#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mgs n SER 2 N 0.00 0.00 -2.18 0.00 3.41 -1.26 -4.27 113.62 109.32 1mgs n SER 2 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1mgs n SER 2 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1mgs n SER 2 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1mgs n VAL 3 N 0.00 -0.07 -3.45 -3.33 3.14 -1.26 -4.80 118.33 108.56 1mgs n VAL 3 Ca 0.00 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 1mgs n VAL 3 Cb 0.00 -0.26 -0.02 0.00 -1.06 0.00 0.00 33.84 32.50 1mgs n VAL 3 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1mgs s ALA 4 N -1.90 -1.60 0.00 1.55 0.00 -1.26 -5.06 121.76 113.49 1mgs s ALA 4 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1mgs s ALA 4 Cb 0.00 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.96 1mgs s ALA 4 CO 0.00 -0.78 0.52 2.41 0.00 0.00 0.00 175.76 177.92 1mgs n THR 5 N -0.37 0.00 -1.07 0.00 -1.04 -1.26 -5.10 114.28 105.44 1mgs n THR 5 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 1mgs n THR 5 Cb 0.64 0.20 0.00 0.00 -1.82 0.00 0.00 70.33 69.36 1mgs n THR 5 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1mgs n GLU 6 N 0.00 2.02 -3.57 -2.82 2.13 -1.26 -5.17 120.64 111.97 1mgs n GLU 6 Ca -0.11 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.69 1mgs n GLU 6 Cb 0.46 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.12 1mgs n GLU 6 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1mgs s LEU 7 N 0.00 -0.83 0.10 4.31 1.43 -1.26 -5.13 118.68 117.30 1mgs s LEU 7 Ca 0.00 1.19 0.07 0.00 -1.03 0.00 0.00 54.13 54.36 1mgs s LEU 7 Cb 0.00 2.02 -0.04 0.00 0.03 0.00 0.00 46.19 48.20 1mgs s LEU 7 CO 0.00 -0.17 -0.08 -0.13 0.23 0.00 0.00 176.35 176.19 1mgs s ARG 8 N 2.31 2.21 -0.92 1.70 3.00 -1.26 -4.53 118.95 121.46 1mgs s ARG 8 Ca -0.06 -0.98 -0.22 0.00 0.00 0.00 0.00 55.73 54.47 1mgs s ARG 8 Cb -0.08 -2.35 -0.24 0.00 0.00 0.00 0.00 34.95 32.29 1mgs s ARG 8 CO -0.18 0.52 2.44 0.00 0.00 0.00 0.00 175.30 178.08 1mgs h GLN 10 N 12.65 0.00 -2.16 0.00 4.15 -1.93 -1.93 115.11 125.89 1mgs h GLN 10 Ca -0.04 0.00 -0.57 0.00 0.77 0.00 0.00 58.65 58.81 1mgs h GLN 10 Cb 1.21 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 28.49 1mgs h GLN 10 CO 1.41 0.00 -0.79 0.00 -1.93 0.00 0.00 178.83 177.52 1mgs h LEU 12 N 3.57 0.05 -8.08 0.00 3.38 -1.72 -3.35 115.31 109.17 1mgs h LEU 12 Ca 0.14 0.21 -0.62 0.00 0.09 0.00 0.00 57.88 57.69 1mgs h LEU 12 Cb 0.69 0.27 -0.34 0.00 0.09 0.00 0.00 40.66 41.37 1mgs h LEU 12 CO 0.72 -0.19 -0.85 -1.10 0.09 0.00 0.00 178.44 177.11 1mgs s GLN 13 N -5.88 2.56 0.44 1.13 -0.21 -1.26 -5.13 119.66 111.32 1mgs s GLN 13 Ca -0.12 -0.68 0.04 0.00 0.02 0.00 0.00 55.36 54.62 1mgs s GLN 13 Cb 0.27 -2.13 0.01 0.00 1.00 0.00 0.00 33.01 32.16 1mgs s GLN 13 CO 0.78 -0.05 0.63 0.95 -2.12 0.00 0.00 175.29 175.47 1mgs s THR 14 N 0.95 3.44 0.07 -0.19 -4.23 -1.26 -4.71 115.64 109.71 1mgs s THR 14 Ca -0.06 -0.78 0.09 0.00 -1.18 0.00 0.00 61.69 59.76 1mgs s THR 14 Cb -0.15 -3.23 -0.03 0.00 1.34 0.00 0.00 72.50 70.43 1mgs s THR 14 CO -0.02 -0.13 -0.24 -0.76 -0.54 0.00 0.00 174.62 172.93 1mgs s LEU 15 N -4.47 2.34 0.33 4.79 1.43 0.42 -4.81 118.68 118.70 1mgs s LEU 15 Ca 0.51 -0.59 0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1mgs s LEU 15 Cb -0.10 -1.34 1.02 0.00 0.03 0.00 0.00 46.19 45.80 1mgs s LEU 15 CO 0.35 0.23 1.65 -0.61 0.23 0.00 0.00 176.35 178.20 1mgs h GLN 16 N 4.44 0.24 0.00 1.70 4.15 -1.93 -1.70 115.11 122.02 1mgs h GLN 16 Ca -0.48 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.92 1mgs h GLN 16 Cb 1.15 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.79 1mgs h GLN 16 CO 0.43 0.16 0.00 0.41 -1.93 0.00 0.00 178.83 177.91 1mgs n GLY 17 N -1.31 0.29 3.60 2.39 0.00 -1.26 -3.83 105.19 105.06 1mgs n GLY 17 Ca 0.30 -1.62 -0.04 0.00 0.00 0.00 0.00 46.02 44.65 1mgs n GLY 17 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mgs s ILE 18 N -2.73 0.00 0.60 -0.61 -5.25 -1.26 -5.04 121.20 106.91 1mgs s ILE 18 Ca 0.00 -0.17 -0.18 0.00 -0.99 0.00 0.00 60.65 59.31 1mgs s ILE 18 Cb 0.00 -1.37 -0.05 0.00 2.95 0.00 0.00 42.46 43.99 1mgs s ILE 18 CO 0.00 0.00 0.93 1.57 -1.79 0.00 0.00 174.94 175.65 1mgs n HIS 19 N -0.29 0.72 1.37 1.37 -0.00 -1.26 -4.84 115.22 112.29 1mgs n HIS 19 Ca -0.05 0.44 0.13 0.00 -0.00 0.00 0.00 57.72 58.23 1mgs n HIS 19 Cb 0.61 -2.13 0.70 0.00 -0.00 0.00 0.00 29.99 29.17 1mgs n HIS 19 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1mgs n PRO 20 N -0.94 0.51 0.05 1.57 -0.04 -1.26 -2.88 135.00 132.01 1mgs n PRO 20 Ca 0.14 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.66 1mgs n PRO 20 Cb 0.47 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.37 1mgs n PRO 20 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1mgs n LYS 21 N -1.21 0.62 0.00 0.54 2.85 -1.26 -3.68 118.16 116.02 1mgs n LYS 21 Ca 0.15 0.19 0.14 0.00 -1.05 0.00 0.00 58.31 57.74 1mgs n LYS 21 Cb 0.18 -1.81 0.65 0.00 -0.65 0.00 0.00 35.03 33.40 1mgs n LYS 21 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1mgs n ASN 22 N -2.82 0.28 -4.74 -5.58 3.02 -1.14 -4.80 115.26 99.48 1mgs n ASN 22 Ca -0.07 -0.36 -0.32 0.00 -0.03 0.00 0.00 54.58 53.80 1mgs n ASN 22 Cb 0.75 -0.15 -0.08 0.00 -0.61 0.00 0.00 39.78 39.69 1mgs n ASN 22 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1mgs s ILE 23 N -2.55 4.46 -0.01 2.41 1.01 -1.24 -2.40 121.20 122.88 1mgs s ILE 23 Ca 0.27 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.38 1mgs s ILE 23 Cb 0.20 -3.04 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 1mgs s ILE 23 CO 0.48 0.32 0.01 0.00 0.00 0.00 0.00 174.94 175.75 1mgs n GLN 24 N 1.14 2.10 -4.10 2.79 -0.00 -0.30 -4.60 117.38 114.41 1mgs n GLN 24 Ca -0.13 -0.00 -0.17 0.00 -0.00 0.00 0.00 57.00 56.69 1mgs n GLN 24 Cb 0.52 -1.02 -0.06 0.00 -0.00 0.00 0.00 30.24 29.68 1mgs n GLN 24 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1mgs n SER 25 N -1.80 -0.92 -3.56 2.61 3.41 -1.05 -4.96 113.62 107.34 1mgs n SER 25 Ca -0.01 -3.05 -0.14 0.00 -0.26 0.00 0.00 58.87 55.42 1mgs n SER 25 Cb 0.30 1.94 -0.05 0.00 -0.26 0.00 0.00 64.21 66.14 1mgs n SER 25 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1mgs s VAL 26 N -3.14 0.03 -0.12 -3.33 1.01 -1.26 -2.01 120.40 111.57 1mgs s VAL 26 Ca 0.35 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.07 1mgs s VAL 26 Cb 0.01 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.44 1mgs s VAL 26 CO 0.25 -0.13 0.06 0.21 0.00 0.00 0.00 175.10 175.50 1mgs s ASN 27 N -2.10 1.98 -0.38 3.32 3.84 -0.61 -4.94 114.94 116.05 1mgs s ASN 27 Ca -0.04 -0.37 -0.09 0.00 0.21 0.00 0.00 52.86 52.56 1mgs s ASN 27 Cb -0.00 -0.28 0.05 0.00 -0.55 0.00 0.00 41.25 40.46 1mgs s ASN 27 CO -0.03 -0.30 0.20 -0.69 -2.79 0.00 0.00 177.10 173.49 1mgs s VAL 28 N 2.09 4.26 -0.33 -5.21 1.01 -1.26 -1.11 120.40 119.86 1mgs s VAL 28 Ca 0.03 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1mgs s VAL 28 Cb -0.15 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.83 1mgs s VAL 28 CO -0.07 -0.31 0.05 -1.59 0.00 0.00 0.00 175.10 173.19 1mgs s LYS 29 N 1.47 2.40 1.03 2.72 -2.85 -1.05 -5.03 119.74 118.44 1mgs s LYS 29 Ca 0.01 -1.34 -0.11 0.00 -1.00 0.00 0.00 55.97 53.53 1mgs s LYS 29 Cb -0.20 -3.30 0.21 0.00 -2.06 0.00 0.00 37.83 32.47 1mgs s LYS 29 CO 0.04 -0.70 1.08 -1.13 0.10 0.00 0.00 175.35 174.74 1mgs n SER 30 N 4.66 -0.60 -4.82 0.03 3.41 -1.26 -2.47 113.62 112.56 1mgs n SER 30 Ca -0.11 0.16 -0.33 0.00 -0.26 0.00 0.00 58.87 58.33 1mgs n SER 30 Cb 0.43 -1.38 -0.03 0.00 -0.26 0.00 0.00 64.21 62.97 1mgs n SER 30 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1mgs s PRO 31 N -4.52 3.85 0.00 4.33 0.04 -1.25 -4.79 135.00 132.65 1mgs s PRO 31 Ca 0.68 1.14 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1mgs s PRO 31 Cb -0.24 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1mgs s PRO 31 CO 0.61 -0.37 0.00 0.41 0.04 0.00 0.00 177.00 177.70 1mgs n GLY 32 N -0.91 3.34 0.00 0.56 0.00 -0.22 -4.89 105.19 103.06 1mgs n GLY 32 Ca 0.08 -0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1mgs n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mgs n PRO 33 N 0.00 0.88 0.00 1.61 -0.04 -1.26 -3.29 135.00 132.90 1mgs n PRO 33 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1mgs n PRO 33 Cb 0.00 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1mgs n PRO 33 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1mgs n HIS 34 N -0.59 0.00 -3.15 0.54 1.44 -1.26 -4.96 115.22 107.23 1mgs n HIS 34 Ca 0.04 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.79 1mgs n HIS 34 Cb 0.02 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.12 1mgs n HIS 34 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1mgs n ALA 36 N 5.43 1.84 -3.13 0.00 0.00 -1.26 -1.06 120.51 122.33 1mgs n ALA 36 Ca 0.01 -0.07 -0.35 0.00 0.00 0.00 0.00 53.44 53.03 1mgs n ALA 36 Cb 0.52 -1.24 -0.13 0.00 0.00 0.00 0.00 19.45 18.60 1mgs n ALA 36 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1mgs s GLN 37 N -2.56 3.58 0.90 0.00 1.11 -1.26 -4.75 119.66 116.68 1mgs s GLN 37 Ca 0.14 -0.54 -0.15 0.00 0.01 0.00 0.00 55.36 54.82 1mgs s GLN 37 Cb 0.10 -3.04 -0.04 0.00 -1.01 0.00 0.00 33.01 29.02 1mgs s GLN 37 CO 0.22 0.01 0.08 2.41 0.01 0.00 0.00 175.29 178.03 1mgs n THR 38 N 4.22 0.35 -3.59 -0.19 -1.04 -1.26 -4.52 114.28 108.25 1mgs n THR 38 Ca -0.17 -0.33 -0.27 0.00 -2.04 0.00 0.00 64.05 61.24 1mgs n THR 38 Cb 0.52 -0.45 -0.16 0.00 -1.82 0.00 0.00 70.33 68.41 1mgs n THR 38 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1mgs s GLU 39 N -2.90 0.10 0.24 -2.82 0.41 -1.03 -4.89 118.70 107.80 1mgs s GLU 39 Ca 0.54 -0.20 -0.06 0.00 -0.41 0.00 0.00 54.97 54.83 1mgs s GLU 39 Cb -0.24 -1.66 -0.06 0.00 -1.78 0.00 0.00 34.13 30.39 1mgs s GLU 39 CO 0.70 -0.76 0.51 0.08 -0.49 0.00 0.00 175.26 175.30 1mgs s VAL 40 N 2.13 5.02 0.04 2.63 1.01 -1.23 -2.51 120.40 127.49 1mgs s VAL 40 Ca 0.04 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 1mgs s VAL 40 Cb -0.16 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1mgs s VAL 40 CO -0.16 -0.15 -0.02 -0.63 0.00 0.00 0.00 175.10 174.13 1mgs s ILE 41 N -1.89 0.18 -0.10 2.22 1.01 -0.26 -1.59 121.20 120.76 1mgs s ILE 41 Ca 0.44 -1.45 -0.03 0.00 0.00 0.00 0.00 60.65 59.61 1mgs s ILE 41 Cb -0.11 -1.03 0.05 0.00 0.01 0.00 0.00 42.46 41.38 1mgs s ILE 41 CO 0.26 -0.80 0.14 0.00 0.00 0.00 0.00 174.94 174.54 1mgs s ALA 42 N -2.97 -0.04 -0.76 9.38 0.00 -0.58 -1.57 121.76 125.23 1mgs s ALA 42 Ca -0.02 0.37 -0.21 0.00 0.00 0.00 0.00 51.96 52.10 1mgs s ALA 42 Cb 0.01 -0.86 0.10 0.00 0.00 0.00 0.00 23.12 22.37 1mgs s ALA 42 CO -0.06 -0.69 1.01 0.99 0.00 0.00 0.00 175.76 177.01 1mgs s THR 43 N 2.26 4.52 1.01 0.00 2.01 -0.85 -1.07 115.64 123.52 1mgs s THR 43 Ca 0.04 -0.89 -0.22 0.00 0.31 0.00 0.00 61.69 60.93 1mgs s THR 43 Cb -0.13 -4.71 -0.13 0.00 0.01 0.00 0.00 72.50 67.54 1mgs s THR 43 CO -0.06 -1.46 -0.97 0.18 -0.69 0.00 0.00 174.62 171.62 1mgs n LEU 44 N 7.16 -3.80 0.00 4.42 4.77 0.31 -1.15 117.00 128.70 1mgs n LEU 44 Ca 0.07 0.08 0.04 0.00 -0.03 0.00 0.00 56.01 56.17 1mgs n LEU 44 Cb 0.47 -0.70 0.26 0.00 -2.33 0.00 0.00 43.42 41.11 1mgs n LEU 44 CO 0.58 -3.93 0.66 2.29 -1.33 0.00 0.00 177.39 175.66 1mgs n LYS 45 N 1.66 0.98 -0.57 3.23 2.85 -1.01 -3.09 118.16 122.21 1mgs n LYS 45 Ca -0.01 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.28 1mgs n LYS 45 Cb 0.66 -1.14 0.22 0.00 -0.65 0.00 0.00 35.03 34.12 1mgs n LYS 45 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1mgs n ASN 46 N -0.64 3.19 0.00 -5.58 6.94 -1.26 -4.90 115.26 113.01 1mgs n ASN 46 Ca 0.07 -3.34 0.00 0.00 -0.02 0.00 0.00 54.58 51.29 1mgs n ASN 46 Cb 0.03 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 36.87 1mgs n ASN 46 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mgs n GLY 47 N -0.84 0.84 3.92 4.83 0.00 -1.18 -5.00 105.19 107.76 1mgs n GLY 47 Ca 0.26 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.02 1mgs n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mgs s ARG 48 N -0.18 3.26 0.05 1.61 0.52 -1.26 -4.88 118.95 118.07 1mgs s ARG 48 Ca 0.00 -0.03 0.02 0.00 -0.52 0.00 0.00 55.73 55.21 1mgs s ARG 48 Cb 0.00 -2.40 -0.03 0.00 0.52 0.00 0.00 34.95 33.05 1mgs s ARG 48 CO 0.00 -0.34 -0.08 0.15 0.02 0.00 0.00 175.30 175.05 1mgs s LYS 49 N -4.75 0.59 -0.17 3.54 3.01 -1.26 0.11 119.74 120.81 1mgs s LYS 49 Ca 0.49 -0.84 -0.07 0.00 -1.01 0.00 0.00 55.97 54.54 1mgs s LYS 49 Cb -0.10 -0.32 0.07 0.00 -1.01 0.00 0.00 37.83 36.47 1mgs s LYS 49 CO 0.43 0.05 0.36 0.00 0.51 0.00 0.00 175.35 176.71 1mgs s ALA 50 N -1.65 -0.93 0.29 5.17 0.00 -0.23 -4.90 121.76 119.51 1mgs s ALA 50 Ca -0.07 1.33 -0.28 0.00 0.00 0.00 0.00 51.96 52.95 1mgs s ALA 50 Cb -0.08 -1.09 -0.09 0.00 0.00 0.00 0.00 23.12 21.85 1mgs s ALA 50 CO -0.00 -0.56 0.95 0.00 0.00 0.00 0.00 175.76 176.16 1mgs s LEU 52 N -1.71 2.78 -0.26 0.00 1.43 -0.62 -0.44 118.68 119.87 1mgs s LEU 52 Ca 0.47 -1.29 -0.11 0.00 -1.03 0.00 0.00 54.13 52.16 1mgs s LEU 52 Cb -0.22 -0.92 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 1mgs s LEU 52 CO 0.28 -0.35 0.19 0.21 0.23 0.00 0.00 176.35 176.91 1mgs s ASN 53 N -3.65 6.09 0.00 2.29 3.04 -0.64 -3.48 114.94 118.59 1mgs s ASN 53 Ca 0.34 0.08 0.23 0.00 0.04 0.00 0.00 52.86 53.56 1mgs s ASN 53 Cb 0.07 -2.12 1.26 0.00 -1.54 0.00 0.00 41.25 38.92 1mgs s ASN 53 CO 0.17 -0.00 1.77 -0.81 -3.04 0.00 0.00 177.10 175.19 1mgs n PRO 54 N 4.68 0.49 0.03 0.43 -0.04 -1.26 -2.45 135.00 136.88 1mgs n PRO 54 Ca -0.14 0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.48 1mgs n PRO 54 Cb 0.52 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.71 1mgs n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mgs n ALA 55 N -1.18 3.16 -2.28 0.55 0.00 -1.26 -4.70 120.51 114.81 1mgs n ALA 55 Ca 0.14 -0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.04 1mgs n ALA 55 Cb 0.14 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.44 1mgs n ALA 55 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1mgs s SER 56 N -3.60 5.91 0.07 0.00 1.04 -1.02 -5.01 113.70 111.08 1mgs s SER 56 Ca 0.09 0.57 -0.13 0.00 0.48 0.00 0.00 55.95 56.96 1mgs s SER 56 Cb 0.16 -1.79 -0.26 0.00 0.10 0.00 0.00 66.02 64.22 1mgs s SER 56 CO 0.70 -0.74 1.14 1.55 0.98 0.00 0.00 173.24 176.87 1mgs h PRO 57 N 0.23 0.58 -0.28 4.02 0.13 -1.89 -3.06 132.00 131.72 1mgs h PRO 57 Ca -0.46 -0.75 -0.03 0.00 -0.87 0.00 0.00 66.00 63.88 1mgs h PRO 57 Cb 1.24 0.25 -0.01 0.00 0.13 0.00 0.00 31.00 32.61 1mgs h PRO 57 CO 0.60 1.33 0.05 0.97 -0.23 0.00 0.00 178.00 180.72 1mgs h ILE 58 N 0.26 1.23 -0.52 -3.56 2.10 -1.92 -2.05 117.51 113.05 1mgs h ILE 58 Ca -0.17 -0.79 0.04 0.00 1.08 0.00 0.00 64.86 65.03 1mgs h ILE 58 Cb 1.87 1.21 -0.04 0.00 -1.09 0.00 0.00 36.82 38.77 1mgs h ILE 58 CO 0.23 0.25 0.27 0.58 -1.08 0.00 0.00 178.15 178.40 1mgs h VAL 59 N 0.28 0.97 -0.03 2.19 2.07 -1.66 0.20 116.25 120.26 1mgs h VAL 59 Ca 0.08 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1mgs h VAL 59 Cb 0.33 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1mgs h VAL 59 CO 0.01 0.10 0.02 0.11 0.02 0.00 0.00 177.57 177.82 1mgs h LYS 60 N 0.53 0.00 0.00 1.57 1.57 -1.40 0.17 116.57 119.01 1mgs h LYS 60 Ca 0.22 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.93 1mgs h LYS 60 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1mgs h LYS 60 CO -0.15 0.00 -0.35 0.87 -0.57 0.00 0.00 179.45 179.25 1mgs h LYS 61 N 0.00 0.00 -0.16 3.15 1.79 -0.02 -2.82 116.57 118.51 1mgs h LYS 61 Ca 0.01 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.31 1mgs h LYS 61 Cb 0.06 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1mgs h LYS 61 CO -0.00 0.35 -0.63 0.82 -1.08 0.00 0.00 179.45 178.92 1mgs h ILE 62 N 0.00 1.33 0.02 1.86 2.04 0.20 0.03 117.51 122.99 1mgs h ILE 62 Ca -0.00 -1.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.95 1mgs h ILE 62 Cb 1.25 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1mgs h ILE 62 CO 0.05 0.59 -0.01 0.40 0.00 0.00 0.00 178.15 179.17 1mgs h ILE 63 N 0.42 1.45 0.00 -0.67 5.03 -1.41 -2.27 117.51 120.06 1mgs h ILE 63 Ca -0.01 -1.74 -0.05 0.00 -0.12 0.00 0.00 64.86 62.93 1mgs h ILE 63 Cb 1.19 2.57 -0.01 0.00 -3.03 0.00 0.00 36.82 37.55 1mgs h ILE 63 CO 0.12 0.43 -0.26 1.05 -0.68 0.00 0.00 178.15 178.81 1mgs h GLU 64 N -0.83 0.00 -0.16 2.37 4.11 -1.58 -2.53 114.58 115.97 1mgs h GLU 64 Ca -0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 1mgs h GLU 64 Cb 0.73 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 1mgs h GLU 64 CO 0.01 0.26 -0.14 0.87 0.07 0.00 0.00 179.01 180.08 1mgs h LYS 65 N 0.00 0.37 -0.58 1.06 1.79 -1.02 -3.09 116.57 115.11 1mgs h LYS 65 Ca -0.00 -0.19 0.06 0.00 -2.18 0.00 0.00 60.65 58.34 1mgs h LYS 65 Cb 0.49 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.09 1mgs h LYS 65 CO 0.03 0.74 0.28 1.98 -1.08 0.00 0.00 179.45 181.40 1mgs h MET 66 N 0.02 0.51 -0.73 3.15 4.05 -1.09 -1.81 114.93 119.03 1mgs h MET 66 Ca 0.03 -0.03 0.14 0.00 -0.28 0.00 0.00 59.70 59.55 1mgs h MET 66 Cb 0.66 -0.11 -0.14 0.00 -0.80 0.00 0.00 31.60 31.21 1mgs h MET 66 CO 0.04 0.33 -0.26 -0.07 0.23 0.00 0.00 176.91 177.18 1mgs h LEU 67 N 0.52 -0.94 -0.92 3.39 3.38 -1.38 0.49 115.31 119.85 1mgs h LEU 67 Ca 0.27 0.24 -0.07 0.00 0.09 0.00 0.00 57.88 58.41 1mgs h LEU 67 Cb 0.22 0.54 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1mgs h LEU 67 CO -0.21 -0.27 0.04 -1.13 0.09 0.00 0.00 178.44 176.96 1mgs h ASN 68 N -0.06 0.79 -1.04 -0.43 -0.73 -1.35 -2.33 115.58 110.43 1mgs h ASN 68 Ca 0.32 -0.18 0.30 0.00 1.87 0.00 0.00 56.30 58.61 1mgs h ASN 68 Cb 0.56 -0.21 -0.04 0.00 0.27 0.00 0.00 38.32 38.90 1mgs h ASN 68 CO -0.77 0.83 1.02 0.77 -0.37 0.00 0.00 177.43 178.92 1mgs h SER 69 N 0.78 0.00 -3.50 1.15 4.64 0.78 -2.68 113.55 114.73 1mgs h SER 69 Ca 0.16 0.00 -0.70 0.00 -0.47 0.00 0.00 61.79 60.78 1mgs h SER 69 Cb 0.41 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.15 1mgs h SER 69 CO 0.01 0.00 -0.20 1.51 -0.87 0.00 0.00 176.83 177.29 1mgs s ASP 70 N -4.15 5.72 -0.50 4.97 1.47 -0.88 -4.97 116.67 118.33 1mgs s ASP 70 Ca -0.04 -3.55 0.03 0.00 1.18 0.00 0.00 52.55 50.17 1mgs s ASP 70 Cb 0.17 -1.87 0.15 0.00 -0.34 0.00 0.00 42.92 41.03 1mgs s ASP 70 CO 0.59 -0.21 0.31 -0.75 0.68 0.00 0.00 175.17 175.79 1mgs s LYS 71 N -1.09 1.57 0.29 2.11 2.20 -1.01 -5.01 119.74 118.79 1mgs s LYS 71 Ca 0.25 -2.38 -0.00 0.00 -0.36 0.00 0.00 55.97 53.48 1mgs s LYS 71 Cb -0.10 -2.55 -0.04 0.00 -1.51 0.00 0.00 37.83 33.63 1mgs s LYS 71 CO -0.11 -1.21 0.50 -1.12 -0.36 0.00 0.00 175.35 173.04 1mgs s SER 72 N -0.15 6.34 0.00 1.43 0.01 -1.26 -5.18 113.70 114.89 1mgs s SER 72 Ca 0.21 0.45 0.28 0.00 1.31 0.00 0.00 55.95 58.21 1mgs s SER 72 Cb -0.16 -2.03 1.14 0.00 0.21 0.00 0.00 66.02 65.18 1mgs s SER 72 CO -0.06 -0.20 1.80 0.59 0.41 0.00 0.00 173.24 175.78