#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 -8.99 -3.15 0.00 7.64 -1.26 -4.99 113.62 102.87 1mgs n SER 2 Ca 0.00 1.28 -0.19 0.00 1.01 0.00 0.00 58.87 60.96 1mgs n SER 2 Cb 0.00 -4.74 -0.06 0.00 -1.01 0.00 0.00 64.21 58.40 1mgs n SER 2 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1mgs n VAL 3 N 0.67 -0.74 -4.32 0.44 3.14 -1.26 -5.12 118.33 111.14 1mgs n VAL 3 Ca 0.00 -2.80 -0.32 0.00 -2.96 0.00 0.00 64.34 58.26 1mgs n VAL 3 Cb 0.00 -0.82 -0.09 0.00 -1.06 0.00 0.00 33.84 31.87 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 0.07 3.18 0.00 1.55 0.00 -1.26 -5.08 121.76 120.22 1mgs s ALA 4 Ca 0.33 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.28 1mgs s ALA 4 Cb 0.07 -1.23 0.00 0.00 0.00 0.00 0.00 23.12 21.96 1mgs s ALA 4 CO -0.15 0.64 0.00 -2.37 0.00 0.00 0.00 175.76 173.88 1mgs n THR 5 N 1.30 0.00 -2.91 0.00 5.66 -1.26 -5.06 114.28 112.01 1mgs n THR 5 Ca -0.14 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.42 1mgs n THR 5 Cb 0.52 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.29 1mgs n THR 5 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1mgs s GLU 6 N -0.33 3.88 -0.42 1.09 -1.05 -1.26 -4.93 118.70 115.68 1mgs s GLU 6 Ca 0.00 -2.19 -0.00 0.00 -0.15 0.00 0.00 54.97 52.63 1mgs s GLU 6 Cb 0.00 -5.04 0.11 0.00 -0.44 0.00 0.00 34.13 28.76 1mgs s GLU 6 CO 0.00 -1.81 0.19 -0.51 0.95 0.00 0.00 175.26 174.08 1mgs s LEU 7 N 2.25 5.01 0.44 1.83 1.43 -1.26 -5.09 118.68 123.29 1mgs s LEU 7 Ca 0.39 -2.25 -0.07 0.00 -1.03 0.00 0.00 54.13 51.17 1mgs s LEU 7 Cb -0.03 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.39 1mgs s LEU 7 CO -0.04 -0.44 0.76 -0.13 0.23 0.00 0.00 176.35 176.73 1mgs s ARG 8 N 0.80 3.63 -0.42 1.70 0.52 -1.26 -4.70 118.95 119.23 1mgs s ARG 8 Ca 0.11 0.27 -0.42 0.00 -0.52 0.00 0.00 55.73 55.17 1mgs s ARG 8 Cb -0.22 -2.41 -0.17 0.00 0.52 0.00 0.00 34.95 32.68 1mgs s ARG 8 CO -0.05 -0.10 1.93 0.00 0.02 0.00 0.00 175.30 177.10 1mgs h GLN 10 N 8.31 0.00 -2.51 0.00 1.08 -1.91 -2.72 115.11 117.36 1mgs h GLN 10 Ca -0.30 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.31 1mgs h GLN 10 Cb 1.36 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.41 1mgs h GLN 10 CO 1.02 0.00 -0.90 0.00 -0.95 0.00 0.00 178.83 178.00 1mgs h LEU 12 N 5.73 0.73 -8.08 0.00 7.12 -1.85 -3.36 115.31 115.60 1mgs h LEU 12 Ca 0.23 0.06 -0.67 0.00 0.13 0.00 0.00 57.88 57.63 1mgs h LEU 12 Cb 0.89 -0.08 -0.34 0.00 -0.53 0.00 0.00 40.66 40.60 1mgs h LEU 12 CO 0.42 0.37 -0.82 -1.10 -0.13 0.00 0.00 178.44 177.18 1mgs s GLN 13 N -5.98 2.90 0.30 1.25 -0.21 -1.26 -5.11 119.66 111.56 1mgs s GLN 13 Ca -0.12 -0.90 0.06 0.00 0.02 0.00 0.00 55.36 54.41 1mgs s GLN 13 Cb 0.21 -2.72 -0.02 0.00 1.00 0.00 0.00 33.01 31.49 1mgs s GLN 13 CO 0.79 -0.29 0.43 0.95 -2.12 0.00 0.00 175.29 175.06 1mgs s THR 14 N 1.29 4.53 -0.11 -0.19 -4.23 -1.26 -4.74 115.64 110.93 1mgs s THR 14 Ca 0.02 -0.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.53 1mgs s THR 14 Cb -0.15 -3.59 -0.03 0.00 1.34 0.00 0.00 72.50 70.07 1mgs s THR 14 CO -0.10 -0.23 0.02 -0.76 -0.54 0.00 0.00 174.62 173.01 1mgs s LEU 15 N -4.11 3.64 0.33 4.79 1.43 -0.05 -4.83 118.68 119.87 1mgs s LEU 15 Ca 0.41 0.13 0.11 0.00 -1.03 0.00 0.00 54.13 53.75 1mgs s LEU 15 Cb -0.09 -1.85 1.00 0.00 0.03 0.00 0.00 46.19 45.27 1mgs s LEU 15 CO 0.31 0.32 1.65 -0.61 0.23 0.00 0.00 176.35 178.25 1mgs h GLN 16 N 5.57 0.26 0.00 1.70 4.15 -1.93 -2.72 115.11 122.14 1mgs h GLN 16 Ca -0.47 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1mgs h GLN 16 Cb 1.19 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.82 1mgs h GLN 16 CO 0.58 0.17 0.00 0.41 -1.93 0.00 0.00 178.83 178.06 1mgs n GLY 17 N -1.32 0.55 3.32 2.39 0.00 -1.26 -4.16 105.19 104.71 1mgs n GLY 17 Ca 0.29 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 1mgs n GLY 17 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1mgs s ILE 18 N -2.00 0.06 0.24 -0.61 1.10 -1.26 -5.01 121.20 113.72 1mgs s ILE 18 Ca 0.00 -0.53 -0.28 0.00 -0.51 0.00 0.00 60.65 59.33 1mgs s ILE 18 Cb 0.00 -1.10 -0.16 0.00 0.15 0.00 0.00 42.46 41.36 1mgs s ILE 18 CO 0.00 -0.29 0.77 1.57 -2.11 0.00 0.00 174.94 174.88 1mgs n HIS 19 N -0.00 0.41 0.15 3.50 -0.00 -1.26 -4.84 115.22 113.18 1mgs n HIS 19 Ca -0.17 0.84 0.03 0.00 0.46 0.00 0.00 57.72 58.88 1mgs n HIS 19 Cb 0.63 -2.11 0.11 0.00 -0.12 0.00 0.00 29.99 28.50 1mgs n HIS 19 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1mgs h PRO 20 N 1.52 0.00 0.00 1.57 0.13 -1.93 -3.12 132.00 130.17 1mgs h PRO 20 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1mgs h PRO 20 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 1mgs h PRO 20 CO 0.59 0.48 -0.75 1.63 -0.23 0.00 0.00 178.00 179.72 1mgs n LYS 21 N -3.31 0.29 0.04 0.86 5.02 -1.26 -3.66 118.16 116.15 1mgs n LYS 21 Ca 0.01 0.06 0.09 0.00 -2.02 0.00 0.00 58.31 56.45 1mgs n LYS 21 Cb 0.68 -1.66 0.38 0.00 -0.02 0.00 0.00 35.03 34.41 1mgs n LYS 21 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mgs n ASN 22 N -2.07 0.23 -4.77 4.39 3.02 -1.18 -4.70 115.26 110.19 1mgs n ASN 22 Ca 0.03 0.56 -0.31 0.00 -0.03 0.00 0.00 54.58 54.82 1mgs n ASN 22 Cb 0.44 -0.61 -0.07 0.00 -0.61 0.00 0.00 39.78 38.94 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 -3.11 4.54 -0.04 2.41 1.01 -1.24 -2.07 121.20 122.71 1mgs s ILE 23 Ca 0.06 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1mgs s ILE 23 Cb 0.10 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.35 1mgs s ILE 23 CO 0.32 0.17 0.04 0.00 0.00 0.00 0.00 174.94 175.47 1mgs n GLN 24 N 0.62 2.55 -4.17 2.79 -0.00 -0.40 -4.64 117.38 114.13 1mgs n GLN 24 Ca -0.10 -0.01 -0.11 0.00 -0.00 0.00 0.00 57.00 56.79 1mgs n GLN 24 Cb 0.52 -1.11 -0.10 0.00 -0.00 0.00 0.00 30.24 29.54 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 -3.32 1.08 -0.28 2.61 1.04 -1.13 -4.98 113.70 108.73 1mgs s SER 25 Ca -0.02 -1.03 -0.01 0.00 0.48 0.00 0.00 55.95 55.36 1mgs s SER 25 Cb 0.02 0.11 0.13 0.00 0.10 0.00 0.00 66.02 66.37 1mgs s SER 25 CO 0.19 -0.50 0.27 -0.69 0.98 0.00 0.00 173.24 173.49 1mgs s VAL 26 N -3.66 -0.36 -0.31 5.02 1.01 -1.26 -1.28 120.40 119.56 1mgs s VAL 26 Ca 0.13 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 1mgs s VAL 26 Cb 0.06 -0.94 0.02 0.00 0.00 0.00 0.00 36.38 35.51 1mgs s VAL 26 CO -0.04 -0.45 1.07 0.21 0.00 0.00 0.00 175.10 175.89 1mgs s ASN 27 N 2.33 6.94 -1.00 3.32 2.47 0.49 -4.88 114.94 124.62 1mgs s ASN 27 Ca 0.09 1.08 -0.12 0.00 0.42 0.00 0.00 52.86 54.33 1mgs s ASN 27 Cb -0.14 -2.54 0.23 0.00 -1.45 0.00 0.00 41.25 37.35 1mgs s ASN 27 CO -0.30 -0.86 1.01 -0.69 -3.72 0.00 0.00 177.10 172.54 1mgs s VAL 28 N 3.62 5.67 -0.82 -5.21 1.01 -1.26 -1.42 120.40 121.99 1mgs s VAL 28 Ca 0.45 -2.85 -0.20 0.00 0.00 0.00 0.00 61.98 59.38 1mgs s VAL 28 Cb -0.12 -4.60 0.11 0.00 0.00 0.00 0.00 36.38 31.77 1mgs s VAL 28 CO 0.15 -1.19 1.04 -0.75 0.00 0.00 0.00 175.10 174.34 1mgs s LYS 29 N -0.16 3.40 1.07 2.72 2.20 -0.80 -4.98 119.74 123.18 1mgs s LYS 29 Ca 0.27 -1.45 -0.19 0.00 -0.36 0.00 0.00 55.97 54.25 1mgs s LYS 29 Cb -0.09 -4.65 0.04 0.00 -1.51 0.00 0.00 37.83 31.62 1mgs s LYS 29 CO -0.08 -1.76 -0.15 -1.13 -0.36 0.00 0.00 175.35 171.87 1mgs n SER 30 N 6.87 -2.57 -4.72 1.43 3.41 -1.26 -2.42 113.62 114.36 1mgs n SER 30 Ca 0.13 -0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.32 1mgs n SER 30 Cb 0.47 -0.94 -0.03 0.00 -0.26 0.00 0.00 64.21 63.45 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 -3.24 4.56 0.00 4.33 0.04 -1.26 -4.67 135.00 134.77 1mgs s PRO 31 Ca 0.53 1.55 0.00 0.00 0.04 0.00 0.00 61.00 63.12 1mgs s PRO 31 Cb -0.11 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.04 1mgs s PRO 31 CO 0.67 -0.02 0.00 0.41 0.04 0.00 0.00 177.00 178.10 1mgs n GLY 32 N 2.71 5.31 0.00 0.56 0.00 -0.73 -4.83 105.19 108.22 1mgs n GLY 32 Ca 0.05 -1.41 0.06 0.00 0.00 0.00 0.00 46.02 44.72 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 0.85 0.00 1.61 -0.04 -1.26 -3.00 135.00 133.16 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 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 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 -0.73 0.00 -3.17 0.54 1.44 -1.26 -4.96 115.22 107.08 1mgs n HIS 34 Ca 0.09 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.83 1mgs n HIS 34 Cb 0.04 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.15 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 5.10 1.32 -2.67 0.00 0.00 -1.24 -1.77 120.51 121.25 1mgs n ALA 36 Ca 0.07 -0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.13 1mgs n ALA 36 Cb 0.55 -1.14 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 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 -3.05 4.14 0.61 0.00 1.11 -1.26 -4.68 119.66 116.52 1mgs s GLN 37 Ca 0.03 0.04 -0.18 0.00 0.01 0.00 0.00 55.36 55.27 1mgs s GLN 37 Cb 0.05 -3.54 -0.07 0.00 -1.01 0.00 0.00 33.01 28.44 1mgs s GLN 37 CO 0.15 -0.00 0.61 2.41 0.01 0.00 0.00 175.29 178.46 1mgs n THR 38 N 4.31 2.48 -3.84 -0.19 -1.04 -1.26 -4.41 114.28 110.33 1mgs n THR 38 Ca -0.11 -0.48 -0.29 0.00 -2.04 0.00 0.00 64.05 61.13 1mgs n THR 38 Cb 0.51 -0.78 -0.16 0.00 -1.82 0.00 0.00 70.33 68.08 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 -2.35 1.14 -0.64 -2.82 8.01 -1.01 -4.82 118.70 116.20 1mgs s GLU 39 Ca 0.70 -0.87 -0.13 0.00 0.01 0.00 0.00 54.97 54.68 1mgs s GLU 39 Cb -0.42 -2.36 0.16 0.00 -4.31 0.00 0.00 34.13 27.21 1mgs s GLU 39 CO 0.53 -0.70 0.56 0.08 0.01 0.00 0.00 175.26 175.75 1mgs s VAL 40 N 1.56 5.02 0.15 2.63 1.01 -1.25 -1.91 120.40 127.60 1mgs s VAL 40 Ca -0.01 -2.07 -0.22 0.00 0.00 0.00 0.00 61.98 59.68 1mgs s VAL 40 Cb -0.18 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 31.94 1mgs s VAL 40 CO -0.10 -0.91 0.70 -0.63 0.00 0.00 0.00 175.10 174.16 1mgs s ILE 41 N 0.85 4.52 -0.16 2.22 1.09 -0.51 -2.22 121.20 126.99 1mgs s ILE 41 Ca 0.10 1.48 0.00 0.00 -1.10 0.00 0.00 60.65 61.14 1mgs s ILE 41 Cb -0.21 -4.02 0.03 0.00 -1.06 0.00 0.00 42.46 37.20 1mgs s ILE 41 CO -0.03 0.48 -0.14 0.00 -0.10 0.00 0.00 174.94 175.16 1mgs s ALA 42 N -1.20 1.92 -0.65 9.38 0.00 -0.91 -0.38 121.76 129.93 1mgs s ALA 42 Ca 0.35 -0.97 -0.22 0.00 0.00 0.00 0.00 51.96 51.11 1mgs s ALA 42 Cb -0.21 -1.10 0.08 0.00 0.00 0.00 0.00 23.12 21.89 1mgs s ALA 42 CO 0.23 -0.45 0.92 0.99 0.00 0.00 0.00 175.76 177.45 1mgs s THR 43 N 1.46 4.41 1.01 0.00 2.01 -0.40 -0.99 115.64 123.13 1mgs s THR 43 Ca 0.04 -0.46 -0.22 0.00 0.31 0.00 0.00 61.69 61.36 1mgs s THR 43 Cb -0.13 -4.65 -0.15 0.00 0.01 0.00 0.00 72.50 67.58 1mgs s THR 43 CO -0.10 -1.40 -1.06 0.18 -0.69 0.00 0.00 174.62 171.54 1mgs n LEU 44 N 7.48 -3.99 -0.02 4.42 4.77 0.21 -1.27 117.00 128.59 1mgs n LEU 44 Ca -0.05 0.08 0.05 0.00 -0.03 0.00 0.00 56.01 56.06 1mgs n LEU 44 Cb 0.45 -0.67 0.29 0.00 -2.33 0.00 0.00 43.42 41.16 1mgs n LEU 44 CO 0.63 -3.98 0.69 2.29 -1.33 0.00 0.00 177.39 175.69 1mgs n LYS 45 N 1.96 1.03 -0.13 3.23 2.85 -0.88 -2.92 118.16 123.30 1mgs n LYS 45 Ca -0.01 -0.04 0.05 0.00 -1.05 0.00 0.00 58.31 57.25 1mgs n LYS 45 Cb 0.66 -1.16 0.12 0.00 -0.65 0.00 0.00 35.03 34.00 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 -0.61 2.66 0.00 -5.58 6.94 -1.26 -4.93 115.26 112.47 1mgs n ASN 46 Ca 0.08 -1.91 0.00 0.00 -0.02 0.00 0.00 54.58 52.72 1mgs n ASN 46 Cb 0.04 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.29 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 0.40 0.77 3.93 4.83 0.00 -1.15 -5.05 105.19 108.92 1mgs n GLY 47 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.72 2.08 0.08 1.61 0.52 -1.26 -4.84 118.95 116.42 1mgs s ARG 48 Ca 0.00 -0.22 0.03 0.00 -0.52 0.00 0.00 55.73 55.02 1mgs s ARG 48 Cb 0.00 -2.12 -0.03 0.00 0.52 0.00 0.00 34.95 33.31 1mgs s ARG 48 CO 0.00 -1.35 -0.10 0.15 0.02 0.00 0.00 175.30 174.02 1mgs s LYS 49 N -5.33 0.75 -0.18 3.54 1.02 -1.26 0.67 119.74 118.95 1mgs s LYS 49 Ca 0.61 -1.04 -0.05 0.00 0.02 0.00 0.00 55.97 55.50 1mgs s LYS 49 Cb -0.10 -0.47 0.09 0.00 -0.52 0.00 0.00 37.83 36.83 1mgs s LYS 49 CO 0.46 0.07 0.36 0.00 -0.92 0.00 0.00 175.35 175.32 1mgs s ALA 50 N -2.14 -0.94 0.22 5.17 0.00 -0.16 -4.87 121.76 119.04 1mgs s ALA 50 Ca 0.01 1.20 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 1mgs s ALA 50 Cb -0.05 -1.29 -0.08 0.00 0.00 0.00 0.00 23.12 21.70 1mgs s ALA 50 CO -0.00 -0.82 0.96 0.00 0.00 0.00 0.00 175.76 175.90 1mgs s LEU 52 N -0.98 2.33 -0.17 0.00 1.43 -0.94 -0.87 118.68 119.48 1mgs s LEU 52 Ca 0.42 -1.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.17 1mgs s LEU 52 Cb -0.26 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.44 1mgs s LEU 52 CO 0.32 -0.51 -0.02 0.21 0.23 0.00 0.00 176.35 176.58 1mgs s ASN 53 N -3.48 4.91 0.00 2.29 3.04 -1.03 -3.91 114.94 116.77 1mgs s ASN 53 Ca 0.34 -0.11 0.14 0.00 0.04 0.00 0.00 52.86 53.27 1mgs s ASN 53 Cb 0.07 -1.81 0.85 0.00 -1.54 0.00 0.00 41.25 38.82 1mgs s ASN 53 CO 0.14 0.15 1.41 -0.81 -3.04 0.00 0.00 177.10 174.96 1mgs n PRO 54 N 3.63 0.80 0.13 0.43 -0.04 -1.26 -2.96 135.00 135.74 1mgs n PRO 54 Ca -0.17 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.38 1mgs n PRO 54 Cb 0.52 -1.28 0.04 0.00 -0.04 0.00 0.00 33.50 32.74 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 3.17 0.67 -2.18 0.55 0.00 -1.94 -3.43 119.26 116.10 1mgs h ALA 55 Ca 0.00 -0.16 -0.47 0.00 0.00 0.00 0.00 54.91 54.28 1mgs h ALA 55 Cb 0.00 0.03 0.04 0.00 0.00 0.00 0.00 17.79 17.86 1mgs h ALA 55 CO 0.00 0.19 0.02 0.45 0.00 0.00 0.00 179.25 179.92 1mgs s SER 56 N -5.76 5.80 0.19 0.00 0.15 -1.15 -4.99 113.70 107.94 1mgs s SER 56 Ca 0.02 0.52 0.10 0.00 0.70 0.00 0.00 55.95 57.28 1mgs s SER 56 Cb 0.08 -1.69 0.01 0.00 -1.71 0.00 0.00 66.02 62.71 1mgs s SER 56 CO 0.76 -0.81 1.40 1.55 1.20 0.00 0.00 173.24 177.34 1mgs h PRO 57 N 0.18 0.00 -0.13 5.44 0.13 -1.89 -2.99 132.00 132.74 1mgs h PRO 57 Ca -0.46 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 1mgs h PRO 57 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.37 1mgs h PRO 57 CO 0.59 0.81 -0.06 0.82 -0.23 0.00 0.00 178.00 179.94 1mgs h ILE 58 N 0.00 1.31 -0.12 -3.56 1.08 -1.92 -2.02 117.51 112.28 1mgs h ILE 58 Ca -0.01 -1.07 -0.00 0.00 -0.39 0.00 0.00 64.86 63.38 1mgs h ILE 58 Cb 1.52 1.75 -0.01 0.00 -3.07 0.00 0.00 36.82 37.01 1mgs h ILE 58 CO 0.11 0.31 0.06 0.58 -0.69 0.00 0.00 178.15 178.51 1mgs h VAL 59 N -0.07 1.12 -0.35 1.67 2.07 -1.72 0.12 116.25 119.10 1mgs h VAL 59 Ca 0.03 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.30 1mgs h VAL 59 Cb 0.51 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1mgs h VAL 59 CO 0.02 0.11 0.24 0.11 0.02 0.00 0.00 177.57 178.07 1mgs h LYS 60 N 0.07 0.06 0.00 1.57 1.79 -1.53 0.22 116.57 118.75 1mgs h LYS 60 Ca 0.04 -0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.40 1mgs h LYS 60 Cb 0.12 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 1mgs h LYS 60 CO -0.01 0.04 -0.61 0.87 -1.08 0.00 0.00 179.45 178.66 1mgs h LYS 61 N 0.06 0.00 -0.42 3.15 1.79 -0.56 -2.65 116.57 117.95 1mgs h LYS 61 Ca 0.16 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.51 1mgs h LYS 61 Cb 0.57 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.21 1mgs h LYS 61 CO -0.01 0.43 -0.23 0.82 -1.08 0.00 0.00 179.45 179.38 1mgs h ILE 62 N 0.00 1.27 0.11 1.86 2.04 0.21 -1.09 117.51 121.90 1mgs h ILE 62 Ca -0.03 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.47 1mgs h ILE 62 Cb 1.38 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 1mgs h ILE 62 CO 0.06 0.46 -0.05 0.40 0.00 0.00 0.00 178.15 179.01 1mgs h ILE 63 N 0.73 0.00 -0.79 -0.67 5.03 -1.43 -2.75 117.51 117.63 1mgs h ILE 63 Ca 0.10 -0.49 0.15 0.00 -0.12 0.00 0.00 64.86 64.50 1mgs h ILE 63 Cb 0.76 0.00 -0.15 0.00 -3.03 0.00 0.00 36.82 34.40 1mgs h ILE 63 CO 0.06 0.00 -0.23 -0.08 -0.68 0.00 0.00 178.15 177.22 1mgs h GLU 64 N -0.64 -0.02 0.07 2.37 4.22 -1.57 0.64 114.58 119.65 1mgs h GLU 64 Ca -0.02 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.45 1mgs h GLU 64 Cb 0.12 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1mgs h GLU 64 CO 0.03 -0.01 -0.43 -0.22 -2.18 0.00 0.00 179.01 176.20 1mgs h LYS 65 N -0.02 -0.60 -0.87 1.92 3.11 -1.31 -0.48 116.57 118.31 1mgs h LYS 65 Ca 0.36 0.04 0.23 0.00 -2.81 0.00 0.00 60.65 58.47 1mgs h LYS 65 Cb 0.58 0.14 -0.15 0.00 -1.00 0.00 0.00 32.23 31.80 1mgs h LYS 65 CO -0.82 -0.40 0.09 1.98 -2.81 0.00 0.00 179.45 177.49 1mgs h MET 66 N -0.62 0.10 -0.26 1.90 4.05 -0.59 0.51 114.93 120.03 1mgs h MET 66 Ca 0.03 -0.01 0.05 0.00 -0.28 0.00 0.00 59.70 59.49 1mgs h MET 66 Cb 0.67 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.41 1mgs h MET 66 CO -0.28 0.07 -0.02 -0.07 0.23 0.00 0.00 176.91 176.84 1mgs h LEU 67 N 0.11 -0.15 -3.70 3.39 3.38 -0.21 -1.26 115.31 116.86 1mgs h LEU 67 Ca 0.52 0.06 -0.47 0.00 0.09 0.00 0.00 57.88 58.08 1mgs h LEU 67 Cb 1.03 0.12 -0.25 0.00 0.09 0.00 0.00 40.66 41.65 1mgs h LEU 67 CO -0.75 -0.04 0.61 -3.20 0.09 0.00 0.00 178.44 175.15 1mgs n ASN 68 N -5.18 5.05 -0.07 -0.43 2.85 0.14 -4.27 115.26 113.35 1mgs n ASN 68 Ca -0.01 -3.40 -0.18 0.00 -0.11 0.00 0.00 54.58 50.89 1mgs n ASN 68 Cb 0.14 -0.87 -0.13 0.00 1.24 0.00 0.00 39.78 40.16 1mgs n ASN 68 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1mgs n SER 69 N -0.69 1.77 -4.26 1.20 3.41 0.88 -4.59 113.62 111.34 1mgs n SER 69 Ca 0.50 0.05 -0.43 0.00 -0.26 0.00 0.00 58.87 58.73 1mgs n SER 69 Cb 1.13 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 1mgs n SER 69 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1mgs n ASP 70 N -3.28 4.57 0.02 4.04 8.00 -1.26 -4.48 116.55 124.16 1mgs n ASP 70 Ca -0.37 -2.90 -0.02 0.00 0.71 0.00 0.00 54.79 52.21 1mgs n ASP 70 Cb 1.03 -1.71 -0.01 0.00 -0.02 0.00 0.00 41.12 40.42 1mgs n ASP 70 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1mgs n LYS 71 N 7.42 0.08 -0.46 -1.24 4.81 -1.26 -5.14 118.16 122.38 1mgs n LYS 71 Ca 0.50 0.03 0.06 0.00 -0.87 0.00 0.00 58.31 58.03 1mgs n LYS 71 Cb 0.43 -0.65 -0.02 0.00 0.02 0.00 0.00 35.03 34.82 1mgs n LYS 71 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1mgs n SER 72 N -3.57 -2.71 -0.56 3.14 2.88 -1.26 -5.27 113.62 106.26 1mgs n SER 72 Ca -0.03 0.20 0.07 0.00 -1.33 0.00 0.00 58.87 57.77 1mgs n SER 72 Cb 0.16 -1.39 0.06 0.00 -0.75 0.00 0.00 64.21 62.29 1mgs n SER 72 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40