#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 2.48 -0.32 1.08 1.01 -1.26 -4.84 120.40 118.55 1mc7 s VAL 2 Ca 0.00 0.41 0.03 0.00 0.00 0.00 0.00 61.98 62.41 1mc7 s VAL 2 Cb 0.00 -3.23 0.09 0.00 0.00 0.00 0.00 36.38 33.25 1mc7 s VAL 2 CO 0.00 0.04 0.04 -0.89 0.00 0.00 0.00 175.10 174.29 1mc7 s THR 3 N -1.30 1.95 1.04 3.92 2.01 -1.26 -4.29 115.64 117.70 1mc7 s THR 3 Ca 0.61 -2.04 -0.18 0.00 0.31 0.00 0.00 61.69 60.40 1mc7 s THR 3 Cb -0.38 -2.40 0.08 0.00 0.01 0.00 0.00 72.50 69.81 1mc7 s THR 3 CO 0.48 -0.54 -0.11 0.18 -0.69 0.00 0.00 174.62 173.94 1mc7 n LEU 4 N 4.41 -2.04 0.00 4.42 4.77 -1.26 -5.03 117.00 122.27 1mc7 n LEU 4 Ca 0.00 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1mc7 n LEU 4 Cb 0.42 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1mc7 n LEU 4 CO 0.20 -3.02 0.00 0.59 -1.33 0.00 0.00 177.39 173.83 1mc7 n ASN 5 N -0.58 1.48 -1.39 -1.43 3.02 -1.26 -4.90 115.26 110.20 1mc7 n ASN 5 Ca 0.02 -0.91 0.17 0.00 -0.03 0.00 0.00 54.58 53.84 1mc7 n ASN 5 Cb 0.52 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.62 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 -0.24 -2.93 -2.76 3.52 2.81 -1.26 -4.94 117.12 111.33 1mc7 n MET 6 Ca 0.00 2.20 -0.23 0.00 -1.81 0.00 0.00 57.70 57.87 1mc7 n MET 6 Cb 0.00 -3.54 0.11 0.00 -0.71 0.00 0.00 33.22 29.08 1mc7 n MET 6 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1mc7 s GLU 7 N -3.33 1.74 0.37 0.03 2.02 -1.26 -5.02 118.70 113.25 1mc7 s GLU 7 Ca 0.00 -1.40 -0.24 0.00 0.02 0.00 0.00 54.97 53.35 1mc7 s GLU 7 Cb 0.00 -2.42 -0.13 0.00 0.10 0.00 0.00 34.13 31.67 1mc7 s GLU 7 CO 0.00 -1.38 0.61 0.54 0.02 0.00 0.00 175.26 175.06 1mc7 n ARG 8 N -2.71 0.63 -4.28 1.61 1.74 -1.26 -4.99 116.66 107.40 1mc7 n ARG 8 Ca 0.17 0.23 -0.19 0.00 -0.77 0.00 0.00 57.85 57.29 1mc7 n ARG 8 Cb 0.61 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.47 1mc7 n ARG 8 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1mc7 s HIS 9 N -1.35 1.66 -0.54 -1.55 2.46 -1.26 -5.08 115.29 109.63 1mc7 s HIS 9 Ca 0.62 -1.59 0.06 0.00 0.47 0.00 0.00 55.06 54.62 1mc7 s HIS 9 Cb -0.66 -0.72 0.35 0.00 -0.13 0.00 0.00 32.58 31.43 1mc7 s HIS 9 CO 0.58 -0.80 0.96 1.58 -2.47 0.00 0.00 174.74 174.59 1mc7 n HIS 10 N -0.58 3.63 -3.18 3.88 -0.00 -1.26 -4.87 115.22 112.84 1mc7 n HIS 10 Ca 0.06 -3.84 0.05 0.00 0.46 0.00 0.00 57.72 54.45 1mc7 n HIS 10 Cb 0.63 -0.42 -0.02 0.00 -0.12 0.00 0.00 29.99 30.06 1mc7 n HIS 10 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 1mc7 s PHE 11 N -3.40 -0.66 0.00 1.57 5.36 -1.26 -5.15 117.98 114.44 1mc7 s PHE 11 Ca 0.48 0.76 0.00 0.00 -0.96 0.00 0.00 56.93 57.20 1mc7 s PHE 11 Cb 0.31 0.25 0.00 0.00 -0.34 0.00 0.00 43.02 43.24 1mc7 s PHE 11 CO -0.14 -0.36 0.00 -0.11 -1.46 0.00 0.00 175.22 173.15 1mc7 n LEU 12 N 5.39 0.00 -4.07 6.12 -0.00 -1.26 -4.99 117.00 118.19 1mc7 n LEU 12 Ca -0.07 0.00 -0.35 0.00 -0.00 0.00 0.00 56.01 55.59 1mc7 n LEU 12 Cb 0.53 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.84 1mc7 n LEU 12 CO -0.08 0.00 -0.07 -0.83 -0.00 0.00 0.00 177.39 176.41 1mc7 s GLY 13 N 0.00 2.33 0.38 -3.96 0.00 -1.26 -5.06 107.32 99.74 1mc7 s GLY 13 Ca 0.00 -3.03 0.05 0.00 0.00 0.00 0.00 44.72 41.73 1mc7 s GLY 13 CO 0.00 1.06 0.04 -0.26 0.00 0.00 0.00 173.10 173.94 1mc7 s ILE 14 N 0.27 1.39 0.11 0.90 -5.25 -1.26 -3.65 121.20 113.70 1mc7 s ILE 14 Ca 0.14 -2.00 -0.24 0.00 -0.99 0.00 0.00 60.65 57.56 1mc7 s ILE 14 Cb -0.22 -2.75 0.07 0.00 2.95 0.00 0.00 42.46 42.51 1mc7 s ILE 14 CO -0.03 0.00 0.60 -0.44 -1.79 0.00 0.00 174.94 173.28 1mc7 s SER 15 N -3.61 -0.57 0.49 4.36 0.01 -1.24 -5.02 113.70 108.12 1mc7 s SER 15 Ca 0.32 0.14 0.06 0.00 1.31 0.00 0.00 55.95 57.77 1mc7 s SER 15 Cb 0.08 0.58 -0.00 0.00 0.21 0.00 0.00 66.02 66.88 1mc7 s SER 15 CO 0.15 -0.88 0.28 0.27 0.41 0.00 0.00 173.24 173.47 1mc7 s ILE 16 N -3.17 1.90 0.17 1.44 -5.25 -1.26 0.19 121.20 115.21 1mc7 s ILE 16 Ca -0.02 -1.60 -0.24 0.00 -0.99 0.00 0.00 60.65 57.80 1mc7 s ILE 16 Cb -0.01 -2.50 0.07 0.00 2.95 0.00 0.00 42.46 42.97 1mc7 s ILE 16 CO -0.08 0.00 0.98 0.54 -1.79 0.00 0.00 174.94 174.59 1mc7 s VAL 17 N -2.70 0.00 0.00 8.37 0.11 0.19 -3.91 120.40 122.46 1mc7 s VAL 17 Ca 0.34 -0.66 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 1mc7 s VAL 17 Cb 0.00 -2.26 0.00 0.00 -1.53 0.00 0.00 36.38 32.59 1mc7 s VAL 17 CO 0.20 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.58 1mc7 n GLY 18 N -0.53 5.51 0.97 6.54 0.00 -1.26 -0.83 105.19 115.59 1mc7 n GLY 18 Ca -0.05 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1mc7 n GLY 18 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mc7 n GLN 19 N 0.00 0.00 -2.57 1.61 1.13 -1.26 -4.94 117.38 111.35 1mc7 n GLN 19 Ca 0.00 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.05 1mc7 n GLN 19 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.34 1mc7 n GLN 19 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1mc7 n SER 20 N -1.96 -5.70 0.00 1.08 7.64 -1.26 -5.07 113.62 108.34 1mc7 n SER 20 Ca 0.00 1.29 0.00 0.00 1.01 0.00 0.00 58.87 61.17 1mc7 n SER 20 Cb 0.00 -4.93 0.00 0.00 -1.01 0.00 0.00 64.21 58.27 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 0.87 0.00 -4.46 6.43 5.15 -1.26 -5.08 115.26 116.91 1mc7 n ASN 21 Ca -0.10 0.00 -0.44 0.00 -0.60 0.00 0.00 54.58 53.44 1mc7 n ASN 21 Cb 0.15 0.00 -0.13 0.00 -0.53 0.00 0.00 39.78 39.27 1mc7 n ASN 21 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1mc7 n ASP 22 N 0.00 0.59 -2.75 1.20 8.00 -1.26 -4.35 116.55 117.98 1mc7 n ASP 22 Ca 0.00 0.21 0.02 0.00 0.71 0.00 0.00 54.79 55.73 1mc7 n ASP 22 Cb 0.00 -0.98 0.01 0.00 -0.02 0.00 0.00 41.12 40.12 1mc7 n ASP 22 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1mc7 s ARG 23 N 8.39 0.11 -1.03 -1.24 6.06 -1.26 -5.00 118.95 124.98 1mc7 s ARG 23 Ca 1.29 -0.03 -0.26 0.00 -2.50 0.00 0.00 55.73 54.23 1mc7 s ARG 23 Cb -1.19 0.02 0.04 0.00 0.06 0.00 0.00 34.95 33.87 1mc7 s ARG 23 CO 0.50 -0.17 0.50 0.41 -2.50 0.00 0.00 175.30 174.04 1mc7 n GLY 24 N 3.72 -0.62 3.24 8.12 0.00 -1.26 -2.45 105.19 115.94 1mc7 n GLY 24 Ca 0.05 0.26 -0.07 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.66 -6.40 0.00 1.61 -0.08 -1.26 -4.50 116.55 104.26 1mc7 n ASP 25 Ca -0.11 0.32 0.00 0.00 -1.51 0.00 0.00 54.79 53.49 1mc7 n ASP 25 Cb 0.47 -1.64 0.00 0.00 2.34 0.00 0.00 41.12 42.29 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 1.03 1.23 0.00 0.27 0.00 -1.02 -4.93 105.19 101.76 1mc7 n GLY 26 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 1.31 3.71 -0.02 0.00 -1.26 -4.84 105.19 104.09 1mc7 n GLY 27 Ca 0.00 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 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 0.00 0.95 -4.33 -0.61 2.08 -1.26 -4.90 119.36 111.29 1mc7 n ILE 28 Ca 0.00 -0.24 -0.18 0.00 0.56 0.00 0.00 62.75 62.89 1mc7 n ILE 28 Cb 0.00 -1.72 -0.10 0.00 -0.75 0.00 0.00 39.64 37.06 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 0.01 1.65 0.01 1.39 1.13 -0.01 -4.20 117.35 117.33 1mc7 s TYR 29 Ca 0.66 -0.58 -0.34 0.00 -1.41 0.00 0.00 57.07 55.40 1mc7 s TYR 29 Cb -0.57 -0.78 -0.12 0.00 -1.10 0.00 0.00 41.96 39.38 1mc7 s TYR 29 CO 0.49 0.31 1.77 1.51 -2.51 0.00 0.00 175.55 177.11 1mc7 n ILE 30 N -0.23 0.36 -0.23 -3.49 0.13 -0.96 0.55 119.36 115.49 1mc7 n ILE 30 Ca -0.09 -0.06 -0.06 0.00 -1.10 0.00 0.00 62.75 61.44 1mc7 n ILE 30 Cb 0.60 -1.75 0.04 0.00 -0.84 0.00 0.00 39.64 37.69 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 7.97 0.90 0.00 4.50 0.00 0.19 -3.36 103.07 113.27 1mc7 h GLY 31 Ca -0.47 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1mc7 h GLY 31 CO 0.92 0.33 0.00 1.44 0.00 0.00 0.00 176.54 179.23 1mc7 n SER 32 N -4.64 0.00 -4.05 0.19 7.64 -1.25 -4.66 113.62 106.85 1mc7 n SER 32 Ca 0.05 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.63 1mc7 n SER 32 Cb 0.02 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.06 1mc7 n SER 32 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1mc7 s ILE 33 N -2.00 1.68 -0.81 0.44 1.09 -1.26 -3.69 121.20 116.65 1mc7 s ILE 33 Ca 0.00 -0.71 -0.22 0.00 -1.10 0.00 0.00 60.65 58.62 1mc7 s ILE 33 Cb 0.00 -1.55 -0.19 0.00 -1.06 0.00 0.00 42.46 39.66 1mc7 s ILE 33 CO 0.00 0.48 2.38 0.23 -0.10 0.00 0.00 174.94 177.93 1mc7 n MET 34 N 4.63 0.45 -0.87 2.79 2.81 -1.24 -4.87 117.12 120.83 1mc7 n MET 34 Ca -0.18 -0.39 -0.36 0.00 -1.81 0.00 0.00 57.70 54.96 1mc7 n MET 34 Cb 0.50 -2.74 0.09 0.00 -0.71 0.00 0.00 33.22 30.36 1mc7 n MET 34 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1mc7 n LYS 35 N 7.99 -0.63 -3.57 0.03 5.02 -1.26 -3.54 118.16 122.19 1mc7 n LYS 35 Ca 0.52 -0.18 -0.22 0.00 -2.02 0.00 0.00 58.31 56.42 1mc7 n LYS 35 Cb 0.34 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1mc7 n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mc7 n GLY 36 N 2.88 -1.01 0.00 0.72 0.00 -1.26 -4.86 105.19 101.66 1mc7 n GLY 36 Ca -0.01 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 -1.36 3.25 0.00 -0.02 0.00 -1.23 -4.84 105.19 100.99 1mc7 n GLY 37 Ca -0.26 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.67 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 0.28 4.61 0.00 -1.26 -3.33 120.51 117.80 1mc7 n ALA 38 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1mc7 n ALA 38 Cb 0.00 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.08 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 0.00 -0.07 0.00 2.07 -1.95 -2.90 116.25 113.40 1mc7 h VAL 39 Ca 0.00 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 1mc7 h VAL 39 Cb 0.00 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1mc7 h VAL 39 CO 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 177.57 177.53 1mc7 h ALA 40 N 2.01 0.10 0.00 1.67 0.00 -1.78 -2.65 119.26 118.61 1mc7 h ALA 40 Ca 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1mc7 h ALA 40 Cb 0.56 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1mc7 h ALA 40 CO 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 179.25 179.15 1mc7 h ALA 41 N 0.56 1.04 0.06 0.00 0.00 -1.51 -2.12 119.26 117.29 1mc7 h ALA 41 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1mc7 h ALA 41 Cb 0.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1mc7 h ALA 41 CO 0.02 0.01 -0.03 0.22 0.00 0.00 0.00 179.25 179.46 1mc7 h ASP 42 N 0.00 -0.07 0.00 0.00 1.82 -1.32 -3.48 116.42 113.36 1mc7 h ASP 42 Ca -0.00 -0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.58 1mc7 h ASP 42 Cb 0.14 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.17 1mc7 h ASP 42 CO 0.00 0.01 0.00 0.61 -1.61 0.00 0.00 179.24 178.25 1mc7 n GLY 43 N -0.96 3.39 2.71 -0.78 0.00 -0.80 -5.05 105.19 103.70 1mc7 n GLY 43 Ca -0.08 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 1mc7 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mc7 n ARG 44 N 0.00 3.38 -0.97 1.61 1.74 -1.26 -4.73 116.66 116.42 1mc7 n ARG 44 Ca 0.00 -4.66 -0.36 0.00 -0.77 0.00 0.00 57.85 52.05 1mc7 n ARG 44 Cb 0.00 -2.25 0.05 0.00 -1.02 0.00 0.00 32.46 29.24 1mc7 n ARG 44 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1mc7 n ILE 45 N -0.36 0.00 -4.23 0.55 2.08 -1.26 -5.00 119.36 111.14 1mc7 n ILE 45 Ca 0.36 -0.37 -0.13 0.00 0.56 0.00 0.00 62.75 63.17 1mc7 n ILE 45 Cb 0.51 -0.07 -0.10 0.00 -0.75 0.00 0.00 39.64 39.23 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 -2.17 1.02 0.16 0.38 2.02 -1.26 -4.92 118.70 113.92 1mc7 s GLU 46 Ca 0.41 -1.45 -0.01 0.00 0.02 0.00 0.00 54.97 53.94 1mc7 s GLU 46 Cb -0.12 -0.39 -0.00 0.00 0.10 0.00 0.00 34.13 33.72 1mc7 s GLU 46 CO 0.78 -0.02 1.38 -1.00 0.02 0.00 0.00 175.26 176.42 1mc7 h PRO 47 N 2.80 0.33 -0.87 0.39 0.13 -1.83 -3.02 132.00 129.93 1mc7 h PRO 47 Ca -0.36 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1mc7 h PRO 47 Cb 1.19 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1mc7 h PRO 47 CO 0.64 1.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.81 1mc7 n GLY 48 N 0.77 1.78 0.25 1.56 0.00 -1.26 -2.28 105.19 106.01 1mc7 n GLY 48 Ca -0.05 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.83 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 0.97 0.00 -1.74 1.61 5.19 -1.83 -3.41 116.42 117.21 1mc7 h ASP 49 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1mc7 h ASP 49 Cb 0.83 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.34 1mc7 h ASP 49 CO 0.11 0.04 0.00 0.80 -3.12 0.00 0.00 179.24 177.08 1mc7 n MET 50 N -4.47 0.00 -2.93 3.56 1.56 -1.26 -4.00 117.12 109.58 1mc7 n MET 50 Ca -0.03 0.00 -0.44 0.00 -0.27 0.00 0.00 57.70 56.96 1mc7 n MET 50 Cb 0.13 -2.34 -0.01 0.00 2.15 0.00 0.00 33.22 33.15 1mc7 n MET 50 CO 0.00 0.00 0.00 -1.17 -0.73 0.00 0.00 175.97 174.07 1mc7 s LEU 51 N -1.74 5.01 0.00 -0.89 1.98 -1.26 -2.90 118.68 118.87 1mc7 s LEU 51 Ca 0.00 -2.56 0.00 0.00 -2.89 0.00 0.00 54.13 48.68 1mc7 s LEU 51 Cb 0.00 -2.41 0.00 0.00 0.66 0.00 0.00 46.19 44.44 1mc7 s LEU 51 CO 0.00 -0.90 0.42 0.00 -1.89 0.00 0.00 176.35 173.98 1mc7 n LEU 52 N 6.13 0.84 -4.16 -0.68 -0.00 -1.23 -4.23 117.00 113.68 1mc7 n LEU 52 Ca 0.31 -0.84 -0.17 0.00 -0.00 0.00 0.00 56.01 55.31 1mc7 n LEU 52 Cb 0.46 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.76 1mc7 n LEU 52 CO 0.57 0.21 -0.45 0.00 -0.00 0.00 0.00 177.39 177.73 1mc7 s GLN 53 N -0.04 0.78 0.02 1.47 -2.07 -0.94 -3.40 119.66 115.48 1mc7 s GLN 53 Ca 0.00 -0.95 -0.00 0.00 -1.82 0.00 0.00 55.36 52.59 1mc7 s GLN 53 Cb 0.00 -0.73 -0.02 0.00 -1.09 0.00 0.00 33.01 31.17 1mc7 s GLN 53 CO 0.00 0.16 -0.03 0.08 -1.32 0.00 0.00 175.29 174.18 1mc7 s VAL 54 N -1.40 0.12 0.00 3.63 1.01 -1.22 0.27 120.40 122.81 1mc7 s VAL 54 Ca -0.02 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1mc7 s VAL 54 Cb -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 35.99 1mc7 s VAL 54 CO 0.02 -0.51 0.00 -3.20 0.00 0.00 0.00 175.10 171.41 1mc7 n ASN 55 N 1.56 0.00 -0.05 3.32 2.85 0.91 0.19 115.26 124.04 1mc7 n ASN 55 Ca -0.24 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.33 1mc7 n ASN 55 Cb 0.55 0.00 0.54 0.00 1.24 0.00 0.00 39.78 42.11 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 -0.99 0.15 -4.87 1.20 5.75 -1.26 -4.83 116.55 111.69 1mc7 n ASP 56 Ca 0.00 -1.44 -0.31 0.00 -0.01 0.00 0.00 54.79 53.03 1mc7 n ASP 56 Cb 0.00 -0.01 0.01 0.00 -1.03 0.00 0.00 41.12 40.09 1mc7 n ASP 56 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1mc7 s VAL 57 N -1.98 4.67 -0.35 2.12 1.01 0.50 -5.06 120.40 121.30 1mc7 s VAL 57 Ca 0.29 0.85 0.05 0.00 0.00 0.00 0.00 61.98 63.17 1mc7 s VAL 57 Cb 0.13 -3.85 0.17 0.00 0.00 0.00 0.00 36.38 32.83 1mc7 s VAL 57 CO 0.22 -1.13 0.52 0.20 0.00 0.00 0.00 175.10 174.91 1mc7 s ASN 58 N -4.19 -0.52 -0.02 3.32 -0.87 -1.26 -3.44 114.94 107.97 1mc7 s ASN 58 Ca 0.55 -0.67 0.01 0.00 -1.57 0.00 0.00 52.86 51.18 1mc7 s ASN 58 Cb -0.11 1.47 0.05 0.00 -0.02 0.00 0.00 41.25 42.64 1mc7 s ASN 58 CO 0.54 -0.26 0.70 0.49 -2.57 0.00 0.00 177.10 176.00 1mc7 n PHE 59 N 4.80 0.15 -1.39 2.20 3.72 -1.22 -4.91 117.46 120.81 1mc7 n PHE 59 Ca 0.07 -0.19 -0.36 0.00 -0.05 0.00 0.00 57.45 56.92 1mc7 n PHE 59 Cb 0.52 -0.17 0.07 0.00 -0.94 0.00 0.00 39.48 38.96 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 0.13 0.51 0.00 -1.08 4.71 -1.26 -2.07 120.64 121.58 1mc7 n GLU 60 Ca 0.02 0.22 0.00 0.00 -0.01 0.00 0.00 57.16 57.39 1mc7 n GLU 60 Cb 0.38 -2.02 0.00 0.00 -1.01 0.00 0.00 31.44 28.79 1mc7 n GLU 60 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 1mc7 n ASN 61 N -0.80 0.00 -0.18 1.62 2.85 -1.26 -4.70 115.26 112.78 1mc7 n ASN 61 Ca 0.12 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 54.54 1mc7 n ASN 61 Cb 0.49 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.47 1mc7 n ASN 61 CO 0.00 0.00 0.00 0.80 -2.11 0.00 0.00 177.26 175.95 1mc7 n MET 62 N 0.00 -0.19 -3.48 1.20 1.56 -0.88 -4.68 117.12 110.66 1mc7 n MET 62 Ca 0.00 1.01 -0.14 0.00 -0.27 0.00 0.00 57.70 58.30 1mc7 n MET 62 Cb 0.00 -1.50 -0.02 0.00 2.15 0.00 0.00 33.22 33.85 1mc7 n MET 62 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 1mc7 n SER 63 N -4.01 -0.48 -0.53 6.12 2.88 -1.25 -4.67 113.62 111.69 1mc7 n SER 63 Ca 0.01 -0.47 0.03 0.00 -1.33 0.00 0.00 58.87 57.11 1mc7 n SER 63 Cb 0.11 -0.57 0.10 0.00 -0.75 0.00 0.00 64.21 63.10 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 -0.55 1.47 -1.47 -3.46 5.15 -1.26 -4.84 115.26 110.30 1mc7 n ASN 64 Ca -0.08 -2.06 -0.14 0.00 -0.60 0.00 0.00 54.58 51.70 1mc7 n ASN 64 Cb 0.23 -0.24 -0.05 0.00 -0.53 0.00 0.00 39.78 39.18 1mc7 n ASN 64 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1mc7 n ASP 65 N 0.16 -3.62 -0.86 1.20 8.00 -1.26 -4.53 116.55 115.64 1mc7 n ASP 65 Ca 0.08 0.32 -0.05 0.00 0.71 0.00 0.00 54.79 55.85 1mc7 n ASP 65 Cb 0.27 -3.35 -0.05 0.00 -0.02 0.00 0.00 41.12 37.97 1mc7 n ASP 65 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1mc7 n ASP 66 N -0.64 -0.74 0.16 -2.24 9.92 -1.26 -4.82 116.55 116.93 1mc7 n ASP 66 Ca -0.14 -1.54 0.11 0.00 -0.53 0.00 0.00 54.79 52.69 1mc7 n ASP 66 Cb 0.46 0.22 0.57 0.00 -0.64 0.00 0.00 41.12 41.74 1mc7 n ASP 66 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1mc7 n ALA 67 N 0.00 1.03 -0.33 2.24 0.00 -1.26 -1.37 120.51 120.83 1mc7 n ALA 67 Ca -0.21 0.20 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1mc7 n ALA 67 Cb 0.59 -1.30 0.18 0.00 0.00 0.00 0.00 19.45 18.93 1mc7 n ALA 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1mc7 h VAL 68 N 0.00 0.97 -0.90 0.00 2.07 -1.97 0.11 116.25 116.53 1mc7 h VAL 68 Ca 0.00 -0.32 0.26 0.00 0.82 0.00 0.00 66.70 67.46 1mc7 h VAL 68 Cb 0.01 -0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 29.69 1mc7 h VAL 68 CO 0.00 0.17 1.04 -0.09 0.02 0.00 0.00 177.57 178.72 1mc7 h ARG 69 N 0.94 0.00 0.00 1.57 2.43 -1.65 0.91 114.38 118.58 1mc7 h ARG 69 Ca 0.43 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 59.22 1mc7 h ARG 69 Cb 0.33 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.82 1mc7 h ARG 69 CO -0.23 0.00 -2.28 1.55 -1.51 0.00 0.00 179.97 177.51 1mc7 n VAL 70 N -3.35 1.26 -0.29 0.20 3.14 0.22 -4.28 118.33 115.23 1mc7 n VAL 70 Ca 0.20 -0.36 0.10 0.00 -2.96 0.00 0.00 64.34 61.32 1mc7 n VAL 70 Cb 1.33 -1.69 0.25 0.00 -1.06 0.00 0.00 33.84 32.68 1mc7 n VAL 70 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 1mc7 h LEU 71 N -0.64 0.35 -2.29 6.55 5.85 0.89 1.63 115.31 127.66 1mc7 h LEU 71 Ca -0.56 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1mc7 h LEU 71 Cb 1.57 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.70 1mc7 h LEU 71 CO -0.29 0.07 0.00 -0.09 -0.34 0.00 0.00 178.44 177.79 1mc7 h ARG 72 N 0.46 0.00 0.00 1.25 9.65 0.47 0.70 114.38 126.91 1mc7 h ARG 72 Ca 0.50 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.37 1mc7 h ARG 72 Cb 0.85 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.43 1mc7 h ARG 72 CO -0.46 0.00 -0.05 1.05 2.80 0.00 0.00 179.97 183.30 1mc7 h GLU 73 N 0.00 0.00 0.00 0.20 4.11 0.22 -3.03 114.58 116.08 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 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1mc7 h GLU 73 CO 0.00 0.05 0.00 -0.89 0.07 0.00 0.00 179.01 178.24 1mc7 n ILE 74 N -3.12 0.00 -0.35 -1.06 2.08 0.24 -1.19 119.36 115.96 1mc7 n ILE 74 Ca 0.03 0.26 0.33 0.00 0.56 0.00 0.00 62.75 63.93 1mc7 n ILE 74 Cb 0.52 -0.97 0.58 0.00 -0.75 0.00 0.00 39.64 39.02 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 0.00 -0.33 0.12 1.39 0.24 -1.25 0.52 118.33 119.02 1mc7 n VAL 75 Ca 0.00 1.81 -0.13 0.00 -2.04 0.00 0.00 64.34 63.98 1mc7 n VAL 75 Cb 0.00 -2.94 -0.07 0.00 -1.47 0.00 0.00 33.84 29.35 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 -1.17 0.00 -1.34 0.87 -1.61 -3.45 113.55 106.86 1mc7 h SER 76 Ca 0.80 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 61.48 1mc7 h SER 76 Cb 2.31 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 64.69 1mc7 h SER 76 CO -0.60 -0.44 0.00 0.00 -0.53 0.00 0.00 176.83 175.26 1mc7 n GLN 77 N -4.71 0.00 -0.10 2.24 6.02 0.19 -5.07 117.38 115.94 1mc7 n GLN 77 Ca -0.07 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.88 1mc7 n GLN 77 Cb 0.32 0.00 0.04 0.00 1.02 0.00 0.00 30.24 31.62 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 -1.41 5.09 -2.24 -1.24 -4.77 114.28 109.71 1mc7 n THR 78 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1mc7 n THR 78 Cb 0.00 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 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 -0.60 -4.37 3.79 3.38 0.00 -1.26 -3.96 105.19 102.17 1mc7 n GLY 79 Ca 0.02 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.66 3.92 0.39 1.61 0.04 -1.26 -4.27 135.00 133.78 1mc7 s PRO 80 Ca 0.00 1.42 -0.24 0.00 0.04 0.00 0.00 61.00 62.22 1mc7 s PRO 80 Cb 0.00 -2.25 -0.09 0.00 0.04 0.00 0.00 34.50 32.20 1mc7 s PRO 80 CO 0.00 -0.33 1.02 0.42 0.04 0.00 0.00 177.00 178.15 1mc7 s ILE 81 N -1.86 3.87 0.00 0.56 1.01 -1.26 -4.39 121.20 119.13 1mc7 s ILE 81 Ca 0.64 1.41 0.00 0.00 0.00 0.00 0.00 60.65 62.70 1mc7 s ILE 81 Cb -0.18 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.57 1mc7 s ILE 81 CO 0.23 -0.01 0.00 -0.24 0.00 0.00 0.00 174.94 174.92 1mc7 n SER 82 N -0.05 0.00 -2.90 3.58 2.88 -1.26 -4.69 113.62 111.18 1mc7 n SER 82 Ca 0.05 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.30 1mc7 n SER 82 Cb 0.50 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1mc7 n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1mc7 n LEU 83 N 0.00 -1.80 -3.91 2.46 4.32 -1.26 -0.06 117.00 116.75 1mc7 n LEU 83 Ca 0.00 0.57 -0.11 0.00 -0.02 0.00 0.00 56.01 56.45 1mc7 n LEU 83 Cb 0.00 -0.60 -0.13 0.00 -1.62 0.00 0.00 43.42 41.07 1mc7 n LEU 83 CO 0.00 -2.73 -0.36 -0.89 -1.22 0.00 0.00 177.39 172.19 1mc7 s THR 84 N -1.07 0.04 0.07 -5.08 2.01 0.77 -4.33 115.64 108.05 1mc7 s THR 84 Ca 0.40 -0.30 0.03 0.00 0.31 0.00 0.00 61.69 62.13 1mc7 s THR 84 Cb -0.45 -0.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.93 1mc7 s THR 84 CO 0.42 -0.16 -0.08 0.68 -0.69 0.00 0.00 174.62 174.78 1mc7 s VAL 85 N -0.48 0.72 -0.48 3.82 -7.23 -1.26 -2.21 120.40 113.28 1mc7 s VAL 85 Ca -0.05 -1.46 -0.02 0.00 -1.81 0.00 0.00 61.98 58.64 1mc7 s VAL 85 Cb -0.03 -1.11 0.30 0.00 0.56 0.00 0.00 36.38 36.10 1mc7 s VAL 85 CO -0.00 -0.54 2.08 0.00 -0.31 0.00 0.00 175.10 176.32 1mc7 n ALA 86 N 0.83 5.74 -0.96 1.32 0.00 -1.14 -1.61 120.51 124.68 1mc7 n ALA 86 Ca -0.18 -2.54 0.11 0.00 0.00 0.00 0.00 53.44 50.83 1mc7 n ALA 86 Cb 0.57 -1.60 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 1mc7 n ALA 86 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1mc7 n LYS 87 N -0.13 -1.79 -2.70 0.00 4.76 -1.26 -4.94 118.16 112.10 1mc7 n LYS 87 Ca 0.45 1.26 -0.03 0.00 -2.87 0.00 0.00 58.31 57.12 1mc7 n LYS 87 Cb 0.59 -2.27 0.03 0.00 -1.84 0.00 0.00 35.03 31.54 1mc7 n LYS 87 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1mc7 s ALA 88 N -2.45 -4.12 -0.04 7.82 0.00 -1.26 -4.65 121.76 117.07 1mc7 s ALA 88 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 51.96 52.44 1mc7 s ALA 88 Cb 0.00 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 20.18 1mc7 s ALA 88 CO 0.00 -2.48 0.01 1.87 0.00 0.00 0.00 175.76 175.16 1mc7 n TRP 89 N 2.74 -0.58 -3.37 0.00 -0.00 -1.26 -4.93 117.44 110.04 1mc7 n TRP 89 Ca 0.12 0.29 -0.38 0.00 -0.00 0.00 0.00 57.50 57.53 1mc7 n TRP 89 Cb 0.63 -1.84 -0.06 0.00 -0.00 0.00 0.00 31.31 30.04 1mc7 n TRP 89 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1mc7 s ASP 90 N -0.17 6.71 0.45 5.87 2.15 -1.26 -5.08 116.67 125.33 1mc7 s ASP 90 Ca -0.02 0.84 0.00 0.00 0.43 0.00 0.00 52.55 53.81 1mc7 s ASP 90 Cb 0.00 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 1mc7 s ASP 90 CO 0.11 0.09 0.00 -0.81 -0.17 0.00 0.00 175.17 174.39 1mc7 n PRO 91 N 3.19 0.33 -4.57 4.34 -0.04 -1.26 -5.06 135.00 131.93 1mc7 n PRO 91 Ca -0.09 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.04 1mc7 n PRO 91 Cb 0.52 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.82 1mc7 n PRO 91 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1mc7 s THR 92 N -0.45 2.23 0.74 0.52 2.01 -1.26 -5.13 115.64 114.31 1mc7 s THR 92 Ca 0.00 -0.92 -0.13 0.00 0.31 0.00 0.00 61.69 60.96 1mc7 s THR 92 Cb 0.00 -1.91 0.18 0.00 0.01 0.00 0.00 72.50 70.78 1mc7 s THR 92 CO 0.00 0.54 0.82 -0.81 -0.69 0.00 0.00 174.62 174.48 1mc7 n PRO 93 N 4.14 -1.64 -4.12 4.92 -0.04 -1.26 -4.31 135.00 132.68 1mc7 n PRO 93 Ca -0.20 -1.29 -0.44 0.00 -0.04 0.00 0.00 63.50 61.54 1mc7 n PRO 93 Cb 0.51 -1.01 -0.00 0.00 -0.04 0.00 0.00 33.50 32.96 1mc7 n PRO 93 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1mc7 n ARG 94 N -3.32 -0.34 -0.58 0.54 1.85 -1.26 -5.35 116.66 108.21 1mc7 n ARG 94 Ca 0.11 0.04 0.00 0.00 -1.00 0.00 0.00 57.85 57.00 1mc7 n ARG 94 Cb 0.39 -2.55 0.00 0.00 -1.05 0.00 0.00 32.46 29.26 1mc7 n ARG 94 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05