#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 2.49 0.00 0.00 -0.04 -1.26 -4.89 135.00 131.30 1e9j n PRO 2 Ca 0.00 -1.42 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 1e9j n PRO 2 Cb 0.00 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.15 1e9j n PRO 2 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1e9j n ASP 3 N 3.14 0.00 0.00 3.54 9.92 -1.26 -4.42 116.55 127.47 1e9j n ASP 3 Ca 0.53 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.79 1e9j n ASP 3 Cb 0.51 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 1e9j n ASP 3 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1e9j n VAL 4 N 0.00 0.00 0.00 2.53 3.14 -1.26 -3.70 118.33 119.04 1e9j n VAL 4 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1e9j n VAL 4 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1e9j n VAL 4 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1e9j n GLN 5 N 0.00 0.00 -3.75 1.45 10.64 -1.26 -5.05 117.38 119.41 1e9j n GLN 5 Ca 0.00 0.00 -0.28 0.00 -1.83 0.00 0.00 57.00 54.89 1e9j n GLN 5 Cb 0.00 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.27 1e9j n GLN 5 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1e9j n ASP 6 N 0.00 3.33 -4.63 2.61 8.00 -1.26 -5.07 116.55 119.53 1e9j n ASP 6 Ca 0.00 -3.28 -0.43 0.00 0.71 0.00 0.00 54.79 51.80 1e9j n ASP 6 Cb 0.00 -0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 40.32 1e9j n ASP 6 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1e9j n PRO 8 N 6.70 0.96 -0.24 0.00 -0.04 -1.26 -4.77 135.00 136.35 1e9j n PRO 8 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1e9j n PRO 8 Cb 0.47 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.83 1e9j n PRO 8 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1e9j n GLU 9 N -0.38 1.81 -2.72 0.54 -0.58 -1.26 -4.88 120.64 113.16 1e9j n GLU 9 Ca 0.00 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.57 1e9j n GLU 9 Cb 0.05 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 30.94 1e9j n GLU 9 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1e9j n THR 11 N -4.18 0.00 -3.96 0.00 5.66 -1.26 -4.77 114.28 105.76 1e9j n THR 11 Ca -0.11 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.54 1e9j n THR 11 Cb 0.61 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.28 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 3.69 -0.40 1.09 1.02 -1.26 0.12 118.68 122.94 1e9j s LEU 12 Ca 0.00 -0.01 -0.03 0.00 0.02 0.00 0.00 54.13 54.11 1e9j s LEU 12 Cb 0.00 -1.95 0.11 0.00 0.02 0.00 0.00 46.19 44.38 1e9j s LEU 12 CO 0.00 0.11 2.53 0.00 0.02 0.00 0.00 176.35 179.01 1e9j n GLN 13 N 3.96 2.20 0.00 1.70 6.02 -1.26 -4.86 117.38 125.14 1e9j n GLN 13 Ca -0.16 -2.08 0.00 0.00 -0.01 0.00 0.00 57.00 54.75 1e9j n GLN 13 Cb 0.52 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.81 1e9j n GLN 13 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1e9j n GLU 14 N 0.70 0.00 -1.54 -1.09 2.13 -1.25 -4.38 120.64 115.21 1e9j n GLU 14 Ca 0.43 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.85 1e9j n GLU 14 Cb 0.57 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.23 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 2.19 0.00 4.31 2.85 0.95 -4.75 115.26 120.81 1e9j n ASN 15 Ca 0.00 -0.17 0.01 0.00 -0.11 0.00 0.00 54.58 54.30 1e9j n ASN 15 Cb 0.00 -1.45 0.04 0.00 1.24 0.00 0.00 39.78 39.61 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 8.79 0.86 -0.06 1.20 -0.04 -1.26 -1.10 135.00 143.39 1e9j n PRO 16 Ca 0.40 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.80 1e9j n PRO 16 Cb 0.42 -1.03 -0.02 0.00 -0.04 0.00 0.00 33.50 32.83 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 -0.53 0.00 1.38 0.54 7.35 -1.26 -4.52 117.46 120.43 1e9j n PHE 17 Ca 0.01 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.84 1e9j n PHE 17 Cb 0.00 -0.36 0.72 0.00 0.35 0.00 0.00 39.48 40.20 1e9j n PHE 17 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1e9j n PHE 18 N -4.04 0.00 -1.60 -5.13 3.72 -1.21 -4.76 117.46 104.44 1e9j n PHE 18 Ca -0.10 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.92 1e9j n PHE 18 Cb 0.37 -0.24 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 1e9j n PHE 18 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1e9j s SER 19 N -2.49 4.72 -0.01 4.37 1.04 -0.26 -4.53 113.70 116.53 1e9j s SER 19 Ca 0.29 1.22 0.04 0.00 0.48 0.00 0.00 55.95 57.99 1e9j s SER 19 Cb 0.19 -2.50 -0.01 0.00 0.10 0.00 0.00 66.02 63.79 1e9j s SER 19 CO 0.41 -2.64 -0.14 -1.58 0.98 0.00 0.00 173.24 170.27 1e9j s GLN 20 N 7.75 1.18 -0.08 4.02 2.00 0.14 -4.96 119.66 129.71 1e9j s GLN 20 Ca 0.96 -0.51 -0.01 0.00 -2.00 0.00 0.00 55.36 53.81 1e9j s GLN 20 Cb -0.20 -1.13 -0.03 0.00 0.80 0.00 0.00 33.01 32.44 1e9j s GLN 20 CO 0.28 0.30 0.67 -2.30 -0.50 0.00 0.00 175.29 173.74 1e9j n PRO 21 N 2.77 0.00 0.00 1.67 -0.02 -1.26 0.25 135.00 138.41 1e9j n PRO 21 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1e9j n PRO 21 Cb 0.55 -0.58 0.00 0.00 -0.02 0.00 0.00 33.50 33.45 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 2.68 0.30 3.15 -1.23 0.00 -1.26 -5.10 105.19 103.73 1e9j n GLY 22 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.22 -2.43 -0.96 4.61 0.00 0.68 -5.07 121.76 117.38 1e9j s ALA 23 Ca 0.00 1.48 -0.01 0.00 0.00 0.00 0.00 51.96 53.43 1e9j s ALA 23 Cb 0.00 -2.36 0.30 0.00 0.00 0.00 0.00 23.12 21.05 1e9j s ALA 23 CO 0.00 -1.57 1.31 -0.35 0.00 0.00 0.00 175.76 175.15 1e9j n PRO 24 N 5.42 4.04 -0.53 0.00 -0.04 -1.26 0.23 135.00 142.87 1e9j n PRO 24 Ca 0.02 -4.60 -0.04 0.00 -0.04 0.00 0.00 63.50 58.84 1e9j n PRO 24 Cb 0.53 -2.44 0.04 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 1.06 0.00 -2.65 0.52 2.08 -1.26 -4.30 119.36 114.82 1e9j n ILE 25 Ca 0.28 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.59 1e9j n ILE 25 Cb 0.35 -0.12 0.00 0.00 -0.75 0.00 0.00 39.64 39.12 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 0.32 117.00 122.22 1e9j n LEU 26 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1e9j n LEU 26 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1e9j n LEU 26 CO 0.05 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 177.78 1e9j n GLN 27 N 0.00 0.00 0.00 3.23 0.00 -1.26 -4.36 117.38 114.99 1e9j n GLN 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1e9j n GLN 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1e9j n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1e9j n MET 29 N 0.00 0.00 0.00 0.00 1.56 0.33 -4.86 117.12 114.15 1e9j n MET 29 Ca 0.00 0.02 0.00 0.00 -0.27 0.00 0.00 57.70 57.45 1e9j n MET 29 Cb 0.00 -0.56 0.00 0.00 2.15 0.00 0.00 33.22 34.81 1e9j n MET 29 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1e9j n GLY 30 N -0.08 0.33 0.76 -5.12 0.00 -1.26 -4.81 105.19 95.01 1e9j n GLY 30 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.08 0.00 -3.61 0.00 3.01 -1.26 -4.93 117.46 110.58 1e9j n PHE 33 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 1e9j n PHE 33 Cb 0.01 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.40 1e9j n PHE 33 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1e9j n SER 34 N 0.00 4.01 0.00 4.37 3.41 -1.26 -5.01 113.62 119.14 1e9j n SER 34 Ca 0.00 -3.24 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 1e9j n SER 34 Cb 0.00 -0.92 0.00 0.00 -0.26 0.00 0.00 64.21 63.03 1e9j n SER 34 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1e9j n ARG 35 N 1.83 0.00 0.00 4.33 0.63 -1.26 -5.16 116.66 117.03 1e9j n ARG 35 Ca 0.23 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 1e9j n ARG 35 Cb 0.37 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.28 1e9j n ARG 35 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1e9j n ALA 36 N -3.00 -0.27 -3.11 5.13 0.00 -1.26 -4.81 120.51 113.18 1e9j n ALA 36 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 53.44 52.99 1e9j n ALA 36 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 1e9j n ALA 36 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1e9j s TYR 37 N -3.43 3.37 -0.25 0.00 2.02 -1.26 -5.01 117.35 112.80 1e9j s TYR 37 Ca 0.00 -1.59 -0.32 0.00 -0.37 0.00 0.00 57.07 54.79 1e9j s TYR 37 Cb 0.00 -4.06 -0.08 0.00 -0.40 0.00 0.00 41.96 37.42 1e9j s TYR 37 CO 0.00 -1.26 2.16 -0.35 -1.57 0.00 0.00 175.55 174.53 1e9j n PRO 38 N 5.46 1.67 -2.36 -1.71 -0.04 -1.26 -4.82 135.00 131.93 1e9j n PRO 38 Ca 0.16 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 1e9j n PRO 38 Cb 0.47 -2.86 0.04 0.00 -0.04 0.00 0.00 33.50 31.12 1e9j n PRO 38 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1e9j n THR 39 N 7.15 0.94 -1.68 0.52 5.66 -1.25 -5.10 114.28 120.53 1e9j n THR 39 Ca 0.33 -2.38 -0.42 0.00 -3.05 0.00 0.00 64.05 58.53 1e9j n THR 39 Cb 0.34 1.10 -0.03 0.00 -1.55 0.00 0.00 70.33 70.19 1e9j n THR 39 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1e9j n PRO 40 N -0.28 2.84 -3.08 1.09 -0.04 -1.24 -4.55 135.00 129.74 1e9j n PRO 40 Ca 0.08 1.03 -0.22 0.00 -0.04 0.00 0.00 63.50 64.35 1e9j n PRO 40 Cb 0.91 -2.95 -0.04 0.00 -0.04 0.00 0.00 33.50 31.38 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 6.28 2.52 -0.79 1.53 7.94 -1.26 -5.08 117.00 128.14 1e9j n LEU 41 Ca 0.19 -5.32 0.00 0.00 -1.11 0.00 0.00 56.01 49.77 1e9j n LEU 41 Cb 0.39 0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.46 1e9j n LEU 41 CO 0.67 2.31 -0.23 -1.14 -1.11 0.00 0.00 177.39 177.89 1e9j n ARG 42 N 0.07 -2.23 -2.52 1.96 0.63 -1.26 -5.05 116.66 108.26 1e9j n ARG 42 Ca 0.28 1.67 -0.03 0.00 -0.92 0.00 0.00 57.85 58.85 1e9j n ARG 42 Cb 0.53 -1.92 -0.02 0.00 0.45 0.00 0.00 32.46 31.50 1e9j n ARG 42 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1e9j n SER 43 N -1.15 -0.95 -1.14 6.15 7.64 -1.26 -4.95 113.62 117.97 1e9j n SER 43 Ca 0.00 -1.51 -0.12 0.00 1.01 0.00 0.00 58.87 58.25 1e9j n SER 43 Cb 0.04 0.88 -0.03 0.00 -1.01 0.00 0.00 64.21 64.10 1e9j n SER 43 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1e9j n LYS 44 N -0.46 -0.89 -1.57 1.43 3.00 -1.26 -4.92 118.16 113.49 1e9j n LYS 44 Ca -0.26 0.74 -0.49 0.00 -0.00 0.00 0.00 58.31 58.30 1e9j n LYS 44 Cb 0.61 -4.83 -0.04 0.00 0.00 0.00 0.00 35.03 30.78 1e9j n LYS 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1e9j n LYS 45 N -2.39 1.12 -0.99 1.64 4.76 -1.26 -4.88 118.16 116.16 1e9j n LYS 45 Ca -0.13 0.40 0.01 0.00 -2.87 0.00 0.00 58.31 55.71 1e9j n LYS 45 Cb 0.50 -1.87 -0.00 0.00 -1.84 0.00 0.00 35.03 31.81 1e9j n LYS 45 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1e9j n THR 46 N 1.36 0.00 -4.48 -0.18 -1.04 -1.26 -5.11 114.28 103.57 1e9j n THR 46 Ca 0.15 -0.41 -0.23 0.00 -2.04 0.00 0.00 64.05 61.52 1e9j n THR 46 Cb 0.25 0.65 -0.11 0.00 -1.82 0.00 0.00 70.33 69.30 1e9j n THR 46 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1e9j s MET 47 N 0.00 1.67 0.49 -2.82 -1.94 -1.26 -5.16 119.30 110.28 1e9j s MET 47 Ca 0.14 -1.89 0.08 0.00 -1.71 0.00 0.00 55.69 52.31 1e9j s MET 47 Cb 0.16 -1.21 0.03 0.00 2.01 0.00 0.00 34.83 35.83 1e9j s MET 47 CO -0.07 -0.03 0.56 -0.51 -0.01 0.00 0.00 175.02 174.95 1e9j s LEU 48 N -3.52 3.24 0.00 -0.03 1.43 -1.26 -5.15 118.68 113.39 1e9j s LEU 48 Ca 0.33 -0.79 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 1e9j s LEU 48 Cb 0.06 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 1e9j s LEU 48 CO 0.14 -0.98 0.08 1.33 0.23 0.00 0.00 176.35 177.16 1e9j n VAL 49 N -1.88 0.00 -0.38 -1.59 0.24 -1.26 -5.00 118.33 108.46 1e9j n VAL 49 Ca 0.07 -1.01 0.00 0.00 -2.04 0.00 0.00 64.34 61.37 1e9j n VAL 49 Cb 0.61 0.42 0.00 0.00 -1.47 0.00 0.00 33.84 33.40 1e9j n VAL 49 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1e9j n GLN 50 N -0.34 0.00 -3.47 7.34 6.02 -1.26 -5.11 117.38 120.56 1e9j n GLN 50 Ca -0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 1e9j n GLN 50 Cb 0.26 -0.43 -0.12 0.00 1.02 0.00 0.00 30.24 30.97 1e9j n GLN 50 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1e9j s LYS 51 N -1.33 0.23 -0.27 -1.09 -0.14 -1.26 -5.00 119.74 110.88 1e9j s LYS 51 Ca 0.00 0.02 0.17 0.00 -1.36 0.00 0.00 55.97 54.80 1e9j s LYS 51 Cb 0.00 -1.06 0.49 0.00 -1.68 0.00 0.00 37.83 35.58 1e9j s LYS 51 CO 0.00 -0.80 1.14 0.27 -0.76 0.00 0.00 175.35 175.20 1e9j n ASN 52 N 5.31 2.91 -4.71 2.83 6.94 -1.26 -5.08 115.26 122.21 1e9j n ASN 52 Ca -0.05 -2.71 -0.42 0.00 -0.02 0.00 0.00 54.58 51.38 1e9j n ASN 52 Cb 0.48 -0.42 -0.03 0.00 -2.36 0.00 0.00 39.78 37.44 1e9j n ASN 52 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1e9j s VAL 53 N -4.13 4.71 -0.96 3.53 1.01 -1.26 -4.87 120.40 118.43 1e9j s VAL 53 Ca 0.37 1.95 -0.14 0.00 0.00 0.00 0.00 61.98 64.15 1e9j s VAL 53 Cb 0.36 -4.25 -0.29 0.00 0.00 0.00 0.00 36.38 32.19 1e9j s VAL 53 CO -0.01 0.14 2.26 1.07 0.00 0.00 0.00 175.10 178.57 1e9j n THR 54 N 3.95 -0.00 -3.11 3.92 5.66 -1.26 -4.72 114.28 118.71 1e9j n THR 54 Ca 0.07 -0.44 -0.21 0.00 -3.05 0.00 0.00 64.05 60.42 1e9j n THR 54 Cb 0.50 -0.37 -0.03 0.00 -1.55 0.00 0.00 70.33 68.88 1e9j n THR 54 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1e9j n SER 55 N 7.98 1.98 -3.44 1.09 3.41 -1.26 -4.99 113.62 118.38 1e9j n SER 55 Ca 0.65 -3.22 -0.36 0.00 -0.26 0.00 0.00 58.87 55.67 1e9j n SER 55 Cb 0.17 -0.60 -0.02 0.00 -0.26 0.00 0.00 64.21 63.49 1e9j n SER 55 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1e9j n GLU 56 N 0.13 2.63 0.00 4.33 4.71 -1.26 -4.78 120.64 126.40 1e9j n GLU 56 Ca 0.27 -2.04 0.00 0.00 -0.01 0.00 0.00 57.16 55.38 1e9j n GLU 56 Cb 0.57 -2.86 0.00 0.00 -1.01 0.00 0.00 31.44 28.15 1e9j n GLU 56 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 1e9j n SER 57 N 5.16 0.00 -1.66 1.62 7.64 -1.26 -5.10 113.62 120.02 1e9j n SER 57 Ca 0.57 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1e9j n SER 57 Cb 0.28 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1e9j n SER 57 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1e9j n THR 58 N 0.00 -4.86 -3.55 0.44 -2.24 -1.26 -4.99 114.28 97.82 1e9j n THR 58 Ca 0.00 2.25 -0.08 0.00 -2.27 0.00 0.00 64.05 63.95 1e9j n THR 58 Cb 0.00 -3.14 -0.03 0.00 -2.10 0.00 0.00 70.33 65.06 1e9j n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j s VAL 61 N 0.09 5.28 0.00 0.00 0.11 -1.25 -4.64 120.40 119.99 1e9j s VAL 61 Ca 0.19 -2.20 0.00 0.00 -2.93 0.00 0.00 61.98 57.04 1e9j s VAL 61 Cb -0.10 -4.61 0.00 0.00 -1.53 0.00 0.00 36.38 30.14 1e9j s VAL 61 CO -0.09 -1.24 0.00 0.00 -3.33 0.00 0.00 175.10 170.44 1e9j n ALA 62 N 4.93 -0.35 0.25 1.54 0.00 -1.25 -4.61 120.51 121.01 1e9j n ALA 62 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.70 1e9j n ALA 62 Cb 0.47 0.00 0.59 0.00 0.00 0.00 0.00 19.45 20.51 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 0.83 0.00 -2.48 0.00 3.64 0.82 -3.40 116.57 115.98 1e9j h LYS 63 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1e9j h LYS 63 Cb 0.00 0.00 -0.29 0.00 -0.41 0.00 0.00 32.23 31.53 1e9j h LYS 63 CO 0.00 0.08 -0.41 -1.12 -2.27 0.00 0.00 179.45 175.73 1e9j s SER 64 N -7.01 -0.09 0.31 4.20 0.01 -0.82 -4.91 113.70 105.40 1e9j s SER 64 Ca -0.05 0.82 0.04 0.00 1.31 0.00 0.00 55.95 58.08 1e9j s SER 64 Cb 0.16 1.22 -0.02 0.00 0.21 0.00 0.00 66.02 67.59 1e9j s SER 64 CO 0.68 -0.24 0.47 -0.72 0.41 0.00 0.00 173.24 173.83 1e9j s TYR 65 N 2.57 3.32 -0.06 2.43 -0.85 -1.25 0.30 117.35 123.81 1e9j s TYR 65 Ca 0.01 0.00 0.17 0.00 -0.52 0.00 0.00 57.07 56.73 1e9j s TYR 65 Cb -0.12 -1.86 0.32 0.00 0.38 0.00 0.00 41.96 40.68 1e9j s TYR 65 CO -0.12 0.14 1.14 0.09 -1.52 0.00 0.00 175.55 175.28 1e9j n ASN 66 N -1.63 1.07 0.00 -0.18 4.13 0.20 -4.69 115.26 114.15 1e9j n ASN 66 Ca -0.04 -2.51 0.00 0.00 1.68 0.00 0.00 54.58 53.71 1e9j n ASN 66 Cb 0.57 -0.34 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 -2.11 0.28 0.00 0.00 177.26 175.43 1e9j n ARG 67 N -0.14 0.00 -1.99 3.52 1.85 -1.20 -3.90 116.66 114.79 1e9j n ARG 67 Ca 0.08 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.68 1e9j n ARG 67 Cb 0.91 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 32.34 1e9j n ARG 67 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1e9j n VAL 68 N 0.00 2.63 0.00 8.89 0.24 -1.26 -4.67 118.33 124.17 1e9j n VAL 68 Ca 0.00 -4.16 0.00 0.00 -2.04 0.00 0.00 64.34 58.14 1e9j n VAL 68 Cb 0.00 -1.15 0.00 0.00 -1.47 0.00 0.00 33.84 31.22 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 -0.71 0.00 -3.07 3.34 -1.04 -1.25 -4.87 114.28 106.68 1e9j n THR 69 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 1e9j n THR 69 Cb 0.91 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.42 1e9j n THR 69 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1e9j n VAL 70 N 0.00 0.00 0.00 12.58 0.31 -1.05 -4.78 118.33 125.39 1e9j n VAL 70 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1e9j n VAL 70 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1e9j n VAL 70 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1e9j n MET 71 N 0.00 0.00 -1.99 5.55 2.81 -1.26 0.18 117.12 122.41 1e9j n MET 71 Ca 0.00 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.75 1e9j n MET 71 Cb 0.00 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.48 1e9j n MET 71 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1e9j n GLY 72 N 0.00 0.31 2.22 3.03 0.00 -1.26 -0.37 105.19 109.13 1e9j n GLY 72 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.60 0.63 3.14 -0.02 0.00 0.38 -4.99 105.19 103.74 1e9j n GLY 73 Ca -0.16 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 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 -3.26 -1.42 -3.28 1.61 3.72 0.48 -4.56 117.46 110.75 1e9j n PHE 74 Ca -0.10 0.34 -0.08 0.00 -0.05 0.00 0.00 57.45 57.57 1e9j n PHE 74 Cb 0.41 -1.47 -0.05 0.00 -0.94 0.00 0.00 39.48 37.43 1e9j n PHE 74 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1e9j s LYS 75 N -2.87 0.56 -0.05 -1.08 1.02 -1.26 -2.53 119.74 113.54 1e9j s LYS 75 Ca 0.46 -0.15 0.13 0.00 0.02 0.00 0.00 55.97 56.43 1e9j s LYS 75 Cb -0.02 -0.27 0.46 0.00 -0.52 0.00 0.00 37.83 37.48 1e9j s LYS 75 CO 0.62 -1.11 1.34 1.33 -0.92 0.00 0.00 175.35 176.62 1e9j n VAL 76 N 4.90 1.02 -2.64 3.17 0.24 -1.26 -4.85 118.33 118.91 1e9j n VAL 76 Ca 0.06 -0.73 -0.16 0.00 -2.04 0.00 0.00 64.34 61.46 1e9j n VAL 76 Cb 0.50 0.10 -0.03 0.00 -1.47 0.00 0.00 33.84 32.95 1e9j n VAL 76 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 1e9j n GLU 77 N 0.75 -1.08 0.00 7.34 0.00 -1.26 -1.39 120.64 125.01 1e9j n GLU 77 Ca 0.17 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.38 1e9j n GLU 77 Cb 0.56 -2.20 0.00 0.00 0.00 0.00 0.00 31.44 29.79 1e9j n GLU 77 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1e9j n ASN 78 N -0.73 0.00 -4.68 -1.84 5.15 -1.25 0.09 115.26 112.00 1e9j n ASN 78 Ca 0.05 0.00 -0.67 0.00 -0.60 0.00 0.00 54.58 53.36 1e9j n ASN 78 Cb 0.22 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.36 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 1.68 0.11 1.20 8.25 -0.48 0.58 115.22 126.56 1e9j n HIS 79 Ca 0.00 1.10 0.09 0.00 -0.26 0.00 0.00 57.72 58.65 1e9j n HIS 79 Cb 0.00 -2.24 -0.14 0.00 1.12 0.00 0.00 29.99 28.74 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 4.33 0.00 -3.54 1.59 -2.24 0.87 -4.81 114.28 110.48 1e9j n THR 80 Ca 0.34 -0.37 -0.17 0.00 -2.27 0.00 0.00 64.05 61.57 1e9j n THR 80 Cb -0.06 0.21 -0.06 0.00 -2.10 0.00 0.00 70.33 68.32 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 -3.20 -1.71 0.08 6.98 0.00 -0.28 -4.86 121.76 118.77 1e9j s ALA 81 Ca -0.05 1.30 0.04 0.00 0.00 0.00 0.00 51.96 53.25 1e9j s ALA 81 Cb 0.12 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1e9j s ALA 81 CO 0.76 -0.36 -0.11 0.00 0.00 0.00 0.00 175.76 176.06 1e9j s HIS 83 N -1.93 -1.47 0.91 0.00 -3.43 -1.26 -4.54 115.29 103.57 1e9j s HIS 83 Ca 0.00 1.82 -0.10 0.00 -0.80 0.00 0.00 55.06 55.98 1e9j s HIS 83 Cb -0.06 0.61 0.14 0.00 -1.43 0.00 0.00 32.58 31.84 1e9j s HIS 83 CO 0.01 -0.78 1.12 0.00 -2.00 0.00 0.00 174.74 173.08 1e9j n SER 85 N -4.14 -2.90 -2.72 0.00 2.88 -0.47 -4.83 113.62 101.45 1e9j n SER 85 Ca 0.10 0.33 -0.11 0.00 -1.33 0.00 0.00 58.87 57.87 1e9j n SER 85 Cb 0.53 -1.56 -0.01 0.00 -0.75 0.00 0.00 64.21 62.42 1e9j n SER 85 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1e9j n THR 86 N -3.03 -0.41 -1.47 2.46 -1.04 -1.26 -4.66 114.28 104.87 1e9j n THR 86 Ca -0.01 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.57 1e9j n THR 86 Cb 0.22 -1.05 -0.13 0.00 -1.82 0.00 0.00 70.33 67.56 1e9j n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1e9j n TYR 88 N 10.80 1.13 0.00 0.00 9.36 -1.26 -3.95 117.16 133.23 1e9j n TYR 88 Ca 0.60 0.20 0.00 0.00 3.32 0.00 0.00 57.90 62.02 1e9j n TYR 88 Cb 0.10 -2.54 0.00 0.00 -0.63 0.00 0.00 39.34 36.27 1e9j n TYR 88 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 1e9j n TYR 89 N 14.14 -0.12 0.00 2.98 9.36 -1.26 -5.07 117.16 137.19 1e9j n TYR 89 Ca 0.47 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.69 1e9j n TYR 89 Cb 0.37 0.02 0.00 0.00 -0.63 0.00 0.00 39.34 39.11 1e9j n TYR 89 CO 0.00 0.00 0.00 1.58 0.22 0.00 0.00 176.86 178.66 1e9j n HIS 90 N -0.86 0.00 -4.45 2.98 -0.00 -1.25 -4.16 115.22 107.48 1e9j n HIS 90 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.72 57.48 1e9j n HIS 90 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 29.86 1e9j n HIS 90 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1e9j s LYS 91 N 0.00 1.20 0.00 1.57 1.02 -1.26 -5.26 119.74 117.00 1e9j s LYS 91 Ca 0.00 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 55.00 1e9j s LYS 91 Cb 0.00 -1.34 0.00 0.00 -0.52 0.00 0.00 37.83 35.97 1e9j s LYS 91 CO 0.00 0.33 0.40 0.45 -0.92 0.00 0.00 175.35 175.61