#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q78 s ASP 3 N 0.00 5.62 -0.05 0.41 2.15 -1.26 -5.15 116.67 118.39 2q78 s ASP 3 Ca 0.00 0.02 0.12 0.00 0.43 0.00 0.00 52.55 53.12 2q78 s ASP 3 Cb 0.00 -1.99 0.34 0.00 -0.30 0.00 0.00 42.92 40.98 2q78 s ASP 3 CO 0.00 0.10 1.28 0.49 -0.17 0.00 0.00 175.17 176.87 2q78 n PHE 4 N 4.01 0.55 0.23 -5.34 3.72 -1.26 -4.65 117.46 114.73 2q78 n PHE 4 Ca -0.16 -0.61 0.15 0.00 -0.05 0.00 0.00 57.45 56.78 2q78 n PHE 4 Cb 0.52 -0.11 0.82 0.00 -0.94 0.00 0.00 39.48 39.78 2q78 n PHE 4 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2q78 h ASP 5 N 1.78 0.00 0.28 4.37 3.32 -1.92 -0.51 116.42 123.75 2q78 h ASP 5 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2q78 h ASP 5 Cb 0.91 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2q78 h ASP 5 CO 0.06 0.00 0.00 2.19 -1.72 0.00 0.00 179.24 179.77 2q78 h PHE 6 N 0.00 0.00 0.00 4.55 -5.15 -2.01 -1.89 116.94 112.44 2q78 h PHE 6 Ca 0.05 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.82 2q78 h PHE 6 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.45 2q78 h PHE 6 CO 0.00 0.00 0.00 -0.07 -2.00 0.00 0.00 178.31 176.24 2q78 h LEU 7 N 0.00 0.00 -9.71 2.10 3.38 -1.46 -3.45 115.31 106.16 2q78 h LEU 7 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 2q78 h LEU 7 Cb 0.14 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.96 2q78 h LEU 7 CO 0.00 0.00 0.94 -0.70 0.09 0.00 0.00 178.44 178.77 2q78 s GLU 8 N -3.46 4.14 0.00 1.13 2.12 -0.71 -1.54 118.70 120.38 2q78 s GLU 8 Ca 0.03 2.56 0.00 0.00 0.36 0.00 0.00 54.97 57.92 2q78 s GLU 8 Cb 0.09 -3.07 0.00 0.00 0.26 0.00 0.00 34.13 31.41 2q78 s GLU 8 CO 0.50 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 2q78 n GLY 9 N 3.20 1.70 3.77 -1.50 0.00 -0.26 -5.00 105.19 107.09 2q78 n GLY 9 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2q78 n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q78 s LYS 10 N -0.24 4.17 0.10 1.61 1.02 -0.59 -4.75 119.74 121.05 2q78 s LYS 10 Ca 0.00 1.83 0.03 0.00 0.02 0.00 0.00 55.97 57.86 2q78 s LYS 10 Cb 0.00 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.51 2q78 s LYS 10 CO 0.00 -0.22 -0.10 1.03 -0.92 0.00 0.00 175.35 175.15 2q78 s ARG 11 N -2.16 0.84 -0.19 1.68 0.52 -1.26 -0.87 118.95 117.50 2q78 s ARG 11 Ca 0.55 -1.17 -0.17 0.00 -0.52 0.00 0.00 55.73 54.42 2q78 s ARG 11 Cb -0.31 -0.48 0.05 0.00 0.52 0.00 0.00 34.95 34.73 2q78 s ARG 11 CO 0.39 0.07 0.51 -1.17 0.02 0.00 0.00 175.30 175.12 2q78 s LEU 12 N -2.50 -0.02 0.03 2.53 2.96 -0.55 -5.01 118.68 116.12 2q78 s LEU 12 Ca 0.06 1.04 0.07 0.00 -0.22 0.00 0.00 54.13 55.07 2q78 s LEU 12 Cb -0.02 1.74 -0.02 0.00 0.50 0.00 0.00 46.19 48.39 2q78 s LEU 12 CO -0.01 -0.18 -0.19 -0.89 -1.32 0.00 0.00 176.35 173.76 2q78 s THR 13 N 0.48 1.52 -0.03 3.68 2.01 -1.26 -0.89 115.64 121.15 2q78 s THR 13 Ca -0.02 -1.09 -0.04 0.00 0.31 0.00 0.00 61.69 60.85 2q78 s THR 13 Cb -0.04 -1.32 0.01 0.00 0.01 0.00 0.00 72.50 71.15 2q78 s THR 13 CO -0.02 0.19 0.10 -0.70 -0.69 0.00 0.00 174.62 173.50 2q78 s GLU 14 N -1.06 0.20 -0.35 4.92 2.12 0.12 -4.96 118.70 119.70 2q78 s GLU 14 Ca 0.06 -0.02 -0.22 0.00 0.36 0.00 0.00 54.97 55.14 2q78 s GLU 14 Cb -0.08 0.09 0.00 0.00 0.26 0.00 0.00 34.13 34.40 2q78 s GLU 14 CO 0.01 -0.04 0.74 0.34 -0.54 0.00 0.00 175.26 175.78 2q78 s ASP 15 N -0.35 6.54 -0.07 -1.70 2.15 -1.26 -0.36 116.67 121.62 2q78 s ASP 15 Ca -0.04 0.37 0.04 0.00 0.43 0.00 0.00 52.55 53.35 2q78 s ASP 15 Cb -0.03 -2.38 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2q78 s ASP 15 CO 0.00 -0.66 -0.21 -0.69 -0.17 0.00 0.00 175.17 173.45 2q78 s VAL 16 N 2.95 1.76 0.07 1.11 1.01 0.49 -4.94 120.40 122.85 2q78 s VAL 16 Ca 0.29 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 2q78 s VAL 16 Cb -0.14 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 2q78 s VAL 16 CO 0.15 0.49 1.04 0.00 0.00 0.00 0.00 175.10 176.78 2q78 s ALA 17 N 0.26 3.26 -0.34 5.51 0.00 -1.26 -0.33 121.76 128.86 2q78 s ALA 17 Ca -0.12 0.66 -0.21 0.00 0.00 0.00 0.00 51.96 52.29 2q78 s ALA 17 Cb -0.16 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.62 2q78 s ALA 17 CO 0.06 -0.21 0.65 -0.51 0.00 0.00 0.00 175.76 175.74 2q78 s LEU 18 N 0.50 4.21 0.00 0.00 1.43 0.32 -4.97 118.68 120.17 2q78 s LEU 18 Ca 0.51 0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.94 2q78 s LEU 18 Cb -0.25 -2.82 0.06 0.00 0.03 0.00 0.00 46.19 43.22 2q78 s LEU 18 CO 0.30 -0.57 0.52 -0.90 0.23 0.00 0.00 176.35 175.94 2q78 n ASP 19 N 6.02 2.57 0.28 2.29 5.68 -1.26 -0.03 116.55 132.10 2q78 n ASP 19 Ca -0.01 -2.79 0.11 0.00 -0.50 0.00 0.00 54.79 51.61 2q78 n ASP 19 Cb 0.49 -0.15 0.75 0.00 -1.14 0.00 0.00 41.12 41.07 2q78 n ASP 19 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2q78 h GLU 20 N 0.00 0.00 -2.24 0.11 9.09 -1.97 -3.36 114.58 116.20 2q78 h GLU 20 Ca -0.33 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.00 2q78 h GLU 20 Cb 1.26 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.33 2q78 h GLU 20 CO 0.50 0.00 -0.06 0.25 0.05 0.00 0.00 179.01 179.75 2q78 n THR 21 N -4.24 1.80 0.00 -1.06 -2.24 -1.26 -4.98 114.28 102.30 2q78 n THR 21 Ca -0.03 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 2q78 n THR 21 Cb 0.09 -1.69 0.00 0.00 -2.10 0.00 0.00 70.33 66.63 2q78 n THR 21 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2q78 n VAL 23 N 2.38 0.00 -2.85 2.28 0.31 -1.26 -5.06 118.33 114.13 2q78 n VAL 23 Ca 0.20 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 64.11 2q78 n VAL 23 Cb 0.53 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.42 2q78 n VAL 23 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 2q78 s TRP 24 N -1.59 3.21 -0.04 3.52 -0.00 0.27 -4.54 118.94 119.77 2q78 s TRP 24 Ca 0.00 0.97 0.06 0.00 -0.00 0.00 0.00 56.10 57.12 2q78 s TRP 24 Cb 0.00 -3.31 0.09 0.00 -0.00 0.00 0.00 33.47 30.24 2q78 s TRP 24 CO 0.00 -0.59 0.94 0.27 -0.00 0.00 0.00 176.95 177.57 2q78 n ASN 25 N 6.34 1.18 -0.08 5.86 0.23 -1.26 -4.59 115.26 122.94 2q78 n ASN 25 Ca 0.06 -2.12 0.03 0.00 -0.53 0.00 0.00 54.58 52.01 2q78 n ASN 25 Cb 0.48 -0.18 0.35 0.00 -2.08 0.00 0.00 39.78 38.35 2q78 n ASN 25 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2q78 h GLU 26 N 0.00 0.70 -4.59 -3.83 5.08 -2.01 -3.40 114.58 106.53 2q78 h GLU 26 Ca 0.00 -0.05 -0.70 0.00 -1.00 0.00 0.00 59.36 57.62 2q78 h GLU 26 Cb 0.99 -0.16 -0.32 0.00 0.50 0.00 0.00 28.75 29.76 2q78 h GLU 26 CO 0.00 0.47 -0.59 0.34 -1.00 0.00 0.00 179.01 178.24 2q78 s ASP 27 N -6.57 5.24 0.56 1.42 -1.08 -1.26 -4.97 116.67 110.00 2q78 s ASP 27 Ca -0.09 -1.55 0.29 0.00 -0.52 0.00 0.00 52.55 50.68 2q78 s ASP 27 Cb 0.17 -1.83 1.64 0.00 -1.46 0.00 0.00 42.92 41.44 2q78 s ASP 27 CO 0.75 -0.42 2.16 0.40 0.52 0.00 0.00 175.17 178.58 2q78 h ILE 28 N 6.30 0.54 0.00 4.11 1.08 -1.98 -3.07 117.51 124.50 2q78 h ILE 28 Ca -0.19 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 2q78 h ILE 28 Cb 1.06 1.18 0.00 0.00 -3.07 0.00 0.00 36.82 35.99 2q78 h ILE 28 CO 0.64 0.06 0.00 -0.62 -0.69 0.00 0.00 178.15 177.54 2q78 n GLU 29 N -3.74 0.82 0.00 2.37 1.02 -1.26 -4.73 120.64 115.12 2q78 n GLU 29 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2q78 n GLU 29 Cb 0.16 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 2q78 n GLU 29 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2q78 n LEU 31 N 1.41 0.00 0.30 -4.62 4.77 -1.16 -4.95 117.00 112.75 2q78 n LEU 31 Ca 0.00 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.14 2q78 n LEU 31 Cb 0.41 0.00 0.93 0.00 -2.33 0.00 0.00 43.42 42.43 2q78 n LEU 31 CO 0.00 0.00 1.11 -2.24 -1.33 0.00 0.00 177.39 174.93 2q78 h ASP 32 N 0.00 0.00 1.67 -1.43 2.03 -1.92 -1.69 116.42 115.08 2q78 h ASP 32 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2q78 h ASP 32 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2q78 h ASP 32 CO 0.00 0.02 0.00 -0.07 -1.03 0.00 0.00 179.24 178.16 2q78 h LEU 33 N 0.00 0.00 -3.18 0.15 3.38 -1.97 -3.48 115.31 110.22 2q78 h LEU 33 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2q78 h LEU 33 Cb 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.71 2q78 h LEU 33 CO 0.00 0.00 -0.92 0.00 0.09 0.00 0.00 178.44 177.61 2q78 n HIS 34 N -2.87 -1.22 -2.20 1.13 1.44 -0.64 -4.71 115.22 106.16 2q78 n HIS 34 Ca 0.04 0.25 -0.39 0.00 -2.01 0.00 0.00 57.72 55.61 2q78 n HIS 34 Cb 0.46 -2.56 -0.01 0.00 0.12 0.00 0.00 29.99 27.99 2q78 n HIS 34 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2q78 s LEU 35 N -7.22 4.22 0.24 2.39 1.43 -1.26 -0.49 118.68 117.98 2q78 s LEU 35 Ca 0.27 2.47 -0.30 0.00 -1.03 0.00 0.00 54.13 55.55 2q78 s LEU 35 Cb -0.15 -3.95 -0.09 0.00 0.03 0.00 0.00 46.19 42.03 2q78 s LEU 35 CO 0.91 -0.72 1.25 0.54 0.23 0.00 0.00 176.35 178.57 2q78 s VAL 36 N -1.33 3.22 0.51 -1.59 0.11 0.25 0.98 120.40 122.54 2q78 s VAL 36 Ca 0.56 1.08 -0.19 0.00 -2.93 0.00 0.00 61.98 60.50 2q78 s VAL 36 Cb -0.34 -3.69 -0.08 0.00 -1.53 0.00 0.00 36.38 30.75 2q78 s VAL 36 CO 0.43 0.20 1.03 0.00 -3.33 0.00 0.00 175.10 173.43 2q78 s ALA 37 N -0.38 2.87 0.07 1.54 0.00 -1.26 -4.65 121.76 119.95 2q78 s ALA 37 Ca 0.52 0.51 -0.23 0.00 0.00 0.00 0.00 51.96 52.76 2q78 s ALA 37 Cb -0.36 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.39 2q78 s ALA 37 CO 0.41 -0.37 1.63 1.15 0.00 0.00 0.00 175.76 178.58 2q78 h THR 38 N 1.29 1.12 -0.45 0.00 2.02 -1.97 -2.44 112.91 112.48 2q78 h THR 38 Ca -0.49 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.34 2q78 h THR 38 Cb 1.21 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 68.84 2q78 h THR 38 CO 0.59 0.10 0.23 0.77 0.37 0.00 0.00 175.52 177.58 2q78 h SER 39 N -0.04 0.55 -0.32 4.18 4.64 -1.99 -1.08 113.55 119.49 2q78 h SER 39 Ca 0.02 -0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 2q78 h SER 39 Cb 0.13 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 2q78 h SER 39 CO -0.00 0.46 0.08 0.00 -0.87 0.00 0.00 176.83 176.50 2q78 h ALA 40 N 1.63 0.43 -0.82 5.18 0.00 -1.91 -1.77 119.26 121.98 2q78 h ALA 40 Ca 0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2q78 h ALA 40 Cb 0.05 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2q78 h ALA 40 CO -0.02 0.09 0.39 -0.07 0.00 0.00 0.00 179.25 179.64 2q78 h LEU 41 N 0.36 1.08 -0.35 0.00 3.38 -0.85 -1.17 115.31 117.76 2q78 h LEU 41 Ca 0.10 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2q78 h LEU 41 Cb 0.30 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2q78 h LEU 41 CO 0.00 0.91 0.19 0.40 0.09 0.00 0.00 178.44 180.03 2q78 h ILE 42 N 1.18 1.02 -0.77 1.22 2.04 -1.13 -1.37 117.51 119.69 2q78 h ILE 42 Ca 0.28 -0.13 0.12 0.00 1.00 0.00 0.00 64.86 66.13 2q78 h ILE 42 Cb 0.12 0.59 -0.09 0.00 -0.74 0.00 0.00 36.82 36.70 2q78 h ILE 42 CO -0.04 0.07 0.36 1.23 0.00 0.00 0.00 178.15 179.78 2q78 h GLY 43 N 0.39 1.19 0.96 5.37 0.00 -0.78 0.26 103.07 110.46 2q78 h GLY 43 Ca 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 2q78 h GLY 43 CO -0.08 -0.02 0.16 -2.08 0.00 0.00 0.00 176.54 174.52 2q78 h VAL 44 N 0.56 1.22 -0.17 4.60 2.07 -0.82 -0.37 116.25 123.33 2q78 h VAL 44 Ca 0.41 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2q78 h VAL 44 Cb 0.54 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2q78 h VAL 44 CO -0.34 0.26 0.02 0.58 0.02 0.00 0.00 177.57 178.10 2q78 h VAL 45 N 0.60 1.23 -0.46 2.57 2.07 -0.53 -2.94 116.25 118.79 2q78 h VAL 45 Ca 0.15 -0.76 0.08 0.00 0.82 0.00 0.00 66.70 66.98 2q78 h VAL 45 Cb 0.24 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 2q78 h VAL 45 CO -0.01 0.23 0.09 0.45 0.02 0.00 0.00 177.57 178.35 2q78 h HIS 46 N 0.06 0.14 -0.93 1.57 3.86 -0.40 -2.56 115.15 116.89 2q78 h HIS 46 Ca 0.05 0.03 0.14 0.00 -1.16 0.00 0.00 60.37 59.43 2q78 h HIS 46 Cb 0.33 0.01 -0.09 0.00 1.06 0.00 0.00 27.41 28.72 2q78 h HIS 46 CO 0.02 -0.00 0.55 -0.09 0.86 0.00 0.00 177.93 179.27 2q78 h ARG 47 N 0.22 0.78 -0.39 2.45 2.43 -0.95 -1.90 114.38 117.02 2q78 h ARG 47 Ca 0.23 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.22 2q78 h ARG 47 Cb 0.30 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2q78 h ARG 47 CO -0.30 0.52 -0.27 0.28 -1.51 0.00 0.00 179.97 178.68 2q78 h VAL 48 N 0.80 1.28 -0.36 0.20 2.07 -1.29 -1.64 116.25 117.32 2q78 h VAL 48 Ca 0.49 -1.43 0.05 0.00 0.82 0.00 0.00 66.70 66.63 2q78 h VAL 48 Cb 0.61 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2q78 h VAL 48 CO -0.32 0.48 0.24 0.77 0.02 0.00 0.00 177.57 178.76 2q78 h SER 49 N 0.67 0.25 -0.08 0.57 4.64 -1.11 -1.20 113.55 117.30 2q78 h SER 49 Ca 0.08 -0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.19 2q78 h SER 49 Cb 0.85 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2q78 h SER 49 CO 0.07 0.17 -0.72 0.22 -0.87 0.00 0.00 176.83 175.70 2q78 h TYR 50 N 0.29 0.95 -0.57 4.77 5.03 -0.77 -0.71 116.97 125.96 2q78 h TYR 50 Ca 0.15 -0.40 -0.01 0.00 2.58 0.00 0.00 58.73 61.05 2q78 h TYR 50 Cb 0.25 -0.15 -0.03 0.00 1.55 0.00 0.00 36.73 38.35 2q78 h TYR 50 CO -0.00 1.21 0.33 0.93 -1.32 0.00 0.00 178.16 179.31 2q78 h GLU 51 N 0.50 0.79 0.39 1.82 5.08 -0.69 0.14 114.58 122.61 2q78 h GLU 51 Ca -0.03 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2q78 h GLU 51 Cb 1.33 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 2q78 h GLU 51 CO 0.14 0.59 -0.22 1.25 -1.00 0.00 0.00 179.01 179.78 2q78 h LEU 52 N 0.77 -0.53 -0.65 1.33 5.85 -1.11 -3.10 115.31 117.88 2q78 h LEU 52 Ca 0.20 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2q78 h LEU 52 Cb 0.02 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2q78 h LEU 52 CO -0.03 -0.35 0.35 -0.07 -0.34 0.00 0.00 178.44 178.00 2q78 h LEU 53 N -0.57 0.82 -1.87 2.25 3.38 -0.96 -2.98 115.31 115.38 2q78 h LEU 53 Ca -0.05 -0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2q78 h LEU 53 Cb 0.45 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2q78 h LEU 53 CO 0.07 0.68 0.21 0.77 0.09 0.00 0.00 178.44 180.25 2q78 h SER 54 N 0.89 0.14 0.51 -0.43 4.64 -0.69 0.15 113.55 118.77 2q78 h SER 54 Ca 0.23 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2q78 h SER 54 Cb 0.05 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2q78 h SER 54 CO -0.04 0.10 -0.05 0.03 -0.87 0.00 0.00 176.83 176.00 2q78 h ARG 55 N 0.17 0.00 -0.00 4.77 3.08 -1.45 -3.30 114.38 117.65 2q78 h ARG 55 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2q78 h ARG 55 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2q78 h ARG 55 CO -0.02 0.05 -0.08 0.66 -1.07 0.00 0.00 179.97 179.51 2q78 n TYR 56 N -3.27 0.00 -3.08 3.04 4.01 0.43 -5.04 117.16 113.25 2q78 n TYR 56 Ca -0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.43 2q78 n TYR 56 Cb 0.22 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.21 2q78 n TYR 56 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2q78 s LEU 57 N -1.50 3.95 0.83 7.72 1.43 -0.72 -5.06 118.68 125.32 2q78 s LEU 57 Ca 0.02 1.00 -0.10 0.00 -1.03 0.00 0.00 54.13 54.01 2q78 s LEU 57 Cb 0.02 -3.84 0.09 0.00 0.03 0.00 0.00 46.19 42.49 2q78 s LEU 57 CO 0.08 -0.29 1.11 -2.84 0.23 0.00 0.00 176.35 174.63 2q78 s PRO 58 N -3.60 1.78 0.48 1.29 0.02 -1.26 -4.91 135.00 128.80 2q78 s PRO 58 Ca 0.49 1.26 0.32 0.00 0.02 0.00 0.00 61.00 63.09 2q78 s PRO 58 Cb -0.10 -1.84 1.30 0.00 0.02 0.00 0.00 34.50 33.88 2q78 s PRO 58 CO 0.29 -2.01 1.93 -0.91 -0.33 0.00 0.00 177.00 175.97 2q78 h ASN 59 N -1.40 0.00 -0.39 2.53 2.35 -1.97 -2.21 115.58 114.49 2q78 h ASN 59 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 2q78 h ASN 59 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 2q78 h ASN 59 CO 0.48 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.36 2q78 n ASP 60 N -2.88 2.94 -4.53 5.81 5.75 -1.26 -4.96 116.55 117.43 2q78 n ASP 60 Ca 0.01 -1.93 -0.33 0.00 -0.01 0.00 0.00 54.79 52.53 2q78 n ASP 60 Cb 0.28 -0.26 -0.12 0.00 -1.03 0.00 0.00 41.12 39.99 2q78 n ASP 60 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2q78 s TYR 61 N -1.49 2.80 0.37 2.11 1.51 -0.83 -1.84 117.35 119.99 2q78 s TYR 61 Ca 0.37 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.37 2q78 s TYR 61 Cb 0.21 -1.65 0.02 0.00 -0.11 0.00 0.00 41.96 40.42 2q78 s TYR 61 CO 0.29 0.26 0.16 -2.37 -1.11 0.00 0.00 175.55 172.77 2q78 n THR 62 N 2.20 0.00 -3.72 -0.71 5.66 0.82 -4.79 114.28 113.74 2q78 n THR 62 Ca -0.17 -1.60 -0.13 0.00 -3.05 0.00 0.00 64.05 59.10 2q78 n THR 62 Cb 0.52 0.06 -0.14 0.00 -1.55 0.00 0.00 70.33 69.23 2q78 n THR 62 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2q78 s ALA 63 N -2.58 -0.44 0.13 1.79 0.00 -1.26 -1.33 121.76 118.07 2q78 s ALA 63 Ca 0.12 0.86 0.10 0.00 0.00 0.00 0.00 51.96 53.04 2q78 s ALA 63 Cb -0.01 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2q78 s ALA 63 CO 0.07 -0.29 -0.25 0.14 0.00 0.00 0.00 175.76 175.43 2q78 s VAL 64 N 1.51 2.15 0.01 0.00 -7.23 -0.62 -4.90 120.40 111.33 2q78 s VAL 64 Ca -0.06 -1.75 -0.30 0.00 -1.81 0.00 0.00 61.98 58.05 2q78 s VAL 64 Cb -0.11 -1.93 -0.05 0.00 0.56 0.00 0.00 36.38 34.85 2q78 s VAL 64 CO -0.08 0.03 1.26 -0.69 -0.31 0.00 0.00 175.10 175.31 2q78 s VAL 65 N -1.17 3.98 -0.06 1.32 1.01 -1.26 -0.68 120.40 123.53 2q78 s VAL 65 Ca 0.13 1.37 0.09 0.00 0.00 0.00 0.00 61.98 63.58 2q78 s VAL 65 Cb -0.10 -3.88 -0.14 0.00 0.00 0.00 0.00 36.38 32.27 2q78 s VAL 65 CO 0.06 0.04 0.11 1.33 0.00 0.00 0.00 175.10 176.65 2q78 n VAL 66 N 4.34 0.39 -3.74 2.92 0.24 -0.44 -4.92 118.33 117.12 2q78 n VAL 66 Ca 0.11 -0.34 -0.13 0.00 -2.04 0.00 0.00 64.34 61.94 2q78 n VAL 66 Cb 0.45 -0.34 -0.09 0.00 -1.47 0.00 0.00 33.84 32.39 2q78 n VAL 66 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2q78 s GLU 67 N -2.43 0.58 -0.12 7.34 2.12 -1.20 -5.01 118.70 119.99 2q78 s GLU 67 Ca -0.04 0.20 -0.13 0.00 0.36 0.00 0.00 54.97 55.36 2q78 s GLU 67 Cb 0.04 0.27 0.03 0.00 0.26 0.00 0.00 34.13 34.73 2q78 s GLU 67 CO 0.41 -0.13 0.35 -0.08 -0.54 0.00 0.00 175.26 175.27 2q78 s THR 68 N -0.54 0.01 -0.02 -1.70 -1.32 -1.26 -0.76 115.64 110.04 2q78 s THR 68 Ca -0.07 -0.07 0.02 0.00 -1.21 0.00 0.00 61.69 60.36 2q78 s THR 68 Cb -0.04 -0.52 0.01 0.00 -1.51 0.00 0.00 72.50 70.44 2q78 s THR 68 CO 0.03 -0.04 -0.06 -0.22 -2.21 0.00 0.00 174.62 172.12 2q78 s LEU 69 N -0.04 1.74 -0.12 9.08 2.96 0.53 -4.99 118.68 127.85 2q78 s LEU 69 Ca -0.02 -0.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.65 2q78 s LEU 69 Cb -0.03 -0.39 0.03 0.00 0.50 0.00 0.00 46.19 46.31 2q78 s LEU 69 CO 0.01 0.03 0.34 0.00 -1.32 0.00 0.00 176.35 175.41 2q78 s ALA 70 N 0.26 -0.85 -0.20 5.97 0.00 -1.26 -0.83 121.76 124.85 2q78 s ALA 70 Ca -0.03 0.94 -0.06 0.00 0.00 0.00 0.00 51.96 52.81 2q78 s ALA 70 Cb -0.07 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 2q78 s ALA 70 CO -0.00 -0.17 0.03 1.03 0.00 0.00 0.00 175.76 176.65 2q78 s ARG 71 N 0.12 3.73 -0.47 0.00 0.52 0.16 -5.00 118.95 118.01 2q78 s ARG 71 Ca -0.01 -0.46 -0.08 0.00 -0.52 0.00 0.00 55.73 54.66 2q78 s ARG 71 Cb -0.03 -3.14 0.12 0.00 0.52 0.00 0.00 34.95 32.42 2q78 s ARG 71 CO 0.01 0.08 0.33 -1.58 0.02 0.00 0.00 175.30 174.16 2q78 s HIS 72 N 0.85 3.45 -0.10 -0.53 2.46 -1.26 -1.65 115.29 118.51 2q78 s HIS 72 Ca 0.02 -1.96 0.22 0.00 0.47 0.00 0.00 55.06 53.81 2q78 s HIS 72 Cb -0.14 -3.47 -0.29 0.00 -0.13 0.00 0.00 32.58 28.55 2q78 s HIS 72 CO 0.02 -0.99 0.57 1.33 -2.47 0.00 0.00 174.74 173.20 2q78 n VAL 73 N 4.84 0.07 -3.75 0.89 0.24 -0.39 -4.92 118.33 115.30 2q78 n VAL 73 Ca -0.07 -0.48 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 2q78 n VAL 73 Cb 0.41 0.01 -0.13 0.00 -1.47 0.00 0.00 33.84 32.66 2q78 n VAL 73 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2q78 s LYS 74 N -3.48 0.22 0.34 7.34 2.20 -1.13 -5.03 119.74 120.20 2q78 s LYS 74 Ca -0.06 0.44 -0.27 0.00 -0.36 0.00 0.00 55.97 55.72 2q78 s LYS 74 Cb 0.14 -0.04 -0.09 0.00 -1.51 0.00 0.00 37.83 36.32 2q78 s LYS 74 CO 0.89 -0.12 1.15 0.00 -0.36 0.00 0.00 175.35 176.91 2q78 s ALA 75 N 0.86 3.30 -0.06 3.13 0.00 -1.26 -4.75 121.76 122.98 2q78 s ALA 75 Ca -0.06 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 52.81 2q78 s ALA 75 Cb -0.07 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.71 2q78 s ALA 75 CO -0.05 -0.36 0.14 0.54 0.00 0.00 0.00 175.76 176.03 2q78 s VAL 76 N -1.30 -0.02 0.41 0.00 0.11 -1.26 -5.06 120.40 113.27 2q78 s VAL 76 Ca 0.51 0.08 -0.20 0.00 -2.93 0.00 0.00 61.98 59.44 2q78 s VAL 76 Cb -0.31 -0.21 -0.11 0.00 -1.53 0.00 0.00 36.38 34.22 2q78 s VAL 76 CO 0.40 0.03 0.91 -2.16 -3.33 0.00 0.00 175.10 170.96 2q78 s PRO 77 N 0.54 4.19 1.09 1.54 0.04 -1.26 -0.58 135.00 140.55 2q78 s PRO 77 Ca -0.04 1.04 -0.12 0.00 0.04 0.00 0.00 61.00 61.92 2q78 s PRO 77 Cb -0.05 -2.22 0.24 0.00 0.04 0.00 0.00 34.50 32.51 2q78 s PRO 77 CO -0.02 -0.00 1.06 0.95 0.04 0.00 0.00 177.00 179.02 2q78 s THR 78 N -2.16 2.08 0.00 1.26 -4.23 0.35 -3.82 115.64 109.12 2q78 s THR 78 Ca 0.61 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 61.14 2q78 s THR 78 Cb -0.09 -2.12 0.00 0.00 1.34 0.00 0.00 72.50 71.62 2q78 s THR 78 CO 0.14 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 2q78 n GLY 79 N 0.46 0.45 3.34 3.99 0.00 0.96 -5.00 105.19 109.38 2q78 n GLY 79 Ca 0.05 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 2q78 n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q78 s THR 80 N -2.00 2.01 -0.11 2.61 2.01 -1.25 -4.96 115.64 113.95 2q78 s THR 80 Ca 0.00 -1.63 -0.06 0.00 0.31 0.00 0.00 61.69 60.31 2q78 s THR 80 Cb 0.00 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 2q78 s THR 80 CO 0.00 0.05 0.10 -0.13 -0.69 0.00 0.00 174.62 173.95 2q78 s ARG 81 N -1.92 3.33 0.11 4.92 0.52 -1.26 -0.52 118.95 124.12 2q78 s ARG 81 Ca 0.11 -0.20 0.08 0.00 -0.52 0.00 0.00 55.73 55.19 2q78 s ARG 81 Cb -0.10 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 2q78 s ARG 81 CO 0.05 0.76 -0.20 0.14 0.02 0.00 0.00 175.30 176.07 2q78 s VAL 82 N -0.98 1.64 -0.21 3.52 -7.23 0.56 -4.77 120.40 112.92 2q78 s VAL 82 Ca 0.15 -1.56 -0.21 0.00 -1.81 0.00 0.00 61.98 58.54 2q78 s VAL 82 Cb -0.12 -1.53 -0.02 0.00 0.56 0.00 0.00 36.38 35.27 2q78 s VAL 82 CO 0.04 -0.12 0.64 0.00 -0.31 0.00 0.00 175.10 175.34 2q78 s ALA 83 N -1.31 3.56 -0.23 1.32 0.00 -1.26 -0.38 121.76 123.46 2q78 s ALA 83 Ca 0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 2q78 s ALA 83 Cb -0.09 -3.00 0.02 0.00 0.00 0.00 0.00 23.12 20.05 2q78 s ALA 83 CO 0.04 -0.61 -0.09 0.08 0.00 0.00 0.00 175.76 175.18 2q78 s VAL 84 N 2.05 2.79 -0.07 0.00 1.01 0.52 -4.18 120.40 122.51 2q78 s VAL 84 Ca 0.29 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.39 2q78 s VAL 84 Cb -0.16 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 2q78 s VAL 84 CO 0.10 0.31 -0.18 -0.83 0.00 0.00 0.00 175.10 174.49 2q78 s GLY 85 N 1.34 1.44 0.11 4.51 0.00 -0.43 0.11 107.32 114.40 2q78 s GLY 85 Ca 0.02 -0.99 0.06 0.00 0.00 0.00 0.00 44.72 43.81 2q78 s GLY 85 CO -0.06 -0.60 -0.16 -1.34 0.00 0.00 0.00 173.10 170.94 2q78 s VAL 86 N -0.28 1.38 -0.07 1.40 -7.23 -0.07 -0.53 120.40 115.00 2q78 s VAL 86 Ca 0.01 -1.61 -0.06 0.00 -1.81 0.00 0.00 61.98 58.51 2q78 s VAL 86 Cb -0.13 -1.45 0.03 0.00 0.56 0.00 0.00 36.38 35.38 2q78 s VAL 86 CO 0.03 -0.31 0.19 -0.60 -0.31 0.00 0.00 175.10 174.10 2q78 s ARG 87 N -2.34 0.19 -0.25 4.82 3.52 -0.26 -1.48 118.95 123.16 2q78 s ARG 87 Ca 0.06 0.32 -0.29 0.00 -0.13 0.00 0.00 55.73 55.70 2q78 s ARG 87 Cb -0.07 0.02 0.01 0.00 -1.56 0.00 0.00 34.95 33.35 2q78 s ARG 87 CO 0.03 -0.07 1.04 0.08 -0.81 0.00 0.00 175.30 175.58 2q78 s VAL 88 N 0.46 4.64 -1.11 7.11 1.01 -0.05 -1.00 120.40 131.46 2q78 s VAL 88 Ca -0.03 1.95 0.14 0.00 0.00 0.00 0.00 61.98 64.04 2q78 s VAL 88 Cb -0.04 -4.33 -0.05 0.00 0.00 0.00 0.00 36.38 31.96 2q78 s VAL 88 CO -0.02 -0.25 0.73 1.33 0.00 0.00 0.00 175.10 176.89 2q78 n VAL 89 N 5.45 0.00 -3.65 2.92 0.24 -0.21 -1.10 118.33 121.98 2q78 n VAL 89 Ca 0.12 -0.30 -0.03 0.00 -2.04 0.00 0.00 64.34 62.09 2q78 n VAL 89 Cb 0.46 1.12 -0.07 0.00 -1.47 0.00 0.00 33.84 33.88 2q78 n VAL 89 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2q78 s GLY 90 N -1.90 0.30 -0.07 7.63 0.00 -1.18 -4.93 107.32 107.16 2q78 s GLY 90 Ca 0.10 3.39 0.01 0.00 0.00 0.00 0.00 44.72 48.22 2q78 s GLY 90 CO 0.42 1.83 -0.06 0.14 0.00 0.00 0.00 173.10 175.43 2q78 s VAL 91 N -0.10 0.74 -0.25 1.40 1.01 -1.26 -0.38 120.40 121.56 2q78 s VAL 91 Ca 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 2q78 s VAL 91 Cb -0.04 -0.75 0.08 0.00 0.00 0.00 0.00 36.38 35.66 2q78 s VAL 91 CO -0.14 0.29 0.05 -0.69 0.00 0.00 0.00 175.10 174.61 2q78 s VAL 92 N 1.16 0.76 0.00 2.92 1.01 -0.26 -4.94 120.40 121.04 2q78 s VAL 92 Ca -0.07 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 60.93 2q78 s VAL 92 Cb -0.14 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.86 2q78 s VAL 92 CO -0.01 -0.40 0.00 0.61 0.00 0.00 0.00 175.10 175.29 2q78 n GLY 93 N 4.93 3.09 0.70 4.51 0.00 -1.26 -1.92 105.19 115.25 2q78 n GLY 93 Ca -0.06 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.82 2q78 n GLY 93 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2q78 n ASN 94 N 5.75 2.02 -4.60 1.61 6.94 -1.26 -4.52 115.26 121.20 2q78 n ASN 94 Ca 0.00 -2.04 -0.38 0.00 -0.02 0.00 0.00 54.58 52.14 2q78 n ASN 94 Cb 0.00 -0.27 -0.11 0.00 -2.36 0.00 0.00 39.78 37.04 2q78 n ASN 94 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2q78 s ARG 95 N -1.56 3.97 -0.23 -3.83 1.81 -0.81 0.10 118.95 118.41 2q78 s ARG 95 Ca 0.24 -0.24 0.01 0.00 -1.72 0.00 0.00 55.73 54.01 2q78 s ARG 95 Cb 0.13 -3.65 0.04 0.00 -0.45 0.00 0.00 34.95 31.02 2q78 s ARG 95 CO 0.15 -0.18 -0.12 0.08 -0.68 0.00 0.00 175.30 174.55 2q78 s VAL 96 N 1.78 2.38 -0.12 3.52 1.01 0.32 -1.11 120.40 128.17 2q78 s VAL 96 Ca 0.09 -1.23 -0.15 0.00 0.00 0.00 0.00 61.98 60.68 2q78 s VAL 96 Cb -0.16 -2.22 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 2q78 s VAL 96 CO 0.10 0.21 0.38 -0.75 0.00 0.00 0.00 175.10 175.04 2q78 s LYS 97 N 1.23 4.21 0.14 2.72 2.20 0.49 -0.85 119.74 129.89 2q78 s LYS 97 Ca -0.02 0.28 0.10 0.00 -0.36 0.00 0.00 55.97 55.96 2q78 s LYS 97 Cb -0.17 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 2q78 s LYS 97 CO -0.07 0.30 -0.18 -0.06 -0.36 0.00 0.00 175.35 174.98 2q78 s PHE 98 N 0.23 2.50 -0.03 4.03 0.40 0.86 -1.05 117.98 124.92 2q78 s PHE 98 Ca 0.21 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 56.28 2q78 s PHE 98 Cb -0.14 -1.29 -0.03 0.00 0.51 0.00 0.00 43.02 42.06 2q78 s PHE 98 CO 0.08 0.43 -0.05 1.03 0.70 0.00 0.00 175.22 177.40 2q78 s ARG 99 N -2.38 2.68 0.06 0.44 0.52 -0.17 -1.61 118.95 118.49 2q78 s ARG 99 Ca 0.20 -0.62 0.04 0.00 -0.52 0.00 0.00 55.73 54.83 2q78 s ARG 99 Cb -0.10 -2.57 -0.03 0.00 0.52 0.00 0.00 34.95 32.77 2q78 s ARG 99 CO 0.11 0.64 -0.13 0.20 0.02 0.00 0.00 175.30 176.14 2q78 s GLY 100 N -1.17 0.77 -0.02 -3.53 0.00 -0.44 -1.10 107.32 101.83 2q78 s GLY 100 Ca 0.15 -0.92 -0.02 0.00 0.00 0.00 0.00 44.72 43.94 2q78 s GLY 100 CO 0.05 -0.94 0.06 -1.50 0.00 0.00 0.00 173.10 170.77 2q78 s ILE 101 N -1.22 0.00 0.43 0.90 2.07 0.31 -0.99 121.20 122.70 2q78 s ILE 101 Ca -0.03 -0.01 0.07 0.00 -1.41 0.00 0.00 60.65 59.26 2q78 s ILE 101 Cb -0.10 -0.10 -0.04 0.00 0.13 0.00 0.00 42.46 42.36 2q78 s ILE 101 CO 0.02 -0.01 0.20 -0.69 -1.91 0.00 0.00 174.94 172.55 2q78 s VAL 102 N 0.01 2.16 -0.33 4.00 1.01 0.08 -1.31 120.40 126.02 2q78 s VAL 102 Ca -0.00 -1.68 0.02 0.00 0.00 0.00 0.00 61.98 60.32 2q78 s VAL 102 Cb -0.01 -2.85 0.19 0.00 0.00 0.00 0.00 36.38 33.72 2q78 s VAL 102 CO 0.00 0.00 0.73 -0.55 0.00 0.00 0.00 175.10 175.28 2q78 s SER 104 N -3.95 -1.26 1.49 3.32 0.15 0.32 -0.77 113.70 113.01 2q78 s SER 104 Ca 0.38 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2q78 s SER 104 Cb 0.03 1.70 0.00 0.00 -1.71 0.00 0.00 66.02 66.04 2q78 s SER 104 CO 0.21 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.07 2q78 n GLY 105 N 4.83 3.14 1.21 9.45 0.00 -1.26 -2.37 105.19 120.18 2q78 n GLY 105 Ca 0.08 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.01 2q78 n GLY 105 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q78 n ASP 106 N 8.63 3.73 -4.64 1.61 8.00 -1.26 -4.93 116.55 127.69 2q78 n ASP 106 Ca 0.00 -2.00 -0.36 0.00 0.71 0.00 0.00 54.79 53.15 2q78 n ASP 106 Cb 0.00 -0.43 -0.10 0.00 -0.02 0.00 0.00 41.12 40.58 2q78 n ASP 106 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2q78 s GLU 107 N -1.03 4.02 0.08 -1.24 0.41 -1.00 -5.07 118.70 114.87 2q78 s GLU 107 Ca 0.44 -0.30 -0.31 0.00 -0.41 0.00 0.00 54.97 54.38 2q78 s GLU 107 Cb 0.23 -3.39 -0.07 0.00 -1.78 0.00 0.00 34.13 29.13 2q78 s GLU 107 CO 0.30 0.16 1.33 0.21 -0.49 0.00 0.00 175.26 176.76 2q78 s LYS 108 N 0.74 4.35 -0.27 1.61 2.20 -1.26 -0.52 119.74 126.59 2q78 s LYS 108 Ca 0.06 1.95 -0.12 0.00 -0.36 0.00 0.00 55.97 57.50 2q78 s LYS 108 Cb -0.13 -3.33 -0.12 0.00 -1.51 0.00 0.00 37.83 32.74 2q78 s LYS 108 CO 0.02 -0.40 -0.34 -0.89 -0.36 0.00 0.00 175.35 173.38 2q78 n ILE 109 N 4.06 1.49 -3.77 5.43 2.08 0.05 -4.32 119.36 124.37 2q78 n ILE 109 Ca 0.11 -0.40 -0.13 0.00 0.56 0.00 0.00 62.75 62.89 2q78 n ILE 109 Cb 0.44 -1.82 -0.11 0.00 -0.75 0.00 0.00 39.64 37.40 2q78 n ILE 109 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 2q78 s LEU 110 N -7.36 0.90 0.06 1.39 0.20 -1.12 -1.27 118.68 111.49 2q78 s LEU 110 Ca -0.38 0.56 0.09 0.00 0.69 0.00 0.00 54.13 55.10 2q78 s LEU 110 Cb 0.14 1.00 -0.03 0.00 -0.43 0.00 0.00 46.19 46.87 2q78 s LEU 110 CO 0.49 -0.11 -0.26 -1.83 -0.29 0.00 0.00 176.35 174.35 2q78 s GLU 111 N 0.10 1.66 0.07 1.98 -1.05 -0.66 -0.74 118.70 120.06 2q78 s GLU 111 Ca -0.00 -1.14 0.00 0.00 -0.15 0.00 0.00 54.97 53.67 2q78 s GLU 111 Cb -0.02 -1.90 -0.04 0.00 -0.44 0.00 0.00 34.13 31.73 2q78 s GLU 111 CO 0.01 0.48 -0.05 0.00 0.95 0.00 0.00 175.26 176.65 2q78 s ALA 112 N -0.86 0.68 -0.07 -0.84 0.00 -0.17 -0.67 121.76 119.83 2q78 s ALA 112 Ca 0.12 -1.21 -0.03 0.00 0.00 0.00 0.00 51.96 50.84 2q78 s ALA 112 Cb -0.10 0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.27 2q78 s ALA 112 CO 0.03 -0.29 0.16 -2.00 0.00 0.00 0.00 175.76 173.66 2q78 s GLU 113 N -3.63 0.09 0.19 0.00 2.12 -0.01 -1.32 118.70 116.14 2q78 s GLU 113 Ca 0.07 0.41 -0.18 0.00 0.36 0.00 0.00 54.97 55.63 2q78 s GLU 113 Cb 0.05 -0.19 0.03 0.00 0.26 0.00 0.00 34.13 34.28 2q78 s GLU 113 CO -0.07 -0.19 0.54 -0.59 -0.54 0.00 0.00 175.26 174.42 2q78 s PHE 114 N 1.35 -0.19 -0.09 5.30 -0.71 -0.64 -0.34 117.98 122.66 2q78 s PHE 114 Ca -0.07 -0.14 0.02 0.00 -1.04 0.00 0.00 56.93 55.69 2q78 s PHE 114 Cb -0.12 0.43 0.01 0.00 -1.21 0.00 0.00 43.02 42.14 2q78 s PHE 114 CO -0.06 -0.92 -0.14 0.08 -1.34 0.00 0.00 175.22 172.83 2q78 s VAL 115 N -3.86 1.38 -0.06 -2.49 1.01 0.06 -0.10 120.40 116.34 2q78 s VAL 115 Ca 0.08 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 2q78 s VAL 115 Cb -0.01 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2q78 s VAL 115 CO -0.04 0.41 0.10 -0.13 0.00 0.00 0.00 175.10 175.44 2q78 s ARG 116 N 0.83 3.22 -0.21 2.72 0.52 -0.03 -1.32 118.95 124.67 2q78 s ARG 116 Ca -0.10 -0.33 -0.10 0.00 -0.52 0.00 0.00 55.73 54.68 2q78 s ARG 116 Cb -0.15 -2.98 -0.05 0.00 0.52 0.00 0.00 34.95 32.29 2q78 s ARG 116 CO 0.01 0.71 0.13 0.00 0.02 0.00 0.00 175.30 176.17 2q78 s ALA 117 N -1.09 3.59 -0.23 2.13 0.00 0.14 -0.53 121.76 125.78 2q78 s ALA 117 Ca 0.19 -0.79 -0.22 0.00 0.00 0.00 0.00 51.96 51.14 2q78 s ALA 117 Cb -0.12 -2.19 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 2q78 s ALA 117 CO 0.09 -0.00 0.68 0.42 0.00 0.00 0.00 175.76 176.95 2q78 s ILE 118 N 0.69 4.96 0.01 0.00 1.01 0.12 -1.59 121.20 126.39 2q78 s ILE 118 Ca 0.07 1.26 0.00 0.00 0.00 0.00 0.00 60.65 61.99 2q78 s ILE 118 Cb -0.12 -3.99 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 2q78 s ILE 118 CO 0.01 0.03 -0.02 0.68 0.00 0.00 0.00 174.94 175.64 2q78 s VAL 119 N 2.40 0.12 0.29 2.92 -7.23 -0.45 -4.84 120.40 113.61 2q78 s VAL 119 Ca 0.29 -0.39 -0.30 0.00 -1.81 0.00 0.00 61.98 59.77 2q78 s VAL 119 Cb -0.16 -0.17 -0.12 0.00 0.56 0.00 0.00 36.38 36.49 2q78 s VAL 119 CO 0.09 -0.17 1.53 -2.65 -0.31 0.00 0.00 175.10 173.59 2q78 n PRO 120 N 2.48 2.53 -0.32 4.82 -0.02 -1.26 -0.12 135.00 143.11 2q78 n PRO 120 Ca -0.17 0.90 0.14 0.00 -2.02 0.00 0.00 63.50 62.35 2q78 n PRO 120 Cb 0.58 -2.64 0.37 0.00 -0.02 0.00 0.00 33.50 31.79 2q78 n PRO 120 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q78 h ARG 121 N 4.43 0.67 -0.73 -0.52 3.08 -1.68 -1.67 114.38 117.95 2q78 h ARG 121 Ca -0.47 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.51 2q78 h ARG 121 Cb 1.24 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 2q78 h ARG 121 CO 0.77 0.44 0.31 1.05 -1.07 0.00 0.00 179.97 181.47 2q78 h GLU 122 N 0.69 1.06 0.11 0.04 4.11 -1.90 0.13 114.58 118.81 2q78 h GLU 122 Ca 0.53 -0.17 0.01 0.00 0.07 0.00 0.00 59.36 59.80 2q78 h GLU 122 Cb 0.92 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2q78 h GLU 122 CO -0.30 0.84 -0.14 -0.22 0.07 0.00 0.00 179.01 179.27 2q78 h LYS 123 N 1.04 -0.28 -0.15 1.06 1.63 -1.68 0.65 116.57 118.84 2q78 h LYS 123 Ca 0.25 0.02 0.01 0.00 -0.85 0.00 0.00 60.65 60.07 2q78 h LYS 123 Cb 0.16 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.84 2q78 h LYS 123 CO -0.03 -0.18 0.09 1.25 -3.45 0.00 0.00 179.45 177.13 2q78 h LEU 124 N -0.29 0.14 -1.11 5.20 5.85 -1.28 0.15 115.31 123.98 2q78 h LEU 124 Ca 0.01 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2q78 h LEU 124 Cb 0.28 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 2q78 h LEU 124 CO -0.05 0.11 0.60 -0.09 -0.34 0.00 0.00 178.44 178.66 2q78 h ARG 125 N 0.18 1.19 0.14 1.25 2.43 -0.48 0.12 114.38 119.22 2q78 h ARG 125 Ca 0.06 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2q78 h ARG 125 Cb -0.00 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.28 2q78 h ARG 125 CO -0.03 0.79 -0.07 0.00 -1.51 0.00 0.00 179.97 179.15 2q78 h ARG 126 N 1.22 -0.18 0.16 0.20 3.08 0.85 -2.64 114.38 117.06 2q78 h ARG 126 Ca 0.33 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.41 2q78 h ARG 126 Cb -0.13 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 2q78 h ARG 126 CO -0.07 0.06 -0.23 -0.07 -1.07 0.00 0.00 179.97 178.59 2q78 h LEU 127 N -0.41 -0.63 -0.19 3.04 3.38 -0.20 -3.00 115.31 117.30 2q78 h LEU 127 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2q78 h LEU 127 Cb 0.32 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2q78 h LEU 127 CO 0.03 -0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.24 2q78 n ALA 128 N -2.53 2.02 -2.05 1.53 0.00 0.38 -2.64 120.51 117.23 2q78 n ALA 128 Ca -0.07 -0.01 -0.31 0.00 0.00 0.00 0.00 53.44 53.05 2q78 n ALA 128 Cb 0.26 -1.41 0.03 0.00 0.00 0.00 0.00 19.45 18.33 2q78 n ALA 128 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2q78 n LEU 129 N -1.97 5.94 0.00 0.00 4.77 -0.99 -5.08 117.00 119.67 2q78 n LEU 129 Ca 0.05 -4.87 0.00 0.00 -0.03 0.00 0.00 56.01 51.16 2q78 n LEU 129 Cb 0.31 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 2q78 n LEU 129 CO 0.24 1.97 0.25 -0.62 -1.33 0.00 0.00 177.39 177.89