca 0.00 1.02 -0.23 0.00 1.01 0.00 0.00 58.87 60.66 2jza n SER 91 Cb 0.00 -3.96 0.00 0.00 -1.01 0.00 0.00 64.21 59.24 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 -0.45 2.03 0.38 0.44 -7.23 -0.65 -5.01 120.40 109.91 2jza s VAL 92 Ca -0.16 -1.33 0.07 0.00 -1.81 0.00 0.00 61.98 58.75 2jza s VAL 92 Cb 0.01 -2.36 -0.01 0.00 0.56 0.00 0.00 36.38 34.58 2jza s VAL 92 CO 0.43 0.00 0.43 0.00 -0.31 0.00 0.00 175.10 175.66 2jza s ALA 93 N -2.67 4.19 -0.20 1.32 0.00 -1.26 -4.37 121.76 118.76 2jza s ALA 93 Ca 0.44 -1.67 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2jza s ALA 93 Cb -0.03 -1.39 0.05 0.00 0.00 0.00 0.00 23.12 21.75 2jza s ALA 93 CO 0.27 -0.14 -0.05 0.00 0.00 0.00 0.00 175.76 175.84 2jza s ALA 94 N -2.32 1.73 0.46 0.00 0.00 -1.25 -3.73 121.76 116.65 2jza s ALA 94 Ca 0.48 -1.10 -0.09 0.00 0.00 0.00 0.00 51.96 51.25 2jza s ALA 94 Cb -0.07 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 2jza s ALA 94 CO 0.30 -1.00 0.80 0.71 0.00 0.00 0.00 175.76 176.57 2jza s TYR 95 N 1.51 3.52 0.63 0.00 1.51 -1.16 -5.03 117.35 118.33 2jza s TYR 95 Ca -0.03 0.98 -0.09 0.00 -1.01 0.00 0.00 57.07 56.92 2jza s TYR 95 Cb -0.17 -2.42 -0.01 0.00 -0.11 0.00 0.00 41.96 39.26 2jza s TYR 95 CO -0.07 -0.23 0.99 0.34 -1.11 0.00 0.00 175.55 175.47 2jza s ASP 96 N -3.62 5.77 0.03 2.29 -1.08 -1.17 -4.63 116.67 114.26 2jza s ASP 96 Ca 0.50 1.07 -0.13 0.00 -0.52 0.00 0.00 52.55 53.47 2jza s ASP 96 Cb -0.10 -2.04 0.02 0.00 -1.46 0.00 0.00 42.92 39.33 2jza s ASP 96 CO 0.39 -1.06 0.28 0.42 0.52 0.00 0.00 175.17 175.71 2jza s THR 97 N -3.15 0.08 0.03 1.71 -4.23 -1.26 -0.09 115.64 108.74 2jza s THR 97 Ca 0.55 -0.69 -0.20 0.00 -1.18 0.00 0.00 61.69 60.17 2jza s THR 97 Cb -0.11 -0.87 0.04 0.00 1.34 0.00 0.00 72.50 72.90 2jza s THR 97 CO 0.50 -0.38 0.46 0.00 -0.54 0.00 0.00 174.62 174.66 2jza s GLN 98 N -2.34 0.95 -0.60 3.99 -2.07 0.48 -4.93 119.66 115.13 2jza s GLN 98 Ca -0.07 -0.25 0.04 0.00 -1.82 0.00 0.00 55.36 53.27 2jza s GLN 98 Cb -0.02 0.43 0.16 0.00 -1.09 0.00 0.00 33.01 32.49 2jza s GLN 98 CO -0.02 -0.32 0.40 0.08 -1.32 0.00 0.00 175.29 174.10 2jza s VAL 99 N -2.25 2.41 -2.82 3.63 1.01 -1.26 -2.17 120.40 118.95 2jza s VAL 99 Ca -0.07 -3.72 0.25 0.00 0.00 0.00 0.00 61.98 58.45 2jza s VAL 99 Cb -0.01 -2.61 0.28 0.00 0.00 0.00 0.00 36.38 34.03 2jza s VAL 99 CO -0.00 -0.97 1.39 1.07 0.00 0.00 0.00 175.10 176.58 2jza n THR 100 N 2.48 0.00 -2.53 3.92 5.66 -1.26 -4.98 114.28 117.57 2jza n THR 100 Ca 0.16 -0.42 0.00 0.00 -3.05 0.00 0.00 64.05 60.74 2jza n THR 100 Cb 0.36 1.22 0.00 0.00 -1.55 0.00 0.00 70.33 70.35 2jza n THR 100 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jza n ASN 101 N 0.97 0.00 0.03 1.09 2.85 -1.26 -5.00 115.26 113.94 2jza n ASN 101 Ca 0.15 -0.48 0.12 0.00 -0.11 0.00 0.00 54.58 54.26 2jza n ASN 101 Cb 0.53 0.00 0.48 0.00 1.24 0.00 0.00 39.78 42.03 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 -1.37 3.71 8.20 0.00 -1.26 -4.74 105.19 109.73 2jza n GLY 102 Ca 0.00 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.42 5.09 -0.14 1.61 2.20 -1.26 -0.91 114.94 118.12 2jza s ASN 103 Ca 0.10 -0.21 -0.08 0.00 -0.94 0.00 0.00 52.86 51.73 2jza s ASN 103 Cb 0.14 -1.22 -0.04 0.00 -2.00 0.00 0.00 41.25 38.13 2jza s ASN 103 CO 0.45 0.13 0.15 -0.69 -2.94 0.00 0.00 177.10 174.20 2jza s VAL 104 N -1.52 5.47 0.07 3.54 1.01 0.51 -4.35 120.40 125.13 2jza s VAL 104 Ca 0.28 0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.55 2jza s VAL 104 Cb -0.11 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 2jza s VAL 104 CO 0.20 0.56 -0.19 -1.10 0.00 0.00 0.00 175.10 174.57 2jza s GLN 105 N -0.58 1.16 0.20 2.72 -0.21 -0.92 -0.38 119.66 121.64 2jza s GLN 105 Ca 0.13 -1.00 0.08 0.00 0.02 0.00 0.00 55.36 54.59 2jza s GLN 105 Cb -0.12 -1.31 -0.05 0.00 1.00 0.00 0.00 33.01 32.53 2jza s GLN 105 CO 0.02 0.32 -0.16 0.96 -2.12 0.00 0.00 175.29 174.31 2jza s ILE 106 N -0.99 1.81 -0.27 1.08 -0.00 -0.70 -0.38 121.20 121.74 2jza s ILE 106 Ca 0.05 -2.12 -0.10 0.00 -0.00 0.00 0.00 60.65 58.48 2jza s ILE 106 Cb -0.09 -1.99 -0.04 0.00 -0.00 0.00 0.00 42.46 40.34 2jza s ILE 106 CO 0.03 -0.49 0.14 -0.55 -0.00 0.00 0.00 174.94 174.07 2jza s SER 107 N -3.11 5.65 -0.20 4.36 0.15 0.87 -0.60 113.70 120.83 2jza s SER 107 Ca 0.21 -0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.74 2jza s SER 107 Cb -0.03 -2.04 0.03 0.00 -1.71 0.00 0.00 66.02 62.28 2jza s SER 107 CO 0.07 -0.06 -0.17 -0.63 1.20 0.00 0.00 173.24 173.66 2jza s ILE 108 N 1.69 2.00 -0.20 6.45 1.01 -1.00 -3.04 121.20 128.10 2jza s ILE 108 Ca 0.07 -1.07 0.15 0.00 0.00 0.00 0.00 60.65 59.80 2jza s ILE 108 Cb -0.16 -1.90 0.33 0.00 0.01 0.00 0.00 42.46 40.74 2jza s ILE 108 CO 0.08 0.38 1.22 0.00 0.00 0.00 0.00 174.94 176.62 2jza n ALA 109 N 4.60 2.45 -3.63 9.38 0.00 -1.26 -4.89 120.51 127.15 2jza n ALA 109 Ca -0.19 -2.17 -0.07 0.00 0.00 0.00 0.00 53.44 51.02 2jza n ALA 109 Cb 0.48 -0.44 -0.07 0.00 0.00 0.00 0.00 19.45 19.43 2jza n ALA 109 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jza s ASP 110 N -2.15 -0.27 0.00 0.00 -1.08 -1.26 -5.13 116.67 106.79 2jza s ASP 110 Ca 0.30 0.48 0.00 0.00 -0.52 0.00 0.00 52.55 52.81 2jza s ASP 110 Cb 0.25 0.47 0.00 0.00 -1.46 0.00 0.00 42.92 42.18 2jza s ASP 110 CO 0.06 -0.12 0.00 -1.20 0.52 0.00 0.00 175.17 174.43 2jza n SER 111 N 1.69 0.00 -1.34 -0.34 7.64 -1.26 -5.10 113.62 114.92 2jza n SER 111 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.78 2jza n SER 111 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2jza n SER 111 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2jza n ASP 112 N -2.16 -4.50 -4.64 6.43 2.03 -1.26 -4.87 116.55 107.58 2jza n ASP 112 Ca 0.00 0.58 -0.42 0.00 0.52 0.00 0.00 54.79 55.47 2jza n ASP 112 Cb 0.00 -2.41 -0.03 0.00 -0.72 0.00 0.00 41.12 37.96 2jza n ASP 112 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2jza s VAL 113 N -0.19 3.19 -0.62 5.18 1.01 -1.26 -4.64 120.40 123.07 2jza s VAL 113 Ca 0.00 0.22 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 2jza s VAL 113 Cb 0.00 -3.17 0.16 0.00 0.00 0.00 0.00 36.38 33.37 2jza s VAL 113 CO 0.00 -0.06 0.50 0.00 0.00 0.00 0.00 175.10 175.54 2jza s ALA 114 N 5.54 3.66 -0.56 5.51 0.00 -0.61 -5.04 121.76 130.26 2jza s ALA 114 Ca 0.87 -2.96 -0.20 0.00 0.00 0.00 0.00 51.96 49.67 2jza s ALA 114 Cb -0.36 -3.00 0.07 0.00 0.00 0.00 0.00 23.12 19.82 2jza s ALA 114 CO 0.37 -2.07 0.74 0.54 0.00 0.00 0.00 175.76 175.33 2jza s VAL 115 N 0.64 4.71 -0.08 0.00 0.11 -1.26 -4.69 120.40 119.83 2jza s VAL 115 Ca 0.12 -0.49 -0.00 0.00 -2.93 0.00 0.00 61.98 58.68 2jza s VAL 115 Cb -0.20 -4.44 0.02 0.00 -1.53 0.00 0.00 36.38 30.23 2jza s VAL 115 CO -0.04 -1.02 -0.05 -0.62 -3.33 0.00 0.00 175.10 170.04 2jza s ASP 116 N 3.09 1.72 0.12 3.54 -1.08 -1.26 -5.11 116.67 117.69 2jza s ASP 116 Ca 0.17 -0.20 -0.31 0.00 -0.52 0.00 0.00 52.55 51.69 2jza s ASP 116 Cb -0.19 -0.64 -0.10 0.00 -1.46 0.00 0.00 42.92 40.52 2jza s ASP 116 CO 0.11 -0.11 1.86 -0.46 0.52 0.00 0.00 175.17 177.09 2jza n ASN 117 N 4.71 4.10 -4.02 -0.34 6.94 -1.26 -4.93 115.26 120.47 2jza n ASN 117 Ca -0.14 0.97 -0.33 0.00 -0.02 0.00 0.00 54.58 55.07 2jza n ASN 117 Cb 0.50 -1.55 -0.09 0.00 -2.36 0.00 0.00 39.78 36.28 2jza n ASN 117 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2jza s SER 118 N 2.98 5.45 -0.20 0.53 0.01 -1.26 -5.05 113.70 116.16 2jza s SER 118 Ca 0.83 -3.75 -0.29 0.00 1.31 0.00 0.00 55.95 54.05 2jza s SER 118 Cb -0.47 -1.79 -0.02 0.00 0.21 0.00 0.00 66.02 63.96 2jza s SER 118 CO 0.38 -0.15 1.43 -1.58 0.41 0.00 0.00 173.24 173.73 2jza s GLN 119 N -1.34 4.01 -0.23 12.44 2.00 -1.26 -4.95 119.66 130.34 2jza s GLN 119 Ca 0.26 1.63 -0.28 0.00 -2.00 0.00 0.00 55.36 54.96 2jza s GLN 119 Cb -0.07 -3.91 -0.04 0.00 0.80 0.00 0.00 33.01 29.79 2jza s GLN 119 CO -0.14 -1.01 2.06 -1.25 -0.50 0.00 0.00 175.29 174.45 2jza s PRO 120 N 4.10 3.30 -0.14 1.67 0.04 -1.26 -4.94 135.00 137.77 2jza s PRO 120 Ca 0.63 1.90 -0.29 0.00 0.04 0.00 0.00 61.00 63.28 2jza s PRO 120 Cb -0.23 -4.29 -0.02 0.00 0.04 0.00 0.00 34.50 30.00 2jza s PRO 120 CO 0.23 -1.91 1.22 -0.51 0.04 0.00 0.00 177.00 176.07 2jza s LEU 121 N 7.47 4.20 0.01 -3.56 1.43 -1.26 -4.96 118.68 122.01 2jza s LEU 121 Ca 0.93 1.69 -0.30 0.00 -1.03 0.00 0.00 54.13 55.42 2jza s LEU 121 Cb -0.31 -3.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.29 2jza s LEU 121 CO 0.35 -0.69 2.00 -2.84 0.23 0.00 0.00 176.35 175.40 2jza s PRO 122 N 3.06 4.02 -0.19 1.29 0.02 -1.26 -4.97 135.00 136.97 2jza s PRO 122 Ca 0.54 2.55 -0.01 0.00 0.02 0.00 0.00 61.00 64.09 2jza s PRO 122 Cb -0.22 -4.19 0.05 0.00 0.02 0.00 0.00 34.50 30.17 2jza s PRO 122 CO 0.16 -1.10 -0.02 -1.17 -0.33 0.00 0.00 177.00 174.55 2jza s LEU 123 N 4.93 1.68 0.01 -5.54 0.20 -1.26 -5.12 118.68 113.58 2jza s LEU 123 Ca 0.90 -0.86 0.08 0.00 0.69 0.00 0.00 54.13 54.95 2jza s LEU 123 Cb -0.42 -0.84 -0.02 0.00 -0.43 0.00 0.00 46.19 44.48 2jza s LEU 123 CO 0.41 -0.25 -0.25 -1.83 -0.29 0.00 0.00 176.35 174.14 2jza s GLU 124 N 1.67 2.02 -0.57 1.98 -1.05 -1.26 -5.08 118.70 116.41 2jza s GLU 124 Ca -0.02 -0.98 0.04 0.00 -0.15 0.00 0.00 54.97 53.86 2jza s GLU 124 Cb -0.17 -2.05 0.15 0.00 -0.44 0.00 0.00 34.13 31.62 2jza s GLU 124 CO -0.07 0.55 0.37 -1.58 0.95 0.00 0.00 175.26 175.47 2jza s HIS 125 N -0.71 2.82 -0.26 4.83 2.46 -1.26 -5.08 115.29 118.09 2jza s HIS 125 Ca 0.11 -2.98 -0.13 0.00 0.47 0.00 0.00 55.06 52.53 2jza s HIS 125 Cb -0.10 -2.32 -0.04 0.00 -0.13 0.00 0.00 32.58 29.98 2jza s HIS 125 CO 0.01 -0.68 0.29 -3.38 -2.47 0.00 0.00 174.74 168.51 2jza s HIS 126 N -0.61 3.26 -0.96 3.88 -3.43 -1.26 -5.01 115.29 111.16 2jza s HIS 126 Ca 0.23 0.30 -0.03 0.00 -0.80 0.00 0.00 55.06 54.76 2jza s HIS 126 Cb -0.13 -2.47 0.24 0.00 -1.43 0.00 0.00 32.58 28.80 2jza s HIS 126 CO -0.10 -0.15 0.93 1.58 -2.00 0.00 0.00 174.74 175.00 2jza n HIS 127 N 5.05 4.30 -3.90 0.38 -0.00 -1.26 -4.95 115.22 114.84 2jza n HIS 127 Ca -0.11 -3.95 -0.30 0.00 0.46 0.00 0.00 57.72 53.81 2jza n HIS 127 Cb 0.51 -1.26 -0.13 0.00 -0.12 0.00 0.00 29.99 29.00 2jza n HIS 127 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2jza s HIS 128 N -1.55 3.35 -0.04 1.57 3.76 -1.26 -5.06 115.29 116.07 2jza s HIS 128 Ca 0.29 -3.18 0.02 0.00 -0.15 0.00 0.00 55.06 52.04 2jza s HIS 128 Cb -0.06 -2.84 0.01 0.00 1.11 0.00 0.00 32.58 30.80 2jza s HIS 128 CO -0.09 -0.69 -0.08 -1.58 -0.85 0.00 0.00 174.74 171.44 2jza s HIS 129 N -0.67 0.99 -2.00 1.40 2.46 -1.26 -5.33 115.29 110.88 2jza s HIS 129 Ca 0.20 -0.28 0.26 0.00 0.47 0.00 0.00 55.06 55.71 2jza s HIS 129 Cb -0.18 -0.75 1.56 0.00 -0.13 0.00 0.00 32.58 33.08 2jza s HIS 129 CO -0.06 -0.16 1.91 1.58 -2.47 0.00 0.00 174.74 175.55