#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 -0.21 7.83 3.41 -1.26 -4.89 113.62 118.50 2jza n SER 2 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.63 2jza n SER 2 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 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 0.00 0.76 -1.64 4.33 10.64 -1.26 -5.07 117.38 125.14 2jza n GLN 3 Ca 0.00 -1.35 -0.42 0.00 -1.83 0.00 0.00 57.00 53.39 2jza n GLN 3 Cb 0.00 -0.82 -0.03 0.00 -0.86 0.00 0.00 30.24 28.53 2jza n GLN 3 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 2jza n TRP 4 N -0.43 2.36 -3.22 2.61 7.02 -1.26 -4.73 117.44 119.79 2jza n TRP 4 Ca 0.04 -0.31 -0.39 0.00 -1.02 0.00 0.00 57.50 55.83 2jza n TRP 4 Cb 0.57 -2.78 -0.06 0.00 -2.42 0.00 0.00 31.31 26.63 2jza n TRP 4 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2jza s THR 5 N 5.55 5.06 -0.18 -0.99 2.01 -0.13 -4.79 115.64 122.17 2jza s THR 5 Ca 0.92 1.17 -0.29 0.00 0.31 0.00 0.00 61.69 63.80 2jza s THR 5 Cb -0.41 -3.91 -0.01 0.00 0.01 0.00 0.00 72.50 68.18 2jza s THR 5 CO 0.40 0.34 1.32 -0.89 -0.69 0.00 0.00 174.62 175.10 2jza s THR 6 N 0.37 4.18 0.00 -0.82 2.01 -1.26 -1.86 115.64 118.26 2jza s THR 6 Ca 0.30 1.40 0.00 0.00 0.31 0.00 0.00 61.69 63.71 2jza s THR 6 Cb -0.17 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.37 2jza s THR 6 CO 0.14 -0.20 0.00 0.52 -0.69 0.00 0.00 174.62 174.40 2jza n VAL 7 N 5.58 0.00 -3.62 3.82 0.31 0.11 -4.99 118.33 119.54 2jza n VAL 7 Ca 0.15 0.49 -0.06 0.00 -0.01 0.00 0.00 64.34 64.90 2jza n VAL 7 Cb 0.45 -1.47 0.02 0.00 -0.91 0.00 0.00 33.84 31.93 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 -2.06 4.22 0.16 0.00 1.02 -1.26 0.38 119.74 122.20 2jza s LYS 9 Ca 0.13 0.82 0.18 0.00 0.02 0.00 0.00 55.97 57.11 2jza s LYS 9 Cb -0.03 -2.95 0.78 0.00 -0.52 0.00 0.00 37.83 35.12 2jza s LYS 9 CO 0.08 0.44 1.54 -0.11 -0.92 0.00 0.00 175.35 176.39 2jza n LEU 10 N 0.88 0.37 0.15 3.17 7.94 0.41 -2.25 117.00 127.68 2jza n LEU 10 Ca -0.04 0.61 0.13 0.00 -1.11 0.00 0.00 56.01 55.60 2jza n LEU 10 Cb 0.51 -0.58 0.30 0.00 0.53 0.00 0.00 43.42 44.18 2jza n LEU 10 CO 0.43 -0.52 0.85 -0.78 -1.11 0.00 0.00 177.39 176.26 2jza h ASP 11 N 0.00 0.00 -0.00 1.96 3.58 -1.92 -3.12 116.42 116.92 2jza h ASP 11 Ca 0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jza h ASP 11 Cb 0.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2jza h ASP 11 CO 0.00 0.00 -0.59 -0.67 -2.88 0.00 0.00 179.24 175.10 2jza n ASP 12 N -2.62 0.80 -4.70 2.28 2.03 -0.95 -4.96 116.55 108.43 2jza n ASP 12 Ca 0.05 -0.90 -0.42 0.00 0.52 0.00 0.00 54.79 54.03 2jza n ASP 12 Cb 0.47 0.91 -0.03 0.00 -0.72 0.00 0.00 41.12 41.75 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 -2.21 4.26 0.26 5.18 -1.09 -1.18 -4.99 121.20 121.43 2jza s ILE 13 Ca 0.06 1.60 -0.30 0.00 -2.23 0.00 0.00 60.65 59.79 2jza s ILE 13 Cb 0.11 -4.03 -0.09 0.00 -1.58 0.00 0.00 42.46 36.87 2jza s ILE 13 CO 0.53 0.04 1.25 -0.76 -1.23 0.00 0.00 174.94 174.78 2jza s LEU 14 N 1.80 4.45 -0.05 2.97 1.43 -1.26 -4.99 118.68 123.04 2jza s LEU 14 Ca 0.56 2.45 -0.30 0.00 -1.03 0.00 0.00 54.13 55.81 2jza s LEU 14 Cb -0.25 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.32 2jza s LEU 14 CO 0.24 -0.43 1.01 -2.84 0.23 0.00 0.00 176.35 174.57 2jza s PRO 15 N -0.95 4.48 0.00 1.29 0.02 -1.26 -3.72 135.00 134.86 2jza s PRO 15 Ca 0.51 1.44 0.00 0.00 0.02 0.00 0.00 61.00 62.97 2jza s PRO 15 Cb -0.36 -3.49 0.00 0.00 0.02 0.00 0.00 34.50 30.66 2jza s PRO 15 CO 0.43 -0.20 0.00 0.41 -0.33 0.00 0.00 177.00 177.32 2jza n GLY 16 N 3.02 0.67 3.55 0.52 0.00 0.34 -4.98 105.19 108.32 2jza n GLY 16 Ca 0.08 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 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 0.02 0.01 2.61 -4.23 -1.15 -4.92 115.64 105.98 2jza s THR 17 Ca 0.00 -1.14 0.05 0.00 -1.18 0.00 0.00 61.69 59.43 2jza s THR 17 Cb 0.00 -1.90 -0.02 0.00 1.34 0.00 0.00 72.50 71.92 2jza s THR 17 CO 0.00 -0.09 -0.17 -0.83 -0.54 0.00 0.00 174.62 173.00 2jza s GLY 18 N -2.95 0.85 -0.02 3.99 0.00 -1.23 0.45 107.32 108.41 2jza s GLY 18 Ca 0.16 -0.79 0.05 0.00 0.00 0.00 0.00 44.72 44.14 2jza s GLY 18 CO 0.03 -0.70 -0.16 -1.34 0.00 0.00 0.00 173.10 170.93 2jza s VAL 19 N -0.55 1.29 -0.65 1.40 -7.23 -0.93 -4.61 120.40 109.11 2jza s VAL 19 Ca 0.05 -0.69 -0.26 0.00 -1.81 0.00 0.00 61.98 59.27 2jza s VAL 19 Cb -0.07 -1.08 -0.02 0.00 0.56 0.00 0.00 36.38 35.77 2jza s VAL 19 CO 0.00 0.37 1.82 0.00 -0.31 0.00 0.00 175.10 176.98 2jza s ALA 21 N 8.89 3.36 -0.66 0.00 0.00 0.94 -4.82 121.76 129.48 2jza s ALA 21 Ca 0.65 0.17 -0.23 0.00 0.00 0.00 0.00 51.96 52.55 2jza s ALA 21 Cb -0.12 -2.95 0.06 0.00 0.00 0.00 0.00 23.12 20.12 2jza s ALA 21 CO 0.18 -0.02 1.00 -1.17 0.00 0.00 0.00 175.76 175.75 2jza s LEU 22 N 0.41 4.22 -0.23 0.00 1.98 -1.26 -1.61 118.68 122.19 2jza s LEU 22 Ca 0.37 -0.88 0.02 0.00 -2.89 0.00 0.00 54.13 50.76 2jza s LEU 22 Cb -0.19 -2.47 0.05 0.00 0.66 0.00 0.00 46.19 44.25 2jza s LEU 22 CO 0.20 -1.47 -0.13 -0.69 -1.89 0.00 0.00 176.35 172.37 2jza s VAL 23 N 4.26 2.05 -1.91 1.68 1.01 0.30 -4.68 120.40 123.11 2jza s VAL 23 Ca 0.24 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.83 2jza s VAL 23 Cb -0.15 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2jza s VAL 23 CO 0.11 0.12 0.00 -0.62 0.00 0.00 0.00 175.10 174.71 2jza n GLU 24 N 4.51 -1.36 -0.93 2.72 1.02 -1.26 -0.49 120.64 124.86 2jza n GLU 24 Ca -0.16 1.13 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 2jza n GLU 24 Cb 0.44 -5.45 0.00 0.00 -0.02 0.00 0.00 31.44 26.42 2jza n GLU 24 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2jza n GLN 25 N -2.26 0.00 -4.82 3.49 1.13 -1.26 -4.96 117.38 108.69 2jza n GLN 25 Ca -0.18 0.45 -0.33 0.00 -1.94 0.00 0.00 57.00 55.00 2jza n GLN 25 Cb 0.62 -3.68 -0.13 0.00 0.11 0.00 0.00 30.24 27.16 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 -1.80 2.72 -0.43 -1.09 2.00 0.36 -4.18 119.66 117.25 2jza s GLN 26 Ca 0.00 -0.67 -0.16 0.00 -2.00 0.00 0.00 55.36 52.54 2jza s GLN 26 Cb 0.00 -2.47 0.03 0.00 0.80 0.00 0.00 33.01 31.38 2jza s GLN 26 CO 0.00 0.55 0.35 -0.65 -0.50 0.00 0.00 175.29 175.04 2jza s GLN 27 N -0.53 3.00 -0.14 1.67 -0.21 -1.26 -0.54 119.66 121.66 2jza s GLN 27 Ca 0.07 -1.04 -0.02 0.00 0.02 0.00 0.00 55.36 54.39 2jza s GLN 27 Cb -0.12 -4.01 -0.02 0.00 1.00 0.00 0.00 33.01 29.86 2jza s GLN 27 CO 0.02 -0.84 -0.08 0.42 -2.12 0.00 0.00 175.29 172.68 2jza s ILE 28 N 1.77 3.48 -0.38 1.08 1.09 -0.63 -4.76 121.20 122.85 2jza s ILE 28 Ca 0.06 -0.51 -0.25 0.00 -1.10 0.00 0.00 60.65 58.85 2jza s ILE 28 Cb -0.20 -2.49 0.02 0.00 -1.06 0.00 0.00 42.46 38.73 2jza s ILE 28 CO 0.10 0.51 0.90 0.00 -0.10 0.00 0.00 174.94 176.36 2jza s ALA 29 N 0.29 3.38 -0.55 9.38 0.00 0.81 -0.04 121.76 135.04 2jza s ALA 29 Ca -0.07 -0.54 -0.18 0.00 0.00 0.00 0.00 51.96 51.17 2jza s ALA 29 Cb -0.15 -3.53 0.09 0.00 0.00 0.00 0.00 23.12 19.53 2jza s ALA 29 CO 0.04 -1.66 0.62 0.08 0.00 0.00 0.00 175.76 174.84 2jza s VAL 30 N 3.46 4.93 -0.02 0.00 1.01 0.39 -0.88 120.40 129.30 2jza s VAL 30 Ca 0.37 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 2jza s VAL 30 Cb -0.12 -4.37 -0.03 0.00 0.00 0.00 0.00 36.38 31.86 2jza s VAL 30 CO 0.20 -0.93 1.04 -0.36 0.00 0.00 0.00 175.10 175.04 2jza s PHE 31 N 2.43 3.56 -0.76 5.22 0.40 0.19 -2.18 117.98 126.83 2jza s PHE 31 Ca 0.11 1.58 -0.01 0.00 -0.60 0.00 0.00 56.93 58.01 2jza s PHE 31 Cb -0.23 -3.20 0.19 0.00 0.51 0.00 0.00 43.02 40.28 2jza s PHE 31 CO 0.08 -0.35 0.61 0.50 0.70 0.00 0.00 175.22 176.76 2jza s ARG 32 N 1.36 2.88 0.38 0.44 3.52 0.17 0.17 118.95 127.86 2jza s ARG 32 Ca 0.52 -3.01 0.10 0.00 -0.13 0.00 0.00 55.73 53.21 2jza s ARG 32 Cb -0.22 -3.79 0.75 0.00 -1.56 0.00 0.00 34.95 30.13 2jza s ARG 32 CO 0.25 -1.23 1.88 -1.35 -0.81 0.00 0.00 175.30 174.04 2jza h PRO 33 N 6.30 0.20 -6.14 5.12 0.11 -1.81 0.99 132.00 136.76 2jza h PRO 33 Ca 0.09 -0.05 -0.53 0.00 0.11 0.00 0.00 66.00 65.62 2jza h PRO 33 Cb 0.86 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 31.88 2jza h PRO 33 CO 0.78 0.40 -0.51 1.03 -0.21 0.00 0.00 178.00 179.48 2jza s ARG 34 N -4.59 2.53 -0.00 1.05 0.52 -1.26 -4.25 118.95 112.95 2jza s ARG 34 Ca -0.05 -1.42 0.13 0.00 -0.52 0.00 0.00 55.73 53.87 2jza s ARG 34 Cb 0.15 -2.31 0.39 0.00 0.52 0.00 0.00 34.95 33.70 2jza s ARG 34 CO 0.73 0.14 1.32 -1.71 0.02 0.00 0.00 175.30 175.80 2jza n ASN 35 N -1.22 2.36 0.00 0.23 5.15 -1.26 -4.33 115.26 116.20 2jza n ASN 35 Ca -0.03 -2.02 0.00 0.00 -0.60 0.00 0.00 54.58 51.93 2jza n ASN 35 Cb 0.60 -0.30 0.00 0.00 -0.53 0.00 0.00 39.78 39.55 2jza n ASN 35 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2jza n ASP 36 N 0.76 0.00 0.01 1.20 9.92 -1.26 -5.05 116.55 122.13 2jza n ASP 36 Ca 0.15 0.00 -0.00 0.00 -0.53 0.00 0.00 54.79 54.40 2jza n ASP 36 Cb 0.38 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 40.86 2jza n ASP 36 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2jza n GLU 37 N 0.00 0.03 -1.74 -1.24 2.13 -1.26 -5.04 120.64 113.52 2jza n GLU 37 Ca 0.00 0.01 -0.42 0.00 0.66 0.00 0.00 57.16 57.41 2jza n GLU 37 Cb 0.00 -0.26 -0.03 0.00 0.27 0.00 0.00 31.44 31.42 2jza n GLU 37 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2jza s GLN 38 N -1.34 4.12 0.35 5.31 -1.52 -1.26 -4.97 119.66 120.35 2jza s GLN 38 Ca -0.02 2.61 0.05 0.00 -1.95 0.00 0.00 55.36 56.06 2jza s GLN 38 Cb 0.00 -3.06 -0.07 0.00 -0.22 0.00 0.00 33.01 29.66 2jza s GLN 38 CO 0.02 -0.73 0.02 0.14 -0.25 0.00 0.00 175.29 174.50 2jza s VAL 39 N 0.89 1.56 -0.24 1.09 -7.23 -1.26 -4.46 120.40 110.74 2jza s VAL 39 Ca 0.72 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.83 2jza s VAL 39 Cb -0.49 -2.82 0.08 0.00 0.56 0.00 0.00 36.38 33.71 2jza s VAL 39 CO 0.36 -0.04 0.10 -0.31 -0.31 0.00 0.00 175.10 174.89 2jza s TYR 40 N -3.04 0.62 -0.45 2.82 2.02 0.13 -4.78 117.35 114.68 2jza s TYR 40 Ca 0.35 -0.86 -0.17 0.00 -0.37 0.00 0.00 57.07 56.02 2jza s TYR 40 Cb 0.08 -0.99 0.04 0.00 -0.40 0.00 0.00 41.96 40.69 2jza s TYR 40 CO 0.16 -0.71 0.45 0.00 -1.57 0.00 0.00 175.55 173.88 2jza s ALA 41 N 1.99 3.45 0.19 3.71 0.00 -1.26 0.55 121.76 130.40 2jza s ALA 41 Ca 0.06 -1.69 0.06 0.00 0.00 0.00 0.00 51.96 50.39 2jza s ALA 41 Cb -0.16 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 2jza s ALA 41 CO -0.23 -1.68 -0.09 0.96 0.00 0.00 0.00 175.76 174.72 2jza s ILE 42 N 2.10 1.37 -1.17 0.00 -4.36 -0.06 -3.81 121.20 115.28 2jza s ILE 42 Ca 0.11 -2.11 -0.20 0.00 -0.26 0.00 0.00 60.65 58.19 2jza s ILE 42 Cb -0.19 -2.06 -0.04 0.00 1.25 0.00 0.00 42.46 41.42 2jza s ILE 42 CO 0.12 -0.58 1.93 -1.20 0.24 0.00 0.00 174.94 175.45 2jza n SER 43 N -0.33 3.59 -3.81 4.36 7.64 -0.21 -0.13 113.62 124.72 2jza n SER 43 Ca -0.08 -2.78 -0.35 0.00 1.01 0.00 0.00 58.87 56.67 2jza n SER 43 Cb 0.61 -1.58 -0.04 0.00 -1.01 0.00 0.00 64.21 62.19 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 9.59 4.83 -4.07 6.43 2.85 -1.26 -3.81 115.26 129.82 2jza n ASN 44 Ca 0.48 -3.35 -0.25 0.00 -0.11 0.00 0.00 54.58 51.35 2jza n ASN 44 Cb 0.44 -0.98 -0.16 0.00 1.24 0.00 0.00 39.78 40.31 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 -2.31 1.24 -0.15 -1.44 -1.09 -1.26 -4.50 121.20 111.68 2jza s ILE 45 Ca 0.34 -0.58 -0.22 0.00 -2.23 0.00 0.00 60.65 57.96 2jza s ILE 45 Cb 0.06 -1.09 -0.03 0.00 -1.58 0.00 0.00 42.46 39.82 2jza s ILE 45 CO -0.00 0.37 0.66 -0.62 -1.23 0.00 0.00 174.94 174.12 2jza s ASP 46 N 0.31 6.80 0.07 3.58 -1.08 -1.19 -4.94 116.67 120.23 2jza s ASP 46 Ca -0.08 0.97 0.09 0.00 -0.52 0.00 0.00 52.55 53.02 2jza s ASP 46 Cb -0.13 -2.37 0.44 0.00 -1.46 0.00 0.00 42.92 39.39 2jza s ASP 46 CO 0.03 -0.23 1.30 -0.81 0.52 0.00 0.00 175.17 175.98 2jza n PRO 47 N 4.62 0.04 0.08 4.34 -0.04 -1.26 0.16 135.00 142.94 2jza n PRO 47 Ca -0.01 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 2jza n PRO 47 Cb 0.50 -1.60 0.15 0.00 -0.04 0.00 0.00 33.50 32.52 2jza n PRO 47 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2jza h PHE 48 N 0.00 0.00 0.00 0.54 3.57 -1.98 -3.40 116.94 115.68 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 0.11 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.85 2jza h PHE 48 CO 0.00 0.00 -0.58 0.00 -2.23 0.00 0.00 178.31 175.50 2jza n ALA 49 N -1.91 1.44 -2.92 2.41 0.00 -0.41 -5.03 120.51 114.08 2jza n ALA 49 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.26 2jza n ALA 49 Cb 0.47 0.10 0.03 0.00 0.00 0.00 0.00 19.45 20.04 2jza n ALA 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jza n GLN 50 N -1.20 -4.38 -4.13 0.00 3.00 0.12 -4.99 117.38 105.81 2jza n GLN 50 Ca 0.00 0.86 -0.11 0.00 -0.01 0.00 0.00 57.00 57.74 2jza n GLN 50 Cb 0.19 -5.57 -0.08 0.00 0.00 0.00 0.00 30.24 24.77 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 -3.13 0.69 -0.20 -1.58 0.00 -1.26 -4.97 121.76 111.31 2jza s ALA 51 Ca 0.26 -1.42 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 2jza s ALA 51 Cb -0.12 1.27 -0.23 0.00 0.00 0.00 0.00 23.12 24.05 2jza s ALA 51 CO 0.33 -0.67 3.50 -1.13 0.00 0.00 0.00 175.76 177.78 2jza n SER 52 N -0.30 5.70 0.23 0.00 3.41 -1.26 -3.13 113.62 118.26 2jza n SER 52 Ca 0.01 -2.54 0.15 0.00 -0.26 0.00 0.00 58.87 56.22 2jza n SER 52 Cb 0.65 -1.42 0.49 0.00 -0.26 0.00 0.00 64.21 63.67 2jza n SER 52 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2jza h VAL 53 N 2.11 0.00 0.00 -3.33 -1.51 -1.90 -1.55 116.25 110.07 2jza h VAL 53 Ca 0.28 -0.60 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2jza h VAL 53 Cb 1.33 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 32.06 2jza h VAL 53 CO 0.44 0.00 -0.32 -0.07 -1.23 0.00 0.00 177.57 176.39 2jza h LEU 54 N 0.00 0.00 0.00 4.19 3.38 -1.81 -3.31 115.31 117.76 2jza h LEU 54 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2jza h LEU 54 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2jza h LEU 54 CO 0.00 0.03 -0.66 -1.20 0.09 0.00 0.00 178.44 176.70 2jza n SER 55 N -2.52 0.61 -1.84 -0.43 7.64 -0.59 -3.92 113.62 112.57 2jza n SER 55 Ca 0.04 -0.06 -0.17 0.00 1.01 0.00 0.00 58.87 59.68 2jza n SER 55 Cb 0.48 0.31 0.18 0.00 -1.01 0.00 0.00 64.21 64.17 2jza n SER 55 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jza n ARG 56 N -1.88 2.11 0.00 1.43 1.74 -1.17 -3.50 116.66 115.39 2jza n ARG 56 Ca 0.04 -3.10 0.00 0.00 -0.77 0.00 0.00 57.85 54.02 2jza n ARG 56 Cb 0.40 -2.05 0.00 0.00 -1.02 0.00 0.00 32.46 29.79 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jza n GLY 57 N -1.13 0.61 3.34 -0.13 0.00 -1.25 -4.76 105.19 101.87 2jza n GLY 57 Ca 0.50 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.11 2jza n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jza s ILE 58 N 2.88 4.53 -0.40 -0.61 1.01 0.84 -4.88 121.20 124.56 2jza s ILE 58 Ca 0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 60.65 59.48 2jza s ILE 58 Cb 0.00 -3.62 0.04 0.00 0.01 0.00 0.00 42.46 38.89 2jza s ILE 58 CO 0.00 -0.35 0.26 0.54 0.00 0.00 0.00 174.94 175.39 2jza s VAL 59 N 1.52 4.74 0.17 2.92 0.11 -1.26 0.14 120.40 128.74 2jza s VAL 59 Ca 0.02 -0.95 -0.08 0.00 -2.93 0.00 0.00 61.98 58.05 2jza s VAL 59 Cb -0.21 -3.71 -0.01 0.00 -1.53 0.00 0.00 36.38 30.92 2jza s VAL 59 CO 0.05 -0.35 0.27 0.00 -3.33 0.00 0.00 175.10 171.75 2jza s ALA 60 N 1.57 0.13 -0.25 1.54 0.00 -0.40 -4.99 121.76 119.35 2jza s ALA 60 Ca 0.03 -0.99 -0.17 0.00 0.00 0.00 0.00 51.96 50.83 2jza s ALA 60 Cb -0.20 0.92 -0.03 0.00 0.00 0.00 0.00 23.12 23.80 2jza s ALA 60 CO 0.07 -0.65 0.48 -2.00 0.00 0.00 0.00 175.76 173.66 2jza s GLU 61 N -3.99 4.08 0.00 0.00 2.12 -1.26 -0.88 118.70 118.77 2jza s GLU 61 Ca 0.20 0.28 0.00 0.00 0.36 0.00 0.00 54.97 55.81 2jza s GLU 61 Cb 0.03 -3.63 0.00 0.00 0.26 0.00 0.00 34.13 30.79 2jza s GLU 61 CO 0.02 -0.29 0.58 1.58 -0.54 0.00 0.00 175.26 176.60 2jza n HIS 62 N 5.33 0.00 0.00 5.30 -0.00 -0.20 -4.85 115.22 120.80 2jza n HIS 62 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.67 2jza n HIS 62 Cb 0.50 -0.16 0.00 0.00 -0.00 0.00 0.00 29.99 30.33 2jza n HIS 62 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2jza n GLN 63 N -0.97 0.00 0.00 1.57 1.13 -1.26 -4.93 117.38 112.92 2jza n GLN 63 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2jza n GLN 63 Cb 0.00 -0.48 0.00 0.00 0.11 0.00 0.00 30.24 29.87 2jza n GLN 63 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2jza n ASP 64 N -2.34 1.91 -4.87 1.08 9.92 -1.26 -5.11 116.55 115.89 2jza n ASP 64 Ca 0.00 0.00 -0.25 0.00 -0.53 0.00 0.00 54.79 54.01 2jza n ASP 64 Cb 0.23 0.35 -0.02 0.00 -0.64 0.00 0.00 41.12 41.04 2jza n ASP 64 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2jza s ASP 65 N -0.91 4.68 -0.16 -2.24 -1.08 -1.26 -5.10 116.67 110.61 2jza s ASP 65 Ca 0.00 -1.11 0.00 0.00 -0.52 0.00 0.00 52.55 50.92 2jza s ASP 65 Cb 0.00 0.04 0.00 0.00 -1.46 0.00 0.00 42.92 41.50 2jza s ASP 65 CO 0.00 -0.91 -0.16 -0.76 0.52 0.00 0.00 175.17 173.87 2jza s LEU 66 N -4.18 2.44 0.03 -1.34 1.43 -1.26 -1.03 118.68 114.76 2jza s LEU 66 Ca 0.38 -0.49 0.07 0.00 -1.03 0.00 0.00 54.13 53.06 2jza s LEU 66 Cb -0.01 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 2jza s LEU 66 CO 0.23 0.07 -0.21 0.26 0.23 0.00 0.00 176.35 176.93 2jza s TRP 67 N 0.90 1.81 -0.22 0.29 0.52 -0.06 -0.94 118.94 121.24 2jza s TRP 67 Ca -0.04 -0.37 -0.01 0.00 0.02 0.00 0.00 56.10 55.71 2jza s TRP 67 Cb -0.15 -1.10 0.02 0.00 -1.15 0.00 0.00 33.47 31.09 2jza s TRP 67 CO -0.02 0.06 -0.11 0.54 0.02 0.00 0.00 176.95 177.45 2jza s VAL 68 N -0.73 2.66 -0.33 4.03 0.11 0.46 -1.28 120.40 125.33 2jza s VAL 68 Ca 0.07 -0.93 -0.20 0.00 -2.93 0.00 0.00 61.98 58.00 2jza s VAL 68 Cb -0.09 -2.26 -0.00 0.00 -1.53 0.00 0.00 36.38 32.50 2jza s VAL 68 CO 0.01 0.34 0.63 0.00 -3.33 0.00 0.00 175.10 172.75 2jza s ALA 69 N 1.33 3.50 0.32 1.54 0.00 0.12 -0.19 121.76 128.38 2jza s ALA 69 Ca 0.02 -0.74 -0.29 0.00 0.00 0.00 0.00 51.96 50.95 2jza s ALA 69 Cb -0.15 -3.12 -0.11 0.00 0.00 0.00 0.00 23.12 19.73 2jza s ALA 69 CO -0.07 -1.18 1.58 -1.54 0.00 0.00 0.00 175.76 174.54 2jza s SER 70 N 1.71 6.34 0.39 0.00 1.04 -0.72 -0.11 113.70 122.34 2jza s SER 70 Ca 0.25 3.01 0.10 0.00 0.48 0.00 0.00 55.95 59.79 2jza s SER 70 Cb -0.15 -2.65 0.78 0.00 0.10 0.00 0.00 66.02 64.10 2jza s SER 70 CO 0.13 -0.92 1.90 1.55 0.98 0.00 0.00 173.24 176.87 2jza h PRO 71 N 4.28 0.17 0.00 4.02 0.13 -1.86 -0.11 132.00 138.63 2jza h PRO 71 Ca -0.48 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 64.51 2jza h PRO 71 Cb 1.23 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2jza h PRO 71 CO 0.75 0.37 -0.96 1.28 -0.23 0.00 0.00 178.00 179.20 2jza n LEU 72 N -4.24 1.86 0.04 1.56 4.77 -1.26 -4.57 117.00 115.16 2jza n LEU 72 Ca -0.01 0.50 0.12 0.00 -0.03 0.00 0.00 56.01 56.59 2jza n LEU 72 Cb 0.30 -0.86 0.13 0.00 -2.33 0.00 0.00 43.42 40.65 2jza n LEU 72 CO 0.38 -0.17 0.23 0.29 -1.33 0.00 0.00 177.39 176.80 2jza n LYS 73 N -4.51 0.23 -0.94 3.23 5.02 -1.25 -4.94 118.16 115.00 2jza n LYS 73 Ca -0.19 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 2jza n LYS 73 Cb 0.46 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 2jza n LYS 73 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jza n LYS 74 N -1.93 -1.37 -1.98 1.97 5.02 -0.06 -4.94 118.16 114.88 2jza n LYS 74 Ca 0.03 0.34 -0.42 0.00 -2.02 0.00 0.00 58.31 56.24 2jza n LYS 74 Cb 0.42 -4.53 -0.03 0.00 -0.02 0.00 0.00 35.03 30.87 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 -1.48 4.22 -0.65 1.97 -0.21 -1.26 -4.53 119.66 117.73 2jza s GLN 75 Ca 0.00 2.29 -0.21 0.00 0.02 0.00 0.00 55.36 57.46 2jza s GLN 75 Cb 0.00 -3.42 0.09 0.00 1.00 0.00 0.00 33.01 30.68 2jza s GLN 75 CO 0.00 -0.65 0.87 -1.01 -2.12 0.00 0.00 175.29 172.38 2jza s HIS 76 N 1.99 2.83 -0.23 0.91 3.76 -1.26 -1.75 115.29 121.54 2jza s HIS 76 Ca 0.71 -0.76 -0.25 0.00 -0.15 0.00 0.00 55.06 54.61 2jza s HIS 76 Cb -0.40 -4.18 -0.01 0.00 1.11 0.00 0.00 32.58 29.10 2jza s HIS 76 CO 0.31 -1.50 0.84 -0.06 -0.85 0.00 0.00 174.74 173.48 2jza s PHE 77 N 3.43 3.32 -0.18 1.40 0.08 0.73 -1.43 117.98 125.33 2jza s PHE 77 Ca 0.18 1.16 -0.29 0.00 0.12 0.00 0.00 56.93 58.10 2jza s PHE 77 Cb -0.19 -3.05 -0.00 0.00 -0.57 0.00 0.00 43.02 39.20 2jza s PHE 77 CO 0.07 -0.38 1.09 0.50 -0.10 0.00 0.00 175.22 176.40 2jza s ARG 78 N 2.77 4.29 0.23 0.44 3.52 -0.52 -0.40 118.95 129.28 2jza s ARG 78 Ca 0.36 1.45 -0.02 0.00 -0.13 0.00 0.00 55.73 57.39 2jza s ARG 78 Cb -0.15 -3.64 0.23 0.00 -1.56 0.00 0.00 34.95 29.83 2jza s ARG 78 CO 0.08 -0.58 1.62 -0.07 -0.81 0.00 0.00 175.30 175.54 2jza h LEU 79 N 9.18 0.64 0.00 -0.88 3.38 -1.38 -1.29 115.31 124.95 2jza h LEU 79 Ca -0.24 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 2jza h LEU 79 Cb 1.09 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 2jza h LEU 79 CO 0.95 0.92 -0.04 0.22 0.09 0.00 0.00 178.44 180.58 2jza h TYR 80 N 0.52 0.00 0.00 1.13 3.20 -1.92 -3.43 116.97 116.48 2jza h TYR 80 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2jza h TYR 80 Cb 0.82 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.09 2jza h TYR 80 CO 0.03 0.01 0.00 -3.47 -1.64 0.00 0.00 178.16 173.09 2jza n ASP 81 N -3.09 0.00 0.00 -2.11 -0.08 -1.10 -5.01 116.55 105.16 2jza n ASP 81 Ca 0.04 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.32 2jza n ASP 81 Cb 0.53 -0.07 0.00 0.00 2.34 0.00 0.00 41.12 43.93 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jza n GLY 82 N 3.30 1.34 3.74 0.27 0.00 -0.51 -4.55 105.19 108.78 2jza n GLY 82 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 2.21 -0.78 1.61 0.08 -1.26 -2.04 117.98 117.79 2jza s PHE 83 Ca 0.00 1.54 -0.01 0.00 0.12 0.00 0.00 56.93 58.58 2jza s PHE 83 Cb 0.00 -3.51 0.36 0.00 -0.57 0.00 0.00 43.02 39.30 2jza s PHE 83 CO 0.00 -2.50 1.87 0.00 -0.10 0.00 0.00 175.22 174.50 2jza n LEU 85 N -0.53 0.00 -0.28 0.00 7.94 -0.51 -1.34 117.00 122.28 2jza n LEU 85 Ca 0.51 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.47 2jza n LEU 85 Cb 0.30 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.25 2jza n LEU 85 CO 0.48 0.00 0.24 -0.62 -1.11 0.00 0.00 177.39 176.38 2jza n GLU 86 N 0.00 1.90 -4.37 1.96 1.02 -1.26 -4.99 120.64 114.90 2jza n GLU 86 Ca 0.00 -0.70 -0.23 0.00 -0.02 0.00 0.00 57.16 56.21 2jza n GLU 86 Cb 0.00 -1.16 -0.08 0.00 -0.02 0.00 0.00 31.44 30.18 2jza n GLU 86 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2jza s ASP 87 N -1.55 4.16 0.00 1.62 1.11 -0.45 -5.04 116.67 116.53 2jza s ASP 87 Ca 0.10 -0.80 0.20 0.00 0.18 0.00 0.00 52.55 52.23 2jza s ASP 87 Cb 0.10 -0.63 0.32 0.00 1.07 0.00 0.00 42.92 43.79 2jza s ASP 87 CO 0.31 0.02 1.13 0.61 1.18 0.00 0.00 175.17 178.41 2jza n GLY 88 N -0.79 0.88 0.16 0.21 0.00 -1.26 -0.78 105.19 103.61 2jza n GLY 88 Ca -0.06 -0.64 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 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 0.75 0.06 -2.15 4.61 0.00 -1.96 -3.36 119.26 117.21 2jza h ALA 89 Ca -0.18 -0.66 -0.62 0.00 0.00 0.00 0.00 54.91 53.45 2jza h ALA 89 Cb 1.77 0.06 -0.40 0.00 0.00 0.00 0.00 17.79 19.23 2jza h ALA 89 CO 0.07 0.51 -0.41 0.66 0.00 0.00 0.00 179.25 180.08 2jza n TYR 90 N -4.03 3.79 -1.88 0.00 4.01 -1.26 -5.03 117.16 112.77 2jza n TYR 90 Ca -0.12 -3.84 -0.41 0.00 -0.16 0.00 0.00 57.90 53.37 2jza n TYR 90 Cb 0.81 -0.60 -0.03 0.00 -0.31 0.00 0.00 39.34 39.21 2jza n TYR 90 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2jza s SER 91 N -3.00 5.54 0.26 7.72 1.04 -1.26 -4.80 113.70 119.21 2jza s SER 91 Ca 0.46 1.24 -0.30 0.00 0.48 0.00 0.00 55.95 57.83 2jza s SER 91 Cb 0.24 -2.52 -0.10 0.00 0.10 0.00 0.00 66.02 63.74 2jza s SER 91 CO -0.10 -2.00 1.33 0.68 0.98 0.00 0.00 173.24 174.12 2jza s VAL 92 N 8.12 2.93 -0.47 5.02 -7.23 -0.87 -4.93 120.40 122.98 2jza s VAL 92 Ca 0.84 0.83 -0.28 0.00 -1.81 0.00 0.00 61.98 61.56 2jza s VAL 92 Cb -0.22 -3.53 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 2jza s VAL 92 CO 0.31 0.16 1.66 0.00 -0.31 0.00 0.00 175.10 176.91 2jza s ALA 93 N -0.42 2.72 -1.06 1.32 0.00 -1.25 -4.46 121.76 118.61 2jza s ALA 93 Ca 0.54 -0.25 -0.22 0.00 0.00 0.00 0.00 51.96 52.03 2jza s ALA 93 Cb -0.39 -4.09 0.05 0.00 0.00 0.00 0.00 23.12 18.69 2jza s ALA 93 CO 0.44 -2.96 1.53 0.00 0.00 0.00 0.00 175.76 174.77 2jza s ALA 94 N 6.97 2.74 0.92 0.00 0.00 -1.26 -1.05 121.76 130.08 2jza s ALA 94 Ca 0.67 -2.32 -0.15 0.00 0.00 0.00 0.00 51.96 50.16 2jza s ALA 94 Cb -0.16 -4.55 0.17 0.00 0.00 0.00 0.00 23.12 18.58 2jza s ALA 94 CO 0.28 -3.66 1.28 0.71 0.00 0.00 0.00 175.76 174.38 2jza s TYR 95 N 5.24 1.95 0.07 0.00 2.02 -1.25 -5.04 117.35 120.33 2jza s TYR 95 Ca 0.49 0.42 0.07 0.00 -0.37 0.00 0.00 57.07 57.68 2jza s TYR 95 Cb 0.00 -3.95 -0.04 0.00 -0.40 0.00 0.00 41.96 37.58 2jza s TYR 95 CO -0.06 -2.41 -0.14 0.34 -1.57 0.00 0.00 175.55 171.71 2jza s ASP 96 N -4.81 4.13 0.15 2.29 2.15 -1.26 -4.72 116.67 114.61 2jza s ASP 96 Ca 0.71 -0.39 0.06 0.00 0.43 0.00 0.00 52.55 53.36 2jza s ASP 96 Cb -0.06 -0.75 -0.04 0.00 -0.30 0.00 0.00 42.92 41.78 2jza s ASP 96 CO 0.52 0.22 -0.13 -0.89 -0.17 0.00 0.00 175.17 174.72 2jza s THR 97 N -1.06 1.42 -0.13 1.71 2.01 -1.26 -1.48 115.64 116.84 2jza s THR 97 Ca 0.18 -1.92 -0.18 0.00 0.31 0.00 0.00 61.69 60.07 2jza s THR 97 Cb -0.11 -1.74 0.04 0.00 0.01 0.00 0.00 72.50 70.71 2jza s THR 97 CO 0.09 -0.53 0.47 0.00 -0.69 0.00 0.00 174.62 173.96 2jza s GLN 98 N -3.15 0.64 -0.50 4.92 -2.07 0.33 -4.98 119.66 114.84 2jza s GLN 98 Ca 0.14 0.44 -0.08 0.00 -1.82 0.00 0.00 55.36 54.04 2jza s GLN 98 Cb -0.02 0.30 0.13 0.00 -1.09 0.00 0.00 33.01 32.33 2jza s GLN 98 CO 0.03 -0.12 0.37 0.08 -1.32 0.00 0.00 175.29 174.33 2jza s VAL 99 N -0.25 4.12 -0.14 3.63 1.01 -1.26 -0.64 120.40 126.88 2jza s VAL 99 Ca -0.04 -2.00 0.07 0.00 0.00 0.00 0.00 61.98 60.00 2jza s VAL 99 Cb -0.03 -3.71 -0.23 0.00 0.00 0.00 0.00 36.38 32.40 2jza s VAL 99 CO 0.03 -0.79 0.28 1.07 0.00 0.00 0.00 175.10 175.68 2jza n THR 100 N 4.64 1.58 -2.42 3.92 5.66 -1.15 -4.52 114.28 121.99 2jza n THR 100 Ca -0.04 -0.73 0.03 0.00 -3.05 0.00 0.00 64.05 60.26 2jza n THR 100 Cb 0.41 -1.17 0.05 0.00 -1.55 0.00 0.00 70.33 68.07 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 -3.14 1.26 0.00 1.09 3.02 -1.26 -4.91 115.26 111.32 2jza n ASN 101 Ca -0.30 -2.29 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 2jza n ASN 101 Cb 1.06 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.88 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 0.12 1.88 3.87 7.41 0.00 -1.26 -5.03 105.19 112.18 2jza n GLY 102 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.65 6.07 -0.27 1.61 2.20 -1.26 -0.44 114.94 120.20 2jza s ASN 103 Ca 0.00 0.16 -0.14 0.00 -0.94 0.00 0.00 52.86 51.94 2jza s ASN 103 Cb 0.00 -1.79 -0.04 0.00 -2.00 0.00 0.00 41.25 37.42 2jza s ASN 103 CO 0.00 0.16 0.31 -0.69 -2.94 0.00 0.00 177.10 173.94 2jza s VAL 104 N -1.50 5.22 -0.01 3.54 1.01 0.16 -2.93 120.40 125.89 2jza s VAL 104 Ca 0.33 0.44 0.06 0.00 0.00 0.00 0.00 61.98 62.81 2jza s VAL 104 Cb -0.12 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2jza s VAL 104 CO 0.26 0.19 -0.17 -1.10 0.00 0.00 0.00 175.10 174.29 2jza s GLN 105 N 1.92 2.27 0.18 2.72 -0.21 0.19 0.07 119.66 126.80 2jza s GLN 105 Ca 0.12 -0.85 0.10 0.00 0.02 0.00 0.00 55.36 54.76 2jza s GLN 105 Cb -0.16 -2.26 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 2jza s GLN 105 CO 0.10 0.58 -0.22 0.96 -2.12 0.00 0.00 175.29 174.59 2jza s ILE 106 N -0.81 2.12 -0.39 1.08 -5.25 -0.77 -0.51 121.20 116.67 2jza s ILE 106 Ca 0.13 -1.97 -0.03 0.00 -0.99 0.00 0.00 60.65 57.79 2jza s ILE 106 Cb -0.10 -2.00 0.10 0.00 2.95 0.00 0.00 42.46 43.41 2jza s ILE 106 CO 0.03 -0.19 0.16 -0.55 -1.79 0.00 0.00 174.94 172.60 2jza s SER 107 N -2.65 5.19 -0.33 4.36 0.15 -0.55 -0.96 113.70 118.91 2jza s SER 107 Ca 0.18 -1.88 -0.07 0.00 0.70 0.00 0.00 55.95 54.89 2jza s SER 107 Cb -0.07 -1.81 0.03 0.00 -1.71 0.00 0.00 66.02 62.46 2jza s SER 107 CO 0.08 -0.49 0.10 0.27 1.20 0.00 0.00 173.24 174.41 2jza s ILE 108 N 1.16 3.86 -1.47 6.45 -4.36 -1.26 -4.13 121.20 121.46 2jza s ILE 108 Ca 0.06 -1.03 0.17 0.00 -0.26 0.00 0.00 60.65 59.58 2jza s ILE 108 Cb -0.22 -3.14 0.59 0.00 1.25 0.00 0.00 42.46 40.93 2jza s ILE 108 CO -0.03 -0.13 1.48 0.00 0.24 0.00 0.00 174.94 176.50 2jza n ALA 109 N 4.83 2.82 -3.54 2.27 0.00 -1.26 -4.85 120.51 120.77 2jza n ALA 109 Ca -0.13 -1.25 -0.11 0.00 0.00 0.00 0.00 53.44 51.95 2jza n ALA 109 Cb 0.45 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.88 -0.56 -0.16 0.00 -1.08 -1.26 -5.04 116.67 107.69 2jza s ASP 110 Ca 0.43 0.99 0.17 0.00 -0.52 0.00 0.00 52.55 53.61 2jza s ASP 110 Cb 0.26 0.93 0.46 0.00 -1.46 0.00 0.00 42.92 43.11 2jza s ASP 110 CO 0.23 -0.19 1.35 -1.20 0.52 0.00 0.00 175.17 175.89 2jza n SER 111 N 3.63 3.50 0.00 -0.34 7.64 -1.26 -5.03 113.62 121.76 2jza n SER 111 Ca -0.19 -2.98 0.00 0.00 1.01 0.00 0.00 58.87 56.72 2jza n SER 111 Cb 0.56 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 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 -0.66 0.00 -3.68 6.43 2.03 -1.26 -3.74 116.55 115.67 2jza n ASP 112 Ca 0.20 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.30 2jza n ASP 112 Cb 0.81 0.00 -0.18 0.00 -0.72 0.00 0.00 41.12 41.03 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 0.00 -0.04 -0.05 5.18 1.01 -1.26 -5.12 120.40 120.11 2jza s VAL 113 Ca 0.00 0.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 2jza s VAL 113 Cb 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2jza s VAL 113 CO 0.00 0.18 1.37 0.00 0.00 0.00 0.00 175.10 176.65 2jza s ALA 114 N 2.14 3.59 -0.07 5.51 0.00 -1.25 -4.97 121.76 126.71 2jza s ALA 114 Ca 0.05 0.75 -0.03 0.00 0.00 0.00 0.00 51.96 52.73 2jza s ALA 114 Cb -0.12 -3.61 0.04 0.00 0.00 0.00 0.00 23.12 19.44 2jza s ALA 114 CO -0.03 -1.00 0.14 0.54 0.00 0.00 0.00 175.76 175.41 2jza s VAL 115 N 2.81 -0.17 -0.08 0.00 0.11 -1.26 -5.14 120.40 116.68 2jza s VAL 115 Ca 0.62 0.29 -0.21 0.00 -2.93 0.00 0.00 61.98 59.75 2jza s VAL 115 Cb -0.28 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 2jza s VAL 115 CO 0.23 0.12 0.59 -0.62 -3.33 0.00 0.00 175.10 172.10 2jza s ASP 116 N 1.82 6.86 -0.03 3.54 -1.08 -1.26 -4.84 116.67 121.68 2jza s ASP 116 Ca -0.02 1.03 0.04 0.00 -0.52 0.00 0.00 52.55 53.09 2jza s ASP 116 Cb -0.12 -2.35 -0.01 0.00 -1.46 0.00 0.00 42.92 38.98 2jza s ASP 116 CO -0.06 -0.04 -0.16 0.54 0.52 0.00 0.00 175.17 175.98 2jza s ASN 117 N 0.58 1.98 -0.01 -0.34 2.20 -1.26 -5.05 114.94 113.05 2jza s ASN 117 Ca 0.32 -0.32 0.18 0.00 -0.94 0.00 0.00 52.86 52.10 2jza s ASN 117 Cb -0.17 -0.45 -0.22 0.00 -2.00 0.00 0.00 41.25 38.42 2jza s ASN 117 CO 0.15 0.16 0.66 -1.20 -2.94 0.00 0.00 177.10 173.93 2jza n SER 118 N 3.02 0.83 -4.61 3.54 7.64 -1.26 -4.93 113.62 117.85 2jza n SER 118 Ca -0.17 -0.68 -0.42 0.00 1.01 0.00 0.00 58.87 58.61 2jza n SER 118 Cb 0.53 1.22 -0.05 0.00 -1.01 0.00 0.00 64.21 64.90 2jza n SER 118 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2jza s GLN 119 N -2.83 3.96 0.72 1.43 -0.21 -1.26 -5.05 119.66 116.41 2jza s GLN 119 Ca 0.03 0.55 0.01 0.00 0.02 0.00 0.00 55.36 55.97 2jza s GLN 119 Cb 0.13 -3.73 0.13 0.00 1.00 0.00 0.00 33.01 30.55 2jza s GLN 119 CO 0.74 -0.66 0.99 -1.25 -2.12 0.00 0.00 175.29 172.98 2jza s PRO 120 N 2.90 1.67 -0.27 2.91 0.04 -1.26 -5.11 135.00 135.88 2jza s PRO 120 Ca 0.31 -1.26 0.02 0.00 0.04 0.00 0.00 61.00 60.11 2jza s PRO 120 Cb -0.14 -2.37 0.07 0.00 0.04 0.00 0.00 34.50 32.10 2jza s PRO 120 CO 0.12 -1.44 -0.02 -0.51 0.04 0.00 0.00 177.00 175.20 2jza s LEU 121 N -5.11 3.14 0.00 -3.56 1.43 -1.26 -5.12 118.68 108.21 2jza s LEU 121 Ca 0.67 -1.50 -0.00 0.00 -1.03 0.00 0.00 54.13 52.27 2jza s LEU 121 Cb -0.05 -1.29 0.01 0.00 0.03 0.00 0.00 46.19 44.90 2jza s LEU 121 CO 0.44 -0.29 0.10 -0.81 0.23 0.00 0.00 176.35 176.02 2jza n PRO 122 N 4.57 0.50 -4.02 1.29 -0.04 -1.26 -5.15 135.00 130.89 2jza n PRO 122 Ca -0.07 -0.25 -0.10 0.00 -0.04 0.00 0.00 63.50 63.04 2jza n PRO 122 Cb 0.43 -0.07 -0.08 0.00 -0.04 0.00 0.00 33.50 33.74 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 0.00 1.14 -0.23 1.53 0.05 -1.26 -5.15 118.68 114.77 2jza s LEU 123 Ca 0.06 -0.98 -0.13 0.00 0.05 0.00 0.00 54.13 53.13 2jza s LEU 123 Cb -0.00 0.96 -0.04 0.00 -2.05 0.00 0.00 46.19 45.05 2jza s LEU 123 CO 0.04 -0.86 0.27 -1.83 -0.55 0.00 0.00 176.35 173.42 2jza s GLU 124 N -4.00 4.11 -0.13 1.48 1.03 -1.26 -5.07 118.70 114.86 2jza s GLU 124 Ca 0.20 -0.06 -0.01 0.00 0.03 0.00 0.00 54.97 55.13 2jza s GLU 124 Cb 0.04 -3.55 -0.02 0.00 -0.80 0.00 0.00 34.13 29.81 2jza s GLU 124 CO 0.01 -0.00 -0.10 -3.38 -1.33 0.00 0.00 175.26 170.46 2jza s HIS 125 N 1.23 2.88 -0.21 4.83 -3.43 -1.26 -5.10 115.29 114.23 2jza s HIS 125 Ca 0.13 -0.46 -0.08 0.00 -0.80 0.00 0.00 55.06 53.85 2jza s HIS 125 Cb -0.14 -1.86 0.10 0.00 -1.43 0.00 0.00 32.58 29.25 2jza s HIS 125 CO 0.06 -0.09 0.46 -3.38 -2.00 0.00 0.00 174.74 169.79 2jza s HIS 126 N 0.21 -0.88 0.43 0.38 -3.43 -1.26 -5.16 115.29 105.57 2jza s HIS 126 Ca -0.06 1.65 -0.06 0.00 -0.80 0.00 0.00 55.06 55.80 2jza s HIS 126 Cb -0.15 0.39 -0.04 0.00 -1.43 0.00 0.00 32.58 31.35 2jza s HIS 126 CO 0.04 -0.51 0.73 -1.01 -2.00 0.00 0.00 174.74 171.99 2jza s HIS 127 N 2.59 3.53 0.31 0.38 3.76 -1.26 -5.11 115.29 119.49 2jza s HIS 127 Ca -0.03 0.79 0.03 0.00 -0.15 0.00 0.00 55.06 55.69 2jza s HIS 127 Cb -0.12 -2.26 -0.05 0.00 1.11 0.00 0.00 32.58 31.27 2jza s HIS 127 CO -0.14 -0.14 0.10 -1.01 -0.85 0.00 0.00 174.74 172.70 2jza s HIS 128 N -2.53 1.71 0.19 1.40 3.76 -1.26 -5.18 115.29 113.38 2jza s HIS 128 Ca 0.47 -1.17 -0.17 0.00 -0.15 0.00 0.00 55.06 54.04 2jza s HIS 128 Cb -0.10 -1.04 0.02 0.00 1.11 0.00 0.00 32.58 32.57 2jza s HIS 128 CO 0.39 -0.26 0.50 -3.38 -0.85 0.00 0.00 174.74 171.14 2jza s HIS 129 N -3.52 -0.08 -2.03 1.40 -3.43 -1.26 -5.38 115.29 101.00 2jza s HIS 129 Ca 0.35 -0.27 0.32 0.00 -0.80 0.00 0.00 55.06 54.66 2jza s HIS 129 Cb 0.07 0.36 1.86 0.00 -1.43 0.00 0.00 32.58 33.44 2jza s HIS 129 CO 0.15 -0.90 2.20 -2.39 -2.00 0.00 0.00 174.74 171.80