#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 -1.23 7.83 3.41 -1.26 -4.58 113.62 117.78 2jza n SER 2 Ca 0.00 0.33 0.11 0.00 -0.26 0.00 0.00 58.87 59.06 2jza n SER 2 Cb 0.00 -0.48 0.27 0.00 -0.26 0.00 0.00 64.21 63.75 2jza n SER 2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jza n GLN 3 N -2.09 2.64 -2.66 4.33 10.64 -1.26 -4.88 117.38 124.09 2jza n GLN 3 Ca 0.00 -2.49 -0.43 0.00 -1.83 0.00 0.00 57.00 52.25 2jza n GLN 3 Cb 0.00 -1.53 -0.02 0.00 -0.86 0.00 0.00 30.24 27.83 2jza n GLN 3 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 2jza s TRP 4 N -1.16 2.94 -0.20 2.61 0.52 -1.26 -4.13 118.94 118.27 2jza s TRP 4 Ca 0.44 0.79 -0.14 0.00 0.02 0.00 0.00 56.10 57.21 2jza s TRP 4 Cb 0.24 -4.10 -0.04 0.00 -1.15 0.00 0.00 33.47 28.41 2jza s TRP 4 CO 0.31 -1.07 0.32 0.99 0.02 0.00 0.00 176.95 177.52 2jza s THR 5 N 4.05 5.26 0.12 2.01 2.01 0.23 -4.86 115.64 124.45 2jza s THR 5 Ca 0.45 0.56 -0.30 0.00 0.31 0.00 0.00 61.69 62.71 2jza s THR 5 Cb -0.09 -3.66 -0.07 0.00 0.01 0.00 0.00 72.50 68.69 2jza s THR 5 CO 0.26 0.31 1.20 -0.89 -0.69 0.00 0.00 174.62 174.80 2jza s THR 6 N 1.00 3.83 -0.04 -0.82 2.01 -1.26 -0.95 115.64 119.41 2jza s THR 6 Ca 0.16 1.41 -0.03 0.00 0.31 0.00 0.00 61.69 63.54 2jza s THR 6 Cb -0.14 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.46 2jza s THR 6 CO 0.06 0.16 -0.06 0.52 -0.69 0.00 0.00 174.62 174.61 2jza n VAL 7 N 3.30 0.36 -3.28 3.82 0.31 0.22 -4.94 118.33 118.12 2jza n VAL 7 Ca 0.07 0.42 0.00 0.00 -0.01 0.00 0.00 64.34 64.82 2jza n VAL 7 Cb 0.46 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.67 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 -1.35 3.62 0.29 0.00 1.02 -1.26 -0.11 119.74 121.95 2jza s LYS 9 Ca 0.00 1.09 0.15 0.00 0.02 0.00 0.00 55.97 57.23 2jza s LYS 9 Cb 0.00 -2.08 0.33 0.00 -0.52 0.00 0.00 37.83 35.56 2jza s LYS 9 CO 0.00 -0.55 1.57 1.25 -0.92 0.00 0.00 175.35 176.70 2jza h LEU 10 N 0.68 0.00 -0.84 3.17 5.85 -0.71 -3.13 115.31 120.34 2jza h LEU 10 Ca -0.47 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.13 2jza h LEU 10 Cb 1.20 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2jza h LEU 10 CO 0.59 0.54 -0.50 -0.78 -0.34 0.00 0.00 178.44 177.95 2jza h ASP 11 N 0.00 0.21 1.36 1.25 3.58 -1.93 -2.59 116.42 118.30 2jza h ASP 11 Ca -0.01 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.34 2jza h ASP 11 Cb 1.19 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.18 2jza h ASP 11 CO 0.07 0.68 0.00 -0.67 -2.88 0.00 0.00 179.24 176.44 2jza n ASP 12 N -3.95 0.72 -4.58 2.28 2.03 -1.19 -4.64 116.55 107.23 2jza n ASP 12 Ca -0.02 0.58 -0.41 0.00 0.52 0.00 0.00 54.79 55.46 2jza n ASP 12 Cb 0.54 -0.77 -0.08 0.00 -0.72 0.00 0.00 41.12 40.10 2jza n ASP 12 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2jza s ILE 13 N -3.11 5.02 0.14 5.18 1.01 -0.98 -5.00 121.20 123.47 2jza s ILE 13 Ca 0.10 0.51 -0.31 0.00 0.00 0.00 0.00 60.65 60.95 2jza s ILE 13 Cb 0.13 -3.93 -0.10 0.00 0.01 0.00 0.00 42.46 38.57 2jza s ILE 13 CO 0.57 -0.14 1.58 -0.76 0.00 0.00 0.00 174.94 176.19 2jza s LEU 14 N 2.40 4.37 0.03 2.97 1.43 -1.26 -4.94 118.68 123.68 2jza s LEU 14 Ca 0.20 2.57 -0.30 0.00 -1.03 0.00 0.00 54.13 55.57 2jza s LEU 14 Cb -0.15 -3.59 -0.07 0.00 0.03 0.00 0.00 46.19 42.41 2jza s LEU 14 CO 0.12 -0.83 1.61 -2.16 0.23 0.00 0.00 176.35 175.32 2jza s PRO 15 N 1.49 4.21 0.00 1.29 0.04 -1.26 -3.03 135.00 137.75 2jza s PRO 15 Ca 0.71 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.98 2jza s PRO 15 Cb -0.43 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2jza s PRO 15 CO 0.31 -0.72 0.00 0.41 0.04 0.00 0.00 177.00 177.04 2jza n GLY 16 N 3.95 1.68 3.81 0.56 0.00 0.33 -4.91 105.19 110.62 2jza n GLY 16 Ca 0.16 -0.11 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.00 0.00 0.01 2.61 -4.23 -0.94 -4.95 115.64 106.15 2jza s THR 17 Ca 0.00 -0.84 0.01 0.00 -1.18 0.00 0.00 61.69 59.68 2jza s THR 17 Cb 0.00 -2.05 -0.01 0.00 1.34 0.00 0.00 72.50 71.78 2jza s THR 17 CO 0.00 0.00 -0.04 -0.83 -0.54 0.00 0.00 174.62 173.21 2jza s GLY 18 N -2.95 0.24 0.05 3.99 0.00 -1.26 0.47 107.32 107.85 2jza s GLY 18 Ca 0.12 -0.37 0.06 0.00 0.00 0.00 0.00 44.72 44.53 2jza s GLY 18 CO 0.05 -0.39 -0.17 -1.34 0.00 0.00 0.00 173.10 171.25 2jza s VAL 19 N -0.70 1.32 -0.01 1.40 -7.23 -0.95 -4.75 120.40 109.48 2jza s VAL 19 Ca -0.06 -1.11 -0.23 0.00 -1.81 0.00 0.00 61.98 58.78 2jza s VAL 19 Cb -0.05 -1.18 -0.05 0.00 0.56 0.00 0.00 36.38 35.66 2jza s VAL 19 CO -0.00 0.05 0.68 0.00 -0.31 0.00 0.00 175.10 175.53 2jza s ALA 21 N 0.20 1.46 -0.65 0.00 0.00 0.07 -4.92 121.76 117.91 2jza s ALA 21 Ca 0.36 -0.58 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 2jza s ALA 21 Cb -0.19 -0.75 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 2jza s ALA 21 CO 0.19 -0.08 1.68 -1.17 0.00 0.00 0.00 175.76 176.38 2jza s LEU 22 N 1.02 3.25 -0.41 0.00 1.98 -1.26 -1.05 118.68 122.21 2jza s LEU 22 Ca -0.07 0.08 -0.06 0.00 -2.89 0.00 0.00 54.13 51.19 2jza s LEU 22 Cb -0.15 -2.54 0.09 0.00 0.66 0.00 0.00 46.19 44.26 2jza s LEU 22 CO -0.01 -2.21 0.23 -0.69 -1.89 0.00 0.00 176.35 171.77 2jza s VAL 23 N 8.05 3.81 0.00 1.68 1.01 -0.11 -4.83 120.40 130.00 2jza s VAL 23 Ca 0.57 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.89 2jza s VAL 23 Cb -0.11 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.84 2jza s VAL 23 CO 0.19 -0.57 0.00 -0.62 0.00 0.00 0.00 175.10 174.10 2jza n GLU 24 N 4.79 0.00 0.01 2.72 -0.58 -1.26 -3.30 120.64 123.01 2jza n GLU 24 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2jza n GLU 24 Cb 0.42 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.29 2jza n GLU 24 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jza n GLN 25 N 0.00 0.00 -3.88 3.49 -0.00 -1.26 -4.93 117.38 110.79 2jza n GLN 25 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.00 56.78 2jza n GLN 25 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 30.24 30.19 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 -2.00 2.47 -0.19 2.61 -0.21 -1.21 -5.08 119.66 116.06 2jza s GLN 26 Ca 0.00 -1.54 -0.15 0.00 0.02 0.00 0.00 55.36 53.69 2jza s GLN 26 Cb 0.00 -2.27 -0.04 0.00 1.00 0.00 0.00 33.01 31.70 2jza s GLN 26 CO 0.00 -0.02 0.34 -0.65 -2.12 0.00 0.00 175.29 172.84 2jza s GLN 27 N -3.97 4.20 -0.11 2.91 -0.21 -1.26 -0.94 119.66 120.27 2jza s GLN 27 Ca 0.42 0.12 -0.02 0.00 0.02 0.00 0.00 55.36 55.91 2jza s GLN 27 Cb -0.02 -3.50 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 2jza s GLN 27 CO 0.25 0.07 -0.05 0.42 -2.12 0.00 0.00 175.29 173.86 2jza s ILE 28 N 0.97 3.78 -0.24 1.08 1.09 -0.22 -4.70 121.20 122.97 2jza s ILE 28 Ca 0.17 -0.42 -0.16 0.00 -1.10 0.00 0.00 60.65 59.14 2jza s ILE 28 Cb -0.14 -2.60 -0.03 0.00 -1.06 0.00 0.00 42.46 38.62 2jza s ILE 28 CO 0.06 0.54 0.43 0.00 -0.10 0.00 0.00 174.94 175.87 2jza s ALA 29 N -0.18 3.57 -0.44 9.38 0.00 0.42 -0.75 121.76 133.76 2jza s ALA 29 Ca 0.03 -0.64 -0.10 0.00 0.00 0.00 0.00 51.96 51.25 2jza s ALA 29 Cb -0.13 -2.74 0.08 0.00 0.00 0.00 0.00 23.12 20.34 2jza s ALA 29 CO 0.03 -0.55 0.30 0.08 0.00 0.00 0.00 175.76 175.62 2jza s VAL 30 N 1.85 4.42 0.11 0.00 1.01 0.29 -1.39 120.40 126.69 2jza s VAL 30 Ca 0.18 -1.38 -0.30 0.00 0.00 0.00 0.00 61.98 60.49 2jza s VAL 30 Cb -0.15 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 2jza s VAL 30 CO 0.09 -0.55 0.96 -0.36 0.00 0.00 0.00 175.10 175.24 2jza s PHE 31 N 1.46 3.81 -0.68 5.22 0.40 0.17 -2.23 117.98 126.14 2jza s PHE 31 Ca 0.03 1.80 0.05 0.00 -0.60 0.00 0.00 56.93 58.21 2jza s PHE 31 Cb -0.24 -3.06 0.16 0.00 0.51 0.00 0.00 43.02 40.40 2jza s PHE 31 CO 0.03 0.19 0.46 0.50 0.70 0.00 0.00 175.22 177.10 2jza s ARG 32 N -0.02 2.40 0.39 0.44 3.52 0.18 -0.37 118.95 125.49 2jza s ARG 32 Ca 0.47 -3.21 0.20 0.00 -0.13 0.00 0.00 55.73 53.06 2jza s ARG 32 Cb -0.23 -3.42 0.74 0.00 -1.56 0.00 0.00 34.95 30.47 2jza s ARG 32 CO 0.30 -1.25 1.76 -1.00 -0.81 0.00 0.00 175.30 174.30 2jza h PRO 33 N 5.63 0.00 -6.04 5.12 0.13 -1.78 0.97 132.00 136.02 2jza h PRO 33 Ca 0.10 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.69 2jza h PRO 33 Cb 0.78 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.84 2jza h PRO 33 CO 0.72 0.34 -0.49 1.03 -0.23 0.00 0.00 178.00 179.36 2jza s ARG 34 N -3.63 2.35 0.00 0.86 0.52 -1.26 -4.35 118.95 113.43 2jza s ARG 34 Ca 0.00 -1.65 0.23 0.00 -0.52 0.00 0.00 55.73 53.79 2jza s ARG 34 Cb 0.11 -2.14 1.13 0.00 0.52 0.00 0.00 34.95 34.56 2jza s ARG 34 CO 0.67 -0.03 1.76 0.27 0.02 0.00 0.00 175.30 178.00 2jza n ASN 35 N -1.25 0.74 -0.20 0.23 6.94 -1.26 -4.08 115.26 116.37 2jza n ASN 35 Ca -0.01 -1.45 0.00 0.00 -0.02 0.00 0.00 54.58 53.10 2jza n ASN 35 Cb 0.63 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 38.01 2jza n ASN 35 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2jza n ASP 36 N -0.34 0.00 -1.44 0.53 2.03 -1.26 -4.99 116.55 111.09 2jza n ASP 36 Ca 0.17 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.52 2jza n ASP 36 Cb 0.20 0.00 0.31 0.00 -0.72 0.00 0.00 41.12 40.91 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 3.58 -3.46 -0.67 1.02 -1.26 -4.91 120.64 114.94 2jza n GLU 37 Ca 0.00 -3.02 -0.38 0.00 -0.02 0.00 0.00 57.16 53.74 2jza n GLU 37 Cb 0.00 -2.05 -0.09 0.00 -0.02 0.00 0.00 31.44 29.29 2jza n GLU 37 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2jza s GLN 38 N -2.89 4.09 0.35 3.49 2.00 -1.26 -4.94 119.66 120.50 2jza s GLN 38 Ca 0.49 0.01 0.07 0.00 -2.00 0.00 0.00 55.36 53.93 2jza s GLN 38 Cb 0.39 -3.58 -0.07 0.00 0.80 0.00 0.00 33.01 30.55 2jza s GLN 38 CO 0.11 -0.10 -0.03 0.14 -0.50 0.00 0.00 175.29 174.91 2jza s VAL 39 N 1.52 1.88 -0.23 1.34 -7.23 -1.26 -4.16 120.40 112.26 2jza s VAL 39 Ca 0.14 -2.09 -0.04 0.00 -1.81 0.00 0.00 61.98 58.18 2jza s VAL 39 Cb -0.15 -2.74 0.08 0.00 0.56 0.00 0.00 36.38 34.13 2jza s VAL 39 CO 0.08 -0.13 0.10 -0.31 -0.31 0.00 0.00 175.10 174.53 2jza s TYR 40 N -2.83 0.42 -0.49 2.82 2.02 0.50 -4.93 117.35 114.85 2jza s TYR 40 Ca 0.33 -0.67 -0.14 0.00 -0.37 0.00 0.00 57.07 56.22 2jza s TYR 40 Cb 0.06 -0.87 0.11 0.00 -0.40 0.00 0.00 41.96 40.86 2jza s TYR 40 CO 0.16 -0.67 0.41 0.00 -1.57 0.00 0.00 175.55 173.89 2jza s ALA 41 N 2.06 3.53 0.34 3.71 0.00 -1.26 0.45 121.76 130.60 2jza s ALA 41 Ca 0.05 -2.38 0.03 0.00 0.00 0.00 0.00 51.96 49.66 2jza s ALA 41 Cb -0.16 -3.06 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 2jza s ALA 41 CO -0.21 -1.88 0.11 0.96 0.00 0.00 0.00 175.76 174.75 2jza s ILE 42 N 1.54 0.68 -1.43 0.00 -4.36 -0.49 -3.21 121.20 113.94 2jza s ILE 42 Ca 0.04 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.31 2jza s ILE 42 Cb -0.27 -2.56 0.06 0.00 1.25 0.00 0.00 42.46 40.94 2jza s ILE 42 CO 0.03 0.00 2.26 -1.54 0.24 0.00 0.00 174.94 175.93 2jza n SER 43 N -0.91 5.21 -2.20 4.36 3.41 -0.68 -0.44 113.62 122.36 2jza n SER 43 Ca -0.02 -2.89 -0.28 0.00 -0.26 0.00 0.00 58.87 55.42 2jza n SER 43 Cb 0.66 -1.58 0.11 0.00 -0.26 0.00 0.00 64.21 63.14 2jza n SER 43 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2jza n ASN 44 N 4.85 5.97 -4.31 4.04 2.85 -1.26 -4.48 115.26 122.91 2jza n ASN 44 Ca 0.54 -3.59 -0.39 0.00 -0.11 0.00 0.00 54.58 51.02 2jza n ASN 44 Cb 0.35 -0.92 -0.11 0.00 1.24 0.00 0.00 39.78 40.33 2jza n ASN 44 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2jza s ILE 45 N -3.85 4.18 -0.22 -1.44 -1.09 -1.26 -4.34 121.20 113.18 2jza s ILE 45 Ca 0.56 -1.07 -0.29 0.00 -2.23 0.00 0.00 60.65 57.62 2jza s ILE 45 Cb 0.45 -3.39 -0.02 0.00 -1.58 0.00 0.00 42.46 37.93 2jza s ILE 45 CO 0.04 -0.26 1.50 -0.62 -1.23 0.00 0.00 174.94 174.36 2jza s ASP 46 N 1.58 6.55 0.48 3.58 -1.08 -1.25 -4.88 116.67 121.65 2jza s ASP 46 Ca 0.01 1.57 0.28 0.00 -0.52 0.00 0.00 52.55 53.89 2jza s ASP 46 Cb -0.20 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.27 2jza s ASP 46 CO 0.04 -1.13 1.85 -0.65 0.52 0.00 0.00 175.17 175.81 2jza h PRO 47 N 9.96 0.00 0.00 4.34 0.11 -1.97 0.38 132.00 144.82 2jza h PRO 47 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2jza h PRO 47 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2jza h PRO 47 CO 1.00 0.00 0.00 0.35 -0.21 0.00 0.00 178.00 179.14 2jza h PHE 48 N 0.00 0.00 0.00 0.65 3.57 -1.98 -3.34 116.94 115.84 2jza h PHE 48 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2jza h PHE 48 Cb 0.21 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.95 2jza h PHE 48 CO 0.00 0.00 -0.70 0.00 -2.23 0.00 0.00 178.31 175.38 2jza n ALA 49 N -1.83 1.70 -3.23 2.41 0.00 0.25 -5.04 120.51 114.77 2jza n ALA 49 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.28 2jza n ALA 49 Cb 0.39 0.17 0.05 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 -1.55 -5.83 -3.94 0.00 6.02 0.11 -4.99 117.38 107.20 2jza n GLN 50 Ca 0.00 0.75 -0.08 0.00 -0.01 0.00 0.00 57.00 57.66 2jza n GLN 50 Cb 0.35 -5.43 -0.04 0.00 1.02 0.00 0.00 30.24 26.14 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 -3.20 -0.62 -1.36 -1.58 0.00 -1.26 -5.02 121.76 108.71 2jza s ALA 51 Ca 0.41 -0.66 -0.10 0.00 0.00 0.00 0.00 51.96 51.60 2jza s ALA 51 Cb -0.18 0.97 -0.07 0.00 0.00 0.00 0.00 23.12 23.84 2jza s ALA 51 CO 0.50 -0.93 2.58 0.43 0.00 0.00 0.00 175.76 178.34 2jza n SER 52 N -0.47 6.74 0.18 0.00 7.64 -1.26 -3.83 113.62 122.61 2jza n SER 52 Ca -0.03 -2.54 0.07 0.00 1.01 0.00 0.00 58.87 57.39 2jza n SER 52 Cb 0.61 -1.42 0.10 0.00 -1.01 0.00 0.00 64.21 62.48 2jza n SER 52 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2jza h VAL 53 N 3.33 0.40 0.00 0.44 -1.51 -1.93 -2.94 116.25 114.05 2jza h VAL 53 Ca 0.71 -1.57 -0.00 0.00 -1.23 0.00 0.00 66.70 64.61 2jza h VAL 53 Cb 0.31 2.18 -0.00 0.00 -2.13 0.00 0.00 31.29 31.65 2jza h VAL 53 CO 1.72 0.23 -0.11 -0.07 -1.23 0.00 0.00 177.57 178.11 2jza h LEU 54 N 0.00 0.00 -0.02 4.19 3.38 -1.77 -3.17 115.31 117.92 2jza h LEU 54 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jza h LEU 54 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2jza h LEU 54 CO 0.03 0.00 0.00 0.28 0.09 0.00 0.00 178.44 178.84 2jza h SER 55 N 0.00 0.00 -0.58 -0.43 0.02 -1.76 -3.03 113.55 107.77 2jza h SER 55 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jza h SER 55 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 2jza h SER 55 CO 0.00 0.00 0.00 -1.14 -1.14 0.00 0.00 176.83 174.55 2jza n ARG 56 N -2.40 4.54 0.00 3.45 0.63 -1.20 -4.53 116.66 117.16 2jza n ARG 56 Ca 0.05 -3.09 0.00 0.00 -0.92 0.00 0.00 57.85 53.89 2jza n ARG 56 Cb 0.44 -2.16 0.00 0.00 0.45 0.00 0.00 32.46 31.19 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 0.69 0.09 3.66 5.14 0.00 -1.15 -4.94 105.19 108.69 2jza n GLY 57 Ca 0.27 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 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 0.32 5.36 -0.67 -0.61 1.01 -0.71 -4.85 121.20 121.06 2jza s ILE 58 Ca 0.00 0.18 -0.27 0.00 0.00 0.00 0.00 60.65 60.56 2jza s ILE 58 Cb 0.00 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.98 2jza s ILE 58 CO 0.00 0.35 1.46 -0.69 0.00 0.00 0.00 174.94 176.06 2jza s VAL 59 N 1.05 3.64 -0.59 2.92 1.01 -1.26 0.54 120.40 127.70 2jza s VAL 59 Ca 0.07 0.41 -0.09 0.00 0.00 0.00 0.00 61.98 62.38 2jza s VAL 59 Cb -0.13 -4.55 0.15 0.00 0.00 0.00 0.00 36.38 31.84 2jza s VAL 59 CO 0.04 -1.45 0.47 0.00 0.00 0.00 0.00 175.10 174.16 2jza s ALA 60 N 6.69 3.60 0.23 5.51 0.00 0.20 -4.98 121.76 133.01 2jza s ALA 60 Ca 0.47 -2.90 -0.30 0.00 0.00 0.00 0.00 51.96 49.24 2jza s ALA 60 Cb -0.10 -2.95 -0.09 0.00 0.00 0.00 0.00 23.12 19.99 2jza s ALA 60 CO 0.19 -2.04 1.12 -2.00 0.00 0.00 0.00 175.76 173.02 2jza s GLU 61 N 0.74 4.60 0.00 0.00 2.12 -1.26 -3.12 118.70 121.77 2jza s GLU 61 Ca 0.11 1.79 0.00 0.00 0.36 0.00 0.00 54.97 57.23 2jza s GLU 61 Cb -0.21 -3.23 0.00 0.00 0.26 0.00 0.00 34.13 30.95 2jza s GLU 61 CO -0.03 0.11 0.00 1.58 -0.54 0.00 0.00 175.26 176.38 2jza n HIS 62 N 1.82 -3.89 -0.28 5.30 -0.00 0.45 -4.91 115.22 113.71 2jza n HIS 62 Ca 0.01 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.83 2jza n HIS 62 Cb 0.45 0.00 0.33 0.00 -0.00 0.00 0.00 29.99 30.78 2jza n HIS 62 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 176.34 176.71 2jza h GLN 63 N 0.00 0.77 0.00 1.57 -0.00 -2.05 -3.34 115.11 112.06 2jza h GLN 63 Ca 0.00 -0.05 -0.20 0.00 -0.00 0.00 0.00 58.65 58.40 2jza h GLN 63 Cb 0.00 -0.17 -0.14 0.00 0.00 0.00 0.00 27.48 27.17 2jza h GLN 63 CO 0.00 0.51 -0.32 -3.47 0.00 0.00 0.00 178.83 175.55 2jza n ASP 64 N -4.55 -2.09 -3.58 -0.69 2.03 -1.26 -5.16 116.55 101.25 2jza n ASP 64 Ca 0.16 -3.23 -0.09 0.00 0.52 0.00 0.00 54.79 52.16 2jza n ASP 64 Cb 0.39 1.73 -0.02 0.00 -0.72 0.00 0.00 41.12 42.50 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 -1.03 -0.01 -0.20 1.67 -1.08 -1.26 -5.16 116.67 109.61 2jza s ASP 65 Ca 0.22 -0.93 0.01 0.00 -0.52 0.00 0.00 52.55 51.33 2jza s ASP 65 Cb 0.29 0.72 0.02 0.00 -1.46 0.00 0.00 42.92 42.49 2jza s ASP 65 CO -0.10 -1.38 -0.17 -0.76 0.52 0.00 0.00 175.17 173.29 2jza s LEU 66 N -3.02 2.46 -0.05 -1.34 1.43 -1.26 -0.41 118.68 116.48 2jza s LEU 66 Ca 0.17 -0.77 -0.00 0.00 -1.03 0.00 0.00 54.13 52.51 2jza s LEU 66 Cb -0.04 -1.52 0.03 0.00 0.03 0.00 0.00 46.19 44.69 2jza s LEU 66 CO 0.10 -0.04 -0.01 0.26 0.23 0.00 0.00 176.35 176.90 2jza s TRP 67 N 1.27 0.53 -0.19 0.29 0.52 -1.18 -2.57 118.94 117.62 2jza s TRP 67 Ca 0.03 -0.09 -0.08 0.00 0.02 0.00 0.00 56.10 55.97 2jza s TRP 67 Cb -0.14 -0.62 -0.04 0.00 -1.15 0.00 0.00 33.47 31.51 2jza s TRP 67 CO -0.11 -0.22 0.10 0.54 0.02 0.00 0.00 176.95 177.28 2jza s VAL 68 N 1.42 5.10 -0.35 4.03 0.11 0.62 -0.63 120.40 130.70 2jza s VAL 68 Ca -0.04 0.08 -0.25 0.00 -2.93 0.00 0.00 61.98 58.84 2jza s VAL 68 Cb -0.13 -3.31 0.01 0.00 -1.53 0.00 0.00 36.38 31.42 2jza s VAL 68 CO -0.03 0.46 0.88 0.00 -3.33 0.00 0.00 175.10 173.09 2jza s ALA 69 N 0.27 3.44 0.13 1.54 0.00 0.19 -0.01 121.76 127.32 2jza s ALA 69 Ca 0.06 -0.47 -0.31 0.00 0.00 0.00 0.00 51.96 51.24 2jza s ALA 69 Cb -0.12 -3.47 -0.10 0.00 0.00 0.00 0.00 23.12 19.44 2jza s ALA 69 CO -0.01 -1.50 1.73 0.45 0.00 0.00 0.00 175.76 176.43 2jza s SER 70 N 1.81 6.49 0.00 0.00 0.15 0.37 -1.73 113.70 120.78 2jza s SER 70 Ca 0.36 2.69 0.26 0.00 0.70 0.00 0.00 55.95 59.96 2jza s SER 70 Cb -0.13 -2.58 1.40 0.00 -1.71 0.00 0.00 66.02 63.01 2jza s SER 70 CO 0.17 -0.94 1.91 -0.81 1.20 0.00 0.00 173.24 174.77 2jza n PRO 71 N 5.09 0.50 -0.04 5.44 -0.04 -1.26 -1.41 135.00 143.28 2jza n PRO 71 Ca 0.16 0.03 -0.09 0.00 -0.04 0.00 0.00 63.50 63.56 2jza n PRO 71 Cb 0.38 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.31 2jza n PRO 71 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jza n LEU 72 N -1.21 1.32 0.05 1.53 4.77 -1.26 -4.75 117.00 117.46 2jza n LEU 72 Ca 0.15 0.21 0.12 0.00 -0.03 0.00 0.00 56.01 56.45 2jza n LEU 72 Cb 0.18 -0.49 0.06 0.00 -2.33 0.00 0.00 43.42 40.83 2jza n LEU 72 CO 0.19 -0.18 0.08 0.29 -1.33 0.00 0.00 177.39 176.44 2jza n LYS 73 N -3.85 0.38 -3.26 3.23 4.76 -1.26 -5.00 118.16 113.17 2jza n LYS 73 Ca -0.16 0.05 -0.07 0.00 -2.87 0.00 0.00 58.31 55.26 2jza n LYS 73 Cb 0.44 -1.68 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2jza n LYS 73 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2jza n LYS 74 N -2.20 -1.38 -3.97 1.97 4.81 -0.50 -5.00 118.16 111.90 2jza n LYS 74 Ca 0.02 1.30 -0.09 0.00 -0.87 0.00 0.00 58.31 58.67 2jza n LYS 74 Cb 0.47 -4.84 -0.10 0.00 0.02 0.00 0.00 35.03 30.58 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 -3.52 0.42 -0.59 1.64 -0.21 -1.26 -4.87 119.66 111.27 2jza s GLN 75 Ca 0.00 -0.68 -0.19 0.00 0.02 0.00 0.00 55.36 54.51 2jza s GLN 75 Cb -0.00 0.16 0.10 0.00 1.00 0.00 0.00 33.01 34.26 2jza s GLN 75 CO 0.79 -0.08 0.73 -1.01 -2.12 0.00 0.00 175.29 173.59 2jza s HIS 76 N -1.95 2.96 -0.16 0.91 3.76 -1.25 -0.48 115.29 119.09 2jza s HIS 76 Ca -0.11 -0.89 -0.24 0.00 -0.15 0.00 0.00 55.06 53.67 2jza s HIS 76 Cb -0.06 -4.01 -0.02 0.00 1.11 0.00 0.00 32.58 29.60 2jza s HIS 76 CO -0.02 -1.32 0.76 -0.06 -0.85 0.00 0.00 174.74 173.25 2jza s PHE 77 N 2.83 3.43 -0.09 1.40 0.08 0.99 -3.62 117.98 123.00 2jza s PHE 77 Ca 0.13 1.17 -0.30 0.00 0.12 0.00 0.00 56.93 58.06 2jza s PHE 77 Cb -0.23 -2.93 -0.03 0.00 -0.57 0.00 0.00 43.02 39.26 2jza s PHE 77 CO 0.07 -0.18 1.30 0.50 -0.10 0.00 0.00 175.22 176.82 2jza s ARG 78 N 1.89 4.27 0.00 0.44 3.52 -0.78 -0.27 118.95 128.02 2jza s ARG 78 Ca 0.36 1.76 0.14 0.00 -0.13 0.00 0.00 55.73 57.87 2jza s ARG 78 Cb -0.17 -3.68 0.86 0.00 -1.56 0.00 0.00 34.95 30.40 2jza s ARG 78 CO 0.13 -0.61 1.28 1.28 -0.81 0.00 0.00 175.30 176.57 2jza n LEU 79 N 5.99 0.00 -1.05 -0.88 7.99 -1.06 -2.81 117.00 125.18 2jza n LEU 79 Ca 0.13 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 56.10 2jza n LEU 79 Cb 0.45 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.72 2jza n LEU 79 CO 0.57 0.00 0.26 0.00 -1.51 0.00 0.00 177.39 176.70 2jza n TYR 80 N -0.93 0.00 0.00 -1.77 4.11 -1.26 -4.86 117.16 112.45 2jza n TYR 80 Ca 0.11 -0.41 0.00 0.00 -0.00 0.00 0.00 57.90 57.59 2jza n TYR 80 Cb 0.05 0.27 0.00 0.00 -0.00 0.00 0.00 39.34 39.66 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 0.13 0.00 0.00 9.48 2.03 -1.12 -4.95 116.55 122.11 2jza n ASP 81 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 2jza n ASP 81 Cb 0.80 0.11 0.00 0.00 -0.72 0.00 0.00 41.12 41.30 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 0.66 1.14 3.77 0.27 0.00 -1.22 -4.13 105.19 105.68 2jza n GLY 82 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.22 2.58 -0.20 1.61 0.08 -1.26 -2.22 117.98 118.36 2jza s PHE 83 Ca 0.00 1.56 0.16 0.00 0.12 0.00 0.00 56.93 58.76 2jza s PHE 83 Cb 0.00 -3.12 0.56 0.00 -0.57 0.00 0.00 43.02 39.89 2jza s PHE 83 CO 0.00 -1.77 1.47 0.00 -0.10 0.00 0.00 175.22 174.82 2jza n LEU 85 N -0.46 0.00 -0.06 0.00 7.94 -1.24 -3.69 117.00 119.50 2jza n LEU 85 Ca 0.24 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 55.09 2jza n LEU 85 Cb 0.95 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.89 2jza n LEU 85 CO 0.18 0.00 -0.35 -0.62 -1.11 0.00 0.00 177.39 175.49 2jza n GLU 86 N 0.00 0.34 -3.16 1.96 1.02 -1.26 -4.76 120.64 114.79 2jza n GLU 86 Ca 0.00 0.31 -0.45 0.00 -0.02 0.00 0.00 57.16 56.99 2jza n GLU 86 Cb 0.00 -1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 2jza n GLU 86 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jza s ASP 87 N -5.19 6.59 -1.31 1.62 -1.08 -1.24 -4.96 116.67 111.10 2jza s ASP 87 Ca -0.15 -2.21 -0.13 0.00 -0.52 0.00 0.00 52.55 49.54 2jza s ASP 87 Cb 0.02 -2.29 0.13 0.00 -1.46 0.00 0.00 42.92 39.32 2jza s ASP 87 CO 0.22 -0.85 1.82 0.61 0.52 0.00 0.00 175.17 177.50 2jza n GLY 88 N 4.76 4.00 0.23 2.66 0.00 -1.26 -4.49 105.19 111.10 2jza n GLY 88 Ca 0.12 -1.87 0.03 0.00 0.00 0.00 0.00 46.02 44.30 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 5.51 2.52 -2.65 4.61 0.00 -1.26 -4.70 120.51 124.54 2jza n ALA 89 Ca 0.43 -0.51 -0.15 0.00 0.00 0.00 0.00 53.44 53.22 2jza n ALA 89 Cb 0.40 -0.22 0.02 0.00 0.00 0.00 0.00 19.45 19.65 2jza n ALA 89 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2jza n TYR 90 N 0.20 1.78 -1.88 0.00 4.19 -1.26 -5.08 117.16 115.11 2jza n TYR 90 Ca 0.03 -2.97 -0.42 0.00 3.31 0.00 0.00 57.90 57.85 2jza n TYR 90 Cb 0.15 -0.30 -0.03 0.00 0.49 0.00 0.00 39.34 39.65 2jza n TYR 90 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 2jza s SER 91 N -3.20 6.30 0.39 2.98 0.01 -1.26 -4.84 113.70 114.07 2jza s SER 91 Ca 0.34 2.10 0.08 0.00 1.31 0.00 0.00 55.95 59.77 2jza s SER 91 Cb 0.43 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 2jza s SER 91 CO -0.03 -1.25 0.45 0.68 0.41 0.00 0.00 173.24 173.50 2jza s VAL 92 N 5.28 3.23 0.15 3.43 -7.23 -0.94 -5.03 120.40 119.29 2jza s VAL 92 Ca 0.82 -1.15 0.03 0.00 -1.81 0.00 0.00 61.98 59.86 2jza s VAL 92 Cb -0.33 -3.12 -0.04 0.00 0.56 0.00 0.00 36.38 33.45 2jza s VAL 92 CO 0.34 -0.06 0.28 0.00 -0.31 0.00 0.00 175.10 175.34 2jza s ALA 93 N -2.34 3.95 -0.26 1.32 0.00 -1.26 -4.12 121.76 119.05 2jza s ALA 93 Ca 0.49 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.43 2jza s ALA 93 Cb -0.07 -1.76 0.06 0.00 0.00 0.00 0.00 23.12 21.35 2jza s ALA 93 CO 0.30 0.54 -0.08 0.00 0.00 0.00 0.00 175.76 176.53 2jza s ALA 94 N -1.74 2.39 0.87 0.00 0.00 -1.26 -1.69 121.76 120.33 2jza s ALA 94 Ca 0.34 -1.70 -0.08 0.00 0.00 0.00 0.00 51.96 50.53 2jza s ALA 94 Cb -0.11 -1.57 0.15 0.00 0.00 0.00 0.00 23.12 21.59 2jza s ALA 94 CO 0.28 -1.24 0.96 0.66 0.00 0.00 0.00 175.76 176.42 2jza n TYR 95 N 4.50 -3.61 -4.75 0.00 4.01 -1.20 -5.04 117.16 111.08 2jza n TYR 95 Ca -0.12 -1.13 -0.33 0.00 -0.16 0.00 0.00 57.90 56.16 2jza n TYR 95 Cb 0.43 -0.72 -0.13 0.00 -0.31 0.00 0.00 39.34 38.60 2jza n TYR 95 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jza s ASP 96 N -4.63 4.28 0.13 7.72 2.15 -1.26 -4.86 116.67 120.21 2jza s ASP 96 Ca 0.57 -0.16 0.02 0.00 0.43 0.00 0.00 52.55 53.41 2jza s ASP 96 Cb -0.02 -1.17 -0.04 0.00 -0.30 0.00 0.00 42.92 41.38 2jza s ASP 96 CO 0.39 0.30 -0.05 -0.89 -0.17 0.00 0.00 175.17 174.75 2jza s THR 97 N -0.45 0.80 0.04 1.71 2.01 -1.26 0.26 115.64 118.76 2jza s THR 97 Ca 0.06 -1.98 0.01 0.00 0.31 0.00 0.00 61.69 60.09 2jza s THR 97 Cb -0.12 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.51 2jza s THR 97 CO 0.02 -0.73 -0.05 0.00 -0.69 0.00 0.00 174.62 173.17 2jza s GLN 98 N -3.84 0.48 -0.10 4.92 -2.07 0.15 -4.94 119.66 114.26 2jza s GLN 98 Ca 0.16 -0.85 0.01 0.00 -1.82 0.00 0.00 55.36 52.86 2jza s GLN 98 Cb 0.05 -0.00 0.02 0.00 -1.09 0.00 0.00 33.01 31.99 2jza s GLN 98 CO -0.01 -0.03 -0.11 0.08 -1.32 0.00 0.00 175.29 173.90 2jza s VAL 99 N -2.20 1.18 0.14 3.63 1.01 -1.26 -1.40 120.40 121.50 2jza s VAL 99 Ca -0.07 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2jza s VAL 99 Cb -0.05 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.20 2jza s VAL 99 CO -0.03 0.38 0.00 1.07 0.00 0.00 0.00 175.10 176.52 2jza n THR 100 N 4.51 0.34 -1.20 3.92 5.66 -1.19 -4.89 114.28 121.43 2jza n THR 100 Ca -0.17 0.11 -0.17 0.00 -3.05 0.00 0.00 64.05 60.78 2jza n THR 100 Cb 0.51 -0.77 0.22 0.00 -1.55 0.00 0.00 70.33 68.74 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 -3.15 3.95 0.00 1.09 3.02 -1.26 -4.78 115.26 114.13 2jza n ASN 101 Ca 0.00 -3.51 0.00 0.00 -0.03 0.00 0.00 54.58 51.04 2jza n ASN 101 Cb 0.00 -0.79 0.00 0.00 -0.61 0.00 0.00 39.78 38.38 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 -0.86 0.79 3.63 7.41 0.00 -1.26 -5.04 105.19 109.86 2jza n GLY 102 Ca 0.52 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.68 4.48 -0.20 1.61 4.22 -1.26 -0.00 114.94 121.10 2jza s ASN 103 Ca 0.00 -0.62 -0.04 0.00 -2.14 0.00 0.00 52.86 50.06 2jza s ASN 103 Cb 0.00 -0.82 -0.01 0.00 1.28 0.00 0.00 41.25 41.70 2jza s ASN 103 CO 0.00 0.03 -0.04 -0.69 -2.04 0.00 0.00 177.10 174.37 2jza s VAL 104 N -2.15 3.55 -0.04 3.54 1.01 0.84 -3.18 120.40 123.98 2jza s VAL 104 Ca 0.30 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.87 2jza s VAL 104 Cb -0.07 -2.60 -0.00 0.00 0.00 0.00 0.00 36.38 33.71 2jza s VAL 104 CO 0.19 0.44 -0.16 -1.10 0.00 0.00 0.00 175.10 174.46 2jza s GLN 105 N 1.19 1.60 0.15 2.72 -0.21 -0.49 -0.61 119.66 124.00 2jza s GLN 105 Ca 0.02 -0.57 0.06 0.00 0.02 0.00 0.00 55.36 54.90 2jza s GLN 105 Cb -0.14 -1.42 -0.04 0.00 1.00 0.00 0.00 33.01 32.40 2jza s GLN 105 CO -0.00 0.25 0.05 0.96 -2.12 0.00 0.00 175.29 174.42 2jza s ILE 106 N -0.02 4.08 -0.59 1.08 -0.00 -0.13 0.31 121.20 125.94 2jza s ILE 106 Ca -0.02 -1.20 -0.12 0.00 -0.00 0.00 0.00 60.65 59.32 2jza s ILE 106 Cb -0.10 -3.04 0.15 0.00 -0.00 0.00 0.00 42.46 39.47 2jza s ILE 106 CO 0.01 -0.06 0.50 -0.55 -0.00 0.00 0.00 174.94 174.85 2jza s SER 107 N -2.87 6.06 -0.86 4.36 0.15 0.14 -0.60 113.70 120.08 2jza s SER 107 Ca 0.28 -2.15 -0.00 0.00 0.70 0.00 0.00 55.95 54.79 2jza s SER 107 Cb -0.10 -2.11 0.22 0.00 -1.71 0.00 0.00 66.02 62.32 2jza s SER 107 CO 0.20 -0.69 0.78 2.30 1.20 0.00 0.00 173.24 177.03 2jza n ILE 108 N 4.67 2.90 0.21 6.45 -5.35 -1.26 -4.06 119.36 122.91 2jza n ILE 108 Ca -0.03 -5.13 0.10 0.00 -0.27 0.00 0.00 62.75 57.42 2jza n ILE 108 Cb 0.42 -2.32 0.23 0.00 -1.74 0.00 0.00 39.64 36.23 2jza n ILE 108 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jza h ALA 109 N 5.73 0.92 -2.94 -1.28 0.00 -1.94 -3.44 119.26 116.32 2jza h ALA 109 Ca 0.17 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2jza h ALA 109 Cb 0.78 -0.02 -0.28 0.00 0.00 0.00 0.00 17.79 18.27 2jza h ALA 109 CO 0.86 0.18 -0.42 0.34 0.00 0.00 0.00 179.25 180.21 2jza s ASP 110 N -6.20 -0.33 0.00 0.00 2.15 -1.26 -5.04 116.67 105.99 2jza s ASP 110 Ca 0.05 0.62 0.00 0.00 0.43 0.00 0.00 52.55 53.65 2jza s ASP 110 Cb 0.07 0.53 0.00 0.00 -0.30 0.00 0.00 42.92 43.22 2jza s ASP 110 CO 0.67 -0.16 0.00 -1.20 -0.17 0.00 0.00 175.17 174.31 2jza n SER 111 N 3.97 0.00 -3.63 -0.34 7.64 -1.26 -5.10 113.62 114.89 2jza n SER 111 Ca -0.22 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.56 2jza n SER 111 Cb 0.55 0.09 -0.11 0.00 -1.01 0.00 0.00 64.21 63.73 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 1.25 -0.01 -0.10 6.43 2.15 -1.26 -5.12 116.67 120.02 2jza s ASP 112 Ca 0.00 0.79 -0.34 0.00 0.43 0.00 0.00 52.55 53.43 2jza s ASP 112 Cb 0.00 1.12 -0.11 0.00 -0.30 0.00 0.00 42.92 43.63 2jza s ASP 112 CO 0.00 -0.24 1.91 0.52 -0.17 0.00 0.00 175.17 177.19 2jza n VAL 113 N 5.38 0.58 -2.76 1.11 0.31 -1.26 -4.86 118.33 116.82 2jza n VAL 113 Ca -0.07 -0.12 -0.43 0.00 -0.01 0.00 0.00 64.34 63.71 2jza n VAL 113 Cb 0.50 -1.91 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 2jza n VAL 113 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jza s ALA 114 N 4.32 3.22 -0.79 3.52 0.00 -1.26 -4.93 121.76 125.83 2jza s ALA 114 Ca 0.93 -2.69 -0.20 0.00 0.00 0.00 0.00 51.96 50.00 2jza s ALA 114 Cb -0.68 -4.30 0.10 0.00 0.00 0.00 0.00 23.12 18.25 2jza s ALA 114 CO 0.51 -3.22 1.03 0.08 0.00 0.00 0.00 175.76 174.17 2jza s VAL 115 N 3.52 4.55 0.00 0.00 1.01 -1.26 -4.89 120.40 123.33 2jza s VAL 115 Ca 0.41 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.38 2jza s VAL 115 Cb -0.02 -4.72 0.00 0.00 0.00 0.00 0.00 36.38 31.64 2jza s VAL 115 CO -0.06 -1.46 0.00 -0.67 0.00 0.00 0.00 175.10 172.90 2jza n ASP 116 N 7.06 0.34 -4.75 3.32 2.03 -1.26 -5.13 116.55 118.15 2jza n ASP 116 Ca 0.10 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 55.00 2jza n ASP 116 Cb 0.47 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.84 2jza n ASP 116 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2jza s ASN 117 N 1.66 6.92 0.13 1.67 0.01 -1.26 -4.93 114.94 119.12 2jza s ASN 117 Ca 0.00 2.47 -0.15 0.00 -0.71 0.00 0.00 52.86 54.47 2jza s ASN 117 Cb 0.00 -2.63 -0.01 0.00 0.41 0.00 0.00 41.25 39.02 2jza s ASN 117 CO 0.00 -0.47 1.62 -1.28 -1.51 0.00 0.00 177.10 175.47 2jza h SER 118 N 4.48 0.61 -3.27 -1.22 0.87 -2.00 -3.40 113.55 109.62 2jza h SER 118 Ca -0.46 -0.24 -0.64 0.00 -1.23 0.00 0.00 61.79 59.22 2jza h SER 118 Cb 1.22 -0.16 -0.34 0.00 -0.44 0.00 0.00 62.40 62.68 2jza h SER 118 CO 0.72 0.69 -0.86 0.00 -0.53 0.00 0.00 176.83 176.85 2jza s GLN 119 N -5.27 2.69 1.16 2.24 -2.07 -1.26 -5.14 119.66 112.01 2jza s GLN 119 Ca -0.13 -0.74 -0.17 0.00 -1.82 0.00 0.00 55.36 52.50 2jza s GLN 119 Cb 0.10 -2.16 0.27 0.00 -1.09 0.00 0.00 33.01 30.12 2jza s GLN 119 CO 0.77 0.02 1.08 -2.14 -1.32 0.00 0.00 175.29 173.70 2jza s PRO 120 N 0.74 -0.90 0.74 9.60 0.02 -1.26 -5.01 135.00 138.93 2jza s PRO 120 Ca -0.10 0.17 -0.14 0.00 0.02 0.00 0.00 61.00 60.95 2jza s PRO 120 Cb -0.16 -1.61 0.04 0.00 0.02 0.00 0.00 34.50 32.79 2jza s PRO 120 CO 0.01 -3.55 1.19 -0.51 -0.33 0.00 0.00 177.00 173.81 2jza s LEU 121 N -6.91 3.28 -0.47 -5.54 1.02 -1.26 -4.82 118.68 103.98 2jza s LEU 121 Ca 0.69 2.29 -0.32 0.00 0.02 0.00 0.00 54.13 56.81 2jza s LEU 121 Cb -0.14 -4.58 -0.11 0.00 0.02 0.00 0.00 46.19 41.38 2jza s LEU 121 CO 0.57 -2.26 2.32 -0.81 0.02 0.00 0.00 176.35 176.19 2jza n PRO 122 N -2.84 0.97 -3.93 1.29 -0.04 -1.26 -4.94 135.00 124.26 2jza n PRO 122 Ca 0.13 0.20 -0.36 0.00 -0.04 0.00 0.00 63.50 63.43 2jza n PRO 122 Cb 0.51 -2.60 -0.07 0.00 -0.04 0.00 0.00 33.50 31.29 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 8.75 4.16 -0.50 1.53 0.05 -1.26 -5.03 118.68 126.38 2jza s LEU 123 Ca 1.10 0.32 -0.27 0.00 0.05 0.00 0.00 54.13 55.33 2jza s LEU 123 Cb -0.72 -2.02 -0.01 0.00 -2.05 0.00 0.00 46.19 41.38 2jza s LEU 123 CO 0.43 0.32 1.74 -1.61 -0.55 0.00 0.00 176.35 176.68 2jza s GLU 124 N -0.51 3.03 -0.57 1.48 2.02 -1.26 -4.93 118.70 117.95 2jza s GLU 124 Ca 0.12 0.88 -0.05 0.00 0.02 0.00 0.00 54.97 55.93 2jza s GLU 124 Cb -0.12 -4.26 0.15 0.00 0.10 0.00 0.00 34.13 30.00 2jza s GLU 124 CO 0.02 -2.24 0.40 -3.38 0.02 0.00 0.00 175.26 170.08 2jza s HIS 125 N 7.65 3.49 -0.46 1.61 -3.43 -1.26 -5.04 115.29 117.84 2jza s HIS 125 Ca 0.69 -2.44 -0.12 0.00 -0.80 0.00 0.00 55.06 52.38 2jza s HIS 125 Cb -0.16 -3.32 0.09 0.00 -1.43 0.00 0.00 32.58 27.77 2jza s HIS 125 CO 0.26 -0.91 0.35 -1.58 -2.00 0.00 0.00 174.74 170.86 2jza s HIS 126 N 0.46 3.31 -0.28 0.38 5.04 -1.26 -4.99 115.29 117.94 2jza s HIS 126 Ca 0.13 -1.33 -0.28 0.00 -1.54 0.00 0.00 55.06 52.04 2jza s HIS 126 Cb -0.21 -3.22 0.19 0.00 0.04 0.00 0.00 32.58 29.38 2jza s HIS 126 CO -0.04 -0.87 1.37 -1.58 -2.34 0.00 0.00 174.74 171.28 2jza s HIS 127 N 1.52 -0.06 -0.59 3.88 2.46 -1.26 -5.09 115.29 116.14 2jza s HIS 127 Ca 0.04 0.12 -0.29 0.00 0.47 0.00 0.00 55.06 55.39 2jza s HIS 127 Cb -0.25 0.49 -0.12 0.00 -0.13 0.00 0.00 32.58 32.57 2jza s HIS 127 CO 0.03 -0.05 2.45 1.58 -2.47 0.00 0.00 174.74 176.28 2jza n HIS 128 N 0.85 1.24 -3.22 3.88 -0.00 -1.26 -4.89 115.22 111.82 2jza n HIS 128 Ca -0.04 0.21 -0.39 0.00 0.46 0.00 0.00 57.72 57.97 2jza n HIS 128 Cb 0.58 -2.55 -0.06 0.00 -0.12 0.00 0.00 29.99 27.84 2jza n HIS 128 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2jza s HIS 129 N 10.27 3.70 -2.86 1.57 5.04 -1.26 -5.31 115.29 126.44 2jza s HIS 129 Ca 1.11 1.20 0.25 0.00 -1.54 0.00 0.00 55.06 56.08 2jza s HIS 129 Cb -0.61 -2.59 0.44 0.00 0.04 0.00 0.00 32.58 29.86 2jza s HIS 129 CO 0.37 0.39 1.40 0.72 -2.34 0.00 0.00 174.74 175.28