#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mc7 n VAL 2 N 0.00 0.80 -3.71 1.08 0.31 -1.25 -4.84 118.33 110.73 1mc7 n VAL 2 Ca 0.00 -0.20 -0.37 0.00 -0.01 0.00 0.00 64.34 63.76 1mc7 n VAL 2 Cb 0.00 -1.03 -0.10 0.00 -0.91 0.00 0.00 33.84 31.79 1mc7 n VAL 2 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1mc7 s THR 3 N -0.06 3.63 1.08 2.52 2.01 -1.26 -4.05 115.64 119.51 1mc7 s THR 3 Ca 0.73 -2.24 -0.17 0.00 0.31 0.00 0.00 61.69 60.32 1mc7 s THR 3 Cb -0.80 -3.43 0.15 0.00 0.01 0.00 0.00 72.50 68.43 1mc7 s THR 3 CO 0.50 -0.76 0.17 0.18 -0.69 0.00 0.00 174.62 174.02 1mc7 n LEU 4 N 4.36 -1.71 0.00 4.42 4.77 -1.26 -4.98 117.00 122.60 1mc7 n LEU 4 Ca -0.00 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 1mc7 n LEU 4 Cb 0.40 -0.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1mc7 n LEU 4 CO 0.35 -3.24 0.00 -3.20 -1.33 0.00 0.00 177.39 169.97 1mc7 n ASN 5 N -1.52 0.00 0.00 -1.43 2.85 -1.26 -4.98 115.26 108.92 1mc7 n ASN 5 Ca 0.04 0.36 0.00 0.00 -0.11 0.00 0.00 54.58 54.87 1mc7 n ASN 5 Cb 0.48 -0.49 0.00 0.00 1.24 0.00 0.00 39.78 41.01 1mc7 n ASN 5 CO 0.00 0.00 0.00 0.80 -2.11 0.00 0.00 177.26 175.95 1mc7 n MET 6 N -2.10 0.00 -1.21 1.20 0.00 -1.26 -5.11 117.12 108.65 1mc7 n MET 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1mc7 n MET 6 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1mc7 n MET 6 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1mc7 n GLU 7 N 0.00 -2.37 -3.22 2.12 -0.58 -1.26 -5.02 120.64 110.31 1mc7 n GLU 7 Ca 0.00 1.97 -0.23 0.00 -0.42 0.00 0.00 57.16 58.48 1mc7 n GLU 7 Cb 0.00 -1.86 -0.07 0.00 -0.57 0.00 0.00 31.44 28.94 1mc7 n GLU 7 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1mc7 n ARG 8 N 0.81 0.49 0.00 3.49 0.63 -1.26 -5.01 116.66 115.80 1mc7 n ARG 8 Ca 0.00 -3.04 0.00 0.00 -0.92 0.00 0.00 57.85 53.89 1mc7 n ARG 8 Cb 0.00 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 31.48 1mc7 n ARG 8 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1mc7 n HIS 9 N 2.09 0.00 -1.17 -0.14 8.25 -1.26 -4.93 115.22 118.06 1mc7 n HIS 9 Ca 0.24 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.84 1mc7 n HIS 9 Cb 0.52 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 1mc7 n HIS 9 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1mc7 n HIS 10 N 0.00 -2.77 -1.42 4.41 -0.00 -1.26 -4.96 115.22 109.22 1mc7 n HIS 10 Ca 0.00 1.43 0.19 0.00 0.46 0.00 0.00 57.72 59.80 1mc7 n HIS 10 Cb 0.00 -2.52 -0.05 0.00 -0.12 0.00 0.00 29.99 27.30 1mc7 n HIS 10 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1mc7 n PHE 11 N -3.56 -3.58 -1.40 1.57 7.35 -1.26 -5.03 117.46 111.55 1mc7 n PHE 11 Ca -0.02 1.81 0.00 0.00 -0.76 0.00 0.00 57.45 58.48 1mc7 n PHE 11 Cb 0.63 -3.25 0.00 0.00 0.35 0.00 0.00 39.48 37.21 1mc7 n PHE 11 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1mc7 n LEU 12 N -4.18 -1.86 -4.18 -2.13 0.00 -1.26 -5.01 117.00 98.38 1mc7 n LEU 12 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 56.01 55.61 1mc7 n LEU 12 Cb 0.67 -0.93 -0.08 0.00 0.00 0.00 0.00 43.42 43.08 1mc7 n LEU 12 CO 0.01 0.00 0.09 -0.83 0.00 0.00 0.00 177.39 176.66 1mc7 s GLY 13 N 0.00 2.38 0.40 -3.96 0.00 -1.26 -5.04 107.32 99.84 1mc7 s GLY 13 Ca 0.00 -3.04 0.03 0.00 0.00 0.00 0.00 44.72 41.72 1mc7 s GLY 13 CO 0.00 1.13 0.10 -0.26 0.00 0.00 0.00 173.10 174.07 1mc7 s ILE 14 N 0.44 0.78 0.21 0.90 -5.25 -1.26 -3.86 121.20 113.15 1mc7 s ILE 14 Ca 0.14 -2.00 -0.20 0.00 -0.99 0.00 0.00 60.65 57.59 1mc7 s ILE 14 Cb -0.20 -2.43 0.04 0.00 2.95 0.00 0.00 42.46 42.82 1mc7 s ILE 14 CO -0.04 0.00 0.61 -0.44 -1.79 0.00 0.00 174.94 173.28 1mc7 s SER 15 N -3.60 -0.37 0.56 4.36 0.01 -1.24 -5.02 113.70 108.40 1mc7 s SER 15 Ca 0.25 -0.35 0.06 0.00 1.31 0.00 0.00 55.95 57.22 1mc7 s SER 15 Cb 0.04 0.63 0.05 0.00 0.21 0.00 0.00 66.02 66.95 1mc7 s SER 15 CO 0.14 -1.11 0.45 0.27 0.41 0.00 0.00 173.24 173.40 1mc7 s ILE 16 N -3.84 1.58 0.06 1.44 -4.36 -1.26 0.19 121.20 115.01 1mc7 s ILE 16 Ca 0.07 -1.45 -0.27 0.00 -0.26 0.00 0.00 60.65 58.74 1mc7 s ILE 16 Cb -0.02 -2.04 0.09 0.00 1.25 0.00 0.00 42.46 41.74 1mc7 s ILE 16 CO -0.03 0.00 1.17 0.54 0.24 0.00 0.00 174.94 176.86 1mc7 s VAL 17 N -2.80 0.00 0.00 8.37 0.11 0.15 -3.49 120.40 122.75 1mc7 s VAL 17 Ca 0.35 -0.37 0.00 0.00 -2.93 0.00 0.00 61.98 59.03 1mc7 s VAL 17 Cb -0.03 -2.41 0.00 0.00 -1.53 0.00 0.00 36.38 32.41 1mc7 s VAL 17 CO 0.22 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.60 1mc7 n GLY 18 N -0.63 4.35 0.42 6.54 0.00 -1.26 -1.35 105.19 113.26 1mc7 n GLY 18 Ca -0.04 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.42 1.61 0.00 -1.26 -4.98 117.38 111.33 1mc7 n GLN 19 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 57.00 57.18 1mc7 n GLN 19 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 30.24 30.17 1mc7 n GLN 19 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1mc7 n SER 20 N -1.83 -8.29 -2.50 1.69 7.64 -1.26 -5.00 113.62 104.07 1mc7 n SER 20 Ca 0.00 1.14 -0.04 0.00 1.01 0.00 0.00 58.87 60.98 1mc7 n SER 20 Cb 0.00 -4.67 -0.03 0.00 -1.01 0.00 0.00 64.21 58.49 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 -4.29 -2.17 -3.61 6.43 5.15 -1.26 -5.08 115.26 110.43 1mc7 n ASN 21 Ca -0.05 1.22 -0.04 0.00 -0.60 0.00 0.00 54.58 55.10 1mc7 n ASN 21 Cb 0.66 -4.82 -0.03 0.00 -0.53 0.00 0.00 39.78 35.07 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 -0.81 -0.12 -0.43 1.20 2.15 -1.26 -5.09 116.67 112.31 1mc7 s ASP 22 Ca -0.20 0.06 -0.27 0.00 0.43 0.00 0.00 52.55 52.57 1mc7 s ASP 22 Cb 0.01 0.11 -0.05 0.00 -0.30 0.00 0.00 42.92 42.70 1mc7 s ASP 22 CO 0.71 -0.16 2.15 -0.60 -0.17 0.00 0.00 175.17 177.10 1mc7 s ARG 23 N -1.81 2.64 -0.21 4.34 3.00 -1.26 -3.94 118.95 121.71 1mc7 s ARG 23 Ca 0.08 1.39 -0.18 0.00 -1.00 0.00 0.00 55.73 56.02 1mc7 s ARG 23 Cb -0.01 -4.43 0.03 0.00 0.00 0.00 0.00 34.95 30.54 1mc7 s ARG 23 CO -0.05 -2.67 0.31 0.41 0.00 0.00 0.00 175.30 173.30 1mc7 n GLY 24 N 5.79 0.09 0.00 8.12 0.00 -1.26 -4.96 105.19 112.97 1mc7 n GLY 24 Ca 0.30 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.85 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 0.61 0.00 -3.36 1.61 -0.08 -1.25 -5.13 116.55 108.94 1mc7 n ASP 25 Ca -0.04 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.03 1mc7 n ASP 25 Cb 0.50 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.87 1mc7 n ASP 25 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1mc7 s GLY 26 N 0.00 0.28 -0.21 0.27 0.00 -1.26 -4.52 107.32 101.88 1mc7 s GLY 26 Ca 0.00 -1.36 -0.05 0.00 0.00 0.00 0.00 44.72 43.31 1mc7 s GLY 26 CO 0.00 2.55 0.37 -0.32 0.00 0.00 0.00 173.10 175.70 1mc7 s GLY 27 N 1.14 -0.34 0.23 0.20 0.00 -1.26 -4.88 107.32 102.42 1mc7 s GLY 27 Ca 0.20 1.14 -0.29 0.00 0.00 0.00 0.00 44.72 45.77 1mc7 s GLY 27 CO -0.03 2.45 0.83 1.39 0.00 0.00 0.00 173.10 177.74 1mc7 n ILE 28 N 5.37 1.82 -4.41 0.90 2.08 -1.26 -4.96 119.36 118.89 1mc7 n ILE 28 Ca -0.06 -0.45 -0.20 0.00 0.56 0.00 0.00 62.75 62.59 1mc7 n ILE 28 Cb 0.50 -0.55 -0.10 0.00 -0.75 0.00 0.00 39.64 38.73 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 -0.91 1.85 0.03 1.39 1.13 -0.46 -4.01 117.35 116.38 1mc7 s TYR 29 Ca 0.63 -0.89 -0.32 0.00 -1.41 0.00 0.00 57.07 55.09 1mc7 s TYR 29 Cb -0.83 -1.14 -0.10 0.00 -1.10 0.00 0.00 41.96 38.79 1mc7 s TYR 29 CO 0.57 0.05 1.90 1.51 -2.51 0.00 0.00 175.55 177.08 1mc7 n ILE 30 N -0.59 0.59 -0.20 -3.49 0.13 -1.05 0.33 119.36 115.08 1mc7 n ILE 30 Ca -0.04 -0.11 -0.02 0.00 -1.10 0.00 0.00 62.75 61.49 1mc7 n ILE 30 Cb 0.65 -2.13 0.08 0.00 -0.84 0.00 0.00 39.64 37.41 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 9.53 0.85 -3.29 4.50 0.00 0.20 -3.36 103.07 111.50 1mc7 h GLY 31 Ca -0.48 -0.20 0.37 0.00 0.00 0.00 0.00 47.33 47.02 1mc7 h GLY 31 CO 0.94 0.10 0.98 -1.35 0.00 0.00 0.00 176.54 177.21 1mc7 s SER 32 N -5.51 -0.01 -0.11 0.19 1.04 -1.25 -4.65 113.70 103.40 1mc7 s SER 32 Ca -0.13 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.30 1mc7 s SER 32 Cb 0.15 0.01 0.02 0.00 0.10 0.00 0.00 66.02 66.31 1mc7 s SER 32 CO 0.75 -0.03 -0.10 -0.63 0.98 0.00 0.00 173.24 174.21 1mc7 s ILE 33 N -2.04 1.18 -1.19 -1.02 1.09 -1.26 -3.72 121.20 114.24 1mc7 s ILE 33 Ca 0.14 -0.41 -0.23 0.00 -1.10 0.00 0.00 60.65 59.05 1mc7 s ILE 33 Cb 0.05 -1.15 -0.10 0.00 -1.06 0.00 0.00 42.46 40.20 1mc7 s ILE 33 CO -0.05 0.39 1.94 0.23 -0.10 0.00 0.00 174.94 177.35 1mc7 n MET 34 N 4.66 1.54 -1.46 2.79 2.81 -1.25 -4.89 117.12 121.31 1mc7 n MET 34 Ca -0.16 -2.44 -0.57 0.00 -1.81 0.00 0.00 57.70 52.72 1mc7 n MET 34 Cb 0.50 -3.75 -0.08 0.00 -0.71 0.00 0.00 33.22 29.19 1mc7 n MET 34 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1mc7 n LYS 35 N 8.26 0.00 -0.43 0.03 2.85 -1.26 -3.38 118.16 124.23 1mc7 n LYS 35 Ca 0.45 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.71 1mc7 n LYS 35 Cb 0.47 -1.43 0.00 0.00 -0.65 0.00 0.00 35.03 33.41 1mc7 n LYS 35 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1mc7 n GLY 36 N 1.76 0.60 0.00 2.58 0.00 -1.24 -4.85 105.19 104.03 1mc7 n GLY 36 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.26 3.47 0.00 -0.02 0.00 -1.22 -4.75 105.19 102.41 1mc7 n GLY 37 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.29 4.61 0.00 -1.26 -3.32 120.51 117.83 1mc7 n ALA 38 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1mc7 n ALA 38 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.66 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 -0.19 0.00 2.07 -1.97 -2.93 116.25 113.23 1mc7 h VAL 39 Ca 0.00 -0.91 -0.12 0.00 0.82 0.00 0.00 66.70 66.50 1mc7 h VAL 39 Cb 0.00 1.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1mc7 h VAL 39 CO 0.00 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 177.25 1mc7 h ALA 40 N 2.09 0.30 0.00 1.67 0.00 -1.81 -2.82 119.26 118.68 1mc7 h ALA 40 Ca 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1mc7 h ALA 40 Cb 0.95 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1mc7 h ALA 40 CO 0.00 0.35 -0.05 0.00 0.00 0.00 0.00 179.25 179.55 1mc7 h ALA 41 N 0.60 1.00 -0.22 0.00 0.00 -1.55 -3.02 119.26 116.06 1mc7 h ALA 41 Ca 0.01 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1mc7 h ALA 41 Cb 0.93 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1mc7 h ALA 41 CO 0.08 0.06 0.07 0.22 0.00 0.00 0.00 179.25 179.67 1mc7 h ASP 42 N 0.00 0.07 0.00 0.00 3.58 -1.30 -3.47 116.42 115.29 1mc7 h ASP 42 Ca -0.00 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.47 1mc7 h ASP 42 Cb 0.64 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.71 1mc7 h ASP 42 CO 0.01 0.07 0.00 0.61 -2.88 0.00 0.00 179.24 177.05 1mc7 n GLY 43 N -1.17 3.17 2.66 -0.78 0.00 -1.14 -5.04 105.19 102.88 1mc7 n GLY 43 Ca -0.02 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 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 3.27 -0.95 1.61 1.74 -1.26 -4.74 116.66 116.33 1mc7 n ARG 44 Ca 0.00 -4.21 -0.37 0.00 -0.77 0.00 0.00 57.85 52.50 1mc7 n ARG 44 Cb 0.00 -2.26 0.06 0.00 -1.02 0.00 0.00 32.46 29.23 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 -0.47 0.00 -4.28 0.55 2.08 -1.26 -5.01 119.36 110.97 1mc7 n ILE 45 Ca 0.44 -0.25 -0.15 0.00 0.56 0.00 0.00 62.75 63.34 1mc7 n ILE 45 Cb 0.48 -0.12 -0.10 0.00 -0.75 0.00 0.00 39.64 39.15 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 -2.30 1.23 0.14 0.38 2.02 -1.26 -4.86 118.70 114.05 1mc7 s GLU 46 Ca 0.42 -1.61 -0.05 0.00 0.02 0.00 0.00 54.97 53.75 1mc7 s GLU 46 Cb -0.06 -0.38 -0.06 0.00 0.10 0.00 0.00 34.13 33.73 1mc7 s GLU 46 CO 0.73 -0.14 1.34 -1.00 0.02 0.00 0.00 175.26 176.21 1mc7 h PRO 47 N 2.58 0.45 -0.67 0.39 0.13 -1.83 -3.01 132.00 130.04 1mc7 h PRO 47 Ca -0.37 -0.44 0.00 0.00 -0.87 0.00 0.00 66.00 64.32 1mc7 h PRO 47 Cb 1.22 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1mc7 h PRO 47 CO 0.63 1.09 0.00 0.41 -0.23 0.00 0.00 178.00 179.90 1mc7 n GLY 48 N 0.82 0.86 0.30 1.56 0.00 -1.26 -2.54 105.19 104.92 1mc7 n GLY 48 Ca -0.06 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 45.98 1mc7 n GLY 48 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1mc7 h ASP 49 N 0.34 0.14 -1.79 1.61 1.82 -1.83 -3.41 116.42 113.30 1mc7 h ASP 49 Ca 0.00 -0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1mc7 h ASP 49 Cb 0.45 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.43 1mc7 h ASP 49 CO 0.03 0.09 0.00 0.80 -1.61 0.00 0.00 179.24 178.55 1mc7 n MET 50 N -4.49 0.00 -2.94 0.28 0.00 -1.25 -4.10 117.12 104.61 1mc7 n MET 50 Ca 0.02 0.00 -0.44 0.00 -0.00 0.00 0.00 57.70 57.28 1mc7 n MET 50 Cb 0.21 -1.80 -0.01 0.00 0.00 0.00 0.00 33.22 31.62 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 -1.79 5.05 0.00 -0.89 1.98 -1.26 -3.38 118.68 118.40 1mc7 s LEU 51 Ca 0.00 -2.80 0.00 0.00 -2.89 0.00 0.00 54.13 48.44 1mc7 s LEU 51 Cb 0.00 -2.40 0.00 0.00 0.66 0.00 0.00 46.19 44.45 1mc7 s LEU 51 CO 0.00 -0.81 0.43 0.00 -1.89 0.00 0.00 176.35 174.08 1mc7 n LEU 52 N 5.83 0.83 -4.05 -0.68 -0.00 -1.24 -4.10 117.00 113.59 1mc7 n LEU 52 Ca 0.34 -0.83 -0.11 0.00 -0.00 0.00 0.00 56.01 55.40 1mc7 n LEU 52 Cb 0.44 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.75 1mc7 n LEU 52 CO 0.60 0.21 -0.39 0.00 -0.00 0.00 0.00 177.39 177.81 1mc7 s GLN 53 N -0.09 0.49 0.02 1.47 -2.07 -0.89 -3.31 119.66 115.28 1mc7 s GLN 53 Ca 0.00 -0.78 -0.01 0.00 -1.82 0.00 0.00 55.36 52.75 1mc7 s GLN 53 Cb 0.00 -0.15 -0.02 0.00 -1.09 0.00 0.00 33.01 31.75 1mc7 s GLN 53 CO 0.00 0.01 -0.00 0.08 -1.32 0.00 0.00 175.29 174.06 1mc7 s VAL 54 N -1.67 0.12 0.00 3.63 1.01 -1.22 0.25 120.40 122.52 1mc7 s VAL 54 Ca -0.09 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1mc7 s VAL 54 Cb -0.08 -0.47 0.00 0.00 0.00 0.00 0.00 36.38 35.83 1mc7 s VAL 54 CO -0.01 -0.55 0.00 -3.20 0.00 0.00 0.00 175.10 171.34 1mc7 n ASN 55 N 1.35 0.00 -0.02 3.32 2.85 0.35 0.18 115.26 123.29 1mc7 n ASN 55 Ca -0.22 0.00 0.09 0.00 -0.11 0.00 0.00 54.58 54.34 1mc7 n ASN 55 Cb 0.56 0.00 0.53 0.00 1.24 0.00 0.00 39.78 42.11 1mc7 n ASN 55 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1mc7 n ASP 56 N -1.21 0.05 -4.87 1.20 4.64 -1.26 -4.82 116.55 110.28 1mc7 n ASP 56 Ca 0.00 -1.45 -0.31 0.00 -1.38 0.00 0.00 54.79 51.66 1mc7 n ASP 56 Cb 0.00 -0.00 0.01 0.00 -1.04 0.00 0.00 41.12 40.09 1mc7 n ASP 56 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1mc7 s VAL 57 N -1.99 4.71 -0.35 5.18 1.01 0.47 -5.06 120.40 124.36 1mc7 s VAL 57 Ca 0.27 0.86 0.05 0.00 0.00 0.00 0.00 61.98 63.16 1mc7 s VAL 57 Cb 0.13 -3.87 0.17 0.00 0.00 0.00 0.00 36.38 32.81 1mc7 s VAL 57 CO 0.21 -1.13 0.50 0.54 0.00 0.00 0.00 175.10 175.22 1mc7 s ASN 58 N -4.16 -0.38 -0.00 3.32 4.22 -1.26 -3.45 114.94 113.23 1mc7 s ASN 58 Ca 0.55 -0.73 0.00 0.00 -2.14 0.00 0.00 52.86 50.54 1mc7 s ASN 58 Cb -0.11 1.40 0.01 0.00 1.28 0.00 0.00 41.25 43.83 1mc7 s ASN 58 CO 0.53 -0.26 0.64 0.49 -2.04 0.00 0.00 177.10 176.47 1mc7 n PHE 59 N 4.77 0.03 -1.59 1.54 3.72 -1.21 -4.91 117.46 119.82 1mc7 n PHE 59 Ca 0.07 -0.14 -0.37 0.00 -0.05 0.00 0.00 57.45 56.96 1mc7 n PHE 59 Cb 0.52 -0.15 0.06 0.00 -0.94 0.00 0.00 39.48 38.97 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 0.81 0.00 -1.08 4.71 -1.26 -1.92 120.64 122.03 1mc7 n GLU 60 Ca 0.01 0.32 0.00 0.00 -0.01 0.00 0.00 57.16 57.48 1mc7 n GLU 60 Cb 0.33 -2.16 0.00 0.00 -1.01 0.00 0.00 31.44 28.60 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 -0.86 0.00 -0.22 1.62 5.15 -1.26 -4.74 115.26 114.95 1mc7 n ASN 61 Ca 0.14 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 54.06 1mc7 n ASN 61 Cb 0.48 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.68 1mc7 n ASN 61 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 1mc7 h MET 62 N 0.00 -0.00 -5.48 1.20 4.05 -1.76 -3.42 114.93 109.51 1mc7 h MET 62 Ca 0.00 0.00 -0.22 0.00 -0.28 0.00 0.00 59.70 59.20 1mc7 h MET 62 Cb 0.00 0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 30.71 1mc7 h MET 62 CO 0.00 -0.00 -0.34 0.45 0.23 0.00 0.00 176.91 177.25 1mc7 n SER 63 N -4.18 0.14 -0.32 1.39 2.88 -1.25 -4.63 113.62 107.65 1mc7 n SER 63 Ca 0.01 -0.45 0.03 0.00 -1.33 0.00 0.00 58.87 57.13 1mc7 n SER 63 Cb 0.14 -0.56 0.08 0.00 -0.75 0.00 0.00 64.21 63.11 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 -0.73 0.93 -1.48 -3.46 5.15 -1.26 -4.84 115.26 109.57 1mc7 n ASN 64 Ca -0.08 -2.00 -0.13 0.00 -0.60 0.00 0.00 54.58 51.77 1mc7 n ASN 64 Cb 0.23 -0.12 -0.05 0.00 -0.53 0.00 0.00 39.78 39.31 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 0.00 -3.43 -0.76 1.20 8.00 -1.26 -4.55 116.55 115.75 1mc7 n ASP 65 Ca 0.06 0.30 -0.02 0.00 0.71 0.00 0.00 54.79 55.84 1mc7 n ASP 65 Cb 0.15 -3.19 -0.02 0.00 -0.02 0.00 0.00 41.12 38.04 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 -0.60 -0.30 0.27 -2.24 9.92 -1.26 -4.90 116.55 117.44 1mc7 n ASP 66 Ca -0.13 -1.54 0.15 0.00 -0.53 0.00 0.00 54.79 52.74 1mc7 n ASP 66 Cb 0.44 0.07 0.79 0.00 -0.64 0.00 0.00 41.12 41.78 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 0.07 1.15 -0.77 2.24 0.00 -1.96 -0.62 119.26 119.37 1mc7 h ALA 67 Ca -0.23 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.81 1mc7 h ALA 67 Cb 1.25 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.96 1mc7 h ALA 67 CO -0.10 -0.15 0.35 0.28 0.00 0.00 0.00 179.25 179.63 1mc7 h VAL 68 N 0.00 0.72 -1.25 0.00 2.07 -1.96 0.30 116.25 116.13 1mc7 h VAL 68 Ca 0.00 -0.18 0.36 0.00 0.82 0.00 0.00 66.70 67.70 1mc7 h VAL 68 Cb 0.34 0.15 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 1mc7 h VAL 68 CO 0.00 0.10 1.22 -0.09 0.02 0.00 0.00 177.57 178.81 1mc7 h ARG 69 N 0.52 0.00 0.00 1.57 2.43 -1.53 1.17 114.38 118.54 1mc7 h ARG 69 Ca 0.41 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 59.24 1mc7 h ARG 69 Cb 0.58 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.08 1mc7 h ARG 69 CO -0.36 0.00 -2.17 1.55 -1.51 0.00 0.00 179.97 177.48 1mc7 n VAL 70 N -3.47 1.15 -0.28 0.20 3.14 0.83 -4.28 118.33 115.61 1mc7 n VAL 70 Ca 0.28 -0.32 0.09 0.00 -2.96 0.00 0.00 64.34 61.43 1mc7 n VAL 70 Cb 1.60 -1.69 0.24 0.00 -1.06 0.00 0.00 33.84 32.93 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 -0.63 0.29 -2.22 6.55 5.85 0.17 1.56 115.31 126.88 1mc7 h LEU 71 Ca -0.52 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1mc7 h LEU 71 Cb 1.50 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.65 1mc7 h LEU 71 CO -0.28 0.05 0.00 -0.09 -0.34 0.00 0.00 178.44 177.78 1mc7 h ARG 72 N 0.42 0.00 0.00 1.25 9.65 0.10 0.23 114.38 126.04 1mc7 h ARG 72 Ca 0.48 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.34 1mc7 h ARG 72 Cb 0.82 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.40 1mc7 h ARG 72 CO -0.47 0.00 -0.10 1.05 2.80 0.00 0.00 179.97 183.25 1mc7 h GLU 73 N 0.00 0.00 0.00 0.20 4.11 0.21 -3.01 114.58 116.09 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 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1mc7 h GLU 73 CO 0.00 0.10 0.00 -0.89 0.07 0.00 0.00 179.01 178.29 1mc7 n ILE 74 N -3.13 0.00 -0.34 -1.06 2.08 0.07 -1.09 119.36 115.88 1mc7 n ILE 74 Ca 0.03 0.29 0.33 0.00 0.56 0.00 0.00 62.75 63.96 1mc7 n ILE 74 Cb 0.54 -1.01 0.59 0.00 -0.75 0.00 0.00 39.64 39.01 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 -0.36 0.09 1.39 0.24 -1.25 0.27 118.33 118.70 1mc7 n VAL 75 Ca 0.00 1.89 -0.10 0.00 -2.04 0.00 0.00 64.34 64.09 1mc7 n VAL 75 Cb 0.00 -3.07 -0.06 0.00 -1.47 0.00 0.00 33.84 29.24 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 -0.93 0.00 -1.34 0.87 -1.60 -3.41 113.55 107.14 1mc7 h SER 76 Ca 0.82 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 61.47 1mc7 h SER 76 Cb 2.30 0.34 0.00 0.00 -0.44 0.00 0.00 62.40 64.59 1mc7 h SER 76 CO -0.66 -0.34 0.00 0.00 -0.53 0.00 0.00 176.83 175.29 1mc7 n GLN 77 N -4.23 0.00 -0.35 2.24 6.02 0.14 -5.01 117.38 116.19 1mc7 n GLN 77 Ca -0.05 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.82 1mc7 n GLN 77 Cb 0.25 0.00 0.11 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 -1.04 5.09 -2.24 -1.24 -4.74 114.28 110.11 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 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 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 -1.10 -3.57 3.79 3.38 0.00 -1.26 -3.86 105.19 102.56 1mc7 n GLY 79 Ca 0.05 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.10 4.06 0.33 1.61 0.04 -1.26 -4.33 135.00 133.34 1mc7 s PRO 80 Ca 0.00 1.48 -0.27 0.00 0.04 0.00 0.00 61.00 62.25 1mc7 s PRO 80 Cb 0.00 -2.42 -0.09 0.00 0.04 0.00 0.00 34.50 32.03 1mc7 s PRO 80 CO 0.00 -0.23 1.04 0.42 0.04 0.00 0.00 177.00 178.28 1mc7 s ILE 81 N -1.74 3.73 0.00 0.56 1.01 -1.26 -4.42 121.20 119.07 1mc7 s ILE 81 Ca 0.60 1.52 0.00 0.00 0.00 0.00 0.00 60.65 62.77 1mc7 s ILE 81 Cb -0.21 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.38 1mc7 s ILE 81 CO 0.26 0.20 0.00 -1.20 0.00 0.00 0.00 174.94 174.20 1mc7 n SER 82 N 0.61 0.00 -2.44 3.58 7.64 -1.26 -4.76 113.62 116.99 1mc7 n SER 82 Ca 0.02 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.63 1mc7 n SER 82 Cb 0.48 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.66 1mc7 n SER 82 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mc7 n LEU 83 N 0.00 -0.73 -3.97 -3.43 -0.00 -1.26 -0.50 117.00 107.12 1mc7 n LEU 83 Ca 0.00 0.62 -0.18 0.00 -0.00 0.00 0.00 56.01 56.45 1mc7 n LEU 83 Cb 0.00 -0.53 -0.15 0.00 -0.00 0.00 0.00 43.42 42.74 1mc7 n LEU 83 CO 0.00 -1.69 -0.42 -0.89 -0.00 0.00 0.00 177.39 174.40 1mc7 s THR 84 N -0.57 0.58 0.07 1.47 2.01 0.69 -3.82 115.64 116.07 1mc7 s THR 84 Ca 0.35 -0.27 0.02 0.00 0.31 0.00 0.00 61.69 62.11 1mc7 s THR 84 Cb -0.51 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.44 1mc7 s THR 84 CO 0.31 0.19 -0.07 0.68 -0.69 0.00 0.00 174.62 175.04 1mc7 s VAL 85 N 0.14 0.60 -0.47 3.82 -7.23 -1.25 -2.11 120.40 113.90 1mc7 s VAL 85 Ca -0.02 -1.53 -0.02 0.00 -1.81 0.00 0.00 61.98 58.61 1mc7 s VAL 85 Cb -0.06 -1.17 0.30 0.00 0.56 0.00 0.00 36.38 36.01 1mc7 s VAL 85 CO -0.00 -0.65 2.07 0.00 -0.31 0.00 0.00 175.10 176.21 1mc7 n ALA 86 N 0.67 5.69 -1.14 1.32 0.00 -1.22 -1.58 120.51 124.26 1mc7 n ALA 86 Ca -0.17 -2.48 0.13 0.00 0.00 0.00 0.00 53.44 50.92 1mc7 n ALA 86 Cb 0.58 -1.58 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 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 -0.12 -2.18 0.00 0.00 3.00 -1.26 -4.97 118.16 112.64 1mc7 n LYS 87 Ca 0.44 1.59 0.00 0.00 -0.00 0.00 0.00 58.31 60.34 1mc7 n LYS 87 Cb 0.60 -2.74 0.00 0.00 0.00 0.00 0.00 35.03 32.89 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 -2.71 0.00 0.00 3.14 0.00 -1.26 -4.69 120.51 114.98 1mc7 n ALA 88 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1mc7 n ALA 88 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 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 -1.69 0.00 -0.00 -1.26 -4.82 117.44 109.67 1mc7 n TRP 89 Ca 0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 57.50 57.06 1mc7 n TRP 89 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 31.31 31.28 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 0.35 3.37 -4.58 5.87 8.00 -1.26 -4.88 116.55 123.42 1mc7 n ASP 90 Ca 0.00 1.09 -0.42 0.00 0.71 0.00 0.00 54.79 56.18 1mc7 n ASP 90 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 41.12 39.59 1mc7 n ASP 90 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1mc7 s PRO 91 N 0.60 3.32 0.05 -0.24 0.04 -1.26 -5.00 135.00 132.52 1mc7 s PRO 91 Ca 0.74 0.64 -0.09 0.00 0.04 0.00 0.00 61.00 62.34 1mc7 s PRO 91 Cb -0.61 -4.12 -0.05 0.00 0.04 0.00 0.00 34.50 29.76 1mc7 s PRO 91 CO 0.39 -1.90 0.35 0.99 0.04 0.00 0.00 177.00 176.88 1mc7 s THR 92 N 6.17 5.17 0.60 1.26 2.01 -1.26 -5.10 115.64 124.49 1mc7 s THR 92 Ca 0.57 0.35 -0.10 0.00 0.31 0.00 0.00 61.69 62.82 1mc7 s THR 92 Cb -0.12 -3.62 0.14 0.00 0.01 0.00 0.00 72.50 68.91 1mc7 s THR 92 CO 0.27 0.32 0.66 -0.81 -0.69 0.00 0.00 174.62 174.37 1mc7 n PRO 93 N 0.98 -1.43 -3.17 4.92 -0.04 -1.26 -5.08 135.00 129.92 1mc7 n PRO 93 Ca -0.09 -1.04 -0.19 0.00 -0.04 0.00 0.00 63.50 62.15 1mc7 n PRO 93 Cb 0.52 -0.82 0.01 0.00 -0.04 0.00 0.00 33.50 33.18 1mc7 n PRO 93 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1mc7 s ARG 94 N -4.47 2.64 0.00 0.54 1.70 -1.26 -5.31 118.95 112.79 1mc7 s ARG 94 Ca 0.40 -1.42 0.28 0.00 -0.47 0.00 0.00 55.73 54.52 1mc7 s ARG 94 Cb -0.02 -2.63 1.07 0.00 -0.57 0.00 0.00 34.95 32.79 1mc7 s ARG 94 CO 0.29 -0.39 1.75 0.45 -1.08 0.00 0.00 175.30 176.32