#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jza h SER 2 N 0.00 -0.95 0.03 6.12 4.64 -2.03 -3.21 113.55 118.15 2jza h SER 2 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2jza h SER 2 Cb 0.00 0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2jza h SER 2 CO 0.00 -0.64 -0.04 0.00 -0.87 0.00 0.00 176.83 175.28 2jza n GLN 3 N -5.25 1.49 -3.93 4.77 10.64 -1.26 -4.53 117.38 119.31 2jza n GLN 3 Ca -0.14 -0.84 -0.32 0.00 -1.83 0.00 0.00 57.00 53.87 2jza n GLN 3 Cb 0.44 -1.48 -0.14 0.00 -0.86 0.00 0.00 30.24 28.21 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 -2.09 3.48 -0.06 2.61 0.52 -1.21 -1.15 118.94 121.04 2jza s TRP 4 Ca 0.36 -2.97 -0.16 0.00 0.02 0.00 0.00 56.10 53.35 2jza s TRP 4 Cb 0.21 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.52 2jza s TRP 4 CO 0.37 -0.86 0.43 0.99 0.02 0.00 0.00 176.95 177.90 2jza s THR 5 N 0.35 5.10 -0.15 2.01 2.01 -0.66 -4.10 115.64 120.21 2jza s THR 5 Ca 0.14 0.87 -0.29 0.00 0.31 0.00 0.00 61.69 62.72 2jza s THR 5 Cb -0.22 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2jza s THR 5 CO -0.04 0.46 1.19 -0.89 -0.69 0.00 0.00 174.62 174.65 2jza s THR 6 N -0.26 4.38 -0.01 -0.82 2.01 -1.26 -1.76 115.64 117.92 2jza s THR 6 Ca 0.24 1.68 -0.00 0.00 0.31 0.00 0.00 61.69 63.92 2jza s THR 6 Cb -0.16 -4.08 -0.00 0.00 0.01 0.00 0.00 72.50 68.27 2jza s THR 6 CO 0.11 -0.11 -0.00 0.58 -0.69 0.00 0.00 174.62 174.51 2jza h VAL 7 N 5.37 0.00 -2.87 3.82 2.07 -1.36 -3.49 116.25 119.79 2jza h VAL 7 Ca -0.27 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2jza h VAL 7 Cb 1.11 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2jza h VAL 7 CO 0.95 0.00 0.32 0.00 0.02 0.00 0.00 177.57 178.86 2jza s LYS 9 N -2.08 4.65 0.00 0.00 1.02 -1.26 -1.56 119.74 120.51 2jza s LYS 9 Ca 0.16 1.69 0.16 0.00 0.02 0.00 0.00 55.97 58.01 2jza s LYS 9 Cb -0.04 -3.26 0.75 0.00 -0.52 0.00 0.00 37.83 34.76 2jza s LYS 9 CO 0.10 0.19 1.50 -0.11 -0.92 0.00 0.00 175.35 176.11 2jza n LEU 10 N 1.92 0.00 0.07 3.17 7.94 -0.25 -1.62 117.00 128.22 2jza n LEU 10 Ca 0.01 0.40 0.12 0.00 -1.11 0.00 0.00 56.01 55.43 2jza n LEU 10 Cb 0.46 -0.40 0.20 0.00 0.53 0.00 0.00 43.42 44.21 2jza n LEU 10 CO 0.53 -0.18 0.41 -0.67 -1.11 0.00 0.00 177.39 176.37 2jza n ASP 11 N -1.40 0.72 -0.06 1.96 2.03 -1.26 -3.83 116.55 114.72 2jza n ASP 11 Ca 0.06 0.18 -0.00 0.00 0.52 0.00 0.00 54.79 55.55 2jza n ASP 11 Cb 0.16 0.04 -0.16 0.00 -0.72 0.00 0.00 41.12 40.44 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 -2.14 0.22 -4.62 1.67 2.03 -0.64 -4.91 116.55 108.16 2jza n ASP 12 Ca 0.04 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.92 2jza n ASP 12 Cb 0.44 1.43 -0.03 0.00 -0.72 0.00 0.00 41.12 42.24 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 -2.92 3.56 0.08 5.18 1.01 -1.10 -4.95 121.20 122.07 2jza s ILE 13 Ca -0.09 0.62 -0.31 0.00 0.00 0.00 0.00 60.65 60.87 2jza s ILE 13 Cb 0.09 -3.62 -0.07 0.00 0.01 0.00 0.00 42.46 38.88 2jza s ILE 13 CO 0.83 -0.30 1.30 -0.76 0.00 0.00 0.00 174.94 176.01 2jza s LEU 14 N 5.79 4.36 0.11 2.97 1.43 -1.26 -4.97 118.68 127.11 2jza s LEU 14 Ca 0.76 2.16 -0.31 0.00 -1.03 0.00 0.00 54.13 55.71 2jza s LEU 14 Cb -0.26 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.30 2jza s LEU 14 CO 0.31 -0.57 1.46 -2.84 0.23 0.00 0.00 176.35 174.94 2jza s PRO 15 N 1.21 4.28 0.00 1.29 0.02 -1.26 -3.18 135.00 137.35 2jza s PRO 15 Ca 0.62 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.79 2jza s PRO 15 Cb -0.33 -3.30 0.00 0.00 0.02 0.00 0.00 34.50 30.89 2jza s PRO 15 CO 0.29 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.85 2jza n GLY 16 N 3.62 1.21 3.76 0.52 0.00 0.24 -4.90 105.19 109.64 2jza n GLY 16 Ca 0.13 -0.37 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 2jza n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jza s THR 17 N -2.00 0.00 -0.28 2.61 -4.23 -0.90 -4.98 115.64 105.86 2jza s THR 17 Ca 0.00 -0.72 -0.16 0.00 -1.18 0.00 0.00 61.69 59.62 2jza s THR 17 Cb 0.00 -1.87 0.11 0.00 1.34 0.00 0.00 72.50 72.08 2jza s THR 17 CO 0.00 0.00 0.84 -0.83 -0.54 0.00 0.00 174.62 174.09 2jza s GLY 18 N -2.89 -0.31 0.34 3.99 0.00 -1.26 0.25 107.32 107.45 2jza s GLY 18 Ca 0.11 2.79 0.03 0.00 0.00 0.00 0.00 44.72 47.65 2jza s GLY 18 CO 0.03 2.48 0.13 -1.34 0.00 0.00 0.00 173.10 174.40 2jza s VAL 19 N 1.44 0.57 0.20 1.40 -7.23 -1.24 -4.33 120.40 111.23 2jza s VAL 19 Ca -0.09 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 57.79 2jza s VAL 19 Cb -0.04 -2.51 -0.08 0.00 0.56 0.00 0.00 36.38 34.30 2jza s VAL 19 CO -0.17 0.00 0.92 0.00 -0.31 0.00 0.00 175.10 175.54 2jza s ALA 21 N -0.94 1.51 -0.68 0.00 0.00 0.12 -4.97 121.76 116.80 2jza s ALA 21 Ca 0.41 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.54 2jza s ALA 21 Cb -0.25 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.22 2jza s ALA 21 CO 0.31 0.03 1.09 -1.17 0.00 0.00 0.00 175.76 176.02 2jza s LEU 22 N 0.81 3.87 -0.33 0.00 1.98 -1.26 -2.60 118.68 121.15 2jza s LEU 22 Ca -0.11 -0.71 -0.08 0.00 -2.89 0.00 0.00 54.13 50.34 2jza s LEU 22 Cb -0.16 -2.52 0.02 0.00 0.66 0.00 0.00 46.19 44.19 2jza s LEU 22 CO 0.02 -1.58 0.13 -0.69 -1.89 0.00 0.00 176.35 172.34 2jza s VAL 23 N 4.72 4.13 0.00 1.68 1.01 -0.39 -4.88 120.40 126.67 2jza s VAL 23 Ca 0.28 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.42 2jza s VAL 23 Cb -0.13 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.01 2jza s VAL 23 CO 0.13 -0.08 0.00 -0.62 0.00 0.00 0.00 175.10 174.53 2jza n GLU 24 N 4.90 0.00 0.00 2.72 -0.58 -1.26 -0.37 120.64 126.05 2jza n GLU 24 Ca -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 2jza n GLU 24 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 2jza n GLU 24 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2jza n GLN 25 N 0.00 1.54 -3.30 3.49 6.02 -1.26 -5.09 117.38 118.78 2jza n GLN 25 Ca 0.00 -0.06 -0.39 0.00 -0.01 0.00 0.00 57.00 56.54 2jza n GLN 25 Cb 0.00 -0.36 -0.06 0.00 1.02 0.00 0.00 30.24 30.84 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 -0.24 4.18 -0.49 -1.09 -1.52 0.50 -4.79 119.66 116.21 2jza s GLN 26 Ca 0.00 0.67 -0.15 0.00 -1.95 0.00 0.00 55.36 53.93 2jza s GLN 26 Cb 0.00 -3.26 0.09 0.00 -0.22 0.00 0.00 33.01 29.62 2jza s GLN 26 CO 0.00 0.59 0.42 -0.65 -0.25 0.00 0.00 175.29 175.39 2jza s GLN 27 N -0.89 2.95 0.01 2.91 -0.21 -1.26 -1.26 119.66 121.91 2jza s GLN 27 Ca 0.28 -1.48 0.08 0.00 0.02 0.00 0.00 55.36 54.26 2jza s GLN 27 Cb -0.19 -4.16 -0.02 0.00 1.00 0.00 0.00 33.01 29.64 2jza s GLN 27 CO 0.17 -1.12 -0.25 0.42 -2.12 0.00 0.00 175.29 172.40 2jza s ILE 28 N 1.61 2.23 -0.17 1.08 1.09 -1.07 -4.56 121.20 121.40 2jza s ILE 28 Ca 0.04 -1.20 -0.07 0.00 -1.10 0.00 0.00 60.65 58.32 2jza s ILE 28 Cb -0.26 -1.83 -0.04 0.00 -1.06 0.00 0.00 42.46 39.27 2jza s ILE 28 CO 0.05 0.48 0.07 0.00 -0.10 0.00 0.00 174.94 175.43 2jza s ALA 29 N -0.72 3.45 -0.46 9.38 0.00 0.53 0.12 121.76 134.06 2jza s ALA 29 Ca 0.11 -0.74 -0.07 0.00 0.00 0.00 0.00 51.96 51.27 2jza s ALA 29 Cb -0.10 -1.90 0.12 0.00 0.00 0.00 0.00 23.12 21.24 2jza s ALA 29 CO 0.01 0.25 0.30 0.08 0.00 0.00 0.00 175.76 176.40 2jza s VAL 30 N 0.14 3.91 -0.06 0.00 1.01 -0.51 -0.96 120.40 123.93 2jza s VAL 30 Ca 0.05 -1.91 -0.30 0.00 0.00 0.00 0.00 61.98 59.83 2jza s VAL 30 Cb -0.12 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2jza s VAL 30 CO 0.00 -0.75 1.19 -0.36 0.00 0.00 0.00 175.10 175.18 2jza s PHE 31 N 1.25 3.21 -0.73 5.22 0.40 0.11 -3.60 117.98 123.85 2jza s PHE 31 Ca 0.07 1.24 -0.04 0.00 -0.60 0.00 0.00 56.93 57.60 2jza s PHE 31 Cb -0.25 -3.41 0.18 0.00 0.51 0.00 0.00 43.02 40.06 2jza s PHE 31 CO -0.02 -1.24 0.57 0.50 0.70 0.00 0.00 175.22 175.73 2jza s ARG 32 N 2.23 2.88 0.15 0.44 3.52 0.14 0.30 118.95 128.60 2jza s ARG 32 Ca 0.55 -2.76 0.27 0.00 -0.13 0.00 0.00 55.73 53.67 2jza s ARG 32 Cb -0.24 -3.86 0.94 0.00 -1.56 0.00 0.00 34.95 30.23 2jza s ARG 32 CO 0.21 -1.21 1.82 -0.35 -0.81 0.00 0.00 175.30 174.96 2jza n PRO 33 N 3.17 0.18 -4.40 5.12 -0.04 -1.26 0.80 135.00 138.58 2jza n PRO 33 Ca 0.13 0.15 -0.25 0.00 -0.04 0.00 0.00 63.50 63.49 2jza n PRO 33 Cb 0.38 -1.71 -0.09 0.00 -0.04 0.00 0.00 33.50 32.04 2jza n PRO 33 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2jza s ARG 34 N -3.07 1.98 0.00 0.54 0.52 -1.26 -4.61 118.95 113.04 2jza s ARG 34 Ca 0.12 -1.75 0.31 0.00 -0.52 0.00 0.00 55.73 53.89 2jza s ARG 34 Cb 0.14 -1.88 1.77 0.00 0.52 0.00 0.00 34.95 35.50 2jza s ARG 34 CO 0.57 0.20 2.16 0.09 0.02 0.00 0.00 175.30 178.35 2jza n ASN 35 N -0.85 0.00 -4.69 0.23 4.13 -1.26 -3.87 115.26 108.95 2jza n ASN 35 Ca -0.05 -0.71 -0.23 0.00 1.68 0.00 0.00 54.58 55.27 2jza n ASN 35 Cb 0.62 -0.10 0.11 0.00 -1.54 0.00 0.00 39.78 38.87 2jza n ASN 35 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2jza s ASP 36 N -2.19 4.35 -0.24 6.41 2.15 -1.26 -4.94 116.67 120.94 2jza s ASP 36 Ca 0.41 -0.46 -0.03 0.00 0.43 0.00 0.00 52.55 52.90 2jza s ASP 36 Cb 0.21 0.10 -0.00 0.00 -0.30 0.00 0.00 42.92 42.93 2jza s ASP 36 CO 0.40 -1.87 2.75 -0.62 -0.17 0.00 0.00 175.17 175.66 2jza n GLU 37 N -2.81 1.99 -4.93 4.34 1.02 -1.26 -4.84 120.64 114.15 2jza n GLU 37 Ca 0.16 -1.51 -0.33 0.00 -0.02 0.00 0.00 57.16 55.46 2jza n GLU 37 Cb 0.61 -1.85 -0.16 0.00 -0.02 0.00 0.00 31.44 30.02 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 -0.77 3.18 0.17 3.49 -0.44 -1.26 -5.07 119.66 118.96 2jza s GLN 38 Ca 0.48 -0.79 0.03 0.00 -2.50 0.00 0.00 55.36 52.57 2jza s GLN 38 Cb 0.29 -2.47 -0.05 0.00 -1.64 0.00 0.00 33.01 29.14 2jza s GLN 38 CO -0.09 0.15 -0.04 0.14 0.50 0.00 0.00 175.29 175.96 2jza s VAL 39 N 0.45 0.95 -0.24 1.34 -7.23 -1.26 -4.14 120.40 110.28 2jza s VAL 39 Ca -0.13 -2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 58.00 2jza s VAL 39 Cb -0.17 -2.05 0.07 0.00 0.56 0.00 0.00 36.38 34.79 2jza s VAL 39 CO 0.06 -0.56 0.04 -0.31 -0.31 0.00 0.00 175.10 174.02 2jza s TYR 40 N -3.47 1.41 -0.54 2.82 2.02 0.15 -4.95 117.35 114.78 2jza s TYR 40 Ca 0.22 -1.25 -0.17 0.00 -0.37 0.00 0.00 57.07 55.49 2jza s TYR 40 Cb 0.05 -1.31 0.10 0.00 -0.40 0.00 0.00 41.96 40.40 2jza s TYR 40 CO 0.03 -0.72 0.58 0.00 -1.57 0.00 0.00 175.55 173.87 2jza s ALA 41 N 1.73 3.51 0.12 3.71 0.00 -1.26 0.10 121.76 129.67 2jza s ALA 41 Ca 0.02 -2.24 0.06 0.00 0.00 0.00 0.00 51.96 49.79 2jza s ALA 41 Cb -0.17 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 2jza s ALA 41 CO -0.14 -2.10 -0.13 0.96 0.00 0.00 0.00 175.76 174.35 2jza s ILE 42 N 2.17 1.28 -1.03 0.00 -4.36 -0.13 -4.04 121.20 115.10 2jza s ILE 42 Ca 0.08 -1.73 -0.16 0.00 -0.26 0.00 0.00 60.65 58.58 2jza s ILE 42 Cb -0.25 -1.53 0.16 0.00 1.25 0.00 0.00 42.46 42.08 2jza s ILE 42 CO 0.06 -0.45 1.21 -0.44 0.24 0.00 0.00 174.94 175.56 2jza s SER 43 N -2.50 6.83 -0.43 4.36 0.01 -0.58 -0.35 113.70 121.04 2jza s SER 43 Ca 0.09 -2.51 0.09 0.00 1.31 0.00 0.00 55.95 54.93 2jza s SER 43 Cb -0.04 -2.38 0.29 0.00 0.21 0.00 0.00 66.02 64.10 2jza s SER 43 CO 0.03 -0.88 0.67 -0.46 0.41 0.00 0.00 173.24 173.01 2jza n ASN 44 N 5.86 1.31 0.10 2.44 0.23 -1.26 -4.20 115.26 119.73 2jza n ASN 44 Ca 0.28 -3.00 0.12 0.00 -0.53 0.00 0.00 54.58 51.45 2jza n ASN 44 Cb 0.46 -0.63 0.26 0.00 -2.08 0.00 0.00 39.78 37.79 2jza n ASN 44 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 2jza h ILE 45 N 1.90 0.00 -3.29 1.53 1.08 -1.87 -3.36 117.51 113.51 2jza h ILE 45 Ca 0.10 -0.58 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 2jza h ILE 45 Cb 0.84 1.38 0.00 0.00 -3.07 0.00 0.00 36.82 35.97 2jza h ILE 45 CO 0.56 0.00 -0.67 -0.67 -0.69 0.00 0.00 178.15 176.68 2jza n ASP 46 N -2.33 -6.91 0.00 1.72 -0.08 -1.26 -0.83 116.55 106.87 2jza n ASP 46 Ca 0.04 0.96 0.11 0.00 -1.51 0.00 0.00 54.79 54.40 2jza n ASP 46 Cb 0.45 -3.78 0.61 0.00 2.34 0.00 0.00 41.12 40.74 2jza n ASP 46 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2jza n PRO 47 N 1.21 0.42 -0.10 -0.67 -0.02 -1.26 -0.65 135.00 133.94 2jza n PRO 47 Ca 0.00 0.05 -0.11 0.00 -2.02 0.00 0.00 63.50 61.42 2jza n PRO 47 Cb 0.00 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 31.83 2jza n PRO 47 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2jza n PHE 48 N -1.22 0.08 -0.06 6.00 7.35 -1.26 -4.63 117.46 123.72 2jza n PHE 48 Ca 0.12 0.03 -0.07 0.00 -0.76 0.00 0.00 57.45 56.77 2jza n PHE 48 Cb 0.16 -1.01 -0.09 0.00 0.35 0.00 0.00 39.48 38.88 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 -2.83 1.69 -1.33 3.13 0.00 -1.17 -5.00 120.51 115.01 2jza n ALA 49 Ca -0.34 -0.78 -0.11 0.00 0.00 0.00 0.00 53.44 52.21 2jza n ALA 49 Cb 1.12 0.02 -0.05 0.00 0.00 0.00 0.00 19.45 20.54 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 -2.53 -1.34 -0.61 0.00 1.13 0.18 -4.80 117.38 109.41 2jza n GLN 50 Ca -0.21 0.87 0.05 0.00 -1.94 0.00 0.00 57.00 55.76 2jza n GLN 50 Cb 0.88 -5.09 0.08 0.00 0.11 0.00 0.00 30.24 26.22 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 1.21 2.44 -3.12 -1.58 0.00 -1.17 -4.95 120.51 113.34 2jza n ALA 51 Ca -0.11 -2.14 -0.14 0.00 0.00 0.00 0.00 53.44 51.04 2jza n ALA 51 Cb 0.51 -0.49 0.07 0.00 0.00 0.00 0.00 19.45 19.54 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 -0.49 -5.49 0.09 0.00 7.64 -0.01 -4.55 113.62 110.82 2jza n SER 52 Ca 0.09 -0.63 0.13 0.00 1.01 0.00 0.00 58.87 59.47 2jza n SER 52 Cb 0.78 -4.76 0.44 0.00 -1.01 0.00 0.00 64.21 59.65 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 -3.20 0.53 0.20 0.44 0.24 -1.24 -0.62 118.33 114.68 2jza n VAL 53 Ca -0.10 -0.23 0.09 0.00 -2.04 0.00 0.00 64.34 62.06 2jza n VAL 53 Cb 0.62 -0.60 0.32 0.00 -1.47 0.00 0.00 33.84 32.71 2jza n VAL 53 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2jza h LEU 54 N 0.00 0.00 0.10 1.34 3.38 -1.83 -3.12 115.31 115.18 2jza h LEU 54 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 2jza h LEU 54 Cb 0.69 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2jza h LEU 54 CO 0.00 0.26 -1.97 -1.20 0.09 0.00 0.00 178.44 175.62 2jza n SER 55 N -3.29 1.90 -1.01 -0.43 7.64 -0.75 -4.03 113.62 113.66 2jza n SER 55 Ca 0.01 0.23 -0.01 0.00 1.01 0.00 0.00 58.87 60.12 2jza n SER 55 Cb 0.52 -0.71 0.01 0.00 -1.01 0.00 0.00 64.21 63.02 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 -3.40 1.05 0.00 1.43 1.74 0.21 -4.69 116.66 113.00 2jza n ARG 56 Ca -0.30 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.68 2jza n ARG 56 Cb 1.05 -1.07 0.00 0.00 -1.02 0.00 0.00 32.46 31.42 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 0.42 1.86 3.35 -0.13 0.00 -1.18 -4.89 105.19 104.61 2jza n GLY 57 Ca 0.02 -1.84 -0.45 0.00 0.00 0.00 0.00 46.02 43.75 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 3.37 5.18 -0.86 -0.61 -1.09 0.93 -4.91 121.20 123.22 2jza s ILE 58 Ca 0.00 -1.26 -0.23 0.00 -2.23 0.00 0.00 60.65 56.93 2jza s ILE 58 Cb 0.00 -4.27 0.07 0.00 -1.58 0.00 0.00 42.46 36.68 2jza s ILE 58 CO 0.00 -0.77 1.24 -0.69 -1.23 0.00 0.00 174.94 173.48 2jza s VAL 59 N 1.72 4.14 0.55 2.92 1.01 -1.26 0.18 120.40 129.66 2jza s VAL 59 Ca 0.04 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2jza s VAL 59 Cb -0.27 -4.89 0.03 0.00 0.00 0.00 0.00 36.38 31.26 2jza s VAL 59 CO 0.05 -1.72 0.28 0.00 0.00 0.00 0.00 175.10 173.70 2jza s ALA 60 N 4.46 4.43 0.20 5.51 0.00 -0.26 -4.95 121.76 131.14 2jza s ALA 60 Ca 0.35 -0.78 0.10 0.00 0.00 0.00 0.00 51.96 51.63 2jza s ALA 60 Cb -0.07 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 2jza s ALA 60 CO 0.00 -0.32 -0.13 -1.21 0.00 0.00 0.00 175.76 174.11 2jza s GLU 61 N -4.18 1.93 -0.27 0.00 2.02 -1.26 -0.50 118.70 116.45 2jza s GLU 61 Ca 0.22 -1.39 0.13 0.00 0.02 0.00 0.00 54.97 53.94 2jza s GLU 61 Cb -0.02 -2.05 0.47 0.00 0.10 0.00 0.00 34.13 32.64 2jza s GLU 61 CO 0.14 0.41 1.16 1.58 0.02 0.00 0.00 175.26 178.57 2jza n HIS 62 N -0.09 2.05 -1.98 1.61 -0.00 -0.42 -4.86 115.22 111.54 2jza n HIS 62 Ca -0.10 -2.11 -0.02 0.00 0.46 0.00 0.00 57.72 55.95 2jza n HIS 62 Cb 0.56 -0.29 -0.02 0.00 -0.12 0.00 0.00 29.99 30.12 2jza n HIS 62 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2jza n GLN 63 N -0.66 -2.62 0.00 1.57 6.02 -1.26 -4.49 117.38 115.94 2jza n GLN 63 Ca 0.30 2.17 0.00 0.00 -0.01 0.00 0.00 57.00 59.46 2jza n GLN 63 Cb 0.91 -3.08 0.00 0.00 1.02 0.00 0.00 30.24 29.08 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 0.95 0.00 -4.77 1.08 2.03 -1.26 -4.91 116.55 109.67 2jza n ASP 64 Ca -0.16 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 54.77 2jza n ASP 64 Cb 0.25 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.60 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 0.00 7.04 -0.26 1.67 1.01 -1.26 -5.03 116.67 119.84 2jza s ASP 65 Ca 0.00 2.05 -0.09 0.00 0.71 0.00 0.00 52.55 55.22 2jza s ASP 65 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2jza s ASP 65 CO 0.00 -0.29 0.12 -0.76 0.21 0.00 0.00 175.17 174.45 2jza s LEU 66 N -2.15 3.69 -0.18 1.23 1.43 -1.26 -1.30 118.68 120.14 2jza s LEU 66 Ca 0.52 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2jza s LEU 66 Cb -0.24 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.01 2jza s LEU 66 CO 0.30 -0.04 -0.12 0.26 0.23 0.00 0.00 176.35 176.99 2jza s TRP 67 N 1.64 2.29 -0.13 0.29 0.52 0.35 -1.06 118.94 122.84 2jza s TRP 67 Ca 0.07 -1.41 -0.17 0.00 0.02 0.00 0.00 56.10 54.61 2jza s TRP 67 Cb -0.15 -1.61 -0.04 0.00 -1.15 0.00 0.00 33.47 30.51 2jza s TRP 67 CO 0.07 -0.71 0.42 0.54 0.02 0.00 0.00 176.95 177.29 2jza s VAL 68 N 1.44 5.22 -0.29 4.03 0.11 -0.07 -1.10 120.40 129.74 2jza s VAL 68 Ca 0.02 0.84 -0.08 0.00 -2.93 0.00 0.00 61.98 59.83 2jza s VAL 68 Cb -0.15 -3.76 -0.01 0.00 -1.53 0.00 0.00 36.38 30.93 2jza s VAL 68 CO -0.09 0.35 0.10 0.00 -3.33 0.00 0.00 175.10 172.13 2jza s ALA 69 N 0.53 3.16 0.18 1.54 0.00 0.13 -1.11 121.76 126.18 2jza s ALA 69 Ca 0.23 -1.34 -0.29 0.00 0.00 0.00 0.00 51.96 50.56 2jza s ALA 69 Cb -0.15 -2.20 -0.08 0.00 0.00 0.00 0.00 23.12 20.70 2jza s ALA 69 CO 0.09 -0.79 0.90 -1.54 0.00 0.00 0.00 175.76 174.41 2jza s SER 70 N 1.57 7.52 0.34 0.00 1.04 -1.20 -0.05 113.70 122.93 2jza s SER 70 Ca 0.04 1.81 0.12 0.00 0.48 0.00 0.00 55.95 58.40 2jza s SER 70 Cb -0.17 -2.57 0.62 0.00 0.10 0.00 0.00 66.02 64.00 2jza s SER 70 CO 0.04 0.10 1.76 1.55 0.98 0.00 0.00 173.24 177.67 2jza h PRO 71 N 4.68 0.00 0.00 4.02 0.13 -1.90 0.14 132.00 139.06 2jza h PRO 71 Ca -0.45 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.56 2jza h PRO 71 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2jza h PRO 71 CO 0.69 0.44 -0.76 -0.07 -0.23 0.00 0.00 178.00 178.08 2jza h LEU 72 N 0.00 0.00 0.06 1.56 3.38 -1.93 -3.39 115.31 114.99 2jza h LEU 72 Ca -0.00 -0.51 -0.26 0.00 0.09 0.00 0.00 57.88 57.19 2jza h LEU 72 Cb 0.79 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 2jza h LEU 72 CO 0.06 1.19 -1.27 0.11 0.09 0.00 0.00 178.44 178.62 2jza h LYS 73 N -1.00 0.12 -4.71 1.13 1.79 -1.96 -3.48 116.57 108.46 2jza h LYS 73 Ca -0.19 -0.21 -0.36 0.00 -2.18 0.00 0.00 60.65 57.72 2jza h LYS 73 Cb 1.02 0.08 0.09 0.00 -1.58 0.00 0.00 32.23 31.84 2jza h LYS 73 CO -0.11 1.01 -0.58 1.63 -1.08 0.00 0.00 179.45 180.32 2jza n LYS 74 N -3.38 -5.85 -4.51 3.15 5.02 0.50 -4.99 118.16 108.10 2jza n LYS 74 Ca -0.08 0.77 -0.30 0.00 -2.02 0.00 0.00 58.31 56.68 2jza n LYS 74 Cb 1.00 -5.49 -0.12 0.00 -0.02 0.00 0.00 35.03 30.39 2jza n LYS 74 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2jza s GLN 75 N -5.89 2.02 -0.32 1.97 -0.21 -1.26 -4.88 119.66 111.08 2jza s GLN 75 Ca 0.41 -1.03 -0.20 0.00 0.02 0.00 0.00 55.36 54.56 2jza s GLN 75 Cb -0.18 -2.19 -0.01 0.00 1.00 0.00 0.00 33.01 31.63 2jza s GLN 75 CO 0.50 0.52 0.59 -1.01 -2.12 0.00 0.00 175.29 173.78 2jza s HIS 76 N -1.02 3.19 -0.24 0.91 3.76 -1.26 -3.22 115.29 117.41 2jza s HIS 76 Ca 0.16 0.43 -0.07 0.00 -0.15 0.00 0.00 55.06 55.43 2jza s HIS 76 Cb -0.11 -2.99 -0.03 0.00 1.11 0.00 0.00 32.58 30.56 2jza s HIS 76 CO 0.07 -0.51 0.07 -0.06 -0.85 0.00 0.00 174.74 173.46 2jza s PHE 77 N 2.56 3.10 -0.05 1.40 0.08 -0.27 -0.71 117.98 124.09 2jza s PHE 77 Ca 0.23 -0.35 -0.25 0.00 0.12 0.00 0.00 56.93 56.68 2jza s PHE 77 Cb -0.15 -2.22 -0.03 0.00 -0.57 0.00 0.00 43.02 40.05 2jza s PHE 77 CO 0.13 -0.29 0.79 0.50 -0.10 0.00 0.00 175.22 176.24 2jza s ARG 78 N 1.46 4.47 -0.75 0.44 3.52 -0.33 -0.89 118.95 126.87 2jza s ARG 78 Ca 0.06 1.04 -0.26 0.00 -0.13 0.00 0.00 55.73 56.44 2jza s ARG 78 Cb -0.15 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.76 2jza s ARG 78 CO 0.04 0.03 1.89 -0.51 -0.81 0.00 0.00 175.30 175.93 2jza s LEU 79 N 0.86 3.23 0.42 -0.88 1.43 -0.22 -3.95 118.68 119.57 2jza s LEU 79 Ca 0.42 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 2jza s LEU 79 Cb -0.19 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.49 2jza s LEU 79 CO 0.21 -2.52 0.00 0.00 0.23 0.00 0.00 176.35 174.27 2jza n TYR 80 N 13.21 -4.47 0.00 0.29 9.36 -1.26 -4.85 117.16 129.43 2jza n TYR 80 Ca 0.29 1.44 0.00 0.00 3.32 0.00 0.00 57.90 62.95 2jza n TYR 80 Cb 0.50 3.64 0.00 0.00 -0.63 0.00 0.00 39.34 42.84 2jza n TYR 80 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2jza n ASP 81 N -3.36 0.00 -1.41 2.98 8.00 -1.25 -4.80 116.55 116.71 2jza n ASP 81 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 2jza n ASP 81 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jza n GLY 82 N 0.98 0.88 3.66 0.44 0.00 -1.11 -4.08 105.19 105.96 2jza n GLY 82 Ca 0.00 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 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 2.45 -0.08 1.61 0.40 -1.26 -3.70 117.98 117.38 2jza s PHE 83 Ca 0.03 0.62 -0.05 0.00 -0.60 0.00 0.00 56.93 56.93 2jza s PHE 83 Cb 0.12 -3.70 -0.04 0.00 0.51 0.00 0.00 43.02 39.91 2jza s PHE 83 CO -0.03 -2.72 0.13 0.00 0.70 0.00 0.00 175.22 173.30 2jza h LEU 85 N 4.67 -0.26 0.00 0.00 5.85 -1.30 -3.42 115.31 120.86 2jza h LEU 85 Ca -0.53 0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.09 2jza h LEU 85 Cb 1.21 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 2jza h LEU 85 CO 0.60 -0.04 -0.65 1.05 -0.34 0.00 0.00 178.44 179.06 2jza h GLU 86 N -0.59 0.00 0.00 1.25 9.09 -1.96 -3.49 114.58 118.88 2jza h GLU 86 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.38 2jza h GLU 86 Cb 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 2jza h GLU 86 CO 0.05 0.82 0.00 -3.47 0.05 0.00 0.00 179.01 176.46 2jza n ASP 87 N -4.54 0.30 -2.55 3.06 2.03 -1.26 -5.10 116.55 108.49 2jza n ASP 87 Ca -0.19 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.08 2jza n ASP 87 Cb 0.52 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.94 2jza n ASP 87 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jza n GLY 88 N 5.00 -0.09 0.26 0.27 0.00 -1.26 -4.44 105.19 104.92 2jza n GLY 88 Ca 0.00 -0.05 0.12 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 1.23 1.31 0.00 4.61 0.00 -1.99 -3.38 119.26 121.05 2jza h ALA 89 Ca -0.45 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2jza h ALA 89 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2jza h ALA 89 CO -0.16 0.17 -0.12 0.66 0.00 0.00 0.00 179.25 179.80 2jza n TYR 90 N -3.70 -0.91 -2.90 0.00 4.01 -1.26 -5.10 117.16 107.31 2jza n TYR 90 Ca -0.02 0.16 -0.09 0.00 -0.16 0.00 0.00 57.90 57.79 2jza n TYR 90 Cb 0.25 0.25 0.01 0.00 -0.31 0.00 0.00 39.34 39.54 2jza n TYR 90 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2jza n SER 91 N -3.36 -7.67 -4.73 7.72 7.64 -1.26 -4.97 113.62 107.00 2jza n SER 91 Ca 0.00 0.69 -0.29 0.00 1.01 0.00 0.00 58.87 60.28 2jza n SER 91 Cb 0.06 -4.84 0.14 0.00 -1.01 0.00 0.00 64.21 58.56 2jza n SER 91 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2jza s VAL 92 N -2.17 2.53 0.02 0.44 -7.23 -1.24 -4.80 120.40 107.96 2jza s VAL 92 Ca 0.19 0.17 -0.04 0.00 -1.81 0.00 0.00 61.98 60.49 2jza s VAL 92 Cb -0.05 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.13 2jza s VAL 92 CO 0.75 -0.23 0.24 0.00 -0.31 0.00 0.00 175.10 175.56 2jza s ALA 93 N -3.00 3.90 -0.26 1.32 0.00 -1.26 -2.74 121.76 119.72 2jza s ALA 93 Ca 0.63 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.93 2jza s ALA 93 Cb -0.17 -1.98 0.07 0.00 0.00 0.00 0.00 23.12 21.04 2jza s ALA 93 CO 0.56 0.71 -0.03 0.00 0.00 0.00 0.00 175.76 177.00 2jza s ALA 94 N -1.37 2.12 0.25 0.00 0.00 -1.26 -1.52 121.76 119.97 2jza s ALA 94 Ca 0.30 -1.58 -0.22 0.00 0.00 0.00 0.00 51.96 50.46 2jza s ALA 94 Cb -0.13 -1.54 -0.09 0.00 0.00 0.00 0.00 23.12 21.37 2jza s ALA 94 CO 0.19 -1.30 0.79 0.71 0.00 0.00 0.00 175.76 176.15 2jza s TYR 95 N 1.31 3.67 0.23 0.00 2.02 -1.26 -4.98 117.35 118.34 2jza s TYR 95 Ca -0.03 1.50 -0.30 0.00 -0.37 0.00 0.00 57.07 57.88 2jza s TYR 95 Cb -0.19 -2.71 -0.09 0.00 -0.40 0.00 0.00 41.96 38.58 2jza s TYR 95 CO -0.08 0.31 1.26 0.34 -1.57 0.00 0.00 175.55 175.81 2jza s ASP 96 N -1.62 6.96 0.03 2.29 2.15 -1.26 -4.81 116.67 120.41 2jza s ASP 96 Ca 0.45 2.40 0.06 0.00 0.43 0.00 0.00 52.55 55.88 2jza s ASP 96 Cb -0.17 -2.62 -0.02 0.00 -0.30 0.00 0.00 42.92 39.81 2jza s ASP 96 CO 0.22 -0.45 -0.17 0.42 -0.17 0.00 0.00 175.17 175.02 2jza s THR 97 N -0.27 1.33 0.00 1.71 -4.23 -1.26 0.17 115.64 113.09 2jza s THR 97 Ca 0.53 -1.01 -0.00 0.00 -1.18 0.00 0.00 61.69 60.03 2jza s THR 97 Cb -0.36 -1.17 -0.00 0.00 1.34 0.00 0.00 72.50 72.31 2jza s THR 97 CO 0.41 0.13 -0.00 0.00 -0.54 0.00 0.00 174.62 174.62 2jza s GLN 98 N -1.02 0.06 -0.48 3.99 -2.07 0.42 -4.99 119.66 115.57 2jza s GLN 98 Ca 0.04 -0.10 -0.05 0.00 -1.82 0.00 0.00 55.36 53.43 2jza s GLN 98 Cb -0.08 0.02 0.12 0.00 -1.09 0.00 0.00 33.01 31.99 2jza s GLN 98 CO 0.01 -0.01 0.31 0.08 -1.32 0.00 0.00 175.29 174.36 2jza s VAL 99 N -0.26 3.74 0.00 3.63 1.01 -1.26 -0.97 120.40 126.29 2jza s VAL 99 Ca -0.03 -2.12 0.00 0.00 0.00 0.00 0.00 61.98 59.83 2jza s VAL 99 Cb -0.02 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2jza s VAL 99 CO -0.00 -0.76 0.25 1.07 0.00 0.00 0.00 175.10 175.66 2jza n THR 100 N 4.51 0.00 -2.08 3.92 5.66 -1.25 -4.75 114.28 120.29 2jza n THR 100 Ca -0.02 -0.30 0.03 0.00 -3.05 0.00 0.00 64.05 60.71 2jza n THR 100 Cb 0.41 1.34 0.04 0.00 -1.55 0.00 0.00 70.33 70.57 2jza n THR 100 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jza n ASN 101 N -0.09 0.78 0.00 1.09 2.85 -1.26 -4.95 115.26 113.68 2jza n ASN 101 Ca 0.00 -2.27 0.00 0.00 -0.11 0.00 0.00 54.58 52.20 2jza n ASN 101 Cb 0.08 -0.29 0.00 0.00 1.24 0.00 0.00 39.78 40.81 2jza n ASN 101 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2jza n GLY 102 N -0.03 2.53 3.85 8.20 0.00 -1.26 -4.94 105.19 113.54 2jza n GLY 102 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.67 5.82 -0.25 1.61 0.01 -1.26 -1.09 114.94 119.11 2jza s ASN 103 Ca 0.00 0.01 -0.20 0.00 -0.71 0.00 0.00 52.86 51.96 2jza s ASN 103 Cb 0.00 -1.62 -0.02 0.00 0.41 0.00 0.00 41.25 40.02 2jza s ASN 103 CO 0.00 0.09 0.61 -0.69 -1.51 0.00 0.00 177.10 175.60 2jza s VAL 104 N -1.68 5.00 -0.15 1.60 1.01 -0.60 -3.87 120.40 121.71 2jza s VAL 104 Ca 0.32 1.09 -0.01 0.00 0.00 0.00 0.00 61.98 63.38 2jza s VAL 104 Cb -0.11 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 2jza s VAL 104 CO 0.25 0.04 -0.12 -1.10 0.00 0.00 0.00 175.10 174.17 2jza s GLN 105 N 2.45 3.35 0.14 2.72 -0.21 -0.14 -0.83 119.66 127.15 2jza s GLN 105 Ca 0.25 -0.68 0.06 0.00 0.02 0.00 0.00 55.36 55.00 2jza s GLN 105 Cb -0.16 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.11 2jza s GLN 105 CO 0.09 0.09 0.05 0.96 -2.12 0.00 0.00 175.29 174.36 2jza s ILE 106 N 0.66 4.11 -0.54 1.08 -0.00 -0.72 -0.44 121.20 125.35 2jza s ILE 106 Ca -0.06 -1.14 -0.27 0.00 -0.00 0.00 0.00 60.65 59.18 2jza s ILE 106 Cb -0.15 -3.04 0.03 0.00 -0.00 0.00 0.00 42.46 39.30 2jza s ILE 106 CO 0.02 -0.02 1.07 -0.55 -0.00 0.00 0.00 174.94 175.46 2jza s SER 107 N -2.76 6.45 -0.20 4.36 0.15 0.13 -1.65 113.70 120.18 2jza s SER 107 Ca 0.28 0.03 -0.28 0.00 0.70 0.00 0.00 55.95 56.69 2jza s SER 107 Cb -0.10 -2.50 -0.00 0.00 -1.71 0.00 0.00 66.02 61.70 2jza s SER 107 CO 0.20 -1.30 0.97 0.27 1.20 0.00 0.00 173.24 174.58 2jza s ILE 108 N 4.39 4.76 -0.25 6.45 -5.25 -0.30 -4.45 121.20 126.54 2jza s ILE 108 Ca 0.39 1.89 0.13 0.00 -0.99 0.00 0.00 60.65 62.07 2jza s ILE 108 Cb -0.09 -4.25 0.55 0.00 2.95 0.00 0.00 42.46 41.61 2jza s ILE 108 CO 0.25 -0.10 1.50 0.00 -1.79 0.00 0.00 174.94 174.80 2jza n ALA 109 N 5.85 3.75 -1.77 2.27 0.00 -1.26 -4.95 120.51 124.40 2jza n ALA 109 Ca 0.09 -2.65 -0.39 0.00 0.00 0.00 0.00 53.44 50.49 2jza n ALA 109 Cb 0.47 -0.81 -0.04 0.00 0.00 0.00 0.00 19.45 19.07 2jza n ALA 109 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jza s ASP 110 N -2.05 7.10 0.00 0.00 2.15 -1.26 -4.98 116.67 117.62 2jza s ASP 110 Ca 0.45 2.20 0.00 0.00 0.43 0.00 0.00 52.55 55.63 2jza s ASP 110 Cb 0.38 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 2jza s ASP 110 CO 0.06 -0.26 0.00 -1.20 -0.17 0.00 0.00 175.17 173.60 2jza n SER 111 N 0.78 0.00 -3.47 -0.34 7.64 -1.26 -5.10 113.62 111.88 2jza n SER 111 Ca 0.01 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.79 2jza n SER 111 Cb 0.46 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.57 2jza n SER 111 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2jza s ASP 112 N -0.64 0.26 -0.02 6.43 1.01 -1.26 -5.08 116.67 117.37 2jza s ASP 112 Ca 0.00 0.39 0.00 0.00 0.71 0.00 0.00 52.55 53.65 2jza s ASP 112 Cb 0.00 1.05 0.02 0.00 1.01 0.00 0.00 42.92 45.00 2jza s ASP 112 CO 0.00 -0.28 0.00 0.54 0.21 0.00 0.00 175.17 175.64 2jza s VAL 113 N 2.52 0.10 -0.66 -1.27 0.11 -1.26 -5.11 120.40 114.83 2jza s VAL 113 Ca 0.08 0.07 -0.16 0.00 -2.93 0.00 0.00 61.98 59.05 2jza s VAL 113 Cb -0.14 -0.17 0.16 0.00 -1.53 0.00 0.00 36.38 34.69 2jza s VAL 113 CO -0.14 0.10 0.64 0.00 -3.33 0.00 0.00 175.10 172.37 2jza s ALA 114 N 0.71 3.78 0.81 1.54 0.00 -1.26 -4.94 121.76 122.40 2jza s ALA 114 Ca -0.07 -2.81 -0.12 0.00 0.00 0.00 0.00 51.96 48.97 2jza s ALA 114 Cb -0.10 -3.41 0.08 0.00 0.00 0.00 0.00 23.12 19.69 2jza s ALA 114 CO -0.02 -2.18 1.15 0.14 0.00 0.00 0.00 175.76 174.86 2jza s VAL 115 N 1.20 2.30 0.00 0.00 -7.23 -1.26 -5.09 120.40 110.33 2jza s VAL 115 Ca 0.10 0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.37 2jza s VAL 115 Cb -0.21 -3.03 0.00 0.00 0.56 0.00 0.00 36.38 33.69 2jza s VAL 115 CO -0.02 -0.13 0.00 -0.67 -0.31 0.00 0.00 175.10 173.98 2jza n ASP 116 N -3.36 0.00 -4.63 4.85 2.03 -1.26 -4.98 116.55 109.19 2jza n ASP 116 Ca 0.07 -0.94 -0.43 0.00 0.52 0.00 0.00 54.79 54.01 2jza n ASP 116 Cb 0.60 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.98 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 -1.00 6.87 0.12 1.67 4.22 -1.26 -4.89 114.94 120.66 2jza s ASN 117 Ca 0.00 0.97 -0.14 0.00 -2.14 0.00 0.00 52.86 51.55 2jza s ASN 117 Cb 0.00 -2.54 -0.06 0.00 1.28 0.00 0.00 41.25 39.93 2jza s ASN 117 CO 0.00 -0.95 1.47 -1.28 -2.04 0.00 0.00 177.10 174.30 2jza h SER 118 N 8.35 0.81 -3.36 3.54 0.87 -2.00 -3.41 113.55 118.35 2jza h SER 118 Ca -0.21 -0.43 -0.57 0.00 -1.23 0.00 0.00 61.79 59.34 2jza h SER 118 Cb 1.06 -0.23 -0.07 0.00 -0.44 0.00 0.00 62.40 62.73 2jza h SER 118 CO 1.05 1.07 0.01 0.00 -0.53 0.00 0.00 176.83 178.43 2jza s GLN 119 N -4.51 4.36 1.04 2.24 0.00 -1.26 -5.07 119.66 116.45 2jza s GLN 119 Ca -0.12 0.67 -0.17 0.00 -0.00 0.00 0.00 55.36 55.74 2jza s GLN 119 Cb 0.10 -3.47 0.22 0.00 0.00 0.00 0.00 33.01 29.86 2jza s GLN 119 CO 0.84 0.04 1.22 -2.14 0.00 0.00 0.00 175.29 175.25 2jza s PRO 120 N 0.94 0.06 -0.01 9.60 0.02 -1.26 -5.05 135.00 139.31 2jza s PRO 120 Ca 0.32 -0.19 -0.17 0.00 0.02 0.00 0.00 61.00 60.97 2jza s PRO 120 Cb -0.16 -1.76 -0.06 0.00 0.02 0.00 0.00 34.50 32.54 2jza s PRO 120 CO 0.14 -2.84 0.49 -0.51 -0.33 0.00 0.00 177.00 173.95 2jza s LEU 121 N -6.28 4.44 -0.06 -5.54 1.02 -1.26 -5.02 118.68 105.98 2jza s LEU 121 Ca 0.71 1.03 -0.29 0.00 0.02 0.00 0.00 54.13 55.60 2jza s LEU 121 Cb -0.07 -2.73 -0.06 0.00 0.02 0.00 0.00 46.19 43.34 2jza s LEU 121 CO 0.54 0.21 1.87 -2.16 0.02 0.00 0.00 176.35 176.83 2jza s PRO 122 N -0.60 3.95 0.58 1.29 0.04 -1.26 -4.99 135.00 134.02 2jza s PRO 122 Ca 0.26 2.27 -0.04 0.00 0.04 0.00 0.00 61.00 63.53 2jza s PRO 122 Cb -0.17 -4.13 0.02 0.00 0.04 0.00 0.00 34.50 30.26 2jza s PRO 122 CO 0.15 -1.15 0.87 -0.48 0.04 0.00 0.00 177.00 176.43 2jza s LEU 123 N 5.03 3.23 -0.06 -3.56 0.05 -1.26 -5.09 118.68 117.02 2jza s LEU 123 Ca 0.84 0.55 0.06 0.00 0.05 0.00 0.00 54.13 55.62 2jza s LEU 123 Cb -0.36 -3.36 -0.01 0.00 -2.05 0.00 0.00 46.19 40.41 2jza s LEU 123 CO 0.36 -1.10 -0.23 -0.70 -0.55 0.00 0.00 176.35 174.12 2jza s GLU 124 N -4.95 2.56 -0.18 1.48 2.12 -1.26 -5.10 118.70 113.37 2jza s GLU 124 Ca 0.54 -0.87 -0.05 0.00 0.36 0.00 0.00 54.97 54.96 2jza s GLU 124 Cb -0.10 -2.21 0.06 0.00 0.26 0.00 0.00 34.13 32.14 2jza s GLU 124 CO 0.43 0.42 0.09 -1.58 -0.54 0.00 0.00 175.26 174.08 2jza s HIS 125 N -0.24 0.30 0.06 5.30 2.46 -1.26 -5.12 115.29 116.79 2jza s HIS 125 Ca -0.01 -0.43 -0.32 0.00 0.47 0.00 0.00 55.06 54.78 2jza s HIS 125 Cb -0.13 -0.75 -0.11 0.00 -0.13 0.00 0.00 32.58 31.46 2jza s HIS 125 CO 0.03 -0.55 1.85 0.72 -2.47 0.00 0.00 174.74 174.32 2jza n HIS 126 N 5.25 2.50 -1.72 3.88 -0.00 -1.26 -4.90 115.22 118.97 2jza n HIS 126 Ca -0.07 -0.13 -0.42 0.00 -0.00 0.00 0.00 57.72 57.10 2jza n HIS 126 Cb 0.48 -2.71 -0.03 0.00 -0.00 0.00 0.00 29.99 27.73 2jza n HIS 126 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2jza s HIS 127 N 3.22 2.37 -0.42 4.41 -3.43 -1.26 -4.96 115.29 115.22 2jza s HIS 127 Ca 0.86 0.08 -0.17 0.00 -0.80 0.00 0.00 55.06 55.03 2jza s HIS 127 Cb -0.54 -4.17 0.02 0.00 -1.43 0.00 0.00 32.58 26.46 2jza s HIS 127 CO 0.42 -4.72 0.44 -1.01 -2.00 0.00 0.00 174.74 167.87 2jza s HIS 128 N 2.27 3.17 -0.08 0.38 3.76 -1.26 -5.02 115.29 118.51 2jza s HIS 128 Ca 0.79 -0.40 -0.09 0.00 -0.15 0.00 0.00 55.06 55.21 2jza s HIS 128 Cb -0.47 -2.91 0.02 0.00 1.11 0.00 0.00 32.58 30.33 2jza s HIS 128 CO 0.35 -0.71 0.25 -1.58 -0.85 0.00 0.00 174.74 172.20 2jza s HIS 129 N 2.13 -0.24 -2.47 1.40 5.04 -1.26 -5.34 115.29 114.55 2jza s HIS 129 Ca 0.12 0.56 0.28 0.00 -1.54 0.00 0.00 55.06 54.48 2jza s HIS 129 Cb -0.17 0.08 1.10 0.00 0.04 0.00 0.00 32.58 33.63 2jza s HIS 129 CO 0.13 -0.18 1.77 1.58 -2.34 0.00 0.00 174.74 175.71