#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mgs s SER 2 N 0.00 -0.31 -0.30 0.00 0.15 -1.26 -5.14 113.70 106.84 1mgs s SER 2 Ca 0.00 -0.15 -0.12 0.00 0.70 0.00 0.00 55.95 56.38 1mgs s SER 2 Cb 0.00 0.41 0.17 0.00 -1.71 0.00 0.00 66.02 64.89 1mgs s SER 2 CO 0.00 -0.03 0.96 0.54 1.20 0.00 0.00 173.24 175.90 1mgs s VAL 3 N 1.99 -0.51 -0.32 4.45 0.11 -1.26 -5.08 120.40 119.78 1mgs s VAL 3 Ca 0.15 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 59.11 1mgs s VAL 3 Cb 0.03 -1.00 0.21 0.00 -1.53 0.00 0.00 36.38 34.09 1mgs s VAL 3 CO -0.15 0.00 1.13 0.00 -3.33 0.00 0.00 175.10 172.75 1mgs s ALA 4 N 2.72 -4.71 -0.74 1.54 0.00 -1.26 -4.94 121.76 114.37 1mgs s ALA 4 Ca 0.02 0.75 -0.08 0.00 0.00 0.00 0.00 51.96 52.65 1mgs s ALA 4 Cb -0.09 -3.01 0.08 0.00 0.00 0.00 0.00 23.12 20.09 1mgs s ALA 4 CO -0.15 -2.55 0.23 -2.37 0.00 0.00 0.00 175.76 170.91 1mgs n THR 5 N 2.66 -0.16 -3.07 0.00 5.66 -1.26 -4.80 114.28 113.31 1mgs n THR 5 Ca 0.10 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.82 1mgs n THR 5 Cb 0.66 -0.47 -0.05 0.00 -1.55 0.00 0.00 70.33 68.92 1mgs n THR 5 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 1mgs n GLU 6 N -3.10 3.24 -3.92 1.09 0.28 -1.26 -4.98 120.64 111.99 1mgs n GLU 6 Ca 0.02 -4.78 -0.31 0.00 -0.16 0.00 0.00 57.16 51.93 1mgs n GLU 6 Cb 0.50 -2.27 -0.15 0.00 1.43 0.00 0.00 31.44 30.94 1mgs n GLU 6 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1mgs s LEU 7 N -3.21 3.66 0.13 -1.84 1.43 -1.26 -5.02 118.68 112.56 1mgs s LEU 7 Ca 0.45 -1.85 0.04 0.00 -1.03 0.00 0.00 54.13 51.73 1mgs s LEU 7 Cb 0.22 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 1mgs s LEU 7 CO -0.09 -0.37 0.13 -0.13 0.23 0.00 0.00 176.35 176.13 1mgs s ARG 8 N 1.19 2.98 -0.91 1.70 0.52 -1.26 -4.63 118.95 118.53 1mgs s ARG 8 Ca 0.08 -0.75 -0.24 0.00 -0.52 0.00 0.00 55.73 54.30 1mgs s ARG 8 Cb -0.18 -2.73 -0.23 0.00 0.52 0.00 0.00 34.95 32.33 1mgs s ARG 8 CO -0.13 0.53 2.49 0.00 0.02 0.00 0.00 175.30 178.20 1mgs h GLN 10 N 12.85 0.00 -2.20 0.00 4.15 -1.95 -0.90 115.11 127.05 1mgs h GLN 10 Ca -0.05 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 58.78 1mgs h GLN 10 Cb 1.23 0.00 -0.42 0.00 0.21 0.00 0.00 27.48 28.51 1mgs h GLN 10 CO 1.39 0.00 -0.67 0.00 -1.93 0.00 0.00 178.83 177.63 1mgs h LEU 12 N 3.70 0.47 0.00 0.00 7.12 -1.52 -3.41 115.31 121.67 1mgs h LEU 12 Ca 0.16 0.17 -0.22 0.00 0.13 0.00 0.00 57.88 58.12 1mgs h LEU 12 Cb 0.63 0.12 -0.04 0.00 -0.53 0.00 0.00 40.66 40.84 1mgs h LEU 12 CO 0.79 -0.12 -0.15 0.00 -0.13 0.00 0.00 178.44 178.83 1mgs n GLN 13 N -4.94 1.52 -3.44 1.25 3.00 -1.26 -5.11 117.38 108.40 1mgs n GLN 13 Ca 0.32 -1.26 -0.13 0.00 -0.01 0.00 0.00 57.00 55.92 1mgs n GLN 13 Cb 1.04 0.31 -0.03 0.00 0.00 0.00 0.00 30.24 31.56 1mgs n GLN 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1mgs s THR 14 N -1.52 0.00 0.01 5.09 -4.23 -1.26 -4.74 115.64 108.98 1mgs s THR 14 Ca 0.02 0.00 0.07 0.00 -1.18 0.00 0.00 61.69 60.59 1mgs s THR 14 Cb -0.00 -1.00 -0.03 0.00 1.34 0.00 0.00 72.50 72.81 1mgs s THR 14 CO 0.01 0.00 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.13 1mgs s LEU 15 N -2.44 2.47 0.48 4.79 1.43 0.04 -4.82 118.68 120.64 1mgs s LEU 15 Ca -0.01 -0.40 0.35 0.00 -1.03 0.00 0.00 54.13 53.03 1mgs s LEU 15 Cb -0.01 -1.46 1.48 0.00 0.03 0.00 0.00 46.19 46.23 1mgs s LEU 15 CO -0.08 0.29 1.68 -0.61 0.23 0.00 0.00 176.35 177.85 1mgs h GLN 16 N 4.96 0.09 0.00 1.70 4.15 -1.94 -2.64 115.11 121.43 1mgs h GLN 16 Ca -0.46 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1mgs h GLN 16 Cb 1.15 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.82 1mgs h GLN 16 CO 0.48 0.06 0.00 0.41 -1.93 0.00 0.00 178.83 177.84 1mgs n GLY 17 N -1.66 0.24 3.60 2.39 0.00 -1.26 -3.81 105.19 104.68 1mgs n GLY 17 Ca 0.34 -1.64 -0.04 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.59 0.00 0.62 -0.61 -5.25 -1.26 -5.07 121.20 107.05 1mgs s ILE 18 Ca 0.00 -0.15 -0.18 0.00 -0.99 0.00 0.00 60.65 59.33 1mgs s ILE 18 Cb 0.00 -1.35 -0.03 0.00 2.95 0.00 0.00 42.46 44.03 1mgs s ILE 18 CO 0.00 0.00 1.12 1.57 -1.79 0.00 0.00 174.94 175.84 1mgs n HIS 19 N -0.27 1.35 1.35 1.37 -0.00 -1.26 -4.85 115.22 112.91 1mgs n HIS 19 Ca -0.05 0.43 0.13 0.00 -0.00 0.00 0.00 57.72 58.23 1mgs n HIS 19 Cb 0.61 -2.20 0.70 0.00 -0.00 0.00 0.00 29.99 29.09 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 -1.42 0.49 0.05 1.57 -0.04 -1.26 -2.87 135.00 131.52 1mgs n PRO 20 Ca 0.15 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.67 1mgs n PRO 20 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 1mgs n PRO 20 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1mgs n LYS 21 N -1.22 0.62 0.10 0.54 5.02 -1.26 -3.78 118.16 118.18 1mgs n LYS 21 Ca 0.14 0.19 0.12 0.00 -2.02 0.00 0.00 58.31 56.75 1mgs n LYS 21 Cb 0.18 -1.81 0.25 0.00 -0.02 0.00 0.00 35.03 33.63 1mgs n LYS 21 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1mgs h ASN 22 N 0.00 0.00 -3.16 4.39 2.35 -1.90 -3.45 115.58 113.81 1mgs h ASN 22 Ca -0.11 -0.08 -0.45 0.00 -0.55 0.00 0.00 56.30 55.10 1mgs h ASN 22 Cb 1.41 0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.84 1mgs h ASN 22 CO 0.03 0.04 0.09 -0.63 -1.65 0.00 0.00 177.43 175.31 1mgs s ILE 23 N -3.16 2.71 0.00 2.81 1.01 -1.24 -2.16 121.20 121.17 1mgs s ILE 23 Ca 0.08 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.31 1mgs s ILE 23 Cb 0.12 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.50 1mgs s ILE 23 CO 0.67 -0.07 0.00 1.67 0.00 0.00 0.00 174.94 177.20 1mgs n GLN 24 N -2.59 0.00 -4.49 2.79 0.00 0.38 -4.21 117.38 109.25 1mgs n GLN 24 Ca 0.07 0.00 -0.24 0.00 -0.00 0.00 0.00 57.00 56.83 1mgs n GLN 24 Cb 0.60 -0.56 -0.10 0.00 0.00 0.00 0.00 30.24 30.18 1mgs n GLN 24 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1mgs s SER 25 N -3.12 2.64 -0.32 1.69 1.04 -0.95 -4.88 113.70 109.79 1mgs s SER 25 Ca 0.00 -1.50 -0.01 0.00 0.48 0.00 0.00 55.95 54.92 1mgs s SER 25 Cb 0.00 0.16 0.13 0.00 0.10 0.00 0.00 66.02 66.41 1mgs s SER 25 CO 0.00 -0.74 0.22 -0.69 0.98 0.00 0.00 173.24 173.01 1mgs s VAL 26 N -3.24 -0.09 -0.41 5.02 1.01 -1.26 -2.14 120.40 119.29 1mgs s VAL 26 Ca 0.30 -1.05 -0.19 0.00 0.00 0.00 0.00 61.98 61.03 1mgs s VAL 26 Cb 0.06 -0.98 0.02 0.00 0.00 0.00 0.00 36.38 35.47 1mgs s VAL 26 CO 0.14 -0.75 0.57 0.21 0.00 0.00 0.00 175.10 175.27 1mgs s ASN 27 N 1.72 6.31 -0.50 3.32 3.84 0.12 -4.86 114.94 124.89 1mgs s ASN 27 Ca 0.13 -0.29 -0.06 0.00 0.21 0.00 0.00 52.86 52.85 1mgs s ASN 27 Cb -0.18 -2.29 0.13 0.00 -0.55 0.00 0.00 41.25 38.36 1mgs s ASN 27 CO -0.20 -0.66 0.35 -0.69 -2.79 0.00 0.00 177.10 173.11 1mgs s VAL 28 N 2.59 3.92 -0.44 -5.21 1.01 -1.26 0.48 120.40 121.49 1mgs s VAL 28 Ca 0.20 -2.12 -0.22 0.00 0.00 0.00 0.00 61.98 59.84 1mgs s VAL 28 Cb -0.15 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.66 1mgs s VAL 28 CO 0.16 -0.78 0.69 -0.75 0.00 0.00 0.00 175.10 174.42 1mgs s LYS 29 N 0.96 3.34 1.07 2.72 2.20 -0.36 -4.95 119.74 124.74 1mgs s LYS 29 Ca 0.09 -0.26 -0.12 0.00 -0.36 0.00 0.00 55.97 55.32 1mgs s LYS 29 Cb -0.23 -3.94 0.23 0.00 -1.51 0.00 0.00 37.83 32.38 1mgs s LYS 29 CO -0.03 -1.03 1.06 -1.54 -0.36 0.00 0.00 175.35 173.45 1mgs s SER 30 N 2.04 1.78 0.37 1.43 1.04 -1.26 -1.99 113.70 117.11 1mgs s SER 30 Ca 0.25 1.53 -0.25 0.00 0.48 0.00 0.00 55.95 57.97 1mgs s SER 30 Cb -0.13 -2.24 -0.10 0.00 0.10 0.00 0.00 66.02 63.65 1mgs s SER 30 CO 0.20 -3.71 1.00 -2.16 0.98 0.00 0.00 173.24 169.55 1mgs s PRO 31 N -4.63 4.35 0.00 4.02 0.04 -1.26 -4.78 135.00 132.75 1mgs s PRO 31 Ca 0.67 1.40 0.00 0.00 0.04 0.00 0.00 61.00 63.11 1mgs s PRO 31 Cb -0.23 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.69 1mgs s PRO 31 CO 0.62 0.05 0.00 0.41 0.04 0.00 0.00 177.00 178.11 1mgs n GLY 32 N 0.34 4.33 0.04 0.56 0.00 0.15 -4.92 105.19 105.68 1mgs n GLY 32 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 0.89 0.00 1.61 -0.04 -1.26 -3.49 135.00 132.71 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 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.46 0.00 -3.59 0.54 1.44 -1.26 -5.03 115.22 106.86 1mgs n HIS 34 Ca 0.00 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.55 1mgs n HIS 34 Cb 0.02 0.00 -0.14 0.00 0.12 0.00 0.00 29.99 29.99 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 5.33 2.55 -3.70 0.00 0.00 -1.26 -0.67 120.51 122.76 1mgs n ALA 36 Ca -0.05 -0.11 -0.32 0.00 0.00 0.00 0.00 53.44 52.96 1mgs n ALA 36 Cb 0.50 -1.15 -0.16 0.00 0.00 0.00 0.00 19.45 18.64 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 -1.97 2.91 0.84 0.00 1.11 -1.26 -4.85 119.66 116.44 1mgs s GLN 37 Ca 0.16 -0.81 -0.16 0.00 0.01 0.00 0.00 55.36 54.56 1mgs s GLN 37 Cb 0.07 -2.37 -0.07 0.00 -1.01 0.00 0.00 33.01 29.64 1mgs s GLN 37 CO 0.12 -0.04 0.01 2.41 0.01 0.00 0.00 175.29 177.81 1mgs n THR 38 N 4.14 0.53 -3.56 -0.19 -1.04 -1.26 -4.50 114.28 108.40 1mgs n THR 38 Ca -0.20 -0.38 -0.25 0.00 -2.04 0.00 0.00 64.05 61.18 1mgs n THR 38 Cb 0.51 -0.39 -0.15 0.00 -1.82 0.00 0.00 70.33 68.48 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 -2.55 0.12 0.24 -2.82 0.41 -0.84 -4.81 118.70 108.45 1mgs s GLU 39 Ca 0.54 -0.12 -0.10 0.00 -0.41 0.00 0.00 54.97 54.89 1mgs s GLU 39 Cb -0.28 -1.52 -0.07 0.00 -1.78 0.00 0.00 34.13 30.48 1mgs s GLU 39 CO 0.69 -0.75 0.56 0.08 -0.49 0.00 0.00 175.26 175.35 1mgs s VAL 40 N 2.18 4.92 0.01 2.63 1.01 -1.24 -1.23 120.40 128.69 1mgs s VAL 40 Ca 0.05 0.47 -0.00 0.00 0.00 0.00 0.00 61.98 62.50 1mgs s VAL 40 Cb -0.16 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1mgs s VAL 40 CO -0.16 -0.10 -0.01 -0.63 0.00 0.00 0.00 175.10 174.19 1mgs s ILE 41 N -1.85 0.08 -0.07 2.22 1.01 0.18 -1.66 121.20 121.11 1mgs s ILE 41 Ca 0.48 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 1mgs s ILE 41 Cb -0.11 -0.22 0.03 0.00 0.01 0.00 0.00 42.46 42.17 1mgs s ILE 41 CO 0.22 -0.38 -0.00 0.00 0.00 0.00 0.00 174.94 174.77 1mgs s ALA 42 N -1.13 0.71 -0.63 9.38 0.00 -0.59 -0.70 121.76 128.80 1mgs s ALA 42 Ca -0.12 -0.13 -0.22 0.00 0.00 0.00 0.00 51.96 51.48 1mgs s ALA 42 Cb -0.08 -0.75 0.07 0.00 0.00 0.00 0.00 23.12 22.37 1mgs s ALA 42 CO -0.01 -0.46 0.90 0.99 0.00 0.00 0.00 175.76 177.19 1mgs s THR 43 N 1.96 4.44 0.99 0.00 2.01 -0.91 -0.98 115.64 123.15 1mgs s THR 43 Ca 0.05 -0.40 -0.19 0.00 0.31 0.00 0.00 61.69 61.46 1mgs s THR 43 Cb -0.12 -4.62 0.00 0.00 0.01 0.00 0.00 72.50 67.77 1mgs s THR 43 CO -0.05 -1.33 -0.49 0.18 -0.69 0.00 0.00 174.62 172.23 1mgs n LEU 44 N 7.38 -2.35 -0.57 4.42 4.77 0.24 0.14 117.00 131.03 1mgs n LEU 44 Ca -0.04 -0.13 0.05 0.00 -0.03 0.00 0.00 56.01 55.86 1mgs n LEU 44 Cb 0.45 -0.71 0.13 0.00 -2.33 0.00 0.00 43.42 40.97 1mgs n LEU 44 CO 0.63 -2.79 0.61 0.29 -1.33 0.00 0.00 177.39 174.79 1mgs n LYS 45 N 0.03 1.73 -0.67 3.23 5.02 -0.92 -3.63 118.16 122.95 1mgs n LYS 45 Ca 0.01 -1.08 0.00 0.00 -2.02 0.00 0.00 58.31 55.22 1mgs n LYS 45 Cb 0.55 -1.26 0.21 0.00 -0.02 0.00 0.00 35.03 34.51 1mgs n LYS 45 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1mgs n ASN 46 N 0.36 2.58 -0.08 4.39 6.94 -1.26 -4.89 115.26 123.29 1mgs n ASN 46 Ca 0.10 -3.63 -0.01 0.00 -0.02 0.00 0.00 54.58 51.02 1mgs n ASN 46 Cb 0.27 -0.59 -0.00 0.00 -2.36 0.00 0.00 39.78 37.09 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 -1.05 0.37 3.99 4.83 0.00 -1.24 -4.99 105.19 107.10 1mgs n GLY 47 Ca 0.28 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.11 3.07 0.06 1.61 0.52 -1.26 -4.93 118.95 116.91 1mgs s ARG 48 Ca 0.00 -1.05 0.01 0.00 -0.52 0.00 0.00 55.73 54.17 1mgs s ARG 48 Cb 0.00 -2.80 -0.03 0.00 0.52 0.00 0.00 34.95 32.64 1mgs s ARG 48 CO 0.00 0.02 -0.06 0.15 0.02 0.00 0.00 175.30 175.42 1mgs s LYS 49 N -4.19 0.60 -0.16 3.54 3.01 -1.26 0.82 119.74 122.10 1mgs s LYS 49 Ca 0.46 -0.96 -0.07 0.00 -1.01 0.00 0.00 55.97 54.39 1mgs s LYS 49 Cb -0.09 -0.17 0.07 0.00 -1.01 0.00 0.00 37.83 36.63 1mgs s LYS 49 CO 0.31 0.00 0.36 0.00 0.51 0.00 0.00 175.35 176.54 1mgs s ALA 50 N -2.33 -0.93 0.34 5.17 0.00 -0.15 -4.88 121.76 118.98 1mgs s ALA 50 Ca -0.02 1.33 -0.25 0.00 0.00 0.00 0.00 51.96 53.01 1mgs s ALA 50 Cb -0.04 -1.08 -0.10 0.00 0.00 0.00 0.00 23.12 21.91 1mgs s ALA 50 CO -0.02 -0.54 0.96 0.00 0.00 0.00 0.00 175.76 176.15 1mgs s LEU 52 N -2.20 2.68 -0.30 0.00 1.43 -0.66 -0.78 118.68 118.84 1mgs s LEU 52 Ca 0.52 -1.29 -0.14 0.00 -1.03 0.00 0.00 54.13 52.19 1mgs s LEU 52 Cb -0.18 -0.82 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 1mgs s LEU 52 CO 0.23 -0.37 0.33 0.21 0.23 0.00 0.00 176.35 176.98 1mgs s ASN 53 N -3.61 6.18 0.00 2.29 3.04 -0.99 -3.63 114.94 118.21 1mgs s ASN 53 Ca 0.34 0.02 0.23 0.00 0.04 0.00 0.00 52.86 53.48 1mgs s ASN 53 Cb 0.06 -2.19 1.34 0.00 -1.54 0.00 0.00 41.25 38.93 1mgs s ASN 53 CO 0.16 -0.22 1.73 -0.81 -3.04 0.00 0.00 177.10 174.92 1mgs n PRO 54 N 5.30 0.69 0.03 0.43 -0.04 -1.26 -2.33 135.00 137.81 1mgs n PRO 54 Ca -0.10 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.48 1mgs n PRO 54 Cb 0.50 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.52 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 -1.02 3.41 -2.30 0.55 0.00 -1.26 -4.72 120.51 115.16 1mgs n ALA 55 Ca 0.17 -0.39 -0.25 0.00 0.00 0.00 0.00 53.44 52.97 1mgs n ALA 55 Cb 0.08 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.54 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 -3.85 5.96 0.09 0.00 1.04 -0.99 -5.01 113.70 110.95 1mgs s SER 56 Ca 0.05 0.59 -0.06 0.00 0.48 0.00 0.00 55.95 57.00 1mgs s SER 56 Cb 0.15 -1.85 -0.21 0.00 0.10 0.00 0.00 66.02 64.21 1mgs s SER 56 CO 0.79 -0.69 1.19 1.55 0.98 0.00 0.00 173.24 177.06 1mgs h PRO 57 N 0.27 0.39 -0.39 4.02 0.13 -1.90 -3.06 132.00 131.46 1mgs h PRO 57 Ca -0.47 -0.53 -0.09 0.00 -0.87 0.00 0.00 66.00 64.04 1mgs h PRO 57 Cb 1.23 0.18 -0.02 0.00 0.13 0.00 0.00 31.00 32.53 1mgs h PRO 57 CO 0.60 1.21 -0.13 0.82 -0.23 0.00 0.00 178.00 180.27 1mgs h ILE 58 N 0.17 1.25 0.08 -3.56 2.04 -1.92 -2.25 117.51 113.32 1mgs h ILE 58 Ca -0.13 -1.15 -0.00 0.00 1.00 0.00 0.00 64.86 64.58 1mgs h ILE 58 Cb 1.82 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 39.00 1mgs h ILE 58 CO 0.20 0.39 -0.04 0.58 0.00 0.00 0.00 178.15 179.27 1mgs h VAL 59 N 0.63 1.14 -0.58 1.67 2.07 -1.66 0.47 116.25 119.99 1mgs h VAL 59 Ca 0.11 -0.86 0.16 0.00 0.82 0.00 0.00 66.70 66.93 1mgs h VAL 59 Cb 0.58 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1mgs h VAL 59 CO 0.04 0.21 0.42 0.11 0.02 0.00 0.00 177.57 178.36 1mgs h LYS 60 N -0.51 0.02 0.00 1.57 1.57 -1.46 0.30 116.57 118.06 1mgs h LYS 60 Ca -0.01 -0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.57 1mgs h LYS 60 Cb 0.43 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1mgs h LYS 60 CO 0.02 0.01 -1.03 0.87 -0.57 0.00 0.00 179.45 178.75 1mgs h LYS 61 N 0.02 0.00 -0.83 3.15 1.79 -1.06 -2.72 116.57 116.93 1mgs h LYS 61 Ca 0.28 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.76 1mgs h LYS 61 Cb 1.08 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.68 1mgs h LYS 61 CO -0.01 0.80 0.55 0.82 -1.08 0.00 0.00 179.45 180.52 1mgs h ILE 62 N 0.00 1.19 0.16 1.86 2.04 0.19 -0.48 117.51 122.47 1mgs h ILE 62 Ca -0.06 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1mgs h ILE 62 Cb 1.72 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1mgs h ILE 62 CO 0.11 0.20 -0.08 0.40 0.00 0.00 0.00 178.15 178.78 1mgs h ILE 63 N 1.09 0.00 -1.48 -0.67 5.03 -1.48 -2.78 117.51 117.22 1mgs h ILE 63 Ca 0.31 -0.68 0.43 0.00 -0.12 0.00 0.00 64.86 64.80 1mgs h ILE 63 Cb -0.08 0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 33.65 1mgs h ILE 63 CO -0.08 0.00 1.17 -0.08 -0.68 0.00 0.00 178.15 178.49 1mgs h GLU 64 N -0.90 0.00 0.26 2.37 4.22 -1.41 0.70 114.58 119.82 1mgs h GLU 64 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.40 1mgs h GLU 64 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1mgs h GLU 64 CO 0.04 0.00 -0.13 0.87 -2.18 0.00 0.00 179.01 177.61 1mgs h LYS 65 N 0.00 -0.34 -0.84 1.92 1.57 -1.08 -3.25 116.57 114.55 1mgs h LYS 65 Ca 0.70 0.02 0.20 0.00 -1.87 0.00 0.00 60.65 59.70 1mgs h LYS 65 Cb 3.05 0.08 -0.15 0.00 0.08 0.00 0.00 32.23 35.28 1mgs h LYS 65 CO -0.01 -0.23 -0.03 0.52 -0.57 0.00 0.00 179.45 179.14 1mgs h MET 66 N -1.07 0.06 -0.79 3.15 2.86 -0.60 0.33 114.93 118.86 1mgs h MET 66 Ca -0.04 -0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.75 1mgs h MET 66 Cb 0.27 -0.01 -0.15 0.00 0.06 0.00 0.00 31.60 31.77 1mgs h MET 66 CO 0.06 0.04 -0.25 -0.07 1.06 0.00 0.00 176.91 177.75 1mgs h LEU 67 N 0.06 -0.91 -0.99 1.22 3.38 -1.41 0.77 115.31 117.42 1mgs h LEU 67 Ca 0.46 0.25 -0.08 0.00 0.09 0.00 0.00 57.88 58.60 1mgs h LEU 67 Cb 0.84 0.55 -0.02 0.00 0.09 0.00 0.00 40.66 42.12 1mgs h LEU 67 CO -0.77 -0.28 -0.18 -1.13 0.09 0.00 0.00 178.44 176.17 1mgs h ASN 68 N -0.03 0.51 -1.11 -0.43 -1.24 -0.43 -2.60 115.58 110.26 1mgs h ASN 68 Ca 0.36 -0.15 0.32 0.00 0.71 0.00 0.00 56.30 57.54 1mgs h ASN 68 Cb 0.59 -0.14 -0.04 0.00 0.73 0.00 0.00 38.32 39.46 1mgs h ASN 68 CO -0.83 0.71 1.05 0.77 -1.29 0.00 0.00 177.43 177.84 1mgs h SER 69 N 0.47 0.00 -2.42 1.15 4.64 0.16 -1.06 113.55 116.48 1mgs h SER 69 Ca 0.08 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.72 1mgs h SER 69 Cb 0.58 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.30 1mgs h SER 69 CO 0.04 0.00 -0.03 -0.90 -0.87 0.00 0.00 176.83 175.07 1mgs n ASP 70 N -3.60 5.03 -3.91 4.97 5.75 -0.98 -4.93 116.55 118.88 1mgs n ASP 70 Ca 0.24 -3.50 -0.29 0.00 -0.01 0.00 0.00 54.79 51.24 1mgs n ASP 70 Cb 1.40 -0.88 -0.13 0.00 -1.03 0.00 0.00 41.12 40.49 1mgs n ASP 70 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1mgs s LYS 71 N -2.92 2.33 0.47 0.11 2.36 -0.40 -5.05 119.74 116.63 1mgs s LYS 71 Ca 0.39 -3.15 0.00 0.00 -2.55 0.00 0.00 55.97 50.66 1mgs s LYS 71 Cb 0.14 -3.39 0.00 0.00 -1.05 0.00 0.00 37.83 33.53 1mgs s LYS 71 CO -0.01 -1.24 0.00 0.45 1.55 0.00 0.00 175.35 176.11 1mgs n SER 72 N 2.28 -8.57 0.00 1.43 2.88 -1.26 -5.16 113.62 105.23 1mgs n SER 72 Ca 0.16 0.99 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 1mgs n SER 72 Cb 0.34 -4.60 0.00 0.00 -0.75 0.00 0.00 64.21 59.21 1mgs n SER 72 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35