#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e9j n PRO 2 N 0.00 0.00 0.00 0.00 -0.02 -1.26 -4.86 135.00 128.86 1e9j n PRO 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1e9j n PRO 2 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1e9j n PRO 2 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1e9j n ASP 3 N 1.65 0.00 0.00 2.55 2.03 -1.26 -4.98 116.55 116.54 1e9j n ASP 3 Ca 0.19 0.83 0.00 0.00 0.52 0.00 0.00 54.79 56.33 1e9j n ASP 3 Cb 0.14 -0.33 0.00 0.00 -0.72 0.00 0.00 41.12 40.21 1e9j n ASP 3 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1e9j n VAL 4 N -2.30 -0.33 0.00 5.18 0.31 -1.26 -5.12 118.33 114.81 1e9j n VAL 4 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1e9j n VAL 4 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1e9j n VAL 4 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1e9j n GLN 5 N 0.24 0.00 -1.51 5.55 10.64 -1.26 -5.09 117.38 125.94 1e9j n GLN 5 Ca 0.00 0.00 -0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1e9j n GLN 5 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 1e9j n GLN 5 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1e9j n ASP 6 N 0.00 -2.04 -1.93 2.61 2.03 -1.26 -4.91 116.55 111.05 1e9j n ASP 6 Ca 0.00 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1e9j n ASP 6 Cb 0.00 -1.03 0.00 0.00 -0.72 0.00 0.00 41.12 39.37 1e9j n ASP 6 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1e9j n PRO 8 N 1.81 2.30 -0.18 0.00 -0.04 -1.26 -4.87 135.00 132.76 1e9j n PRO 8 Ca 0.00 -2.22 0.00 0.00 -0.04 0.00 0.00 63.50 61.24 1e9j n PRO 8 Cb 0.00 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 1e9j n PRO 8 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1e9j n GLU 9 N 0.77 -0.50 -1.97 0.54 0.00 -1.26 -4.82 120.64 113.40 1e9j n GLU 9 Ca 0.46 0.38 -0.42 0.00 0.00 0.00 0.00 57.16 57.58 1e9j n GLU 9 Cb 0.56 -0.45 -0.03 0.00 0.00 0.00 0.00 31.44 31.52 1e9j n GLU 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1e9j n THR 11 N 4.80 0.00 -4.77 0.00 5.66 -0.49 -4.92 114.28 114.56 1e9j n THR 11 Ca 0.16 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.90 1e9j n THR 11 Cb 0.41 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.04 1e9j n THR 11 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1e9j s LEU 12 N 0.00 2.10 -0.88 1.09 1.02 -1.26 0.28 118.68 121.03 1e9j s LEU 12 Ca 0.00 -0.42 0.01 0.00 0.02 0.00 0.00 54.13 53.73 1e9j s LEU 12 Cb 0.00 -0.95 0.32 0.00 0.02 0.00 0.00 46.19 45.57 1e9j s LEU 12 CO 0.00 0.19 1.44 0.00 0.02 0.00 0.00 176.35 178.00 1e9j n GLN 13 N 2.25 4.45 0.00 1.70 10.64 -1.25 -4.41 117.38 130.76 1e9j n GLN 13 Ca -0.16 -4.71 0.00 0.00 -1.83 0.00 0.00 57.00 50.30 1e9j n GLN 13 Cb 0.53 -2.39 0.00 0.00 -0.86 0.00 0.00 30.24 27.52 1e9j n GLN 13 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1e9j n GLU 14 N 0.16 0.00 -1.71 2.61 2.13 -1.25 -4.28 120.64 118.30 1e9j n GLU 14 Ca 0.38 0.00 -0.56 0.00 0.66 0.00 0.00 57.16 57.64 1e9j n GLU 14 Cb 0.32 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.96 1e9j n GLU 14 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1e9j n ASN 15 N 0.00 2.55 -0.43 4.31 2.85 0.11 -4.72 115.26 119.92 1e9j n ASN 15 Ca 0.00 1.06 0.00 0.00 -0.11 0.00 0.00 54.58 55.53 1e9j n ASN 15 Cb 0.00 -1.17 0.01 0.00 1.24 0.00 0.00 39.78 39.85 1e9j n ASN 15 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1e9j n PRO 16 N 5.57 1.05 0.05 1.20 -0.04 -1.26 -1.47 135.00 140.09 1e9j n PRO 16 Ca 0.26 -0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 1e9j n PRO 16 Cb 0.15 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1e9j n PRO 16 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1e9j n PHE 17 N -0.07 -0.48 0.18 0.54 7.35 -1.26 -4.79 117.46 118.93 1e9j n PHE 17 Ca 0.00 0.08 0.06 0.00 -0.76 0.00 0.00 57.45 56.84 1e9j n PHE 17 Cb 0.22 0.18 0.26 0.00 0.35 0.00 0.00 39.48 40.49 1e9j n PHE 17 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 1e9j h PHE 18 N 0.00 0.00 -0.68 -5.13 3.04 -1.87 -3.44 116.94 108.86 1e9j h PHE 18 Ca 0.00 0.00 -0.57 0.00 3.98 0.00 0.00 57.97 61.38 1e9j h PHE 18 Cb 0.30 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 38.77 1e9j h PHE 18 CO 0.00 0.38 1.59 -1.13 -2.02 0.00 0.00 178.31 177.13 1e9j n SER 19 N -3.39 1.32 -4.03 0.41 3.41 -0.54 -4.43 113.62 106.36 1e9j n SER 19 Ca 0.01 0.13 -0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1e9j n SER 19 Cb 0.57 -1.17 -0.08 0.00 -0.26 0.00 0.00 64.21 63.26 1e9j n SER 19 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1e9j s GLN 20 N 7.76 0.98 0.00 4.33 -0.21 0.58 -4.91 119.66 128.19 1e9j s GLN 20 Ca 1.18 -1.26 -0.09 0.00 0.02 0.00 0.00 55.36 55.21 1e9j s GLN 20 Cb -0.92 0.31 -0.12 0.00 1.00 0.00 0.00 33.01 33.28 1e9j s GLN 20 CO 0.45 -0.31 1.09 -2.30 -2.12 0.00 0.00 175.29 172.10 1e9j n PRO 21 N -0.12 0.00 0.00 2.91 -0.02 -1.26 0.15 135.00 136.66 1e9j n PRO 21 Ca -0.08 -0.60 0.00 0.00 -2.02 0.00 0.00 63.50 60.80 1e9j n PRO 21 Cb 0.63 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1e9j n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1e9j n GLY 22 N 4.18 0.32 2.70 -1.23 0.00 -1.26 -5.09 105.19 104.81 1e9j n GLY 22 Ca 0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 1e9j n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9j s ALA 23 N 0.00 -0.19 -0.81 4.61 0.00 0.12 -5.03 121.76 120.46 1e9j s ALA 23 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1e9j s ALA 23 Cb 0.00 -1.70 0.35 0.00 0.00 0.00 0.00 23.12 21.77 1e9j s ALA 23 CO 0.00 -1.70 1.65 -0.35 0.00 0.00 0.00 175.76 175.36 1e9j n PRO 24 N 5.29 3.90 -0.33 0.00 -0.04 -1.26 0.21 135.00 142.78 1e9j n PRO 24 Ca -0.03 -4.29 0.00 0.00 -0.04 0.00 0.00 63.50 59.14 1e9j n PRO 24 Cb 0.45 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 1e9j n PRO 24 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1e9j n ILE 25 N -0.31 0.00 -2.13 0.52 2.08 -1.26 -4.36 119.36 113.90 1e9j n ILE 25 Ca 0.46 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.77 1e9j n ILE 25 Cb 0.33 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.22 1e9j n ILE 25 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1e9j n LEU 26 N 0.00 0.00 0.00 1.39 4.77 -1.26 0.04 117.00 121.94 1e9j n LEU 26 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1e9j n LEU 26 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1e9j n LEU 26 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 177.73 1e9j n GLN 27 N 0.00 0.00 0.00 3.23 7.27 -1.26 -3.88 117.38 122.74 1e9j n GLN 27 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1e9j n GLN 27 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1e9j n GLN 27 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1e9j s MET 29 N 0.00 2.24 0.00 0.00 1.75 0.81 -4.58 119.30 119.52 1e9j s MET 29 Ca 0.00 -1.63 0.00 0.00 -1.25 0.00 0.00 55.69 52.81 1e9j s MET 29 Cb 0.00 -3.57 0.00 0.00 2.84 0.00 0.00 34.83 34.10 1e9j s MET 29 CO 0.00 -0.97 0.00 0.41 -0.65 0.00 0.00 175.02 173.81 1e9j n GLY 30 N 4.69 0.93 0.00 2.11 0.00 -1.22 -1.39 105.19 110.31 1e9j n GLY 30 Ca -0.06 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1e9j n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9j n PHE 33 N -0.19 0.00 -2.67 0.00 1.16 -1.26 -4.81 117.46 109.69 1e9j n PHE 33 Ca 0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.15 1e9j n PHE 33 Cb 0.00 0.18 0.00 0.00 -1.61 0.00 0.00 39.48 38.06 1e9j n PHE 33 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1e9j n SER 34 N 0.00 5.08 -3.12 5.98 2.88 -1.26 -4.72 113.62 118.46 1e9j n SER 34 Ca 0.00 -3.00 -0.18 0.00 -1.33 0.00 0.00 58.87 54.36 1e9j n SER 34 Cb 0.24 -1.57 -0.02 0.00 -0.75 0.00 0.00 64.21 62.10 1e9j n SER 34 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1e9j n ARG 35 N 5.54 1.13 -2.98 -1.46 3.00 -1.26 -4.98 116.66 115.65 1e9j n ARG 35 Ca 0.40 -3.46 -0.08 0.00 -0.00 0.00 0.00 57.85 54.72 1e9j n ARG 35 Cb 0.41 -1.70 -0.02 0.00 0.00 0.00 0.00 32.46 31.16 1e9j n ARG 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1e9j s ALA 36 N -2.57 -1.50 -0.04 5.13 0.00 -1.26 -5.02 121.76 116.51 1e9j s ALA 36 Ca 0.39 -0.66 -0.23 0.00 0.00 0.00 0.00 51.96 51.47 1e9j s ALA 36 Cb 0.36 -2.50 -0.25 0.00 0.00 0.00 0.00 23.12 20.73 1e9j s ALA 36 CO -0.07 -2.19 1.01 -0.92 0.00 0.00 0.00 175.76 173.59 1e9j h TYR 37 N 5.60 0.41 -3.13 0.00 3.20 -2.01 -3.46 116.97 117.58 1e9j h TYR 37 Ca 0.09 -0.24 -0.58 0.00 3.14 0.00 0.00 58.73 61.14 1e9j h TYR 37 Cb 1.09 -0.04 0.12 0.00 1.54 0.00 0.00 36.73 39.44 1e9j h TYR 37 CO 0.15 1.08 0.30 -2.30 -1.64 0.00 0.00 178.16 175.75 1e9j n PRO 38 N -4.35 1.64 -1.68 1.82 -0.02 -1.26 -5.00 135.00 126.16 1e9j n PRO 38 Ca -0.11 0.58 -0.30 0.00 -2.02 0.00 0.00 63.50 61.66 1e9j n PRO 38 Cb 0.62 -2.15 0.21 0.00 -0.02 0.00 0.00 33.50 32.16 1e9j n PRO 38 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1e9j s THR 39 N -1.19 1.86 0.00 3.45 -4.23 -1.26 -4.86 115.64 109.41 1e9j s THR 39 Ca 0.60 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 1e9j s THR 39 Cb -0.57 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.42 1e9j s THR 39 CO 0.59 0.00 1.48 -0.81 -0.54 0.00 0.00 174.62 175.34 1e9j n PRO 40 N -4.13 0.83 0.00 3.99 -0.04 -1.26 -2.72 135.00 131.66 1e9j n PRO 40 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1e9j n PRO 40 Cb 0.59 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1e9j n PRO 40 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1e9j n LEU 41 N 1.38 0.09 0.06 1.53 -0.00 -1.26 -4.92 117.00 113.87 1e9j n LEU 41 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 56.01 55.92 1e9j n LEU 41 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.83 1e9j n LEU 41 CO 0.00 0.02 -0.03 -1.14 -0.00 0.00 0.00 177.39 176.25 1e9j n ARG 42 N -0.01 0.00 -2.62 1.96 0.63 -1.10 -5.04 116.66 110.48 1e9j n ARG 42 Ca 0.00 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.51 1e9j n ARG 42 Cb 0.36 -0.46 -0.03 0.00 0.45 0.00 0.00 32.46 32.78 1e9j n ARG 42 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1e9j s SER 43 N -5.86 7.29 0.00 6.15 0.15 -1.25 -4.92 113.70 115.25 1e9j s SER 43 Ca 0.00 1.79 0.00 0.00 0.70 0.00 0.00 55.95 58.44 1e9j s SER 43 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1e9j s SER 43 CO 0.00 -0.31 0.00 0.29 1.20 0.00 0.00 173.24 174.42 1e9j n LYS 44 N 3.81 0.00 -1.83 5.44 5.02 -1.26 -4.91 118.16 124.43 1e9j n LYS 44 Ca 0.07 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.31 1e9j n LYS 44 Cb 0.49 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.54 1e9j n LYS 44 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1e9j n LYS 45 N -2.03 0.68 -0.42 1.97 3.00 -1.26 -5.15 118.16 114.96 1e9j n LYS 45 Ca 0.00 -1.05 0.05 0.00 -0.00 0.00 0.00 58.31 57.31 1e9j n LYS 45 Cb 0.00 0.45 -0.03 0.00 0.00 0.00 0.00 35.03 35.46 1e9j n LYS 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1e9j n THR 46 N -0.78 -0.20 -3.92 3.15 -1.04 -1.26 -5.09 114.28 105.15 1e9j n THR 46 Ca -0.22 0.24 -0.10 0.00 -2.04 0.00 0.00 64.05 61.94 1e9j n THR 46 Cb 0.77 -0.38 -0.02 0.00 -1.82 0.00 0.00 70.33 68.88 1e9j n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1e9j s MET 47 N -3.08 1.89 2.30 -2.82 0.23 -1.26 -5.14 119.30 111.42 1e9j s MET 47 Ca 0.00 -1.34 0.00 0.00 -1.03 0.00 0.00 55.69 53.32 1e9j s MET 47 Cb 0.00 0.55 0.00 0.00 -1.53 0.00 0.00 34.83 33.85 1e9j s MET 47 CO 0.00 -0.84 0.00 -0.11 -2.03 0.00 0.00 175.02 172.04 1e9j n LEU 48 N -0.48 0.00 -0.34 0.18 7.94 -1.26 -4.31 117.00 118.73 1e9j n LEU 48 Ca -0.04 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 54.94 1e9j n LEU 48 Cb 0.60 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.55 1e9j n LEU 48 CO 0.23 -1.14 0.24 0.55 -1.11 0.00 0.00 177.39 176.16 1e9j n VAL 49 N -1.31 0.00 -1.88 1.96 3.14 -1.26 -4.99 118.33 113.99 1e9j n VAL 49 Ca 0.00 -0.33 -0.41 0.00 -2.96 0.00 0.00 64.34 60.64 1e9j n VAL 49 Cb 0.00 1.18 -0.02 0.00 -1.06 0.00 0.00 33.84 33.94 1e9j n VAL 49 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 1e9j s GLN 50 N -1.90 4.19 -0.41 1.45 0.74 -1.26 -4.93 119.66 117.53 1e9j s GLN 50 Ca 0.13 2.45 0.05 0.00 0.05 0.00 0.00 55.36 58.04 1e9j s GLN 50 Cb 0.13 -3.06 0.31 0.00 1.10 0.00 0.00 33.01 31.49 1e9j s GLN 50 CO 0.41 -0.53 1.20 1.63 -0.55 0.00 0.00 175.29 177.45 1e9j n LYS 51 N 2.14 0.68 -2.89 1.67 4.76 -1.26 -4.92 118.16 118.34 1e9j n LYS 51 Ca 0.07 -1.47 -0.20 0.00 -2.87 0.00 0.00 58.31 53.84 1e9j n LYS 51 Cb 0.39 -0.74 0.06 0.00 -1.84 0.00 0.00 35.03 32.89 1e9j n LYS 51 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1e9j s ASN 52 N -0.91 5.03 0.26 4.39 2.20 -1.26 -5.04 114.94 119.60 1e9j s ASN 52 Ca 0.22 -0.59 -0.31 0.00 -0.94 0.00 0.00 52.86 51.25 1e9j s ASN 52 Cb 0.28 -0.04 -0.12 0.00 -2.00 0.00 0.00 41.25 39.38 1e9j s ASN 52 CO -0.12 -1.35 1.65 0.68 -2.94 0.00 0.00 177.10 175.02 1e9j s VAL 53 N -2.74 2.04 0.00 3.54 -7.23 -1.26 -4.88 120.40 109.87 1e9j s VAL 53 Ca 0.61 0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.81 1e9j s VAL 53 Cb -0.07 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.86 1e9j s VAL 53 CO 0.39 0.00 0.49 0.35 -0.31 0.00 0.00 175.10 176.03 1e9j n THR 54 N 2.92 0.10 -1.51 5.32 -2.24 -1.26 -5.13 114.28 112.49 1e9j n THR 54 Ca 0.11 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1e9j n THR 54 Cb 0.36 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1e9j n THR 54 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1e9j n SER 55 N -0.05 -8.06 0.00 3.42 2.88 -1.26 -4.87 113.62 105.67 1e9j n SER 55 Ca 0.00 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.63 1e9j n SER 55 Cb 0.44 -3.90 0.00 0.00 -0.75 0.00 0.00 64.21 59.99 1e9j n SER 55 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1e9j n GLU 56 N 0.32 0.00 -3.05 -1.46 4.71 -1.26 -5.00 120.64 114.90 1e9j n GLU 56 Ca 0.00 0.41 -0.00 0.00 -0.01 0.00 0.00 57.16 57.55 1e9j n GLU 56 Cb 0.00 -1.25 0.01 0.00 -1.01 0.00 0.00 31.44 29.19 1e9j n GLU 56 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1e9j n SER 57 N -1.49 -0.96 -3.12 1.62 3.41 -1.26 -5.13 113.62 106.69 1e9j n SER 57 Ca 0.00 -1.41 -0.07 0.00 -0.26 0.00 0.00 58.87 57.13 1e9j n SER 57 Cb 0.00 1.53 0.07 0.00 -0.26 0.00 0.00 64.21 65.55 1e9j n SER 57 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1e9j n THR 58 N -0.50 0.00 -3.68 6.66 -2.24 -1.26 -5.02 114.28 108.23 1e9j n THR 58 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.69 1e9j n THR 58 Cb 0.36 -0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 68.28 1e9j n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j n VAL 61 N 6.06 3.35 0.00 0.00 0.24 -1.15 -4.83 118.33 122.00 1e9j n VAL 61 Ca 0.07 -5.33 0.00 0.00 -2.04 0.00 0.00 64.34 57.03 1e9j n VAL 61 Cb 0.47 -2.23 0.00 0.00 -1.47 0.00 0.00 33.84 30.61 1e9j n VAL 61 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1e9j n ALA 62 N 1.67 -0.74 -0.23 2.33 0.00 -1.25 -4.66 120.51 117.63 1e9j n ALA 62 Ca 0.25 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.78 1e9j n ALA 62 Cb 0.37 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.19 1e9j n ALA 62 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1e9j h LYS 63 N 1.92 0.70 -2.57 0.00 3.64 2.09 -3.37 116.57 118.98 1e9j h LYS 63 Ca 0.00 -0.04 -0.35 0.00 -1.27 0.00 0.00 60.65 58.99 1e9j h LYS 63 Cb 0.00 -0.16 -0.36 0.00 -0.41 0.00 0.00 32.23 31.30 1e9j h LYS 63 CO 0.00 0.46 -0.65 -1.12 -2.27 0.00 0.00 179.45 175.87 1e9j s SER 64 N -5.98 1.63 0.45 4.20 0.01 -0.28 -4.90 113.70 108.83 1e9j s SER 64 Ca -0.10 -0.38 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 1e9j s SER 64 Cb 0.21 0.28 -0.01 0.00 0.21 0.00 0.00 66.02 66.71 1e9j s SER 64 CO 0.78 -0.34 0.68 -0.72 0.41 0.00 0.00 173.24 174.05 1e9j s TYR 65 N 2.29 3.28 -0.05 2.43 1.13 -1.25 0.35 117.35 125.53 1e9j s TYR 65 Ca 0.07 0.32 0.21 0.00 -1.41 0.00 0.00 57.07 56.25 1e9j s TYR 65 Cb -0.16 -2.29 0.40 0.00 -1.10 0.00 0.00 41.96 38.81 1e9j s TYR 65 CO -0.15 -0.33 1.17 0.09 -2.51 0.00 0.00 175.55 173.82 1e9j n ASN 66 N -2.09 1.12 0.00 -0.18 4.13 0.51 -4.70 115.26 114.05 1e9j n ASN 66 Ca 0.01 -2.44 0.00 0.00 1.68 0.00 0.00 54.58 53.83 1e9j n ASN 66 Cb 0.57 -0.35 0.00 0.00 -1.54 0.00 0.00 39.78 38.47 1e9j n ASN 66 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 1e9j n ARG 67 N 0.08 0.00 -2.62 3.52 0.63 -1.22 -3.89 116.66 113.16 1e9j n ARG 67 Ca 0.09 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.89 1e9j n ARG 67 Cb 1.01 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.95 1e9j n ARG 67 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 1e9j n VAL 68 N 0.00 1.29 -0.40 5.15 0.24 -1.26 -4.60 118.33 118.76 1e9j n VAL 68 Ca 0.00 -3.44 -0.16 0.00 -2.04 0.00 0.00 64.34 58.70 1e9j n VAL 68 Cb 0.00 0.28 -0.03 0.00 -1.47 0.00 0.00 33.84 32.63 1e9j n VAL 68 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1e9j n THR 69 N -0.17 0.00 -3.62 3.34 -1.04 -1.20 -4.76 114.28 106.82 1e9j n THR 69 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 1e9j n THR 69 Cb 0.79 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 69.18 1e9j n THR 69 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1e9j n VAL 70 N 1.10 0.00 0.00 12.58 0.24 0.31 -4.75 118.33 127.80 1e9j n VAL 70 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1e9j n VAL 70 Cb -0.01 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 1e9j n VAL 70 CO 0.00 0.00 0.00 1.15 -2.14 0.00 0.00 176.83 175.84 1e9j n MET 71 N 0.00 0.00 -1.74 7.34 0.00 -1.26 0.33 117.12 121.78 1e9j n MET 71 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 57.70 57.56 1e9j n MET 71 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.18 1e9j n MET 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1e9j n GLY 72 N 0.00 0.73 2.15 3.17 0.00 -1.26 -0.25 105.19 109.72 1e9j n GLY 72 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1e9j n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1e9j n GLY 73 N -0.45 0.06 3.64 -0.02 0.00 0.62 -4.94 105.19 104.10 1e9j n GLY 73 Ca -0.15 -0.57 -0.44 0.00 0.00 0.00 0.00 46.02 44.87 1e9j n GLY 73 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1e9j n PHE 74 N -4.00 2.33 -3.34 1.61 3.01 0.99 -4.49 117.46 113.57 1e9j n PHE 74 Ca -0.09 -0.25 -0.45 0.00 1.01 0.00 0.00 57.45 57.67 1e9j n PHE 74 Cb 0.57 -2.76 -0.06 0.00 -0.01 0.00 0.00 39.48 37.22 1e9j n PHE 74 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1e9j s LYS 75 N 4.91 2.94 -0.04 -1.08 1.02 -1.26 0.11 119.74 126.34 1e9j s LYS 75 Ca 0.93 -1.69 0.15 0.00 0.02 0.00 0.00 55.97 55.39 1e9j s LYS 75 Cb -0.46 -4.25 0.51 0.00 -0.52 0.00 0.00 37.83 33.10 1e9j s LYS 75 CO 0.42 -1.29 1.40 1.33 -0.92 0.00 0.00 175.35 176.29 1e9j n VAL 76 N 5.22 1.00 -2.54 3.17 0.24 -1.26 -4.87 118.33 119.28 1e9j n VAL 76 Ca -0.13 -0.79 -0.14 0.00 -2.04 0.00 0.00 64.34 61.24 1e9j n VAL 76 Cb 0.40 0.21 -0.03 0.00 -1.47 0.00 0.00 33.84 32.96 1e9j n VAL 76 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1e9j n GLU 77 N 0.96 -0.91 0.00 7.34 4.07 -1.26 -1.75 120.64 129.08 1e9j n GLU 77 Ca 0.19 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 1e9j n GLU 77 Cb 0.56 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 30.45 1e9j n GLU 77 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1e9j n ASN 78 N -0.30 0.00 -4.57 4.31 5.15 -1.25 -0.78 115.26 117.82 1e9j n ASN 78 Ca 0.03 0.00 -0.56 0.00 -0.60 0.00 0.00 54.58 53.44 1e9j n ASN 78 Cb 0.15 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.32 1e9j n ASN 78 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1e9j n HIS 79 N 0.00 1.80 -0.00 1.20 8.25 -0.72 0.19 115.22 125.94 1e9j n HIS 79 Ca 0.00 0.51 0.09 0.00 -0.26 0.00 0.00 57.72 58.06 1e9j n HIS 79 Cb 0.00 -2.45 -0.15 0.00 1.12 0.00 0.00 29.99 28.51 1e9j n HIS 79 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1e9j n THR 80 N 5.60 0.20 -3.67 1.59 -2.24 1.08 -4.85 114.28 112.00 1e9j n THR 80 Ca 0.35 -0.54 -0.11 0.00 -2.27 0.00 0.00 64.05 61.48 1e9j n THR 80 Cb 0.13 -0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.18 1e9j n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j s ALA 81 N -3.41 -1.47 -0.13 6.98 0.00 -0.15 -4.85 121.76 118.73 1e9j s ALA 81 Ca -0.07 1.85 0.01 0.00 0.00 0.00 0.00 51.96 53.75 1e9j s ALA 81 Cb 0.13 -1.09 0.02 0.00 0.00 0.00 0.00 23.12 22.18 1e9j s ALA 81 CO 0.89 -0.30 -0.16 0.00 0.00 0.00 0.00 175.76 176.19 1e9j s HIS 83 N 1.18 1.44 -0.23 0.00 -3.43 -1.26 -4.70 115.29 108.28 1e9j s HIS 83 Ca -0.02 -0.57 -0.29 0.00 -0.80 0.00 0.00 55.06 53.38 1e9j s HIS 83 Cb -0.14 -1.09 -0.01 0.00 -1.43 0.00 0.00 32.58 29.91 1e9j s HIS 83 CO -0.06 -0.33 1.36 0.00 -2.00 0.00 0.00 174.74 173.72 1e9j n SER 85 N 7.43 0.00 0.00 0.00 7.64 0.53 -4.56 113.62 124.67 1e9j n SER 85 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1e9j n SER 85 Cb 0.46 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.66 1e9j n SER 85 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1e9j n THR 86 N 9.00 0.00 -2.77 0.44 -2.24 -1.26 -4.09 114.28 113.36 1e9j n THR 86 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 1e9j n THR 86 Cb 0.00 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1e9j n THR 86 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j s TYR 88 N -3.12 3.37 -0.95 0.00 2.02 -1.26 -5.02 117.35 112.39 1e9j s TYR 88 Ca 0.18 1.51 -0.03 0.00 -0.37 0.00 0.00 57.07 58.36 1e9j s TYR 88 Cb -0.08 -2.76 0.25 0.00 -0.40 0.00 0.00 41.96 38.97 1e9j s TYR 88 CO 0.22 -0.02 0.98 0.98 -1.57 0.00 0.00 175.55 176.15 1e9j n TYR 89 N -0.43 4.01 -2.38 2.71 4.19 -1.26 -5.05 117.16 118.94 1e9j n TYR 89 Ca 0.05 -3.80 -0.24 0.00 3.31 0.00 0.00 57.90 57.22 1e9j n TYR 89 Cb 0.53 -1.21 0.08 0.00 0.49 0.00 0.00 39.34 39.23 1e9j n TYR 89 CO 0.00 0.00 0.00 -1.58 0.91 0.00 0.00 176.86 176.19 1e9j s HIS 90 N -1.77 2.47 0.00 2.98 2.46 -1.26 -4.93 115.29 115.24 1e9j s HIS 90 Ca 0.30 0.14 0.00 0.00 0.47 0.00 0.00 55.06 55.97 1e9j s HIS 90 Cb -0.03 -3.11 0.00 0.00 -0.13 0.00 0.00 32.58 29.31 1e9j s HIS 90 CO -0.06 -1.45 0.00 1.17 -2.47 0.00 0.00 174.74 171.93 1e9j n LYS 91 N -2.82 0.00 -0.47 2.88 4.81 -1.26 -5.30 118.16 116.00 1e9j n LYS 91 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.54 1e9j n LYS 91 Cb 0.60 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.65 1e9j n LYS 91 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02