#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jza s SER 2 N 0.00 5.05 -0.25 6.12 0.01 -1.26 -4.51 113.70 118.86 2jza s SER 2 Ca 0.00 -2.65 -0.29 0.00 1.31 0.00 0.00 55.95 54.32 2jza s SER 2 Cb 0.00 -1.80 -0.02 0.00 0.21 0.00 0.00 66.02 64.41 2jza s SER 2 CO 0.00 -0.39 1.56 -1.58 0.41 0.00 0.00 173.24 173.24 2jza s GLN 3 N 0.23 3.78 -0.44 12.44 2.00 0.16 -4.53 119.66 133.30 2jza s GLN 3 Ca 0.15 1.53 -0.28 0.00 -2.00 0.00 0.00 55.36 54.76 2jza s GLN 3 Cb -0.22 -4.01 -0.02 0.00 0.80 0.00 0.00 33.01 29.56 2jza s GLN 3 CO -0.03 -1.31 1.88 -1.58 -0.50 0.00 0.00 175.29 173.75 2jza s TRP 4 N 5.15 1.68 0.06 1.67 0.52 -1.26 -1.80 118.94 124.96 2jza s TRP 4 Ca 0.68 0.76 -0.07 0.00 0.02 0.00 0.00 56.10 57.49 2jza s TRP 4 Cb -0.23 -4.06 -0.05 0.00 -1.15 0.00 0.00 33.47 27.98 2jza s TRP 4 CO 0.28 -2.72 0.33 0.95 0.02 0.00 0.00 176.95 175.82 2jza s THR 5 N 8.13 5.20 -0.24 2.01 -4.23 0.11 -4.84 115.64 121.78 2jza s THR 5 Ca 0.77 0.22 -0.26 0.00 -1.18 0.00 0.00 61.69 61.25 2jza s THR 5 Cb -0.19 -3.61 -0.00 0.00 1.34 0.00 0.00 72.50 70.04 2jza s THR 5 CO 0.29 0.27 0.89 -0.89 -0.54 0.00 0.00 174.62 174.63 2jza s THR 6 N -1.41 4.79 0.00 3.99 2.01 -1.26 -1.44 115.64 122.32 2jza s THR 6 Ca 0.32 1.69 0.00 0.00 0.31 0.00 0.00 61.69 64.01 2jza s THR 6 Cb -0.13 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.21 2jza s THR 6 CO 0.19 -0.11 0.00 0.52 -0.69 0.00 0.00 174.62 174.53 2jza n VAL 7 N 5.28 0.00 -3.86 3.82 0.31 0.24 -4.68 118.33 119.44 2jza n VAL 7 Ca 0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.32 2jza n VAL 7 Cb 0.47 -0.20 -0.00 0.00 -0.91 0.00 0.00 33.84 33.19 2jza n VAL 7 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jza s LYS 9 N -3.13 4.55 0.58 0.00 1.02 -1.26 -1.43 119.74 120.07 2jza s LYS 9 Ca 0.15 1.70 0.37 0.00 0.02 0.00 0.00 55.97 58.20 2jza s LYS 9 Cb -0.05 -3.31 1.70 0.00 -0.52 0.00 0.00 37.83 35.65 2jza s LYS 9 CO 0.10 -0.02 2.11 1.25 -0.92 0.00 0.00 175.35 177.87 2jza h LEU 10 N 5.70 0.00 -1.13 3.17 5.85 -1.03 -1.78 115.31 126.09 2jza h LEU 10 Ca -0.43 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.20 2jza h LEU 10 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2jza h LEU 10 CO 0.75 0.01 -0.42 -0.78 -0.34 0.00 0.00 178.44 177.66 2jza h ASP 11 N 0.00 0.00 1.24 1.25 3.58 -1.92 -2.16 116.42 118.42 2jza h ASP 11 Ca -0.00 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.34 2jza h ASP 11 Cb 0.35 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 2jza h ASP 11 CO 0.00 0.42 -0.51 -0.78 -2.88 0.00 0.00 179.24 175.49 2jza h ASP 12 N 0.00 0.00 -3.43 2.28 3.58 -1.71 -3.42 116.42 113.72 2jza h ASP 12 Ca -0.00 0.00 -0.61 0.00 0.42 0.00 0.00 57.03 56.83 2jza h ASP 12 Cb 0.78 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.71 2jza h ASP 12 CO 0.05 0.51 0.50 -0.63 -2.88 0.00 0.00 179.24 176.79 2jza s ILE 13 N -3.14 4.49 0.46 2.25 1.01 -0.81 -5.02 121.20 120.43 2jza s ILE 13 Ca 0.02 0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.85 2jza s ILE 13 Cb 0.09 -4.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.03 2jza s ILE 13 CO 0.73 -0.94 1.20 -0.76 0.00 0.00 0.00 174.94 175.17 2jza s LEU 14 N 3.70 4.03 0.09 2.97 1.43 -1.26 -4.93 118.68 124.70 2jza s LEU 14 Ca 0.31 2.39 -0.31 0.00 -1.03 0.00 0.00 54.13 55.50 2jza s LEU 14 Cb -0.12 -4.20 -0.09 0.00 0.03 0.00 0.00 46.19 41.82 2jza s LEU 14 CO 0.22 -0.97 1.65 -2.84 0.23 0.00 0.00 176.35 174.64 2jza s PRO 15 N -2.65 4.20 0.00 1.29 0.02 -1.26 -3.38 135.00 133.22 2jza s PRO 15 Ca 0.63 2.35 0.00 0.00 0.02 0.00 0.00 61.00 64.01 2jza s PRO 15 Cb -0.31 -3.52 0.00 0.00 0.02 0.00 0.00 34.50 30.69 2jza s PRO 15 CO 0.38 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 2jza n GLY 16 N 3.97 0.84 3.16 0.52 0.00 0.20 -5.02 105.19 108.85 2jza n GLY 16 Ca 0.16 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 2jza n GLY 16 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jza n THR 17 N -0.96 0.00 -2.76 2.61 -2.24 -1.04 -4.89 114.28 105.00 2jza n THR 17 Ca 0.00 -2.37 -0.03 0.00 -2.27 0.00 0.00 64.05 59.38 2jza n THR 17 Cb 0.23 1.11 0.02 0.00 -2.10 0.00 0.00 70.33 69.59 2jza n THR 17 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jza s GLY 18 N -3.31 -1.52 0.11 3.38 0.00 -1.25 -0.27 107.32 104.46 2jza s GLY 18 Ca 0.35 0.09 0.06 0.00 0.00 0.00 0.00 44.72 45.22 2jza s GLY 18 CO 0.25 3.94 -0.06 -1.34 0.00 0.00 0.00 173.10 175.89 2jza s VAL 19 N 1.03 3.61 -0.24 1.40 -7.23 -1.10 -4.63 120.40 113.25 2jza s VAL 19 Ca 0.26 -1.21 -0.29 0.00 -1.81 0.00 0.00 61.98 58.93 2jza s VAL 19 Cb 0.05 -2.72 -0.02 0.00 0.56 0.00 0.00 36.38 34.24 2jza s VAL 19 CO -0.08 0.08 1.60 0.00 -0.31 0.00 0.00 175.10 176.40 2jza s ALA 21 N 5.28 3.88 -0.58 0.00 0.00 0.93 -4.89 121.76 126.38 2jza s ALA 21 Ca 0.71 -0.85 -0.22 0.00 0.00 0.00 0.00 51.96 51.60 2jza s ALA 21 Cb -0.24 -1.76 0.06 0.00 0.00 0.00 0.00 23.12 21.18 2jza s ALA 21 CO 0.29 0.78 0.86 -1.17 0.00 0.00 0.00 175.76 176.52 2jza s LEU 22 N -2.24 4.48 -0.40 0.00 1.98 -1.26 -2.78 118.68 118.46 2jza s LEU 22 Ca 0.31 -0.75 0.00 0.00 -2.89 0.00 0.00 54.13 50.80 2jza s LEU 22 Cb -0.13 -2.58 0.11 0.00 0.66 0.00 0.00 46.19 44.25 2jza s LEU 22 CO 0.23 -1.20 0.15 -0.69 -1.89 0.00 0.00 176.35 172.95 2jza s VAL 23 N 3.58 2.86 0.00 1.68 1.01 -0.29 -4.87 120.40 124.38 2jza s VAL 23 Ca 0.23 -2.28 0.00 0.00 0.00 0.00 0.00 61.98 59.93 2jza s VAL 23 Cb -0.16 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.21 2jza s VAL 23 CO 0.14 -0.67 0.00 -0.62 0.00 0.00 0.00 175.10 173.95 2jza n GLU 24 N 4.33 0.00 0.00 2.72 -0.58 -1.26 0.07 120.64 125.92 2jza n GLU 24 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2jza n GLU 24 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.28 2jza n GLU 24 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2jza n GLN 25 N 0.00 0.03 -4.23 3.49 6.02 -1.26 -5.07 117.38 116.35 2jza n GLN 25 Ca 0.00 -0.45 -0.35 0.00 -0.01 0.00 0.00 57.00 56.19 2jza n GLN 25 Cb 0.00 -0.75 -0.09 0.00 1.02 0.00 0.00 30.24 30.42 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 -0.13 3.31 -0.55 -1.09 -1.52 0.11 -5.06 119.66 114.72 2jza s GLN 26 Ca 0.00 -0.36 -0.11 0.00 -1.95 0.00 0.00 55.36 52.94 2jza s GLN 26 Cb 0.00 -2.94 0.14 0.00 -0.22 0.00 0.00 33.01 29.99 2jza s GLN 26 CO 0.00 0.59 0.44 -0.65 -0.25 0.00 0.00 175.29 175.42 2jza s GLN 27 N -0.55 2.74 -0.10 2.91 -0.21 -1.26 -1.14 119.66 122.05 2jza s GLN 27 Ca 0.10 -1.92 -0.01 0.00 0.02 0.00 0.00 55.36 53.55 2jza s GLN 27 Cb -0.12 -4.05 -0.03 0.00 1.00 0.00 0.00 33.01 29.81 2jza s GLN 27 CO 0.02 -1.23 -0.06 0.42 -2.12 0.00 0.00 175.29 172.31 2jza s ILE 28 N 1.12 3.72 -0.37 1.08 1.09 -1.12 -4.73 121.20 122.00 2jza s ILE 28 Ca 0.08 -0.45 -0.26 0.00 -1.10 0.00 0.00 60.65 58.92 2jza s ILE 28 Cb -0.24 -2.56 0.01 0.00 -1.06 0.00 0.00 42.46 38.61 2jza s ILE 28 CO -0.01 0.56 0.92 0.00 -0.10 0.00 0.00 174.94 176.31 2jza s ALA 29 N -0.34 3.41 -0.46 9.38 0.00 0.97 -0.05 121.76 134.68 2jza s ALA 29 Ca 0.05 -0.45 -0.15 0.00 0.00 0.00 0.00 51.96 51.41 2jza s ALA 29 Cb -0.12 -3.53 0.06 0.00 0.00 0.00 0.00 23.12 19.53 2jza s ALA 29 CO 0.02 -1.59 0.38 0.08 0.00 0.00 0.00 175.76 174.65 2jza s VAL 30 N 3.45 5.23 -0.07 0.00 1.01 0.45 -1.88 120.40 128.60 2jza s VAL 30 Ca 0.38 -0.97 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 2jza s VAL 30 Cb -0.12 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.15 2jza s VAL 30 CO 0.18 -0.53 0.94 -0.36 0.00 0.00 0.00 175.10 175.34 2jza s PHE 31 N 1.67 3.56 -0.72 5.22 0.40 0.97 -2.72 117.98 126.35 2jza s PHE 31 Ca 0.04 1.55 0.04 0.00 -0.60 0.00 0.00 56.93 57.97 2jza s PHE 31 Cb -0.23 -3.10 0.17 0.00 0.51 0.00 0.00 43.02 40.37 2jza s PHE 31 CO 0.07 -0.12 0.52 0.50 0.70 0.00 0.00 175.22 176.90 2jza s ARG 32 N 1.56 2.55 0.03 0.44 3.52 0.63 -0.01 118.95 127.68 2jza s ARG 32 Ca 0.47 -3.33 0.28 0.00 -0.13 0.00 0.00 55.73 53.01 2jza s ARG 32 Cb -0.19 -3.48 1.14 0.00 -1.56 0.00 0.00 34.95 30.85 2jza s ARG 32 CO 0.21 -1.28 1.88 -0.35 -0.81 0.00 0.00 175.30 174.94 2jza n PRO 33 N 2.02 0.04 -4.49 5.12 -0.04 -1.26 0.63 135.00 137.02 2jza n PRO 33 Ca 0.20 0.05 -0.24 0.00 -0.04 0.00 0.00 63.50 63.47 2jza n PRO 33 Cb 0.35 -1.55 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 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 -3.02 1.69 0.29 0.54 0.52 -1.26 -4.62 118.95 113.09 2jza s ARG 34 Ca 0.13 -1.83 0.25 0.00 -0.52 0.00 0.00 55.73 53.76 2jza s ARG 34 Cb 0.17 -1.59 0.95 0.00 0.52 0.00 0.00 34.95 35.00 2jza s ARG 34 CO 0.52 0.19 1.76 -0.97 0.02 0.00 0.00 175.30 176.81 2jza h ASN 35 N 2.18 0.00 -1.22 0.23 -0.73 -1.94 -3.40 115.58 110.71 2jza h ASN 35 Ca -0.41 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.76 2jza h ASN 35 Cb 1.25 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.84 2jza h ASN 35 CO 0.66 0.00 0.00 -0.67 -0.37 0.00 0.00 177.43 177.05 2jza n ASP 36 N -2.39 0.00 -0.81 1.15 2.03 -1.26 -4.96 116.55 110.32 2jza n ASP 36 Ca 0.03 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.39 2jza n ASP 36 Cb 0.31 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 40.88 2jza n ASP 36 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jza n GLU 37 N 0.00 2.13 -2.27 -0.67 1.02 -1.26 -4.78 120.64 114.81 2jza n GLU 37 Ca 0.00 -1.33 -0.36 0.00 -0.02 0.00 0.00 57.16 55.45 2jza n GLU 37 Cb 0.00 -1.46 -0.04 0.00 -0.02 0.00 0.00 31.44 29.93 2jza n GLU 37 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2jza s GLN 38 N -1.63 2.96 0.14 3.49 1.11 -1.26 -4.85 119.66 119.62 2jza s GLN 38 Ca 0.24 -0.28 0.08 0.00 0.01 0.00 0.00 55.36 55.41 2jza s GLN 38 Cb 0.14 -4.81 -0.04 0.00 -1.01 0.00 0.00 33.01 27.29 2jza s GLN 38 CO 0.13 -2.70 -0.10 0.14 0.01 0.00 0.00 175.29 172.77 2jza s VAL 39 N 7.73 3.26 -0.34 1.09 -7.23 -1.26 -4.04 120.40 119.61 2jza s VAL 39 Ca 0.57 -1.45 0.03 0.00 -1.81 0.00 0.00 61.98 59.31 2jza s VAL 39 Cb -0.07 -2.56 0.10 0.00 0.56 0.00 0.00 36.38 34.41 2jza s VAL 39 CO 0.05 0.01 0.06 -0.31 -0.31 0.00 0.00 175.10 174.61 2jza s TYR 40 N -1.42 3.34 -0.56 2.82 2.02 0.99 -4.93 117.35 119.61 2jza s TYR 40 Ca 0.23 -2.75 -0.18 0.00 -0.37 0.00 0.00 57.07 54.00 2jza s TYR 40 Cb -0.10 -2.68 0.11 0.00 -0.40 0.00 0.00 41.96 38.89 2jza s TYR 40 CO 0.14 -0.93 0.60 0.00 -1.57 0.00 0.00 175.55 173.79 2jza s ALA 41 N 1.03 3.51 0.11 3.71 0.00 -1.26 -0.02 121.76 128.83 2jza s ALA 41 Ca 0.11 -2.30 0.04 0.00 0.00 0.00 0.00 51.96 49.81 2jza s ALA 41 Cb -0.19 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 2jza s ALA 41 CO -0.11 -2.16 -0.11 0.96 0.00 0.00 0.00 175.76 174.34 2jza s ILE 42 N 2.21 1.05 -0.29 0.00 -4.36 -0.79 -3.87 121.20 115.14 2jza s ILE 42 Ca 0.08 -1.73 -0.06 0.00 -0.26 0.00 0.00 60.65 58.68 2jza s ILE 42 Cb -0.26 -1.48 -0.18 0.00 1.25 0.00 0.00 42.46 41.79 2jza s ILE 42 CO 0.05 -0.57 2.92 -1.20 0.24 0.00 0.00 174.94 176.38 2jza n SER 43 N 0.41 4.84 -4.39 4.36 7.64 -1.20 -0.02 113.62 125.27 2jza n SER 43 Ca -0.15 -2.32 -0.44 0.00 1.01 0.00 0.00 58.87 56.97 2jza n SER 43 Cb 0.58 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 2jza n SER 43 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2jza n ASN 44 N 2.88 5.23 -4.19 6.43 5.15 -1.26 -4.74 115.26 124.77 2jza n ASN 44 Ca 0.41 -3.00 -0.24 0.00 -0.60 0.00 0.00 54.58 51.15 2jza n ASN 44 Cb 0.61 -1.55 -0.14 0.00 -0.53 0.00 0.00 39.78 38.17 2jza n ASN 44 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2jza s ILE 45 N 1.27 1.41 -0.10 -1.44 -1.09 -1.26 -4.50 121.20 115.49 2jza s ILE 45 Ca 0.42 -0.95 -0.29 0.00 -2.23 0.00 0.00 60.65 57.60 2jza s ILE 45 Cb -0.02 -1.21 -0.02 0.00 -1.58 0.00 0.00 42.46 39.63 2jza s ILE 45 CO 0.00 0.24 0.96 -0.62 -1.23 0.00 0.00 174.94 174.29 2jza s ASP 46 N -0.83 7.20 0.16 3.58 -1.08 -1.02 -4.92 116.67 119.76 2jza s ASP 46 Ca 0.06 1.48 0.15 0.00 -0.52 0.00 0.00 52.55 53.71 2jza s ASP 46 Cb -0.08 -2.54 0.71 0.00 -1.46 0.00 0.00 42.92 39.56 2jza s ASP 46 CO 0.01 -0.41 1.46 -2.65 0.52 0.00 0.00 175.17 174.10 2jza n PRO 47 N 4.87 0.09 -0.24 4.34 -0.02 -1.26 -0.82 135.00 141.96 2jza n PRO 47 Ca 0.07 0.48 0.07 0.00 -2.02 0.00 0.00 63.50 62.10 2jza n PRO 47 Cb 0.49 -1.73 0.17 0.00 -0.02 0.00 0.00 33.50 32.41 2jza n PRO 47 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2jza n PHE 48 N -1.91 0.51 0.00 6.00 3.01 -1.26 -4.65 117.46 119.16 2jza n PHE 48 Ca 0.01 -0.71 0.00 0.00 1.01 0.00 0.00 57.45 57.76 2jza n PHE 48 Cb 0.09 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 2jza n PHE 48 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jza n ALA 49 N -0.28 1.55 -1.76 4.37 0.00 -0.47 -5.01 120.51 118.91 2jza n ALA 49 Ca 0.14 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.41 2jza n ALA 49 Cb 0.60 0.09 -0.05 0.00 0.00 0.00 0.00 19.45 20.09 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 -1.24 -1.27 -4.10 0.00 6.02 -0.00 -4.98 117.38 111.82 2jza n GLN 50 Ca 0.00 1.03 -0.08 0.00 -0.01 0.00 0.00 57.00 57.94 2jza n GLN 50 Cb 0.13 -5.34 -0.10 0.00 1.02 0.00 0.00 30.24 25.95 2jza n GLN 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jza s ALA 51 N -2.72 0.56 -1.52 -1.58 0.00 -1.26 -4.96 121.76 110.29 2jza s ALA 51 Ca 0.00 -1.19 -0.12 0.00 0.00 0.00 0.00 51.96 50.65 2jza s ALA 51 Cb 0.00 0.24 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2jza s ALA 51 CO 0.00 -0.33 2.53 -1.13 0.00 0.00 0.00 175.76 176.83 2jza n SER 52 N 0.19 6.14 0.01 0.00 3.41 -1.26 -2.44 113.62 119.67 2jza n SER 52 Ca -0.14 -2.75 0.14 0.00 -0.26 0.00 0.00 58.87 55.85 2jza n SER 52 Cb 0.61 -1.60 0.54 0.00 -0.26 0.00 0.00 64.21 63.50 2jza n SER 52 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2jza n VAL 53 N 4.25 0.07 1.41 -3.33 0.24 -1.26 -1.94 118.33 117.77 2jza n VAL 53 Ca 0.63 -0.04 0.08 0.00 -2.04 0.00 0.00 64.34 62.97 2jza n VAL 53 Cb 0.32 -0.41 0.32 0.00 -1.47 0.00 0.00 33.84 32.60 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 -1.59 1.15 -1.49 1.34 4.77 -1.26 -3.56 117.00 116.35 2jza n LEU 54 Ca 0.07 -0.52 0.04 0.00 -0.03 0.00 0.00 56.01 55.57 2jza n LEU 54 Cb 0.35 -0.10 0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2jza n LEU 54 CO 0.29 0.26 0.07 -1.20 -1.33 0.00 0.00 177.39 175.48 2jza n SER 55 N 0.03 1.06 -3.32 -1.43 7.64 -0.82 -4.47 113.62 112.30 2jza n SER 55 Ca 0.13 -2.10 -0.36 0.00 1.01 0.00 0.00 58.87 57.55 2jza n SER 55 Cb 0.23 -0.32 -0.03 0.00 -1.01 0.00 0.00 64.21 63.08 2jza n SER 55 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2jza n ARG 56 N 0.38 3.23 0.00 1.43 0.63 -1.18 -4.30 116.66 116.86 2jza n ARG 56 Ca 0.07 -2.06 0.00 0.00 -0.92 0.00 0.00 57.85 54.94 2jza n ARG 56 Cb 1.12 -2.77 0.00 0.00 0.45 0.00 0.00 32.46 31.26 2jza n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2jza n GLY 57 N 3.69 1.65 3.57 5.14 0.00 -1.26 -4.92 105.19 113.06 2jza n GLY 57 Ca 0.68 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 46.12 2jza n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jza s ILE 58 N -0.12 3.40 -0.20 -0.61 1.01 -1.26 -4.93 121.20 118.50 2jza s ILE 58 Ca 0.00 0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.97 2jza s ILE 58 Cb 0.00 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.67 2jza s ILE 58 CO 0.00 -0.72 -0.18 0.54 0.00 0.00 0.00 174.94 174.58 2jza s VAL 59 N 8.39 2.13 -0.07 2.92 0.11 -1.26 0.04 120.40 132.65 2jza s VAL 59 Ca 0.72 -1.06 0.05 0.00 -2.93 0.00 0.00 61.98 58.76 2jza s VAL 59 Cb -0.16 -1.97 -0.01 0.00 -1.53 0.00 0.00 36.38 32.72 2jza s VAL 59 CO 0.25 0.43 -0.23 0.00 -3.33 0.00 0.00 175.10 172.21 2jza s ALA 60 N 1.26 2.22 -0.83 1.54 0.00 0.33 -4.94 121.76 121.34 2jza s ALA 60 Ca 0.02 -1.01 -0.25 0.00 0.00 0.00 0.00 51.96 50.72 2jza s ALA 60 Cb -0.14 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.23 2jza s ALA 60 CO -0.11 0.37 1.53 -2.00 0.00 0.00 0.00 175.76 175.55 2jza s GLU 61 N -0.00 3.12 -1.01 0.00 2.12 -1.26 -0.18 118.70 121.49 2jza s GLU 61 Ca -0.08 -0.37 -0.21 0.00 0.36 0.00 0.00 54.97 54.68 2jza s GLU 61 Cb -0.15 -4.70 0.09 0.00 0.26 0.00 0.00 34.13 29.63 2jza s GLU 61 CO 0.05 -2.45 1.33 -1.58 -0.54 0.00 0.00 175.26 172.08 2jza s HIS 62 N 6.72 2.83 0.00 5.30 5.65 -0.59 -4.72 115.29 130.48 2jza s HIS 62 Ca 0.49 -1.17 0.00 0.00 0.25 0.00 0.00 55.06 54.63 2jza s HIS 62 Cb -0.06 -4.51 0.00 0.00 -1.18 0.00 0.00 32.58 26.82 2jza s HIS 62 CO 0.06 -1.72 0.00 1.04 -0.65 0.00 0.00 174.74 173.47 2jza n GLN 63 N 7.75 0.00 0.00 2.88 1.13 -1.26 -3.18 117.38 124.71 2jza n GLN 63 Ca 0.30 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.36 2jza n GLN 63 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.85 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 1.82 4.38 -2.13 1.08 8.00 -1.26 -5.11 116.55 123.34 2jza n ASP 64 Ca 0.00 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 2jza n ASP 64 Cb 0.00 0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 41.40 2jza n ASP 64 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2jza n ASP 65 N -2.07 1.23 -4.52 -2.24 -0.08 -1.19 -5.12 116.55 102.56 2jza n ASP 65 Ca 0.00 -1.50 -0.39 0.00 -1.51 0.00 0.00 54.79 51.39 2jza n ASP 65 Cb 0.47 0.21 -0.11 0.00 2.34 0.00 0.00 41.12 44.03 2jza n ASP 65 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2jza s LEU 66 N 0.00 4.18 -0.16 -2.67 1.43 -1.26 -1.54 118.68 118.65 2jza s LEU 66 Ca 0.04 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2jza s LEU 66 Cb 0.00 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.16 2jza s LEU 66 CO 0.03 -0.15 -0.17 0.26 0.23 0.00 0.00 176.35 176.55 2jza s TRP 67 N 1.70 2.45 0.35 0.29 0.52 0.75 -1.02 118.94 123.98 2jza s TRP 67 Ca 0.06 -1.43 -0.17 0.00 0.02 0.00 0.00 56.10 54.59 2jza s TRP 67 Cb -0.17 -1.74 -0.10 0.00 -1.15 0.00 0.00 33.47 30.32 2jza s TRP 67 CO 0.09 -0.73 0.80 0.54 0.02 0.00 0.00 176.95 177.66 2jza s VAL 68 N 1.40 4.59 -0.10 4.03 0.11 0.28 -0.52 120.40 130.20 2jza s VAL 68 Ca 0.05 1.11 0.04 0.00 -2.93 0.00 0.00 61.98 60.25 2jza s VAL 68 Cb -0.13 -3.62 -0.00 0.00 -1.53 0.00 0.00 36.38 31.10 2jza s VAL 68 CO -0.12 -0.21 -0.24 0.00 -3.33 0.00 0.00 175.10 171.21 2jza s ALA 69 N -2.02 2.18 -0.05 1.54 0.00 0.11 -0.43 121.76 123.09 2jza s ALA 69 Ca 0.56 -0.98 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 2jza s ALA 69 Cb -0.10 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 2jza s ALA 69 CO 0.16 0.31 0.10 -1.54 0.00 0.00 0.00 175.76 174.79 2jza s SER 70 N 0.28 5.93 0.00 0.00 1.04 -1.26 -4.33 113.70 115.37 2jza s SER 70 Ca -0.17 0.27 0.21 0.00 0.48 0.00 0.00 55.95 56.73 2jza s SER 70 Cb -0.17 -1.79 1.13 0.00 0.10 0.00 0.00 66.02 65.28 2jza s SER 70 CO 0.08 0.32 1.63 -0.81 0.98 0.00 0.00 173.24 175.45 2jza n PRO 71 N 1.48 0.47 -0.08 4.02 -0.04 -1.26 -0.79 135.00 138.80 2jza n PRO 71 Ca -0.15 0.05 -0.14 0.00 -0.04 0.00 0.00 63.50 63.22 2jza n PRO 71 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.45 2jza n PRO 71 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2jza n LEU 72 N -1.15 1.64 0.05 1.53 4.77 -1.26 -4.71 117.00 117.87 2jza n LEU 72 Ca 0.13 0.27 0.02 0.00 -0.03 0.00 0.00 56.01 56.40 2jza n LEU 72 Cb 0.12 -0.63 -0.06 0.00 -2.33 0.00 0.00 43.42 40.51 2jza n LEU 72 CO 0.14 -0.04 -0.19 0.11 -1.33 0.00 0.00 177.39 176.07 2jza h LYS 73 N -0.76 0.00 0.00 3.23 6.56 -1.95 -3.47 116.57 120.18 2jza h LYS 73 Ca -0.23 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.36 2jza h LYS 73 Cb 1.06 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.72 2jza h LYS 73 CO -0.14 0.25 0.00 1.17 -2.06 0.00 0.00 179.45 178.67 2jza n LYS 74 N -2.87 0.00 -1.30 3.15 4.81 0.03 -4.93 118.16 117.04 2jza n LYS 74 Ca -0.07 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.08 2jza n LYS 74 Cb 0.78 -0.49 0.15 0.00 0.02 0.00 0.00 35.03 35.49 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 0.00 0.94 -0.18 1.64 -0.21 -1.26 -4.55 119.66 116.04 2jza s GLN 75 Ca 0.00 0.54 -0.14 0.00 0.02 0.00 0.00 55.36 55.78 2jza s GLN 75 Cb 0.00 -1.79 -0.05 0.00 1.00 0.00 0.00 33.01 32.17 2jza s GLN 75 CO 0.00 -2.39 0.29 -1.01 -2.12 0.00 0.00 175.29 170.06 2jza s HIS 76 N -3.05 3.42 -0.25 0.91 3.76 -1.26 -3.98 115.29 114.84 2jza s HIS 76 Ca 0.64 0.54 -0.13 0.00 -0.15 0.00 0.00 55.06 55.96 2jza s HIS 76 Cb -0.17 -2.36 -0.05 0.00 1.11 0.00 0.00 32.58 31.11 2jza s HIS 76 CO 0.56 0.17 0.26 -0.06 -0.85 0.00 0.00 174.74 174.82 2jza s PHE 77 N 0.70 3.29 -0.20 1.40 0.40 0.43 -0.11 117.98 123.89 2jza s PHE 77 Ca 0.15 0.31 -0.29 0.00 -0.60 0.00 0.00 56.93 56.50 2jza s PHE 77 Cb -0.13 -2.41 -0.02 0.00 0.51 0.00 0.00 43.02 40.97 2jza s PHE 77 CO 0.04 -0.07 1.42 0.50 0.70 0.00 0.00 175.22 177.82 2jza s ARG 78 N 1.51 4.03 0.57 0.44 3.52 -0.73 -0.55 118.95 127.73 2jza s ARG 78 Ca 0.11 1.64 0.28 0.00 -0.13 0.00 0.00 55.73 57.63 2jza s ARG 78 Cb -0.15 -3.90 1.69 0.00 -1.56 0.00 0.00 34.95 31.03 2jza s ARG 78 CO 0.08 -0.98 2.20 -0.07 -0.81 0.00 0.00 175.30 175.71 2jza h LEU 79 N 10.59 0.00 -0.86 -0.88 3.38 -1.44 0.23 115.31 126.34 2jza h LEU 79 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2jza h LEU 79 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2jza h LEU 79 CO 0.99 0.04 -0.02 0.00 0.09 0.00 0.00 178.44 179.54 2jza n TYR 80 N -3.81 0.00 0.07 1.13 9.36 -1.26 -4.68 117.16 117.97 2jza n TYR 80 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 2jza n TYR 80 Cb 0.13 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 38.83 2jza n TYR 80 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2jza n ASP 81 N 0.02 -0.18 0.00 2.98 2.03 -0.30 -4.98 116.55 116.13 2jza n ASP 81 Ca 0.19 0.23 0.00 0.00 0.52 0.00 0.00 54.79 55.73 2jza n ASP 81 Cb 0.34 0.29 0.00 0.00 -0.72 0.00 0.00 41.12 41.03 2jza n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jza n GLY 82 N 1.34 1.25 3.67 0.27 0.00 0.67 -4.25 105.19 108.13 2jza n GLY 82 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2jza n GLY 82 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2jza n PHE 83 N 0.00 1.71 -2.68 1.61 3.01 -1.26 -4.48 117.46 115.37 2jza n PHE 83 Ca 0.00 0.50 -0.42 0.00 1.01 0.00 0.00 57.45 58.55 2jza n PHE 83 Cb 0.00 -2.30 0.01 0.00 -0.01 0.00 0.00 39.48 37.18 2jza n PHE 83 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2jza n LEU 85 N 1.09 0.00 -0.00 0.00 7.94 0.84 -0.96 117.00 125.90 2jza n LEU 85 Ca 0.40 0.00 0.09 0.00 -1.11 0.00 0.00 56.01 55.38 2jza n LEU 85 Cb 0.30 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.13 2jza n LEU 85 CO 0.65 0.00 -0.20 -0.62 -1.11 0.00 0.00 177.39 176.11 2jza n GLU 86 N 0.00 0.87 -4.48 1.96 4.71 -1.26 -4.98 120.64 117.45 2jza n GLU 86 Ca 0.00 -0.04 -0.30 0.00 -0.01 0.00 0.00 57.16 56.81 2jza n GLU 86 Cb 0.00 -1.38 -0.07 0.00 -1.01 0.00 0.00 31.44 28.98 2jza n GLU 86 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2jza s ASP 87 N -3.07 4.24 -0.27 1.62 1.01 -0.14 -5.07 116.67 114.99 2jza s ASP 87 Ca 0.04 -1.46 0.20 0.00 0.71 0.00 0.00 52.55 52.04 2jza s ASP 87 Cb 0.13 0.24 0.50 0.00 1.01 0.00 0.00 42.92 44.81 2jza s ASP 87 CO 0.76 -0.81 1.10 0.61 0.21 0.00 0.00 175.17 177.04 2jza n GLY 88 N -1.32 2.32 0.22 0.21 0.00 -1.26 0.20 105.19 105.55 2jza n GLY 88 Ca -0.11 -1.29 -0.03 0.00 0.00 0.00 0.00 46.02 44.59 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 2.61 0.69 -3.02 4.61 0.00 -1.91 -3.26 119.26 118.97 2jza h ALA 89 Ca -0.07 0.05 -0.64 0.00 0.00 0.00 0.00 54.91 54.24 2jza h ALA 89 Cb 1.28 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 18.65 2jza h ALA 89 CO 0.29 -0.13 -0.45 0.71 0.00 0.00 0.00 179.25 179.67 2jza s TYR 90 N -6.12 3.66 -0.78 0.00 2.02 -1.26 -5.02 117.35 109.85 2jza s TYR 90 Ca -0.13 -3.27 -0.26 0.00 -0.37 0.00 0.00 57.07 53.04 2jza s TYR 90 Cb 0.15 -2.85 0.01 0.00 -0.40 0.00 0.00 41.96 38.88 2jza s TYR 90 CO 0.74 -0.59 1.51 -1.12 -1.57 0.00 0.00 175.55 174.52 2jza s SER 91 N -1.13 5.92 0.68 2.29 0.01 -1.23 -4.41 113.70 115.83 2jza s SER 91 Ca 0.26 -0.49 -0.09 0.00 1.31 0.00 0.00 55.95 56.93 2jza s SER 91 Cb -0.05 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.65 2jza s SER 91 CO -0.16 -1.99 1.03 0.68 0.41 0.00 0.00 173.24 173.22 2jza s VAL 92 N 6.78 3.25 -0.23 3.43 -7.23 -1.26 -5.04 120.40 120.10 2jza s VAL 92 Ca 0.48 0.18 -0.11 0.00 -1.81 0.00 0.00 61.98 60.72 2jza s VAL 92 Cb -0.07 -3.36 -0.05 0.00 0.56 0.00 0.00 36.38 33.45 2jza s VAL 92 CO 0.10 -0.43 0.17 0.00 -0.31 0.00 0.00 175.10 174.62 2jza s ALA 93 N -3.24 3.62 -0.70 1.32 0.00 -1.26 -4.73 121.76 116.77 2jza s ALA 93 Ca 0.57 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 2jza s ALA 93 Cb -0.11 -2.32 0.12 0.00 0.00 0.00 0.00 23.12 20.81 2jza s ALA 93 CO 0.48 -0.16 0.81 0.00 0.00 0.00 0.00 175.76 176.89 2jza s ALA 94 N 0.99 3.49 0.41 0.00 0.00 -1.26 -3.23 121.76 122.17 2jza s ALA 94 Ca 0.08 -2.48 -0.16 0.00 0.00 0.00 0.00 51.96 49.40 2jza s ALA 94 Cb -0.13 -3.64 -0.09 0.00 0.00 0.00 0.00 23.12 19.26 2jza s ALA 94 CO 0.04 -2.48 0.86 0.71 0.00 0.00 0.00 175.76 174.89 2jza s TYR 95 N 2.37 3.39 0.03 0.00 2.02 -1.25 -5.02 117.35 118.89 2jza s TYR 95 Ca 0.17 1.35 -0.30 0.00 -0.37 0.00 0.00 57.07 57.92 2jza s TYR 95 Cb -0.18 -2.66 -0.05 0.00 -0.40 0.00 0.00 41.96 38.67 2jza s TYR 95 CO 0.01 -0.11 1.19 0.34 -1.57 0.00 0.00 175.55 175.41 2jza s ASP 96 N -2.61 7.08 0.22 2.29 2.15 -1.26 -4.80 116.67 119.75 2jza s ASP 96 Ca 0.57 1.95 0.10 0.00 0.43 0.00 0.00 52.55 55.60 2jza s ASP 96 Cb -0.10 -2.57 -0.05 0.00 -0.30 0.00 0.00 42.92 39.90 2jza s ASP 96 CO 0.22 -0.49 -0.18 -0.89 -0.17 0.00 0.00 175.17 173.66 2jza s THR 97 N 1.36 2.11 -0.19 1.71 2.01 -1.26 -0.69 115.64 120.69 2jza s THR 97 Ca 0.58 -2.21 -0.21 0.00 0.31 0.00 0.00 61.69 60.15 2jza s THR 97 Cb -0.28 -2.11 0.06 0.00 0.01 0.00 0.00 72.50 70.18 2jza s THR 97 CO 0.27 -0.41 0.59 -1.58 -0.69 0.00 0.00 174.62 172.80 2jza s GLN 98 N -3.31 0.73 -0.38 4.92 0.74 0.65 -4.99 119.66 118.03 2jza s GLN 98 Ca 0.24 0.70 -0.06 0.00 0.05 0.00 0.00 55.36 56.29 2jza s GLN 98 Cb -0.04 0.35 0.07 0.00 1.10 0.00 0.00 33.01 34.49 2jza s GLN 98 CO 0.10 -0.12 0.17 0.08 -0.55 0.00 0.00 175.29 174.97 2jza s VAL 99 N 0.04 3.70 0.00 1.34 1.01 -1.26 -0.24 120.40 124.99 2jza s VAL 99 Ca -0.02 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.46 2jza s VAL 99 Cb -0.04 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2jza s VAL 99 CO 0.02 -0.41 0.00 1.07 0.00 0.00 0.00 175.10 175.78 2jza n THR 100 N 4.77 0.00 -3.43 3.92 5.66 -1.04 -4.78 114.28 119.37 2jza n THR 100 Ca -0.09 0.18 -0.27 0.00 -3.05 0.00 0.00 64.05 60.82 2jza n THR 100 Cb 0.43 -0.76 -0.08 0.00 -1.55 0.00 0.00 70.33 68.37 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 -1.32 3.59 0.00 1.09 5.03 -1.26 -4.85 115.26 117.54 2jza n ASN 101 Ca 0.00 -3.41 0.00 0.00 0.87 0.00 0.00 54.58 52.04 2jza n ASN 101 Cb 0.00 -0.67 0.00 0.00 -1.02 0.00 0.00 39.78 38.09 2jza n ASN 101 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jza n GLY 102 N 0.92 2.26 3.85 7.41 0.00 -1.26 -4.95 105.19 113.42 2jza n GLY 102 Ca 0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 6.81 -0.15 1.61 2.20 -1.26 -0.35 114.94 123.80 2jza s ASN 103 Ca 0.00 1.12 -0.05 0.00 -0.94 0.00 0.00 52.86 52.99 2jza s ASN 103 Cb 0.00 -2.31 -0.04 0.00 -2.00 0.00 0.00 41.25 36.91 2jza s ASN 103 CO 0.00 0.00 0.03 -0.69 -2.94 0.00 0.00 177.10 173.50 2jza s VAL 104 N -1.64 4.51 0.05 3.54 1.01 -0.51 -2.51 120.40 124.85 2jza s VAL 104 Ca 0.43 -0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.32 2jza s VAL 104 Cb -0.14 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2jza s VAL 104 CO 0.20 0.52 -0.15 -1.10 0.00 0.00 0.00 175.10 174.56 2jza s GLN 105 N -0.05 0.97 -0.04 2.72 -0.21 0.67 -0.59 119.66 123.12 2jza s GLN 105 Ca 0.05 -0.84 0.06 0.00 0.02 0.00 0.00 55.36 54.65 2jza s GLN 105 Cb -0.12 -1.00 -0.01 0.00 1.00 0.00 0.00 33.01 32.87 2jza s GLN 105 CO 0.02 0.24 -0.24 0.42 -2.12 0.00 0.00 175.29 173.61 2jza s ILE 106 N -0.95 1.91 -0.39 1.08 1.01 -0.52 -0.25 121.20 123.09 2jza s ILE 106 Ca 0.02 -1.00 -0.21 0.00 0.00 0.00 0.00 60.65 59.46 2jza s ILE 106 Cb -0.09 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.79 2jza s ILE 106 CO 0.02 0.54 0.65 -0.94 0.00 0.00 0.00 174.94 175.21 2jza s SER 107 N -0.27 6.40 0.16 3.58 1.04 0.13 0.05 113.70 124.79 2jza s SER 107 Ca 0.01 -0.01 0.08 0.00 0.48 0.00 0.00 55.95 56.50 2jza s SER 107 Cb -0.12 -2.33 -0.04 0.00 0.10 0.00 0.00 66.02 63.63 2jza s SER 107 CO 0.02 -0.68 -0.17 0.27 0.98 0.00 0.00 173.24 173.66 2jza s ILE 108 N 2.79 1.72 0.98 -1.02 -4.36 -0.74 -4.22 121.20 116.35 2jza s ILE 108 Ca 0.24 -1.92 -0.15 0.00 -0.26 0.00 0.00 60.65 58.56 2jza s ILE 108 Cb -0.14 -1.81 0.18 0.00 1.25 0.00 0.00 42.46 41.94 2jza s ILE 108 CO 0.17 -0.37 1.18 0.00 0.24 0.00 0.00 174.94 176.16 2jza s ALA 109 N -2.20 1.69 0.20 2.27 0.00 -1.26 -0.66 121.76 121.81 2jza s ALA 109 Ca 0.15 -0.81 -0.31 0.00 0.00 0.00 0.00 51.96 51.00 2jza s ALA 109 Cb -0.05 -2.93 -0.10 0.00 0.00 0.00 0.00 23.12 20.05 2jza s ALA 109 CO 0.06 -2.58 1.50 0.16 0.00 0.00 0.00 175.76 174.90 2jza s ASP 110 N -4.26 6.63 -0.27 0.00 -4.77 -1.26 -4.86 116.67 107.87 2jza s ASP 110 Ca 0.68 2.63 0.09 0.00 -3.30 0.00 0.00 52.55 52.64 2jza s ASP 110 Cb -0.10 -2.61 0.46 0.00 -1.09 0.00 0.00 42.92 39.57 2jza s ASP 110 CO 0.54 -0.76 1.31 -0.24 0.70 0.00 0.00 175.17 176.72 2jza n SER 111 N 3.16 3.03 -4.57 2.11 2.88 -1.26 -4.97 113.62 114.00 2jza n SER 111 Ca 0.10 -3.83 -0.32 0.00 -1.33 0.00 0.00 58.87 53.49 2jza n SER 111 Cb 0.40 -0.53 -0.04 0.00 -0.75 0.00 0.00 64.21 63.29 2jza n SER 111 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jza s ASP 112 N -3.10 5.60 0.13 -3.46 2.15 -1.26 -4.90 116.67 111.83 2jza s ASP 112 Ca 0.44 -1.49 0.08 0.00 0.43 0.00 0.00 52.55 52.02 2jza s ASP 112 Cb 0.40 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 40.40 2jza s ASP 112 CO -0.02 -2.41 -0.18 -0.69 -0.17 0.00 0.00 175.17 171.69 2jza s VAL 113 N 8.65 1.65 -1.14 1.11 1.01 -1.26 -5.06 120.40 125.37 2jza s VAL 113 Ca 0.63 -1.68 -0.22 0.00 0.00 0.00 0.00 61.98 60.70 2jza s VAL 113 Cb -0.02 -1.62 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 2jza s VAL 113 CO 0.05 -0.21 1.88 0.00 0.00 0.00 0.00 175.10 176.82 2jza s ALA 114 N -1.62 2.05 -0.13 5.51 0.00 -1.26 -4.89 121.76 121.42 2jza s ALA 114 Ca 0.09 -2.15 0.02 0.00 0.00 0.00 0.00 51.96 49.93 2jza s ALA 114 Cb -0.08 -4.64 0.01 0.00 0.00 0.00 0.00 23.12 18.41 2jza s ALA 114 CO 0.05 -4.77 -0.20 0.08 0.00 0.00 0.00 175.76 170.92 2jza s VAL 115 N 9.49 1.90 0.67 0.00 1.01 -1.26 -5.13 120.40 127.07 2jza s VAL 115 Ca 0.65 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 2jza s VAL 115 Cb -0.01 -1.69 0.09 0.00 0.00 0.00 0.00 36.38 34.77 2jza s VAL 115 CO 0.08 0.52 0.93 1.51 0.00 0.00 0.00 175.10 178.14 2jza s ASP 116 N 0.85 4.68 -0.10 3.32 -4.77 -1.26 -5.10 116.67 114.29 2jza s ASP 116 Ca -0.07 -0.14 0.03 0.00 -3.30 0.00 0.00 52.55 49.06 2jza s ASP 116 Cb -0.15 -0.43 -0.01 0.00 -1.09 0.00 0.00 42.92 41.24 2jza s ASP 116 CO -0.01 -1.61 -0.18 0.54 0.70 0.00 0.00 175.17 174.60 2jza s ASN 117 N -4.61 3.59 -0.02 2.11 2.20 -1.26 -4.98 114.94 111.97 2jza s ASN 117 Ca 0.63 -0.41 0.21 0.00 -0.94 0.00 0.00 52.86 52.35 2jza s ASN 117 Cb -0.08 -1.33 -0.29 0.00 -2.00 0.00 0.00 41.25 37.56 2jza s ASN 117 CO 0.43 0.20 0.62 -1.20 -2.94 0.00 0.00 177.10 174.21 2jza n SER 118 N 3.27 0.46 -4.13 3.54 7.64 -1.26 -4.88 113.62 118.26 2jza n SER 118 Ca -0.18 -0.38 -0.31 0.00 1.01 0.00 0.00 58.87 59.00 2jza n SER 118 Cb 0.53 1.59 -0.16 0.00 -1.01 0.00 0.00 64.21 65.16 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 -3.27 2.79 0.33 1.43 -0.21 -1.26 -5.11 119.66 114.36 2jza s GLN 119 Ca -0.02 -0.77 -0.29 0.00 0.02 0.00 0.00 55.36 54.31 2jza s GLN 119 Cb 0.14 -2.30 -0.11 0.00 1.00 0.00 0.00 33.01 31.74 2jza s GLN 119 CO 0.87 -0.06 1.47 -2.14 -2.12 0.00 0.00 175.29 173.31 2jza s PRO 120 N 0.94 4.19 0.34 2.91 0.02 -1.26 -4.96 135.00 137.18 2jza s PRO 120 Ca -0.05 2.46 -0.29 0.00 0.02 0.00 0.00 61.00 63.14 2jza s PRO 120 Cb -0.15 -3.02 -0.11 0.00 0.02 0.00 0.00 34.50 31.24 2jza s PRO 120 CO -0.03 -0.47 1.39 -0.51 -0.33 0.00 0.00 177.00 177.04 2jza s LEU 121 N -1.38 4.38 -0.73 -5.54 2.01 -1.26 -4.91 118.68 111.26 2jza s LEU 121 Ca 0.56 2.83 -0.26 0.00 0.01 0.00 0.00 54.13 57.27 2jza s LEU 121 Cb -0.45 -3.65 0.00 0.00 0.01 0.00 0.00 46.19 42.10 2jza s LEU 121 CO 0.54 -0.68 1.63 -2.84 1.01 0.00 0.00 176.35 176.01 2jza s PRO 122 N -1.79 2.90 -0.65 1.29 0.02 -1.26 -4.95 135.00 130.57 2jza s PRO 122 Ca 0.51 0.05 -0.20 0.00 0.02 0.00 0.00 61.00 61.38 2jza s PRO 122 Cb -0.43 -4.48 0.09 0.00 0.02 0.00 0.00 34.50 29.71 2jza s PRO 122 CO 0.56 -2.56 0.84 -1.17 -0.33 0.00 0.00 177.00 174.34 2jza s LEU 123 N 7.65 5.00 -0.18 -5.54 0.20 -1.26 -5.02 118.68 119.53 2jza s LEU 123 Ca 0.54 -1.33 -0.02 0.00 0.69 0.00 0.00 54.13 54.01 2jza s LEU 123 Cb -0.09 -2.35 -0.01 0.00 -0.43 0.00 0.00 46.19 43.30 2jza s LEU 123 CO 0.13 -1.23 -0.08 -0.70 -0.29 0.00 0.00 176.35 174.19 2jza s GLU 124 N 3.18 3.39 -0.68 1.98 -6.30 -1.26 -5.06 118.70 113.95 2jza s GLU 124 Ca 0.17 -0.64 -0.27 0.00 -2.50 0.00 0.00 54.97 51.73 2jza s GLU 124 Cb -0.20 -2.86 0.02 0.00 0.00 0.00 0.00 34.13 31.09 2jza s GLU 124 CO 0.06 -0.02 1.37 -1.58 0.02 0.00 0.00 175.26 175.11 2jza s HIS 125 N 1.00 2.23 0.10 5.30 5.65 -1.26 -4.98 115.29 123.33 2jza s HIS 125 Ca -0.00 0.18 -0.30 0.00 0.25 0.00 0.00 55.06 55.18 2jza s HIS 125 Cb -0.15 -4.51 -0.06 0.00 -1.18 0.00 0.00 32.58 26.68 2jza s HIS 125 CO -0.00 -2.05 1.14 -1.01 -0.65 0.00 0.00 174.74 172.17 2jza s HIS 126 N 6.16 3.52 0.21 3.88 0.09 -1.26 -4.96 115.29 122.93 2jza s HIS 126 Ca 0.43 1.45 -0.32 0.00 -0.00 0.00 0.00 55.06 56.62 2jza s HIS 126 Cb -0.09 -3.34 -0.13 0.00 -0.00 0.00 0.00 32.58 29.02 2jza s HIS 126 CO 0.18 -0.90 1.53 -2.39 -0.00 0.00 0.00 174.74 173.16 2jza n HIS 127 N 3.33 2.35 -3.59 1.40 1.44 -1.26 -5.00 115.22 113.90 2jza n HIS 127 Ca 0.06 0.30 -0.21 0.00 -2.01 0.00 0.00 57.72 55.86 2jza n HIS 127 Cb 0.47 -2.53 -0.15 0.00 0.12 0.00 0.00 29.99 27.89 2jza n HIS 127 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2jza s HIS 128 N 0.48 -0.05 -0.06 -1.40 3.76 -1.26 -5.14 115.29 111.62 2jza s HIS 128 Ca 0.73 0.10 -0.14 0.00 -0.15 0.00 0.00 55.06 55.60 2jza s HIS 128 Cb -0.63 -0.48 -0.05 0.00 1.11 0.00 0.00 32.58 32.53 2jza s HIS 128 CO 0.43 -0.47 0.35 -1.01 -0.85 0.00 0.00 174.74 173.19 2jza s HIS 129 N 2.23 3.63 0.00 1.40 3.76 -1.26 -5.32 115.29 119.74 2jza s HIS 129 Ca 0.04 0.83 0.00 0.00 -0.15 0.00 0.00 55.06 55.78 2jza s HIS 129 Cb -0.15 -2.27 0.00 0.00 1.11 0.00 0.00 32.58 31.27 2jza s HIS 129 CO -0.09 0.53 0.00 1.58 -0.85 0.00 0.00 174.74 175.91