#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mc7 s VAL 2 N 0.00 0.10 -0.43 1.08 1.01 -1.22 -4.86 120.40 116.07 1mc7 s VAL 2 Ca 0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 1mc7 s VAL 2 Cb 0.00 -0.37 0.12 0.00 0.00 0.00 0.00 36.38 36.13 1mc7 s VAL 2 CO 0.00 -0.44 0.21 -0.89 0.00 0.00 0.00 175.10 173.98 1mc7 s THR 3 N -1.45 3.07 1.35 3.92 2.01 -1.26 -4.15 115.64 119.13 1mc7 s THR 3 Ca -0.15 -2.35 -0.21 0.00 0.31 0.00 0.00 61.69 59.29 1mc7 s THR 3 Cb -0.08 -3.12 0.33 0.00 0.01 0.00 0.00 72.50 69.63 1mc7 s THR 3 CO 0.00 -0.71 0.75 0.18 -0.69 0.00 0.00 174.62 174.16 1mc7 n LEU 4 N 4.25 -0.66 0.00 4.42 4.77 -1.26 -4.91 117.00 123.61 1mc7 n LEU 4 Ca 0.01 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 1mc7 n LEU 4 Cb 0.40 -0.96 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1mc7 n LEU 4 CO 0.31 -4.22 0.33 0.59 -1.33 0.00 0.00 177.39 173.07 1mc7 n ASN 5 N -4.64 0.00 0.00 -1.43 3.02 -1.26 -4.94 115.26 106.01 1mc7 n ASN 5 Ca 0.11 0.65 0.00 0.00 -0.03 0.00 0.00 54.58 55.31 1mc7 n ASN 5 Cb 0.53 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.55 1mc7 n ASN 5 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1mc7 n MET 6 N -1.45 0.00 -1.08 3.52 2.81 -1.26 -5.14 117.12 114.52 1mc7 n MET 6 Ca 0.00 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.55 1mc7 n MET 6 Cb 0.00 0.00 0.01 0.00 -0.71 0.00 0.00 33.22 32.52 1mc7 n MET 6 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1mc7 n GLU 7 N 0.00 0.00 -3.34 0.03 2.13 -1.26 -4.84 120.64 113.36 1mc7 n GLU 7 Ca 0.00 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.39 1mc7 n GLU 7 Cb 0.00 -0.89 -0.01 0.00 0.27 0.00 0.00 31.44 30.81 1mc7 n GLU 7 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1mc7 n ARG 8 N 1.49 3.52 -2.34 5.31 1.74 -1.26 -5.01 116.66 120.11 1mc7 n ARG 8 Ca 0.06 -4.48 -0.25 0.00 -0.77 0.00 0.00 57.85 52.41 1mc7 n ARG 8 Cb 0.43 -2.52 0.08 0.00 -1.02 0.00 0.00 32.46 29.43 1mc7 n ARG 8 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1mc7 s HIS 9 N -1.53 2.52 -0.01 -1.55 3.76 -1.26 -5.06 115.29 112.15 1mc7 s HIS 9 Ca 0.31 0.19 -0.04 0.00 -0.15 0.00 0.00 55.06 55.37 1mc7 s HIS 9 Cb -0.07 -3.15 -0.01 0.00 1.11 0.00 0.00 32.58 30.46 1mc7 s HIS 9 CO -0.06 -1.47 -0.07 1.58 -0.85 0.00 0.00 174.74 173.87 1mc7 n HIS 10 N -2.86 0.00 -1.46 1.40 -0.00 -1.26 -4.90 115.22 106.14 1mc7 n HIS 10 Ca 0.10 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.85 1mc7 n HIS 10 Cb 0.60 -0.10 -0.00 0.00 -0.12 0.00 0.00 29.99 30.37 1mc7 n HIS 10 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1mc7 n PHE 11 N -3.15 -0.28 0.00 1.57 1.16 -1.26 -4.72 117.46 110.78 1mc7 n PHE 11 Ca -0.03 0.66 0.00 0.00 -1.87 0.00 0.00 57.45 56.22 1mc7 n PHE 11 Cb 0.11 -2.02 0.00 0.00 -1.61 0.00 0.00 39.48 35.96 1mc7 n PHE 11 CO 0.00 0.00 0.00 -0.11 -1.87 0.00 0.00 176.76 174.78 1mc7 n LEU 12 N 1.40 -0.09 -1.90 5.98 0.00 -1.26 -5.08 117.00 116.05 1mc7 n LEU 12 Ca 0.12 0.06 -0.01 0.00 0.00 0.00 0.00 56.01 56.19 1mc7 n LEU 12 Cb 0.37 0.20 0.00 0.00 0.00 0.00 0.00 43.42 43.99 1mc7 n LEU 12 CO 0.56 -0.07 0.06 0.61 0.00 0.00 0.00 177.39 178.55 1mc7 n GLY 13 N -1.09 -0.67 3.58 -3.96 0.00 -1.26 -4.55 105.19 97.24 1mc7 n GLY 13 Ca 0.00 0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1mc7 n GLY 13 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mc7 s ILE 14 N -2.40 1.25 -0.01 -0.61 -4.36 -1.26 -2.76 121.20 111.04 1mc7 s ILE 14 Ca 0.03 -2.00 -0.28 0.00 -0.26 0.00 0.00 60.65 58.13 1mc7 s ILE 14 Cb -0.01 -2.59 0.10 0.00 1.25 0.00 0.00 42.46 41.21 1mc7 s ILE 14 CO 0.21 0.00 0.82 -0.44 0.24 0.00 0.00 174.94 175.76 1mc7 s SER 15 N -3.67 -0.46 0.47 4.36 0.01 -1.24 -5.00 113.70 108.17 1mc7 s SER 15 Ca 0.26 0.22 0.05 0.00 1.31 0.00 0.00 55.95 57.78 1mc7 s SER 15 Cb 0.06 0.44 -0.03 0.00 0.21 0.00 0.00 66.02 66.70 1mc7 s SER 15 CO 0.13 -0.63 0.13 0.27 0.41 0.00 0.00 173.24 173.55 1mc7 s ILE 16 N -2.46 1.77 0.16 1.44 -5.25 -1.26 0.19 121.20 115.79 1mc7 s ILE 16 Ca -0.00 -1.81 -0.24 0.00 -0.99 0.00 0.00 60.65 57.60 1mc7 s ILE 16 Cb -0.01 -2.58 0.07 0.00 2.95 0.00 0.00 42.46 42.89 1mc7 s ILE 16 CO -0.04 0.00 0.99 0.54 -1.79 0.00 0.00 174.94 174.64 1mc7 s VAL 17 N -2.74 0.00 0.00 8.37 0.11 -0.42 -4.07 120.40 121.65 1mc7 s VAL 17 Ca 0.28 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.70 1mc7 s VAL 17 Cb 0.03 -2.22 0.00 0.00 -1.53 0.00 0.00 36.38 32.66 1mc7 s VAL 17 CO 0.15 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.53 1mc7 n GLY 18 N -0.53 5.11 1.69 6.54 0.00 -1.26 -1.38 105.19 115.37 1mc7 n GLY 18 Ca -0.06 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.45 1mc7 n GLY 18 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1mc7 n GLN 19 N 0.00 0.00 -2.31 1.61 7.27 -1.26 -4.97 117.38 117.72 1mc7 n GLN 19 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 57.00 57.07 1mc7 n GLN 19 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1mc7 n GLN 19 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1mc7 n SER 20 N -2.79 -6.02 -0.05 1.69 7.64 -1.26 -5.03 113.62 107.79 1mc7 n SER 20 Ca 0.00 0.95 -0.10 0.00 1.01 0.00 0.00 58.87 60.73 1mc7 n SER 20 Cb 0.00 -3.89 -0.03 0.00 -1.01 0.00 0.00 64.21 59.27 1mc7 n SER 20 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1mc7 n ASN 21 N 0.45 1.48 -4.86 6.43 5.15 -1.23 -5.02 115.26 117.66 1mc7 n ASN 21 Ca 0.00 0.24 -0.31 0.00 -0.60 0.00 0.00 54.58 53.91 1mc7 n ASN 21 Cb 0.01 -0.56 -0.03 0.00 -0.53 0.00 0.00 39.78 38.66 1mc7 n ASN 21 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1mc7 s ASP 22 N -6.15 6.57 -0.46 1.20 2.15 -1.26 -4.92 116.67 113.79 1mc7 s ASP 22 Ca -0.20 1.25 -0.45 0.00 0.43 0.00 0.00 52.55 53.58 1mc7 s ASP 22 Cb 0.05 -2.37 -0.19 0.00 -0.30 0.00 0.00 42.92 40.11 1mc7 s ASP 22 CO 0.28 -0.43 1.75 0.54 -0.17 0.00 0.00 175.17 177.15 1mc7 n ARG 23 N -1.28 0.20 -2.71 4.34 1.74 -1.26 -2.92 116.66 114.77 1mc7 n ARG 23 Ca 0.03 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 1mc7 n ARG 23 Cb 0.54 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 1mc7 n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mc7 n GLY 24 N 4.85 0.00 0.00 -0.13 0.00 -1.26 -4.99 105.19 103.66 1mc7 n GLY 24 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1mc7 n GLY 24 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mc7 n ASP 25 N 1.50 0.00 -2.66 1.61 -0.08 -1.15 -5.10 116.55 110.67 1mc7 n ASP 25 Ca 0.00 0.00 -0.04 0.00 -1.51 0.00 0.00 54.79 53.24 1mc7 n ASP 25 Cb 0.34 0.00 0.06 0.00 2.34 0.00 0.00 41.12 43.86 1mc7 n ASP 25 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1mc7 n GLY 26 N 0.00 -1.86 3.49 0.27 0.00 -1.26 -3.52 105.19 102.31 1mc7 n GLY 26 Ca 0.00 1.24 -0.45 0.00 0.00 0.00 0.00 46.02 46.81 1mc7 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mc7 n GLY 27 N 2.06 0.31 3.58 -0.02 0.00 -1.26 -4.65 105.19 105.21 1mc7 n GLY 27 Ca 0.06 0.89 -0.46 0.00 0.00 0.00 0.00 46.02 46.51 1mc7 n GLY 27 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1mc7 n ILE 28 N 7.49 1.69 -4.32 -0.61 2.08 -1.26 -4.94 119.36 119.50 1mc7 n ILE 28 Ca 0.43 -0.42 -0.18 0.00 0.56 0.00 0.00 62.75 63.13 1mc7 n ILE 28 Cb 0.29 -0.93 -0.14 0.00 -0.75 0.00 0.00 39.64 38.12 1mc7 n ILE 28 CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 1mc7 s TYR 29 N -0.81 0.94 -0.22 1.39 1.13 -0.48 -4.12 117.35 115.18 1mc7 s TYR 29 Ca 0.63 -0.28 -0.40 0.00 -1.41 0.00 0.00 57.07 55.61 1mc7 s TYR 29 Cb -0.75 -0.58 -0.16 0.00 -1.10 0.00 0.00 41.96 39.37 1mc7 s TYR 29 CO 0.58 -0.01 1.64 1.51 -2.51 0.00 0.00 175.55 176.75 1mc7 n ILE 30 N 2.30 0.21 -0.24 -3.49 0.13 -0.57 -1.29 119.36 116.41 1mc7 n ILE 30 Ca -0.16 -0.04 -0.00 0.00 -1.10 0.00 0.00 62.75 61.45 1mc7 n ILE 30 Cb 0.56 -1.05 0.12 0.00 -0.84 0.00 0.00 39.64 38.42 1mc7 n ILE 30 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1mc7 h GLY 31 N 6.40 1.03 -3.02 4.50 0.00 0.19 -3.35 103.07 108.82 1mc7 h GLY 31 Ca -0.47 -0.25 0.40 0.00 0.00 0.00 0.00 47.33 47.02 1mc7 h GLY 31 CO 0.92 0.12 1.00 -1.35 0.00 0.00 0.00 176.54 177.22 1mc7 s SER 32 N -5.56 -0.00 -0.05 0.19 1.04 -1.25 -4.67 113.70 103.40 1mc7 s SER 32 Ca -0.13 -0.00 0.04 0.00 0.48 0.00 0.00 55.95 56.35 1mc7 s SER 32 Cb 0.17 0.00 -0.00 0.00 0.10 0.00 0.00 66.02 66.29 1mc7 s SER 32 CO 0.76 -0.00 -0.19 -0.63 0.98 0.00 0.00 173.24 174.16 1mc7 s ILE 33 N -2.00 1.61 0.51 -1.02 1.09 -1.26 -3.65 121.20 116.48 1mc7 s ILE 33 Ca 0.15 -0.81 0.44 0.00 -1.10 0.00 0.00 60.65 59.33 1mc7 s ILE 33 Cb 0.08 -1.39 0.65 0.00 -1.06 0.00 0.00 42.46 40.74 1mc7 s ILE 33 CO -0.07 0.46 1.40 0.23 -0.10 0.00 0.00 174.94 176.86 1mc7 n MET 34 N 3.20 0.00 -0.61 2.79 2.81 -1.11 -4.85 117.12 119.35 1mc7 n MET 34 Ca -0.18 0.98 0.05 0.00 -1.81 0.00 0.00 57.70 56.74 1mc7 n MET 34 Cb 0.53 -2.29 -0.03 0.00 -0.71 0.00 0.00 33.22 30.72 1mc7 n MET 34 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1mc7 n LYS 35 N -3.68 -1.45 -4.01 0.03 0.00 -1.26 -4.84 118.16 102.95 1mc7 n LYS 35 Ca 0.39 1.17 -0.36 0.00 0.00 0.00 0.00 58.31 59.51 1mc7 n LYS 35 Cb 1.80 -1.62 0.01 0.00 0.00 0.00 0.00 35.03 35.22 1mc7 n LYS 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mc7 n GLY 36 N -2.72 -0.59 0.00 3.14 0.00 -1.26 -4.84 105.19 98.91 1mc7 n GLY 36 Ca -0.03 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1mc7 n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mc7 n GLY 37 N -1.91 4.69 0.00 -0.02 0.00 -1.26 -4.84 105.19 101.85 1mc7 n GLY 37 Ca -0.11 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1mc7 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mc7 n ALA 38 N -3.00 0.00 0.25 4.61 0.00 -1.26 -3.38 120.51 117.73 1mc7 n ALA 38 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1mc7 n ALA 38 Cb 0.00 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.04 1mc7 n ALA 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1mc7 h VAL 39 N 0.00 0.28 -0.00 0.00 2.07 -1.98 -2.75 116.25 113.87 1mc7 h VAL 39 Ca 0.00 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 1mc7 h VAL 39 Cb 0.00 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1mc7 h VAL 39 CO 0.00 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1mc7 h ALA 40 N 1.89 0.01 0.00 1.67 0.00 -1.90 -1.96 119.26 118.97 1mc7 h ALA 40 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1mc7 h ALA 40 Cb 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1mc7 h ALA 40 CO 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 178.91 1mc7 n ALA 41 N -2.23 1.59 0.24 0.00 0.00 -1.11 0.12 120.51 119.11 1mc7 n ALA 41 Ca -0.08 0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.25 1mc7 n ALA 41 Cb 0.15 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 18.21 1mc7 n ALA 41 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1mc7 h ASP 42 N 0.00 -0.48 0.00 0.00 1.82 -1.06 -3.42 116.42 113.28 1mc7 h ASP 42 Ca 0.00 0.01 -0.15 0.00 -0.39 0.00 0.00 57.03 56.50 1mc7 h ASP 42 Cb 0.28 0.12 -0.12 0.00 0.68 0.00 0.00 39.33 40.30 1mc7 h ASP 42 CO 0.00 -0.33 -0.07 0.61 -1.61 0.00 0.00 179.24 177.84 1mc7 n GLY 43 N -1.29 0.22 3.94 -0.78 0.00 -1.11 -5.01 105.19 101.16 1mc7 n GLY 43 Ca -0.11 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 1mc7 n GLY 43 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1mc7 n ARG 44 N -0.51 -0.56 -0.99 1.61 1.85 0.12 -4.74 116.66 113.45 1mc7 n ARG 44 Ca -0.15 -0.18 -0.36 0.00 -1.00 0.00 0.00 57.85 56.16 1mc7 n ARG 44 Cb 0.74 -1.09 0.04 0.00 -1.05 0.00 0.00 32.46 31.11 1mc7 n ARG 44 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1mc7 n ILE 45 N -3.40 0.00 -4.43 8.89 2.08 -1.26 -4.99 119.36 116.25 1mc7 n ILE 45 Ca -0.07 -0.43 -0.25 0.00 0.56 0.00 0.00 62.75 62.56 1mc7 n ILE 45 Cb 0.33 -0.03 -0.09 0.00 -0.75 0.00 0.00 39.64 39.10 1mc7 n ILE 45 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1mc7 s GLU 46 N -2.07 1.93 0.13 0.38 2.02 -1.26 -4.84 118.70 114.98 1mc7 s GLU 46 Ca 0.40 -1.80 -0.06 0.00 0.02 0.00 0.00 54.97 53.53 1mc7 s GLU 46 Cb -0.15 -1.83 -0.09 0.00 0.10 0.00 0.00 34.13 32.16 1mc7 s GLU 46 CO 0.80 0.18 1.32 -1.00 0.02 0.00 0.00 175.26 176.58 1mc7 h PRO 47 N 1.96 0.51 -0.53 0.39 0.13 -1.83 -3.01 132.00 129.62 1mc7 h PRO 47 Ca -0.42 -0.50 0.00 0.00 -0.87 0.00 0.00 66.00 64.21 1mc7 h PRO 47 Cb 1.25 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1mc7 h PRO 47 CO 0.67 1.13 0.00 0.41 -0.23 0.00 0.00 178.00 179.98 1mc7 n GLY 48 N 0.85 0.64 0.39 1.56 0.00 -1.26 -1.51 105.19 105.85 1mc7 n GLY 48 Ca -0.07 -0.13 0.19 0.00 0.00 0.00 0.00 46.02 46.02 1mc7 n GLY 48 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mc7 h ASP 49 N 0.62 0.11 -1.60 1.61 3.45 -1.82 -3.40 116.42 115.40 1mc7 h ASP 49 Ca 0.00 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.47 1mc7 h ASP 49 Cb 0.44 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 39.19 1mc7 h ASP 49 CO 0.04 0.06 0.00 0.80 -1.57 0.00 0.00 179.24 178.57 1mc7 n MET 50 N -4.40 0.00 -2.82 3.56 0.00 -1.26 -3.79 117.12 108.41 1mc7 n MET 50 Ca 0.12 0.00 -0.44 0.00 -0.00 0.00 0.00 57.70 57.38 1mc7 n MET 50 Cb 0.60 -2.37 -0.00 0.00 0.00 0.00 0.00 33.22 31.45 1mc7 n MET 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 1mc7 s LEU 51 N -1.60 4.62 0.00 -0.89 1.98 -1.26 -3.28 118.68 118.25 1mc7 s LEU 51 Ca 0.00 -2.68 0.00 0.00 -2.89 0.00 0.00 54.13 48.56 1mc7 s LEU 51 Cb 0.00 -2.46 0.00 0.00 0.66 0.00 0.00 46.19 44.39 1mc7 s LEU 51 CO 0.00 -0.94 0.45 0.00 -1.89 0.00 0.00 176.35 173.97 1mc7 n LEU 52 N 6.69 0.85 -4.17 -0.68 -0.00 -1.23 -4.34 117.00 114.13 1mc7 n LEU 52 Ca 0.39 -0.85 -0.15 0.00 -0.00 0.00 0.00 56.01 55.39 1mc7 n LEU 52 Cb 0.45 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.76 1mc7 n LEU 52 CO 0.66 0.21 -0.43 0.00 -0.00 0.00 0.00 177.39 177.83 1mc7 s GLN 53 N -0.12 0.82 0.04 1.47 -2.07 -0.96 -3.49 119.66 115.35 1mc7 s GLN 53 Ca 0.00 -1.07 0.00 0.00 -1.82 0.00 0.00 55.36 52.47 1mc7 s GLN 53 Cb 0.00 -0.60 -0.03 0.00 -1.09 0.00 0.00 33.01 31.29 1mc7 s GLN 53 CO 0.00 0.11 -0.04 0.08 -1.32 0.00 0.00 175.29 174.12 1mc7 s VAL 54 N -2.03 0.23 0.00 3.63 1.01 -1.13 0.28 120.40 122.39 1mc7 s VAL 54 Ca 0.02 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 60.71 1mc7 s VAL 54 Cb -0.05 -0.80 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1mc7 s VAL 54 CO 0.01 -0.68 0.00 -3.20 0.00 0.00 0.00 175.10 171.23 1mc7 n ASN 55 N 0.99 0.00 0.00 3.32 2.85 0.29 0.15 115.26 122.86 1mc7 n ASN 55 Ca -0.20 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.38 1mc7 n ASN 55 Cb 0.57 0.00 0.63 0.00 1.24 0.00 0.00 39.78 42.22 1mc7 n ASN 55 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1mc7 n ASP 56 N -2.02 0.00 -4.86 1.20 5.68 -1.26 -4.79 116.55 110.49 1mc7 n ASP 56 Ca 0.00 -1.12 -0.31 0.00 -0.50 0.00 0.00 54.79 52.86 1mc7 n ASP 56 Cb 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 39.94 1mc7 n ASP 56 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1mc7 s VAL 57 N -2.00 4.67 -0.39 2.12 1.01 0.39 -5.05 120.40 121.15 1mc7 s VAL 57 Ca 0.32 0.89 0.05 0.00 0.00 0.00 0.00 61.98 63.24 1mc7 s VAL 57 Cb 0.15 -3.71 0.16 0.00 0.00 0.00 0.00 36.38 32.98 1mc7 s VAL 57 CO 0.25 -0.52 0.46 0.20 0.00 0.00 0.00 175.10 175.48 1mc7 s ASN 58 N -2.97 0.31 -0.28 3.32 0.01 -1.26 -2.85 114.94 111.22 1mc7 s ASN 58 Ca 0.55 -1.38 -0.06 0.00 -0.71 0.00 0.00 52.86 51.26 1mc7 s ASN 58 Cb -0.10 0.99 -0.20 0.00 0.41 0.00 0.00 41.25 42.35 1mc7 s ASN 58 CO 0.29 -0.23 3.12 0.49 -1.51 0.00 0.00 177.10 179.26 1mc7 n PHE 59 N 4.24 0.41 0.00 2.20 3.72 -1.23 -4.57 117.46 122.23 1mc7 n PHE 59 Ca 0.12 -1.59 0.00 0.00 -0.05 0.00 0.00 57.45 55.93 1mc7 n PHE 59 Cb 0.49 -1.60 0.00 0.00 -0.94 0.00 0.00 39.48 37.43 1mc7 n PHE 59 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1mc7 n GLU 60 N 2.80 0.00 -0.55 -1.08 -0.58 -1.26 -2.39 120.64 117.57 1mc7 n GLU 60 Ca 0.44 0.21 0.46 0.00 -0.42 0.00 0.00 57.16 57.85 1mc7 n GLU 60 Cb 0.68 -1.08 0.75 0.00 -0.57 0.00 0.00 31.44 31.22 1mc7 n GLU 60 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 1mc7 h ASN 61 N 0.00 0.00 0.00 1.62 4.21 -2.00 -2.20 115.58 117.21 1mc7 h ASN 61 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1mc7 h ASN 61 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 1mc7 h ASN 61 CO 0.00 0.00 0.00 0.23 -1.29 0.00 0.00 177.43 176.37 1mc7 n MET 62 N -3.86 0.00 -3.90 0.81 2.81 -1.15 -4.79 117.12 107.04 1mc7 n MET 62 Ca 0.37 0.02 -0.24 0.00 -1.81 0.00 0.00 57.70 56.04 1mc7 n MET 62 Cb 1.79 -0.84 -0.08 0.00 -0.71 0.00 0.00 33.22 33.39 1mc7 n MET 62 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1mc7 n SER 63 N -0.35 0.64 -1.65 7.83 2.88 -0.83 -4.73 113.62 117.41 1mc7 n SER 63 Ca 0.00 -0.99 -0.12 0.00 -1.33 0.00 0.00 58.87 56.44 1mc7 n SER 63 Cb 0.00 -1.23 0.11 0.00 -0.75 0.00 0.00 64.21 62.35 1mc7 n SER 63 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1mc7 n ASN 64 N -2.14 3.44 -2.47 -3.46 5.15 -1.26 -4.82 115.26 109.69 1mc7 n ASN 64 Ca -0.24 -2.86 0.00 0.00 -0.60 0.00 0.00 54.58 50.88 1mc7 n ASN 64 Cb 0.53 -0.68 0.00 0.00 -0.53 0.00 0.00 39.78 39.10 1mc7 n ASN 64 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1mc7 n ASP 65 N -0.35 -0.99 -0.85 1.20 -0.08 -1.26 -4.44 116.55 109.78 1mc7 n ASP 65 Ca 0.32 0.49 -0.05 0.00 -1.51 0.00 0.00 54.79 54.04 1mc7 n ASP 65 Cb 1.12 -0.99 -0.05 0.00 2.34 0.00 0.00 41.12 43.54 1mc7 n ASP 65 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1mc7 n ASP 66 N -1.48 -0.73 0.17 1.67 9.92 -1.26 -4.81 116.55 120.04 1mc7 n ASP 66 Ca 0.00 -1.57 0.12 0.00 -0.53 0.00 0.00 54.79 52.81 1mc7 n ASP 66 Cb 0.49 0.22 0.62 0.00 -0.64 0.00 0.00 41.12 41.81 1mc7 n ASP 66 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1mc7 h ALA 67 N 0.00 1.01 -0.83 2.24 0.00 -1.96 -0.69 119.26 119.03 1mc7 h ALA 67 Ca -0.42 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.50 1mc7 h ALA 67 Cb 1.21 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1mc7 h ALA 67 CO -0.21 -0.01 0.55 0.28 0.00 0.00 0.00 179.25 179.86 1mc7 h VAL 68 N 0.00 1.21 -0.85 0.00 2.07 -1.96 0.36 116.25 117.09 1mc7 h VAL 68 Ca 0.00 -0.39 0.25 0.00 0.82 0.00 0.00 66.70 67.38 1mc7 h VAL 68 Cb 0.02 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 1mc7 h VAL 68 CO 0.00 0.21 1.02 -0.09 0.02 0.00 0.00 177.57 178.73 1mc7 h ARG 69 N 1.12 0.00 0.00 1.57 2.43 -1.54 0.91 114.38 118.87 1mc7 h ARG 69 Ca 0.30 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 59.23 1mc7 h ARG 69 Cb -0.13 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 1mc7 h ARG 69 CO -0.07 0.00 -1.85 0.28 -1.51 0.00 0.00 179.97 176.82 1mc7 n VAL 70 N -3.33 0.84 -0.30 0.20 0.31 -0.41 -4.43 118.33 111.21 1mc7 n VAL 70 Ca 0.19 -0.25 0.11 0.00 -0.01 0.00 0.00 64.34 64.38 1mc7 n VAL 70 Cb 1.29 -1.49 0.28 0.00 -0.91 0.00 0.00 33.84 33.01 1mc7 n VAL 70 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1mc7 h LEU 71 N -0.38 0.42 -2.67 7.52 5.85 0.16 1.60 115.31 127.81 1mc7 h LEU 71 Ca -0.37 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1mc7 h LEU 71 Cb 1.39 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 1mc7 h LEU 71 CO -0.18 0.09 -0.00 -0.09 -0.34 0.00 0.00 178.44 177.91 1mc7 h ARG 72 N 0.49 0.00 0.00 1.25 2.43 0.52 0.94 114.38 120.01 1mc7 h ARG 72 Ca 0.53 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.65 1mc7 h ARG 72 Cb 0.91 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1mc7 h ARG 72 CO -0.46 0.00 -0.23 1.05 -1.51 0.00 0.00 179.97 178.81 1mc7 h GLU 73 N 0.00 0.00 0.00 0.20 4.11 0.22 -2.94 114.58 116.17 1mc7 h GLU 73 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1mc7 h GLU 73 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1mc7 h GLU 73 CO 0.00 0.23 0.00 -0.89 0.07 0.00 0.00 179.01 178.43 1mc7 n ILE 74 N -3.22 0.00 -0.33 -1.06 2.08 0.32 -1.25 119.36 115.90 1mc7 n ILE 74 Ca 0.02 0.35 0.31 0.00 0.56 0.00 0.00 62.75 63.99 1mc7 n ILE 74 Cb 0.55 -1.01 0.55 0.00 -0.75 0.00 0.00 39.64 38.98 1mc7 n ILE 74 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 1mc7 n VAL 75 N -0.02 -0.33 0.17 1.39 0.24 -1.24 0.76 118.33 119.29 1mc7 n VAL 75 Ca 0.00 1.74 -0.14 0.00 -2.04 0.00 0.00 64.34 63.91 1mc7 n VAL 75 Cb 0.00 -2.84 -0.08 0.00 -1.47 0.00 0.00 33.84 29.45 1mc7 n VAL 75 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1mc7 h SER 76 N 0.00 -1.16 0.00 -1.34 0.87 -1.58 -3.47 113.55 106.86 1mc7 h SER 76 Ca 0.76 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.43 1mc7 h SER 76 Cb 2.17 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 64.53 1mc7 h SER 76 CO -0.60 -0.49 0.00 0.00 -0.53 0.00 0.00 176.83 175.21 1mc7 n GLN 77 N -4.81 0.00 -1.00 2.24 6.02 0.23 -5.08 117.38 114.98 1mc7 n GLN 77 Ca -0.08 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.55 1mc7 n GLN 77 Cb 0.35 0.00 0.04 0.00 1.02 0.00 0.00 30.24 31.65 1mc7 n GLN 77 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1mc7 n THR 78 N 0.00 0.00 0.00 5.09 -2.24 -1.26 -4.63 114.28 111.24 1mc7 n THR 78 Ca 0.00 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1mc7 n THR 78 Cb 0.00 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 1mc7 n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mc7 n GLY 79 N 3.46 1.29 3.78 3.38 0.00 -1.26 -3.81 105.19 112.02 1mc7 n GLY 79 Ca -0.02 -1.17 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 1mc7 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1mc7 s PRO 80 N -2.77 4.15 0.35 1.61 0.04 -1.26 -4.55 135.00 132.58 1mc7 s PRO 80 Ca 0.00 1.52 -0.25 0.00 0.04 0.00 0.00 61.00 62.32 1mc7 s PRO 80 Cb 0.00 -2.54 -0.10 0.00 0.04 0.00 0.00 34.50 31.90 1mc7 s PRO 80 CO 0.00 -0.15 0.95 0.42 0.04 0.00 0.00 177.00 178.26 1mc7 s ILE 81 N -1.65 4.22 0.00 0.56 1.01 -1.26 -4.47 121.20 119.61 1mc7 s ILE 81 Ca 0.58 1.71 0.00 0.00 0.00 0.00 0.00 60.65 62.94 1mc7 s ILE 81 Cb -0.22 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.36 1mc7 s ILE 81 CO 0.28 0.02 0.00 -1.20 0.00 0.00 0.00 174.94 174.04 1mc7 n SER 82 N 0.23 0.00 -2.60 3.58 7.64 -1.26 -4.74 113.62 116.46 1mc7 n SER 82 Ca 0.03 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.65 1mc7 n SER 82 Cb 0.51 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.70 1mc7 n SER 82 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1mc7 n LEU 83 N 0.00 -1.50 -4.03 -3.43 4.32 -1.26 -0.54 117.00 110.55 1mc7 n LEU 83 Ca 0.00 0.53 -0.13 0.00 -0.02 0.00 0.00 56.01 56.39 1mc7 n LEU 83 Cb 0.00 -0.54 -0.12 0.00 -1.62 0.00 0.00 43.42 41.14 1mc7 n LEU 83 CO 0.00 -2.36 -0.40 -0.89 -1.22 0.00 0.00 177.39 172.52 1mc7 s THR 84 N -0.91 0.49 0.04 -5.08 2.01 0.81 -3.46 115.64 109.54 1mc7 s THR 84 Ca 0.36 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.46 1mc7 s THR 84 Cb -0.43 -0.53 -0.02 0.00 0.01 0.00 0.00 72.50 71.53 1mc7 s THR 84 CO 0.37 -0.27 0.04 0.68 -0.69 0.00 0.00 174.62 174.75 1mc7 s VAL 85 N -1.09 0.15 -0.32 3.82 -7.23 -1.26 -2.26 120.40 112.22 1mc7 s VAL 85 Ca -0.07 -1.27 0.01 0.00 -1.81 0.00 0.00 61.98 58.83 1mc7 s VAL 85 Cb -0.08 -0.99 0.34 0.00 0.56 0.00 0.00 36.38 36.22 1mc7 s VAL 85 CO 0.00 -0.70 1.74 0.00 -0.31 0.00 0.00 175.10 175.83 1mc7 n ALA 86 N 0.68 4.77 -1.06 1.32 0.00 -1.21 -1.84 120.51 123.18 1mc7 n ALA 86 Ca -0.18 -1.86 0.12 0.00 0.00 0.00 0.00 53.44 51.52 1mc7 n ALA 86 Cb 0.59 -1.35 -0.04 0.00 0.00 0.00 0.00 19.45 18.65 1mc7 n ALA 86 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1mc7 n LYS 87 N -0.26 -1.99 0.00 0.00 3.00 -1.25 -4.96 118.16 112.70 1mc7 n LYS 87 Ca 0.36 1.43 0.00 0.00 -0.00 0.00 0.00 58.31 60.10 1mc7 n LYS 87 Cb 0.95 -2.51 0.00 0.00 0.00 0.00 0.00 35.03 33.47 1mc7 n LYS 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mc7 n ALA 88 N -2.44 0.00 -1.43 3.14 0.00 -1.26 -4.68 120.51 113.84 1mc7 n ALA 88 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1mc7 n ALA 88 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1mc7 n ALA 88 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1mc7 n TRP 89 N 0.00 0.00 -1.47 0.00 -0.00 -1.26 -4.77 117.44 109.94 1mc7 n TRP 89 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.50 57.09 1mc7 n TRP 89 Cb 0.00 -1.43 -0.15 0.00 -0.00 0.00 0.00 31.31 29.74 1mc7 n TRP 89 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 177.69 177.44 1mc7 n ASP 90 N -0.27 0.29 -2.97 5.87 8.00 -1.26 -4.86 116.55 121.35 1mc7 n ASP 90 Ca 0.00 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.69 1mc7 n ASP 90 Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 40.20 1mc7 n ASP 90 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1mc7 n PRO 91 N 8.33 0.59 -1.56 -0.24 -0.04 -1.26 -4.96 135.00 135.86 1mc7 n PRO 91 Ca 0.65 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.70 1mc7 n PRO 91 Cb 0.03 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.51 1mc7 n PRO 91 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1mc7 n THR 92 N -0.80 2.47 -1.52 0.52 5.66 -1.26 -4.97 114.28 114.38 1mc7 n THR 92 Ca 0.00 -0.50 -0.30 0.00 -3.05 0.00 0.00 64.05 60.20 1mc7 n THR 92 Cb 0.00 -0.96 0.22 0.00 -1.55 0.00 0.00 70.33 68.04 1mc7 n THR 92 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1mc7 s PRO 93 N -2.04 -0.43 0.27 1.09 0.04 -1.26 -5.10 135.00 127.57 1mc7 s PRO 93 Ca 0.66 -0.31 0.02 0.00 0.04 0.00 0.00 61.00 61.41 1mc7 s PRO 93 Cb -0.53 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1mc7 s PRO 93 CO 0.55 -3.15 0.13 -0.98 0.04 0.00 0.00 177.00 173.60 1mc7 s ARG 94 N -5.70 1.47 0.00 4.56 1.04 -1.26 -5.20 118.95 113.86 1mc7 s ARG 94 Ca 0.73 -1.82 0.00 0.00 -1.04 0.00 0.00 55.73 53.61 1mc7 s ARG 94 Cb -0.06 -0.11 0.00 0.00 -2.04 0.00 0.00 34.95 32.74 1mc7 s ARG 94 CO 0.55 -0.38 0.40 0.43 -0.04 0.00 0.00 175.30 176.26