#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 0.22 0.00 4.03 4.77 -1.26 -4.46 117.00 120.29 2o5j n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2o5j n LEU 2 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2o5j n LEU 2 CO 0.00 -0.22 0.00 -0.67 -1.33 0.00 0.00 177.39 175.17 2o5j n ASP 3 N -2.52 0.00 0.04 -1.43 2.03 -1.26 -4.33 116.55 109.08 2o5j n ASP 3 Ca 0.00 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.23 2o5j n ASP 3 Cb 0.18 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.46 2o5j n ASP 3 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2o5j h SER 4 N 0.00 0.02 0.39 1.67 0.87 -1.98 -3.16 113.55 111.36 2o5j h SER 4 Ca 0.00 -0.02 -0.32 0.00 -1.23 0.00 0.00 61.79 60.22 2o5j h SER 4 Cb 0.00 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2o5j h SER 4 CO 0.00 1.02 -1.60 0.50 -0.53 0.00 0.00 176.83 176.21 2o5j h LYS 5 N 0.00 0.26 -0.53 2.24 1.63 -1.95 -3.28 116.57 114.95 2o5j h LYS 5 Ca -0.10 -0.45 -0.03 0.00 -0.85 0.00 0.00 60.65 59.22 2o5j h LYS 5 Cb 1.85 0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 33.62 2o5j h LYS 5 CO 0.12 1.13 0.20 1.25 -3.45 0.00 0.00 179.45 178.69 2o5j h LEU 6 N 0.07 0.70 -6.64 5.20 5.85 -1.75 -3.07 115.31 115.67 2o5j h LEU 6 Ca -0.27 -0.09 -0.62 0.00 0.84 0.00 0.00 57.88 57.74 2o5j h LEU 6 Cb 2.03 -0.18 0.05 0.00 0.37 0.00 0.00 40.66 42.94 2o5j h LEU 6 CO 0.16 0.64 2.11 1.17 -0.34 0.00 0.00 178.44 182.18 2o5j n LYS 7 N -4.33 1.35 -4.41 1.25 4.81 -1.19 -4.85 118.16 110.79 2o5j n LYS 7 Ca 0.04 -1.80 -0.26 0.00 -0.87 0.00 0.00 58.31 55.43 2o5j n LYS 7 Cb 0.17 -2.93 -0.10 0.00 0.02 0.00 0.00 35.03 32.18 2o5j n LYS 7 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2o5j s ALA 8 N 5.67 2.71 -0.60 3.14 0.00 -1.16 -4.90 121.76 126.62 2o5j s ALA 8 Ca 0.59 -1.69 -0.33 0.00 0.00 0.00 0.00 51.96 50.54 2o5j s ALA 8 Cb 0.13 -0.41 -0.15 0.00 0.00 0.00 0.00 23.12 22.70 2o5j s ALA 8 CO 0.14 0.38 2.40 -2.30 0.00 0.00 0.00 175.76 176.38 2o5j n PRO 9 N -0.12 0.61 -2.16 0.00 -0.02 -1.26 -4.53 135.00 127.52 2o5j n PRO 9 Ca -0.10 0.10 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 2o5j n PRO 9 Cb 0.57 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 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 8.83 3.46 -0.56 -1.45 1.01 -0.07 -4.79 120.40 126.83 2o5j s VAL 10 Ca 1.16 0.12 -0.28 0.00 0.00 0.00 0.00 61.98 62.99 2o5j s VAL 10 Cb -0.90 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 31.31 2o5j s VAL 10 CO 0.46 -1.14 1.45 0.12 0.00 0.00 0.00 175.10 175.99 2o5j s PHE 11 N 8.42 2.22 -0.10 5.22 5.36 -1.26 -3.80 117.98 134.04 2o5j s PHE 11 Ca 0.61 0.48 -0.02 0.00 -0.96 0.00 0.00 56.93 57.03 2o5j s PHE 11 Cb -0.10 -4.37 -0.03 0.00 -0.34 0.00 0.00 43.02 38.17 2o5j s PHE 11 CO 0.15 -2.04 -0.02 0.95 -1.46 0.00 0.00 175.22 172.80 2o5j s THR 12 N 6.28 4.08 0.05 0.12 -4.23 0.01 -5.01 115.64 116.94 2o5j s THR 12 Ca 0.54 -0.32 0.08 0.00 -1.18 0.00 0.00 61.69 60.80 2o5j s THR 12 Cb -0.11 -2.73 -0.03 0.00 1.34 0.00 0.00 72.50 70.97 2o5j s THR 12 CO 0.25 0.57 -0.23 -0.69 -0.54 0.00 0.00 174.62 173.97 2o5j s VAL 13 N -0.47 1.85 -0.33 2.29 1.01 -1.26 -1.24 120.40 122.24 2o5j s VAL 13 Ca 0.08 -1.28 0.01 0.00 0.00 0.00 0.00 61.98 60.78 2o5j s VAL 13 Cb -0.12 -1.60 0.14 0.00 0.00 0.00 0.00 36.38 34.80 2o5j s VAL 13 CO 0.02 0.26 0.29 -0.13 0.00 0.00 0.00 175.10 175.53 2o5j s ARG 14 N -1.23 0.48 -0.11 2.72 0.52 -1.08 -5.04 118.95 115.21 2o5j s ARG 14 Ca 0.09 -0.73 0.02 0.00 -0.52 0.00 0.00 55.73 54.59 2o5j s ARG 14 Cb -0.09 -0.89 0.01 0.00 0.52 0.00 0.00 34.95 34.50 2o5j s ARG 14 CO 0.02 -1.13 -0.18 -0.08 0.02 0.00 0.00 175.30 173.95 2o5j s THR 15 N 1.68 1.66 -0.21 0.02 -1.32 -1.26 -1.13 115.64 115.08 2o5j s THR 15 Ca 0.14 -0.76 -0.03 0.00 -1.21 0.00 0.00 61.69 59.84 2o5j s THR 15 Cb -0.17 -1.49 -0.00 0.00 -1.51 0.00 0.00 72.50 69.33 2o5j s THR 15 CO -0.14 0.47 -0.08 -1.58 -2.21 0.00 0.00 174.62 171.08 2o5j s GLN 16 N 0.77 3.30 2.37 7.08 0.74 -1.13 -5.01 119.66 127.78 2o5j s GLN 16 Ca -0.11 -0.67 0.00 0.00 0.05 0.00 0.00 55.36 54.64 2o5j s GLN 16 Cb -0.16 -2.92 0.00 0.00 1.10 0.00 0.00 33.01 31.03 2o5j s GLN 16 CO 0.01 -0.20 0.00 0.41 -0.55 0.00 0.00 175.29 174.96 2o5j n GLY 17 N 4.76 -0.57 0.49 2.59 0.00 -1.26 -3.44 105.19 107.75 2o5j n GLY 17 Ca -0.19 -1.13 0.05 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 -0.01 1.65 -0.09 1.61 1.74 -1.26 -4.68 116.66 115.61 2o5j n ARG 18 Ca 0.00 -1.55 -0.13 0.00 -0.77 0.00 0.00 57.85 55.40 2o5j n ARG 18 Cb 0.00 -1.22 -0.05 0.00 -1.02 0.00 0.00 32.46 30.18 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 0.49 0.52 -3.97 5.56 4.71 -1.26 -3.86 120.64 122.83 2o5j n GLU 19 Ca 0.08 0.36 -0.33 0.00 -0.01 0.00 0.00 57.16 57.26 2o5j n GLU 19 Cb 0.33 -1.56 -0.06 0.00 -1.01 0.00 0.00 31.44 29.14 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 -2.57 3.46 -0.30 -0.32 6.04 -1.22 0.54 117.35 122.97 2o5j s TYR 20 Ca -0.26 0.31 0.01 0.00 0.04 0.00 0.00 57.07 57.17 2o5j s TYR 20 Cb 0.05 -1.80 0.19 0.00 -1.04 0.00 0.00 41.96 39.37 2o5j s TYR 20 CO 0.39 0.62 0.63 0.20 -1.54 0.00 0.00 175.55 175.85 2o5j s GLY 21 N -1.84 -1.09 0.33 8.97 0.00 -0.80 -2.82 107.32 110.07 2o5j s GLY 21 Ca 0.25 1.54 -0.19 0.00 0.00 0.00 0.00 44.72 46.32 2o5j s GLY 21 CO 0.16 3.56 0.82 1.85 0.00 0.00 0.00 173.10 179.49 2o5j s GLU 22 N 2.85 4.18 -0.23 2.90 2.56 -0.28 -2.24 118.70 128.44 2o5j s GLU 22 Ca 0.15 0.91 -0.03 0.00 0.00 0.00 0.00 54.97 56.00 2o5j s GLU 22 Cb -0.12 -2.50 0.10 0.00 2.00 0.00 0.00 34.13 33.61 2o5j s GLU 22 CO -0.23 0.17 0.21 -0.06 -0.56 0.00 0.00 175.26 174.79 2o5j s PHE 23 N -1.90 -0.17 -0.06 5.30 0.08 -1.03 -2.62 117.98 117.58 2o5j s PHE 23 Ca 0.53 -0.09 -0.08 0.00 0.12 0.00 0.00 56.93 57.42 2o5j s PHE 23 Cb -0.12 -0.50 -0.04 0.00 -0.57 0.00 0.00 43.02 41.78 2o5j s PHE 23 CO 0.18 -0.70 0.22 0.08 -0.10 0.00 0.00 175.22 174.90 2o5j s VAL 24 N 2.28 5.38 -0.24 -0.44 1.01 -0.37 -1.67 120.40 126.34 2o5j s VAL 24 Ca 0.07 0.27 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 2o5j s VAL 24 Cb -0.15 -3.50 0.13 0.00 0.00 0.00 0.00 36.38 32.86 2o5j s VAL 24 CO -0.20 0.53 0.38 -0.22 0.00 0.00 0.00 175.10 175.60 2o5j s LEU 25 N -1.28 -0.66 0.11 3.92 2.96 -0.33 -0.81 118.68 122.60 2o5j s LEU 25 Ca 0.20 0.25 -0.15 0.00 -0.22 0.00 0.00 54.13 54.21 2o5j s LEU 25 Cb -0.13 1.15 0.03 0.00 0.50 0.00 0.00 46.19 47.74 2o5j s LEU 25 CO 0.10 -0.30 0.38 -0.70 -1.32 0.00 0.00 176.35 174.51 2o5j s GLU 26 N 2.56 1.03 0.55 1.98 -6.30 -1.25 -2.82 118.70 114.45 2o5j s GLU 26 Ca 0.13 -0.70 -0.06 0.00 -2.50 0.00 0.00 54.97 51.83 2o5j s GLU 26 Cb -0.15 0.45 -0.02 0.00 0.00 0.00 0.00 34.13 34.41 2o5j s GLU 26 CO -0.16 -0.39 0.88 -2.14 0.02 0.00 0.00 175.26 173.47 2o5j s PRO 27 N -3.69 3.26 0.06 4.30 0.02 -1.26 -0.89 135.00 136.80 2o5j s PRO 27 Ca 0.02 0.20 0.06 0.00 0.02 0.00 0.00 61.00 61.30 2o5j s PRO 27 Cb 0.02 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 32.23 2o5j s PRO 27 CO -0.11 -0.49 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.39 2o5j s LEU 28 N -4.93 2.22 0.00 -5.54 1.43 -0.42 -4.30 118.68 107.14 2o5j s LEU 28 Ca 0.51 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2o5j s LEU 28 Cb -0.10 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.39 2o5j s LEU 28 CO 0.46 0.04 0.00 1.21 0.23 0.00 0.00 176.35 178.29 2o5j n GLU 29 N 1.56 3.16 -3.33 1.70 0.00 -1.26 -1.92 120.64 120.54 2o5j n GLU 29 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.59 2o5j n GLU 29 Cb 0.54 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.92 2o5j n GLU 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2o5j s ARG 30 N 0.00 4.29 -1.43 5.31 6.06 -1.26 -3.11 118.95 128.82 2o5j s ARG 30 Ca 0.00 0.39 -0.09 0.00 -2.50 0.00 0.00 55.73 53.54 2o5j s ARG 30 Cb 0.00 -3.47 0.05 0.00 0.06 0.00 0.00 34.95 31.59 2o5j s ARG 30 CO 0.00 0.09 0.66 0.41 -2.50 0.00 0.00 175.30 173.96 2o5j n GLY 31 N 3.44 -0.50 0.08 8.12 0.00 -1.26 -4.88 105.19 110.18 2o5j n GLY 31 Ca -0.07 0.13 -0.04 0.00 0.00 0.00 0.00 46.02 46.04 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 -4.33 0.23 -0.29 1.61 0.99 -1.26 -3.62 117.46 110.80 2o5j n PHE 32 Ca -0.04 0.08 0.05 0.00 -0.00 0.00 0.00 57.45 57.54 2o5j n PHE 32 Cb 0.57 -0.92 0.27 0.00 -1.00 0.00 0.00 39.48 38.39 2o5j n PHE 32 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2o5j h GLY 33 N 3.92 1.28 1.31 1.37 0.00 -1.90 -0.34 103.07 108.72 2o5j h GLY 33 Ca -0.35 -0.39 -0.22 0.00 0.00 0.00 0.00 47.33 46.37 2o5j h GLY 33 CO 0.03 0.27 -0.79 -0.24 0.00 0.00 0.00 176.54 175.81 2o5j h VAL 34 N 0.96 1.31 0.00 4.60 3.04 -1.97 0.68 116.25 124.88 2o5j h VAL 34 Ca 0.39 -2.06 -0.03 0.00 -1.01 0.00 0.00 66.70 63.99 2o5j h VAL 34 Cb 0.26 2.06 -0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2o5j h VAL 34 CO -0.15 0.64 -0.16 0.74 -1.01 0.00 0.00 177.57 177.63 2o5j h THR 35 N 0.45 0.91 0.01 3.17 2.02 -1.35 -2.58 112.91 115.55 2o5j h THR 35 Ca -0.05 -0.58 -0.41 0.00 0.77 0.00 0.00 66.41 66.14 2o5j h THR 35 Cb 1.41 1.33 -0.06 0.00 -1.74 0.00 0.00 68.15 69.09 2o5j h THR 35 CO 0.15 0.15 -2.33 0.18 0.37 0.00 0.00 175.52 174.05 2o5j n LEU 36 N -4.06 2.24 -0.10 2.58 4.77 -0.24 -4.42 117.00 117.76 2o5j n LEU 36 Ca -0.02 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.13 2o5j n LEU 36 Cb 0.24 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 2o5j n LEU 36 CO 0.34 0.64 0.78 1.23 -1.33 0.00 0.00 177.39 179.05 2o5j h GLY 37 N -0.14 0.22 0.87 -0.72 0.00 -0.84 -2.38 103.07 100.08 2o5j h GLY 37 Ca -0.61 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 2o5j h GLY 37 CO -0.29 -0.15 -0.10 -0.57 0.00 0.00 0.00 176.54 175.44 2o5j h ASN 38 N -0.03 -0.23 -0.52 0.19 -0.00 -1.68 -1.15 115.58 112.16 2o5j h ASN 38 Ca 0.17 -0.09 0.08 0.00 -0.00 0.00 0.00 56.30 56.45 2o5j h ASN 38 Cb 0.29 0.06 -0.06 0.00 -0.00 0.00 0.00 38.32 38.60 2o5j h ASN 38 CO -0.38 -0.05 0.16 -0.65 -0.00 0.00 0.00 177.43 176.52 2o5j h PRO 39 N -0.40 0.32 -0.51 6.67 0.11 -1.74 0.94 132.00 137.38 2o5j h PRO 39 Ca -0.03 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.10 2o5j h PRO 39 Cb 0.31 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 2o5j h PRO 39 CO 0.05 0.21 0.34 -0.07 -0.21 0.00 0.00 178.00 178.31 2o5j h LEU 40 N 0.33 0.50 -0.03 2.35 3.38 -1.33 -0.88 115.31 119.62 2o5j h LEU 40 Ca 0.26 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 2o5j h LEU 40 Cb 0.30 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2o5j h LEU 40 CO -0.28 0.34 0.00 -0.09 0.09 0.00 0.00 178.44 178.50 2o5j h ARG 41 N 0.58 0.05 0.00 1.13 2.43 0.37 0.30 114.38 119.23 2o5j h ARG 41 Ca 0.21 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 2o5j h ARG 41 Cb 0.10 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2o5j h ARG 41 CO -0.05 0.31 -0.01 0.00 -1.51 0.00 0.00 179.97 178.70 2o5j h ARG 42 N -0.22 0.00 0.07 0.20 3.08 -0.25 -2.61 114.38 114.65 2o5j h ARG 42 Ca 0.01 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 2o5j h ARG 42 Cb 0.28 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.34 2o5j h ARG 42 CO 0.00 0.01 -0.42 0.82 -1.07 0.00 0.00 179.97 179.32 2o5j h ILE 43 N 0.00 1.63 -0.25 2.04 1.08 -0.98 -3.14 117.51 117.90 2o5j h ILE 43 Ca -0.00 -2.39 0.07 0.00 -0.39 0.00 0.00 64.86 62.15 2o5j h ILE 43 Cb 0.02 3.22 -0.01 0.00 -3.07 0.00 0.00 36.82 36.98 2o5j h ILE 43 CO 0.00 0.65 0.33 -0.07 -0.69 0.00 0.00 178.15 178.37 2o5j h LEU 44 N -0.64 0.00 0.03 1.44 3.38 -0.59 0.22 115.31 119.15 2o5j h LEU 44 Ca -0.07 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.52 2o5j h LEU 44 Cb 1.30 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.00 2o5j h LEU 44 CO 0.08 0.00 -2.33 0.18 0.09 0.00 0.00 178.44 176.46 2o5j n LEU 45 N -3.58 2.30 -0.10 1.67 4.32 -1.01 -4.62 117.00 115.97 2o5j n LEU 45 Ca 0.03 -0.02 -0.23 0.00 -0.02 0.00 0.00 56.01 55.77 2o5j n LEU 45 Cb 0.46 -0.66 -0.11 0.00 -1.62 0.00 0.00 43.42 41.48 2o5j n LEU 45 CO 0.25 0.82 -0.73 -1.54 -1.22 0.00 0.00 177.39 174.96 2o5j n SER 46 N -3.21 1.90 0.09 -1.43 3.41 -0.90 -4.72 113.62 108.75 2o5j n SER 46 Ca -0.39 0.38 -0.22 0.00 -0.26 0.00 0.00 58.87 58.38 2o5j n SER 46 Cb 1.03 -0.92 -0.15 0.00 -0.26 0.00 0.00 64.21 63.91 2o5j n SER 46 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2o5j h SER 47 N -0.92 0.67 -2.11 4.04 0.87 -0.80 -3.38 113.55 111.92 2o5j h SER 47 Ca -0.43 -0.91 -0.61 0.00 -1.23 0.00 0.00 61.79 58.61 2o5j h SER 47 Cb 1.42 -0.22 0.05 0.00 -0.44 0.00 0.00 62.40 63.21 2o5j h SER 47 CO -0.23 1.52 0.84 -0.38 -0.53 0.00 0.00 176.83 178.05 2o5j n ILE 48 N -3.95 0.16 -2.17 2.23 5.41 -1.24 -4.83 119.36 114.98 2o5j n ILE 48 Ca -0.15 -0.03 -0.31 0.00 1.00 0.00 0.00 62.75 63.27 2o5j n ILE 48 Cb 0.93 -1.52 -0.01 0.00 -0.71 0.00 0.00 39.64 38.33 2o5j n ILE 48 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2o5j s PRO 49 N 1.77 3.71 0.00 0.38 0.04 -1.26 -4.52 135.00 135.12 2o5j s PRO 49 Ca 0.84 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.62 2o5j s PRO 49 Cb -0.73 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 31.66 2o5j s PRO 49 CO 0.44 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.48 2o5j n GLY 50 N -2.25 3.35 3.27 0.56 0.00 -0.51 -4.56 105.19 105.05 2o5j n GLY 50 Ca 0.05 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 1.09 0.09 -0.15 2.61 -4.23 -1.25 -3.03 115.64 110.76 2o5j s THR 51 Ca 0.00 -0.74 -0.33 0.00 -1.18 0.00 0.00 61.69 59.44 2o5j s THR 51 Cb 0.00 -1.13 0.13 0.00 1.34 0.00 0.00 72.50 72.85 2o5j s THR 51 CO 0.00 -0.41 1.13 0.00 -0.54 0.00 0.00 174.62 174.80 2o5j s ALA 52 N -3.34 -2.01 -0.24 3.99 0.00 -1.11 -4.37 121.76 114.67 2o5j s ALA 52 Ca 0.00 1.49 -0.29 0.00 0.00 0.00 0.00 51.96 53.17 2o5j s ALA 52 Cb 0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 2o5j s ALA 52 CO -0.08 -0.57 1.44 0.08 0.00 0.00 0.00 175.76 176.63 2o5j s VAL 53 N -2.37 3.95 -0.05 0.00 1.01 -1.26 -2.42 120.40 119.25 2o5j s VAL 53 Ca 0.07 1.08 0.13 0.00 0.00 0.00 0.00 61.98 63.26 2o5j s VAL 53 Cb -0.01 -3.93 -0.23 0.00 0.00 0.00 0.00 36.38 32.22 2o5j s VAL 53 CO -0.05 -0.35 0.65 0.41 0.00 0.00 0.00 175.10 175.76 2o5j n THR 54 N 6.17 1.60 -3.57 3.92 -1.04 -0.95 -4.53 114.28 115.88 2o5j n THR 54 Ca 0.16 -0.80 -0.11 0.00 -2.04 0.00 0.00 64.05 61.27 2o5j n THR 54 Cb 0.46 -1.02 -0.03 0.00 -1.82 0.00 0.00 70.33 67.92 2o5j n THR 54 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2o5j s SER 55 N -6.07 -0.41 0.03 8.00 0.15 -1.25 -1.85 113.70 112.30 2o5j s SER 55 Ca -0.05 -0.22 -0.04 0.00 0.70 0.00 0.00 55.95 56.35 2o5j s SER 55 Cb 0.08 0.58 -0.01 0.00 -1.71 0.00 0.00 66.02 64.95 2o5j s SER 55 CO 0.83 -0.99 0.05 -0.69 1.20 0.00 0.00 173.24 173.63 2o5j s VAL 56 N -3.80 0.13 -0.23 4.45 1.01 -0.97 -0.85 120.40 120.13 2o5j s VAL 56 Ca 0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.93 2o5j s VAL 56 Cb -0.01 -0.70 0.09 0.00 0.00 0.00 0.00 36.38 35.77 2o5j s VAL 56 CO -0.09 -0.58 0.17 -0.47 0.00 0.00 0.00 175.10 174.13 2o5j s TYR 57 N -2.21 0.02 0.04 5.22 5.04 -0.45 -1.16 117.35 123.84 2o5j s TYR 57 Ca -0.09 -0.33 -0.24 0.00 -2.44 0.00 0.00 57.07 53.97 2o5j s TYR 57 Cb -0.04 -0.64 -0.05 0.00 0.35 0.00 0.00 41.96 41.58 2o5j s TYR 57 CO -0.03 -0.69 0.74 0.42 -1.34 0.00 0.00 175.55 174.64 2o5j s ILE 58 N 2.21 4.76 0.09 3.14 -1.09 -1.26 -2.17 121.20 126.88 2o5j s ILE 58 Ca 0.06 1.56 -0.35 0.00 -2.23 0.00 0.00 60.65 59.69 2o5j s ILE 58 Cb -0.16 -4.08 -0.16 0.00 -1.58 0.00 0.00 42.46 36.48 2o5j s ILE 58 CO -0.22 0.37 1.57 -0.08 -1.23 0.00 0.00 174.94 175.35 2o5j h GLU 59 N 5.67 -0.89 -0.01 2.79 4.81 -1.81 -2.88 114.58 122.27 2o5j h GLU 59 Ca -0.44 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2o5j h GLU 59 Cb 1.20 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.79 2o5j h GLU 59 CO 0.71 -0.60 -0.20 -0.25 -0.73 0.00 0.00 179.01 177.94 2o5j n ASP 60 N -5.54 0.73 -4.80 1.04 8.00 -1.26 -4.87 116.55 109.84 2o5j n ASP 60 Ca -0.11 -0.68 -0.38 0.00 0.71 0.00 0.00 54.79 54.33 2o5j n ASP 60 Cb 0.45 0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.52 2o5j n ASP 60 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2o5j s VAL 61 N -2.53 4.52 -0.14 2.53 1.01 -1.09 -4.99 120.40 119.72 2o5j s VAL 61 Ca 0.25 1.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.62 2o5j s VAL 61 Cb 0.19 -3.96 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 2o5j s VAL 61 CO 0.51 0.37 -0.15 0.18 0.00 0.00 0.00 175.10 176.01 2o5j n LEU 62 N 1.17 1.87 -4.75 3.92 4.32 -1.26 -4.64 117.00 117.63 2o5j n LEU 62 Ca -0.05 0.06 -0.24 0.00 -0.02 0.00 0.00 56.01 55.77 2o5j n LEU 62 Cb 0.50 -0.43 -0.07 0.00 -1.62 0.00 0.00 43.42 41.81 2o5j n LEU 62 CO 0.44 0.48 -0.16 -1.38 -1.22 0.00 0.00 177.39 175.55 2o5j s HIS 63 N -2.26 2.65 -0.25 -1.77 -3.43 -1.26 -4.70 115.29 104.27 2o5j s HIS 63 Ca -0.19 -0.50 0.28 0.00 -0.80 0.00 0.00 55.06 53.85 2o5j s HIS 63 Cb 0.06 -1.85 0.92 0.00 -1.43 0.00 0.00 32.58 30.28 2o5j s HIS 63 CO 0.27 0.22 1.80 1.49 -2.00 0.00 0.00 174.74 176.52 2o5j h GLU 64 N 1.44 0.00 -0.95 -0.38 4.81 -1.96 -3.25 114.58 114.29 2o5j h GLU 64 Ca -0.43 0.00 -0.56 0.00 -0.13 0.00 0.00 59.36 58.24 2o5j h GLU 64 Cb 1.25 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 30.34 2o5j h GLU 64 CO 0.66 0.00 0.66 1.19 -0.73 0.00 0.00 179.01 180.79 2o5j n PHE 65 N -2.87 3.02 -3.40 0.92 3.01 -1.26 -3.51 117.46 113.37 2o5j n PHE 65 Ca 0.02 -2.31 -0.19 0.00 1.01 0.00 0.00 57.45 55.98 2o5j n PHE 65 Cb 0.38 -1.11 -0.01 0.00 -0.01 0.00 0.00 39.48 38.73 2o5j n PHE 65 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2o5j s SER 66 N -1.65 5.59 -0.06 4.37 0.15 -1.23 -4.99 113.70 115.89 2o5j s SER 66 Ca 0.59 -0.41 0.03 0.00 0.70 0.00 0.00 55.95 56.86 2o5j s SER 66 Cb 0.49 -0.89 0.01 0.00 -1.71 0.00 0.00 66.02 63.91 2o5j s SER 66 CO 0.05 -0.56 -0.14 0.28 1.20 0.00 0.00 173.24 174.07 2o5j s THR 67 N -2.30 1.27 -0.18 6.45 -1.32 -1.26 -1.66 115.64 116.64 2o5j s THR 67 Ca 0.48 -0.59 -0.11 0.00 -1.21 0.00 0.00 61.69 60.27 2o5j s THR 67 Cb -0.08 -1.13 -0.05 0.00 -1.51 0.00 0.00 72.50 69.74 2o5j s THR 67 CO 0.30 0.38 0.17 -0.63 -2.21 0.00 0.00 174.62 172.64 2o5j s ILE 68 N 0.39 5.39 0.61 5.08 1.09 -1.26 -5.00 121.20 127.50 2o5j s ILE 68 Ca -0.10 0.28 -0.19 0.00 -1.10 0.00 0.00 60.65 59.54 2o5j s ILE 68 Cb -0.14 -3.50 -0.03 0.00 -1.06 0.00 0.00 42.46 37.72 2o5j s ILE 68 CO 0.03 0.45 1.19 -2.65 -0.10 0.00 0.00 174.94 173.87 2o5j n PRO 69 N 3.33 1.17 -0.92 2.79 -0.02 -1.26 -2.13 135.00 137.96 2o5j n PRO 69 Ca -0.15 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2o5j n PRO 69 Cb 0.52 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2o5j n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 70 N 1.02 0.33 2.87 -1.23 0.00 -1.26 -4.47 105.19 102.44 2o5j n GLY 70 Ca 0.14 0.00 -0.29 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 -1.82 1.16 0.08 1.61 1.01 -0.91 -0.59 120.40 120.95 2o5j s VAL 71 Ca 0.00 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 2o5j s VAL 71 Cb 0.00 -1.52 -0.08 0.00 0.00 0.00 0.00 36.38 34.77 2o5j s VAL 71 CO 0.00 -0.14 1.37 0.50 0.00 0.00 0.00 175.10 176.83 2o5j h LYS 72 N 8.06 -0.35 -7.11 2.72 3.64 -1.79 -3.42 116.57 118.32 2o5j h LYS 72 Ca -0.17 0.02 -0.56 0.00 -1.27 0.00 0.00 60.65 58.68 2o5j h LYS 72 Cb 1.09 0.08 0.15 0.00 -0.41 0.00 0.00 32.23 33.14 2o5j h LYS 72 CO 0.38 -0.23 0.51 -1.83 -2.27 0.00 0.00 179.45 176.01 2o5j s GLU 73 N -4.81 2.59 0.28 1.90 1.03 -1.26 -4.99 118.70 113.44 2o5j s GLU 73 Ca -0.10 2.05 -0.02 0.00 0.03 0.00 0.00 54.97 56.92 2o5j s GLU 73 Cb 0.05 -1.85 -0.04 0.00 -0.80 0.00 0.00 34.13 31.48 2o5j s GLU 73 CO 0.41 -1.56 0.51 0.16 -1.33 0.00 0.00 175.26 173.44 2o5j s ASP 74 N -1.40 6.39 0.32 0.83 1.47 -1.26 -4.49 116.67 118.52 2o5j s ASP 74 Ca 0.82 0.56 0.09 0.00 1.18 0.00 0.00 52.55 55.20 2o5j s ASP 74 Cb -0.37 -2.08 0.92 0.00 -0.34 0.00 0.00 42.92 41.05 2o5j s ASP 74 CO 0.39 -0.18 1.67 0.58 0.68 0.00 0.00 175.17 178.32 2o5j h VAL 75 N 1.25 0.36 -0.67 2.11 2.07 -1.56 0.16 116.25 119.96 2o5j h VAL 75 Ca -0.48 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 2o5j h VAL 75 Cb 1.20 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2o5j h VAL 75 CO 0.65 0.06 0.26 0.58 0.02 0.00 0.00 177.57 179.14 2o5j h VAL 76 N 0.34 1.24 -0.07 2.57 2.07 -1.79 -0.08 116.25 120.54 2o5j h VAL 76 Ca 0.65 -0.78 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 2o5j h VAL 76 Cb 1.39 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2o5j h VAL 76 CO -0.59 0.31 -0.50 -0.33 0.02 0.00 0.00 177.57 176.48 2o5j h GLU 77 N 0.96 0.18 0.52 1.57 5.08 -1.12 -2.50 114.58 119.27 2o5j h GLU 77 Ca 0.22 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 2o5j h GLU 77 Cb 0.23 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.49 2o5j h GLU 77 CO -0.02 0.64 -0.25 0.82 -1.00 0.00 0.00 179.01 179.20 2o5j h ILE 78 N 0.14 0.07 -0.52 3.13 2.04 -0.86 -2.34 117.51 119.18 2o5j h ILE 78 Ca 0.01 -0.49 0.15 0.00 1.00 0.00 0.00 64.86 65.52 2o5j h ILE 78 Cb 0.93 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2o5j h ILE 78 CO 0.07 0.01 0.43 0.16 0.00 0.00 0.00 178.15 178.82 2o5j h ILE 79 N -1.16 0.57 -0.19 -0.67 -0.00 -1.08 0.20 117.51 115.18 2o5j h ILE 79 Ca -0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 64.86 64.72 2o5j h ILE 79 Cb 0.56 0.69 -0.00 0.00 -0.00 0.00 0.00 36.82 38.07 2o5j h ILE 79 CO 0.12 0.00 -0.16 0.25 -0.00 0.00 0.00 178.15 178.36 2o5j h LEU 80 N 0.00 0.47 -1.96 0.16 6.46 -1.42 -2.92 115.31 116.10 2o5j h LEU 80 Ca 0.24 -0.46 -0.02 0.00 -0.12 0.00 0.00 57.88 57.52 2o5j h LEU 80 Cb 1.09 -0.13 -0.00 0.00 -0.73 0.00 0.00 40.66 40.89 2o5j h LEU 80 CO -0.00 0.83 -0.10 0.78 -0.62 0.00 0.00 178.44 179.33 2o5j h ASN 81 N 0.11 0.00 -0.26 1.25 4.21 -0.10 -2.24 115.58 118.55 2o5j h ASN 81 Ca 0.03 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.37 2o5j h ASN 81 Cb 0.69 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.89 2o5j h ASN 81 CO 0.04 0.10 -0.48 -0.07 -1.29 0.00 0.00 177.43 175.74 2o5j h LEU 82 N 0.00 0.91 -2.57 1.61 3.38 -1.00 -2.72 115.31 114.93 2o5j h LEU 82 Ca -0.00 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.52 2o5j h LEU 82 Cb 0.32 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2o5j h LEU 82 CO 0.01 1.24 0.11 0.50 0.09 0.00 0.00 178.44 180.39 2o5j h LYS 83 N 0.66 0.00 0.00 1.13 3.64 -1.23 0.14 116.57 120.92 2o5j h LYS 83 Ca 0.03 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2o5j h LYS 83 Cb 1.06 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 2o5j h LYS 83 CO 0.11 0.00 -0.42 0.93 -2.27 0.00 0.00 179.45 177.80 2o5j h GLU 84 N 0.00 0.00 -6.43 1.90 4.39 -1.52 -3.46 114.58 109.46 2o5j h GLU 84 Ca 0.02 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.18 2o5j h GLU 84 Cb 0.24 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.91 2o5j h GLU 84 CO -0.00 0.14 1.02 -1.17 -1.16 0.00 0.00 179.01 177.85 2o5j s LEU 85 N -6.08 4.37 -0.31 1.33 2.96 0.04 -4.98 118.68 116.01 2o5j s LEU 85 Ca 0.04 2.49 -0.05 0.00 -0.22 0.00 0.00 54.13 56.39 2o5j s LEU 85 Cb 0.07 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.23 2o5j s LEU 85 CO 0.72 -0.91 0.06 0.54 -1.32 0.00 0.00 176.35 175.45 2o5j s VAL 86 N 2.84 3.64 0.32 1.68 0.11 -1.26 -4.72 120.40 123.00 2o5j s VAL 86 Ca 0.75 -1.01 0.08 0.00 -2.93 0.00 0.00 61.98 58.86 2o5j s VAL 86 Cb -0.40 -2.98 -0.03 0.00 -1.53 0.00 0.00 36.38 31.44 2o5j s VAL 86 CO 0.33 -0.05 0.25 0.68 -3.33 0.00 0.00 175.10 172.98 2o5j s VAL 87 N 1.41 3.68 -0.24 2.04 -7.23 -1.26 -2.98 120.40 115.81 2o5j s VAL 87 Ca -0.01 -1.43 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 2o5j s VAL 87 Cb -0.18 -3.20 0.10 0.00 0.56 0.00 0.00 36.38 33.66 2o5j s VAL 87 CO 0.01 -0.22 0.20 -0.60 -0.31 0.00 0.00 175.10 174.19 2o5j s ARG 88 N -3.93 0.21 0.66 4.82 3.00 -0.25 -4.70 118.95 118.77 2o5j s ARG 88 Ca 0.38 -0.09 -0.07 0.00 -1.00 0.00 0.00 55.73 54.96 2o5j s ARG 88 Cb -0.06 -1.13 0.04 0.00 0.00 0.00 0.00 34.95 33.80 2o5j s ARG 88 CO 0.26 -0.84 0.98 -0.59 0.00 0.00 0.00 175.30 175.10 2o5j s PHE 89 N 2.26 3.06 -0.45 5.12 -0.71 -1.26 -2.41 117.98 123.59 2o5j s PHE 89 Ca 0.07 0.55 0.15 0.00 -1.04 0.00 0.00 56.93 56.67 2o5j s PHE 89 Cb -0.15 -3.02 -0.19 0.00 -1.21 0.00 0.00 43.02 38.45 2o5j s PHE 89 CO -0.23 -1.18 0.52 1.28 -1.34 0.00 0.00 175.22 174.27 2o5j n LEU 90 N -2.80 0.45 -3.60 -1.99 4.32 -1.02 -4.98 117.00 107.37 2o5j n LEU 90 Ca 0.07 -0.32 -0.14 0.00 -0.02 0.00 0.00 56.01 55.60 2o5j n LEU 90 Cb 0.59 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.33 2o5j n LEU 90 CO 0.53 0.11 0.25 0.21 -1.22 0.00 0.00 177.39 177.27 2o5j s ASN 91 N -2.89 -0.41 0.44 -1.43 2.47 -1.26 -5.04 114.94 106.82 2o5j s ASN 91 Ca 0.02 0.18 0.28 0.00 0.42 0.00 0.00 52.86 53.76 2o5j s ASN 91 Cb 0.11 0.47 1.34 0.00 -1.45 0.00 0.00 41.25 41.72 2o5j s ASN 91 CO 0.62 -0.68 1.68 -0.65 -3.72 0.00 0.00 177.10 174.36 2o5j h PRO 92 N 2.94 0.17 -0.54 0.43 0.11 -2.02 0.90 132.00 133.99 2o5j h PRO 92 Ca -0.30 -0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.95 2o5j h PRO 92 Cb 1.20 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2o5j h PRO 92 CO 0.41 0.11 0.61 0.66 -0.21 0.00 0.00 178.00 179.59 2o5j h SER 93 N 0.17 0.00 -3.67 -2.05 4.64 -2.04 -3.22 113.55 107.39 2o5j h SER 93 Ca 0.73 0.00 -0.78 0.00 -0.47 0.00 0.00 61.79 61.27 2o5j h SER 93 Cb 2.25 0.00 -0.26 0.00 -0.31 0.00 0.00 62.40 64.08 2o5j h SER 93 CO -0.33 0.00 0.23 -0.76 -0.87 0.00 0.00 176.83 175.10 2o5j s LEU 94 N -7.14 6.56 -0.17 5.97 1.02 0.31 -4.81 118.68 120.42 2o5j s LEU 94 Ca -0.04 -2.82 -0.11 0.00 0.02 0.00 0.00 54.13 51.19 2o5j s LEU 94 Cb 0.15 -2.22 -0.22 0.00 0.02 0.00 0.00 46.19 43.91 2o5j s LEU 94 CO 0.52 -0.56 0.21 0.00 0.02 0.00 0.00 176.35 176.55 2o5j n GLN 95 N 3.93 0.68 -3.71 1.70 3.00 -1.22 -4.85 117.38 116.92 2o5j n GLN 95 Ca 0.17 0.34 -0.28 0.00 -0.01 0.00 0.00 57.00 57.22 2o5j n GLN 95 Cb 0.46 -1.69 -0.16 0.00 0.00 0.00 0.00 30.24 28.85 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 -2.49 0.45 -0.17 5.09 -1.32 -1.26 -3.12 115.64 112.81 2o5j s THR 96 Ca -0.27 -0.61 -0.02 0.00 -1.21 0.00 0.00 61.69 59.59 2o5j s THR 96 Cb 0.07 -1.04 -0.01 0.00 -1.51 0.00 0.00 72.50 70.01 2o5j s THR 96 CO 0.68 -0.30 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.00 2o5j s VAL 97 N 1.88 3.12 -0.44 5.08 1.01 -0.51 -4.94 120.40 125.59 2o5j s VAL 97 Ca 0.01 -0.61 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 2o5j s VAL 97 Cb -0.17 -2.36 0.03 0.00 0.00 0.00 0.00 36.38 33.89 2o5j s VAL 97 CO -0.12 0.49 0.45 -0.89 0.00 0.00 0.00 175.10 175.02 2o5j s THR 98 N 0.88 5.09 0.09 3.92 2.01 -1.26 -0.73 115.64 125.64 2o5j s THR 98 Ca -0.03 -0.50 -0.29 0.00 0.31 0.00 0.00 61.69 61.19 2o5j s THR 98 Cb -0.15 -4.08 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 2o5j s THR 98 CO 0.00 -0.49 0.93 -0.76 -0.69 0.00 0.00 174.62 173.62 2o5j s LEU 99 N 2.10 4.48 -0.01 4.42 1.02 -0.50 -4.90 118.68 125.29 2o5j s LEU 99 Ca 0.11 1.73 0.05 0.00 0.02 0.00 0.00 54.13 56.04 2o5j s LEU 99 Cb -0.18 -3.53 -0.03 0.00 0.02 0.00 0.00 46.19 42.47 2o5j s LEU 99 CO 0.12 -0.06 -0.17 -0.22 0.02 0.00 0.00 176.35 176.04 2o5j s LEU 100 N 0.05 2.60 -0.20 1.79 0.20 -1.26 -1.77 118.68 120.09 2o5j s LEU 100 Ca 0.46 -0.31 -0.20 0.00 0.69 0.00 0.00 54.13 54.77 2o5j s LEU 100 Cb -0.23 -1.52 0.05 0.00 -0.43 0.00 0.00 46.19 44.07 2o5j s LEU 100 CO 0.29 0.31 0.56 -1.48 -0.29 0.00 0.00 176.35 175.74 2o5j s LEU 101 N -0.97 -0.14 -0.15 -0.68 2.34 -1.09 -1.41 118.68 116.58 2o5j s LEU 101 Ca 0.12 1.08 -0.06 0.00 0.06 0.00 0.00 54.13 55.33 2o5j s LEU 101 Cb -0.10 1.94 0.07 0.00 -0.56 0.00 0.00 46.19 47.53 2o5j s LEU 101 CO 0.02 -0.23 0.32 -1.59 -1.06 0.00 0.00 176.35 173.81 2o5j s LYS 102 N 0.16 0.24 0.03 1.48 0.00 -1.26 -1.45 119.74 118.94 2o5j s LYS 102 Ca -0.01 0.78 0.02 0.00 0.00 0.00 0.00 55.97 56.76 2o5j s LYS 102 Cb -0.04 0.03 -0.02 0.00 0.00 0.00 0.00 37.83 37.81 2o5j s LYS 102 CO 0.01 -0.23 -0.08 0.00 0.00 0.00 0.00 175.35 175.05 2o5j s ALA 103 N 2.07 0.61 0.13 0.59 0.00 -0.48 -5.00 121.76 119.68 2o5j s ALA 103 Ca -0.03 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.31 2o5j s ALA 103 Cb -0.11 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2o5j s ALA 103 CO -0.10 0.04 -0.09 -1.83 0.00 0.00 0.00 175.76 173.77 2o5j s GLU 104 N -1.22 0.97 2.32 0.00 1.03 -1.26 -2.56 118.70 117.98 2o5j s GLU 104 Ca -0.06 -1.36 0.00 0.00 0.03 0.00 0.00 54.97 53.58 2o5j s GLU 104 Cb -0.08 -0.53 0.00 0.00 -0.80 0.00 0.00 34.13 32.72 2o5j s GLU 104 CO 0.00 0.06 0.00 0.41 -1.33 0.00 0.00 175.26 174.40 2o5j n GLY 105 N 0.00 -1.13 1.37 -3.83 0.00 -0.80 -4.34 105.19 96.46 2o5j n GLY 105 Ca -0.12 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.66 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 0.49 -4.24 1.61 -0.02 -0.87 -4.04 135.00 127.92 2o5j n PRO 106 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.21 2o5j n PRO 106 Cb 0.00 -1.25 -0.09 0.00 -0.02 0.00 0.00 33.50 32.14 2o5j n PRO 106 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2o5j s LYS 107 N 0.76 2.21 -0.10 -0.52 2.20 -1.23 -4.92 119.74 118.13 2o5j s LYS 107 Ca 0.00 -1.16 -0.21 0.00 -0.36 0.00 0.00 55.97 54.24 2o5j s LYS 107 Cb 0.00 -2.27 -0.04 0.00 -1.51 0.00 0.00 37.83 34.02 2o5j s LYS 107 CO 0.00 0.46 0.61 -1.21 -0.36 0.00 0.00 175.35 174.85 2o5j s GLU 108 N -2.75 4.38 -0.43 4.03 0.41 -1.26 -2.30 118.70 120.77 2o5j s GLU 108 Ca 0.25 0.70 -0.21 0.00 -0.41 0.00 0.00 54.97 55.30 2o5j s GLU 108 Cb -0.09 -3.46 0.02 0.00 -1.78 0.00 0.00 34.13 28.82 2o5j s GLU 108 CO 0.16 0.06 0.64 0.08 -0.49 0.00 0.00 175.26 175.72 2o5j s VAL 109 N 0.86 4.83 0.42 2.63 1.01 0.49 -4.98 120.40 125.66 2o5j s VAL 109 Ca 0.32 0.16 0.08 0.00 0.00 0.00 0.00 61.98 62.55 2o5j s VAL 109 Cb -0.17 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.01 2o5j s VAL 109 CO 0.14 -0.57 0.40 -0.54 0.00 0.00 0.00 175.10 174.54 2o5j s LYS 110 N 2.82 2.55 0.55 2.72 -0.14 -1.26 -0.38 119.74 126.60 2o5j s LYS 110 Ca 0.23 -1.52 0.34 0.00 -1.36 0.00 0.00 55.97 53.65 2o5j s LYS 110 Cb -0.14 -2.41 1.35 0.00 -1.68 0.00 0.00 37.83 34.95 2o5j s LYS 110 CO 0.19 -0.22 1.98 0.00 -0.76 0.00 0.00 175.35 176.53 2o5j h ALA 111 N 0.97 1.00 0.00 5.17 0.00 -0.37 -2.39 119.26 123.65 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 0.56 0.00 0.00 0.07 0.00 0.00 0.00 179.25 179.88 2o5j h ARG 112 N 0.00 0.00 0.00 0.00 0.11 -1.66 -3.11 114.38 109.73 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 0.52 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.60 2o5j h ARG 112 CO 0.00 0.00 -0.02 -0.44 0.10 0.00 0.00 179.97 179.61 2o5j h ASP 113 N 0.00 0.00 -2.96 0.08 5.19 -1.74 -3.44 116.42 113.55 2o5j h ASP 113 Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 2o5j h ASP 113 Cb 0.53 0.00 0.07 0.00 0.18 0.00 0.00 39.33 40.11 2o5j h ASP 113 CO 0.00 0.02 0.96 0.49 -3.12 0.00 0.00 179.24 177.59 2o5j n PHE 114 N -3.15 2.82 -1.75 4.55 3.01 -1.18 -4.78 117.46 116.97 2o5j n PHE 114 Ca -0.01 0.14 -0.42 0.00 1.01 0.00 0.00 57.45 58.17 2o5j n PHE 114 Cb 0.23 -2.64 -0.03 0.00 -0.01 0.00 0.00 39.48 37.02 2o5j n PHE 114 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2o5j s LEU 115 N 0.38 4.41 0.28 4.37 2.01 -0.50 -4.91 118.68 124.72 2o5j s LEU 115 Ca 0.70 2.60 -0.30 0.00 0.01 0.00 0.00 54.13 57.14 2o5j s LEU 115 Cb -0.50 -3.54 -0.13 0.00 0.01 0.00 0.00 46.19 42.03 2o5j s LEU 115 CO 0.40 -1.01 1.40 -2.65 1.01 0.00 0.00 176.35 175.49 2o5j n PRO 116 N 7.02 2.15 -4.71 1.29 -0.02 -1.26 -4.61 135.00 134.87 2o5j n PRO 116 Ca 0.19 0.76 -0.33 0.00 -2.02 0.00 0.00 63.50 62.10 2o5j n PRO 116 Cb 0.41 -2.41 -0.13 0.00 -0.02 0.00 0.00 33.50 31.35 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 -0.36 3.39 0.00 -1.45 1.01 -1.26 -5.07 120.40 116.66 2o5j s VAL 117 Ca 0.64 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2o5j s VAL 117 Cb -0.60 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2o5j s VAL 117 CO 0.53 0.57 0.56 0.00 0.00 0.00 0.00 175.10 176.76 2o5j n ALA 118 N 2.72 0.00 1.19 5.51 0.00 -1.26 -1.61 120.51 127.07 2o5j n ALA 118 Ca -0.18 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.36 2o5j n ALA 118 Cb 0.53 0.28 0.36 0.00 0.00 0.00 0.00 19.45 20.61 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 -2.19 1.69 -4.60 0.00 10.43 -1.26 -4.89 116.55 115.72 2o5j n ASP 119 Ca 0.00 -1.73 -0.30 0.00 2.57 0.00 0.00 54.79 55.33 2o5j n ASP 119 Cb 0.00 -0.12 -0.09 0.00 1.84 0.00 0.00 41.12 42.75 2o5j n ASP 119 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2o5j s VAL 120 N -1.77 3.53 0.08 2.53 0.11 -0.63 -2.44 120.40 121.81 2o5j s VAL 120 Ca 0.32 -1.17 0.05 0.00 -2.93 0.00 0.00 61.98 58.25 2o5j s VAL 120 Cb 0.17 -2.65 -0.03 0.00 -1.53 0.00 0.00 36.38 32.34 2o5j s VAL 120 CO 0.25 0.14 -0.14 -0.70 -3.33 0.00 0.00 175.10 171.32 2o5j s GLU 121 N -2.16 0.84 -0.32 1.54 2.12 -1.01 -4.42 118.70 115.28 2o5j s GLU 121 Ca 0.22 -0.99 0.03 0.00 0.36 0.00 0.00 54.97 54.59 2o5j s GLU 121 Cb -0.11 -0.83 0.09 0.00 0.26 0.00 0.00 34.13 33.54 2o5j s GLU 121 CO 0.14 0.18 0.02 0.42 -0.54 0.00 0.00 175.26 175.48 2o5j s ILE 122 N -1.38 2.37 -2.26 -3.70 1.01 -1.26 -1.09 121.20 114.89 2o5j s ILE 122 Ca -0.01 -2.08 0.30 0.00 0.00 0.00 0.00 60.65 58.86 2o5j s ILE 122 Cb -0.09 -2.62 0.72 0.00 0.01 0.00 0.00 42.46 40.47 2o5j s ILE 122 CO 0.02 -0.42 1.97 0.23 0.00 0.00 0.00 174.94 176.74 2o5j n MET 123 N 4.35 1.35 -3.17 2.79 2.81 -1.16 -4.17 117.12 119.92 2o5j n MET 123 Ca -0.02 -0.51 -0.28 0.00 -1.81 0.00 0.00 57.70 55.08 2o5j n MET 123 Cb 0.42 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.38 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 -0.38 4.27 0.31 7.83 5.15 -1.24 -4.96 115.26 126.24 2o5j n ASN 124 Ca 0.21 -3.57 -0.12 0.00 -0.60 0.00 0.00 54.58 50.50 2o5j n ASN 124 Cb 0.24 -0.65 -0.06 0.00 -0.53 0.00 0.00 39.78 38.78 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 3.65 -0.78 0.00 1.20 0.11 -1.90 -3.29 132.00 131.00 2o5j h PRO 125 Ca 0.18 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2o5j h PRO 125 Cb 0.58 0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2o5j h PRO 125 CO 0.85 -0.52 0.00 -3.47 -0.21 0.00 0.00 178.00 174.65 2o5j n ASP 126 N -4.72 0.00 -4.68 -2.05 4.64 -1.26 -0.34 116.55 108.14 2o5j n ASP 126 Ca -0.10 -0.93 -0.45 0.00 -1.38 0.00 0.00 54.79 51.93 2o5j n ASP 126 Cb 0.32 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.36 2o5j n ASP 126 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2o5j n LEU 127 N -0.79 3.36 -4.64 -2.67 -0.00 -1.24 -4.79 117.00 106.24 2o5j n LEU 127 Ca 0.09 1.09 -0.43 0.00 -0.00 0.00 0.00 56.01 56.76 2o5j n LEU 127 Cb 0.04 -1.47 -0.02 0.00 -0.00 0.00 0.00 43.42 41.97 2o5j n LEU 127 CO 0.07 -0.19 0.98 -2.28 -0.00 0.00 0.00 177.39 175.97 2o5j s HIS 128 N 0.78 3.08 -0.19 1.47 5.65 -1.26 -2.48 115.29 122.34 2o5j s HIS 128 Ca 0.76 1.14 -0.12 0.00 0.25 0.00 0.00 55.06 57.09 2o5j s HIS 128 Cb -0.63 -3.73 -0.20 0.00 -1.18 0.00 0.00 32.58 26.84 2o5j s HIS 128 CO 0.39 -0.90 0.12 -0.89 -0.65 0.00 0.00 174.74 172.80 2o5j n ILE 129 N 5.92 1.62 -3.62 0.89 2.08 0.49 -4.93 119.36 121.81 2o5j n ILE 129 Ca 0.12 -0.39 -0.06 0.00 0.56 0.00 0.00 62.75 62.99 2o5j n ILE 129 Cb 0.47 -1.82 -0.02 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 -2.48 -1.76 -0.26 -1.39 0.00 -1.07 -4.77 121.76 110.04 2o5j s ALA 130 Ca -0.29 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.28 2o5j s ALA 130 Cb 0.08 0.51 0.05 0.00 0.00 0.00 0.00 23.12 23.76 2o5j s ALA 130 CO 0.64 -0.87 -0.09 0.95 0.00 0.00 0.00 175.76 176.39 2o5j s THR 131 N -3.16 2.42 -0.13 0.00 -4.23 -1.26 -0.38 115.64 108.89 2o5j s THR 131 Ca 0.09 -1.41 -0.08 0.00 -1.18 0.00 0.00 61.69 59.11 2o5j s THR 131 Cb -0.01 -2.34 -0.04 0.00 1.34 0.00 0.00 72.50 71.45 2o5j s THR 131 CO -0.04 0.06 0.15 -0.76 -0.54 0.00 0.00 174.62 173.50 2o5j s LEU 132 N 1.19 4.35 0.00 4.79 1.02 -0.97 -2.99 118.68 126.07 2o5j s LEU 132 Ca -0.05 0.44 0.00 0.00 0.02 0.00 0.00 54.13 54.54 2o5j s LEU 132 Cb -0.19 -2.11 0.00 0.00 0.02 0.00 0.00 46.19 43.92 2o5j s LEU 132 CO -0.05 0.35 0.00 1.21 0.02 0.00 0.00 176.35 177.88 2o5j n GLU 133 N 2.34 0.00 -3.92 1.70 2.13 0.25 -3.55 120.64 119.58 2o5j n GLU 133 Ca -0.19 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.53 2o5j n GLU 133 Cb 0.54 -0.01 -0.11 0.00 0.27 0.00 0.00 31.44 32.14 2o5j n GLU 133 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2o5j s GLU 134 N 0.00 0.39 -1.41 5.31 2.56 -1.26 -2.06 118.70 122.22 2o5j s GLU 134 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.97 54.48 2o5j s GLU 134 Cb 0.00 0.15 0.00 0.00 2.00 0.00 0.00 34.13 36.28 2o5j s GLU 134 CO 0.00 -0.08 0.00 0.41 -0.56 0.00 0.00 175.26 175.03 2o5j n GLY 135 N 1.57 0.15 3.54 -1.50 0.00 -1.26 -4.65 105.19 103.04 2o5j n GLY 135 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 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 1.26 -0.38 -0.02 0.00 -1.26 -4.77 107.32 100.02 2o5j s GLY 136 Ca 0.00 -1.17 -0.12 0.00 0.00 0.00 0.00 44.72 43.44 2o5j s GLY 136 CO 0.00 2.27 0.22 0.50 0.00 0.00 0.00 173.10 176.09 2o5j s ARG 137 N 4.48 2.83 -0.24 2.90 0.52 -1.26 -1.91 118.95 126.28 2o5j s ARG 137 Ca 0.34 -1.08 0.00 0.00 -0.52 0.00 0.00 55.73 54.47 2o5j s ARG 137 Cb -0.11 -3.77 0.06 0.00 0.52 0.00 0.00 34.95 31.66 2o5j s ARG 137 CO 0.20 -0.71 -0.02 -1.17 0.02 0.00 0.00 175.30 173.61 2o5j s LEU 138 N 1.57 2.41 -0.25 2.53 0.20 -1.06 -4.99 118.68 119.08 2o5j s LEU 138 Ca 0.02 -1.19 -0.00 0.00 0.69 0.00 0.00 54.13 53.65 2o5j s LEU 138 Cb -0.19 -1.08 0.07 0.00 -0.43 0.00 0.00 46.19 44.57 2o5j s LEU 138 CO 0.07 -0.27 0.02 0.21 -0.29 0.00 0.00 176.35 176.09 2o5j s ASN 139 N 1.47 3.75 0.26 3.68 3.84 -1.26 -1.38 114.94 125.30 2o5j s ASN 139 Ca -0.03 -1.30 0.02 0.00 0.21 0.00 0.00 52.86 51.76 2o5j s ASN 139 Cb -0.18 -0.99 -0.05 0.00 -0.55 0.00 0.00 41.25 39.47 2o5j s ASN 139 CO -0.08 -0.31 0.06 0.00 -2.79 0.00 0.00 177.10 173.98 2o5j s MET 140 N 1.52 1.42 -0.19 0.43 0.23 -0.53 -1.97 119.30 120.23 2o5j s MET 140 Ca 0.01 -1.76 -0.03 0.00 -1.03 0.00 0.00 55.69 52.88 2o5j s MET 140 Cb -0.18 -0.45 0.06 0.00 -1.53 0.00 0.00 34.83 32.73 2o5j s MET 140 CO -0.12 -0.22 0.03 -1.83 -2.03 0.00 0.00 175.02 170.84 2o5j s GLU 141 N -3.97 0.72 -0.28 3.16 -1.05 -0.92 -2.68 118.70 113.69 2o5j s GLU 141 Ca 0.35 -0.42 -0.05 0.00 -0.15 0.00 0.00 54.97 54.69 2o5j s GLU 141 Cb 0.08 -2.07 0.01 0.00 -0.44 0.00 0.00 34.13 31.71 2o5j s GLU 141 CO 0.12 -0.61 0.04 0.08 0.95 0.00 0.00 175.26 175.84 2o5j s VAL 142 N 1.84 3.70 0.58 1.83 1.01 -0.73 -1.35 120.40 127.28 2o5j s VAL 142 Ca -0.01 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 2o5j s VAL 142 Cb -0.17 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 2o5j s VAL 142 CO -0.08 0.14 1.10 -0.60 0.00 0.00 0.00 175.10 175.67 2o5j s ARG 143 N 1.47 3.22 -0.01 2.72 6.06 -0.03 -1.41 118.95 130.96 2o5j s ARG 143 Ca 0.02 1.43 -0.00 0.00 -2.50 0.00 0.00 55.73 54.68 2o5j s ARG 143 Cb -0.17 -2.00 0.02 0.00 0.06 0.00 0.00 34.95 32.86 2o5j s ARG 143 CO 0.01 -0.92 0.02 0.08 -2.50 0.00 0.00 175.30 171.99 2o5j s VAL 144 N -2.12 -0.04 0.28 7.11 1.01 0.09 -2.23 120.40 124.49 2o5j s VAL 144 Ca 0.68 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.85 2o5j s VAL 144 Cb -0.20 -0.06 -0.06 0.00 0.00 0.00 0.00 36.38 36.06 2o5j s VAL 144 CO 0.33 0.06 0.03 -0.62 0.00 0.00 0.00 175.10 174.90 2o5j s ASP 145 N 0.76 2.07 -0.32 3.32 2.15 -1.02 -1.43 116.67 122.19 2o5j s ASP 145 Ca -0.06 -1.30 -0.06 0.00 0.43 0.00 0.00 52.55 51.56 2o5j s ASP 145 Cb -0.09 -0.03 0.04 0.00 -0.30 0.00 0.00 42.92 42.54 2o5j s ASP 145 CO -0.02 -0.56 0.08 -0.60 -0.17 0.00 0.00 175.17 173.90 2o5j s ARG 146 N -3.88 2.66 0.00 4.34 3.52 -1.18 -2.75 118.95 121.66 2o5j s ARG 146 Ca 0.33 -1.14 0.00 0.00 -0.13 0.00 0.00 55.73 54.79 2o5j s ARG 146 Cb 0.07 -3.39 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 2o5j s ARG 146 CO 0.12 -0.62 0.00 0.41 -0.81 0.00 0.00 175.30 174.40 2o5j n GLY 147 N 4.79 4.41 3.05 8.12 0.00 -1.17 -4.97 105.19 119.42 2o5j n GLY 147 Ca -0.13 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 2o5j n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 148 N -0.87 0.04 0.00 1.61 1.01 -1.26 -1.43 120.40 119.50 2o5j s VAL 148 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.69 2o5j s VAL 148 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 36.09 2o5j s VAL 148 CO 0.00 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.55 2o5j n GLY 149 N 2.38 0.01 3.42 4.51 0.00 -1.26 -4.78 105.19 109.46 2o5j n GLY 149 Ca -0.17 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 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 2.95 -0.27 1.61 5.04 -1.26 -1.61 117.35 123.81 2o5j s TYR 150 Ca 0.00 -0.54 0.00 0.00 -2.44 0.00 0.00 57.07 54.09 2o5j s TYR 150 Cb 0.00 -1.97 0.08 0.00 0.35 0.00 0.00 41.96 40.42 2o5j s TYR 150 CO 0.00 -0.21 0.02 0.08 -1.34 0.00 0.00 175.55 174.10 2o5j s VAL 151 N 0.65 1.33 0.50 3.14 1.01 -1.08 -4.99 120.40 120.96 2o5j s VAL 151 Ca -0.04 -1.37 -0.22 0.00 0.00 0.00 0.00 61.98 60.36 2o5j s VAL 151 Cb -0.15 -1.80 -0.08 0.00 0.00 0.00 0.00 36.38 34.35 2o5j s VAL 151 CO 0.02 -0.36 0.96 -2.65 0.00 0.00 0.00 175.10 173.07 2o5j n PRO 152 N 4.70 1.14 0.26 2.72 -0.02 -1.26 -0.55 135.00 142.00 2o5j n PRO 152 Ca -0.06 0.42 0.18 0.00 -2.02 0.00 0.00 63.50 62.02 2o5j n PRO 152 Cb 0.43 -2.07 0.92 0.00 -0.02 0.00 0.00 33.50 32.76 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 1.07 1.53 -0.01 3.55 0.00 -1.91 -0.80 119.26 122.68 2o5j h ALA 153 Ca -0.46 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.24 2o5j h ALA 153 Cb 1.35 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2o5j h ALA 153 CO 0.54 -0.21 -0.87 0.93 0.00 0.00 0.00 179.25 179.64 2o5j h GLU 154 N 0.00 0.30 -0.19 0.00 3.07 -1.93 -2.49 114.58 113.34 2o5j h GLU 154 Ca 0.05 -0.31 -0.07 0.00 -0.50 0.00 0.00 59.36 58.52 2o5j h GLU 154 Cb 0.37 0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.36 2o5j h GLU 154 CO -0.00 1.00 -0.17 -0.22 -1.40 0.00 0.00 179.01 178.21 2o5j h LYS 155 N 0.18 0.45 0.06 2.33 3.64 -1.48 -3.37 116.57 118.38 2o5j h LYS 155 Ca -0.05 -0.23 -0.33 0.00 -1.27 0.00 0.00 60.65 58.76 2o5j h LYS 155 Cb 1.49 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.28 2o5j h LYS 155 CO 0.14 0.80 -1.84 -2.39 -2.27 0.00 0.00 179.45 173.89 2o5j n HIS 156 N -4.48 0.94 -3.08 1.91 1.44 -1.21 -5.05 115.22 105.69 2o5j n HIS 156 Ca -0.05 0.28 -0.19 0.00 -2.01 0.00 0.00 57.72 55.75 2o5j n HIS 156 Cb 0.39 -1.11 0.02 0.00 0.12 0.00 0.00 29.99 29.40 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 1.76 -0.87 3.79 -1.39 0.00 -0.94 -4.95 105.19 102.60 2o5j n GLY 157 Ca -0.35 1.19 -0.38 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.41 -0.61 -1.09 -1.26 -5.04 121.20 115.13 2o5j s ILE 158 Ca 0.29 1.49 0.05 0.00 -2.23 0.00 0.00 60.65 60.25 2o5j s ILE 158 Cb -0.06 -4.02 0.19 0.00 -1.58 0.00 0.00 42.46 37.00 2o5j s ILE 158 CO 0.80 0.45 0.40 0.29 -1.23 0.00 0.00 174.94 175.64 2o5j n LYS 159 N 1.39 0.32 -0.01 2.79 4.76 -1.26 -4.44 118.16 121.71 2o5j n LYS 159 Ca -0.06 -3.13 -0.13 0.00 -2.87 0.00 0.00 58.31 52.12 2o5j n LYS 159 Cb 0.50 -1.56 -0.10 0.00 -1.84 0.00 0.00 35.03 32.03 2o5j n LYS 159 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2o5j h ASP 160 N 5.22 -0.04 -3.70 4.39 3.32 -1.96 -3.44 116.42 120.21 2o5j h ASP 160 Ca 0.21 -0.54 -0.67 0.00 0.02 0.00 0.00 57.03 56.05 2o5j h ASP 160 Cb 0.91 0.01 -0.18 0.00 0.22 0.00 0.00 39.33 40.29 2o5j h ASP 160 CO 0.38 0.54 -0.75 -0.60 -1.72 0.00 0.00 179.24 177.09 2o5j s ARG 161 N -3.78 2.26 0.33 3.56 6.06 -1.26 -5.04 118.95 121.09 2o5j s ARG 161 Ca -0.16 -0.90 0.04 0.00 -2.50 0.00 0.00 55.73 52.21 2o5j s ARG 161 Cb 0.01 -2.34 0.65 0.00 0.06 0.00 0.00 34.95 33.33 2o5j s ARG 161 CO 0.64 0.55 1.93 -0.84 -2.50 0.00 0.00 175.30 175.08 2o5j h ILE 162 N 3.64 1.03 -0.01 4.11 3.07 -1.98 -2.00 117.51 125.37 2o5j h ILE 162 Ca -0.48 -0.30 0.00 0.00 1.55 0.00 0.00 64.86 65.63 2o5j h ILE 162 Cb 1.16 0.08 0.00 0.00 -0.27 0.00 0.00 36.82 37.80 2o5j h ILE 162 CO 0.51 0.16 -0.04 0.59 -1.05 0.00 0.00 178.15 178.32 2o5j n ASN 163 N -4.49 1.47 -4.73 2.16 5.03 -1.26 -4.93 115.26 108.51 2o5j n ASN 163 Ca 0.12 -1.42 -0.32 0.00 0.87 0.00 0.00 54.58 53.83 2o5j n ASN 163 Cb 0.22 0.02 0.11 0.00 -1.02 0.00 0.00 39.78 39.11 2o5j n ASN 163 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2o5j s ALA 164 N -2.08 2.04 -0.14 5.41 0.00 -0.76 -4.62 121.76 121.62 2o5j s ALA 164 Ca 0.36 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.82 2o5j s ALA 164 Cb 0.21 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.98 2o5j s ALA 164 CO 0.36 -2.00 -0.16 0.96 0.00 0.00 0.00 175.76 174.92 2o5j s ILE 165 N -2.61 1.68 0.84 0.00 -4.36 -0.31 -4.96 121.20 111.48 2o5j s ILE 165 Ca 0.66 -0.72 -0.11 0.00 -0.26 0.00 0.00 60.65 60.21 2o5j s ILE 165 Cb -0.21 -1.53 0.10 0.00 1.25 0.00 0.00 42.46 42.07 2o5j s ILE 165 CO 0.53 0.48 1.15 -2.84 0.24 0.00 0.00 174.94 174.49 2o5j s PRO 166 N 1.19 1.53 0.04 0.37 0.02 -1.26 -2.30 135.00 134.58 2o5j s PRO 166 Ca -0.01 1.50 0.03 0.00 0.02 0.00 0.00 61.00 62.55 2o5j s PRO 166 Cb -0.14 -1.79 -0.02 0.00 0.02 0.00 0.00 34.50 32.57 2o5j s PRO 166 CO -0.06 -2.25 -0.10 0.08 -0.33 0.00 0.00 177.00 174.34 2o5j s VAL 167 N -2.58 0.71 0.18 3.83 1.01 -0.77 -4.87 120.40 117.92 2o5j s VAL 167 Ca 0.67 -1.01 -0.33 0.00 0.00 0.00 0.00 61.98 61.31 2o5j s VAL 167 Cb -0.23 -0.72 -0.13 0.00 0.00 0.00 0.00 36.38 35.30 2o5j s VAL 167 CO 0.55 -0.24 1.61 -0.90 0.00 0.00 0.00 175.10 176.12 2o5j n ASP 168 N 1.66 3.36 -4.71 3.32 5.75 -1.26 -4.36 116.55 120.32 2o5j n ASP 168 Ca -0.21 1.08 -0.40 0.00 -0.01 0.00 0.00 54.79 55.25 2o5j n ASP 168 Cb 0.55 -1.48 -0.04 0.00 -1.03 0.00 0.00 41.12 39.12 2o5j n ASP 168 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2o5j s ALA 169 N 0.91 3.31 -0.42 2.12 0.00 0.29 -4.77 121.76 123.19 2o5j s ALA 169 Ca 0.77 0.23 0.04 0.00 0.00 0.00 0.00 51.96 52.99 2o5j s ALA 169 Cb -0.62 -3.09 0.11 0.00 0.00 0.00 0.00 23.12 19.53 2o5j s ALA 169 CO 0.37 -0.20 0.15 0.14 0.00 0.00 0.00 175.76 176.22 2o5j s VAL 170 N 1.01 2.38 -1.82 0.00 -7.23 -1.26 -2.63 120.40 110.85 2o5j s VAL 170 Ca 0.41 -2.78 0.22 0.00 -1.81 0.00 0.00 61.98 58.03 2o5j s VAL 170 Cb -0.18 -2.71 -0.05 0.00 0.56 0.00 0.00 36.38 34.00 2o5j s VAL 170 CO 0.20 -0.70 1.07 0.49 -0.31 0.00 0.00 175.10 175.85 2o5j n PHE 171 N 3.72 0.00 -2.99 2.82 3.72 -0.64 -4.15 117.46 119.95 2o5j n PHE 171 Ca 0.04 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.04 2o5j n PHE 171 Cb 0.37 -0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 38.86 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 -2.59 6.93 0.00 4.37 0.15 -1.26 -2.20 113.70 119.11 2o5j s SER 172 Ca 0.16 1.13 0.16 0.00 0.70 0.00 0.00 55.95 58.11 2o5j s SER 172 Cb 0.18 -2.42 0.96 0.00 -1.71 0.00 0.00 66.02 63.02 2o5j s SER 172 CO 0.63 -0.25 1.58 -2.65 1.20 0.00 0.00 173.24 173.75 2o5j n PRO 173 N 4.55 0.95 -4.39 5.44 -0.02 -1.26 -4.72 135.00 135.54 2o5j n PRO 173 Ca 0.01 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.16 2o5j n PRO 173 Cb 0.50 -1.26 -0.15 0.00 -0.02 0.00 0.00 33.50 32.57 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 -2.00 2.87 -0.16 -1.45 1.01 -1.26 -0.11 120.40 119.30 2o5j s VAL 174 Ca 0.24 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 2o5j s VAL 174 Cb 0.11 -2.24 -0.23 0.00 0.00 0.00 0.00 36.38 34.02 2o5j s VAL 174 CO 0.19 0.50 0.29 -1.14 0.00 0.00 0.00 175.10 174.93 2o5j n ARG 175 N 4.16 0.68 -3.72 2.72 0.63 -1.00 -4.94 116.66 115.19 2o5j n ARG 175 Ca -0.19 0.38 -0.14 0.00 -0.92 0.00 0.00 57.85 56.99 2o5j n ARG 175 Cb 0.52 -1.72 -0.09 0.00 0.45 0.00 0.00 32.46 31.62 2o5j n ARG 175 CO 0.00 0.00 0.00 -0.98 -2.51 0.00 0.00 177.63 174.14 2o5j s ARG 176 N -2.48 0.68 0.14 -0.14 1.70 -1.25 -5.05 118.95 112.54 2o5j s ARG 176 Ca -0.25 0.05 0.11 0.00 -0.47 0.00 0.00 55.73 55.16 2o5j s ARG 176 Cb 0.06 0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 34.71 2o5j s ARG 176 CO 0.69 -0.17 -0.25 0.08 -1.08 0.00 0.00 175.30 174.57 2o5j s VAL 177 N -0.94 2.39 -0.22 4.99 1.01 -1.26 -1.43 120.40 124.94 2o5j s VAL 177 Ca -0.10 -1.76 -0.16 0.00 0.00 0.00 0.00 61.98 59.97 2o5j s VAL 177 Cb -0.04 -2.08 0.06 0.00 0.00 0.00 0.00 36.38 34.32 2o5j s VAL 177 CO 0.04 0.06 0.56 0.00 0.00 0.00 0.00 175.10 175.76 2o5j s ALA 178 N -1.18 -1.44 0.03 5.51 0.00 -0.45 -4.99 121.76 119.24 2o5j s ALA 178 Ca 0.16 1.82 0.03 0.00 0.00 0.00 0.00 51.96 53.97 2o5j s ALA 178 Cb -0.10 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 2o5j s ALA 178 CO 0.07 -0.30 -0.09 -0.59 0.00 0.00 0.00 175.76 174.86 2o5j s PHE 179 N 1.00 0.75 -0.02 0.00 -0.12 -1.26 0.13 117.98 118.45 2o5j s PHE 179 Ca -0.06 -0.39 0.04 0.00 -0.05 0.00 0.00 56.93 56.48 2o5j s PHE 179 Cb -0.06 -0.45 -0.01 0.00 -0.63 0.00 0.00 43.02 41.88 2o5j s PHE 179 CO -0.09 -0.04 -0.14 -0.65 -0.05 0.00 0.00 175.22 174.25 2o5j s GLN 180 N -1.21 1.22 -0.58 1.99 -0.21 -0.71 -4.99 119.66 115.17 2o5j s GLN 180 Ca -0.05 -0.48 0.02 0.00 0.02 0.00 0.00 55.36 54.87 2o5j s GLN 180 Cb -0.08 -1.14 0.14 0.00 1.00 0.00 0.00 33.01 32.93 2o5j s GLN 180 CO 0.01 0.25 0.35 0.08 -2.12 0.00 0.00 175.29 173.86 2o5j s VAL 181 N -0.16 2.96 -0.01 1.09 1.01 -1.25 -1.96 120.40 122.09 2o5j s VAL 181 Ca 0.02 -3.35 -0.13 0.00 0.00 0.00 0.00 61.98 58.52 2o5j s VAL 181 Cb -0.07 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 2o5j s VAL 181 CO 0.00 -0.85 0.37 -1.83 0.00 0.00 0.00 175.10 172.79 2o5j s GLU 182 N -0.39 3.82 0.38 2.72 1.03 -0.93 -4.78 118.70 120.55 2o5j s GLU 182 Ca 0.18 0.30 -0.28 0.00 0.03 0.00 0.00 54.97 55.20 2o5j s GLU 182 Cb -0.22 -3.18 -0.11 0.00 -0.80 0.00 0.00 34.13 29.82 2o5j s GLU 182 CO -0.03 0.69 1.49 -0.51 -1.33 0.00 0.00 175.26 175.57 2o5j s ASP 183 N -1.17 6.33 0.13 0.83 1.01 -1.26 -2.36 116.67 120.18 2o5j s ASP 183 Ca 0.24 3.06 0.07 0.00 0.71 0.00 0.00 52.55 56.64 2o5j s ASP 183 Cb -0.16 -2.67 -0.04 0.00 1.01 0.00 0.00 42.92 41.07 2o5j s ASP 183 CO 0.13 -0.89 -0.18 0.28 0.21 0.00 0.00 175.17 174.72 2o5j s THR 184 N -1.11 1.61 -0.22 -1.27 -1.32 -1.17 -4.90 115.64 107.26 2o5j s THR 184 Ca 0.53 -1.70 -0.06 0.00 -1.21 0.00 0.00 61.69 59.25 2o5j s THR 184 Cb -0.47 -1.61 -0.02 0.00 -1.51 0.00 0.00 72.50 68.89 2o5j s THR 184 CO 0.63 -0.25 0.03 0.00 -2.21 0.00 0.00 174.62 172.82 2o5j s ARG 185 N -2.39 3.61 -0.27 7.08 1.70 -1.26 -4.16 118.95 123.26 2o5j s ARG 185 Ca 0.10 -0.51 -0.02 0.00 -0.47 0.00 0.00 55.73 54.82 2o5j s ARG 185 Cb -0.07 -3.18 0.03 0.00 -0.57 0.00 0.00 34.95 31.16 2o5j s ARG 185 CO 0.05 -0.10 -0.03 -1.17 -1.08 0.00 0.00 175.30 172.97 2o5j s LEU 186 N 1.32 3.45 0.00 -1.89 2.96 -1.26 -5.03 118.68 118.22 2o5j s LEU 186 Ca 0.04 -0.94 0.00 0.00 -0.22 0.00 0.00 54.13 53.01 2o5j s LEU 186 Cb -0.15 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.84 2o5j s LEU 186 CO 0.02 -0.17 0.00 0.61 -1.32 0.00 0.00 176.35 175.49 2o5j n GLY 187 N 4.69 0.00 0.10 7.98 0.00 -1.26 -2.37 105.19 114.33 2o5j n GLY 187 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 2o5j n GLY 187 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2o5j h GLN 188 N 0.00 -0.22 -5.13 1.61 3.07 -2.03 -3.45 115.11 108.96 2o5j h GLN 188 Ca 0.00 0.02 -0.66 0.00 0.09 0.00 0.00 58.65 58.09 2o5j h GLN 188 Cb 0.00 0.05 -0.29 0.00 0.08 0.00 0.00 27.48 27.32 2o5j h GLN 188 CO 0.00 -0.15 -0.77 0.50 0.09 0.00 0.00 178.83 178.50 2o5j s ARG 189 N -2.59 3.28 0.30 0.06 6.06 -1.00 -5.01 118.95 120.05 2o5j s ARG 189 Ca -0.03 -0.70 0.05 0.00 -2.50 0.00 0.00 55.73 52.54 2o5j s ARG 189 Cb 0.00 -2.76 0.49 0.00 0.06 0.00 0.00 34.95 32.74 2o5j s ARG 189 CO 0.10 -0.05 1.75 1.15 -2.50 0.00 0.00 175.30 175.74 2o5j h THR 190 N 5.66 1.27 -0.56 4.11 2.02 -1.88 -3.36 112.91 120.17 2o5j h THR 190 Ca -0.36 -1.27 -0.18 0.00 0.77 0.00 0.00 66.41 65.36 2o5j h THR 190 Cb 1.18 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 69.00 2o5j h THR 190 CO 0.59 0.39 0.45 1.51 0.37 0.00 0.00 175.52 178.84 2o5j s ASP 191 N -6.84 4.63 0.07 4.18 -4.77 -1.26 -4.52 116.67 108.16 2o5j s ASP 191 Ca -0.06 -0.42 -0.08 0.00 -3.30 0.00 0.00 52.55 48.70 2o5j s ASP 191 Cb 0.14 -2.56 -0.00 0.00 -1.09 0.00 0.00 42.92 39.41 2o5j s ASP 191 CO 0.77 -3.21 0.17 -0.76 0.70 0.00 0.00 175.17 172.84 2o5j s LEU 192 N 12.00 1.52 0.01 2.11 1.43 -1.26 -4.77 118.68 129.73 2o5j s LEU 192 Ca 0.79 -0.62 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 2o5j s LEU 192 Cb -0.09 0.93 -0.04 0.00 0.03 0.00 0.00 46.19 47.02 2o5j s LEU 192 CO 0.03 -0.68 -0.03 -1.81 0.23 0.00 0.00 176.35 174.10 2o5j s ASP 193 N -2.69 4.92 -0.21 2.29 1.11 -0.81 -3.06 116.67 118.22 2o5j s ASP 193 Ca 0.03 -0.08 -0.02 0.00 0.18 0.00 0.00 52.55 52.65 2o5j s ASP 193 Cb 0.04 -1.22 0.07 0.00 1.07 0.00 0.00 42.92 42.87 2o5j s ASP 193 CO -0.09 0.27 0.03 -0.75 1.18 0.00 0.00 175.17 175.81 2o5j s LYS 194 N -1.62 0.77 -0.20 8.23 2.20 -0.99 -1.30 119.74 126.83 2o5j s LYS 194 Ca 0.19 -0.57 -0.09 0.00 -0.36 0.00 0.00 55.97 55.14 2o5j s LYS 194 Cb -0.11 -2.14 -0.05 0.00 -1.51 0.00 0.00 37.83 34.02 2o5j s LYS 194 CO 0.10 -0.68 0.12 -1.17 -0.36 0.00 0.00 175.35 173.36 2o5j s LEU 195 N 1.78 4.07 -0.20 5.43 2.96 -1.13 -2.19 118.68 129.40 2o5j s LEU 195 Ca -0.00 0.16 -0.01 0.00 -0.22 0.00 0.00 54.13 54.05 2o5j s LEU 195 Cb -0.17 -2.06 0.06 0.00 0.50 0.00 0.00 46.19 44.52 2o5j s LEU 195 CO -0.10 0.15 -0.00 0.42 -1.32 0.00 0.00 176.35 175.50 2o5j s THR 196 N 0.53 0.88 -0.19 3.68 -4.23 -0.83 -1.18 115.64 114.31 2o5j s THR 196 Ca 0.07 -0.74 -0.04 0.00 -1.18 0.00 0.00 61.69 59.80 2o5j s THR 196 Cb -0.12 -1.27 -0.02 0.00 1.34 0.00 0.00 72.50 72.44 2o5j s THR 196 CO 0.00 -0.12 -0.04 -1.48 -0.54 0.00 0.00 174.62 172.43 2o5j s LEU 197 N 1.70 3.03 -0.24 4.79 2.34 -0.67 -1.74 118.68 127.88 2o5j s LEU 197 Ca -0.02 -0.28 -0.15 0.00 0.06 0.00 0.00 54.13 53.74 2o5j s LEU 197 Cb -0.17 -1.75 -0.04 0.00 -0.56 0.00 0.00 46.19 43.67 2o5j s LEU 197 CO -0.07 0.07 0.36 0.00 -1.06 0.00 0.00 176.35 175.65 2o5j s ARG 198 N 0.97 4.08 -0.09 1.48 1.70 0.35 -2.46 118.95 124.98 2o5j s ARG 198 Ca 0.00 0.07 0.03 0.00 -0.47 0.00 0.00 55.73 55.37 2o5j s ARG 198 Cb -0.15 -3.60 -0.01 0.00 -0.57 0.00 0.00 34.95 30.63 2o5j s ARG 198 CO 0.01 -0.15 -0.20 0.42 -1.08 0.00 0.00 175.30 174.30 2o5j s ILE 199 N 1.67 2.45 -0.11 4.99 1.09 -0.95 -1.34 121.20 129.00 2o5j s ILE 199 Ca 0.16 -0.90 -0.03 0.00 -1.10 0.00 0.00 60.65 58.78 2o5j s ILE 199 Cb -0.15 -1.96 -0.03 0.00 -1.06 0.00 0.00 42.46 39.26 2o5j s ILE 199 CO 0.09 0.56 -0.01 0.26 -0.10 0.00 0.00 174.94 175.73 2o5j s TRP 200 N 0.06 3.12 -0.01 3.97 0.51 -0.51 -1.90 118.94 124.18 2o5j s TRP 200 Ca -0.08 0.03 0.05 0.00 -2.12 0.00 0.00 56.10 53.98 2o5j s TRP 200 Cb -0.15 -1.86 -0.01 0.00 -0.81 0.00 0.00 33.47 30.63 2o5j s TRP 200 CO 0.05 0.29 -0.15 0.95 -0.51 0.00 0.00 176.95 177.58 2o5j s THR 201 N -0.40 1.17 -1.32 2.01 -4.23 0.19 -2.38 115.64 110.68 2o5j s THR 201 Ca 0.07 -0.66 0.09 0.00 -1.18 0.00 0.00 61.69 60.01 2o5j s THR 201 Cb -0.12 -0.98 0.14 0.00 1.34 0.00 0.00 72.50 72.88 2o5j s THR 201 CO 0.02 0.31 1.21 -0.90 -0.54 0.00 0.00 174.62 174.72 2o5j n ASP 202 N 2.65 0.00 0.00 3.99 3.85 0.84 -4.10 116.55 123.78 2o5j n ASP 202 Ca -0.15 0.24 0.00 0.00 -0.71 0.00 0.00 54.79 54.18 2o5j n ASP 202 Cb 0.55 -0.34 0.00 0.00 -1.35 0.00 0.00 41.12 39.98 2o5j n ASP 202 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2o5j n GLY 203 N -0.50 1.51 0.40 6.12 0.00 -1.26 -4.96 105.19 106.50 2o5j n GLY 203 Ca 0.04 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 2o5j n GLY 203 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2o5j h SER 204 N 1.65 -1.61 -1.66 1.61 0.87 -1.86 -3.42 113.55 109.13 2o5j h SER 204 Ca 0.00 0.25 -0.62 0.00 -1.23 0.00 0.00 61.79 60.19 2o5j h SER 204 Cb 0.00 0.72 -0.13 0.00 -0.44 0.00 0.00 62.40 62.55 2o5j h SER 204 CO 0.00 -0.34 -0.59 0.68 -0.53 0.00 0.00 176.83 176.05 2o5j s VAL 205 N -5.78 2.04 0.34 2.23 -7.23 -1.26 -4.93 120.40 105.80 2o5j s VAL 205 Ca -0.14 -1.97 0.06 0.00 -1.81 0.00 0.00 61.98 58.12 2o5j s VAL 205 Cb 0.12 -2.99 -0.01 0.00 0.56 0.00 0.00 36.38 34.06 2o5j s VAL 205 CO 0.65 -0.01 0.47 0.28 -0.31 0.00 0.00 175.10 176.19 2o5j s THR 206 N -2.70 4.07 0.23 5.32 -1.32 -1.26 -4.70 115.64 115.28 2o5j s THR 206 Ca 0.36 -0.99 -0.07 0.00 -1.21 0.00 0.00 61.69 59.78 2o5j s THR 206 Cb 0.09 -3.41 0.18 0.00 -1.51 0.00 0.00 72.50 67.86 2o5j s THR 206 CO 0.18 -0.16 1.83 -0.65 -2.21 0.00 0.00 174.62 173.62 2o5j h PRO 207 N 0.88 0.83 -0.21 7.08 0.11 -1.84 -1.50 132.00 137.35 2o5j h PRO 207 Ca -0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2o5j h PRO 207 Cb 1.26 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2o5j h PRO 207 CO 0.53 0.55 0.04 1.25 -0.21 0.00 0.00 178.00 180.15 2o5j h LEU 208 N 0.85 0.33 -0.54 2.35 6.46 -1.94 -2.20 115.31 120.62 2o5j h LEU 208 Ca 0.34 -0.25 0.07 0.00 -0.12 0.00 0.00 57.88 57.92 2o5j h LEU 208 Cb 0.17 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 39.96 2o5j h LEU 208 CO -0.17 0.50 0.23 -0.33 -0.62 0.00 0.00 178.44 178.04 2o5j h GLU 209 N 0.15 0.42 0.29 1.25 5.08 -1.87 -1.92 114.58 117.98 2o5j h GLU 209 Ca 0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2o5j h GLU 209 Cb 0.30 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2o5j h GLU 209 CO 0.00 0.27 -0.21 0.00 -1.00 0.00 0.00 179.01 178.08 2o5j h ALA 210 N 1.34 -0.49 -0.54 3.43 0.00 -1.20 -1.70 119.26 120.10 2o5j h ALA 210 Ca 0.26 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.18 2o5j h ALA 210 Cb 0.26 0.27 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 2o5j h ALA 210 CO -0.23 -0.79 0.05 1.25 0.00 0.00 0.00 179.25 179.52 2o5j h LEU 211 N -0.50 -0.13 -0.24 0.00 5.85 -1.14 0.11 115.31 119.26 2o5j h LEU 211 Ca -0.02 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 2o5j h LEU 211 Cb 0.43 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 2o5j h LEU 211 CO 0.01 -0.04 0.14 0.78 -0.34 0.00 0.00 178.44 178.98 2o5j h ASN 212 N 0.17 0.29 -0.34 1.25 4.21 -1.21 -0.35 115.58 119.60 2o5j h ASN 212 Ca 0.28 -0.06 -0.02 0.00 1.21 0.00 0.00 56.30 57.71 2o5j h ASN 212 Cb 0.41 -0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.52 2o5j h ASN 212 CO -0.41 0.27 0.17 1.56 -1.29 0.00 0.00 177.43 177.73 2o5j h GLN 213 N 0.29 0.53 0.23 0.81 4.20 -0.72 -2.14 115.11 118.32 2o5j h GLN 213 Ca 0.08 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 2o5j h GLN 213 Cb 0.03 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2o5j h GLN 213 CO -0.02 0.43 -0.11 0.00 -0.67 0.00 0.00 178.83 178.46 2o5j h ALA 214 N 1.65 -0.31 -0.31 3.87 0.00 -0.13 -2.09 119.26 121.94 2o5j h ALA 214 Ca 0.14 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2o5j h ALA 214 Cb 0.08 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2o5j h ALA 214 CO -0.02 -0.57 0.20 0.28 0.00 0.00 0.00 179.25 179.15 2o5j h VAL 215 N -0.53 1.07 -0.15 0.00 2.07 -0.93 -2.43 116.25 115.34 2o5j h VAL 215 Ca -0.03 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 2o5j h VAL 215 Cb 0.39 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2o5j h VAL 215 CO 0.05 0.07 -0.08 -0.33 0.02 0.00 0.00 177.57 177.31 2o5j h GLU 216 N 0.40 0.32 0.00 1.57 4.39 -1.25 -0.66 114.58 119.35 2o5j h GLU 216 Ca 0.12 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2o5j h GLU 216 Cb -0.02 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2o5j h GLU 216 CO -0.03 0.64 -0.03 0.82 -1.16 0.00 0.00 179.01 179.26 2o5j h ILE 217 N -0.01 1.02 -0.02 3.13 2.04 -1.11 0.40 117.51 122.96 2o5j h ILE 217 Ca 0.03 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 2o5j h ILE 217 Cb 0.55 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2o5j h ILE 217 CO 0.02 0.03 -0.07 -0.07 0.00 0.00 0.00 178.15 178.06 2o5j h LEU 218 N 0.00 0.10 -0.15 1.44 4.07 -1.27 -2.92 115.31 116.58 2o5j h LEU 218 Ca -0.00 -0.64 0.00 0.00 0.08 0.00 0.00 57.88 57.32 2o5j h LEU 218 Cb 0.06 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.76 2o5j h LEU 218 CO 0.00 0.72 0.09 -0.09 -1.08 0.00 0.00 178.44 178.09 2o5j h ARG 219 N -0.52 0.19 -0.69 1.13 2.43 -0.54 -1.09 114.38 115.28 2o5j h ARG 219 Ca -0.00 -0.01 0.16 0.00 -0.81 0.00 0.00 59.98 59.32 2o5j h ARG 219 Cb 0.72 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.19 2o5j h ARG 219 CO 0.02 0.12 0.47 1.49 -1.51 0.00 0.00 179.97 180.56 2o5j h GLU 220 N 0.19 0.21 0.00 0.20 4.81 -0.31 0.58 114.58 120.26 2o5j h GLU 220 Ca 0.06 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2o5j h GLU 220 Cb -0.01 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 2o5j h GLU 220 CO -0.02 0.14 -0.57 0.45 -0.73 0.00 0.00 179.01 178.28 2o5j h HIS 221 N 0.22 0.00 0.00 0.92 3.86 -1.19 -3.21 115.15 115.75 2o5j h HIS 221 Ca 0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.54 2o5j h HIS 221 Cb 1.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.47 2o5j h HIS 221 CO -0.00 0.00 0.00 1.25 0.86 0.00 0.00 177.93 180.04 2o5j h LEU 222 N 0.00 0.00 0.00 2.43 5.85 0.37 -3.04 115.31 120.92 2o5j h LEU 222 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2o5j h LEU 222 Cb 1.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.03 2o5j h LEU 222 CO 0.00 0.00 -0.86 1.07 -0.34 0.00 0.00 178.44 178.31 2o5j n THR 223 N -2.47 0.25 1.40 1.05 5.66 -0.99 -4.07 114.28 115.11 2o5j n THR 223 Ca 0.04 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 2o5j n THR 223 Cb 0.39 0.06 0.00 0.00 -1.55 0.00 0.00 70.33 69.23 2o5j n THR 223 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2o5j n TYR 224 N -2.03 0.00 -1.05 1.09 4.01 -1.15 -2.48 117.16 115.55 2o5j n TYR 224 Ca 0.02 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.78 2o5j n TYR 224 Cb 0.44 -0.01 0.30 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 -0.42 1.76 -0.01 -0.72 0.99 -1.26 -4.73 117.46 113.07 2o5j n PHE 225 Ca 0.00 -1.06 -0.01 0.00 -0.00 0.00 0.00 57.45 56.38 2o5j n PHE 225 Cb 0.02 -0.52 -0.00 0.00 -1.00 0.00 0.00 39.48 37.98 2o5j n PHE 225 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2o5j h SER 226 N 2.44 -0.04 -3.19 4.37 0.87 -1.80 -3.45 113.55 112.75 2o5j h SER 226 Ca 0.13 0.00 -0.66 0.00 -1.23 0.00 0.00 61.79 60.03 2o5j h SER 226 Cb 1.92 0.01 -0.16 0.00 -0.44 0.00 0.00 62.40 63.73 2o5j h SER 226 CO 0.49 0.29 0.25 0.54 -0.53 0.00 0.00 176.83 177.87 2o5j s ASN 227 N -4.67 6.26 0.92 6.23 4.22 -1.26 -5.06 114.94 121.56 2o5j s ASN 227 Ca -0.01 -0.76 -0.12 0.00 -2.14 0.00 0.00 52.86 49.84 2o5j s ASN 227 Cb 0.00 -2.35 0.14 0.00 1.28 0.00 0.00 41.25 40.33 2o5j s ASN 227 CO 0.02 -1.04 1.09 -2.84 -2.04 0.00 0.00 177.10 172.30 2o5j s PRO 228 N 3.14 1.10 0.00 3.55 0.02 -1.26 -5.19 135.00 136.36 2o5j s PRO 228 Ca 0.20 0.71 0.00 0.00 0.02 0.00 0.00 61.00 61.93 2o5j s PRO 228 Cb -0.17 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2o5j s PRO 228 CO 0.14 -2.32 0.00 0.94 -0.33 0.00 0.00 177.00 175.43