#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 -1.63 6.12 7.64 -1.26 -4.86 113.62 119.63 2jza n SER 2 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.96 2jza n SER 2 Cb 0.00 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 63.57 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 -0.58 4.32 -4.03 1.43 10.64 -1.26 -4.90 117.38 123.02 2jza n GLN 3 Ca 0.00 -3.05 -0.34 0.00 -1.83 0.00 0.00 57.00 51.78 2jza n GLN 3 Cb 0.00 -2.12 -0.15 0.00 -0.86 0.00 0.00 30.24 27.11 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 -2.64 2.95 0.05 2.61 0.52 -1.26 -4.21 118.94 116.96 2jza s TRP 4 Ca 0.51 -1.56 -0.20 0.00 0.02 0.00 0.00 56.10 54.86 2jza s TRP 4 Cb 0.39 -2.00 -0.06 0.00 -1.15 0.00 0.00 33.47 30.65 2jza s TRP 4 CO 0.16 -0.75 0.60 -0.08 0.02 0.00 0.00 176.95 176.90 2jza s THR 5 N 1.31 4.76 -0.16 2.01 -1.32 0.35 -4.69 115.64 117.90 2jza s THR 5 Ca 0.02 1.28 -0.29 0.00 -1.21 0.00 0.00 61.69 61.49 2jza s THR 5 Cb -0.15 -3.94 -0.00 0.00 -1.51 0.00 0.00 72.50 66.90 2jza s THR 5 CO -0.08 0.50 1.04 -0.89 -2.21 0.00 0.00 174.62 172.98 2jza s THR 6 N -0.77 4.69 0.00 5.08 2.01 -1.26 -1.98 115.64 123.41 2jza s THR 6 Ca 0.31 2.00 0.00 0.00 0.31 0.00 0.00 61.69 64.30 2jza s THR 6 Cb -0.19 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.03 2jza s THR 6 CO 0.19 -0.08 0.00 0.52 -0.69 0.00 0.00 174.62 174.56 2jza n VAL 7 N 4.93 0.00 -3.83 3.82 0.31 -0.03 -4.94 118.33 118.59 2jza n VAL 7 Ca 0.10 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.33 2jza n VAL 7 Cb 0.47 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.15 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 -2.34 3.73 0.45 0.00 1.02 -1.26 -1.23 119.74 120.11 2jza s LYS 9 Ca 0.19 1.65 0.20 0.00 0.02 0.00 0.00 55.97 58.03 2jza s LYS 9 Cb -0.03 -2.30 1.07 0.00 -0.52 0.00 0.00 37.83 36.06 2jza s LYS 9 CO 0.14 -0.55 1.94 1.25 -0.92 0.00 0.00 175.35 177.21 2jza h LEU 10 N 1.86 0.00 -0.34 3.17 5.85 -0.76 -2.73 115.31 122.36 2jza h LEU 10 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 2jza h LEU 10 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2jza h LEU 10 CO 0.60 0.23 -0.73 -0.90 -0.34 0.00 0.00 178.44 177.30 2jza n ASP 11 N -3.85 1.25 0.20 1.25 5.75 -1.26 -3.60 116.55 116.29 2jza n ASP 11 Ca -0.02 -1.06 0.03 0.00 -0.01 0.00 0.00 54.79 53.74 2jza n ASP 11 Cb 0.32 0.69 0.40 0.00 -1.03 0.00 0.00 41.12 41.50 2jza n ASP 11 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2jza h ASP 12 N 0.83 0.00 -3.42 -1.12 3.58 -1.83 -3.41 116.42 111.04 2jza h ASP 12 Ca 0.00 0.00 -0.62 0.00 0.42 0.00 0.00 57.03 56.83 2jza h ASP 12 Cb 0.58 0.00 -0.16 0.00 1.72 0.00 0.00 39.33 41.47 2jza h ASP 12 CO 0.00 0.32 -0.54 -0.63 -2.88 0.00 0.00 179.24 175.51 2jza s ILE 13 N -4.27 4.98 0.12 2.25 1.01 -1.24 -5.07 121.20 118.98 2jza s ILE 13 Ca -0.03 0.04 -0.13 0.00 0.00 0.00 0.00 60.65 60.53 2jza s ILE 13 Cb 0.15 -3.28 -0.07 0.00 0.01 0.00 0.00 42.46 39.27 2jza s ILE 13 CO 0.71 0.41 0.50 -0.76 0.00 0.00 0.00 174.94 175.80 2jza s LEU 14 N 0.73 4.34 0.58 2.97 1.43 -1.26 -4.96 118.68 122.51 2jza s LEU 14 Ca 0.05 0.98 -0.20 0.00 -1.03 0.00 0.00 54.13 53.93 2jza s LEU 14 Cb -0.13 -3.17 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 2jza s LEU 14 CO 0.02 0.13 1.24 -2.65 0.23 0.00 0.00 176.35 175.32 2jza n PRO 15 N 0.84 1.34 -1.64 1.29 -0.02 -1.26 -3.24 135.00 132.31 2jza n PRO 15 Ca -0.06 0.51 -0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2jza n PRO 15 Cb 0.52 -2.46 -0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2jza n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jza n GLY 16 N 0.93 0.37 3.31 -1.23 0.00 0.15 -5.04 105.19 103.68 2jza n GLY 16 Ca 0.13 -0.95 -0.18 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.01 0.00 0.00 2.61 2.01 -1.20 -5.00 115.64 112.04 2jza s THR 17 Ca 0.00 -1.94 0.00 0.00 0.31 0.00 0.00 61.69 60.06 2jza s THR 17 Cb 0.00 -2.52 0.00 0.00 0.01 0.00 0.00 72.50 69.99 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 -0.59 -0.36 3.29 4.40 0.00 -1.26 -0.06 105.19 110.61 2jza n GLY 18 Ca 0.06 0.80 -0.16 0.00 0.00 0.00 0.00 46.02 46.73 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 0.38 0.06 1.61 -7.23 -1.24 -4.28 120.40 109.70 2jza s VAL 19 Ca 0.00 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.90 2jza s VAL 19 Cb 0.00 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 2jza s VAL 19 CO 0.00 0.00 0.84 0.00 -0.31 0.00 0.00 175.10 175.63 2jza s ALA 21 N 0.01 2.92 -0.72 0.00 0.00 0.12 -4.89 121.76 119.21 2jza s ALA 21 Ca 0.42 -1.03 -0.27 0.00 0.00 0.00 0.00 51.96 51.08 2jza s ALA 21 Cb -0.21 -1.07 0.02 0.00 0.00 0.00 0.00 23.12 21.86 2jza s ALA 21 CO 0.25 0.60 1.37 -1.17 0.00 0.00 0.00 175.76 176.81 2jza s LEU 22 N -1.29 3.18 -1.06 0.00 1.98 -1.26 -1.65 118.68 118.58 2jza s LEU 22 Ca 0.16 -0.32 -0.09 0.00 -2.89 0.00 0.00 54.13 50.99 2jza s LEU 22 Cb -0.11 -2.56 0.27 0.00 0.66 0.00 0.00 46.19 44.44 2jza s LEU 22 CO 0.06 -1.92 1.03 -0.69 -1.89 0.00 0.00 176.35 172.94 2jza s VAL 23 N 6.25 5.76 0.00 1.68 1.01 -0.02 -4.90 120.40 130.18 2jza s VAL 23 Ca 0.40 -3.38 0.00 0.00 0.00 0.00 0.00 61.98 59.00 2jza s VAL 23 Cb -0.09 -4.48 0.00 0.00 0.00 0.00 0.00 36.38 31.81 2jza s VAL 23 CO 0.16 -1.16 0.00 -0.62 0.00 0.00 0.00 175.10 173.48 2jza n GLU 24 N 2.79 0.00 -0.02 2.72 1.02 -1.26 -2.25 120.64 123.64 2jza n GLU 24 Ca 0.22 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.34 2jza n GLU 24 Cb 0.40 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.79 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 0.00 1.64 -4.03 3.49 6.02 -1.26 -5.06 117.38 118.18 2jza n GLN 25 Ca 0.00 0.01 -0.27 0.00 -0.01 0.00 0.00 57.00 56.73 2jza n GLN 25 Cb 0.00 -1.08 -0.05 0.00 1.02 0.00 0.00 30.24 30.13 2jza n GLN 25 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2jza s GLN 26 N -2.08 3.07 -0.32 -1.09 -0.21 -0.95 -5.00 119.66 113.08 2jza s GLN 26 Ca -0.04 -0.74 -0.17 0.00 0.02 0.00 0.00 55.36 54.43 2jza s GLN 26 Cb 0.01 -2.77 -0.01 0.00 1.00 0.00 0.00 33.01 31.24 2jza s GLN 26 CO 0.11 0.52 0.48 -0.65 -2.12 0.00 0.00 175.29 173.63 2jza s GLN 27 N -2.98 3.79 -0.15 2.91 1.11 -1.26 -0.84 119.66 122.24 2jza s GLN 27 Ca 0.32 -0.03 -0.01 0.00 0.01 0.00 0.00 55.36 55.64 2jza s GLN 27 Cb -0.11 -3.75 -0.01 0.00 -1.01 0.00 0.00 33.01 28.13 2jza s GLN 27 CO 0.25 -0.51 -0.10 0.42 0.01 0.00 0.00 175.29 175.36 2jza s ILE 28 N 2.30 3.24 -0.05 1.08 1.09 -0.66 -4.74 121.20 123.46 2jza s ILE 28 Ca 0.18 -0.58 -0.23 0.00 -1.10 0.00 0.00 60.65 58.91 2jza s ILE 28 Cb -0.16 -2.39 -0.04 0.00 -1.06 0.00 0.00 42.46 38.81 2jza s ILE 28 CO 0.12 0.50 0.70 0.00 -0.10 0.00 0.00 174.94 176.16 2jza s ALA 29 N 0.58 3.35 -0.50 9.38 0.00 -0.30 0.15 121.76 134.42 2jza s ALA 29 Ca -0.06 0.15 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 2jza s ALA 29 Cb -0.15 -2.95 0.13 0.00 0.00 0.00 0.00 23.12 20.15 2jza s ALA 29 CO 0.03 -0.06 0.34 0.08 0.00 0.00 0.00 175.76 176.15 2jza s VAL 30 N 0.61 3.84 0.32 0.00 1.01 -0.02 -0.69 120.40 125.47 2jza s VAL 30 Ca 0.37 -2.19 -0.28 0.00 0.00 0.00 0.00 61.98 59.88 2jza s VAL 30 Cb -0.18 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.56 2jza s VAL 30 CO 0.19 -0.78 1.14 -0.36 0.00 0.00 0.00 175.10 175.28 2jza s PHE 31 N 0.89 3.38 -0.44 5.22 0.40 0.78 -3.64 117.98 124.58 2jza s PHE 31 Ca 0.10 1.63 0.10 0.00 -0.60 0.00 0.00 56.93 58.15 2jza s PHE 31 Cb -0.23 -3.34 0.35 0.00 0.51 0.00 0.00 43.02 40.31 2jza s PHE 31 CO -0.03 -0.87 0.82 -2.13 0.70 0.00 0.00 175.22 173.71 2jza n ARG 32 N 0.81 1.81 0.19 0.44 3.00 0.91 -0.84 116.66 122.99 2jza n ARG 32 Ca 0.01 -3.91 0.08 0.00 -0.00 0.00 0.00 57.85 54.02 2jza n ARG 32 Cb 0.45 -1.89 0.13 0.00 0.00 0.00 0.00 32.46 31.16 2jza n ARG 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2jza h PRO 33 N 2.98 0.00 -6.96 -0.14 0.11 -1.85 0.41 132.00 126.56 2jza h PRO 33 Ca 0.11 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.76 2jza h PRO 33 Cb 0.82 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 2jza h PRO 33 CO 0.62 0.22 0.26 1.03 -0.21 0.00 0.00 178.00 179.92 2jza s ARG 34 N -3.13 4.11 -1.22 1.05 1.81 -1.26 -4.78 118.95 115.52 2jza s ARG 34 Ca 0.05 0.93 -0.19 0.00 -1.72 0.00 0.00 55.73 54.80 2jza s ARG 34 Cb 0.06 -2.26 -0.02 0.00 -0.45 0.00 0.00 34.95 32.29 2jza s ARG 34 CO 0.70 -0.00 1.90 -1.71 -0.68 0.00 0.00 175.30 175.51 2jza n ASN 35 N -0.70 3.87 -1.24 0.23 5.15 -1.26 -4.57 115.26 116.74 2jza n ASN 35 Ca 0.06 -2.81 0.17 0.00 -0.60 0.00 0.00 54.58 51.40 2jza n ASN 35 Cb 0.54 -1.65 -0.04 0.00 -0.53 0.00 0.00 39.78 38.10 2jza n ASN 35 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2jza n ASP 36 N 9.81 -7.35 0.00 1.20 2.03 -1.26 -4.79 116.55 116.20 2jza n ASP 36 Ca 0.48 0.50 0.00 0.00 0.52 0.00 0.00 54.79 56.30 2jza n ASP 36 Cb 0.44 -3.75 0.00 0.00 -0.72 0.00 0.00 41.12 37.09 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 -3.79 0.00 -3.76 -0.67 1.02 -1.26 -4.80 120.64 107.38 2jza n GLU 37 Ca 0.01 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.89 2jza n GLU 37 Cb 0.56 -2.30 -0.17 0.00 -0.02 0.00 0.00 31.44 29.51 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 0.00 0.69 0.31 3.49 2.00 -1.26 -5.01 119.66 119.88 2jza s GLN 38 Ca 0.00 -0.22 0.08 0.00 -2.00 0.00 0.00 55.36 53.22 2jza s GLN 38 Cb 0.00 -1.68 -0.04 0.00 0.80 0.00 0.00 33.01 32.09 2jza s GLN 38 CO 0.00 -0.50 0.12 0.14 -0.50 0.00 0.00 175.29 174.55 2jza s VAL 39 N 1.89 3.30 -0.51 1.34 -7.23 -1.26 -4.38 120.40 113.55 2jza s VAL 39 Ca 0.02 -1.70 0.03 0.00 -1.81 0.00 0.00 61.98 58.52 2jza s VAL 39 Cb -0.15 -3.00 0.15 0.00 0.56 0.00 0.00 36.38 33.93 2jza s VAL 39 CO -0.07 -0.24 0.31 -0.31 -0.31 0.00 0.00 175.10 174.47 2jza s TYR 40 N -2.36 2.41 -0.68 2.82 2.02 -0.02 -4.95 117.35 116.59 2jza s TYR 40 Ca 0.36 -2.73 -0.20 0.00 -0.37 0.00 0.00 57.07 54.12 2jza s TYR 40 Cb -0.04 -2.10 0.10 0.00 -0.40 0.00 0.00 41.96 39.51 2jza s TYR 40 CO 0.22 -0.73 0.88 0.00 -1.57 0.00 0.00 175.55 174.36 2jza s ALA 41 N -0.17 3.29 0.36 3.71 0.00 -1.25 -0.15 121.76 127.54 2jza s ALA 41 Ca 0.21 -2.16 0.04 0.00 0.00 0.00 0.00 51.96 50.04 2jza s ALA 41 Cb -0.17 -3.75 -0.04 0.00 0.00 0.00 0.00 23.12 19.16 2jza s ALA 41 CO -0.06 -2.63 0.13 0.96 0.00 0.00 0.00 175.76 174.16 2jza s ILE 42 N 3.24 0.59 -1.32 0.00 -4.36 0.13 -4.40 121.20 115.08 2jza s ILE 42 Ca 0.19 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.44 2jza s ILE 42 Cb -0.18 -2.48 0.10 0.00 1.25 0.00 0.00 42.46 41.15 2jza s ILE 42 CO 0.05 0.00 1.83 -1.20 0.24 0.00 0.00 174.94 175.86 2jza n SER 43 N -1.08 4.75 -3.66 4.36 7.64 -0.77 -1.15 113.62 123.72 2jza n SER 43 Ca -0.03 -2.95 -0.29 0.00 1.01 0.00 0.00 58.87 56.62 2jza n SER 43 Cb 0.65 -1.63 -0.12 0.00 -1.01 0.00 0.00 64.21 62.10 2jza n SER 43 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2jza s ASN 44 N 3.00 3.33 0.00 6.43 3.84 -1.26 -3.86 114.94 126.42 2jza s ASN 44 Ca 0.47 -2.93 0.00 0.00 0.21 0.00 0.00 52.86 50.61 2jza s ASN 44 Cb 0.06 -0.97 0.00 0.00 -0.55 0.00 0.00 41.25 39.79 2jza s ASN 44 CO 0.00 -0.21 0.00 -0.38 -2.79 0.00 0.00 177.10 173.72 2jza n ILE 45 N 3.12 0.00 -3.64 -5.21 2.08 -1.26 -4.48 119.36 109.97 2jza n ILE 45 Ca 0.16 0.00 -0.05 0.00 0.56 0.00 0.00 62.75 63.42 2jza n ILE 45 Cb 0.38 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 39.20 2jza n ILE 45 CO 0.00 0.00 0.00 1.51 0.56 0.00 0.00 176.55 178.62 2jza s ASP 46 N 1.00 -0.17 -0.33 4.38 1.47 -1.26 -3.80 116.67 117.95 2jza s ASP 46 Ca 0.00 0.31 0.03 0.00 1.18 0.00 0.00 52.55 54.07 2jza s ASP 46 Cb 0.00 0.31 0.49 0.00 -0.34 0.00 0.00 42.92 43.38 2jza s ASP 46 CO 0.00 -0.07 1.68 -0.81 0.68 0.00 0.00 175.17 176.65 2jza n PRO 47 N 1.59 1.93 -0.02 2.11 -0.04 -1.26 -2.73 135.00 136.57 2jza n PRO 47 Ca -0.10 -2.22 -0.03 0.00 -0.04 0.00 0.00 63.50 61.11 2jza n PRO 47 Cb 0.57 -1.87 -0.01 0.00 -0.04 0.00 0.00 33.50 32.15 2jza n PRO 47 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2jza n PHE 48 N -0.70 0.00 0.00 0.54 7.35 -1.26 -4.88 117.46 118.50 2jza n PHE 48 Ca 0.44 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.13 2jza n PHE 48 Cb 1.35 -0.12 0.00 0.00 0.35 0.00 0.00 39.48 41.06 2jza n PHE 48 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jza n ALA 49 N -3.04 1.62 -3.28 3.13 0.00 -1.26 -5.06 120.51 112.61 2jza n ALA 49 Ca -0.06 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.23 2jza n ALA 49 Cb 0.55 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.05 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 -1.07 -1.95 -0.32 0.00 1.13 -1.11 -4.95 117.38 109.11 2jza n GLN 50 Ca 0.00 0.92 0.00 0.00 -1.94 0.00 0.00 57.00 55.98 2jza n GLN 50 Cb 0.00 -5.56 0.00 0.00 0.11 0.00 0.00 30.24 24.79 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jza n ALA 51 N -3.10 1.64 -3.14 -1.58 0.00 -1.26 -4.97 120.51 108.10 2jza n ALA 51 Ca -0.06 -0.42 -0.14 0.00 0.00 0.00 0.00 53.44 52.81 2jza n ALA 51 Cb 0.60 -0.17 0.07 0.00 0.00 0.00 0.00 19.45 19.95 2jza n ALA 51 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jza n SER 52 N 0.00 -5.40 0.00 0.00 7.64 -1.26 -4.57 113.62 110.03 2jza n SER 52 Ca 0.00 -0.63 0.10 0.00 1.01 0.00 0.00 58.87 59.34 2jza n SER 52 Cb 0.57 -4.79 0.43 0.00 -1.01 0.00 0.00 64.21 59.40 2jza n SER 52 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2jza n VAL 53 N -3.24 0.61 1.02 0.44 0.24 -1.25 -1.36 118.33 114.79 2jza n VAL 53 Ca -0.10 0.15 0.13 0.00 -2.04 0.00 0.00 64.34 62.47 2jza n VAL 53 Cb 0.62 -0.81 0.35 0.00 -1.47 0.00 0.00 33.84 32.53 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 -1.48 0.40 -0.11 1.34 4.77 -1.25 -4.24 117.00 116.42 2jza n LEU 54 Ca 0.05 0.11 -0.19 0.00 -0.03 0.00 0.00 56.01 55.95 2jza n LEU 54 Cb 0.23 -0.30 -0.10 0.00 -2.33 0.00 0.00 43.42 40.92 2jza n LEU 54 CO 0.18 0.10 -1.26 -1.20 -1.33 0.00 0.00 177.39 173.88 2jza n SER 55 N -1.46 2.05 -2.07 -1.43 7.64 -0.46 -4.08 113.62 113.80 2jza n SER 55 Ca 0.06 0.04 -0.14 0.00 1.01 0.00 0.00 58.87 59.84 2jza n SER 55 Cb 0.33 -0.48 -0.16 0.00 -1.01 0.00 0.00 64.21 62.90 2jza n SER 55 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2jza n ARG 56 N -3.50 2.07 0.00 1.43 1.85 -0.93 -4.61 116.66 112.97 2jza n ARG 56 Ca -0.42 -1.16 0.00 0.00 -1.00 0.00 0.00 57.85 55.27 2jza n ARG 56 Cb 0.88 -2.03 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2jza n GLY 57 N 2.36 2.22 3.40 2.89 0.00 -1.25 -4.69 105.19 110.12 2jza n GLY 57 Ca 0.44 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.97 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 2.55 3.98 -0.78 -0.61 1.01 0.21 -4.91 121.20 122.65 2jza s ILE 58 Ca 0.00 -0.29 -0.23 0.00 0.00 0.00 0.00 60.65 60.14 2jza s ILE 58 Cb 0.00 -2.84 0.07 0.00 0.01 0.00 0.00 42.46 39.70 2jza s ILE 58 CO 0.00 0.38 1.14 -0.69 0.00 0.00 0.00 174.94 175.76 2jza s VAL 59 N 1.50 4.21 -0.28 2.92 1.01 -1.26 -0.07 120.40 128.42 2jza s VAL 59 Ca 0.06 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 2jza s VAL 59 Cb -0.15 -4.81 -0.02 0.00 0.00 0.00 0.00 36.38 31.40 2jza s VAL 59 CO 0.01 -1.63 0.13 0.00 0.00 0.00 0.00 175.10 173.61 2jza s ALA 60 N 4.31 3.28 -0.24 5.51 0.00 -0.72 -4.99 121.76 128.91 2jza s ALA 60 Ca 0.31 -1.23 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 2jza s ALA 60 Cb -0.10 -2.28 -0.03 0.00 0.00 0.00 0.00 23.12 20.70 2jza s ALA 60 CO 0.04 -0.68 0.49 -2.00 0.00 0.00 0.00 175.76 173.62 2jza s GLU 61 N 1.64 4.10 -0.34 0.00 2.12 -1.26 0.32 118.70 125.28 2jza s GLU 61 Ca 0.06 0.29 0.01 0.00 0.36 0.00 0.00 54.97 55.69 2jza s GLU 61 Cb -0.16 -3.62 0.09 0.00 0.26 0.00 0.00 34.13 30.70 2jza s GLU 61 CO 0.06 -0.27 0.06 -1.58 -0.54 0.00 0.00 175.26 172.99 2jza s HIS 62 N 2.03 3.57 0.00 5.30 2.46 0.10 -4.92 115.29 123.83 2jza s HIS 62 Ca 0.21 -2.59 0.00 0.00 0.47 0.00 0.00 55.06 53.15 2jza s HIS 62 Cb -0.15 -2.73 0.00 0.00 -0.13 0.00 0.00 32.58 29.56 2jza s HIS 62 CO 0.09 -0.92 0.00 1.04 -2.47 0.00 0.00 174.74 172.48 2jza n GLN 63 N 4.42 0.00 0.00 2.88 6.02 -1.26 -1.94 117.38 127.50 2jza n GLN 63 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2jza n GLN 63 Cb 0.42 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.68 2jza n GLN 63 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2jza n ASP 64 N 2.75 3.89 -4.90 1.08 2.03 -1.26 -5.09 116.55 115.05 2jza n ASP 64 Ca 0.00 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.03 2jza n ASP 64 Cb 0.00 0.38 0.01 0.00 -0.72 0.00 0.00 41.12 40.79 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 -2.59 6.10 -0.32 1.67 1.01 -0.82 -5.05 116.67 116.68 2jza s ASP 65 Ca 0.00 1.01 -0.07 0.00 0.71 0.00 0.00 52.55 54.20 2jza s ASP 65 Cb 0.00 -2.19 0.02 0.00 1.01 0.00 0.00 42.92 41.76 2jza s ASP 65 CO 0.00 -0.76 0.10 -0.76 0.21 0.00 0.00 175.17 173.96 2jza s LEU 66 N -4.91 4.08 -0.35 1.23 1.43 -1.26 -0.72 118.68 118.17 2jza s LEU 66 Ca 0.51 -0.87 -0.05 0.00 -1.03 0.00 0.00 54.13 52.69 2jza s LEU 66 Cb -0.11 -1.89 0.06 0.00 0.03 0.00 0.00 46.19 44.28 2jza s LEU 66 CO 0.47 -0.25 0.12 0.26 0.23 0.00 0.00 176.35 177.18 2jza s TRP 67 N 1.48 3.32 0.11 0.29 0.52 0.15 0.00 118.94 124.80 2jza s TRP 67 Ca 0.01 -1.67 -0.30 0.00 0.02 0.00 0.00 56.10 54.16 2jza s TRP 67 Cb -0.18 -2.48 -0.06 0.00 -1.15 0.00 0.00 33.47 29.60 2jza s TRP 67 CO 0.03 -0.80 1.03 0.54 0.02 0.00 0.00 176.95 177.77 2jza s VAL 68 N 1.34 4.31 -0.07 4.03 0.11 -0.30 -1.76 120.40 128.06 2jza s VAL 68 Ca -0.00 1.88 0.05 0.00 -2.93 0.00 0.00 61.98 60.97 2jza s VAL 68 Cb -0.21 -4.20 -0.01 0.00 -1.53 0.00 0.00 36.38 30.44 2jza s VAL 68 CO 0.01 0.27 -0.23 0.00 -3.33 0.00 0.00 175.10 171.82 2jza s ALA 69 N 0.15 2.25 0.38 1.54 0.00 0.89 -0.81 121.76 126.17 2jza s ALA 69 Ca 0.49 -1.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.20 2jza s ALA 69 Cb -0.25 -0.78 -0.09 0.00 0.00 0.00 0.00 23.12 22.00 2jza s ALA 69 CO 0.31 0.38 1.06 -1.54 0.00 0.00 0.00 175.76 175.98 2jza s SER 70 N -0.05 6.80 0.11 0.00 1.04 -1.05 0.65 113.70 121.20 2jza s SER 70 Ca -0.06 2.08 -0.26 0.00 0.48 0.00 0.00 55.95 58.19 2jza s SER 70 Cb -0.15 -2.59 -0.10 0.00 0.10 0.00 0.00 66.02 63.29 2jza s SER 70 CO 0.05 -0.46 1.67 1.55 0.98 0.00 0.00 173.24 177.02 2jza h PRO 71 N 2.67 -0.35 0.03 4.02 0.13 -1.84 0.86 132.00 137.52 2jza h PRO 71 Ca -0.48 0.02 -0.31 0.00 -0.87 0.00 0.00 66.00 64.37 2jza h PRO 71 Cb 1.22 0.08 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 2jza h PRO 71 CO 0.63 -0.23 -1.69 1.28 -0.23 0.00 0.00 178.00 177.75 2jza n LEU 72 N -5.31 2.12 0.05 1.56 4.77 -1.26 -4.31 117.00 114.62 2jza n LEU 72 Ca -0.07 0.33 -0.01 0.00 -0.03 0.00 0.00 56.01 56.24 2jza n LEU 72 Cb 0.23 -0.98 0.29 0.00 -2.33 0.00 0.00 43.42 40.63 2jza n LEU 72 CO 0.28 0.49 0.82 0.11 -1.33 0.00 0.00 177.39 177.77 2jza h LYS 73 N -0.69 0.38 -2.68 3.23 1.79 -1.94 -3.46 116.57 113.21 2jza h LYS 73 Ca -0.43 -0.11 -0.40 0.00 -2.18 0.00 0.00 60.65 57.52 2jza h LYS 73 Cb 1.56 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 32.13 2jza h LYS 73 CO -0.17 0.55 -0.50 1.17 -1.08 0.00 0.00 179.45 179.42 2jza n LYS 74 N -4.20 -1.59 -3.39 3.15 4.81 0.30 -4.92 118.16 112.32 2jza n LYS 74 Ca -0.00 1.00 -0.38 0.00 -0.87 0.00 0.00 58.31 58.06 2jza n LYS 74 Cb 0.33 -5.60 -0.06 0.00 0.02 0.00 0.00 35.03 29.72 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 -4.87 4.11 -0.22 1.64 -0.21 -1.26 -4.73 119.66 114.12 2jza s GLN 75 Ca 0.00 0.51 -0.09 0.00 0.02 0.00 0.00 55.36 55.79 2jza s GLN 75 Cb 0.00 -3.29 -0.04 0.00 1.00 0.00 0.00 33.01 30.68 2jza s GLN 75 CO 0.00 0.53 0.12 -1.01 -2.12 0.00 0.00 175.29 172.80 2jza s HIS 76 N -0.60 3.27 -0.13 0.91 3.76 -1.25 -2.52 115.29 118.73 2jza s HIS 76 Ca 0.26 0.10 0.02 0.00 -0.15 0.00 0.00 55.06 55.29 2jza s HIS 76 Cb -0.17 -2.20 0.01 0.00 1.11 0.00 0.00 32.58 31.33 2jza s HIS 76 CO 0.14 0.05 -0.19 -0.06 -0.85 0.00 0.00 174.74 173.83 2jza s PHE 77 N 0.89 2.39 -0.37 1.40 0.08 0.01 -3.59 117.98 118.79 2jza s PHE 77 Ca 0.06 -1.18 -0.29 0.00 0.12 0.00 0.00 56.93 55.64 2jza s PHE 77 Cb -0.13 -1.66 0.00 0.00 -0.57 0.00 0.00 43.02 40.66 2jza s PHE 77 CO 0.03 -0.56 1.47 0.50 -0.10 0.00 0.00 175.22 176.56 2jza s ARG 78 N 0.89 3.61 -1.17 0.44 3.52 0.54 -1.15 118.95 125.63 2jza s ARG 78 Ca -0.07 1.12 -0.21 0.00 -0.13 0.00 0.00 55.73 56.44 2jza s ARG 78 Cb -0.15 -4.03 -0.01 0.00 -1.56 0.00 0.00 34.95 29.20 2jza s ARG 78 CO -0.02 -1.52 1.80 -0.51 -0.81 0.00 0.00 175.30 174.24 2jza s LEU 79 N 5.48 3.42 0.15 -0.88 1.43 0.10 -1.53 118.68 126.85 2jza s LEU 79 Ca 0.64 -1.79 0.00 0.00 -1.03 0.00 0.00 54.13 51.95 2jza s LEU 79 Cb -0.16 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.48 2jza s LEU 79 CO 0.31 -2.12 0.00 0.00 0.23 0.00 0.00 176.35 174.77 2jza n TYR 80 N 11.38 -2.87 0.00 0.29 9.36 -1.26 -4.68 117.16 129.38 2jza n TYR 80 Ca 0.44 0.51 0.00 0.00 3.32 0.00 0.00 57.90 62.17 2jza n TYR 80 Cb 0.47 1.54 0.00 0.00 -0.63 0.00 0.00 39.34 40.72 2jza n TYR 80 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2jza n ASP 81 N -2.98 0.82 0.00 2.98 5.75 -1.22 -4.87 116.55 117.04 2jza n ASP 81 Ca 0.00 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.41 2jza n ASP 81 Cb 0.00 0.90 0.00 0.00 -1.03 0.00 0.00 41.12 40.99 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jza n GLY 82 N 1.15 0.84 3.68 6.12 0.00 -0.58 -4.11 105.19 112.29 2jza n GLY 82 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.07 1.99 0.10 1.61 5.36 -1.24 -4.55 117.98 119.17 2jza s PHE 83 Ca 0.00 0.00 -0.10 0.00 -0.96 0.00 0.00 56.93 55.87 2jza s PHE 83 Cb 0.00 -4.09 -0.06 0.00 -0.34 0.00 0.00 43.02 38.53 2jza s PHE 83 CO 0.00 -4.59 0.43 0.00 -1.46 0.00 0.00 175.22 169.60 2jza h LEU 85 N 3.58 -0.62 -1.12 0.00 5.85 -1.94 -3.41 115.31 117.65 2jza h LEU 85 Ca -0.49 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2jza h LEU 85 Cb 1.19 0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.38 2jza h LEU 85 CO 0.67 -0.33 -0.14 -0.62 -0.34 0.00 0.00 178.44 177.67 2jza n GLU 86 N -4.57 0.00 -0.97 1.25 1.02 -1.26 -4.94 120.64 111.16 2jza n GLU 86 Ca -0.09 -0.50 -0.20 0.00 -0.02 0.00 0.00 57.16 56.35 2jza n GLU 86 Cb 0.29 -0.36 0.13 0.00 -0.02 0.00 0.00 31.44 31.48 2jza n GLU 86 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jza n ASP 87 N 0.00 4.04 -1.76 1.62 9.92 -1.26 -4.70 116.55 124.41 2jza n ASP 87 Ca 0.00 -3.27 -0.05 0.00 -0.53 0.00 0.00 54.79 50.94 2jza n ASP 87 Cb 0.56 -0.79 -0.07 0.00 -0.64 0.00 0.00 41.12 40.18 2jza n ASP 87 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jza n GLY 88 N -0.72 2.53 0.14 0.44 0.00 -1.26 -3.94 105.19 102.39 2jza n GLY 88 Ca 0.46 -0.48 0.08 0.00 0.00 0.00 0.00 46.02 46.09 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 2.15 0.67 -3.19 4.61 0.00 -2.01 -3.40 119.26 118.10 2jza h ALA 89 Ca 0.08 -0.20 -0.62 0.00 0.00 0.00 0.00 54.91 54.16 2jza h ALA 89 Cb 1.11 0.04 -0.40 0.00 0.00 0.00 0.00 17.79 18.54 2jza h ALA 89 CO 0.11 0.24 -0.70 0.71 0.00 0.00 0.00 179.25 179.61 2jza s TYR 90 N -3.20 2.52 -0.48 0.00 2.02 -1.25 -5.07 117.35 111.89 2jza s TYR 90 Ca 0.01 -2.69 -0.26 0.00 -0.37 0.00 0.00 57.07 53.76 2jza s TYR 90 Cb 0.08 -2.29 -0.06 0.00 -0.40 0.00 0.00 41.96 39.29 2jza s TYR 90 CO 0.76 -0.79 2.34 -1.12 -1.57 0.00 0.00 175.55 175.17 2jza s SER 91 N 0.24 4.60 0.28 2.29 0.01 -1.26 -4.94 113.70 114.93 2jza s SER 91 Ca 0.16 1.07 0.10 0.00 1.31 0.00 0.00 55.95 58.59 2jza s SER 91 Cb -0.24 -2.50 -0.05 0.00 0.21 0.00 0.00 66.02 63.43 2jza s SER 91 CO -0.02 -2.76 -0.14 0.68 0.41 0.00 0.00 173.24 171.41 2jza s VAL 92 N 11.58 2.15 0.28 3.43 -7.23 -1.26 -5.14 120.40 124.21 2jza s VAL 92 Ca 0.95 -2.28 0.02 0.00 -1.81 0.00 0.00 61.98 58.86 2jza s VAL 92 Cb -0.18 -2.36 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2jza s VAL 92 CO 0.26 -0.37 0.15 0.00 -0.31 0.00 0.00 175.10 174.83 2jza s ALA 93 N -2.70 1.74 0.00 1.32 0.00 -1.25 -4.88 121.76 115.99 2jza s ALA 93 Ca 0.29 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.46 2jza s ALA 93 Cb -0.01 1.22 0.00 0.00 0.00 0.00 0.00 23.12 24.33 2jza s ALA 93 CO 0.13 -0.53 0.00 0.00 0.00 0.00 0.00 175.76 175.36 2jza n ALA 94 N -0.50 0.00 -3.63 0.00 0.00 -1.26 -1.84 120.51 113.29 2jza n ALA 94 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 2jza n ALA 94 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.07 2jza n ALA 94 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jza s TYR 95 N 2.02 -0.01 -0.14 0.00 2.02 -1.26 -4.59 117.35 115.39 2jza s TYR 95 Ca 0.00 -0.42 -0.21 0.00 -0.37 0.00 0.00 57.07 56.07 2jza s TYR 95 Cb 0.00 0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 42.06 2jza s TYR 95 CO 0.00 -1.15 0.63 -0.51 -1.57 0.00 0.00 175.55 172.95 2jza s ASP 96 N -2.95 6.79 -0.05 2.29 1.01 -1.26 -4.96 116.67 117.53 2jza s ASP 96 Ca 0.15 0.95 0.03 0.00 0.71 0.00 0.00 52.55 54.39 2jza s ASP 96 Cb -0.04 -2.36 0.01 0.00 1.01 0.00 0.00 42.92 41.54 2jza s ASP 96 CO 0.07 -0.18 -0.13 0.42 0.21 0.00 0.00 175.17 175.57 2jza s THR 97 N 1.34 1.14 -0.00 -1.27 -4.23 -1.26 0.09 115.64 111.44 2jza s THR 97 Ca 0.31 -0.51 0.08 0.00 -1.18 0.00 0.00 61.69 60.39 2jza s THR 97 Cb -0.16 -1.02 -0.02 0.00 1.34 0.00 0.00 72.50 72.64 2jza s THR 97 CO 0.13 0.35 -0.25 0.00 -0.54 0.00 0.00 174.62 174.31 2jza s GLN 98 N 0.46 1.91 -0.71 3.99 -2.07 0.56 -5.00 119.66 118.80 2jza s GLN 98 Ca -0.11 -0.92 -0.10 0.00 -1.82 0.00 0.00 55.36 52.41 2jza s GLN 98 Cb -0.14 -1.90 0.18 0.00 -1.09 0.00 0.00 33.01 30.07 2jza s GLN 98 CO 0.03 0.51 0.60 0.08 -1.32 0.00 0.00 175.29 175.20 2jza s VAL 99 N -0.63 4.87 -1.17 3.63 1.01 -1.26 -1.13 120.40 125.72 2jza s VAL 99 Ca 0.10 -2.46 -0.18 0.00 0.00 0.00 0.00 61.98 59.43 2jza s VAL 99 Cb -0.09 -4.08 0.10 0.00 0.00 0.00 0.00 36.38 32.31 2jza s VAL 99 CO -0.00 -0.94 1.53 0.42 0.00 0.00 0.00 175.10 176.10 2jza s THR 100 N 0.34 4.37 0.00 3.92 -4.23 -0.26 -4.82 115.64 114.96 2jza s THR 100 Ca 0.15 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 2jza s THR 100 Cb -0.16 -5.05 0.00 0.00 1.34 0.00 0.00 72.50 68.63 2jza s THR 100 CO -0.05 -1.85 0.00 0.59 -0.54 0.00 0.00 174.62 172.77 2jza n ASN 101 N 7.63 0.00 0.00 3.99 3.02 -1.26 -2.16 115.26 126.49 2jza n ASN 101 Ca 0.39 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.94 2jza n ASN 101 Cb 0.47 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 2jza n ASN 101 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jza n GLY 102 N 0.00 0.91 3.03 7.41 0.00 -1.26 -4.92 105.19 110.36 2jza n GLY 102 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.58 0.52 -0.15 1.61 2.20 -0.92 -0.04 114.94 117.57 2jza s ASN 103 Ca 0.00 -0.62 -0.04 0.00 -0.94 0.00 0.00 52.86 51.26 2jza s ASN 103 Cb 0.00 0.09 -0.03 0.00 -2.00 0.00 0.00 41.25 39.31 2jza s ASN 103 CO 0.00 -0.32 -0.00 -0.69 -2.94 0.00 0.00 177.10 173.14 2jza s VAL 104 N -1.92 4.21 -0.08 3.54 1.01 -0.36 -1.10 120.40 125.69 2jza s VAL 104 Ca -0.09 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2jza s VAL 104 Cb -0.06 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.48 2jza s VAL 104 CO -0.02 0.51 -0.13 -1.10 0.00 0.00 0.00 175.10 174.35 2jza s GLN 105 N 0.12 1.88 0.22 2.72 -0.21 -0.28 -0.85 119.66 123.25 2jza s GLN 105 Ca 0.01 -0.46 0.10 0.00 0.02 0.00 0.00 55.36 55.04 2jza s GLN 105 Cb -0.13 -1.58 -0.04 0.00 1.00 0.00 0.00 33.01 32.26 2jza s GLN 105 CO 0.02 -0.01 -0.16 0.96 -2.12 0.00 0.00 175.29 173.99 2jza s ILE 106 N 0.80 2.79 -0.46 1.08 -0.00 -0.84 -0.32 121.20 124.24 2jza s ILE 106 Ca -0.12 -1.97 -0.17 0.00 -0.00 0.00 0.00 60.65 58.40 2jza s ILE 106 Cb -0.16 -2.40 0.05 0.00 -0.00 0.00 0.00 42.46 39.96 2jza s ILE 106 CO 0.02 -0.20 0.44 -0.55 -0.00 0.00 0.00 174.94 174.65 2jza s SER 107 N -3.01 6.17 0.27 4.36 0.15 0.11 -0.50 113.70 121.25 2jza s SER 107 Ca 0.25 -1.06 -0.27 0.00 0.70 0.00 0.00 55.95 55.57 2jza s SER 107 Cb -0.07 -2.21 -0.09 0.00 -1.71 0.00 0.00 66.02 61.93 2jza s SER 107 CO 0.14 -0.66 0.92 0.27 1.20 0.00 0.00 173.24 175.10 2jza s ILE 108 N 1.95 4.18 -0.10 6.45 -4.36 -1.26 -4.01 121.20 124.07 2jza s ILE 108 Ca 0.08 1.90 0.13 0.00 -0.26 0.00 0.00 60.65 62.50 2jza s ILE 108 Cb -0.21 -4.14 0.24 0.00 1.25 0.00 0.00 42.46 39.60 2jza s ILE 108 CO 0.09 0.32 1.12 0.00 0.24 0.00 0.00 174.94 176.71 2jza n ALA 109 N 1.02 2.38 -3.68 2.27 0.00 -1.26 -5.06 120.51 116.18 2jza n ALA 109 Ca -0.00 -2.26 0.02 0.00 0.00 0.00 0.00 53.44 51.20 2jza n ALA 109 Cb 0.49 -0.43 0.02 0.00 0.00 0.00 0.00 19.45 19.53 2jza n ALA 109 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jza n ASP 110 N -0.87 -1.73 0.00 0.00 -0.08 -1.26 -5.06 116.55 107.55 2jza n ASP 110 Ca 0.11 -2.11 0.00 0.00 -1.51 0.00 0.00 54.79 51.28 2jza n ASP 110 Cb 0.70 2.86 0.00 0.00 2.34 0.00 0.00 41.12 47.02 2jza n ASP 110 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2jza n SER 111 N -1.35 0.08 -2.58 1.67 7.64 -1.26 -5.00 113.62 112.83 2jza n SER 111 Ca -0.05 -0.76 -0.03 0.00 1.01 0.00 0.00 58.87 59.04 2jza n SER 111 Cb 0.48 0.03 -0.02 0.00 -1.01 0.00 0.00 64.21 63.69 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 -0.03 -3.97 -4.47 6.43 2.03 -1.26 -4.73 116.55 110.55 2jza n ASP 112 Ca 0.00 1.31 -0.41 0.00 0.52 0.00 0.00 54.79 56.21 2jza n ASP 112 Cb 0.17 -5.05 -0.11 0.00 -0.72 0.00 0.00 41.12 35.41 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 -1.08 5.06 0.06 5.18 1.01 -1.26 -5.06 120.40 124.31 2jza s VAL 113 Ca -0.14 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 2jza s VAL 113 Cb 0.01 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2jza s VAL 113 CO 0.75 -0.15 -0.04 0.00 0.00 0.00 0.00 175.10 175.66 2jza s ALA 114 N 1.66 0.60 0.17 5.51 0.00 -1.26 -5.15 121.76 123.30 2jza s ALA 114 Ca 0.05 -1.17 -0.24 0.00 0.00 0.00 0.00 51.96 50.60 2jza s ALA 114 Cb -0.18 0.22 -0.08 0.00 0.00 0.00 0.00 23.12 23.08 2jza s ALA 114 CO 0.09 -0.30 0.75 0.14 0.00 0.00 0.00 175.76 176.44 2jza s VAL 115 N -3.49 4.44 0.45 0.00 -7.23 -1.26 -5.04 120.40 108.27 2jza s VAL 115 Ca 0.05 1.58 -0.22 0.00 -1.81 0.00 0.00 61.98 61.58 2jza s VAL 115 Cb 0.05 -4.06 -0.08 0.00 0.56 0.00 0.00 36.38 32.85 2jza s VAL 115 CO -0.07 0.46 1.08 1.51 -0.31 0.00 0.00 175.10 177.77 2jza s ASP 116 N -1.25 6.39 -0.89 4.85 1.47 -1.26 -4.96 116.67 121.01 2jza s ASP 116 Ca 0.37 2.08 -0.21 0.00 1.18 0.00 0.00 52.55 55.97 2jza s ASP 116 Cb -0.21 -2.58 0.09 0.00 -0.34 0.00 0.00 42.92 39.87 2jza s ASP 116 CO 0.24 -0.75 1.20 0.54 0.68 0.00 0.00 175.17 177.08 2jza s ASN 117 N -1.66 6.47 0.61 2.11 4.22 -1.26 -4.85 114.94 120.57 2jza s ASN 117 Ca 0.64 -1.55 0.39 0.00 -2.14 0.00 0.00 52.86 50.19 2jza s ASN 117 Cb -0.22 -2.47 1.98 0.00 1.28 0.00 0.00 41.25 41.82 2jza s ASN 117 CO 0.27 -1.33 2.22 0.28 -2.04 0.00 0.00 177.10 176.50 2jza h SER 118 N 9.35 0.00 -3.97 3.54 0.02 -2.06 -3.28 113.55 117.15 2jza h SER 118 Ca 0.05 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.37 2jza h SER 118 Cb 1.03 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.17 2jza h SER 118 CO 1.23 0.02 -0.68 -1.58 -1.14 0.00 0.00 176.83 174.68 2jza s GLN 119 N -4.06 1.64 0.79 3.45 0.74 -1.26 -5.11 119.66 115.85 2jza s GLN 119 Ca -0.03 -2.22 -0.12 0.00 0.05 0.00 0.00 55.36 53.04 2jza s GLN 119 Cb 0.12 -3.03 0.06 0.00 1.10 0.00 0.00 33.01 31.27 2jza s GLN 119 CO 0.48 -1.07 1.13 -2.14 -0.55 0.00 0.00 175.29 173.14 2jza s PRO 120 N 0.25 2.17 -0.09 1.67 0.02 -1.24 -5.07 135.00 132.71 2jza s PRO 120 Ca 0.15 0.35 -0.10 0.00 0.02 0.00 0.00 61.00 61.42 2jza s PRO 120 Cb -0.23 -1.95 -0.05 0.00 0.02 0.00 0.00 34.50 32.29 2jza s PRO 120 CO -0.04 -1.49 0.23 -0.51 -0.33 0.00 0.00 177.00 174.86 2jza s LEU 121 N -5.60 4.39 -0.15 -5.54 1.43 -1.26 -5.03 118.68 106.92 2jza s LEU 121 Ca 0.61 0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 54.02 2jza s LEU 121 Cb -0.12 -2.25 -0.07 0.00 0.03 0.00 0.00 46.19 43.78 2jza s LEU 121 CO 0.51 0.34 2.15 -2.65 0.23 0.00 0.00 176.35 176.93 2jza n PRO 122 N 2.18 2.19 0.05 1.29 -0.02 -1.26 -4.84 135.00 134.59 2jza n PRO 122 Ca -0.17 0.68 0.13 0.00 -2.02 0.00 0.00 63.50 62.11 2jza n PRO 122 Cb 0.54 -3.13 0.50 0.00 -0.02 0.00 0.00 33.50 31.39 2jza n PRO 122 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 2jza n LEU 123 N 10.36 0.34 -4.72 2.45 -0.00 -1.26 -4.82 117.00 119.36 2jza n LEU 123 Ca 0.27 0.54 -0.42 0.00 -0.00 0.00 0.00 56.01 56.41 2jza n LEU 123 Cb 0.42 -0.44 -0.04 0.00 -0.00 0.00 0.00 43.42 43.37 2jza n LEU 123 CO 0.67 -0.13 0.74 -1.61 -0.00 0.00 0.00 177.39 177.06 2jza s GLU 124 N -3.06 4.58 -0.68 1.47 2.02 -1.26 -4.99 118.70 116.77 2jza s GLU 124 Ca 0.11 1.56 -0.23 0.00 0.02 0.00 0.00 54.97 56.43 2jza s GLU 124 Cb 0.15 -3.38 0.07 0.00 0.10 0.00 0.00 34.13 31.07 2jza s GLU 124 CO 0.52 -0.00 1.02 -1.58 0.02 0.00 0.00 175.26 175.24 2jza s HIS 125 N 0.52 2.62 0.00 1.61 5.65 -1.26 -4.95 115.29 119.48 2jza s HIS 125 Ca 0.52 -0.50 0.00 0.00 0.25 0.00 0.00 55.06 55.32 2jza s HIS 125 Cb -0.25 -4.35 0.00 0.00 -1.18 0.00 0.00 32.58 26.80 2jza s HIS 125 CO 0.30 -1.71 0.20 1.58 -0.65 0.00 0.00 174.74 174.45 2jza n HIS 126 N 7.94 0.00 -3.61 3.88 -0.00 -1.26 -5.02 115.22 117.16 2jza n HIS 126 Ca -0.02 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.05 2jza n HIS 126 Cb 0.46 -0.04 -0.06 0.00 -0.12 0.00 0.00 29.99 30.23 2jza n HIS 126 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2jza s HIS 127 N -0.47 -0.52 0.17 1.57 2.46 -1.26 -5.14 115.29 112.11 2jza s HIS 127 Ca 0.00 1.13 -0.31 0.00 0.47 0.00 0.00 55.06 56.35 2jza s HIS 127 Cb 0.00 0.38 -0.09 0.00 -0.13 0.00 0.00 32.58 32.74 2jza s HIS 127 CO 0.00 -0.33 1.45 -1.58 -2.47 0.00 0.00 174.74 171.82 2jza s HIS 128 N -0.27 3.14 0.03 3.88 2.46 -1.26 -4.92 115.29 118.34 2jza s HIS 128 Ca -0.00 0.88 -0.20 0.00 0.47 0.00 0.00 55.06 56.21 2jza s HIS 128 Cb -0.03 -3.79 -0.15 0.00 -0.13 0.00 0.00 32.58 28.48 2jza s HIS 128 CO -0.01 -2.75 1.31 0.45 -2.47 0.00 0.00 174.74 171.27 2jza h HIS 129 N 6.29 0.45 0.00 3.88 3.86 -2.06 -3.57 115.15 124.00 2jza h HIS 129 Ca -0.43 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 58.63 2jza h HIS 129 Cb 1.21 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 29.59 2jza h HIS 129 CO 0.64 0.80 0.00 -2.39 0.86 0.00 0.00 177.93 177.84