#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 -0.63 6.12 7.64 -1.26 -3.44 113.62 122.05 2jza n SER 2 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.91 2jza n SER 2 Cb 0.00 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.31 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 1.80 -4.26 1.43 1.13 -1.26 -4.71 117.38 111.51 2jza n GLN 3 Ca 0.00 -0.86 -0.26 0.00 -1.94 0.00 0.00 57.00 53.95 2jza n GLN 3 Cb 0.00 -1.41 -0.17 0.00 0.11 0.00 0.00 30.24 28.77 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 -1.63 1.47 -0.09 1.08 0.52 -1.22 -0.22 118.94 118.85 2jza s TRP 4 Ca 0.15 -0.63 0.01 0.00 0.02 0.00 0.00 56.10 55.65 2jza s TRP 4 Cb 0.10 -1.14 -0.02 0.00 -1.15 0.00 0.00 33.47 31.25 2jza s TRP 4 CO 0.08 -0.39 -0.11 0.95 0.02 0.00 0.00 176.95 177.50 2jza s THR 5 N 1.15 3.31 -0.21 2.01 -4.23 -0.67 -3.43 115.64 113.58 2jza s THR 5 Ca -0.05 -0.60 -0.29 0.00 -1.18 0.00 0.00 61.69 59.56 2jza s THR 5 Cb -0.14 -2.36 -0.03 0.00 1.34 0.00 0.00 72.50 71.31 2jza s THR 5 CO -0.02 0.56 1.73 -0.89 -0.54 0.00 0.00 174.62 175.47 2jza s THR 6 N -0.34 3.53 0.00 3.99 2.01 -1.26 -2.16 115.64 121.41 2jza s THR 6 Ca 0.04 0.59 0.00 0.00 0.31 0.00 0.00 61.69 62.63 2jza s THR 6 Cb -0.13 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.83 2jza s THR 6 CO 0.02 -0.25 0.00 0.52 -0.69 0.00 0.00 174.62 174.23 2jza n VAL 7 N 6.58 0.00 -4.19 3.82 0.31 0.74 -4.99 118.33 120.60 2jza n VAL 7 Ca 0.20 0.08 -0.17 0.00 -0.01 0.00 0.00 64.34 64.45 2jza n VAL 7 Cb 0.45 -0.64 -0.07 0.00 -0.91 0.00 0.00 33.84 32.67 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 -3.38 4.05 0.57 0.00 1.02 -1.26 -1.44 119.74 119.30 2jza s LYS 9 Ca 0.36 0.82 0.35 0.00 0.02 0.00 0.00 55.97 57.52 2jza s LYS 9 Cb 0.02 -3.71 1.67 0.00 -0.52 0.00 0.00 37.83 35.29 2jza s LYS 9 CO 0.23 -0.70 2.11 1.25 -0.92 0.00 0.00 175.35 177.31 2jza h LEU 10 N 9.56 0.00 0.00 3.17 5.85 -0.96 0.04 115.31 132.96 2jza h LEU 10 Ca -0.23 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.49 2jza h LEU 10 Cb 1.08 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.11 2jza h LEU 10 CO 0.92 0.04 -0.20 -0.67 -0.34 0.00 0.00 178.44 178.19 2jza n ASP 11 N -3.21 0.58 -0.08 1.25 2.03 -1.24 -3.56 116.55 112.32 2jza n ASP 11 Ca -0.01 0.37 -0.08 0.00 0.52 0.00 0.00 54.79 55.59 2jza n ASP 11 Cb 0.23 -0.40 -0.12 0.00 -0.72 0.00 0.00 41.12 40.11 2jza n ASP 11 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jza n ASP 12 N -1.98 1.12 -4.67 1.67 2.03 -0.32 -4.94 116.55 109.45 2jza n ASP 12 Ca 0.05 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.94 2jza n ASP 12 Cb 0.40 0.89 -0.03 0.00 -0.72 0.00 0.00 41.12 41.67 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 -2.39 3.63 0.36 5.18 1.01 -0.15 -4.97 121.20 123.88 2jza s ILE 13 Ca -0.08 0.88 -0.27 0.00 0.00 0.00 0.00 60.65 61.19 2jza s ILE 13 Cb 0.05 -3.57 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 2jza s ILE 13 CO 0.64 -0.05 1.23 -0.76 0.00 0.00 0.00 174.94 176.01 2jza s LEU 14 N 3.35 4.32 0.36 2.97 1.02 -1.26 -4.95 118.68 124.49 2jza s LEU 14 Ca 0.69 2.50 -0.27 0.00 0.02 0.00 0.00 54.13 57.07 2jza s LEU 14 Cb -0.32 -3.83 -0.09 0.00 0.02 0.00 0.00 46.19 41.96 2jza s LEU 14 CO 0.27 -0.60 1.22 -2.84 0.02 0.00 0.00 176.35 174.43 2jza s PRO 15 N -2.02 4.21 0.00 1.29 0.02 -1.26 -3.54 135.00 133.70 2jza s PRO 15 Ca 0.53 2.00 0.00 0.00 0.02 0.00 0.00 61.00 63.55 2jza s PRO 15 Cb -0.35 -2.88 0.00 0.00 0.02 0.00 0.00 34.50 31.29 2jza s PRO 15 CO 0.45 -0.23 0.00 0.41 -0.33 0.00 0.00 177.00 177.30 2jza n GLY 16 N 0.77 0.51 3.28 0.52 0.00 0.30 -5.00 105.19 105.57 2jza n GLY 16 Ca 0.02 -0.82 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.00 0.03 0.00 2.61 2.01 -1.18 -4.97 115.64 112.14 2jza s THR 17 Ca 0.00 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.00 2jza s THR 17 Cb 0.00 -2.49 0.00 0.00 0.01 0.00 0.00 72.50 70.02 2jza s THR 17 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.54 2jza n GLY 18 N -0.58 0.58 3.25 4.40 0.00 -1.25 0.48 105.19 112.06 2jza n GLY 18 Ca 0.06 0.64 -0.17 0.00 0.00 0.00 0.00 46.02 46.55 2jza n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jza s VAL 19 N 0.00 1.34 -0.53 1.61 -7.23 -1.19 -3.53 120.40 110.87 2jza s VAL 19 Ca 0.00 -1.82 -0.28 0.00 -1.81 0.00 0.00 61.98 58.07 2jza s VAL 19 Cb 0.00 -1.63 0.03 0.00 0.56 0.00 0.00 36.38 35.34 2jza s VAL 19 CO 0.00 -0.49 1.15 0.00 -0.31 0.00 0.00 175.10 175.46 2jza s ALA 21 N 4.67 3.55 -0.70 0.00 0.00 -0.15 -4.77 121.76 124.35 2jza s ALA 21 Ca 0.44 0.05 -0.26 0.00 0.00 0.00 0.00 51.96 52.20 2jza s ALA 21 Cb -0.08 -2.69 0.04 0.00 0.00 0.00 0.00 23.12 20.40 2jza s ALA 21 CO 0.28 0.31 1.17 -1.17 0.00 0.00 0.00 175.76 176.35 2jza s LEU 22 N -0.77 3.59 -0.60 0.00 1.98 -1.26 -2.66 118.68 118.95 2jza s LEU 22 Ca 0.30 -0.60 -0.15 0.00 -2.89 0.00 0.00 54.13 50.79 2jza s LEU 22 Cb -0.19 -2.54 0.15 0.00 0.66 0.00 0.00 46.19 44.26 2jza s LEU 22 CO 0.19 -1.69 0.55 -0.69 -1.89 0.00 0.00 176.35 172.82 2jza s VAL 23 N 5.13 5.25 0.00 1.68 1.01 0.39 -4.85 120.40 129.02 2jza s VAL 23 Ca 0.31 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.57 2jza s VAL 23 Cb -0.11 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.93 2jza s VAL 23 CO 0.14 -0.90 0.00 -0.62 0.00 0.00 0.00 175.10 173.72 2jza n GLU 24 N 4.96 0.00 0.00 2.72 -0.58 -1.26 -1.26 120.64 125.21 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 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.28 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 -4.61 3.49 10.64 -1.26 -5.08 117.38 120.55 2jza n GLN 25 Ca 0.00 -0.26 -0.31 0.00 -1.83 0.00 0.00 57.00 54.60 2jza n GLN 25 Cb 0.00 -0.43 -0.12 0.00 -0.86 0.00 0.00 30.24 28.83 2jza n GLN 25 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 2jza s GLN 26 N 0.00 2.09 -0.20 2.61 -0.21 -0.39 -5.08 119.66 118.48 2jza s GLN 26 Ca 0.00 -0.98 -0.07 0.00 0.02 0.00 0.00 55.36 54.34 2jza s GLN 26 Cb 0.00 -2.21 -0.03 0.00 1.00 0.00 0.00 33.01 31.77 2jza s GLN 26 CO 0.00 0.54 0.05 -0.65 -2.12 0.00 0.00 175.29 173.11 2jza s GLN 27 N -1.50 3.81 -0.05 2.91 -0.21 -1.26 -0.46 119.66 122.90 2jza s GLN 27 Ca 0.15 -0.42 0.02 0.00 0.02 0.00 0.00 55.36 55.13 2jza s GLN 27 Cb -0.11 -3.20 0.02 0.00 1.00 0.00 0.00 33.01 30.72 2jza s GLN 27 CO 0.06 0.11 -0.09 0.42 -2.12 0.00 0.00 175.29 173.67 2jza s ILE 28 N 0.79 0.90 -0.38 1.08 1.09 -1.09 -4.83 121.20 118.76 2jza s ILE 28 Ca 0.03 -0.35 -0.26 0.00 -1.10 0.00 0.00 60.65 58.97 2jza s ILE 28 Cb -0.14 -0.85 0.02 0.00 -1.06 0.00 0.00 42.46 40.43 2jza s ILE 28 CO 0.02 0.30 0.94 0.00 -0.10 0.00 0.00 174.94 176.10 2jza s ALA 29 N 0.71 3.39 -0.61 9.38 0.00 0.52 -0.97 121.76 134.17 2jza s ALA 29 Ca -0.13 -0.46 -0.17 0.00 0.00 0.00 0.00 51.96 51.20 2jza s ALA 29 Cb -0.15 -3.56 0.13 0.00 0.00 0.00 0.00 23.12 19.54 2jza s ALA 29 CO 0.02 -1.66 0.65 0.08 0.00 0.00 0.00 175.76 174.86 2jza s VAL 30 N 3.54 5.06 0.24 0.00 1.01 0.27 -0.85 120.40 129.66 2jza s VAL 30 Ca 0.39 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 2jza s VAL 30 Cb -0.12 -4.44 -0.09 0.00 0.00 0.00 0.00 36.38 31.73 2jza s VAL 30 CO 0.20 -1.03 1.06 -0.36 0.00 0.00 0.00 175.10 174.96 2jza s PHE 31 N 1.98 3.69 -0.64 5.22 0.08 0.19 -3.20 117.98 125.31 2jza s PHE 31 Ca 0.10 1.73 0.05 0.00 0.12 0.00 0.00 56.93 58.93 2jza s PHE 31 Cb -0.24 -3.20 0.20 0.00 -0.57 0.00 0.00 43.02 39.21 2jza s PHE 31 CO 0.03 -0.29 0.56 -2.13 -0.10 0.00 0.00 175.22 173.29 2jza n ARG 32 N 1.62 1.82 0.21 0.44 0.63 0.18 -0.53 116.66 121.03 2jza n ARG 32 Ca -0.00 -4.33 0.09 0.00 -0.92 0.00 0.00 57.85 52.68 2jza n ARG 32 Cb 0.46 -2.14 0.40 0.00 0.45 0.00 0.00 32.46 31.62 2jza n ARG 32 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 2jza h PRO 33 N 4.92 0.00 -5.83 -0.14 0.11 -1.77 0.85 132.00 130.15 2jza h PRO 33 Ca 0.17 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.67 2jza h PRO 33 Cb 0.75 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.79 2jza h PRO 33 CO 0.70 0.27 -0.26 1.03 -0.21 0.00 0.00 178.00 179.53 2jza s ARG 34 N -3.59 3.95 -0.03 1.05 1.81 -1.25 -4.45 118.95 116.44 2jza s ARG 34 Ca 0.01 0.27 0.07 0.00 -1.72 0.00 0.00 55.73 54.36 2jza s ARG 34 Cb 0.10 -3.28 0.25 0.00 -0.45 0.00 0.00 34.95 31.58 2jza s ARG 34 CO 0.65 0.57 1.09 0.27 -0.68 0.00 0.00 175.30 177.20 2jza n ASN 35 N 2.36 1.90 0.00 0.23 6.94 -1.26 -4.54 115.26 120.89 2jza n ASN 35 Ca -0.14 -2.13 0.00 0.00 -0.02 0.00 0.00 54.58 52.29 2jza n ASN 35 Cb 0.53 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 2jza n ASN 35 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2jza n ASP 36 N 0.24 0.00 0.01 0.53 5.75 -1.26 -5.00 116.55 116.83 2jza n ASP 36 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.87 2jza n ASP 36 Cb 0.37 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 2jza n ASP 36 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2jza n GLU 37 N 0.00 0.00 -1.68 0.11 1.02 -1.26 -5.07 120.64 113.77 2jza n GLU 37 Ca 0.00 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.69 2jza n GLU 37 Cb 0.00 -0.47 -0.04 0.00 -0.02 0.00 0.00 31.44 30.91 2jza n GLU 37 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 2jza n GLN 38 N -3.11 2.19 -4.44 3.49 -0.06 -1.26 -5.00 117.38 109.19 2jza n GLN 38 Ca 0.00 0.79 -0.21 0.00 -2.00 0.00 0.00 57.00 55.58 2jza n GLN 38 Cb 0.34 -2.55 -0.10 0.00 -4.06 0.00 0.00 30.24 23.87 2jza n GLN 38 CO 0.00 0.00 0.00 0.14 -0.20 0.00 0.00 177.06 177.00 2jza s VAL 39 N 0.74 1.12 -0.19 1.69 -7.23 -1.26 -3.92 120.40 111.35 2jza s VAL 39 Ca 0.76 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.89 2jza s VAL 39 Cb -0.66 -2.77 0.09 0.00 0.56 0.00 0.00 36.38 33.60 2jza s VAL 39 CO 0.40 0.00 0.21 -0.31 -0.31 0.00 0.00 175.10 175.09 2jza s TYR 40 N -3.34 -0.24 -0.52 2.82 2.02 0.31 -4.91 117.35 113.50 2jza s TYR 40 Ca 0.36 0.25 -0.18 0.00 -0.37 0.00 0.00 57.07 57.13 2jza s TYR 40 Cb 0.09 -0.36 0.08 0.00 -0.40 0.00 0.00 41.96 41.36 2jza s TYR 40 CO 0.15 -0.56 0.58 0.00 -1.57 0.00 0.00 175.55 174.15 2jza s ALA 41 N 2.31 3.46 0.28 3.71 0.00 -1.25 0.58 121.76 130.84 2jza s ALA 41 Ca 0.06 -2.02 0.10 0.00 0.00 0.00 0.00 51.96 50.10 2jza s ALA 41 Cb -0.15 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.59 2jza s ALA 41 CO -0.11 -2.03 -0.14 0.96 0.00 0.00 0.00 175.76 174.44 2jza s ILE 42 N 2.32 2.13 0.00 0.00 -4.36 -0.03 -0.35 121.20 120.91 2jza s ILE 42 Ca 0.11 -2.28 -0.04 0.00 -0.26 0.00 0.00 60.65 58.19 2jza s ILE 42 Cb -0.23 -2.34 -0.16 0.00 1.25 0.00 0.00 42.46 40.98 2jza s ILE 42 CO 0.09 -0.38 2.69 -1.20 0.24 0.00 0.00 174.94 176.37 2jza n SER 43 N -0.60 4.45 -3.62 4.36 7.64 -0.39 -0.36 113.62 125.11 2jza n SER 43 Ca -0.06 -2.28 -0.41 0.00 1.01 0.00 0.00 58.87 57.13 2jza n SER 43 Cb 0.61 -1.12 0.01 0.00 -1.01 0.00 0.00 64.21 62.70 2jza n SER 43 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jza n ASN 44 N 2.27 7.43 -4.15 6.43 5.15 -1.26 -4.70 115.26 126.43 2jza n ASN 44 Ca 0.25 -3.42 -0.29 0.00 -0.60 0.00 0.00 54.58 50.52 2jza n ASN 44 Cb 0.67 -1.27 -0.17 0.00 -0.53 0.00 0.00 39.78 38.48 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 -2.67 1.73 -0.18 -1.44 1.09 -1.26 -4.42 121.20 114.04 2jza s ILE 45 Ca 0.44 -0.82 -0.22 0.00 -1.10 0.00 0.00 60.65 58.95 2jza s ILE 45 Cb 0.17 -1.52 -0.02 0.00 -1.06 0.00 0.00 42.46 40.03 2jza s ILE 45 CO -0.09 0.49 0.69 -0.62 -0.10 0.00 0.00 174.94 175.31 2jza s ASP 46 N 0.49 6.78 0.59 3.58 -1.08 -1.04 -4.95 116.67 121.05 2jza s ASP 46 Ca -0.17 0.96 0.35 0.00 -0.52 0.00 0.00 52.55 53.17 2jza s ASP 46 Cb -0.17 -2.38 1.81 0.00 -1.46 0.00 0.00 42.92 40.72 2jza s ASP 46 CO 0.06 -0.30 2.18 -0.65 0.52 0.00 0.00 175.17 176.98 2jza h PRO 47 N 7.39 0.00 0.00 4.34 0.11 -1.96 0.41 132.00 142.29 2jza h PRO 47 Ca -0.31 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 2jza h PRO 47 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 2jza h PRO 47 CO 0.79 0.04 -0.39 0.35 -0.21 0.00 0.00 178.00 178.59 2jza h PHE 48 N 0.00 0.00 0.00 0.65 3.57 -1.95 -3.26 116.94 115.95 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 0.22 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 2jza h PHE 48 CO 0.00 0.22 -1.65 0.00 -2.23 0.00 0.00 178.31 174.65 2jza n ALA 49 N -2.17 2.51 -2.29 2.41 0.00 -0.83 -4.98 120.51 115.16 2jza n ALA 49 Ca 0.02 -0.35 -0.20 0.00 0.00 0.00 0.00 53.44 52.91 2jza n ALA 49 Cb 0.63 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 2jza n ALA 49 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2jza n GLN 50 N -2.00 -1.69 -3.89 0.00 -0.06 0.14 -4.94 117.38 104.94 2jza n GLN 50 Ca -0.03 1.01 -0.09 0.00 -2.00 0.00 0.00 57.00 55.88 2jza n GLN 50 Cb 0.38 -5.63 -0.06 0.00 -4.06 0.00 0.00 30.24 20.87 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2jza s ALA 51 N -2.97 -0.35 -1.12 1.69 0.00 -1.22 -4.98 121.76 112.81 2jza s ALA 51 Ca 0.00 -0.65 -0.08 0.00 0.00 0.00 0.00 51.96 51.22 2jza s ALA 51 Cb 0.00 0.88 -0.13 0.00 0.00 0.00 0.00 23.12 23.87 2jza s ALA 51 CO 0.00 -0.72 3.12 -1.13 0.00 0.00 0.00 175.76 177.03 2jza n SER 52 N -0.28 7.69 0.00 0.00 3.41 -1.26 -2.49 113.62 120.69 2jza n SER 52 Ca -0.08 -2.59 0.10 0.00 -0.26 0.00 0.00 58.87 56.05 2jza n SER 52 Cb 0.63 -1.50 0.44 0.00 -0.26 0.00 0.00 64.21 63.52 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 3.12 0.57 1.21 -3.33 0.24 -1.26 -0.48 118.33 118.40 2jza n VAL 53 Ca 0.67 0.14 0.13 0.00 -2.04 0.00 0.00 64.34 63.24 2jza n VAL 53 Cb 0.43 -0.79 0.28 0.00 -1.47 0.00 0.00 33.84 32.29 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 2.03 -0.04 1.34 4.77 -1.26 -4.26 117.00 118.09 2jza n LEU 54 Ca 0.05 -0.68 -0.09 0.00 -0.03 0.00 0.00 56.01 55.27 2jza n LEU 54 Cb 0.24 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2jza n LEU 54 CO 0.19 0.35 -0.68 -0.24 -1.33 0.00 0.00 177.39 175.67 2jza n SER 55 N 0.43 0.85 -3.37 -1.43 2.88 0.01 -4.24 113.62 108.75 2jza n SER 55 Ca 0.15 0.14 -0.39 0.00 -1.33 0.00 0.00 58.87 57.43 2jza n SER 55 Cb 0.46 -0.33 -0.02 0.00 -0.75 0.00 0.00 64.21 63.57 2jza n SER 55 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2jza n ARG 56 N -3.53 4.04 0.00 -1.46 0.63 0.37 -4.38 116.66 112.33 2jza n ARG 56 Ca -0.15 -2.66 0.00 0.00 -0.92 0.00 0.00 57.85 54.11 2jza n ARG 56 Cb 0.52 -2.74 0.00 0.00 0.45 0.00 0.00 32.46 30.70 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 2.89 0.63 3.04 5.14 0.00 -1.26 -4.93 105.19 110.70 2jza n GLY 57 Ca 0.73 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 46.49 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 0.13 1.10 -0.13 -0.61 1.01 -0.91 -5.01 121.20 116.78 2jza s ILE 58 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.15 2jza s ILE 58 Cb 0.00 -0.99 0.02 0.00 0.01 0.00 0.00 42.46 41.51 2jza s ILE 58 CO 0.00 0.34 -0.12 0.54 0.00 0.00 0.00 174.94 175.69 2jza s VAL 59 N 0.38 1.39 0.19 2.92 0.11 -1.26 0.15 120.40 124.27 2jza s VAL 59 Ca -0.09 -0.53 -0.22 0.00 -2.93 0.00 0.00 61.98 58.21 2jza s VAL 59 Cb -0.13 -1.32 0.06 0.00 -1.53 0.00 0.00 36.38 33.46 2jza s VAL 59 CO 0.02 0.43 0.62 0.00 -3.33 0.00 0.00 175.10 172.84 2jza s ALA 60 N 1.44 -1.48 0.43 1.54 0.00 -1.18 -5.00 121.76 117.52 2jza s ALA 60 Ca 0.02 0.27 -0.08 0.00 0.00 0.00 0.00 51.96 52.18 2jza s ALA 60 Cb -0.13 0.88 -0.05 0.00 0.00 0.00 0.00 23.12 23.81 2jza s ALA 60 CO -0.08 -0.83 0.76 -1.83 0.00 0.00 0.00 175.76 173.78 2jza s GLU 61 N -3.79 3.66 -0.35 0.00 1.03 -1.26 -2.38 118.70 115.59 2jza s GLU 61 Ca 0.04 0.31 0.00 0.00 0.03 0.00 0.00 54.97 55.35 2jza s GLU 61 Cb -0.02 -2.40 0.11 0.00 -0.80 0.00 0.00 34.13 31.02 2jza s GLU 61 CO -0.08 -0.10 0.15 -1.58 -1.33 0.00 0.00 175.26 172.32 2jza s HIS 62 N -2.52 1.80 0.00 4.83 2.46 0.53 -4.88 115.29 117.51 2jza s HIS 62 Ca 0.49 -1.99 0.00 0.00 0.47 0.00 0.00 55.06 54.03 2jza s HIS 62 Cb -0.10 -1.76 0.00 0.00 -0.13 0.00 0.00 32.58 30.59 2jza s HIS 62 CO 0.37 -0.85 0.00 0.94 -2.47 0.00 0.00 174.74 172.74 2jza n GLN 63 N 4.37 0.00 0.00 2.88 7.27 -1.26 -2.65 117.38 127.99 2jza n GLN 63 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.09 2jza n GLN 63 Cb 0.39 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.04 2jza n GLN 63 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 2jza n ASP 64 N 2.46 0.00 -4.95 1.69 2.03 -1.26 -5.13 116.55 111.39 2jza n ASP 64 Ca 0.00 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.07 2jza n ASP 64 Cb 0.00 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.45 2jza n ASP 64 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2jza s ASP 65 N -1.58 5.06 -0.21 1.67 1.11 -1.08 -5.08 116.67 116.55 2jza s ASP 65 Ca 0.00 0.23 -0.05 0.00 0.18 0.00 0.00 52.55 52.92 2jza s ASP 65 Cb 0.00 -1.01 -0.02 0.00 1.07 0.00 0.00 42.92 42.96 2jza s ASP 65 CO 0.00 -1.37 -0.00 -0.76 1.18 0.00 0.00 175.17 174.22 2jza s LEU 66 N -5.01 3.21 0.36 1.23 1.43 -1.26 -0.34 118.68 118.30 2jza s LEU 66 Ca 0.59 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.49 2jza s LEU 66 Cb -0.11 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 2jza s LEU 66 CO 0.42 0.05 0.12 0.26 0.23 0.00 0.00 176.35 177.42 2jza s TRP 67 N 1.10 1.78 0.06 0.29 0.52 -1.00 -2.01 118.94 119.67 2jza s TRP 67 Ca 0.02 -1.21 0.10 0.00 0.02 0.00 0.00 56.10 55.02 2jza s TRP 67 Cb -0.14 -1.12 -0.03 0.00 -1.15 0.00 0.00 33.47 31.03 2jza s TRP 67 CO 0.01 -0.27 -0.26 0.54 0.02 0.00 0.00 176.95 176.99 2jza s VAL 68 N -3.34 2.15 -0.40 4.03 0.11 -0.11 -3.09 120.40 119.75 2jza s VAL 68 Ca 0.30 -1.45 -0.06 0.00 -2.93 0.00 0.00 61.98 57.84 2jza s VAL 68 Cb 0.05 -1.85 0.09 0.00 -1.53 0.00 0.00 36.38 33.14 2jza s VAL 68 CO 0.15 0.32 0.21 0.00 -3.33 0.00 0.00 175.10 172.45 2jza s ALA 69 N -0.85 3.19 -0.05 1.54 0.00 0.12 -2.65 121.76 123.06 2jza s ALA 69 Ca 0.12 -2.26 -0.30 0.00 0.00 0.00 0.00 51.96 49.52 2jza s ALA 69 Cb -0.10 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 2jza s ALA 69 CO 0.03 -1.67 1.27 -1.12 0.00 0.00 0.00 175.76 174.27 2jza s SER 70 N 1.94 6.98 0.44 0.00 0.01 -1.14 -2.15 113.70 119.77 2jza s SER 70 Ca 0.04 1.90 0.10 0.00 1.31 0.00 0.00 55.95 59.30 2jza s SER 70 Cb -0.23 -2.56 0.96 0.00 0.21 0.00 0.00 66.02 64.41 2jza s SER 70 CO -0.01 -0.64 2.05 1.55 0.41 0.00 0.00 173.24 176.60 2jza h PRO 71 N 7.66 0.32 0.00 12.44 0.13 -1.89 0.11 132.00 150.77 2jza h PRO 71 Ca -0.35 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2jza h PRO 71 Cb 1.16 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2jza h PRO 71 CO 0.90 0.26 -0.30 -0.07 -0.23 0.00 0.00 178.00 178.56 2jza h LEU 72 N 0.32 0.00 -0.95 1.56 3.38 -1.92 -3.40 115.31 114.30 2jza h LEU 72 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 2jza h LEU 72 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2jza h LEU 72 CO -0.01 0.47 -0.39 0.11 0.09 0.00 0.00 178.44 178.71 2jza h LYS 73 N -0.63 0.00 -0.51 1.13 1.79 -1.94 -3.46 116.57 112.95 2jza h LYS 73 Ca 0.00 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.25 2jza h LYS 73 Cb 0.30 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.86 2jza h LYS 73 CO 0.00 0.39 -0.20 1.63 -1.08 0.00 0.00 179.45 180.19 2jza n LYS 74 N -3.58 -1.46 -2.78 3.15 5.02 0.38 -4.97 118.16 113.92 2jza n LYS 74 Ca -0.00 0.85 -0.39 0.00 -2.02 0.00 0.00 58.31 56.75 2jza n LYS 74 Cb 0.51 -5.13 -0.06 0.00 -0.02 0.00 0.00 35.03 30.33 2jza n LYS 74 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2jza s GLN 75 N -2.79 4.73 -0.59 1.97 -0.21 -1.26 -4.76 119.66 116.74 2jza s GLN 75 Ca 0.00 1.40 -0.11 0.00 0.02 0.00 0.00 55.36 56.67 2jza s GLN 75 Cb 0.00 -3.08 0.15 0.00 1.00 0.00 0.00 33.01 31.08 2jza s GLN 75 CO 0.00 0.43 0.49 -1.01 -2.12 0.00 0.00 175.29 173.07 2jza s HIS 76 N -1.36 3.46 -0.21 0.91 3.76 -0.94 -2.90 115.29 118.01 2jza s HIS 76 Ca 0.44 -1.89 -0.27 0.00 -0.15 0.00 0.00 55.06 53.19 2jza s HIS 76 Cb -0.23 -3.60 -0.00 0.00 1.11 0.00 0.00 32.58 29.86 2jza s HIS 76 CO 0.28 -0.98 0.93 -0.06 -0.85 0.00 0.00 174.74 174.06 2jza s PHE 77 N 0.94 3.36 0.04 1.40 0.40 -1.09 -2.02 117.98 121.02 2jza s PHE 77 Ca 0.09 1.33 -0.31 0.00 -0.60 0.00 0.00 56.93 57.45 2jza s PHE 77 Cb -0.23 -3.14 -0.06 0.00 0.51 0.00 0.00 43.02 40.10 2jza s PHE 77 CO -0.02 -0.38 1.33 0.50 0.70 0.00 0.00 175.22 177.35 2jza s ARG 78 N 2.77 4.33 -0.96 0.44 3.52 -0.70 -0.94 118.95 127.42 2jza s ARG 78 Ca 0.40 1.92 -0.17 0.00 -0.13 0.00 0.00 55.73 57.76 2jza s ARG 78 Cb -0.16 -3.43 -0.10 0.00 -1.56 0.00 0.00 34.95 29.70 2jza s ARG 78 CO 0.09 -0.45 2.06 1.28 -0.81 0.00 0.00 175.30 177.47 2jza n LEU 79 N 4.64 4.95 0.00 -0.88 4.77 -0.85 -2.48 117.00 127.15 2jza n LEU 79 Ca 0.11 -3.17 0.00 0.00 -0.03 0.00 0.00 56.01 52.93 2jza n LEU 79 Cb 0.44 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 2jza n LEU 79 CO 0.58 0.20 0.00 0.00 -1.33 0.00 0.00 177.39 176.84 2jza n TYR 80 N 6.38 0.00 -0.03 -1.77 9.36 -1.26 -4.99 117.16 124.84 2jza n TYR 80 Ca 0.50 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.57 2jza n TYR 80 Cb 0.34 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 38.96 2jza n TYR 80 CO 0.00 0.00 0.00 0.22 0.22 0.00 0.00 176.86 177.30 2jza h ASP 81 N 0.00 0.58 0.00 2.98 3.58 -1.87 -3.38 116.42 118.31 2jza h ASP 81 Ca 0.00 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 56.83 2jza h ASP 81 Cb 0.00 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.88 2jza h ASP 81 CO 0.00 1.10 0.00 0.61 -2.88 0.00 0.00 179.24 178.07 2jza n GLY 82 N 0.64 1.88 3.75 -0.78 0.00 -1.04 -4.86 105.19 104.79 2jza n GLY 82 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.38 2.89 -0.51 1.61 5.36 -1.26 -3.73 117.98 119.96 2jza s PHE 83 Ca 0.00 0.96 0.06 0.00 -0.96 0.00 0.00 56.93 56.99 2jza s PHE 83 Cb 0.00 -3.92 0.42 0.00 -0.34 0.00 0.00 43.02 39.17 2jza s PHE 83 CO 0.00 -3.00 1.25 0.00 -1.46 0.00 0.00 175.22 172.01 2jza n LEU 85 N 0.15 0.00 -0.08 0.00 7.94 -0.86 -2.21 117.00 121.95 2jza n LEU 85 Ca 0.19 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.94 2jza n LEU 85 Cb 0.85 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.67 2jza n LEU 85 CO 0.21 0.00 0.24 -0.33 -1.11 0.00 0.00 177.39 176.40 2jza h GLU 86 N 0.00 0.00 0.00 1.96 4.39 -1.92 -3.48 114.58 115.53 2jza h GLU 86 Ca 0.00 -0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.39 2jza h GLU 86 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2jza h GLU 86 CO 0.00 1.00 -0.10 -3.47 -1.16 0.00 0.00 179.01 175.28 2jza n ASP 87 N -4.58 1.65 -1.59 1.42 -0.08 -1.19 -5.06 116.55 107.12 2jza n ASP 87 Ca -0.14 -1.99 -0.03 0.00 -1.51 0.00 0.00 54.79 51.12 2jza n ASP 87 Cb 0.51 -0.12 -0.00 0.00 2.34 0.00 0.00 41.12 43.85 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 1.11 1.02 0.09 0.27 0.00 -1.26 -3.33 105.19 103.08 2jza n GLY 88 Ca 0.03 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 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 0.65 0.01 -2.60 4.61 0.00 -1.97 -3.38 119.26 116.58 2jza h ALA 89 Ca -0.43 -0.48 -0.78 0.00 0.00 0.00 0.00 54.91 53.22 2jza h ALA 89 Cb 1.49 0.02 -0.30 0.00 0.00 0.00 0.00 17.79 19.00 2jza h ALA 89 CO -0.14 0.06 0.34 0.66 0.00 0.00 0.00 179.25 180.17 2jza n TYR 90 N -4.53 4.92 -2.23 0.00 4.01 -1.26 -4.96 117.16 113.10 2jza n TYR 90 Ca -0.10 -3.92 -0.33 0.00 -0.16 0.00 0.00 57.90 53.39 2jza n TYR 90 Cb 0.51 -1.55 -0.04 0.00 -0.31 0.00 0.00 39.34 37.94 2jza n TYR 90 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2jza s SER 91 N 0.81 5.62 0.44 7.72 0.01 -1.26 -4.77 113.70 122.27 2jza s SER 91 Ca 0.30 -1.67 -0.21 0.00 1.31 0.00 0.00 55.95 55.68 2jza s SER 91 Cb -0.09 -2.58 -0.10 0.00 0.21 0.00 0.00 66.02 63.46 2jza s SER 91 CO -0.08 -2.42 0.97 0.68 0.41 0.00 0.00 173.24 172.80 2jza s VAL 92 N 8.67 4.22 0.37 3.43 -7.23 -1.24 -5.05 120.40 123.57 2jza s VAL 92 Ca 0.63 1.41 0.05 0.00 -1.81 0.00 0.00 61.98 62.26 2jza s VAL 92 Cb -0.01 -3.58 -0.00 0.00 0.56 0.00 0.00 36.38 33.35 2jza s VAL 92 CO 0.08 -0.28 0.53 0.00 -0.31 0.00 0.00 175.10 175.12 2jza s ALA 93 N -2.10 4.15 -0.29 1.32 0.00 -1.26 -4.17 121.76 119.40 2jza s ALA 93 Ca 0.63 -1.39 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2jza s ALA 93 Cb -0.11 -1.79 0.08 0.00 0.00 0.00 0.00 23.12 21.30 2jza s ALA 93 CO 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 175.76 175.75 2jza s ALA 94 N -2.29 2.48 -0.05 0.00 0.00 -1.26 -1.26 121.76 119.38 2jza s ALA 94 Ca 0.47 -1.98 -0.25 0.00 0.00 0.00 0.00 51.96 50.19 2jza s ALA 94 Cb -0.10 -1.71 -0.03 0.00 0.00 0.00 0.00 23.12 21.28 2jza s ALA 94 CO 0.33 -1.44 0.78 0.71 0.00 0.00 0.00 175.76 176.14 2jza s TYR 95 N 1.13 3.60 0.68 0.00 2.02 0.52 -5.00 117.35 120.30 2jza s TYR 95 Ca 0.01 1.38 -0.16 0.00 -0.37 0.00 0.00 57.07 57.94 2jza s TYR 95 Cb -0.19 -2.90 0.01 0.00 -0.40 0.00 0.00 41.96 38.48 2jza s TYR 95 CO -0.08 0.05 1.16 -0.51 -1.57 0.00 0.00 175.55 174.60 2jza s ASP 96 N 0.87 4.71 -0.03 2.29 1.11 -1.26 -3.82 116.67 120.53 2jza s ASP 96 Ca 0.42 2.21 0.02 0.00 0.18 0.00 0.00 52.55 55.38 2jza s ASP 96 Cb -0.19 -2.57 0.01 0.00 1.07 0.00 0.00 42.92 41.24 2jza s ASP 96 CO 0.21 -1.91 -0.07 0.42 1.18 0.00 0.00 175.17 175.00 2jza s THR 97 N -2.08 0.64 0.12 -1.27 -4.23 -1.26 0.04 115.64 107.61 2jza s THR 97 Ca 0.72 -0.25 0.08 0.00 -1.18 0.00 0.00 61.69 61.06 2jza s THR 97 Cb -0.26 -0.60 -0.04 0.00 1.34 0.00 0.00 72.50 72.94 2jza s THR 97 CO 0.42 0.22 -0.14 0.00 -0.54 0.00 0.00 174.62 174.58 2jza s GLN 98 N 0.46 1.94 -0.62 3.99 -2.07 0.86 -4.97 119.66 119.25 2jza s GLN 98 Ca -0.07 -1.14 -0.12 0.00 -1.82 0.00 0.00 55.36 52.21 2jza s GLN 98 Cb -0.10 -2.18 0.16 0.00 -1.09 0.00 0.00 33.01 29.79 2jza s GLN 98 CO 0.00 0.48 0.53 0.08 -1.32 0.00 0.00 175.29 175.07 2jza s VAL 99 N -1.26 4.93 0.00 3.63 1.01 -1.26 -1.13 120.40 126.32 2jza s VAL 99 Ca 0.20 -2.00 -0.16 0.00 0.00 0.00 0.00 61.98 60.02 2jza s VAL 99 Cb -0.10 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 2jza s VAL 99 CO 0.12 -0.89 0.89 0.74 0.00 0.00 0.00 175.10 175.96 2jza h THR 100 N 5.56 0.00 -0.31 3.92 2.02 -1.91 -3.46 112.91 118.73 2jza h THR 100 Ca -0.13 -0.22 0.16 0.00 0.77 0.00 0.00 66.41 66.99 2jza h THR 100 Cb 1.06 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.29 2jza h THR 100 CO 0.88 0.00 -0.09 0.21 0.37 0.00 0.00 175.52 176.89 2jza s ASN 101 N -3.76 -0.50 0.00 4.18 3.84 -1.26 -4.96 114.94 112.49 2jza s ASN 101 Ca -0.08 -0.07 0.00 0.00 0.21 0.00 0.00 52.86 52.91 2jza s ASN 101 Cb 0.01 1.02 0.00 0.00 -0.55 0.00 0.00 41.25 41.73 2jza s ASN 101 CO 0.25 -0.08 0.00 0.61 -2.79 0.00 0.00 177.10 175.10 2jza n GLY 102 N 4.55 1.16 3.82 1.21 0.00 -1.26 -4.92 105.19 109.75 2jza n GLY 102 Ca 0.08 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2jza n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jza s ASN 103 N 0.00 5.72 -0.14 1.61 0.01 -1.26 -0.27 114.94 120.61 2jza s ASN 103 Ca 0.00 0.02 -0.07 0.00 -0.71 0.00 0.00 52.86 52.10 2jza s ASN 103 Cb 0.00 -1.58 -0.04 0.00 0.41 0.00 0.00 41.25 40.03 2jza s ASN 103 CO 0.00 0.14 0.11 -0.69 -1.51 0.00 0.00 177.10 175.14 2jza s VAL 104 N -1.53 5.22 -0.13 1.60 1.01 -0.52 -2.93 120.40 123.12 2jza s VAL 104 Ca 0.31 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.42 2jza s VAL 104 Cb -0.12 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 32.96 2jza s VAL 104 CO 0.24 0.55 -0.19 -1.10 0.00 0.00 0.00 175.10 174.59 2jza s GLN 105 N -0.45 3.13 0.15 2.72 -0.21 -0.29 -0.18 119.66 124.53 2jza s GLN 105 Ca 0.11 -0.81 0.03 0.00 0.02 0.00 0.00 55.36 54.71 2jza s GLN 105 Cb -0.12 -2.48 -0.03 0.00 1.00 0.00 0.00 33.01 31.38 2jza s GLN 105 CO 0.02 0.07 0.28 0.96 -2.12 0.00 0.00 175.29 174.50 2jza s ILE 106 N 0.63 5.29 -0.10 1.08 -0.00 -0.92 -0.10 121.20 127.08 2jza s ILE 106 Ca -0.10 -0.72 -0.30 0.00 -0.00 0.00 0.00 60.65 59.53 2jza s ILE 106 Cb -0.16 -3.73 -0.02 0.00 -0.00 0.00 0.00 42.46 38.55 2jza s ILE 106 CO 0.02 -0.10 1.14 -0.55 -0.00 0.00 0.00 174.94 175.45 2jza s SER 107 N -3.26 7.09 -0.75 4.36 0.15 0.11 -1.66 113.70 119.73 2jza s SER 107 Ca 0.34 1.68 0.03 0.00 0.70 0.00 0.00 55.95 58.71 2jza s SER 107 Cb -0.11 -2.55 0.22 0.00 -1.71 0.00 0.00 66.02 61.87 2jza s SER 107 CO 0.28 -0.58 0.75 2.30 1.20 0.00 0.00 173.24 177.19 2jza n ILE 108 N 4.77 2.55 -0.17 6.45 -5.35 0.70 -4.61 119.36 123.69 2jza n ILE 108 Ca 0.11 -5.16 0.05 0.00 -0.27 0.00 0.00 62.75 57.47 2jza n ILE 108 Cb 0.47 -2.18 0.26 0.00 -1.74 0.00 0.00 39.64 36.44 2jza n ILE 108 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jza n ALA 109 N 1.51 3.34 -3.47 -1.28 0.00 -1.26 -4.85 120.51 114.50 2jza n ALA 109 Ca 0.25 -1.20 -0.17 0.00 0.00 0.00 0.00 53.44 52.32 2jza n ALA 109 Cb 0.38 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.69 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 -0.52 -0.59 -0.01 0.00 -1.08 -1.26 -5.06 116.67 108.15 2jza s ASP 110 Ca 0.35 0.57 0.02 0.00 -0.52 0.00 0.00 52.55 52.97 2jza s ASP 110 Cb 0.26 0.52 0.03 0.00 -1.46 0.00 0.00 42.92 42.27 2jza s ASP 110 CO 0.11 -0.62 0.90 -0.24 0.52 0.00 0.00 175.17 175.83 2jza n SER 111 N 0.84 0.32 -2.97 -0.34 2.88 -1.26 -5.05 113.62 108.04 2jza n SER 111 Ca -0.19 -1.87 -0.10 0.00 -1.33 0.00 0.00 58.87 55.38 2jza n SER 111 Cb 0.58 -0.17 0.01 0.00 -0.75 0.00 0.00 64.21 63.88 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 -0.17 -7.38 -4.73 -3.46 2.03 -1.26 -4.85 116.55 96.72 2jza n ASP 112 Ca 0.02 0.68 -0.42 0.00 0.52 0.00 0.00 54.79 55.60 2jza n ASP 112 Cb 0.63 -4.23 -0.03 0.00 -0.72 0.00 0.00 41.12 36.77 2jza n ASP 112 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2jza s VAL 113 N -1.89 2.97 0.19 5.18 -7.23 -1.26 -5.00 120.40 113.36 2jza s VAL 113 Ca 0.16 0.78 -0.03 0.00 -1.81 0.00 0.00 61.98 61.08 2jza s VAL 113 Cb -0.03 -3.50 0.01 0.00 0.56 0.00 0.00 36.38 33.42 2jza s VAL 113 CO 0.69 0.11 0.29 0.00 -0.31 0.00 0.00 175.10 175.87 2jza n ALA 114 N 2.84 -0.35 -1.68 1.32 0.00 -1.26 -5.04 120.51 116.34 2jza n ALA 114 Ca 0.08 -0.80 -0.42 0.00 0.00 0.00 0.00 53.44 52.30 2jza n ALA 114 Cb 0.41 0.64 -0.01 0.00 0.00 0.00 0.00 19.45 20.50 2jza n ALA 114 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2jza n VAL 115 N -0.29 3.30 -3.76 0.00 3.14 -1.26 -4.89 118.33 114.57 2jza n VAL 115 Ca -0.01 -2.88 0.00 0.00 -2.96 0.00 0.00 64.34 58.49 2jza n VAL 115 Cb 0.30 -2.58 0.00 0.00 -1.06 0.00 0.00 33.84 30.50 2jza n VAL 115 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2jza n ASP 116 N 6.23 -1.83 -3.71 6.55 2.03 -1.26 -4.98 116.55 119.57 2jza n ASP 116 Ca 0.52 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.78 2jza n ASP 116 Cb 0.39 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.78 2jza n ASP 116 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2jza s ASN 117 N -4.00 -0.23 -0.76 1.67 2.20 -1.26 -5.09 114.94 107.46 2jza s ASN 117 Ca 0.00 -0.35 0.03 0.00 -0.94 0.00 0.00 52.86 51.60 2jza s ASN 117 Cb 0.00 0.51 0.19 0.00 -2.00 0.00 0.00 41.25 39.95 2jza s ASN 117 CO 0.00 -0.92 0.60 -0.24 -2.94 0.00 0.00 177.10 173.60 2jza n SER 118 N -0.43 3.43 -4.63 3.54 2.88 -1.26 -5.06 113.62 112.09 2jza n SER 118 Ca -0.07 -3.21 -0.43 0.00 -1.33 0.00 0.00 58.87 53.84 2jza n SER 118 Cb 0.61 -0.84 -0.03 0.00 -0.75 0.00 0.00 64.21 63.20 2jza n SER 118 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2jza s GLN 119 N -1.52 3.66 -0.54 -1.46 2.00 -1.26 -4.95 119.66 115.59 2jza s GLN 119 Ca 0.27 2.13 -0.25 0.00 -2.00 0.00 0.00 55.36 55.50 2jza s GLN 119 Cb -0.04 -4.21 0.04 0.00 0.80 0.00 0.00 33.01 29.60 2jza s GLN 119 CO -0.15 -1.49 0.96 -1.25 -0.50 0.00 0.00 175.29 172.86 2jza s PRO 120 N 5.24 3.39 -0.41 1.67 0.05 -1.26 -5.00 135.00 138.69 2jza s PRO 120 Ca 0.88 -0.13 -0.28 0.00 0.05 0.00 0.00 61.00 61.52 2jza s PRO 120 Cb -0.34 -4.02 -0.01 0.00 0.05 0.00 0.00 34.50 30.17 2jza s PRO 120 CO 0.36 -1.45 1.75 -0.51 0.05 0.00 0.00 177.00 177.19 2jza s LEU 121 N 4.01 3.47 0.21 -3.56 2.01 -1.26 -4.98 118.68 118.58 2jza s LEU 121 Ca 0.33 1.00 -0.14 0.00 0.01 0.00 0.00 54.13 55.33 2jza s LEU 121 Cb -0.12 -3.29 -0.08 0.00 0.01 0.00 0.00 46.19 42.72 2jza s LEU 121 CO 0.21 -1.82 0.61 -2.16 1.01 0.00 0.00 176.35 174.21 2jza s PRO 122 N 5.86 3.99 -0.03 1.29 0.04 -1.26 -5.07 135.00 139.82 2jza s PRO 122 Ca 0.74 0.54 -0.18 0.00 0.04 0.00 0.00 61.00 62.14 2jza s PRO 122 Cb -0.19 -2.76 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 2jza s PRO 122 CO 0.30 0.37 0.49 -0.48 0.04 0.00 0.00 177.00 177.72 2jza s LEU 123 N -2.35 4.40 0.54 -3.56 0.05 -1.26 -5.08 118.68 111.42 2jza s LEU 123 Ca 0.44 1.00 0.09 0.00 0.05 0.00 0.00 54.13 55.71 2jza s LEU 123 Cb -0.13 -2.74 0.07 0.00 -2.05 0.00 0.00 46.19 41.34 2jza s LEU 123 CO 0.20 0.16 0.75 -0.70 -0.55 0.00 0.00 176.35 176.21 2jza s GLU 124 N -0.33 2.41 -1.11 1.48 -6.30 -1.26 -4.97 118.70 108.62 2jza s GLU 124 Ca 0.27 -1.56 -0.21 0.00 -2.50 0.00 0.00 54.97 50.96 2jza s GLU 124 Cb -0.17 -2.67 -0.08 0.00 0.00 0.00 0.00 34.13 31.22 2jza s GLU 124 CO 0.14 -0.74 1.92 0.72 0.02 0.00 0.00 175.26 177.32 2jza n HIS 125 N -2.16 2.85 -2.33 5.30 8.25 -1.26 -4.88 115.22 120.98 2jza n HIS 125 Ca 0.14 -1.84 -0.37 0.00 -0.26 0.00 0.00 57.72 55.39 2jza n HIS 125 Cb 0.61 -2.39 -0.03 0.00 1.12 0.00 0.00 29.99 29.30 2jza n HIS 125 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jza s HIS 126 N 8.08 2.11 -1.10 4.41 2.46 -1.26 -4.91 115.29 125.07 2jza s HIS 126 Ca 0.62 0.07 -0.18 0.00 0.47 0.00 0.00 55.06 56.04 2jza s HIS 126 Cb 0.05 -4.40 0.12 0.00 -0.13 0.00 0.00 32.58 28.21 2jza s HIS 126 CO 0.11 -2.02 1.40 -3.38 -2.47 0.00 0.00 174.74 168.38 2jza s HIS 127 N 7.22 3.07 -0.85 3.88 -3.43 -1.26 -4.93 115.29 118.98 2jza s HIS 127 Ca 0.53 -1.57 -0.15 0.00 -0.80 0.00 0.00 55.06 53.07 2jza s HIS 127 Cb -0.07 -4.46 0.20 0.00 -1.43 0.00 0.00 32.58 26.83 2jza s HIS 127 CO 0.06 -1.60 0.84 -1.58 -2.00 0.00 0.00 174.74 170.46 2jza s HIS 128 N 3.05 3.65 -0.24 0.38 2.46 -1.26 -4.79 115.29 118.53 2jza s HIS 128 Ca 0.42 -1.89 -0.16 0.00 0.47 0.00 0.00 55.06 53.90 2jza s HIS 128 Cb -0.02 -3.91 -0.16 0.00 -0.13 0.00 0.00 32.58 28.37 2jza s HIS 128 CO -0.03 -1.08 -0.06 1.58 -2.47 0.00 0.00 174.74 172.67 2jza n HIS 129 N 4.44 0.52 -0.79 3.88 -0.00 -1.26 -5.34 115.22 116.67 2jza n HIS 129 Ca 0.16 0.21 0.00 0.00 0.46 0.00 0.00 57.72 58.55 2jza n HIS 129 Cb 0.47 -1.05 0.00 0.00 -0.12 0.00 0.00 29.99 29.29 2jza n HIS 129 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41