#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5j n LEU 2 N 0.00 0.67 0.00 -0.89 -0.00 -1.26 -4.47 117.00 111.06 2o5j n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2o5j n LEU 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2o5j n LEU 2 CO 0.00 -0.02 0.00 0.47 -0.00 0.00 0.00 177.39 177.84 2o5j n ASP 3 N -2.31 0.00 0.07 1.45 9.92 -1.26 -4.36 116.55 120.06 2o5j n ASP 3 Ca 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.23 2o5j n ASP 3 Cb 0.22 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 40.63 2o5j n ASP 3 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2o5j h SER 4 N 0.00 0.00 0.34 -2.24 0.87 -1.98 -3.10 113.55 107.44 2o5j h SER 4 Ca 0.00 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 60.23 2o5j h SER 4 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2o5j h SER 4 CO 0.00 0.74 -1.60 0.50 -0.53 0.00 0.00 176.83 175.94 2o5j h LYS 5 N 0.00 0.35 -0.54 2.24 3.64 -1.95 -3.28 116.57 117.03 2o5j h LYS 5 Ca -0.09 -0.59 -0.04 0.00 -1.27 0.00 0.00 60.65 58.66 2o5j h LYS 5 Cb 1.64 0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 33.65 2o5j h LYS 5 CO 0.08 1.24 0.16 1.25 -2.27 0.00 0.00 179.45 179.92 2o5j h LEU 6 N 0.09 0.74 -6.62 5.20 5.85 -1.76 -3.05 115.31 115.76 2o5j h LEU 6 Ca -0.28 -0.11 -0.63 0.00 0.84 0.00 0.00 57.88 57.70 2o5j h LEU 6 Cb 2.07 -0.19 0.05 0.00 0.37 0.00 0.00 40.66 42.96 2o5j h LEU 6 CO 0.19 0.70 2.15 1.17 -0.34 0.00 0.00 178.44 182.30 2o5j n LYS 7 N -4.30 1.39 -4.37 1.25 0.00 -1.17 -4.85 118.16 106.11 2o5j n LYS 7 Ca 0.04 -1.82 -0.25 0.00 0.00 0.00 0.00 58.31 56.28 2o5j n LYS 7 Cb 0.20 -2.94 -0.10 0.00 0.00 0.00 0.00 35.03 32.19 2o5j n LYS 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2o5j s ALA 8 N 5.57 2.83 -0.51 3.14 0.00 -1.16 -4.91 121.76 126.73 2o5j s ALA 8 Ca 0.59 -1.65 -0.34 0.00 0.00 0.00 0.00 51.96 50.56 2o5j s ALA 8 Cb 0.13 -0.52 -0.14 0.00 0.00 0.00 0.00 23.12 22.60 2o5j s ALA 8 CO 0.14 0.38 2.32 -2.30 0.00 0.00 0.00 175.76 176.29 2o5j n PRO 9 N -0.22 0.75 -2.39 0.00 -0.02 -1.26 -4.55 135.00 127.30 2o5j n PRO 9 Ca -0.09 0.16 -0.40 0.00 -2.02 0.00 0.00 63.50 61.14 2o5j n PRO 9 Cb 0.57 -2.33 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 2o5j n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2o5j s VAL 10 N 8.26 3.63 -0.38 -1.45 1.01 -0.15 -4.80 120.40 126.51 2o5j s VAL 10 Ca 1.14 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 63.21 2o5j s VAL 10 Cb -0.90 -4.60 0.01 0.00 0.00 0.00 0.00 36.38 30.89 2o5j s VAL 10 CO 0.47 -1.53 1.27 0.12 0.00 0.00 0.00 175.10 175.43 2o5j s PHE 11 N 6.70 2.68 -0.07 5.22 5.36 -1.26 -3.84 117.98 132.77 2o5j s PHE 11 Ca 0.46 0.81 0.01 0.00 -0.96 0.00 0.00 56.93 57.24 2o5j s PHE 11 Cb -0.10 -4.14 -0.03 0.00 -0.34 0.00 0.00 43.02 38.41 2o5j s PHE 11 CO 0.18 -1.58 -0.08 0.95 -1.46 0.00 0.00 175.22 173.23 2o5j s THR 12 N 4.64 3.63 0.07 0.12 -4.23 -0.14 -5.01 115.64 114.72 2o5j s THR 12 Ca 0.54 -0.50 0.07 0.00 -1.18 0.00 0.00 61.69 60.62 2o5j s THR 12 Cb -0.13 -2.49 -0.03 0.00 1.34 0.00 0.00 72.50 71.20 2o5j s THR 12 CO 0.27 0.59 -0.18 -0.69 -0.54 0.00 0.00 174.62 174.07 2o5j s VAL 13 N -0.67 1.44 -0.33 2.29 1.01 -1.26 -1.29 120.40 121.59 2o5j s VAL 13 Ca 0.10 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 60.79 2o5j s VAL 13 Cb -0.11 -1.31 0.14 0.00 0.00 0.00 0.00 36.38 35.10 2o5j s VAL 13 CO 0.02 -0.03 0.31 -0.13 0.00 0.00 0.00 175.10 175.28 2o5j s ARG 14 N -1.55 0.48 -0.08 2.72 0.52 -1.04 -5.04 118.95 114.96 2o5j s ARG 14 Ca 0.04 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.68 2o5j s ARG 14 Cb -0.09 -0.77 0.01 0.00 0.52 0.00 0.00 34.95 34.61 2o5j s ARG 14 CO 0.03 -1.12 -0.17 -0.08 0.02 0.00 0.00 175.30 173.97 2o5j s THR 15 N 1.80 1.51 -0.18 0.02 -1.32 -1.26 -1.09 115.64 115.11 2o5j s THR 15 Ca 0.14 -0.70 -0.00 0.00 -1.21 0.00 0.00 61.69 59.91 2o5j s THR 15 Cb -0.16 -1.33 0.01 0.00 -1.51 0.00 0.00 72.50 69.51 2o5j s THR 15 CO -0.17 0.44 -0.15 -1.10 -2.21 0.00 0.00 174.62 171.44 2o5j s GLN 16 N 0.50 3.15 2.21 7.08 -1.52 -1.10 -5.01 119.66 124.96 2o5j s GLN 16 Ca -0.15 -0.76 0.00 0.00 -1.95 0.00 0.00 55.36 52.50 2o5j s GLN 16 Cb -0.16 -2.70 0.00 0.00 -0.22 0.00 0.00 33.01 29.93 2o5j s GLN 16 CO 0.06 -0.14 0.00 0.41 -0.25 0.00 0.00 175.29 175.36 2o5j n GLY 17 N 4.51 -0.67 0.63 3.09 0.00 -1.26 -3.43 105.19 108.06 2o5j n GLY 17 Ca -0.20 -1.13 0.06 0.00 0.00 0.00 0.00 46.02 44.76 2o5j n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j n ARG 18 N -0.22 2.21 -0.10 1.61 1.74 -1.26 -4.64 116.66 116.00 2o5j n ARG 18 Ca 0.00 -1.84 -0.17 0.00 -0.77 0.00 0.00 57.85 55.08 2o5j n ARG 18 Cb 0.00 -1.27 -0.06 0.00 -1.02 0.00 0.00 32.46 30.10 2o5j n ARG 18 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2o5j n GLU 19 N 0.63 0.54 -4.13 5.56 4.71 -1.26 -3.97 120.64 122.71 2o5j n GLU 19 Ca 0.11 0.33 -0.33 0.00 -0.01 0.00 0.00 57.16 57.26 2o5j n GLU 19 Cb 0.40 -1.54 -0.07 0.00 -1.01 0.00 0.00 31.44 29.22 2o5j n GLU 19 CO 0.00 0.00 0.00 -0.47 0.09 0.00 0.00 177.13 176.75 2o5j s TYR 20 N -2.59 3.25 -0.29 -0.32 6.04 -1.22 0.24 117.35 122.46 2o5j s TYR 20 Ca -0.30 0.19 0.00 0.00 0.04 0.00 0.00 57.07 57.00 2o5j s TYR 20 Cb 0.07 -1.73 0.18 0.00 -1.04 0.00 0.00 41.96 39.45 2o5j s TYR 20 CO 0.44 0.54 0.54 0.20 -1.54 0.00 0.00 175.55 175.72 2o5j s GLY 21 N -1.68 -0.91 0.24 8.97 0.00 -0.74 -2.71 107.32 110.48 2o5j s GLY 21 Ca 0.22 1.42 -0.16 0.00 0.00 0.00 0.00 44.72 46.20 2o5j s GLY 21 CO 0.13 3.28 0.67 -0.54 0.00 0.00 0.00 173.10 176.64 2o5j s GLU 22 N 2.77 4.06 -0.21 2.90 2.02 -0.25 -1.92 118.70 128.07 2o5j s GLU 22 Ca 0.17 0.65 -0.04 0.00 0.02 0.00 0.00 54.97 55.77 2o5j s GLU 22 Cb -0.14 -2.71 0.09 0.00 0.10 0.00 0.00 34.13 31.47 2o5j s GLU 22 CO -0.22 0.32 0.17 -0.06 0.02 0.00 0.00 175.26 175.50 2o5j s PHE 23 N -1.70 -0.08 -0.03 1.61 0.08 -1.02 -2.50 117.98 114.33 2o5j s PHE 23 Ca 0.46 -0.09 -0.03 0.00 0.12 0.00 0.00 56.93 57.40 2o5j s PHE 23 Cb -0.13 -0.53 -0.04 0.00 -0.57 0.00 0.00 43.02 41.75 2o5j s PHE 23 CO 0.19 -0.62 0.15 0.08 -0.10 0.00 0.00 175.22 174.93 2o5j s VAL 24 N 2.25 5.27 -0.24 -0.44 1.01 -0.41 -1.67 120.40 126.16 2o5j s VAL 24 Ca 0.06 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 2o5j s VAL 24 Cb -0.16 -3.42 0.13 0.00 0.00 0.00 0.00 36.38 32.94 2o5j s VAL 24 CO -0.15 0.39 0.41 -0.22 0.00 0.00 0.00 175.10 175.54 2o5j s LEU 25 N -1.70 -0.72 0.16 3.92 0.20 0.03 -0.97 118.68 119.61 2o5j s LEU 25 Ca 0.24 0.50 -0.18 0.00 0.69 0.00 0.00 54.13 55.38 2o5j s LEU 25 Cb -0.12 1.30 0.04 0.00 -0.43 0.00 0.00 46.19 46.98 2o5j s LEU 25 CO 0.15 -0.28 0.49 -1.83 -0.29 0.00 0.00 176.35 174.59 2o5j s GLU 26 N 2.60 1.25 0.61 1.98 1.03 -1.25 -2.70 118.70 122.21 2o5j s GLU 26 Ca 0.10 -0.73 -0.08 0.00 0.03 0.00 0.00 54.97 54.29 2o5j s GLU 26 Cb -0.15 0.52 -0.01 0.00 -0.80 0.00 0.00 34.13 33.69 2o5j s GLU 26 CO -0.16 -0.52 0.96 -2.14 -1.33 0.00 0.00 175.26 172.08 2o5j s PRO 27 N -3.82 3.17 0.08 -4.83 0.02 -1.26 -0.98 135.00 127.38 2o5j s PRO 27 Ca 0.05 0.33 0.06 0.00 0.02 0.00 0.00 61.00 61.46 2o5j s PRO 27 Cb 0.00 -2.18 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 2o5j s PRO 27 CO -0.08 -0.67 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.24 2o5j s LEU 28 N -5.09 2.27 0.00 -5.54 1.43 -0.56 -4.38 118.68 106.81 2o5j s LEU 28 Ca 0.54 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2o5j s LEU 28 Cb -0.11 -0.67 0.00 0.00 0.03 0.00 0.00 46.19 45.45 2o5j s LEU 28 CO 0.49 -0.01 0.00 -0.62 0.23 0.00 0.00 176.35 176.44 2o5j n GLU 29 N 1.30 2.76 -3.22 1.70 1.02 -1.26 -2.30 120.64 120.63 2o5j n GLU 29 Ca -0.20 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.55 2o5j n GLU 29 Cb 0.54 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.90 2o5j n GLU 29 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2o5j s ARG 30 N 0.00 4.36 -1.38 3.49 0.52 -1.26 -3.26 118.95 121.42 2o5j s ARG 30 Ca 0.00 0.59 -0.05 0.00 -0.52 0.00 0.00 55.73 55.75 2o5j s ARG 30 Cb 0.00 -3.45 0.03 0.00 0.52 0.00 0.00 34.95 32.05 2o5j s ARG 30 CO 0.00 0.11 0.42 0.41 0.02 0.00 0.00 175.30 176.26 2o5j n GLY 31 N 3.25 -0.50 0.07 -3.53 0.00 -1.26 -4.88 105.19 98.33 2o5j n GLY 31 Ca -0.05 0.08 -0.00 0.00 0.00 0.00 0.00 46.02 46.05 2o5j n GLY 31 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2o5j n PHE 32 N -4.07 0.24 -0.24 1.61 3.01 -1.26 -3.60 117.46 113.15 2o5j n PHE 32 Ca -0.09 0.08 0.03 0.00 1.01 0.00 0.00 57.45 58.48 2o5j n PHE 32 Cb 0.59 -0.85 0.26 0.00 -0.01 0.00 0.00 39.48 39.48 2o5j n PHE 32 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2o5j h GLY 33 N 3.93 1.13 1.43 1.37 0.00 -1.89 -0.43 103.07 108.61 2o5j h GLY 33 Ca -0.27 -0.38 -0.21 0.00 0.00 0.00 0.00 47.33 46.47 2o5j h GLY 33 CO 0.02 0.32 -0.82 -2.08 0.00 0.00 0.00 176.54 173.98 2o5j h VAL 34 N 0.97 1.35 0.00 4.60 2.07 -1.97 -0.60 116.25 122.66 2o5j h VAL 34 Ca 0.33 -2.18 -0.06 0.00 0.82 0.00 0.00 66.70 65.61 2o5j h VAL 34 Cb 0.08 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 2o5j h VAL 34 CO -0.10 0.66 -0.28 0.74 0.02 0.00 0.00 177.57 178.61 2o5j h THR 35 N 0.35 1.13 0.01 2.57 2.02 -1.39 -2.69 112.91 114.91 2o5j h THR 35 Ca -0.06 -0.99 -0.35 0.00 0.77 0.00 0.00 66.41 65.78 2o5j h THR 35 Cb 1.44 1.54 -0.05 0.00 -1.74 0.00 0.00 68.15 69.34 2o5j h THR 35 CO 0.15 0.28 -1.96 0.18 0.37 0.00 0.00 175.52 174.54 2o5j n LEU 36 N -4.10 2.10 -0.07 2.58 4.77 -0.25 -4.38 117.00 117.65 2o5j n LEU 36 Ca -0.02 0.31 -0.07 0.00 -0.03 0.00 0.00 56.01 56.20 2o5j n LEU 36 Cb 0.34 -0.92 -0.01 0.00 -2.33 0.00 0.00 43.42 40.49 2o5j n LEU 36 CO 0.37 0.52 0.83 1.23 -1.33 0.00 0.00 177.39 179.01 2o5j h GLY 37 N -0.46 0.21 0.87 -0.72 0.00 -1.14 -2.43 103.07 99.40 2o5j h GLY 37 Ca -0.52 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2o5j h GLY 37 CO -0.25 -0.09 -0.25 -0.57 0.00 0.00 0.00 176.54 175.39 2o5j h ASN 38 N 0.02 -0.62 -0.40 0.19 -1.24 -1.71 -0.68 115.58 111.15 2o5j h ASN 38 Ca 0.13 0.04 0.05 0.00 0.71 0.00 0.00 56.30 57.23 2o5j h ASN 38 Cb 0.19 0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.38 2o5j h ASN 38 CO -0.26 -0.39 0.13 -0.65 -1.29 0.00 0.00 177.43 174.98 2o5j h PRO 39 N -0.61 0.28 -0.88 6.67 0.11 -1.75 -0.24 132.00 135.58 2o5j h PRO 39 Ca -0.04 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.14 2o5j h PRO 39 Cb 0.51 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 31.49 2o5j h PRO 39 CO 0.04 0.18 0.57 -0.07 -0.21 0.00 0.00 178.00 178.51 2o5j h LEU 40 N 0.29 0.81 0.17 2.35 3.38 -1.33 -1.17 115.31 119.81 2o5j h LEU 40 Ca 0.19 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2o5j h LEU 40 Cb 0.18 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2o5j h LEU 40 CO -0.20 0.49 -0.08 -0.09 0.09 0.00 0.00 178.44 178.65 2o5j h ARG 41 N 0.90 -0.22 -0.59 1.13 2.43 0.26 0.47 114.38 118.76 2o5j h ARG 41 Ca 0.40 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.69 2o5j h ARG 41 Cb 0.36 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 2o5j h ARG 41 CO -0.17 -0.06 0.40 0.00 -1.51 0.00 0.00 179.97 178.63 2o5j h ARG 42 N -0.33 0.38 0.01 0.20 2.47 -0.44 -2.30 114.38 114.37 2o5j h ARG 42 Ca -0.02 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.65 2o5j h ARG 42 Cb 0.26 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2o5j h ARG 42 CO 0.04 0.25 -0.09 0.82 0.56 0.00 0.00 179.97 181.54 2o5j h ILE 43 N 0.39 1.65 -0.09 2.04 1.08 -1.01 -3.13 117.51 118.44 2o5j h ILE 43 Ca 0.27 -2.05 0.03 0.00 -0.39 0.00 0.00 64.86 62.72 2o5j h ILE 43 Cb 0.56 3.02 -0.00 0.00 -3.07 0.00 0.00 36.82 37.33 2o5j h ILE 43 CO -0.07 0.54 0.24 -0.07 -0.69 0.00 0.00 178.15 178.10 2o5j h LEU 44 N -0.77 0.00 0.02 1.44 3.38 -0.37 0.23 115.31 119.24 2o5j h LEU 44 Ca -0.01 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.56 2o5j h LEU 44 Cb 0.94 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 2o5j h LEU 44 CO 0.02 0.00 -2.28 -0.11 0.09 0.00 0.00 178.44 176.16 2o5j n LEU 45 N -3.24 2.38 -0.11 1.67 0.00 -0.94 -4.64 117.00 112.12 2o5j n LEU 45 Ca -0.00 0.17 -0.25 0.00 0.00 0.00 0.00 56.01 55.93 2o5j n LEU 45 Cb 0.32 -0.91 -0.11 0.00 0.00 0.00 0.00 43.42 42.72 2o5j n LEU 45 CO 0.20 0.69 -0.95 -1.20 0.00 0.00 0.00 177.39 176.13 2o5j n SER 46 N -3.85 1.93 0.02 1.96 7.64 -1.08 -4.62 113.62 115.61 2o5j n SER 46 Ca -0.46 0.34 -0.02 0.00 1.01 0.00 0.00 58.87 59.75 2o5j n SER 46 Cb 0.91 -0.87 -0.01 0.00 -1.01 0.00 0.00 64.21 63.23 2o5j n SER 46 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2o5j h SER 47 N -0.86 -0.16 -0.29 6.43 4.64 -0.72 -3.34 113.55 119.26 2o5j h SER 47 Ca -0.51 0.02 -0.27 0.00 -0.47 0.00 0.00 61.79 60.56 2o5j h SER 47 Cb 1.52 0.06 -0.06 0.00 -0.31 0.00 0.00 62.40 63.60 2o5j h SER 47 CO -0.27 -0.06 1.27 -0.38 -0.87 0.00 0.00 176.83 176.52 2o5j n ILE 48 N -2.71 -0.01 -0.67 0.95 -0.00 -1.22 -4.85 119.36 110.85 2o5j n ILE 48 Ca -0.01 -0.47 -0.32 0.00 -0.00 0.00 0.00 62.75 61.96 2o5j n ILE 48 Cb 0.04 -1.04 0.18 0.00 -0.00 0.00 0.00 39.64 38.82 2o5j n ILE 48 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 176.55 173.90 2o5j n PRO 49 N 7.39 -1.35 0.00 0.38 -0.02 -1.26 -4.37 135.00 135.77 2o5j n PRO 49 Ca 0.57 -0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2o5j n PRO 49 Cb 0.27 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2o5j n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 50 N 1.57 3.53 2.92 -1.23 0.00 -0.45 -4.61 105.19 106.92 2o5j n GLY 50 Ca 0.03 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2o5j n GLY 50 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2o5j s THR 51 N -0.93 -0.02 0.05 2.61 -4.23 -1.24 -2.81 115.64 109.07 2o5j s THR 51 Ca 0.00 0.07 -0.15 0.00 -1.18 0.00 0.00 61.69 60.43 2o5j s THR 51 Cb 0.00 -0.14 0.02 0.00 1.34 0.00 0.00 72.50 73.72 2o5j s THR 51 CO 0.00 0.03 0.34 0.00 -0.54 0.00 0.00 174.62 174.45 2o5j s ALA 52 N 0.44 -0.78 -0.19 3.99 0.00 -1.14 -4.60 121.76 119.48 2o5j s ALA 52 Ca -0.03 0.07 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 2o5j s ALA 52 Cb -0.05 0.36 -0.02 0.00 0.00 0.00 0.00 23.12 23.41 2o5j s ALA 52 CO -0.02 -0.45 1.49 0.08 0.00 0.00 0.00 175.76 176.87 2o5j s VAL 53 N -2.66 3.88 -0.11 0.00 1.01 -1.26 -2.55 120.40 118.71 2o5j s VAL 53 Ca -0.04 1.03 0.16 0.00 0.00 0.00 0.00 61.98 63.13 2o5j s VAL 53 Cb -0.00 -3.81 -0.20 0.00 0.00 0.00 0.00 36.38 32.37 2o5j s VAL 53 CO -0.04 -0.25 0.61 0.41 0.00 0.00 0.00 175.10 175.83 2o5j n THR 54 N 5.97 1.29 -3.59 3.92 -1.04 -0.99 -4.54 114.28 115.30 2o5j n THR 54 Ca 0.17 -0.74 -0.10 0.00 -2.04 0.00 0.00 64.05 61.33 2o5j n THR 54 Cb 0.45 -0.74 -0.03 0.00 -1.82 0.00 0.00 70.33 68.19 2o5j n THR 54 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2o5j s SER 55 N -5.75 -0.41 0.03 8.00 1.04 -1.25 -1.64 113.70 113.71 2o5j s SER 55 Ca -0.05 -0.24 -0.07 0.00 0.48 0.00 0.00 55.95 56.07 2o5j s SER 55 Cb 0.08 0.60 -0.00 0.00 0.10 0.00 0.00 66.02 66.80 2o5j s SER 55 CO 0.82 -1.03 0.12 -0.69 0.98 0.00 0.00 173.24 173.45 2o5j s VAL 56 N -3.81 0.11 -0.23 5.02 1.01 -0.86 -0.61 120.40 121.04 2o5j s VAL 56 Ca 0.05 -0.94 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 2o5j s VAL 56 Cb -0.01 -0.75 0.09 0.00 0.00 0.00 0.00 36.38 35.71 2o5j s VAL 56 CO -0.07 -0.52 0.16 -0.47 0.00 0.00 0.00 175.10 174.20 2o5j s TYR 57 N -2.22 0.01 0.04 5.22 5.04 -0.33 -1.17 117.35 123.95 2o5j s TYR 57 Ca -0.08 -0.31 -0.25 0.00 -2.44 0.00 0.00 57.07 53.99 2o5j s TYR 57 Cb -0.03 -0.63 -0.06 0.00 0.35 0.00 0.00 41.96 41.59 2o5j s TYR 57 CO -0.03 -0.68 0.75 0.42 -1.34 0.00 0.00 175.55 174.68 2o5j s ILE 58 N 2.21 4.73 0.09 3.14 -1.09 -1.26 -1.96 121.20 127.06 2o5j s ILE 58 Ca 0.06 1.60 -0.25 0.00 -2.23 0.00 0.00 60.65 59.83 2o5j s ILE 58 Cb -0.16 -4.10 -0.15 0.00 -1.58 0.00 0.00 42.46 36.47 2o5j s ILE 58 CO -0.21 0.37 1.70 -0.33 -1.23 0.00 0.00 174.94 175.25 2o5j h GLU 59 N 5.63 -0.24 -0.00 2.79 4.39 -1.80 -2.86 114.58 122.49 2o5j h GLU 59 Ca -0.44 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.28 2o5j h GLU 59 Cb 1.20 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 2o5j h GLU 59 CO 0.71 -0.16 -0.30 -0.25 -1.16 0.00 0.00 179.01 177.85 2o5j n ASP 60 N -5.21 0.76 -4.80 1.42 9.92 -1.26 -4.88 116.55 112.50 2o5j n ASP 60 Ca -0.08 -0.61 -0.39 0.00 -0.53 0.00 0.00 54.79 53.18 2o5j n ASP 60 Cb 0.13 0.12 -0.06 0.00 -0.64 0.00 0.00 41.12 40.67 2o5j n ASP 60 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2o5j s VAL 61 N -2.66 4.61 -0.17 2.53 1.01 -1.08 -4.99 120.40 119.65 2o5j s VAL 61 Ca 0.21 1.38 -0.06 0.00 0.00 0.00 0.00 61.98 63.51 2o5j s VAL 61 Cb 0.19 -3.98 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 2o5j s VAL 61 CO 0.57 0.54 -0.20 0.00 0.00 0.00 0.00 175.10 176.01 2o5j n LEU 62 N 1.65 1.68 -4.86 3.92 -0.00 -1.26 -4.63 117.00 113.49 2o5j n LEU 62 Ca -0.09 0.13 -0.21 0.00 -0.00 0.00 0.00 56.01 55.84 2o5j n LEU 62 Cb 0.50 -0.51 -0.04 0.00 -0.00 0.00 0.00 43.42 43.37 2o5j n LEU 62 CO 0.43 0.47 -0.02 -1.00 -0.00 0.00 0.00 177.39 177.27 2o5j s HIS 63 N -2.31 2.66 -0.11 1.47 3.76 -1.26 -4.69 115.29 114.81 2o5j s HIS 63 Ca -0.23 -0.51 0.24 0.00 -0.15 0.00 0.00 55.06 54.40 2o5j s HIS 63 Cb 0.08 -2.14 0.65 0.00 1.11 0.00 0.00 32.58 32.28 2o5j s HIS 63 CO 0.32 -0.10 1.71 1.49 -0.85 0.00 0.00 174.74 177.31 2o5j h GLU 64 N 1.07 0.00 -0.97 1.40 4.81 -1.96 -3.28 114.58 115.64 2o5j h GLU 64 Ca -0.41 0.00 -0.40 0.00 -0.13 0.00 0.00 59.36 58.41 2o5j h GLU 64 Cb 1.27 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 30.40 2o5j h GLU 64 CO 0.59 0.17 0.51 1.19 -0.73 0.00 0.00 179.01 180.74 2o5j n PHE 65 N -3.20 2.52 -3.32 0.92 3.01 -1.26 -3.36 117.46 112.76 2o5j n PHE 65 Ca 0.02 -1.56 -0.18 0.00 1.01 0.00 0.00 57.45 56.74 2o5j n PHE 65 Cb 0.50 -0.81 0.00 0.00 -0.01 0.00 0.00 39.48 39.16 2o5j n PHE 65 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2o5j s SER 66 N -0.91 5.86 -0.06 4.37 0.01 -1.24 -4.98 113.70 116.76 2o5j s SER 66 Ca 0.48 -0.27 0.03 0.00 1.31 0.00 0.00 55.95 57.50 2o5j s SER 66 Cb 0.40 -1.04 0.01 0.00 0.21 0.00 0.00 66.02 65.60 2o5j s SER 66 CO 0.10 -0.54 -0.16 0.28 0.41 0.00 0.00 173.24 173.33 2o5j s THR 67 N -2.23 1.37 -0.15 1.44 -1.32 -1.26 -1.71 115.64 111.77 2o5j s THR 67 Ca 0.48 -0.64 -0.12 0.00 -1.21 0.00 0.00 61.69 60.20 2o5j s THR 67 Cb -0.10 -1.21 -0.05 0.00 -1.51 0.00 0.00 72.50 69.64 2o5j s THR 67 CO 0.32 0.40 0.25 -0.63 -2.21 0.00 0.00 174.62 172.75 2o5j s ILE 68 N 0.39 5.33 0.61 5.08 1.01 -1.26 -5.00 121.20 127.37 2o5j s ILE 68 Ca -0.11 0.45 -0.19 0.00 0.00 0.00 0.00 60.65 60.79 2o5j s ILE 68 Cb -0.15 -3.57 -0.02 0.00 0.01 0.00 0.00 42.46 38.73 2o5j s ILE 68 CO 0.04 0.45 1.30 -2.84 0.00 0.00 0.00 174.94 173.89 2o5j s PRO 69 N 0.10 2.77 0.00 2.79 0.02 -1.26 -2.14 135.00 137.28 2o5j s PRO 69 Ca 0.15 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.25 2o5j s PRO 69 Cb -0.13 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.42 2o5j s PRO 69 CO 0.03 -1.43 0.00 0.41 -0.33 0.00 0.00 177.00 175.68 2o5j n GLY 70 N 0.80 0.41 2.92 0.52 0.00 -1.26 -4.44 105.19 104.14 2o5j n GLY 70 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 2o5j n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 71 N -2.09 1.40 0.11 1.61 1.01 -0.91 -0.51 120.40 121.02 2o5j s VAL 71 Ca 0.00 -1.11 -0.34 0.00 0.00 0.00 0.00 61.98 60.53 2o5j s VAL 71 Cb 0.00 -1.68 -0.13 0.00 0.00 0.00 0.00 36.38 34.56 2o5j s VAL 71 CO 0.00 -0.09 1.56 0.50 0.00 0.00 0.00 175.10 177.07 2o5j h LYS 72 N 8.00 -0.67 -7.07 2.72 3.11 -1.78 -3.42 116.57 117.45 2o5j h LYS 72 Ca -0.18 0.05 -0.55 0.00 -2.81 0.00 0.00 60.65 57.16 2o5j h LYS 72 Cb 1.08 0.15 0.13 0.00 -1.00 0.00 0.00 32.23 32.59 2o5j h LYS 72 CO 0.41 -0.45 0.55 -1.21 -2.81 0.00 0.00 179.45 175.94 2o5j s GLU 73 N -5.77 2.99 0.28 1.90 0.41 -1.26 -5.00 118.70 112.25 2o5j s GLU 73 Ca -0.16 2.08 -0.07 0.00 -0.41 0.00 0.00 54.97 56.41 2o5j s GLU 73 Cb 0.07 -2.09 -0.06 0.00 -1.78 0.00 0.00 34.13 30.26 2o5j s GLU 73 CO 0.61 -1.26 0.57 0.34 -0.49 0.00 0.00 175.26 175.03 2o5j s ASP 74 N -1.22 6.50 0.32 -0.19 2.15 -1.26 -4.50 116.67 118.47 2o5j s ASP 74 Ca 0.75 0.81 0.09 0.00 0.43 0.00 0.00 52.55 54.63 2o5j s ASP 74 Cb -0.37 -2.18 0.91 0.00 -0.30 0.00 0.00 42.92 40.98 2o5j s ASP 74 CO 0.42 -0.18 1.65 0.58 -0.17 0.00 0.00 175.17 177.47 2o5j h VAL 75 N 1.53 0.29 -0.74 1.11 2.07 -1.57 0.13 116.25 119.06 2o5j h VAL 75 Ca -0.47 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 2o5j h VAL 75 Cb 1.18 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2o5j h VAL 75 CO 0.67 0.05 0.31 0.58 0.02 0.00 0.00 177.57 179.19 2o5j h VAL 76 N 0.26 1.25 -0.03 2.57 2.07 -1.78 -0.23 116.25 120.35 2o5j h VAL 76 Ca 0.65 -0.77 -0.14 0.00 0.82 0.00 0.00 66.70 67.26 2o5j h VAL 76 Cb 1.42 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2o5j h VAL 76 CO -0.64 0.31 -0.61 -0.08 0.02 0.00 0.00 177.57 176.57 2o5j h GLU 77 N 1.06 0.11 0.19 1.57 4.57 -1.18 -2.69 114.58 118.21 2o5j h GLU 77 Ca 0.25 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 2o5j h GLU 77 Cb 0.20 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 2o5j h GLU 77 CO -0.02 0.68 -0.09 0.82 -1.18 0.00 0.00 179.01 179.22 2o5j h ILE 78 N 0.08 0.74 -0.29 2.32 2.04 -0.87 -2.38 117.51 119.14 2o5j h ILE 78 Ca -0.01 -1.05 0.08 0.00 1.00 0.00 0.00 64.86 64.89 2o5j h ILE 78 Cb 1.10 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 2o5j h ILE 78 CO 0.09 0.19 0.28 0.16 0.00 0.00 0.00 178.15 178.86 2o5j h ILE 79 N -0.89 0.53 -0.16 -0.67 -0.00 -1.12 0.18 117.51 115.38 2o5j h ILE 79 Ca -0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 64.86 64.76 2o5j h ILE 79 Cb 0.51 0.79 -0.00 0.00 -0.00 0.00 0.00 36.82 38.11 2o5j h ILE 79 CO 0.04 0.00 -0.20 0.25 -0.00 0.00 0.00 178.15 178.24 2o5j h LEU 80 N 0.00 0.46 -1.88 0.16 5.85 -1.47 -2.97 115.31 115.47 2o5j h LEU 80 Ca 0.14 -0.50 -0.02 0.00 0.84 0.00 0.00 57.88 58.33 2o5j h LEU 80 Cb 0.69 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 2o5j h LEU 80 CO -0.00 0.87 -0.11 -1.13 -0.34 0.00 0.00 178.44 177.72 2o5j h ASN 81 N 0.06 0.00 -0.03 1.25 -0.00 -0.16 -2.22 115.58 114.48 2o5j h ASN 81 Ca 0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 56.30 56.15 2o5j h ASN 81 Cb 0.76 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.07 2o5j h ASN 81 CO 0.05 0.11 -0.56 -0.07 -0.00 0.00 0.00 177.43 176.96 2o5j h LEU 82 N 0.00 0.69 -2.56 0.34 3.38 -1.05 -2.56 115.31 113.55 2o5j h LEU 82 Ca -0.00 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.61 2o5j h LEU 82 Cb 0.23 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2o5j h LEU 82 CO 0.01 1.10 0.08 0.11 0.09 0.00 0.00 178.44 179.84 2o5j h LYS 83 N 0.47 0.00 0.00 1.13 1.57 -1.24 -0.12 116.57 118.38 2o5j h LYS 83 Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2o5j h LYS 83 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2o5j h LYS 83 CO 0.11 0.00 -0.42 1.49 -0.57 0.00 0.00 179.45 180.06 2o5j h GLU 84 N 0.00 0.00 -6.36 3.15 4.81 -1.48 -3.46 114.58 111.24 2o5j h GLU 84 Ca 0.02 0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 58.71 2o5j h GLU 84 Cb 0.19 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.57 2o5j h GLU 84 CO -0.00 0.37 1.05 -0.51 -0.73 0.00 0.00 179.01 179.18 2o5j s LEU 85 N -6.36 4.35 -0.32 1.64 1.43 -0.06 -4.98 118.68 114.38 2o5j s LEU 85 Ca 0.04 2.37 -0.06 0.00 -1.03 0.00 0.00 54.13 55.45 2o5j s LEU 85 Cb 0.07 -3.55 0.03 0.00 0.03 0.00 0.00 46.19 42.77 2o5j s LEU 85 CO 0.73 -0.91 0.09 0.54 0.23 0.00 0.00 176.35 177.03 2o5j s VAL 86 N 3.38 3.83 0.28 -1.59 0.11 -1.26 -4.71 120.40 120.43 2o5j s VAL 86 Ca 0.74 -0.97 0.07 0.00 -2.93 0.00 0.00 61.98 58.89 2o5j s VAL 86 Cb -0.37 -3.09 -0.03 0.00 -1.53 0.00 0.00 36.38 31.36 2o5j s VAL 86 CO 0.32 -0.08 0.26 0.68 -3.33 0.00 0.00 175.10 172.95 2o5j s VAL 87 N 1.44 4.19 -0.26 2.04 -7.23 -1.26 -2.98 120.40 116.34 2o5j s VAL 87 Ca -0.00 -1.34 -0.04 0.00 -1.81 0.00 0.00 61.98 58.80 2o5j s VAL 87 Cb -0.19 -3.37 0.10 0.00 0.56 0.00 0.00 36.38 33.48 2o5j s VAL 87 CO 0.02 -0.28 0.17 -0.60 -0.31 0.00 0.00 175.10 174.10 2o5j s ARG 88 N -3.92 0.19 0.72 4.82 3.52 -0.32 -4.69 118.95 119.26 2o5j s ARG 88 Ca 0.36 -0.27 -0.10 0.00 -0.13 0.00 0.00 55.73 55.59 2o5j s ARG 88 Cb -0.07 -1.20 0.04 0.00 -1.56 0.00 0.00 34.95 32.15 2o5j s ARG 88 CO 0.26 -0.91 1.08 -0.06 -0.81 0.00 0.00 175.30 174.86 2o5j s PHE 89 N 2.19 3.16 -0.33 5.12 0.08 -1.26 -2.33 117.98 124.60 2o5j s PHE 89 Ca 0.07 0.83 0.12 0.00 0.12 0.00 0.00 56.93 58.08 2o5j s PHE 89 Cb -0.16 -3.15 -0.16 0.00 -0.57 0.00 0.00 43.02 38.98 2o5j s PHE 89 CO -0.28 -1.32 0.41 -0.11 -0.10 0.00 0.00 175.22 173.83 2o5j n LEU 90 N -3.02 0.32 -3.57 -0.37 0.00 -0.97 -4.96 117.00 104.42 2o5j n LEU 90 Ca 0.07 -0.28 -0.14 0.00 0.00 0.00 0.00 56.01 55.66 2o5j n LEU 90 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 43.42 43.95 2o5j n LEU 90 CO 0.56 0.08 0.28 0.54 0.00 0.00 0.00 177.39 178.85 2o5j s ASN 91 N -2.74 -0.45 0.42 1.96 2.20 -1.26 -5.04 114.94 110.03 2o5j s ASN 91 Ca 0.00 0.19 0.25 0.00 -0.94 0.00 0.00 52.86 52.37 2o5j s ASN 91 Cb 0.09 0.49 1.31 0.00 -2.00 0.00 0.00 41.25 41.14 2o5j s ASN 91 CO 0.52 -0.71 1.66 -0.65 -2.94 0.00 0.00 177.10 174.97 2o5j h PRO 92 N 2.80 0.17 -0.63 3.55 0.11 -2.02 0.13 132.00 136.11 2o5j h PRO 92 Ca -0.31 -0.01 0.18 0.00 0.11 0.00 0.00 66.00 65.98 2o5j h PRO 92 Cb 1.21 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2o5j h PRO 92 CO 0.41 0.11 0.71 0.77 -0.21 0.00 0.00 178.00 179.79 2o5j h SER 93 N 0.18 0.00 -3.64 -2.05 0.02 -2.04 -3.21 113.55 102.81 2o5j h SER 93 Ca 0.76 0.00 -0.78 0.00 -0.84 0.00 0.00 61.79 60.93 2o5j h SER 93 Cb 2.22 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 64.51 2o5j h SER 93 CO -0.42 0.00 0.21 -0.76 -1.14 0.00 0.00 176.83 174.71 2o5j s LEU 94 N -7.09 6.54 -0.19 5.07 1.43 0.46 -4.81 118.68 120.09 2o5j s LEU 94 Ca -0.04 -2.64 -0.09 0.00 -1.03 0.00 0.00 54.13 50.33 2o5j s LEU 94 Cb 0.15 -2.23 -0.21 0.00 0.03 0.00 0.00 46.19 43.93 2o5j s LEU 94 CO 0.52 -0.63 0.12 0.00 0.23 0.00 0.00 176.35 176.60 2o5j n GLN 95 N 4.26 0.67 -3.70 1.70 3.00 -1.21 -4.84 117.38 117.26 2o5j n GLN 95 Ca 0.16 0.31 -0.28 0.00 -0.01 0.00 0.00 57.00 57.18 2o5j n GLN 95 Cb 0.47 -1.65 -0.16 0.00 0.00 0.00 0.00 30.24 28.90 2o5j n GLN 95 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 2o5j s THR 96 N -2.50 0.39 -0.20 5.09 -1.32 -1.26 -3.02 115.64 112.82 2o5j s THR 96 Ca -0.28 -0.57 -0.04 0.00 -1.21 0.00 0.00 61.69 59.58 2o5j s THR 96 Cb 0.08 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.06 2o5j s THR 96 CO 0.66 -0.30 -0.04 -0.69 -2.21 0.00 0.00 174.62 172.03 2o5j s VAL 97 N 1.91 3.48 -0.41 5.08 1.01 -0.51 -4.94 120.40 126.02 2o5j s VAL 97 Ca 0.01 -0.47 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 2o5j s VAL 97 Cb -0.17 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.66 2o5j s VAL 97 CO -0.12 0.44 0.43 -0.89 0.00 0.00 0.00 175.10 174.96 2o5j s THR 98 N 1.21 5.09 0.02 3.92 2.01 -1.26 -0.81 115.64 125.81 2o5j s THR 98 Ca 0.03 -0.25 -0.28 0.00 0.31 0.00 0.00 61.69 61.49 2o5j s THR 98 Cb -0.14 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 2o5j s THR 98 CO -0.01 -0.37 0.90 -0.76 -0.69 0.00 0.00 174.62 173.69 2o5j s LEU 99 N 2.15 4.40 -0.05 4.42 1.02 -0.31 -4.91 118.68 125.40 2o5j s LEU 99 Ca 0.13 1.58 0.03 0.00 0.02 0.00 0.00 54.13 55.88 2o5j s LEU 99 Cb -0.17 -3.44 -0.03 0.00 0.02 0.00 0.00 46.19 42.57 2o5j s LEU 99 CO 0.13 -0.15 -0.12 -0.76 0.02 0.00 0.00 176.35 175.48 2o5j s LEU 100 N 0.57 2.88 -0.18 1.79 1.43 -1.26 -1.54 118.68 122.36 2o5j s LEU 100 Ca 0.46 -0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 53.21 2o5j s LEU 100 Cb -0.21 -1.60 0.06 0.00 0.03 0.00 0.00 46.19 44.47 2o5j s LEU 100 CO 0.26 0.35 0.58 -0.22 0.23 0.00 0.00 176.35 177.55 2o5j s LEU 101 N -0.77 -0.23 -0.16 1.79 0.20 -1.10 -1.49 118.68 116.92 2o5j s LEU 101 Ca 0.12 1.03 -0.07 0.00 0.69 0.00 0.00 54.13 55.89 2o5j s LEU 101 Cb -0.11 2.04 0.07 0.00 -0.43 0.00 0.00 46.19 47.76 2o5j s LEU 101 CO 0.01 -0.29 0.37 -0.75 -0.29 0.00 0.00 176.35 175.40 2o5j s LYS 102 N -0.05 0.30 0.03 1.98 2.20 -1.26 -1.73 119.74 121.21 2o5j s LYS 102 Ca -0.03 0.84 0.01 0.00 -0.36 0.00 0.00 55.97 56.43 2o5j s LYS 102 Cb -0.04 0.08 -0.02 0.00 -1.51 0.00 0.00 37.83 36.35 2o5j s LYS 102 CO 0.03 -0.21 -0.06 0.00 -0.36 0.00 0.00 175.35 174.74 2o5j s ALA 103 N 1.98 0.40 0.11 3.13 0.00 -0.48 -5.01 121.76 121.90 2o5j s ALA 103 Ca -0.05 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.35 2o5j s ALA 103 Cb -0.10 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2o5j s ALA 103 CO -0.12 -0.03 -0.09 -1.21 0.00 0.00 0.00 175.76 174.31 2o5j s GLU 104 N -1.22 0.91 2.02 0.00 2.02 -1.26 -2.57 118.70 118.59 2o5j s GLU 104 Ca -0.09 -1.32 0.00 0.00 0.02 0.00 0.00 54.97 53.58 2o5j s GLU 104 Cb -0.08 -0.44 0.00 0.00 0.10 0.00 0.00 34.13 33.71 2o5j s GLU 104 CO -0.00 0.04 0.00 0.41 0.02 0.00 0.00 175.26 175.73 2o5j n GLY 105 N 0.08 -1.44 1.90 -1.39 0.00 -0.92 -4.40 105.19 99.01 2o5j n GLY 105 Ca -0.13 -1.30 -0.01 0.00 0.00 0.00 0.00 46.02 44.58 2o5j n GLY 105 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 106 N -0.00 0.56 -4.37 1.61 -0.02 -0.69 -4.08 135.00 128.01 2o5j n PRO 106 Ca 0.00 -0.11 -0.28 0.00 -2.02 0.00 0.00 63.50 61.09 2o5j n PRO 106 Cb 0.00 -1.39 -0.11 0.00 -0.02 0.00 0.00 33.50 31.98 2o5j n PRO 106 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2o5j s LYS 107 N 1.34 1.66 -0.10 -0.52 -2.85 -1.22 -4.94 119.74 113.12 2o5j s LYS 107 Ca 0.07 -1.39 -0.25 0.00 -1.00 0.00 0.00 55.97 53.41 2o5j s LYS 107 Cb 0.04 -1.96 -0.03 0.00 -2.06 0.00 0.00 37.83 33.81 2o5j s LYS 107 CO 0.00 0.43 0.77 -1.21 0.10 0.00 0.00 175.35 175.44 2o5j s GLU 108 N -2.54 4.39 -0.45 1.78 2.02 -1.26 -2.34 118.70 120.29 2o5j s GLU 108 Ca 0.20 0.97 -0.20 0.00 0.02 0.00 0.00 54.97 55.97 2o5j s GLU 108 Cb -0.09 -3.50 0.03 0.00 0.10 0.00 0.00 34.13 30.67 2o5j s GLU 108 CO 0.11 -0.10 0.60 0.08 0.02 0.00 0.00 175.26 175.96 2o5j s VAL 109 N 1.35 4.89 0.40 2.63 1.01 -0.13 -4.99 120.40 125.56 2o5j s VAL 109 Ca 0.39 -0.14 0.08 0.00 0.00 0.00 0.00 61.98 62.31 2o5j s VAL 109 Cb -0.18 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 2o5j s VAL 109 CO 0.17 -0.62 0.49 -1.59 0.00 0.00 0.00 175.10 173.55 2o5j s LYS 110 N 2.64 2.79 0.29 2.72 -2.85 -1.26 -0.16 119.74 123.91 2o5j s LYS 110 Ca 0.18 -1.28 0.25 0.00 -1.00 0.00 0.00 55.97 54.12 2o5j s LYS 110 Cb -0.16 -2.66 1.02 0.00 -2.06 0.00 0.00 37.83 33.97 2o5j s LYS 110 CO 0.16 -0.18 1.74 0.00 0.10 0.00 0.00 175.35 177.17 2o5j h ALA 111 N 0.81 1.00 0.00 0.59 0.00 -0.24 -2.58 119.26 118.83 2o5j h ALA 111 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2o5j h ALA 111 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2o5j h ALA 111 CO 0.50 0.00 0.00 0.07 0.00 0.00 0.00 179.25 179.82 2o5j h ARG 112 N 0.00 0.00 0.00 0.00 0.11 -1.70 -3.17 114.38 109.62 2o5j h ARG 112 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2o5j h ARG 112 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 2o5j h ARG 112 CO 0.00 0.00 0.00 -3.47 0.10 0.00 0.00 179.97 176.60 2o5j n ASP 113 N -2.47 0.50 -4.73 0.08 2.03 -0.97 -4.77 116.55 106.22 2o5j n ASP 113 Ca 0.04 0.63 -0.42 0.00 0.52 0.00 0.00 54.79 55.56 2o5j n ASP 113 Cb 0.39 -0.73 -0.03 0.00 -0.72 0.00 0.00 41.12 40.03 2o5j n ASP 113 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2o5j s PHE 114 N -3.24 3.11 0.07 -0.67 0.40 -1.20 -4.74 117.98 111.71 2o5j s PHE 114 Ca 0.05 0.99 -0.31 0.00 -0.60 0.00 0.00 56.93 57.05 2o5j s PHE 114 Cb 0.09 -3.77 -0.10 0.00 0.51 0.00 0.00 43.02 39.75 2o5j s PHE 114 CO 0.35 -2.59 1.89 1.47 0.70 0.00 0.00 175.22 177.04 2o5j n LEU 115 N 2.93 3.99 -4.71 -0.37 -0.00 -0.56 -4.90 117.00 113.38 2o5j n LEU 115 Ca 0.09 0.96 -0.43 0.00 -0.00 0.00 0.00 56.01 56.62 2o5j n LEU 115 Cb 0.41 -1.51 -0.02 0.00 -0.00 0.00 0.00 43.42 42.30 2o5j n LEU 115 CO 0.60 0.14 1.09 -2.65 -0.00 0.00 0.00 177.39 176.57 2o5j n PRO 116 N 6.36 2.36 -4.57 1.47 -0.02 -1.26 -4.64 135.00 134.70 2o5j n PRO 116 Ca 0.19 0.84 -0.34 0.00 -2.02 0.00 0.00 63.50 62.17 2o5j n PRO 116 Cb 0.37 -2.53 -0.11 0.00 -0.02 0.00 0.00 33.50 31.21 2o5j n PRO 116 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2o5j s VAL 117 N -0.31 3.79 0.04 -1.45 1.01 -1.26 -5.06 120.40 117.16 2o5j s VAL 117 Ca 0.63 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 62.09 2o5j s VAL 117 Cb -0.56 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 2o5j s VAL 117 CO 0.53 0.58 1.02 0.00 0.00 0.00 0.00 175.10 177.23 2o5j n ALA 118 N 2.42 -0.17 1.20 5.51 0.00 -1.26 -2.18 120.51 126.03 2o5j n ALA 118 Ca -0.18 0.22 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2o5j n ALA 118 Cb 0.53 0.27 0.37 0.00 0.00 0.00 0.00 19.45 20.62 2o5j n ALA 118 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2o5j n ASP 119 N -3.53 2.05 -4.69 0.00 9.92 -1.26 -4.92 116.55 114.11 2o5j n ASP 119 Ca 0.01 -1.71 -0.32 0.00 -0.53 0.00 0.00 54.79 52.24 2o5j n ASP 119 Cb 0.07 -0.06 -0.08 0.00 -0.64 0.00 0.00 41.12 40.41 2o5j n ASP 119 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2o5j s VAL 120 N -1.89 4.18 0.07 2.53 1.01 -0.93 -2.30 120.40 123.07 2o5j s VAL 120 Ca 0.35 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.71 2o5j s VAL 120 Cb 0.20 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 2o5j s VAL 120 CO 0.31 0.31 -0.16 -0.70 0.00 0.00 0.00 175.10 174.85 2o5j s GLU 121 N -1.76 0.96 -0.36 2.72 2.12 -0.99 -4.40 118.70 116.99 2o5j s GLU 121 Ca 0.21 -0.95 -0.01 0.00 0.36 0.00 0.00 54.97 54.58 2o5j s GLU 121 Cb -0.12 -1.04 0.09 0.00 0.26 0.00 0.00 34.13 33.32 2o5j s GLU 121 CO 0.13 0.24 0.10 0.42 -0.54 0.00 0.00 175.26 175.61 2o5j s ILE 122 N -1.11 2.98 -1.94 -3.70 1.01 -1.26 -1.18 121.20 116.01 2o5j s ILE 122 Ca 0.02 -1.90 0.29 0.00 0.00 0.00 0.00 60.65 59.06 2o5j s ILE 122 Cb -0.09 -2.96 0.59 0.00 0.01 0.00 0.00 42.46 40.00 2o5j s ILE 122 CO 0.02 -0.48 1.92 0.23 0.00 0.00 0.00 174.94 176.63 2o5j n MET 123 N 4.53 1.00 -3.12 2.79 2.81 -1.16 -4.18 117.12 119.79 2o5j n MET 123 Ca -0.05 -0.35 -0.28 0.00 -1.81 0.00 0.00 57.70 55.22 2o5j n MET 123 Cb 0.42 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.39 2o5j n MET 123 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2o5j n ASN 124 N -0.70 4.34 0.30 7.83 5.15 -1.24 -4.96 115.26 125.99 2o5j n ASN 124 Ca 0.18 -3.59 -0.12 0.00 -0.60 0.00 0.00 54.58 50.45 2o5j n ASN 124 Cb 0.25 -0.63 -0.06 0.00 -0.53 0.00 0.00 39.78 38.81 2o5j n ASN 124 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2o5j h PRO 125 N 3.53 -0.74 0.00 1.20 0.11 -1.89 -3.28 132.00 130.92 2o5j h PRO 125 Ca 0.17 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2o5j h PRO 125 Cb 0.56 0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2o5j h PRO 125 CO 0.85 -0.50 0.00 -0.25 -0.21 0.00 0.00 178.00 177.89 2o5j n ASP 126 N -4.33 0.00 -4.71 -2.05 8.00 -1.26 -0.44 116.55 111.76 2o5j n ASP 126 Ca -0.10 -0.81 -0.43 0.00 0.71 0.00 0.00 54.79 54.17 2o5j n ASP 126 Cb 0.30 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2o5j n ASP 126 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2o5j n LEU 127 N -0.72 3.83 -4.63 0.64 7.94 -1.24 -4.79 117.00 118.03 2o5j n LEU 127 Ca 0.05 1.08 -0.43 0.00 -1.11 0.00 0.00 56.01 55.60 2o5j n LEU 127 Cb 0.02 -1.54 -0.03 0.00 0.53 0.00 0.00 43.42 42.40 2o5j n LEU 127 CO 0.04 0.07 0.85 -2.28 -1.11 0.00 0.00 177.39 174.96 2o5j s HIS 128 N 0.95 3.14 -0.16 1.96 5.65 -1.26 -2.17 115.29 123.40 2o5j s HIS 128 Ca 0.74 1.04 -0.11 0.00 0.25 0.00 0.00 55.06 56.98 2o5j s HIS 128 Cb -0.54 -3.60 -0.23 0.00 -1.18 0.00 0.00 32.58 27.02 2o5j s HIS 128 CO 0.36 -0.75 0.26 -0.89 -0.65 0.00 0.00 174.74 173.07 2o5j n ILE 129 N 5.84 1.68 -3.72 0.89 2.08 0.77 -4.94 119.36 121.96 2o5j n ILE 129 Ca 0.10 -0.45 -0.02 0.00 0.56 0.00 0.00 62.75 62.94 2o5j n ILE 129 Cb 0.47 -1.82 -0.01 0.00 -0.75 0.00 0.00 39.64 37.53 2o5j n ILE 129 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2o5j s ALA 130 N -2.49 -1.81 -0.26 -1.39 0.00 -1.07 -4.76 121.76 109.98 2o5j s ALA 130 Ca -0.26 0.28 0.03 0.00 0.00 0.00 0.00 51.96 52.01 2o5j s ALA 130 Cb 0.07 0.56 0.06 0.00 0.00 0.00 0.00 23.12 23.81 2o5j s ALA 130 CO 0.69 -1.05 -0.11 0.95 0.00 0.00 0.00 175.76 176.25 2o5j s THR 131 N -3.06 2.18 -0.13 0.00 -4.23 -1.26 -0.96 115.64 108.19 2o5j s THR 131 Ca 0.13 -1.61 -0.10 0.00 -1.18 0.00 0.00 61.69 58.92 2o5j s THR 131 Cb 0.00 -2.28 -0.05 0.00 1.34 0.00 0.00 72.50 71.52 2o5j s THR 131 CO 0.01 -0.01 0.21 -0.76 -0.54 0.00 0.00 174.62 173.52 2o5j s LEU 132 N 1.11 4.33 0.00 4.79 1.02 -0.99 -2.84 118.68 126.10 2o5j s LEU 132 Ca -0.09 0.49 0.00 0.00 0.02 0.00 0.00 54.13 54.55 2o5j s LEU 132 Cb -0.20 -2.21 0.00 0.00 0.02 0.00 0.00 46.19 43.80 2o5j s LEU 132 CO -0.05 0.28 0.00 1.21 0.02 0.00 0.00 176.35 177.81 2o5j n GLU 133 N 2.64 0.00 -3.95 1.70 4.07 0.33 -3.36 120.64 122.07 2o5j n GLU 133 Ca -0.17 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 56.83 2o5j n GLU 133 Cb 0.53 0.00 -0.12 0.00 -0.06 0.00 0.00 31.44 31.79 2o5j n GLU 133 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2o5j s GLU 134 N 0.01 0.22 -1.48 5.31 -6.30 -1.26 -1.70 118.70 113.51 2o5j s GLU 134 Ca 0.00 -0.42 0.00 0.00 -2.50 0.00 0.00 54.97 52.05 2o5j s GLU 134 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 34.13 34.19 2o5j s GLU 134 CO 0.00 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.66 2o5j n GLY 135 N 2.08 0.01 3.53 -1.50 0.00 -1.26 -4.65 105.19 103.40 2o5j n GLY 135 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2o5j n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2o5j s GLY 136 N -2.12 1.24 -0.37 -0.02 0.00 -1.26 -4.77 107.32 100.01 2o5j s GLY 136 Ca 0.00 -1.28 -0.12 0.00 0.00 0.00 0.00 44.72 43.32 2o5j s GLY 136 CO 0.00 2.27 0.23 -1.60 0.00 0.00 0.00 173.10 174.00 2o5j s ARG 137 N 4.54 3.00 -0.23 2.90 3.00 -1.26 -2.18 118.95 128.72 2o5j s ARG 137 Ca 0.33 -0.97 -0.01 0.00 -1.00 0.00 0.00 55.73 54.08 2o5j s ARG 137 Cb -0.11 -3.78 0.06 0.00 0.00 0.00 0.00 34.95 31.12 2o5j s ARG 137 CO 0.18 -0.65 -0.01 -1.17 0.00 0.00 0.00 175.30 173.65 2o5j s LEU 138 N 1.61 2.06 -0.25 -0.88 2.96 -1.06 -4.98 118.68 118.14 2o5j s LEU 138 Ca 0.04 -1.08 -0.00 0.00 -0.22 0.00 0.00 54.13 52.86 2o5j s LEU 138 Cb -0.19 -0.95 0.07 0.00 0.50 0.00 0.00 46.19 45.63 2o5j s LEU 138 CO 0.08 -0.27 0.01 0.21 -1.32 0.00 0.00 176.35 175.06 2o5j s ASN 139 N 1.57 3.75 0.22 3.68 2.47 -1.26 -1.38 114.94 123.99 2o5j s ASN 139 Ca -0.03 -1.28 0.02 0.00 0.42 0.00 0.00 52.86 51.99 2o5j s ASN 139 Cb -0.18 -1.00 -0.05 0.00 -1.45 0.00 0.00 41.25 38.57 2o5j s ASN 139 CO -0.08 -0.31 0.03 0.00 -3.72 0.00 0.00 177.10 173.02 2o5j s MET 140 N 1.52 1.28 -0.20 0.43 0.23 -0.71 -1.94 119.30 119.92 2o5j s MET 140 Ca 0.00 -1.65 -0.02 0.00 -1.03 0.00 0.00 55.69 52.99 2o5j s MET 140 Cb -0.18 -0.39 0.06 0.00 -1.53 0.00 0.00 34.83 32.79 2o5j s MET 140 CO -0.11 -0.17 0.01 -1.21 -2.03 0.00 0.00 175.02 171.51 2o5j s GLU 141 N -3.93 0.91 -0.29 3.16 2.02 -0.83 -2.71 118.70 117.03 2o5j s GLU 141 Ca 0.30 -0.54 -0.06 0.00 0.02 0.00 0.00 54.97 54.68 2o5j s GLU 141 Cb 0.06 -2.18 0.01 0.00 0.10 0.00 0.00 34.13 32.13 2o5j s GLU 141 CO 0.08 -0.61 0.07 0.14 0.02 0.00 0.00 175.26 174.96 2o5j s VAL 142 N 1.75 3.91 0.61 2.63 -7.23 -0.59 -1.18 120.40 120.29 2o5j s VAL 142 Ca -0.02 -0.68 -0.16 0.00 -1.81 0.00 0.00 61.98 59.31 2o5j s VAL 142 Cb -0.17 -3.00 -0.03 0.00 0.56 0.00 0.00 36.38 33.74 2o5j s VAL 142 CO -0.07 0.10 1.09 -0.13 -0.31 0.00 0.00 175.10 175.77 2o5j s ARG 143 N 1.49 3.15 -0.03 4.82 0.52 0.22 -1.16 118.95 127.96 2o5j s ARG 143 Ca 0.03 1.33 -0.01 0.00 -0.52 0.00 0.00 55.73 56.56 2o5j s ARG 143 Cb -0.17 -2.00 0.03 0.00 0.52 0.00 0.00 34.95 33.33 2o5j s ARG 143 CO 0.02 -0.96 0.06 0.08 0.02 0.00 0.00 175.30 174.52 2o5j s VAL 144 N -2.30 -0.05 0.28 3.52 1.01 0.01 -2.36 120.40 120.52 2o5j s VAL 144 Ca 0.66 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.85 2o5j s VAL 144 Cb -0.19 -0.12 -0.06 0.00 0.00 0.00 0.00 36.38 36.02 2o5j s VAL 144 CO 0.36 0.07 0.03 -1.81 0.00 0.00 0.00 175.10 173.75 2o5j s ASP 145 N 0.89 2.13 -0.29 3.32 -0.00 -1.06 -1.42 116.67 120.25 2o5j s ASP 145 Ca -0.07 -1.31 -0.05 0.00 -0.00 0.00 0.00 52.55 51.12 2o5j s ASP 145 Cb -0.10 -0.04 0.02 0.00 -0.00 0.00 0.00 42.92 42.80 2o5j s ASP 145 CO -0.03 -0.56 0.04 0.00 -0.00 0.00 0.00 175.17 174.62 2o5j s ARG 146 N -3.88 2.95 0.00 8.23 1.70 -1.17 -2.86 118.95 123.93 2o5j s ARG 146 Ca 0.33 -0.94 0.00 0.00 -0.47 0.00 0.00 55.73 54.66 2o5j s ARG 146 Cb 0.07 -3.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.17 2o5j s ARG 146 CO 0.13 -0.46 0.00 0.41 -1.08 0.00 0.00 175.30 174.29 2o5j n GLY 147 N 4.80 4.05 3.01 3.88 0.00 -1.12 -4.97 105.19 114.84 2o5j n GLY 147 Ca -0.15 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.78 2o5j n GLY 147 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2o5j s VAL 148 N -1.66 0.05 0.00 1.61 -7.23 -1.26 -1.80 120.40 110.11 2o5j s VAL 148 Ca 0.00 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.75 2o5j s VAL 148 Cb 0.00 -0.25 0.00 0.00 0.56 0.00 0.00 36.38 36.69 2o5j s VAL 148 CO 0.00 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 2o5j n GLY 149 N 2.23 -0.11 3.40 2.32 0.00 -1.25 -4.78 105.19 107.00 2o5j n GLY 149 Ca -0.18 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 2o5j n GLY 149 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2o5j s TYR 150 N 0.00 2.85 -0.29 1.61 5.04 -1.26 -2.81 117.35 122.49 2o5j s TYR 150 Ca 0.00 -0.55 0.01 0.00 -2.44 0.00 0.00 57.07 54.09 2o5j s TYR 150 Cb 0.00 -1.86 0.08 0.00 0.35 0.00 0.00 41.96 40.54 2o5j s TYR 150 CO 0.00 -0.16 0.03 0.08 -1.34 0.00 0.00 175.55 174.16 2o5j s VAL 151 N 0.31 1.47 0.49 3.14 1.01 -0.98 -4.99 120.40 120.85 2o5j s VAL 151 Ca -0.09 -1.57 -0.22 0.00 0.00 0.00 0.00 61.98 60.11 2o5j s VAL 151 Cb -0.15 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.17 2o5j s VAL 151 CO 0.05 -0.44 0.85 -2.65 0.00 0.00 0.00 175.10 172.91 2o5j n PRO 152 N 4.63 0.98 0.29 2.72 -0.02 -1.26 -1.14 135.00 141.20 2o5j n PRO 152 Ca -0.04 0.36 0.18 0.00 -2.02 0.00 0.00 63.50 61.99 2o5j n PRO 152 Cb 0.43 -1.93 0.98 0.00 -0.02 0.00 0.00 33.50 32.95 2o5j n PRO 152 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2o5j h ALA 153 N 0.96 1.41 -0.05 3.55 0.00 -1.91 -0.53 119.26 122.69 2o5j h ALA 153 Ca -0.45 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.26 2o5j h ALA 153 Cb 1.36 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2o5j h ALA 153 CO 0.53 -0.16 -0.80 1.49 0.00 0.00 0.00 179.25 180.31 2o5j h GLU 154 N 0.00 0.38 -0.04 0.00 4.81 -1.93 -2.57 114.58 115.23 2o5j h GLU 154 Ca 0.03 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 58.90 2o5j h GLU 154 Cb 0.28 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 2o5j h GLU 154 CO -0.00 1.00 -0.01 0.87 -0.73 0.00 0.00 179.01 180.14 2o5j h LYS 155 N 0.24 0.09 0.10 1.92 6.56 -1.42 -3.37 116.57 120.69 2o5j h LYS 155 Ca -0.05 -0.04 -0.37 0.00 -1.06 0.00 0.00 60.65 59.14 2o5j h LYS 155 Cb 1.40 -0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 33.03 2o5j h LYS 155 CO 0.14 0.45 -2.09 -2.39 -2.06 0.00 0.00 179.45 173.49 2o5j n HIS 156 N -4.84 0.99 -3.08 -1.35 1.44 -1.21 -5.04 115.22 102.12 2o5j n HIS 156 Ca -0.07 0.21 -0.19 0.00 -2.01 0.00 0.00 57.72 55.66 2o5j n HIS 156 Cb 0.22 -1.13 0.02 0.00 0.12 0.00 0.00 29.99 29.22 2o5j n HIS 156 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2o5j n GLY 157 N 2.04 -0.87 3.81 -1.39 0.00 -0.97 -4.95 105.19 102.86 2o5j n GLY 157 Ca -0.35 1.19 -0.36 0.00 0.00 0.00 0.00 46.02 46.50 2o5j n GLY 157 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o5j s ILE 158 N -2.16 4.49 -0.40 -0.61 -1.09 -1.26 -5.04 121.20 115.13 2o5j s ILE 158 Ca 0.29 1.39 0.08 0.00 -2.23 0.00 0.00 60.65 60.17 2o5j s ILE 158 Cb -0.06 -3.86 0.24 0.00 -1.58 0.00 0.00 42.46 37.21 2o5j s ILE 158 CO 0.80 0.13 0.52 2.29 -1.23 0.00 0.00 174.94 177.44 2o5j n LYS 159 N 0.52 0.67 0.12 2.79 0.00 -1.26 -4.48 118.16 116.51 2o5j n LYS 159 Ca -0.00 -3.16 -0.13 0.00 -0.00 0.00 0.00 58.31 55.02 2o5j n LYS 159 Cb 0.51 -1.26 -0.08 0.00 -0.00 0.00 0.00 35.03 34.20 2o5j n LYS 159 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2o5j h ASP 160 N 4.14 -0.27 -3.62 -5.58 3.58 -1.96 -3.44 116.42 109.27 2o5j h ASP 160 Ca 0.08 -0.24 -0.67 0.00 0.42 0.00 0.00 57.03 56.62 2o5j h ASP 160 Cb 0.89 0.07 -0.17 0.00 1.72 0.00 0.00 39.33 41.84 2o5j h ASP 160 CO 0.45 0.13 -0.72 -0.60 -2.88 0.00 0.00 179.24 175.62 2o5j s ARG 161 N -4.44 2.39 0.41 0.28 6.06 -1.26 -5.04 118.95 117.35 2o5j s ARG 161 Ca -0.14 -0.84 0.11 0.00 -2.50 0.00 0.00 55.73 52.36 2o5j s ARG 161 Cb 0.02 -2.42 0.88 0.00 0.06 0.00 0.00 34.95 33.49 2o5j s ARG 161 CO 0.55 0.57 1.97 -0.84 -2.50 0.00 0.00 175.30 175.05 2o5j h ILE 162 N 3.57 1.14 -0.06 4.11 -0.00 -1.98 -2.25 117.51 122.03 2o5j h ILE 162 Ca -0.48 -0.59 0.00 0.00 -0.00 0.00 0.00 64.86 63.79 2o5j h ILE 162 Cb 1.17 1.12 0.00 0.00 -0.00 0.00 0.00 36.82 39.10 2o5j h ILE 162 CO 0.53 0.19 0.00 0.59 -0.00 0.00 0.00 178.15 179.46 2o5j n ASN 163 N -4.34 1.65 -4.75 2.16 4.13 -1.26 -4.93 115.26 107.92 2o5j n ASN 163 Ca -0.01 -1.59 -0.31 0.00 1.68 0.00 0.00 54.58 54.36 2o5j n ASN 163 Cb 0.22 -0.03 0.11 0.00 -1.54 0.00 0.00 39.78 38.53 2o5j n ASN 163 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2o5j s ALA 164 N -1.93 2.06 -0.14 5.41 0.00 -0.85 -4.62 121.76 121.69 2o5j s ALA 164 Ca 0.36 0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.64 2o5j s ALA 164 Cb 0.20 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 20.04 2o5j s ALA 164 CO 0.31 -1.99 -0.17 0.42 0.00 0.00 0.00 175.76 174.34 2o5j s ILE 165 N -2.86 1.69 0.79 0.00 1.01 -0.32 -4.97 121.20 116.54 2o5j s ILE 165 Ca 0.62 -0.73 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 2o5j s ILE 165 Cb -0.18 -1.54 0.07 0.00 0.01 0.00 0.00 42.46 40.82 2o5j s ILE 165 CO 0.56 0.48 1.14 -2.84 0.00 0.00 0.00 174.94 174.28 2o5j s PRO 166 N 1.17 1.92 0.06 2.79 0.02 -1.26 -2.02 135.00 137.68 2o5j s PRO 166 Ca -0.01 1.47 0.05 0.00 0.02 0.00 0.00 61.00 62.52 2o5j s PRO 166 Cb -0.14 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 2o5j s PRO 166 CO -0.06 -1.94 -0.14 0.08 -0.33 0.00 0.00 177.00 174.61 2o5j s VAL 167 N -2.52 1.13 0.16 3.83 1.01 -0.65 -4.87 120.40 118.49 2o5j s VAL 167 Ca 0.67 -1.19 -0.33 0.00 0.00 0.00 0.00 61.98 61.13 2o5j s VAL 167 Cb -0.22 -1.06 -0.13 0.00 0.00 0.00 0.00 36.38 34.97 2o5j s VAL 167 CO 0.52 -0.13 1.67 0.47 0.00 0.00 0.00 175.10 177.63 2o5j n ASP 168 N 1.52 3.54 -4.68 3.32 8.00 -1.26 -4.29 116.55 122.70 2o5j n ASP 168 Ca -0.20 1.06 -0.41 0.00 0.71 0.00 0.00 54.79 55.95 2o5j n ASP 168 Cb 0.54 -1.49 -0.05 0.00 -0.02 0.00 0.00 41.12 40.11 2o5j n ASP 168 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2o5j s ALA 169 N 1.37 3.49 -0.41 2.24 0.00 -0.29 -4.77 121.76 123.38 2o5j s ALA 169 Ca 0.79 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.74 2o5j s ALA 169 Cb -0.60 -3.12 0.11 0.00 0.00 0.00 0.00 23.12 19.51 2o5j s ALA 169 CO 0.36 -0.53 0.16 0.14 0.00 0.00 0.00 175.76 175.90 2o5j s VAL 170 N 1.85 2.74 -2.01 0.00 -7.23 -1.26 -2.31 120.40 112.18 2o5j s VAL 170 Ca 0.36 -2.48 0.18 0.00 -1.81 0.00 0.00 61.98 58.23 2o5j s VAL 170 Cb -0.17 -2.93 0.31 0.00 0.56 0.00 0.00 36.38 34.15 2o5j s VAL 170 CO 0.13 -0.68 1.24 0.49 -0.31 0.00 0.00 175.10 175.96 2o5j n PHE 171 N 4.09 0.33 -4.46 2.82 3.72 -1.12 -3.87 117.46 118.97 2o5j n PHE 171 Ca 0.03 -0.21 -0.34 0.00 -0.05 0.00 0.00 57.45 56.87 2o5j n PHE 171 Cb 0.40 -0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.83 2o5j n PHE 171 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2o5j s SER 172 N -1.32 5.01 0.00 4.37 0.15 -1.26 -1.34 113.70 119.30 2o5j s SER 172 Ca 0.29 0.07 0.23 0.00 0.70 0.00 0.00 55.95 57.25 2o5j s SER 172 Cb 0.18 -1.38 1.02 0.00 -1.71 0.00 0.00 66.02 64.13 2o5j s SER 172 CO 0.25 0.36 1.75 -2.65 1.20 0.00 0.00 173.24 174.15 2o5j n PRO 173 N 2.25 0.05 -3.72 5.44 -0.02 -1.26 -4.64 135.00 133.10 2o5j n PRO 173 Ca -0.18 0.09 -0.37 0.00 -2.02 0.00 0.00 63.50 61.02 2o5j n PRO 173 Cb 0.53 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.40 2o5j n PRO 173 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2o5j s VAL 174 N -2.94 4.83 -0.07 -1.45 1.01 -1.26 0.73 120.40 121.24 2o5j s VAL 174 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 61.98 61.91 2o5j s VAL 174 Cb 0.15 -3.26 -0.30 0.00 0.00 0.00 0.00 36.38 32.98 2o5j s VAL 174 CO 0.42 0.32 0.75 0.03 0.00 0.00 0.00 175.10 176.62 2o5j h ARG 175 N 8.02 0.27 -2.84 2.72 2.47 -1.62 -3.47 114.38 119.93 2o5j h ARG 175 Ca -0.37 -0.46 -0.12 0.00 -1.26 0.00 0.00 59.98 57.78 2o5j h ARG 175 Cb 1.18 0.17 -0.22 0.00 -1.65 0.00 0.00 29.97 29.45 2o5j h ARG 175 CO 0.59 1.22 -0.22 -0.98 0.56 0.00 0.00 179.97 181.14 2o5j s ARG 176 N -2.44 0.62 0.17 0.04 1.70 -1.25 -5.04 118.95 112.75 2o5j s ARG 176 Ca -0.16 0.16 0.11 0.00 -0.47 0.00 0.00 55.73 55.37 2o5j s ARG 176 Cb 0.02 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.64 2o5j s ARG 176 CO 0.80 -0.14 -0.25 0.14 -1.08 0.00 0.00 175.30 174.77 2o5j s VAL 177 N -0.68 2.32 -0.23 4.99 -7.23 -1.26 -1.34 120.40 116.97 2o5j s VAL 177 Ca -0.08 -1.94 -0.17 0.00 -1.81 0.00 0.00 61.98 57.99 2o5j s VAL 177 Cb -0.04 -2.08 0.06 0.00 0.56 0.00 0.00 36.38 34.88 2o5j s VAL 177 CO 0.03 -0.04 0.58 0.00 -0.31 0.00 0.00 175.10 175.36 2o5j s ALA 178 N -1.46 -1.50 0.04 1.32 0.00 -0.40 -4.98 121.76 114.78 2o5j s ALA 178 Ca 0.18 1.88 0.03 0.00 0.00 0.00 0.00 51.96 54.06 2o5j s ALA 178 Cb -0.09 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 2o5j s ALA 178 CO 0.08 -0.31 -0.10 -0.59 0.00 0.00 0.00 175.76 174.85 2o5j s PHE 179 N 0.97 0.88 -0.01 0.00 -0.12 -1.26 0.11 117.98 118.54 2o5j s PHE 179 Ca -0.05 -0.39 0.04 0.00 -0.05 0.00 0.00 56.93 56.48 2o5j s PHE 179 Cb -0.05 -0.52 -0.01 0.00 -0.63 0.00 0.00 43.02 41.81 2o5j s PHE 179 CO -0.09 -0.02 -0.13 -0.65 -0.05 0.00 0.00 175.22 174.29 2o5j s GLN 180 N -1.26 1.12 -0.55 1.99 -0.21 -0.67 -4.99 119.66 115.09 2o5j s GLN 180 Ca -0.04 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 54.90 2o5j s GLN 180 Cb -0.08 -1.07 0.14 0.00 1.00 0.00 0.00 33.01 33.00 2o5j s GLN 180 CO 0.01 0.26 0.31 0.08 -2.12 0.00 0.00 175.29 173.83 2o5j s VAL 181 N -0.23 2.92 0.10 1.09 1.01 -1.25 -2.16 120.40 121.87 2o5j s VAL 181 Ca 0.04 -3.22 -0.08 0.00 0.00 0.00 0.00 61.98 58.71 2o5j s VAL 181 Cb -0.06 -2.98 -0.06 0.00 0.00 0.00 0.00 36.38 33.28 2o5j s VAL 181 CO -0.00 -0.82 0.39 -1.61 0.00 0.00 0.00 175.10 173.06 2o5j s GLU 182 N -0.23 3.72 0.35 2.72 8.01 -0.89 -4.77 118.70 127.60 2o5j s GLU 182 Ca 0.17 0.10 -0.28 0.00 0.01 0.00 0.00 54.97 54.97 2o5j s GLU 182 Cb -0.24 -2.95 -0.10 0.00 -4.31 0.00 0.00 34.13 26.53 2o5j s GLU 182 CO -0.01 0.53 1.25 -0.51 0.01 0.00 0.00 175.26 176.53 2o5j s ASP 183 N -1.94 6.72 0.09 -0.19 -0.00 -1.26 -1.84 116.67 118.24 2o5j s ASP 183 Ca 0.35 2.57 0.08 0.00 -0.00 0.00 0.00 52.55 55.55 2o5j s ASP 183 Cb -0.13 -2.64 -0.03 0.00 -0.00 0.00 0.00 42.92 40.12 2o5j s ASP 183 CO 0.20 -0.56 -0.21 0.28 -0.00 0.00 0.00 175.17 174.87 2o5j s THR 184 N -1.21 1.76 -0.25 -1.27 -1.32 -1.21 -4.90 115.64 107.24 2o5j s THR 184 Ca 0.51 -1.48 -0.08 0.00 -1.21 0.00 0.00 61.69 59.44 2o5j s THR 184 Cb -0.37 -1.58 -0.03 0.00 -1.51 0.00 0.00 72.50 69.01 2o5j s THR 184 CO 0.48 0.03 0.09 -0.60 -2.21 0.00 0.00 174.62 172.40 2o5j s ARG 185 N -1.73 3.73 -0.24 7.08 3.52 -1.26 -4.16 118.95 125.88 2o5j s ARG 185 Ca 0.07 -0.44 -0.01 0.00 -0.13 0.00 0.00 55.73 55.22 2o5j s ARG 185 Cb -0.10 -3.36 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2o5j s ARG 185 CO 0.04 -0.15 -0.08 -1.17 -0.81 0.00 0.00 175.30 173.13 2o5j s LEU 186 N 1.53 3.11 0.00 -0.88 0.20 -1.25 -5.03 118.68 116.35 2o5j s LEU 186 Ca 0.06 -0.92 0.00 0.00 0.69 0.00 0.00 54.13 53.96 2o5j s LEU 186 Cb -0.15 -1.63 0.00 0.00 -0.43 0.00 0.00 46.19 43.98 2o5j s LEU 186 CO 0.05 -0.12 0.00 0.61 -0.29 0.00 0.00 176.35 176.59 2o5j n GLY 187 N 4.63 0.00 0.17 7.98 0.00 -1.26 -1.83 105.19 114.88 2o5j n GLY 187 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2o5j n GLY 187 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2o5j h GLN 188 N 0.00 -0.33 -5.10 1.61 4.20 -2.03 -3.45 115.11 110.01 2o5j h GLN 188 Ca 0.00 0.02 -0.66 0.00 0.06 0.00 0.00 58.65 58.07 2o5j h GLN 188 Cb 0.00 0.07 -0.29 0.00 0.30 0.00 0.00 27.48 27.57 2o5j h GLN 188 CO 0.00 -0.22 -0.76 -0.98 -0.67 0.00 0.00 178.83 176.20 2o5j s ARG 189 N -2.65 3.30 0.23 1.46 1.70 -0.76 -5.01 118.95 117.22 2o5j s ARG 189 Ca -0.05 -0.68 -0.03 0.00 -0.47 0.00 0.00 55.73 54.50 2o5j s ARG 189 Cb 0.00 -2.82 0.25 0.00 -0.57 0.00 0.00 34.95 31.81 2o5j s ARG 189 CO 0.15 -0.08 1.68 1.15 -1.08 0.00 0.00 175.30 177.11 2o5j h THR 190 N 5.67 1.26 -0.56 4.99 2.02 -1.88 -3.34 112.91 121.07 2o5j h THR 190 Ca -0.38 -1.22 -0.13 0.00 0.77 0.00 0.00 66.41 65.45 2o5j h THR 190 Cb 1.17 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 2o5j h THR 190 CO 0.60 0.41 0.35 1.51 0.37 0.00 0.00 175.52 178.76 2o5j s ASP 191 N -6.72 4.33 0.09 4.18 -4.77 -1.26 -4.53 116.67 107.99 2o5j s ASP 191 Ca -0.09 -0.12 -0.08 0.00 -3.30 0.00 0.00 52.55 48.96 2o5j s ASP 191 Cb 0.14 -2.55 -0.01 0.00 -1.09 0.00 0.00 42.92 39.41 2o5j s ASP 191 CO 0.82 -3.45 0.17 -0.76 0.70 0.00 0.00 175.17 172.66 2o5j s LEU 192 N 13.10 1.49 0.04 2.11 1.43 -1.26 -4.76 118.68 130.82 2o5j s LEU 192 Ca 0.85 -0.71 0.04 0.00 -1.03 0.00 0.00 54.13 53.29 2o5j s LEU 192 Cb -0.11 0.96 -0.04 0.00 0.03 0.00 0.00 46.19 47.03 2o5j s LEU 192 CO 0.06 -0.73 -0.07 -1.81 0.23 0.00 0.00 176.35 174.03 2o5j s ASP 193 N -2.88 4.57 -0.18 2.29 1.11 -0.97 -3.34 116.67 117.27 2o5j s ASP 193 Ca 0.06 -0.21 -0.02 0.00 0.18 0.00 0.00 52.55 52.56 2o5j s ASP 193 Cb 0.05 -1.01 0.06 0.00 1.07 0.00 0.00 42.92 43.08 2o5j s ASP 193 CO -0.10 0.25 0.02 -0.75 1.18 0.00 0.00 175.17 175.77 2o5j s LYS 194 N -1.68 0.80 -0.19 8.23 2.20 -0.77 -1.49 119.74 126.84 2o5j s LYS 194 Ca 0.19 -0.43 -0.08 0.00 -0.36 0.00 0.00 55.97 55.28 2o5j s LYS 194 Cb -0.11 -2.05 -0.04 0.00 -1.51 0.00 0.00 37.83 34.12 2o5j s LYS 194 CO 0.10 -0.59 0.08 -1.17 -0.36 0.00 0.00 175.35 173.40 2o5j s LEU 195 N 1.81 3.86 -0.17 5.43 2.96 -1.10 -2.11 118.68 129.37 2o5j s LEU 195 Ca -0.01 0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 2o5j s LEU 195 Cb -0.17 -1.99 0.05 0.00 0.50 0.00 0.00 46.19 44.59 2o5j s LEU 195 CO -0.08 0.15 -0.00 0.42 -1.32 0.00 0.00 176.35 175.52 2o5j s THR 196 N 0.51 0.75 -0.17 3.68 -4.23 -0.92 -0.78 115.64 114.48 2o5j s THR 196 Ca 0.04 -0.52 -0.02 0.00 -1.18 0.00 0.00 61.69 60.02 2o5j s THR 196 Cb -0.12 -1.08 -0.01 0.00 1.34 0.00 0.00 72.50 72.62 2o5j s THR 196 CO 0.01 -0.02 -0.09 -1.48 -0.54 0.00 0.00 174.62 172.49 2o5j s LEU 197 N 1.77 2.82 -0.25 4.79 2.34 -0.67 -1.67 118.68 127.81 2o5j s LEU 197 Ca 0.00 -0.34 -0.14 0.00 0.06 0.00 0.00 54.13 53.72 2o5j s LEU 197 Cb -0.16 -1.67 -0.04 0.00 -0.56 0.00 0.00 46.19 43.76 2o5j s LEU 197 CO -0.07 0.10 0.31 -0.13 -1.06 0.00 0.00 176.35 175.50 2o5j s ARG 198 N 0.76 4.06 -0.07 1.48 0.52 0.30 -2.44 118.95 123.56 2o5j s ARG 198 Ca -0.04 -0.03 0.04 0.00 -0.52 0.00 0.00 55.73 55.18 2o5j s ARG 198 Cb -0.15 -3.60 -0.02 0.00 0.52 0.00 0.00 34.95 31.70 2o5j s ARG 198 CO 0.02 -0.13 -0.20 0.42 0.02 0.00 0.00 175.30 175.42 2o5j s ILE 199 N 1.62 2.52 -0.12 1.52 1.01 -0.81 -1.27 121.20 125.68 2o5j s ILE 199 Ca 0.13 -0.90 -0.02 0.00 0.00 0.00 0.00 60.65 59.87 2o5j s ILE 199 Cb -0.15 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 2o5j s ILE 199 CO 0.08 0.57 -0.04 0.26 0.00 0.00 0.00 174.94 175.81 2o5j s TRP 200 N -0.23 3.03 -0.01 3.97 0.51 -0.45 -1.79 118.94 123.96 2o5j s TRP 200 Ca -0.00 -0.12 0.04 0.00 -2.12 0.00 0.00 56.10 53.90 2o5j s TRP 200 Cb -0.13 -1.86 -0.01 0.00 -0.81 0.00 0.00 33.47 30.66 2o5j s TRP 200 CO 0.03 0.15 -0.14 0.99 -0.51 0.00 0.00 176.95 177.47 2o5j s THR 201 N -0.17 1.13 -1.51 2.01 2.01 0.14 -1.81 115.64 117.44 2o5j s THR 201 Ca 0.03 -0.64 0.08 0.00 0.31 0.00 0.00 61.69 61.48 2o5j s THR 201 Cb -0.13 -0.95 0.16 0.00 0.01 0.00 0.00 72.50 71.59 2o5j s THR 201 CO 0.02 0.30 1.12 -0.90 -0.69 0.00 0.00 174.62 174.47 2o5j n ASP 202 N 2.68 0.00 0.00 3.53 5.68 0.22 -4.10 116.55 124.56 2o5j n ASP 202 Ca -0.14 0.11 0.00 0.00 -0.50 0.00 0.00 54.79 54.25 2o5j n ASP 202 Cb 0.55 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.28 2o5j n ASP 202 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2o5j n GLY 203 N -0.56 1.92 0.42 6.12 0.00 -1.26 -4.96 105.19 106.87 2o5j n GLY 203 Ca 0.04 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 2o5j n GLY 203 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2o5j h SER 204 N 1.53 -1.77 -1.57 1.61 0.02 -1.87 -3.42 113.55 108.08 2o5j h SER 204 Ca 0.00 0.27 -0.59 0.00 -0.84 0.00 0.00 61.79 60.62 2o5j h SER 204 Cb 0.00 0.77 -0.10 0.00 0.14 0.00 0.00 62.40 63.21 2o5j h SER 204 CO 0.00 -0.34 -0.53 0.68 -1.14 0.00 0.00 176.83 175.50 2o5j s VAL 205 N -5.70 2.15 0.36 2.27 -7.23 -1.26 -5.16 120.40 105.83 2o5j s VAL 205 Ca -0.14 -1.81 0.06 0.00 -1.81 0.00 0.00 61.98 58.28 2o5j s VAL 205 Cb 0.11 -2.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.08 2o5j s VAL 205 CO 0.64 0.00 0.51 0.28 -0.31 0.00 0.00 175.10 176.21 2o5j s THR 206 N -2.65 4.03 0.23 5.32 -1.32 -1.26 -4.71 115.64 115.27 2o5j s THR 206 Ca 0.38 -0.92 -0.08 0.00 -1.21 0.00 0.00 61.69 59.85 2o5j s THR 206 Cb 0.06 -3.41 0.19 0.00 -1.51 0.00 0.00 72.50 67.84 2o5j s THR 206 CO 0.20 -0.18 1.89 -0.65 -2.21 0.00 0.00 174.62 173.68 2o5j h PRO 207 N 0.80 1.08 -0.22 7.08 0.11 -1.85 -1.42 132.00 137.59 2o5j h PRO 207 Ca -0.46 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 2o5j h PRO 207 Cb 1.26 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2o5j h PRO 207 CO 0.53 0.72 0.04 1.25 -0.21 0.00 0.00 178.00 180.33 2o5j h LEU 208 N 1.12 0.35 -0.55 2.35 5.85 -1.94 -2.08 115.31 120.40 2o5j h LEU 208 Ca 0.32 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.80 2o5j h LEU 208 Cb -0.10 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 2o5j h LEU 208 CO -0.08 0.52 0.35 -0.33 -0.34 0.00 0.00 178.44 178.56 2o5j h GLU 209 N 0.17 0.67 0.06 1.25 5.08 -1.91 -1.99 114.58 117.91 2o5j h GLU 209 Ca 0.07 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2o5j h GLU 209 Cb 0.32 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2o5j h GLU 209 CO 0.00 0.44 -0.09 0.00 -1.00 0.00 0.00 179.01 178.36 2o5j h ALA 210 N 1.23 -0.15 -0.66 3.43 0.00 -1.20 -1.64 119.26 120.27 2o5j h ALA 210 Ca 0.22 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.19 2o5j h ALA 210 Cb -0.01 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2o5j h ALA 210 CO -0.08 -0.61 0.34 1.25 0.00 0.00 0.00 179.25 180.15 2o5j h LEU 211 N -0.19 0.46 -0.31 0.00 5.85 -1.13 0.33 115.31 120.31 2o5j h LEU 211 Ca 0.02 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2o5j h LEU 211 Cb 0.21 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2o5j h LEU 211 CO -0.05 0.29 0.10 0.78 -0.34 0.00 0.00 178.44 179.21 2o5j h ASN 212 N 0.61 0.46 -0.75 1.25 4.21 -1.21 -0.18 115.58 119.96 2o5j h ASN 212 Ca 0.31 -0.20 0.03 0.00 1.21 0.00 0.00 56.30 57.65 2o5j h ASN 212 Cb 0.27 -0.12 -0.04 0.00 -1.12 0.00 0.00 38.32 37.31 2o5j h ASN 212 CO -0.23 0.54 0.50 1.56 -1.29 0.00 0.00 177.43 178.51 2o5j h GLN 213 N 0.35 0.90 0.22 0.81 7.50 -0.76 -1.95 115.11 122.18 2o5j h GLN 213 Ca 0.10 -0.05 -0.01 0.00 0.50 0.00 0.00 58.65 59.19 2o5j h GLN 213 Cb 0.24 -0.20 0.00 0.00 0.05 0.00 0.00 27.48 27.57 2o5j h GLN 213 CO -0.00 0.60 -0.10 0.00 -1.50 0.00 0.00 178.83 177.82 2o5j h ALA 214 N 1.56 -0.29 -0.35 3.87 0.00 -0.44 -1.64 119.26 121.97 2o5j h ALA 214 Ca 0.30 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2o5j h ALA 214 Cb 0.03 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2o5j h ALA 214 CO -0.08 -0.57 0.23 -0.39 0.00 0.00 0.00 179.25 178.44 2o5j h VAL 215 N -0.48 1.08 0.08 0.00 -1.51 -0.86 -2.29 116.25 112.27 2o5j h VAL 215 Ca -0.03 -0.16 -0.00 0.00 -1.23 0.00 0.00 66.70 65.28 2o5j h VAL 215 Cb 0.36 0.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.10 2o5j h VAL 215 CO 0.05 0.08 -0.04 -0.08 -1.23 0.00 0.00 177.57 176.36 2o5j h GLU 216 N 0.46 -0.10 -0.49 5.19 4.57 -1.20 -0.88 114.58 122.13 2o5j h GLU 216 Ca 0.13 0.01 0.11 0.00 -1.18 0.00 0.00 59.36 58.43 2o5j h GLU 216 Cb -0.03 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.55 2o5j h GLU 216 CO -0.03 0.24 0.34 0.82 -1.18 0.00 0.00 179.01 179.20 2o5j h ILE 217 N -0.45 0.84 0.03 2.32 5.03 -0.97 0.26 117.51 124.56 2o5j h ILE 217 Ca -0.01 -0.06 -0.17 0.00 -0.12 0.00 0.00 64.86 64.50 2o5j h ILE 217 Cb 0.39 0.65 0.02 0.00 -3.03 0.00 0.00 36.82 34.84 2o5j h ILE 217 CO 0.02 0.03 -0.69 0.25 -0.68 0.00 0.00 178.15 177.09 2o5j h LEU 218 N 0.18 0.55 -0.23 1.44 5.85 -1.27 -2.94 115.31 118.89 2o5j h LEU 218 Ca 0.23 -0.79 -0.00 0.00 0.84 0.00 0.00 57.88 58.15 2o5j h LEU 218 Cb 0.67 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 2o5j h LEU 218 CO -0.04 1.28 0.14 -0.09 -0.34 0.00 0.00 178.44 179.40 2o5j h ARG 219 N -0.11 0.32 -0.67 1.25 2.43 -0.19 -1.15 114.38 116.25 2o5j h ARG 219 Ca -0.09 -0.03 0.14 0.00 -0.81 0.00 0.00 59.98 59.19 2o5j h ARG 219 Cb 1.41 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.86 2o5j h ARG 219 CO 0.13 0.26 0.46 0.93 -1.51 0.00 0.00 179.97 180.24 2o5j h GLU 220 N 0.29 0.28 0.00 0.20 5.08 -0.63 -0.12 114.58 119.68 2o5j h GLU 220 Ca 0.08 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 2o5j h GLU 220 Cb 0.03 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2o5j h GLU 220 CO -0.02 0.18 -0.73 0.45 -1.00 0.00 0.00 179.01 177.90 2o5j h HIS 221 N 0.29 0.00 0.00 4.33 3.86 -1.22 -3.24 115.15 119.17 2o5j h HIS 221 Ca 0.32 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.53 2o5j h HIS 221 Cb 0.87 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.34 2o5j h HIS 221 CO -0.00 0.73 0.00 -0.07 0.86 0.00 0.00 177.93 179.45 2o5j h LEU 222 N 0.00 0.00 0.00 2.43 3.38 0.21 -2.99 115.31 118.33 2o5j h LEU 222 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2o5j h LEU 222 Cb 1.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2o5j h LEU 222 CO 0.09 0.00 -0.99 0.41 0.09 0.00 0.00 178.44 178.04 2o5j n THR 223 N -2.36 0.43 0.93 0.22 -1.04 -1.03 -4.06 114.28 107.37 2o5j n THR 223 Ca 0.04 -0.42 0.01 0.00 -2.04 0.00 0.00 64.05 61.64 2o5j n THR 223 Cb 0.36 -0.16 0.08 0.00 -1.82 0.00 0.00 70.33 68.79 2o5j n THR 223 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2o5j n TYR 224 N -2.38 0.00 -1.27 -1.42 4.01 -1.13 -2.45 117.16 112.52 2o5j n TYR 224 Ca 0.01 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.71 2o5j n TYR 224 Cb 0.50 0.00 0.22 0.00 -0.31 0.00 0.00 39.34 39.76 2o5j n TYR 224 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2o5j n PHE 225 N -0.59 1.46 -0.05 -0.72 0.99 -1.26 -4.72 117.46 112.58 2o5j n PHE 225 Ca 0.02 -1.42 -0.01 0.00 -0.00 0.00 0.00 57.45 56.04 2o5j n PHE 225 Cb 0.01 -0.53 -0.00 0.00 -1.00 0.00 0.00 39.48 37.95 2o5j n PHE 225 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2o5j h SER 226 N 1.36 0.00 -3.59 4.37 4.64 -1.80 -3.45 113.55 115.09 2o5j h SER 226 Ca 0.23 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.90 2o5j h SER 226 Cb 1.84 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.78 2o5j h SER 226 CO 0.48 0.53 0.09 0.20 -0.87 0.00 0.00 176.83 177.26 2o5j s ASN 227 N -5.43 6.33 0.82 4.97 0.01 -1.26 -5.06 114.94 115.31 2o5j s ASN 227 Ca -0.04 -0.28 -0.12 0.00 -0.71 0.00 0.00 52.86 51.72 2o5j s ASN 227 Cb 0.00 -2.31 0.08 0.00 0.41 0.00 0.00 41.25 39.44 2o5j s ASN 227 CO 0.05 -0.71 1.10 -2.84 -1.51 0.00 0.00 177.10 173.19 2o5j s PRO 228 N 2.72 1.91 0.00 -0.60 0.02 -1.26 -5.19 135.00 132.60 2o5j s PRO 228 Ca 0.22 0.65 0.00 0.00 0.02 0.00 0.00 61.00 61.89 2o5j s PRO 228 Cb -0.14 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.48 2o5j s PRO 228 CO 0.18 -1.74 0.00 0.94 -0.33 0.00 0.00 177.00 176.04