#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 1.75 -0.15 0.00 7.64 -1.26 -4.58 113.62 117.02 1mgs n SER 2 Ca 0.00 -3.88 0.02 0.00 1.01 0.00 0.00 58.87 56.02 1mgs n SER 2 Cb 0.00 -0.53 0.01 0.00 -1.01 0.00 0.00 64.21 62.69 1mgs n SER 2 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1mgs n VAL 3 N -1.13 0.00 -1.75 0.44 0.24 -1.26 -5.05 118.33 109.82 1mgs n VAL 3 Ca 0.19 -0.50 -0.01 0.00 -2.04 0.00 0.00 64.34 61.99 1mgs n VAL 3 Cb 0.69 1.08 0.00 0.00 -1.47 0.00 0.00 33.84 34.14 1mgs n VAL 3 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mgs n ALA 4 N 0.14 -3.04 -1.37 2.33 0.00 -1.26 -4.96 120.51 112.36 1mgs n ALA 4 Ca 0.02 0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.49 1mgs n ALA 4 Cb 0.09 -0.53 0.18 0.00 0.00 0.00 0.00 19.45 19.20 1mgs n ALA 4 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1mgs n THR 5 N -0.23 2.91 0.00 0.00 5.66 -1.26 -4.92 114.28 116.44 1mgs n THR 5 Ca 0.01 -2.42 0.00 0.00 -3.05 0.00 0.00 64.05 58.59 1mgs n THR 5 Cb 0.05 -0.45 0.00 0.00 -1.55 0.00 0.00 70.33 68.39 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 -1.12 0.00 -3.87 1.09 0.28 -1.26 -5.12 120.64 110.64 1mgs n GLU 6 Ca 0.47 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 57.14 1mgs n GLU 6 Cb 1.31 0.00 -0.13 0.00 1.43 0.00 0.00 31.44 34.06 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 0.00 5.00 0.23 -1.84 1.43 -1.26 -5.09 118.68 117.14 1mgs s LEU 7 Ca 0.00 -2.24 -0.02 0.00 -1.03 0.00 0.00 54.13 50.83 1mgs s LEU 7 Cb 0.00 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 1mgs s LEU 7 CO 0.00 -0.44 0.44 -0.13 0.23 0.00 0.00 176.35 176.45 1mgs s ARG 8 N 0.81 3.56 -0.55 1.70 0.52 -1.26 -4.64 118.95 119.09 1mgs s ARG 8 Ca 0.11 -0.22 -0.38 0.00 -0.52 0.00 0.00 55.73 54.72 1mgs s ARG 8 Cb -0.21 -2.78 -0.17 0.00 0.52 0.00 0.00 34.95 32.31 1mgs s ARG 8 CO -0.05 0.35 2.28 0.00 0.02 0.00 0.00 175.30 177.89 1mgs h GLN 10 N 11.10 0.00 -2.29 0.00 1.08 -1.93 -2.79 115.11 120.28 1mgs h GLN 10 Ca -0.15 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.47 1mgs h GLN 10 Cb 1.36 0.00 -0.38 0.00 -0.05 0.00 0.00 27.48 28.41 1mgs h GLN 10 CO 1.13 0.00 -1.00 0.00 -0.95 0.00 0.00 178.83 178.01 1mgs h LEU 12 N 5.29 0.29 -8.22 0.00 7.12 -1.87 -3.36 115.31 114.56 1mgs h LEU 12 Ca 0.23 0.12 -0.67 0.00 0.13 0.00 0.00 57.88 57.69 1mgs h LEU 12 Cb 0.90 0.10 -0.32 0.00 -0.53 0.00 0.00 40.66 40.81 1mgs h LEU 12 CO 0.39 0.08 -0.82 -1.58 -0.13 0.00 0.00 178.44 176.38 1mgs s GLN 13 N -5.99 3.12 0.43 1.25 0.74 -1.26 -5.12 119.66 112.84 1mgs s GLN 13 Ca -0.12 -0.77 0.08 0.00 0.05 0.00 0.00 55.36 54.60 1mgs s GLN 13 Cb 0.22 -2.66 0.01 0.00 1.10 0.00 0.00 33.01 31.68 1mgs s GLN 13 CO 0.77 -0.13 0.57 0.95 -0.55 0.00 0.00 175.29 176.89 1mgs s THR 14 N 1.17 2.93 0.08 -0.34 -4.23 -1.26 -4.74 115.64 109.24 1mgs s THR 14 Ca 0.01 -1.02 0.07 0.00 -1.18 0.00 0.00 61.69 59.57 1mgs s THR 14 Cb -0.14 -2.95 -0.03 0.00 1.34 0.00 0.00 72.50 70.72 1mgs s THR 14 CO -0.07 0.00 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.07 1mgs s LEU 15 N -4.35 2.26 0.19 4.79 1.43 0.42 -4.86 118.68 118.56 1mgs s LEU 15 Ca 0.55 -0.61 -0.21 0.00 -1.03 0.00 0.00 54.13 52.82 1mgs s LEU 15 Cb -0.09 -0.74 0.12 0.00 0.03 0.00 0.00 46.19 45.52 1mgs s LEU 15 CO 0.33 0.02 1.57 -0.61 0.23 0.00 0.00 176.35 177.90 1mgs h GLN 16 N 4.35 -0.14 0.00 1.70 4.15 -1.94 -2.66 115.11 120.58 1mgs h GLN 16 Ca -0.43 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.00 1mgs h GLN 16 Cb 1.18 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.90 1mgs h GLN 16 CO 0.41 -0.09 0.00 0.41 -1.93 0.00 0.00 178.83 177.63 1mgs n GLY 17 N -1.43 2.87 3.18 2.39 0.00 -1.26 -3.65 105.19 107.29 1mgs n GLY 17 Ca 0.05 -1.41 -0.11 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.00 0.59 0.46 -0.61 -0.00 -1.26 -5.03 121.20 113.35 1mgs s ILE 18 Ca 0.00 -1.93 -0.20 0.00 -0.00 0.00 0.00 60.65 58.51 1mgs s ILE 18 Cb 0.00 -1.81 -0.13 0.00 -0.00 0.00 0.00 42.46 40.51 1mgs s ILE 18 CO 0.00 -0.75 0.24 1.57 -0.00 0.00 0.00 174.94 176.00 1mgs n HIS 19 N -0.08 -1.60 1.32 1.37 -0.00 -1.26 -4.78 115.22 110.19 1mgs n HIS 19 Ca -0.10 0.55 0.12 0.00 0.46 0.00 0.00 57.72 58.75 1mgs n HIS 19 Cb 0.62 -1.85 0.66 0.00 -0.12 0.00 0.00 29.99 29.30 1mgs n HIS 19 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1mgs n PRO 20 N 0.93 0.54 0.04 1.57 -0.04 -1.26 -2.61 135.00 134.17 1mgs n PRO 20 Ca 0.11 0.03 0.01 0.00 -0.04 0.00 0.00 63.50 63.61 1mgs n PRO 20 Cb 0.43 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.31 1mgs n PRO 20 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1mgs n LYS 21 N -1.15 0.62 0.00 0.54 3.00 -1.26 -3.68 118.16 116.23 1mgs n LYS 21 Ca 0.15 0.20 0.15 0.00 -0.00 0.00 0.00 58.31 58.81 1mgs n LYS 21 Cb 0.14 -1.80 0.71 0.00 0.00 0.00 0.00 35.03 34.08 1mgs n LYS 21 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1mgs n ASN 22 N -2.86 0.19 -4.73 3.14 3.02 -1.07 -4.81 115.26 108.14 1mgs n ASN 22 Ca -0.09 -0.39 -0.30 0.00 -0.03 0.00 0.00 54.58 53.77 1mgs n ASN 22 Cb 0.81 -0.17 -0.07 0.00 -0.61 0.00 0.00 39.78 39.74 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 -2.49 4.30 0.00 2.41 1.01 -1.24 -2.47 121.20 122.71 1mgs s ILE 23 Ca 0.30 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.11 1mgs s ILE 23 Cb 0.20 -3.05 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1mgs s ILE 23 CO 0.46 0.14 0.00 0.00 0.00 0.00 0.00 174.94 175.54 1mgs n GLN 24 N 0.57 3.14 -4.28 2.79 -0.00 -0.10 -4.61 117.38 114.90 1mgs n GLN 24 Ca -0.10 0.00 -0.15 0.00 -0.00 0.00 0.00 57.00 56.75 1mgs n GLN 24 Cb 0.52 -0.98 -0.10 0.00 -0.00 0.00 0.00 30.24 29.68 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 -2.72 0.93 -0.24 2.61 1.04 -1.09 -4.95 113.70 109.27 1mgs s SER 25 Ca 0.00 -1.35 -0.12 0.00 0.48 0.00 0.00 55.95 54.96 1mgs s SER 25 Cb 0.00 0.21 0.09 0.00 0.10 0.00 0.00 66.02 66.42 1mgs s SER 25 CO 0.00 -0.74 0.57 -0.69 0.98 0.00 0.00 173.24 173.36 1mgs s VAL 26 N -3.85 -0.32 0.22 5.02 1.01 -1.26 -2.07 120.40 119.15 1mgs s VAL 26 Ca 0.36 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.46 1mgs s VAL 26 Cb 0.07 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 1mgs s VAL 26 CO 0.12 0.02 0.10 0.21 0.00 0.00 0.00 175.10 175.55 1mgs s ASN 27 N 2.01 5.14 -0.32 3.32 2.47 -0.51 -4.93 114.94 122.11 1mgs s ASN 27 Ca -0.08 -0.35 -0.01 0.00 0.42 0.00 0.00 52.86 52.85 1mgs s ASN 27 Cb -0.08 -1.20 0.13 0.00 -1.45 0.00 0.00 41.25 38.64 1mgs s ASN 27 CO -0.17 0.02 0.23 -0.69 -3.72 0.00 0.00 177.10 172.77 1mgs s VAL 28 N -2.02 -0.14 -0.22 -5.21 1.01 -1.26 -2.25 120.40 110.31 1mgs s VAL 28 Ca 0.31 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 1mgs s VAL 28 Cb -0.08 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.29 1mgs s VAL 28 CO 0.22 -0.72 0.14 -0.54 0.00 0.00 0.00 175.10 174.20 1mgs s LYS 29 N 1.75 4.09 0.70 2.72 1.02 -0.85 -4.98 119.74 124.19 1mgs s LYS 29 Ca 0.13 -0.27 -0.11 0.00 0.02 0.00 0.00 55.97 55.74 1mgs s LYS 29 Cb -0.17 -3.46 0.01 0.00 -0.52 0.00 0.00 37.83 33.69 1mgs s LYS 29 CO -0.19 0.15 1.06 -1.54 -0.92 0.00 0.00 175.35 173.91 1mgs s SER 30 N 0.78 5.34 0.37 2.83 1.04 -1.26 -1.54 113.70 121.26 1mgs s SER 30 Ca 0.07 1.52 -0.25 0.00 0.48 0.00 0.00 55.95 57.78 1mgs s SER 30 Cb -0.13 -2.39 -0.09 0.00 0.10 0.00 0.00 66.02 63.51 1mgs s SER 30 CO 0.02 -1.45 1.01 -2.16 0.98 0.00 0.00 173.24 171.63 1mgs s PRO 31 N -5.09 4.32 0.00 4.02 0.04 -1.25 -4.81 135.00 132.23 1mgs s PRO 31 Ca 0.58 1.43 0.00 0.00 0.04 0.00 0.00 61.00 63.05 1mgs s PRO 31 Cb -0.14 -2.62 0.00 0.00 0.04 0.00 0.00 34.50 31.79 1mgs s PRO 31 CO 0.55 0.02 0.00 0.41 0.04 0.00 0.00 177.00 178.01 1mgs n GLY 32 N 0.35 3.33 1.57 0.56 0.00 -0.95 -4.90 105.19 105.16 1mgs n GLY 32 Ca 0.04 -0.05 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 1.14 0.00 1.61 -0.04 -1.26 -3.61 135.00 132.85 1mgs n PRO 33 Ca 0.00 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 1mgs n PRO 33 Cb 0.00 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 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 1.65 0.00 -3.43 0.54 1.44 -1.26 -4.94 115.22 109.21 1mgs n HIS 34 Ca 0.06 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.58 1mgs n HIS 34 Cb 0.56 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.56 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 5.30 1.16 -2.91 0.00 0.00 -1.26 -2.23 120.51 120.57 1mgs n ALA 36 Ca -0.03 0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.15 1mgs n ALA 36 Cb 0.46 -1.20 -0.11 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 -3.26 3.78 1.00 0.00 1.11 -1.26 -4.71 119.66 116.33 1mgs s GLN 37 Ca 0.00 -0.45 -0.16 0.00 0.01 0.00 0.00 55.36 54.76 1mgs s GLN 37 Cb 0.05 -3.05 -0.01 0.00 -1.01 0.00 0.00 33.01 28.99 1mgs s GLN 37 CO 0.15 0.23 -0.12 2.41 0.01 0.00 0.00 175.29 177.97 1mgs n THR 38 N 3.60 0.00 -3.71 -0.19 -1.04 -1.26 -4.51 114.28 107.18 1mgs n THR 38 Ca -0.17 -0.27 -0.25 0.00 -2.04 0.00 0.00 64.05 61.33 1mgs n THR 38 Cb 0.52 -0.42 -0.17 0.00 -1.82 0.00 0.00 70.33 68.44 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 -3.09 0.39 -0.02 -2.82 8.01 -0.59 -4.85 118.70 115.73 1mgs s GLU 39 Ca 0.51 -0.07 -0.01 0.00 0.01 0.00 0.00 54.97 55.42 1mgs s GLU 39 Cb -0.16 -1.47 -0.04 0.00 -4.31 0.00 0.00 34.13 28.15 1mgs s GLU 39 CO 0.71 -0.50 0.07 0.08 0.01 0.00 0.00 175.26 175.62 1mgs s VAL 40 N 2.01 4.65 0.07 2.63 1.01 -1.24 -2.01 120.40 127.52 1mgs s VAL 40 Ca 0.02 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.65 1mgs s VAL 40 Cb -0.15 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1mgs s VAL 40 CO -0.07 0.39 -0.10 -0.63 0.00 0.00 0.00 175.10 174.69 1mgs s ILE 41 N -1.14 0.86 -0.10 2.22 1.09 -0.96 -1.61 121.20 121.56 1mgs s ILE 41 Ca 0.21 -1.39 -0.02 0.00 -1.10 0.00 0.00 60.65 58.35 1mgs s ILE 41 Cb -0.12 -1.06 0.04 0.00 -1.06 0.00 0.00 42.46 40.26 1mgs s ILE 41 CO 0.12 -0.42 0.04 0.00 -0.10 0.00 0.00 174.94 174.58 1mgs s ALA 42 N -1.83 0.55 -0.72 9.38 0.00 -0.60 -1.43 121.76 127.12 1mgs s ALA 42 Ca -0.01 -0.15 -0.21 0.00 0.00 0.00 0.00 51.96 51.58 1mgs s ALA 42 Cb -0.07 -0.83 0.09 0.00 0.00 0.00 0.00 23.12 22.31 1mgs s ALA 42 CO 0.01 -0.72 0.98 0.99 0.00 0.00 0.00 175.76 177.02 1mgs s THR 43 N 2.05 4.47 1.03 0.00 2.01 -0.88 -0.65 115.64 123.67 1mgs s THR 43 Ca 0.03 -0.73 -0.22 0.00 0.31 0.00 0.00 61.69 61.09 1mgs s THR 43 Cb -0.14 -4.69 -0.08 0.00 0.01 0.00 0.00 72.50 67.60 1mgs s THR 43 CO -0.06 -1.44 -0.77 0.18 -0.69 0.00 0.00 174.62 171.85 1mgs n LEU 44 N 7.28 -3.10 -0.11 4.42 4.77 0.25 -0.92 117.00 129.60 1mgs n LEU 44 Ca 0.02 0.04 0.03 0.00 -0.03 0.00 0.00 56.01 56.08 1mgs n LEU 44 Cb 0.46 -0.76 0.16 0.00 -2.33 0.00 0.00 43.42 40.95 1mgs n LEU 44 CO 0.60 -3.48 0.61 2.29 -1.33 0.00 0.00 177.39 176.07 1mgs n LYS 45 N 0.77 1.13 -0.43 3.23 2.85 -1.03 -3.15 118.16 121.53 1mgs n LYS 45 Ca -0.00 -0.21 0.09 0.00 -1.05 0.00 0.00 58.31 57.14 1mgs n LYS 45 Cb 0.66 -1.12 0.26 0.00 -0.65 0.00 0.00 35.03 34.18 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 -0.40 3.84 0.00 -5.58 6.94 -1.26 -4.90 115.26 113.90 1mgs n ASN 46 Ca 0.05 -3.02 0.00 0.00 -0.02 0.00 0.00 54.58 51.60 1mgs n ASN 46 Cb 0.07 -0.54 0.00 0.00 -2.36 0.00 0.00 39.78 36.95 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 -0.53 0.77 3.97 4.83 0.00 -1.19 -5.02 105.19 108.03 1mgs n GLY 47 Ca 0.21 0.00 -0.21 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 -0.00 2.74 0.07 1.61 0.52 -1.26 -4.90 118.95 117.73 1mgs s ARG 48 Ca 0.00 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.43 1mgs s ARG 48 Cb 0.00 -2.56 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 1mgs s ARG 48 CO 0.00 -0.50 -0.06 0.15 0.02 0.00 0.00 175.30 174.91 1mgs s LYS 49 N -4.62 0.68 -0.18 3.54 3.01 -1.26 0.86 119.74 121.77 1mgs s LYS 49 Ca 0.54 -1.11 -0.06 0.00 -1.01 0.00 0.00 55.97 54.33 1mgs s LYS 49 Cb -0.10 -0.13 0.08 0.00 -1.01 0.00 0.00 37.83 36.67 1mgs s LYS 49 CO 0.37 -0.02 0.37 0.00 0.51 0.00 0.00 175.35 176.58 1mgs s ALA 50 N -2.95 -0.96 0.22 5.17 0.00 0.17 -4.87 121.76 118.55 1mgs s ALA 50 Ca 0.03 1.31 -0.30 0.00 0.00 0.00 0.00 51.96 53.01 1mgs s ALA 50 Cb 0.01 -1.22 -0.08 0.00 0.00 0.00 0.00 23.12 21.82 1mgs s ALA 50 CO -0.04 -0.72 0.95 0.00 0.00 0.00 0.00 175.76 175.95 1mgs s LEU 52 N -0.99 2.58 -0.27 0.00 1.43 -0.63 -0.44 118.68 120.36 1mgs s LEU 52 Ca 0.42 -1.31 -0.10 0.00 -1.03 0.00 0.00 54.13 52.11 1mgs s LEU 52 Cb -0.26 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 1mgs s LEU 52 CO 0.32 -0.44 0.16 0.21 0.23 0.00 0.00 176.35 176.83 1mgs s ASN 53 N -3.58 5.78 0.00 2.29 3.84 -1.00 -3.60 114.94 118.67 1mgs s ASN 53 Ca 0.34 -0.07 0.20 0.00 0.21 0.00 0.00 52.86 53.54 1mgs s ASN 53 Cb 0.07 -2.07 1.22 0.00 -0.55 0.00 0.00 41.25 39.93 1mgs s ASN 53 CO 0.16 -0.05 1.64 -0.81 -2.79 0.00 0.00 177.10 175.25 1mgs n PRO 54 N 5.02 0.74 0.09 0.43 -0.04 -1.26 -2.58 135.00 137.41 1mgs n PRO 54 Ca -0.15 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.43 1mgs n PRO 54 Cb 0.52 -1.43 0.10 0.00 -0.04 0.00 0.00 33.50 32.65 1mgs n PRO 54 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mgs h ALA 55 N 3.34 0.57 -2.17 0.55 0.00 -1.97 -3.43 119.26 116.16 1mgs h ALA 55 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 1mgs h ALA 55 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.83 1mgs h ALA 55 CO 0.00 0.00 0.02 -1.54 0.00 0.00 0.00 179.25 177.73 1mgs s SER 56 N -4.83 5.79 0.12 0.00 1.04 -1.06 -5.00 113.70 109.75 1mgs s SER 56 Ca 0.03 0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.97 1mgs s SER 56 Cb 0.11 -1.67 -0.16 0.00 0.10 0.00 0.00 66.02 64.40 1mgs s SER 56 CO 0.75 -0.81 1.26 1.55 0.98 0.00 0.00 173.24 176.97 1mgs h PRO 57 N 0.18 0.20 -0.09 4.02 0.13 -1.90 -2.99 132.00 131.56 1mgs h PRO 57 Ca -0.46 -0.29 -0.02 0.00 -0.87 0.00 0.00 66.00 64.36 1mgs h PRO 57 Cb 1.25 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 1mgs h PRO 57 CO 0.59 1.08 -0.02 0.97 -0.23 0.00 0.00 178.00 180.39 1mgs h ILE 58 N 0.08 1.29 -0.24 -3.56 -0.00 -1.92 -2.24 117.51 110.92 1mgs h ILE 58 Ca -0.07 -0.92 0.03 0.00 -0.00 0.00 0.00 64.86 63.89 1mgs h ILE 58 Cb 1.74 1.72 -0.03 0.00 -0.00 0.00 0.00 36.82 40.25 1mgs h ILE 58 CO 0.16 0.26 0.05 0.58 -0.00 0.00 0.00 178.15 179.21 1mgs h VAL 59 N -0.15 0.90 -0.72 2.19 2.07 -1.65 0.13 116.25 119.02 1mgs h VAL 59 Ca 0.02 -0.05 0.18 0.00 0.82 0.00 0.00 66.70 67.67 1mgs h VAL 59 Cb 0.42 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 1mgs h VAL 59 CO 0.01 0.03 0.50 0.11 0.02 0.00 0.00 177.57 178.23 1mgs h LYS 60 N 0.15 0.20 -0.06 1.57 1.79 -1.45 0.40 116.57 119.17 1mgs h LYS 60 Ca 0.11 -0.01 -0.18 0.00 -2.18 0.00 0.00 60.65 58.39 1mgs h LYS 60 Cb 0.10 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 1mgs h LYS 60 CO -0.14 0.13 -0.73 0.87 -1.08 0.00 0.00 179.45 178.50 1mgs h LYS 61 N 0.20 0.32 -0.54 3.15 1.79 -0.18 -2.70 116.57 118.62 1mgs h LYS 61 Ca 0.35 -0.27 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1mgs h LYS 61 Cb 1.09 0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.77 1mgs h LYS 61 CO -0.07 0.92 0.36 0.82 -1.08 0.00 0.00 179.45 180.39 1mgs h ILE 62 N 0.22 1.13 0.50 1.86 5.03 0.14 0.35 117.51 126.73 1mgs h ILE 62 Ca -0.03 -0.25 -0.02 0.00 -0.12 0.00 0.00 64.86 64.44 1mgs h ILE 62 Cb 1.30 0.34 0.00 0.00 -3.03 0.00 0.00 36.82 35.44 1mgs h ILE 62 CO 0.12 0.13 -0.24 0.40 -0.68 0.00 0.00 178.15 177.88 1mgs h ILE 63 N 0.72 0.00 0.00 -0.67 5.03 -1.39 -0.74 117.51 120.47 1mgs h ILE 63 Ca 0.20 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.69 1mgs h ILE 63 Cb -0.08 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.71 1mgs h ILE 63 CO -0.05 0.00 0.07 1.05 -0.68 0.00 0.00 178.15 178.54 1mgs h GLU 64 N -0.91 0.00 0.13 2.37 4.11 -1.47 0.65 114.58 119.46 1mgs h GLU 64 Ca -0.07 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.06 1mgs h GLU 64 Cb 0.51 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1mgs h GLU 64 CO 0.11 0.00 -1.49 0.87 0.07 0.00 0.00 179.01 178.57 1mgs h LYS 65 N 0.00 0.28 -0.23 1.06 1.79 -0.02 -3.32 116.57 116.14 1mgs h LYS 65 Ca 0.00 -0.48 -0.08 0.00 -2.18 0.00 0.00 60.65 57.91 1mgs h LYS 65 Cb 0.13 0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1mgs h LYS 65 CO 0.00 1.17 -0.16 1.98 -1.08 0.00 0.00 179.45 181.36 1mgs h MET 66 N 0.08 0.51 -0.80 3.15 4.05 0.65 -1.48 114.93 121.07 1mgs h MET 66 Ca -0.23 -0.24 0.16 0.00 -0.28 0.00 0.00 59.70 59.10 1mgs h MET 66 Cb 2.02 -0.00 -0.15 0.00 -0.80 0.00 0.00 31.60 32.67 1mgs h MET 66 CO 0.18 0.80 -0.23 -0.07 0.23 0.00 0.00 176.91 177.82 1mgs h LEU 67 N 0.21 -0.85 -0.36 3.39 3.38 -1.50 0.40 115.31 119.97 1mgs h LEU 67 Ca 0.04 0.25 -0.19 0.00 0.09 0.00 0.00 57.88 58.07 1mgs h LEU 67 Cb 0.68 0.53 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1mgs h LEU 67 CO 0.04 -0.28 -0.69 -1.13 0.09 0.00 0.00 178.44 176.48 1mgs h ASN 68 N -0.02 0.65 -0.41 -0.43 -0.73 -1.63 -3.09 115.58 109.92 1mgs h ASN 68 Ca 0.37 -0.41 -0.28 0.00 1.87 0.00 0.00 56.30 57.86 1mgs h ASN 68 Cb 0.59 -0.19 -0.12 0.00 0.27 0.00 0.00 38.32 38.87 1mgs h ASN 68 CO -0.83 1.16 0.36 -1.54 -0.37 0.00 0.00 177.43 176.20 1mgs n SER 69 N -3.90 6.13 0.03 1.15 3.41 0.12 -4.12 113.62 116.44 1mgs n SER 69 Ca -0.05 -2.96 0.12 0.00 -0.26 0.00 0.00 58.87 55.72 1mgs n SER 69 Cb 0.69 -1.04 0.11 0.00 -0.26 0.00 0.00 64.21 63.71 1mgs n SER 69 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1mgs n ASP 70 N 0.45 0.63 -2.74 4.04 5.75 -0.15 -4.34 116.55 120.19 1mgs n ASP 70 Ca 0.26 -0.14 -0.04 0.00 -0.01 0.00 0.00 54.79 54.86 1mgs n ASP 70 Cb 0.59 0.50 0.06 0.00 -1.03 0.00 0.00 41.12 41.24 1mgs n ASP 70 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1mgs n LYS 71 N -1.91 1.43 -2.21 0.11 0.00 -1.26 -5.07 118.16 109.26 1mgs n LYS 71 Ca 0.03 -2.92 -0.03 0.00 0.00 0.00 0.00 58.31 55.39 1mgs n LYS 71 Cb 0.41 -1.03 -0.02 0.00 0.00 0.00 0.00 35.03 34.39 1mgs n LYS 71 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1mgs n SER 72 N -0.56 -3.01 0.00 3.14 7.64 -1.26 -5.21 113.62 114.35 1mgs n SER 72 Ca 0.03 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1mgs n SER 72 Cb 0.82 -4.16 0.00 0.00 -1.01 0.00 0.00 64.21 59.86 1mgs n SER 72 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83