#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1msh s SER 2 N 0.00 -0.24 0.32 0.00 0.01 -1.26 -5.15 113.70 107.38 1msh s SER 2 Ca 0.00 0.96 -0.15 0.00 1.31 0.00 0.00 55.95 58.07 1msh s SER 2 Cb 0.00 1.35 -0.09 0.00 0.21 0.00 0.00 66.02 67.49 1msh s SER 2 CO 0.00 -0.23 0.74 -0.69 0.41 0.00 0.00 173.24 173.46 1msh s VAL 3 N 2.61 4.68 0.00 3.43 1.01 -1.26 -4.90 120.40 125.97 1msh s VAL 3 Ca -0.01 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.92 1msh s VAL 3 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1msh s VAL 3 CO -0.13 -0.18 0.00 0.00 0.00 0.00 0.00 175.10 174.79 1msh n ALA 4 N -0.36 0.00 -3.85 5.51 0.00 -1.26 -4.92 120.51 115.63 1msh n ALA 4 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.19 1msh n ALA 4 Cb 0.53 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.02 1msh n ALA 4 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1msh n THR 5 N -0.84 -2.31 -3.09 0.00 -2.24 -1.26 -4.93 114.28 99.60 1msh n THR 5 Ca 0.00 -0.03 0.01 0.00 -2.27 0.00 0.00 64.05 61.76 1msh n THR 5 Cb 0.00 -3.08 -0.01 0.00 -2.10 0.00 0.00 70.33 65.14 1msh n THR 5 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1msh s GLU 6 N -6.54 0.68 -0.03 -0.78 -1.05 -1.26 -4.14 118.70 105.59 1msh s GLU 6 Ca 0.62 -0.24 -0.06 0.00 -0.15 0.00 0.00 54.97 55.14 1msh s GLU 6 Cb -0.31 0.08 -0.03 0.00 -0.44 0.00 0.00 34.13 33.44 1msh s GLU 6 CO 0.81 -0.98 -0.12 1.28 0.95 0.00 0.00 175.26 177.20 1msh n LEU 7 N 4.20 1.14 -0.23 1.83 7.99 -1.26 -4.70 117.00 125.97 1msh n LEU 7 Ca 0.10 0.17 0.01 0.00 -0.01 0.00 0.00 56.01 56.29 1msh n LEU 7 Cb 0.58 -0.40 0.09 0.00 -0.11 0.00 0.00 43.42 43.58 1msh n LEU 7 CO -0.02 -0.33 0.76 0.03 -1.51 0.00 0.00 177.39 176.32 1msh h ARG 8 N -0.33 0.03 -6.94 3.23 3.08 -1.96 -3.42 114.38 108.07 1msh h ARG 8 Ca -0.08 -0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.47 1msh h ARG 8 Cb 0.63 -0.01 0.22 0.00 0.08 0.00 0.00 29.97 30.88 1msh h ARG 8 CO -0.05 0.02 -0.38 0.00 -1.07 0.00 0.00 179.97 178.49 1msh n GLN 10 N -2.90 1.68 -1.19 0.00 6.02 -1.26 -5.03 117.38 114.70 1msh n GLN 10 Ca 0.06 -0.02 -0.44 0.00 -0.01 0.00 0.00 57.00 56.59 1msh n GLN 10 Cb 0.55 -1.25 -0.04 0.00 1.02 0.00 0.00 30.24 30.51 1msh n GLN 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1msh h LEU 12 N 1.59 -0.28 -4.06 0.00 3.38 -1.89 -3.45 115.31 110.61 1msh h LEU 12 Ca -0.32 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.58 1msh h LEU 12 Cb 1.18 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.93 1msh h LEU 12 CO 0.50 -0.11 -0.07 0.00 0.09 0.00 0.00 178.44 178.85 1msh n GLN 13 N -3.38 0.51 -1.53 1.13 10.64 -1.26 -5.03 117.38 118.46 1msh n GLN 13 Ca -0.04 -0.59 0.00 0.00 -1.83 0.00 0.00 57.00 54.54 1msh n GLN 13 Cb 0.13 0.12 0.00 0.00 -0.86 0.00 0.00 30.24 29.63 1msh n GLN 13 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1msh n THR 14 N -0.58 -0.62 -1.70 -0.39 -2.24 -1.18 -4.90 114.28 102.66 1msh n THR 14 Ca -0.10 0.08 -0.32 0.00 -2.27 0.00 0.00 64.05 61.45 1msh n THR 14 Cb 0.66 -1.23 0.04 0.00 -2.10 0.00 0.00 70.33 67.70 1msh n THR 14 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1msh s LEU 15 N -0.17 3.25 -1.20 3.22 1.43 0.35 -4.34 118.68 121.23 1msh s LEU 15 Ca 0.00 1.71 -0.06 0.00 -1.03 0.00 0.00 54.13 54.75 1msh s LEU 15 Cb 0.00 -4.51 0.22 0.00 0.03 0.00 0.00 46.19 41.92 1msh s LEU 15 CO 0.00 -1.41 1.86 0.00 0.23 0.00 0.00 176.35 177.03 1msh n GLN 16 N -2.78 4.27 -2.31 1.70 6.02 -1.26 -2.50 117.38 120.51 1msh n GLN 16 Ca 0.08 -3.94 -0.02 0.00 -0.01 0.00 0.00 57.00 53.11 1msh n GLN 16 Cb 0.53 -2.70 0.00 0.00 1.02 0.00 0.00 30.24 29.10 1msh n GLN 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1msh n GLY 17 N 1.84 -2.54 0.28 1.08 0.00 -1.26 -4.61 105.19 99.96 1msh n GLY 17 Ca 0.41 0.47 -0.02 0.00 0.00 0.00 0.00 46.02 46.88 1msh n GLY 17 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1msh n ILE 18 N 0.07 0.00 -3.86 -0.61 -0.00 -1.26 -4.95 119.36 108.75 1msh n ILE 18 Ca 0.04 -0.08 -0.33 0.00 -0.00 0.00 0.00 62.75 62.38 1msh n ILE 18 Cb 0.13 -1.85 -0.05 0.00 -0.00 0.00 0.00 39.64 37.88 1msh n ILE 18 CO 0.00 0.00 0.00 -2.28 -0.00 0.00 0.00 176.55 174.27 1msh s HIS 19 N -0.98 3.54 0.00 4.28 5.65 -1.26 -5.02 115.29 121.50 1msh s HIS 19 Ca 0.05 0.39 0.00 0.00 0.25 0.00 0.00 55.06 55.76 1msh s HIS 19 Cb -0.00 -1.86 0.00 0.00 -1.18 0.00 0.00 32.58 29.54 1msh s HIS 19 CO 0.04 0.61 0.00 -0.35 -0.65 0.00 0.00 174.74 174.39 1msh n PRO 20 N 0.79 0.00 0.00 2.88 -0.04 -1.26 -4.59 135.00 132.78 1msh n PRO 20 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1msh n PRO 20 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1msh n PRO 20 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1msh n LYS 21 N 0.00 0.00 -0.12 0.54 4.81 -1.26 -3.78 118.16 118.35 1msh n LYS 21 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 58.31 57.21 1msh n LYS 21 Cb 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 34.96 1msh n LYS 21 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1msh n ASN 22 N 2.30 1.91 -4.40 3.14 3.02 -1.26 -4.86 115.26 115.11 1msh n ASN 22 Ca 0.00 0.40 -0.50 0.00 -0.03 0.00 0.00 54.58 54.44 1msh n ASN 22 Cb 0.00 -0.87 -0.11 0.00 -0.61 0.00 0.00 39.78 38.19 1msh n ASN 22 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1msh n ILE 23 N -4.37 0.05 -0.04 2.41 -0.00 -1.25 0.56 119.36 116.72 1msh n ILE 23 Ca -0.38 -0.14 -0.03 0.00 -0.00 0.00 0.00 62.75 62.19 1msh n ILE 23 Cb 0.72 -1.03 -0.14 0.00 -0.00 0.00 0.00 39.64 39.20 1msh n ILE 23 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.55 178.22 1msh n GLN 24 N 8.09 0.66 -2.48 0.38 7.27 -0.66 -4.82 117.38 125.83 1msh n GLN 24 Ca 0.52 0.05 -0.03 0.00 0.07 0.00 0.00 57.00 57.62 1msh n GLN 24 Cb 0.11 -1.63 0.01 0.00 2.41 0.00 0.00 30.24 31.14 1msh n GLN 24 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 1msh n SER 25 N -2.73 -0.96 -3.54 1.69 3.41 -1.04 -5.00 113.62 105.44 1msh n SER 25 Ca -0.20 -1.59 -0.12 0.00 -0.26 0.00 0.00 58.87 56.70 1msh n SER 25 Cb 0.95 1.58 -0.04 0.00 -0.26 0.00 0.00 64.21 66.45 1msh n SER 25 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1msh s VAL 26 N -2.44 0.03 0.07 -3.33 0.11 -1.26 0.12 120.40 113.70 1msh s VAL 26 Ca 0.09 -0.25 0.09 0.00 -2.93 0.00 0.00 61.98 58.98 1msh s VAL 26 Cb -0.02 -1.04 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 1msh s VAL 26 CO 0.04 -0.14 -0.24 0.20 -3.33 0.00 0.00 175.10 171.63 1msh s ASN 27 N -2.45 2.94 -0.15 3.54 0.01 0.48 -4.85 114.94 114.45 1msh s ASN 27 Ca -0.01 -0.61 -0.03 0.00 -0.71 0.00 0.00 52.86 51.49 1msh s ASN 27 Cb -0.00 -0.23 0.05 0.00 0.41 0.00 0.00 41.25 41.48 1msh s ASN 27 CO -0.08 0.19 0.05 0.54 -1.51 0.00 0.00 177.10 176.29 1msh s VAL 28 N -0.89 0.27 0.49 1.60 0.11 -1.26 0.07 120.40 120.79 1msh s VAL 28 Ca 0.10 -0.25 0.03 0.00 -2.93 0.00 0.00 61.98 58.93 1msh s VAL 28 Cb -0.10 -0.74 -0.02 0.00 -1.53 0.00 0.00 36.38 33.99 1msh s VAL 28 CO 0.03 -0.12 0.03 -0.54 -3.33 0.00 0.00 175.10 171.16 1msh s LYS 29 N 1.98 2.16 0.55 1.54 1.02 -0.72 -4.90 119.74 121.37 1msh s LYS 29 Ca 0.01 -2.32 0.08 0.00 0.02 0.00 0.00 55.97 53.76 1msh s LYS 29 Cb -0.16 -1.59 0.07 0.00 -0.52 0.00 0.00 37.83 35.64 1msh s LYS 29 CO -0.07 -0.31 0.76 -1.54 -0.92 0.00 0.00 175.35 173.27 1msh s SER 30 N -3.87 5.15 1.05 2.83 1.04 -1.26 -0.92 113.70 117.71 1msh s SER 30 Ca 0.13 -0.65 -0.09 0.00 0.48 0.00 0.00 55.95 55.81 1msh s SER 30 Cb 0.03 -0.02 0.13 0.00 0.10 0.00 0.00 66.02 66.26 1msh s SER 30 CO 0.07 -1.26 0.64 -0.81 0.98 0.00 0.00 173.24 172.85 1msh n PRO 31 N -2.23 -1.22 0.00 4.02 -0.04 -1.10 -4.59 135.00 129.84 1msh n PRO 31 Ca 0.13 -0.99 0.00 0.00 -0.04 0.00 0.00 63.50 62.60 1msh n PRO 31 Cb 0.61 -0.75 0.00 0.00 -0.04 0.00 0.00 33.50 33.31 1msh n PRO 31 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1msh n GLY 32 N -0.14 -2.37 0.00 0.55 0.00 -1.26 -4.89 105.19 97.08 1msh n GLY 32 Ca 0.08 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.90 1msh n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1msh n PRO 33 N 0.00 1.01 0.32 1.61 -0.04 -1.26 -4.60 135.00 132.05 1msh n PRO 33 Ca 0.00 0.00 0.20 0.00 -0.04 0.00 0.00 63.50 63.66 1msh n PRO 33 Cb 0.00 0.00 1.10 0.00 -0.04 0.00 0.00 33.50 34.56 1msh n PRO 33 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1msh h HIS 34 N -0.29 0.00 -0.63 0.54 2.07 -2.01 0.26 115.15 115.09 1msh h HIS 34 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1msh h HIS 34 Cb 0.00 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 29.95 1msh h HIS 34 CO 0.00 0.00 0.29 0.00 -3.07 0.00 0.00 177.93 175.16 1msh n ALA 36 N -2.44 -0.72 -2.41 0.00 0.00 0.91 -4.47 120.51 111.38 1msh n ALA 36 Ca 0.06 -0.12 -0.20 0.00 0.00 0.00 0.00 53.44 53.17 1msh n ALA 36 Cb 0.14 -1.48 -0.10 0.00 0.00 0.00 0.00 19.45 18.01 1msh n ALA 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1msh s GLN 37 N -4.71 1.52 0.00 0.00 2.00 -1.26 -4.74 119.66 112.47 1msh s GLN 37 Ca 0.49 -1.80 0.00 0.00 -2.00 0.00 0.00 55.36 52.05 1msh s GLN 37 Cb -0.29 -0.90 0.00 0.00 0.80 0.00 0.00 33.01 32.63 1msh s GLN 37 CO 0.60 -0.08 0.00 2.41 -0.50 0.00 0.00 175.29 177.72 1msh n THR 38 N -0.57 0.00 -3.73 -0.34 -1.04 -1.26 -2.72 114.28 104.63 1msh n THR 38 Ca -0.04 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.85 1msh n THR 38 Cb 0.65 -0.45 -0.11 0.00 -1.82 0.00 0.00 70.33 68.60 1msh n THR 38 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1msh s GLU 39 N -0.67 0.41 -0.48 -2.82 2.02 -0.10 -4.72 118.70 112.34 1msh s GLU 39 Ca 0.00 0.61 0.06 0.00 0.02 0.00 0.00 54.97 55.67 1msh s GLU 39 Cb 0.00 0.11 0.22 0.00 0.10 0.00 0.00 34.13 34.56 1msh s GLU 39 CO 0.00 -0.09 0.74 1.33 0.02 0.00 0.00 175.26 177.25 1msh n VAL 40 N 3.42 -0.20 -3.55 2.63 0.24 -1.22 -1.76 118.33 117.90 1msh n VAL 40 Ca -0.17 -1.80 -0.40 0.00 -2.04 0.00 0.00 64.34 59.93 1msh n VAL 40 Cb 0.56 0.62 -0.11 0.00 -1.47 0.00 0.00 33.84 33.45 1msh n VAL 40 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1msh s ILE 41 N 0.48 5.21 -0.36 1.34 1.01 0.11 -2.07 121.20 126.92 1msh s ILE 41 Ca 0.32 -0.22 -0.23 0.00 0.00 0.00 0.00 60.65 60.52 1msh s ILE 41 Cb 0.12 -3.66 0.01 0.00 0.01 0.00 0.00 42.46 38.94 1msh s ILE 41 CO -0.16 0.01 0.77 0.00 0.00 0.00 0.00 174.94 175.56 1msh s ALA 42 N 1.71 3.43 -0.06 9.38 0.00 0.37 0.18 121.76 136.78 1msh s ALA 42 Ca 0.06 -0.67 -0.30 0.00 0.00 0.00 0.00 51.96 51.05 1msh s ALA 42 Cb -0.17 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 1msh s ALA 42 CO 0.10 -1.47 1.30 0.99 0.00 0.00 0.00 175.76 176.68 1msh s THR 43 N 3.06 4.06 0.63 0.00 2.01 0.33 -1.01 115.64 124.71 1msh s THR 43 Ca 0.31 1.38 -0.12 0.00 0.31 0.00 0.00 61.69 63.57 1msh s THR 43 Cb -0.13 -3.89 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 1msh s THR 43 CO 0.17 -0.03 1.04 -0.76 -0.69 0.00 0.00 174.62 174.34 1msh s LEU 44 N 2.63 3.28 0.27 4.42 2.01 0.19 -1.65 118.68 129.83 1msh s LEU 44 Ca 0.59 1.54 -0.01 0.00 0.01 0.00 0.00 54.13 56.26 1msh s LEU 44 Cb -0.26 -4.49 0.50 0.00 0.01 0.00 0.00 46.19 41.94 1msh s LEU 44 CO 0.22 -1.03 1.82 0.50 1.01 0.00 0.00 176.35 178.87 1msh h LYS 45 N -0.19 0.89 0.00 1.70 3.11 -0.21 0.63 116.57 122.50 1msh h LYS 45 Ca -0.45 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 1msh h LYS 45 Cb 1.20 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.23 1msh h LYS 45 CO 0.60 0.59 0.00 0.27 -2.81 0.00 0.00 179.45 178.09 1msh n ASN 46 N -4.67 0.13 -0.05 4.20 6.94 -1.26 -4.76 115.26 115.80 1msh n ASN 46 Ca 0.17 0.56 0.00 0.00 -0.02 0.00 0.00 54.58 55.29 1msh n ASN 46 Cb 0.33 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 37.17 1msh n ASN 46 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1msh n GLY 47 N -1.25 1.32 0.00 4.83 0.00 0.22 -5.09 105.19 105.22 1msh n GLY 47 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1msh n GLY 47 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1msh n ARG 48 N -0.76 3.06 -3.78 1.61 1.85 -1.13 -4.83 116.66 112.68 1msh n ARG 48 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 57.85 56.73 1msh n ARG 48 Cb 0.16 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.50 1msh n ARG 48 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1msh s LYS 49 N 0.20 0.75 0.13 2.89 0.00 -1.26 0.55 119.74 123.00 1msh s LYS 49 Ca 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 55.97 55.52 1msh s LYS 49 Cb 0.00 0.32 -0.04 0.00 0.00 0.00 0.00 37.83 38.11 1msh s LYS 49 CO 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 175.35 175.09 1msh s ALA 50 N -2.29 1.12 0.13 0.59 0.00 -0.18 -4.86 121.76 116.27 1msh s ALA 50 Ca -0.07 -1.45 0.10 0.00 0.00 0.00 0.00 51.96 50.54 1msh s ALA 50 Cb -0.02 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.42 1msh s ALA 50 CO -0.02 -0.28 -0.21 0.00 0.00 0.00 0.00 175.76 175.25 1msh s LEU 52 N -2.18 1.56 -0.64 0.00 -0.00 -0.88 0.13 118.68 116.66 1msh s LEU 52 Ca 0.17 -1.36 -0.18 0.00 -0.00 0.00 0.00 54.13 52.76 1msh s LEU 52 Cb -0.10 0.12 0.12 0.00 -0.00 0.00 0.00 46.19 46.33 1msh s LEU 52 CO 0.09 -0.74 0.75 0.20 -0.00 0.00 0.00 176.35 176.64 1msh s ASN 53 N -3.25 6.27 0.51 1.48 -0.87 -1.04 -4.72 114.94 113.32 1msh s ASN 53 Ca 0.36 -1.60 0.21 0.00 -1.57 0.00 0.00 52.86 50.26 1msh s ASN 53 Cb 0.07 -2.30 1.32 0.00 -0.02 0.00 0.00 41.25 40.32 1msh s ASN 53 CO 0.12 -1.07 2.09 1.55 -2.57 0.00 0.00 177.10 177.22 1msh h PRO 54 N 9.04 0.00 -0.17 -0.60 0.13 -1.92 0.45 132.00 138.92 1msh h PRO 54 Ca -0.22 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.89 1msh h PRO 54 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1msh h PRO 54 CO 1.07 0.10 0.01 0.00 -0.23 0.00 0.00 178.00 178.95 1msh h ALA 55 N 1.90 1.70 -2.90 -0.56 0.00 -1.96 -3.35 119.26 114.08 1msh h ALA 55 Ca -0.00 -0.10 -0.53 0.00 0.00 0.00 0.00 54.91 54.27 1msh h ALA 55 Cb 0.21 -0.08 0.12 0.00 0.00 0.00 0.00 17.79 18.04 1msh h ALA 55 CO 0.01 0.23 0.53 0.45 0.00 0.00 0.00 179.25 180.48 1msh s SER 56 N -6.88 5.37 -0.06 0.00 0.15 0.16 -4.90 113.70 107.54 1msh s SER 56 Ca -0.06 2.54 -0.19 0.00 0.70 0.00 0.00 55.95 58.94 1msh s SER 56 Cb 0.16 -2.62 -0.14 0.00 -1.71 0.00 0.00 66.02 61.72 1msh s SER 56 CO 0.71 -1.48 0.78 1.55 1.20 0.00 0.00 173.24 176.01 1msh h PRO 57 N 1.33 -0.23 -0.74 5.44 0.13 -1.82 -0.57 132.00 135.55 1msh h PRO 57 Ca -0.50 0.02 0.12 0.00 -0.87 0.00 0.00 66.00 64.76 1msh h PRO 57 Cb 1.29 0.05 -0.08 0.00 0.13 0.00 0.00 31.00 32.39 1msh h PRO 57 CO 0.57 0.17 0.34 0.82 -0.23 0.00 0.00 178.00 179.67 1msh h ILE 58 N -0.91 0.77 -0.52 -3.56 5.03 -1.92 -0.73 117.51 115.67 1msh h ILE 58 Ca -0.02 -0.19 -0.12 0.00 -0.12 0.00 0.00 64.86 64.41 1msh h ILE 58 Cb 0.50 0.18 -0.02 0.00 -3.03 0.00 0.00 36.82 34.45 1msh h ILE 58 CO 0.04 0.10 -0.13 0.58 -0.68 0.00 0.00 178.15 178.06 1msh h VAL 59 N 0.54 1.27 -0.04 1.67 2.07 -1.77 -0.60 116.25 119.39 1msh h VAL 59 Ca 0.38 -1.29 0.01 0.00 0.82 0.00 0.00 66.70 66.63 1msh h VAL 59 Cb 0.49 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1msh h VAL 59 CO -0.33 0.45 0.17 0.50 0.02 0.00 0.00 177.57 178.39 1msh h LYS 60 N 0.88 0.00 0.01 1.57 3.64 0.38 0.49 116.57 123.54 1msh h LYS 60 Ca 0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1msh h LYS 60 Cb 0.70 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1msh h LYS 60 CO 0.05 0.00 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.01 1msh h LYS 61 N 0.00 -0.01 -1.07 1.90 3.64 -0.44 -2.84 116.57 117.75 1msh h LYS 61 Ca 0.02 0.00 0.38 0.00 -1.27 0.00 0.00 60.65 59.78 1msh h LYS 61 Cb 0.36 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.03 1msh h LYS 61 CO -0.00 0.61 0.62 0.82 -2.27 0.00 0.00 179.45 179.23 1msh h ILE 62 N -0.65 0.16 0.09 2.00 5.03 0.65 1.05 117.51 125.85 1msh h ILE 62 Ca -0.00 -0.06 -0.00 0.00 -0.12 0.00 0.00 64.86 64.68 1msh h ILE 62 Cb 0.63 -0.02 0.00 0.00 -3.03 0.00 0.00 36.82 34.40 1msh h ILE 62 CO 0.00 0.03 -0.04 0.40 -0.68 0.00 0.00 178.15 177.86 1msh h ILE 63 N 0.16 1.14 -0.25 -0.67 5.03 -1.31 0.06 117.51 121.67 1msh h ILE 63 Ca 0.79 -0.97 -0.01 0.00 -0.12 0.00 0.00 64.86 64.55 1msh h ILE 63 Cb 2.06 1.74 -0.01 0.00 -3.03 0.00 0.00 36.82 37.58 1msh h ILE 63 CO -0.62 0.23 0.11 -0.08 -0.68 0.00 0.00 178.15 177.11 1msh h GLU 64 N -0.58 0.37 -0.40 2.37 4.81 0.19 0.66 114.58 122.01 1msh h GLU 64 Ca -0.01 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.02 1msh h GLU 64 Cb 0.48 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1msh h GLU 64 CO 0.02 0.39 -0.31 1.57 -0.73 0.00 0.00 179.01 179.95 1msh h LYS 65 N 0.26 0.87 -0.64 1.92 2.10 0.79 -0.62 116.57 121.25 1msh h LYS 65 Ca 0.08 -0.41 -0.00 0.00 -2.00 0.00 0.00 60.65 58.32 1msh h LYS 65 Cb 0.16 -0.01 -0.03 0.00 -0.90 0.00 0.00 32.23 31.45 1msh h LYS 65 CO -0.01 1.06 0.38 0.52 -2.00 0.00 0.00 179.45 179.40 1msh h MET 66 N 0.74 0.86 -0.46 0.07 2.86 -0.83 0.23 114.93 118.39 1msh h MET 66 Ca 0.08 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1msh h MET 66 Cb 0.87 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 1msh h MET 66 CO 0.08 0.61 0.11 -0.07 1.06 0.00 0.00 176.91 178.69 1msh h LEU 67 N 0.88 0.64 -7.84 1.22 3.38 -0.10 -3.37 115.31 110.12 1msh h LEU 67 Ca 0.23 -0.10 -0.70 0.00 0.09 0.00 0.00 57.88 57.40 1msh h LEU 67 Cb -0.02 -0.17 -0.34 0.00 0.09 0.00 0.00 40.66 40.22 1msh h LEU 67 CO -0.04 0.64 -0.51 0.21 0.09 0.00 0.00 178.44 178.82 1msh s ASN 68 N -6.64 5.34 -0.37 -0.43 3.84 0.07 -5.00 114.94 111.75 1msh s ASN 68 Ca -0.09 -2.05 0.06 0.00 0.21 0.00 0.00 52.86 50.99 1msh s ASN 68 Cb 0.16 -1.86 0.18 0.00 -0.55 0.00 0.00 41.25 39.17 1msh s ASN 68 CO 0.78 -0.56 0.55 -0.55 -2.79 0.00 0.00 177.10 174.53 1msh s SER 69 N 1.93 -0.84 0.14 -4.21 0.15 -1.25 -4.76 113.70 104.86 1msh s SER 69 Ca 0.08 -0.71 0.06 0.00 0.70 0.00 0.00 55.95 56.07 1msh s SER 69 Cb -0.23 1.62 -0.04 0.00 -1.71 0.00 0.00 66.02 65.66 1msh s SER 69 CO -0.04 -0.23 -0.13 -1.81 1.20 0.00 0.00 173.24 172.24 1msh s ASP 70 N 2.02 1.99 -0.12 5.45 1.11 -1.26 -5.07 116.67 120.80 1msh s ASP 70 Ca 0.14 -0.90 -0.20 0.00 0.18 0.00 0.00 52.55 51.78 1msh s ASP 70 Cb -0.08 -0.06 -0.26 0.00 1.07 0.00 0.00 42.92 43.59 1msh s ASP 70 CO -0.12 -0.21 0.60 0.50 1.18 0.00 0.00 175.17 177.12 1msh h LYS 71 N 3.17 0.18 -0.01 8.23 3.64 -2.07 -3.56 116.57 126.15 1msh h LYS 71 Ca -0.38 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 58.69 1msh h LYS 71 Cb 1.20 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1msh h LYS 71 CO 0.56 1.14 0.00 0.43 -2.27 0.00 0.00 179.45 179.31