#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5j s GLU 2 N 0.00 2.74 -0.15 0.03 2.02 -1.24 -4.84 118.70 117.26 2o5j s GLU 2 Ca 0.00 -1.09 -0.00 0.00 0.02 0.00 0.00 54.97 53.90 2o5j s GLU 2 Cb 0.00 -2.48 0.04 0.00 0.10 0.00 0.00 34.13 31.79 2o5j s GLU 2 CO 0.00 0.42 -0.06 0.42 0.02 0.00 0.00 175.26 176.06 2o5j s ILE 3 N -2.04 1.09 -0.25 -1.63 -1.09 -1.22 0.14 121.20 116.20 2o5j s ILE 3 Ca 0.32 -0.55 -0.01 0.00 -2.23 0.00 0.00 60.65 58.17 2o5j s ILE 3 Cb -0.08 -1.23 0.03 0.00 -1.58 0.00 0.00 42.46 39.60 2o5j s ILE 3 CO 0.23 0.18 -0.07 -0.75 -1.23 0.00 0.00 174.94 173.31 2o5j s LYS 4 N 1.65 2.69 -0.30 2.79 2.20 -1.16 -4.95 119.74 122.67 2o5j s LYS 4 Ca 0.02 -1.07 -0.12 0.00 -0.36 0.00 0.00 55.97 54.44 2o5j s LYS 4 Cb -0.15 -2.98 -0.04 0.00 -1.51 0.00 0.00 37.83 33.16 2o5j s LYS 4 CO -0.08 -0.45 0.22 -0.98 -0.36 0.00 0.00 175.35 173.70 2o5j s ARG 5 N 1.28 3.83 -0.08 4.03 1.70 -1.26 -1.80 118.95 126.65 2o5j s ARG 5 Ca -0.02 -0.38 -0.00 0.00 -0.47 0.00 0.00 55.73 54.86 2o5j s ARG 5 Cb -0.17 -3.70 -0.00 0.00 -0.57 0.00 0.00 34.95 30.50 2o5j s ARG 5 CO -0.05 -0.26 -0.00 0.74 -1.08 0.00 0.00 175.30 174.65 2o5j h PHE 6 N 8.39 0.00 -2.30 5.89 -1.00 -1.80 -3.47 116.94 122.65 2o5j h PHE 6 Ca -0.34 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 59.88 2o5j h PHE 6 Cb 1.18 0.00 0.04 0.00 3.61 0.00 0.00 35.95 40.78 2o5j h PHE 6 CO 0.73 0.00 1.04 0.41 -1.61 0.00 0.00 178.31 178.89 2o5j n GLY 7 N 1.82 1.50 2.97 -1.45 0.00 -1.14 -4.87 105.19 104.01 2o5j n GLY 7 Ca -0.00 0.75 -0.30 0.00 0.00 0.00 0.00 46.02 46.47 2o5j n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j s ARG 8 N 2.81 1.72 -0.10 1.61 1.81 -1.26 -4.86 118.95 120.68 2o5j s ARG 8 Ca 0.85 -2.26 -0.00 0.00 -1.72 0.00 0.00 55.73 52.60 2o5j s ARG 8 Cb -0.59 -3.21 0.02 0.00 -0.45 0.00 0.00 34.95 30.73 2o5j s ARG 8 CO 0.42 -1.04 -0.08 0.96 -0.68 0.00 0.00 175.30 174.88 2o5j s ILE 9 N 0.27 1.02 -0.52 1.52 -5.25 -1.26 -5.08 121.20 111.90 2o5j s ILE 9 Ca 0.14 -0.30 -0.27 0.00 -0.99 0.00 0.00 60.65 59.23 2o5j s ILE 9 Cb -0.23 -1.02 -0.03 0.00 2.95 0.00 0.00 42.46 44.13 2o5j s ILE 9 CO -0.04 0.36 1.94 -0.13 -1.79 0.00 0.00 174.94 175.28 2o5j s ARG 10 N 1.56 2.72 -0.60 0.37 1.81 -1.26 -4.83 118.95 118.72 2o5j s ARG 10 Ca 0.02 0.96 -0.26 0.00 -1.72 0.00 0.00 55.73 54.74 2o5j s ARG 10 Cb -0.13 -4.37 -0.09 0.00 -0.45 0.00 0.00 34.95 29.91 2o5j s ARG 10 CO -0.06 -2.59 2.37 -1.21 -0.68 0.00 0.00 175.30 173.12 2o5j s GLU 11 N 6.88 1.97 0.22 3.54 2.02 -1.26 -4.81 118.70 127.26 2o5j s GLU 11 Ca 0.76 1.03 -0.05 0.00 0.02 0.00 0.00 54.97 56.73 2o5j s GLU 11 Cb -0.16 -4.65 0.20 0.00 0.10 0.00 0.00 34.13 29.62 2o5j s GLU 11 CO 0.25 -3.64 1.66 -0.24 0.02 0.00 0.00 175.26 173.32 2o5j h VAL 12 N 7.64 1.26 -3.97 2.63 3.04 -1.88 -3.45 116.25 121.52 2o5j h VAL 12 Ca -0.16 -1.22 -0.22 0.00 -1.01 0.00 0.00 66.70 64.10 2o5j h VAL 12 Cb 1.17 1.04 -0.19 0.00 -2.01 0.00 0.00 31.29 31.31 2o5j h VAL 12 CO 1.12 0.42 -0.71 0.27 -1.01 0.00 0.00 177.57 177.65 2o5j s ILE 13 N -4.79 0.45 0.71 3.17 -4.36 -1.26 -5.09 121.20 110.04 2o5j s ILE 13 Ca -0.10 -1.39 -0.11 0.00 -0.26 0.00 0.00 60.65 58.80 2o5j s ILE 13 Cb 0.14 -0.97 0.02 0.00 1.25 0.00 0.00 42.46 42.90 2o5j s ILE 13 CO 0.83 -0.63 1.07 -2.84 0.24 0.00 0.00 174.94 173.61 2o5j s PRO 14 N -2.51 2.79 0.11 0.37 0.02 -1.26 -4.98 135.00 129.54 2o5j s PRO 14 Ca -0.03 1.00 -0.31 0.00 0.02 0.00 0.00 61.00 61.68 2o5j s PRO 14 Cb -0.03 -1.97 -0.08 0.00 0.02 0.00 0.00 34.50 32.44 2o5j s PRO 14 CO -0.03 -1.21 1.44 -0.51 -0.33 0.00 0.00 177.00 176.36 2o5j s LEU 15 N -5.62 4.36 0.95 -5.54 1.02 -1.26 -4.98 118.68 107.61 2o5j s LEU 15 Ca 0.59 2.37 -0.12 0.00 0.02 0.00 0.00 54.13 56.99 2o5j s LEU 15 Cb -0.15 -3.58 0.07 0.00 0.02 0.00 0.00 46.19 42.55 2o5j s LEU 15 CO 0.55 -0.71 0.61 -2.65 0.02 0.00 0.00 176.35 174.17 2o5j n PRO 16 N 4.20 -0.37 -1.57 1.29 -0.02 -1.26 -4.78 135.00 132.50 2o5j n PRO 16 Ca 0.12 -0.06 -0.46 0.00 -2.02 0.00 0.00 63.50 61.09 2o5j n PRO 16 Cb 0.42 -2.00 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 2o5j n PRO 16 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2o5j n PRO 17 N -2.43 1.78 -0.39 0.52 -0.02 -1.26 -4.75 135.00 128.45 2o5j n PRO 17 Ca 0.08 0.52 0.35 0.00 -2.02 0.00 0.00 63.50 62.43 2o5j n PRO 17 Cb 0.53 -2.95 0.69 0.00 -0.02 0.00 0.00 33.50 31.75 2o5j n PRO 17 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2o5j h LEU 18 N 13.52 0.15 0.00 2.45 4.07 -1.91 1.95 115.31 135.54 2o5j h LEU 18 Ca -0.38 0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.62 2o5j h LEU 18 Cb 1.27 0.02 0.00 0.00 1.08 0.00 0.00 40.66 43.03 2o5j h LEU 18 CO 0.97 -0.01 -0.39 0.35 -1.08 0.00 0.00 178.44 178.28 2o5j n THR 19 N -4.34 0.11 -0.31 0.22 -2.24 -1.26 -4.40 114.28 102.05 2o5j n THR 19 Ca 0.30 -0.07 0.16 0.00 -2.27 0.00 0.00 64.05 62.16 2o5j n THR 19 Cb 1.29 -0.04 0.33 0.00 -2.10 0.00 0.00 70.33 69.81 2o5j n THR 19 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2o5j h GLU 20 N 0.00 0.19 -0.63 -0.78 4.81 0.28 -0.28 114.58 118.17 2o5j h GLU 20 Ca 0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2o5j h GLU 20 Cb 0.57 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 2o5j h GLU 20 CO 0.00 0.13 0.14 0.82 -0.73 0.00 0.00 179.01 179.37 2o5j h ILE 21 N 0.20 1.25 0.15 2.32 5.03 -1.77 -1.83 117.51 122.86 2o5j h ILE 21 Ca 0.60 -0.92 -0.21 0.00 -0.12 0.00 0.00 64.86 64.21 2o5j h ILE 21 Cb 1.26 0.61 0.02 0.00 -3.03 0.00 0.00 36.82 35.68 2o5j h ILE 21 CO -0.68 0.35 -0.94 1.56 -0.68 0.00 0.00 178.15 177.76 2o5j h GLN 22 N 0.94 0.32 0.69 2.37 4.20 -1.47 -2.95 115.11 119.22 2o5j h GLN 22 Ca 0.20 -0.55 -0.03 0.00 0.06 0.00 0.00 58.65 58.33 2o5j h GLN 22 Cb 0.35 0.20 0.01 0.00 0.30 0.00 0.00 27.48 28.34 2o5j h GLN 22 CO 0.00 1.26 -0.33 0.28 -0.67 0.00 0.00 178.83 179.37 2o5j h VAL 23 N -0.31 0.00 -0.72 -0.54 2.07 -1.13 -2.66 116.25 112.95 2o5j h VAL 23 Ca -0.17 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.35 2o5j h VAL 23 Cb 1.71 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 2o5j h VAL 23 CO 0.16 0.00 0.47 -0.33 0.02 0.00 0.00 177.57 177.89 2o5j h GLU 24 N -0.94 0.92 -0.35 1.57 4.39 -1.52 -0.63 114.58 118.02 2o5j h GLU 24 Ca -0.10 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.61 2o5j h GLU 24 Cb 0.71 -0.21 -0.06 0.00 -0.10 0.00 0.00 28.75 29.10 2o5j h GLU 24 CO 0.16 0.61 -0.00 0.66 -1.16 0.00 0.00 179.01 179.27 2o5j h SER 25 N 0.95 -0.14 0.85 1.42 4.64 -1.55 0.14 113.55 119.85 2o5j h SER 25 Ca 0.27 0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.65 2o5j h SER 25 Cb -0.06 0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2o5j h SER 25 CO -0.08 -0.04 -0.14 0.22 -0.87 0.00 0.00 176.83 175.93 2o5j h TYR 26 N 0.10 0.00 0.48 4.77 3.20 -1.09 0.16 116.97 124.58 2o5j h TYR 26 Ca 0.17 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 2o5j h TYR 26 Cb 0.23 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.51 2o5j h TYR 26 CO -0.25 0.14 -0.23 -0.09 -1.64 0.00 0.00 178.16 176.09 2o5j h ARG 27 N 0.00 -0.62 -0.28 1.82 2.43 0.76 -2.02 114.38 116.48 2o5j h ARG 27 Ca -0.00 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2o5j h ARG 27 Cb 0.60 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 2o5j h ARG 27 CO 0.02 -0.41 0.19 0.00 -1.51 0.00 0.00 179.97 178.26 2o5j h ARG 28 N -0.84 0.17 0.50 0.20 3.08 -0.96 -2.52 114.38 114.01 2o5j h ARG 28 Ca -0.07 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2o5j h ARG 28 Cb 0.49 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2o5j h ARG 28 CO 0.11 0.11 -0.50 0.00 -1.07 0.00 0.00 179.97 178.62 2o5j h ALA 29 N 1.85 -1.12 -3.12 0.04 0.00 -0.64 -3.35 119.26 112.92 2o5j h ALA 29 Ca 0.12 -0.19 -0.70 0.00 0.00 0.00 0.00 54.91 54.15 2o5j h ALA 29 Cb 0.28 0.71 -0.34 0.00 0.00 0.00 0.00 17.79 18.44 2o5j h ALA 29 CO -0.02 -1.17 -0.45 -0.48 0.00 0.00 0.00 179.25 177.14 2o5j s LEU 30 N -10.13 5.29 0.00 0.00 0.05 -0.76 -0.79 118.68 112.34 2o5j s LEU 30 Ca -0.18 -2.42 0.03 0.00 0.05 0.00 0.00 54.13 51.61 2o5j s LEU 30 Cb 0.04 -1.86 0.19 0.00 -2.05 0.00 0.00 46.19 42.52 2o5j s LEU 30 CO 0.61 -0.47 0.74 1.67 -0.55 0.00 0.00 176.35 178.35 2o5j n GLN 31 N 4.08 0.58 -0.44 1.48 7.27 -1.16 -4.35 117.38 124.85 2o5j n GLN 31 Ca 0.02 0.00 0.41 0.00 0.07 0.00 0.00 57.00 57.50 2o5j n GLN 31 Cb 0.40 -1.09 0.77 0.00 2.41 0.00 0.00 30.24 32.73 2o5j n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2o5j h ALA 32 N 2.33 3.33 0.00 1.69 0.00 -1.92 -1.46 119.26 123.23 2o5j h ALA 32 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 32 Cb 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2o5j h ALA 32 CO 0.00 -1.74 -0.14 -0.44 0.00 0.00 0.00 179.25 176.93 2o5j h ASP 33 N 0.01 0.00 -3.59 0.00 3.32 -1.93 -3.42 116.42 110.80 2o5j h ASP 33 Ca 0.68 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 57.06 2o5j h ASP 33 Cb 2.71 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 42.10 2o5j h ASP 33 CO -0.02 0.14 -0.71 0.68 -1.72 0.00 0.00 179.24 177.61 2o5j s VAL 34 N -4.67 3.60 0.89 -1.35 -7.23 -0.55 -5.10 120.40 105.99 2o5j s VAL 34 Ca -0.04 -0.91 -0.15 0.00 -1.81 0.00 0.00 61.98 59.08 2o5j s VAL 34 Cb 0.16 -2.60 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 2o5j s VAL 34 CO 0.67 0.31 0.19 -2.65 -0.31 0.00 0.00 175.10 173.31 2o5j n PRO 35 N 1.29 -0.08 0.15 4.82 -0.02 -1.26 -4.79 135.00 135.11 2o5j n PRO 35 Ca -0.15 0.01 0.10 0.00 -2.02 0.00 0.00 63.50 61.45 2o5j n PRO 35 Cb 0.52 -1.66 0.55 0.00 -0.02 0.00 0.00 33.50 32.89 2o5j n PRO 35 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2o5j n PRO 36 N -0.56 0.13 -0.11 0.52 -0.02 -1.26 -1.48 135.00 132.22 2o5j n PRO 36 Ca 0.06 0.63 -0.09 0.00 -2.02 0.00 0.00 63.50 62.08 2o5j n PRO 36 Cb 0.53 -1.93 -0.01 0.00 -0.02 0.00 0.00 33.50 32.07 2o5j n PRO 36 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2o5j h GLU 37 N 0.00 0.49 -6.41 -0.52 5.08 -1.99 -3.42 114.58 107.81 2o5j h GLU 37 Ca 0.00 -0.06 -0.60 0.00 -1.00 0.00 0.00 59.36 57.70 2o5j h GLU 37 Cb 0.00 -0.10 0.04 0.00 0.50 0.00 0.00 28.75 29.20 2o5j h GLU 37 CO 0.00 0.41 0.90 1.63 -1.00 0.00 0.00 179.01 180.95 2o5j n LYS 38 N -4.77 2.11 -0.31 2.33 4.76 -0.55 -4.91 118.16 116.82 2o5j n LYS 38 Ca -0.01 0.77 0.03 0.00 -2.87 0.00 0.00 58.31 56.22 2o5j n LYS 38 Cb 0.08 -2.56 0.17 0.00 -1.84 0.00 0.00 35.03 30.88 2o5j n LYS 38 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2o5j h ARG 39 N 7.11 0.86 -5.32 1.97 -0.00 -1.88 -3.42 114.38 113.70 2o5j h ARG 39 Ca -0.46 -0.05 -0.30 0.00 -0.50 0.00 0.00 59.98 58.66 2o5j h ARG 39 Cb 1.26 -0.19 -0.03 0.00 0.00 0.00 0.00 29.97 31.01 2o5j h ARG 39 CO 0.91 0.57 1.19 0.39 0.00 0.00 0.00 179.97 183.03 2o5j n GLU 40 N -4.68 0.53 -0.77 0.04 -0.58 -1.26 -4.75 120.64 109.17 2o5j n GLU 40 Ca 0.14 -0.28 0.01 0.00 -0.42 0.00 0.00 57.16 56.60 2o5j n GLU 40 Cb 0.25 -2.80 0.28 0.00 -0.57 0.00 0.00 31.44 28.60 2o5j n GLU 40 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2o5j n ASN 41 N 14.25 4.19 -4.12 1.62 2.04 -1.26 -4.86 115.26 127.12 2o5j n ASN 41 Ca 0.50 -3.22 -0.30 0.00 -0.44 0.00 0.00 54.58 51.13 2o5j n ASN 41 Cb 0.35 -0.65 0.19 0.00 -2.53 0.00 0.00 39.78 37.14 2o5j n ASN 41 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 2o5j s VAL 42 N -2.96 1.95 0.00 3.53 -7.23 -1.26 -1.28 120.40 113.14 2o5j s VAL 42 Ca 0.49 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.66 2o5j s VAL 42 Cb 0.40 -2.93 0.00 0.00 0.56 0.00 0.00 36.38 34.41 2o5j s VAL 42 CO 0.10 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.50 2o5j n GLY 43 N -3.38 3.36 0.00 2.32 0.00 -1.26 -3.77 105.19 102.46 2o5j n GLY 43 Ca 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2o5j n GLY 43 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2o5j n ILE 44 N 0.00 0.00 -0.30 -0.61 5.41 0.03 -0.37 119.36 123.52 2o5j n ILE 44 Ca 0.00 0.80 0.09 0.00 1.00 0.00 0.00 62.75 64.64 2o5j n ILE 44 Cb 0.00 -1.11 0.25 0.00 -0.71 0.00 0.00 39.64 38.07 2o5j n ILE 44 CO 0.00 0.00 0.00 -0.61 0.00 0.00 0.00 176.55 175.94 2o5j h GLN 45 N 0.00 0.55 0.30 0.38 4.15 -1.79 -0.43 115.11 118.27 2o5j h GLN 45 Ca 0.00 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 2o5j h GLN 45 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.57 2o5j h GLN 45 CO 0.00 0.37 -0.14 0.00 -1.93 0.00 0.00 178.83 177.12 2o5j h ALA 46 N 1.61 -0.40 -0.12 3.38 0.00 0.46 -1.98 119.26 122.21 2o5j h ALA 46 Ca 0.50 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.32 2o5j h ALA 46 Cb 0.79 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2o5j h ALA 46 CO -0.41 -0.68 0.09 0.00 0.00 0.00 0.00 179.25 178.24 2o5j h ALA 47 N 0.19 2.09 0.45 0.00 0.00 -0.08 0.11 119.26 122.02 2o5j h ALA 47 Ca -0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 47 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2o5j h ALA 47 CO 0.07 -0.12 -0.22 0.74 0.00 0.00 0.00 179.25 179.72 2o5j h PHE 48 N 0.02 -0.56 0.00 0.00 0.04 -0.71 -2.99 116.94 112.75 2o5j h PHE 48 Ca 0.06 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.78 2o5j h PHE 48 Cb 0.20 0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.53 2o5j h PHE 48 CO -0.00 -0.24 -0.15 0.07 -0.60 0.00 0.00 178.31 177.39 2o5j h ARG 49 N -0.96 0.00 -0.96 1.51 0.11 -1.16 0.75 114.38 113.68 2o5j h ARG 49 Ca -0.06 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.06 2o5j h ARG 49 Cb 0.58 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.60 2o5j h ARG 49 CO 0.10 0.15 0.63 1.49 0.10 0.00 0.00 179.97 182.44 2o5j h GLU 50 N 0.00 1.16 0.00 0.08 4.22 -0.90 -3.25 114.58 115.89 2o5j h GLU 50 Ca -0.00 -0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.37 2o5j h GLU 50 Cb 0.38 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2o5j h GLU 50 CO 0.02 0.77 -0.03 0.25 -2.18 0.00 0.00 179.01 177.84 2o5j n THR 51 N -4.44 0.88 -0.08 0.32 -2.24 -0.95 -4.83 114.28 102.94 2o5j n THR 51 Ca 0.13 -0.95 -0.13 0.00 -2.27 0.00 0.00 64.05 60.83 2o5j n THR 51 Cb 0.11 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 68.72 2o5j n THR 51 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2o5j h PHE 52 N 0.00 0.00 -0.28 4.78 3.04 0.48 -3.40 116.94 121.56 2o5j h PHE 52 Ca 0.00 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 2o5j h PHE 52 Cb 0.73 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.24 2o5j h PHE 52 CO 0.01 0.89 0.05 -2.14 -2.02 0.00 0.00 178.31 175.10 2o5j s PRO 53 N -2.15 1.47 -0.44 6.41 0.02 -1.25 -4.62 135.00 134.44 2o5j s PRO 53 Ca -0.18 0.14 -0.26 0.00 0.02 0.00 0.00 61.00 60.71 2o5j s PRO 53 Cb -0.00 -4.86 0.03 0.00 0.02 0.00 0.00 34.50 29.68 2o5j s PRO 53 CO 0.53 -4.81 0.97 -1.50 -0.33 0.00 0.00 177.00 171.86 2o5j s ILE 54 N 15.49 4.44 -0.36 2.83 2.07 -1.21 -4.97 121.20 139.49 2o5j s ILE 54 Ca 0.88 0.94 -0.12 0.00 -1.41 0.00 0.00 60.65 60.95 2o5j s ILE 54 Cb -0.10 -4.45 0.01 0.00 0.13 0.00 0.00 42.46 38.06 2o5j s ILE 54 CO 0.11 -0.80 0.22 -0.70 -1.91 0.00 0.00 174.94 171.86 2o5j s GLU 55 N 3.83 3.03 -0.27 3.50 2.56 -1.26 -4.03 118.70 126.06 2o5j s GLU 55 Ca 0.39 -0.95 0.01 0.00 0.00 0.00 0.00 54.97 54.43 2o5j s GLU 55 Cb -0.10 -3.75 0.08 0.00 2.00 0.00 0.00 34.13 32.35 2o5j s GLU 55 CO 0.26 -0.62 0.01 -2.00 -0.56 0.00 0.00 175.26 172.34 2o5j s GLU 56 N 1.61 1.36 0.00 4.30 2.56 -1.25 -5.03 118.70 122.25 2o5j s GLU 56 Ca 0.04 -1.19 0.00 0.00 0.00 0.00 0.00 54.97 53.81 2o5j s GLU 56 Cb -0.18 -2.58 0.00 0.00 2.00 0.00 0.00 34.13 33.37 2o5j s GLU 56 CO 0.08 -0.76 0.00 -1.91 -0.56 0.00 0.00 175.26 172.10 2o5j n GLU 57 N 4.63 0.00 -4.34 4.30 4.07 -1.26 -1.27 120.64 126.77 2o5j n GLU 57 Ca -0.06 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.81 2o5j n GLU 57 Cb 0.43 0.00 -0.16 0.00 -0.06 0.00 0.00 31.44 31.65 2o5j n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2o5j s ASP 58 N -0.79 1.40 0.00 4.31 1.01 -1.26 -2.37 116.67 118.97 2o5j s ASP 58 Ca 0.00 -0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.05 2o5j s ASP 58 Cb 0.00 -0.64 0.00 0.00 1.01 0.00 0.00 42.92 43.29 2o5j s ASP 58 CO 0.00 -0.02 0.00 0.29 0.21 0.00 0.00 175.17 175.65 2o5j n LYS 59 N 4.00 0.00 0.00 8.23 5.02 -1.26 -5.06 118.16 129.08 2o5j n LYS 59 Ca -0.23 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2o5j n LYS 59 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.52 2o5j n LYS 59 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2o5j n GLY 60 N 0.00 1.06 3.16 0.72 0.00 -1.26 -4.86 105.19 104.02 2o5j n GLY 60 Ca 0.00 -0.86 -0.28 0.00 0.00 0.00 0.00 46.02 44.87 2o5j n GLY 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2o5j s LYS 61 N 0.00 2.23 0.00 1.61 2.20 -1.26 -5.11 119.74 119.41 2o5j s LYS 61 Ca 0.00 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 54.91 2o5j s LYS 61 Cb 0.00 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.49 2o5j s LYS 61 CO 0.00 0.22 0.00 0.41 -0.36 0.00 0.00 175.35 175.62 2o5j n GLY 62 N 3.31 4.99 1.06 5.54 0.00 -1.00 -4.95 105.19 114.15 2o5j n GLY 62 Ca -0.19 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2o5j n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 63 N 0.00 1.11 3.72 -0.02 0.00 -0.39 -4.56 105.19 105.05 2o5j n GLY 63 Ca 0.00 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2o5j n GLY 63 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2o5j s LEU 64 N 0.00 4.37 -0.32 0.99 2.96 -0.86 -4.34 118.68 121.48 2o5j s LEU 64 Ca 0.00 2.31 -0.01 0.00 -0.22 0.00 0.00 54.13 56.22 2o5j s LEU 64 Cb 0.00 -3.59 0.13 0.00 0.50 0.00 0.00 46.19 43.23 2o5j s LEU 64 CO 0.00 -0.64 0.25 -0.69 -1.32 0.00 0.00 176.35 173.95 2o5j s VAL 65 N 1.06 -0.18 -0.25 1.68 1.01 -1.26 -3.78 120.40 118.69 2o5j s VAL 65 Ca 0.64 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 2o5j s VAL 65 Cb -0.36 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 2o5j s VAL 65 CO 0.30 -0.68 0.13 -0.22 0.00 0.00 0.00 175.10 174.63 2o5j s LEU 66 N 1.82 3.83 0.07 3.92 2.96 -1.26 0.47 118.68 130.49 2o5j s LEU 66 Ca 0.13 -0.03 0.04 0.00 -0.22 0.00 0.00 54.13 54.04 2o5j s LEU 66 Cb -0.17 -2.03 -0.03 0.00 0.50 0.00 0.00 46.19 44.46 2o5j s LEU 66 CO -0.21 0.01 -0.11 -1.81 -1.32 0.00 0.00 176.35 172.91 2o5j s ASP 67 N 1.36 1.38 0.09 3.68 1.11 -0.94 -3.34 116.67 120.02 2o5j s ASP 67 Ca 0.06 -0.65 -0.29 0.00 0.18 0.00 0.00 52.55 51.86 2o5j s ASP 67 Cb -0.15 -0.01 -0.05 0.00 1.07 0.00 0.00 42.92 43.78 2o5j s ASP 67 CO 0.06 -0.16 0.93 0.12 1.18 0.00 0.00 175.17 177.30 2o5j s PHE 68 N -1.59 3.79 0.00 4.23 5.36 -1.26 -3.12 117.98 125.38 2o5j s PHE 68 Ca -0.03 1.73 0.00 0.00 -0.96 0.00 0.00 56.93 57.68 2o5j s PHE 68 Cb -0.08 -3.02 0.00 0.00 -0.34 0.00 0.00 43.02 39.58 2o5j s PHE 68 CO 0.01 0.20 0.00 1.28 -1.46 0.00 0.00 175.22 175.25 2o5j n LEU 69 N 2.88 0.00 -3.82 6.12 4.32 -1.17 -5.06 117.00 120.28 2o5j n LEU 69 Ca 0.02 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.88 2o5j n LEU 69 Cb 0.49 -0.03 -0.13 0.00 -1.62 0.00 0.00 43.42 42.14 2o5j n LEU 69 CO 0.50 -0.04 -0.22 -1.61 -1.22 0.00 0.00 177.39 174.81 2o5j s GLU 70 N -0.07 0.14 -0.22 3.23 0.41 -1.26 -4.98 118.70 115.95 2o5j s GLU 70 Ca 0.00 0.20 -0.13 0.00 -0.41 0.00 0.00 54.97 54.64 2o5j s GLU 70 Cb 0.00 0.04 -0.05 0.00 -1.78 0.00 0.00 34.13 32.34 2o5j s GLU 70 CO 0.00 -0.04 0.25 1.52 -0.49 0.00 0.00 175.26 176.50 2o5j s TYR 71 N 0.22 3.34 -0.03 1.61 -0.85 -1.26 -1.43 117.35 118.95 2o5j s TYR 71 Ca -0.01 0.38 -0.01 0.00 -0.52 0.00 0.00 57.07 56.91 2o5j s TYR 71 Cb -0.02 -2.36 0.03 0.00 0.38 0.00 0.00 41.96 39.99 2o5j s TYR 71 CO -0.01 0.05 0.06 -0.98 -1.52 0.00 0.00 175.55 173.15 2o5j s ARG 72 N 1.12 -0.02 -0.02 -3.49 1.70 -1.25 -4.79 118.95 112.20 2o5j s ARG 72 Ca 0.12 0.26 0.04 0.00 -0.47 0.00 0.00 55.73 55.68 2o5j s ARG 72 Cb -0.14 -0.28 -0.01 0.00 -0.57 0.00 0.00 34.95 33.96 2o5j s ARG 72 CO 0.06 -0.20 -0.13 -0.48 -1.08 0.00 0.00 175.30 173.47 2o5j s LEU 73 N 1.30 1.93 0.00 -1.89 2.34 -1.26 -2.93 118.68 118.17 2o5j s LEU 73 Ca -0.07 -0.25 0.00 0.00 0.06 0.00 0.00 54.13 53.87 2o5j s LEU 73 Cb -0.13 -0.72 0.00 0.00 -0.56 0.00 0.00 46.19 44.79 2o5j s LEU 73 CO -0.04 0.14 0.00 0.61 -1.06 0.00 0.00 176.35 176.00 2o5j n GLY 74 N 2.98 0.05 3.25 -3.48 0.00 -1.17 -4.98 105.19 101.85 2o5j n GLY 74 Ca -0.16 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2o5j n GLY 74 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5j s GLU 75 N -0.90 2.54 0.28 1.61 0.41 -1.26 -4.94 118.70 116.44 2o5j s GLU 75 Ca 0.00 -1.38 -0.30 0.00 -0.41 0.00 0.00 54.97 52.89 2o5j s GLU 75 Cb 0.00 -3.61 -0.13 0.00 -1.78 0.00 0.00 34.13 28.61 2o5j s GLU 75 CO 0.00 -0.84 1.34 -2.30 -0.49 0.00 0.00 175.26 172.97 2o5j n PRO 76 N 4.83 2.05 0.31 0.39 -0.02 -1.26 -4.36 135.00 136.94 2o5j n PRO 76 Ca -0.10 0.72 -0.17 0.00 -2.02 0.00 0.00 63.50 61.93 2o5j n PRO 76 Cb 0.43 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 2o5j n PRO 76 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2o5j h PRO 77 N 3.44 -0.78 0.00 0.52 0.11 -1.96 -3.46 132.00 129.86 2o5j h PRO 77 Ca -0.45 0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.14 2o5j h PRO 77 Cb 1.28 0.18 -0.13 0.00 0.11 0.00 0.00 31.00 32.44 2o5j h PRO 77 CO 0.70 -0.52 -0.49 1.19 -0.21 0.00 0.00 178.00 178.67 2o5j n PHE 78 N -5.46 0.01 -3.79 0.65 3.01 -1.26 -5.17 117.46 105.45 2o5j n PHE 78 Ca -0.12 -2.76 -0.21 0.00 1.01 0.00 0.00 57.45 55.37 2o5j n PHE 78 Cb 0.35 0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.83 2o5j n PHE 78 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2o5j s PRO 79 N -3.60 2.91 0.00 -1.08 0.04 -1.26 -4.93 135.00 127.08 2o5j s PRO 79 Ca 0.24 -1.15 0.00 0.00 0.04 0.00 0.00 61.00 60.14 2o5j s PRO 79 Cb 0.01 -2.61 0.00 0.00 0.04 0.00 0.00 34.50 31.95 2o5j s PRO 79 CO 0.17 0.16 0.65 1.04 0.04 0.00 0.00 177.00 179.07 2o5j n GLN 80 N -1.41 0.00 -0.34 4.56 6.02 -1.26 -0.82 117.38 124.13 2o5j n GLN 80 Ca -0.03 0.65 0.13 0.00 -0.01 0.00 0.00 57.00 57.74 2o5j n GLN 80 Cb 0.59 -1.11 0.33 0.00 1.02 0.00 0.00 30.24 31.07 2o5j n GLN 80 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 2o5j h ASP 81 N 0.00 0.77 -0.08 1.08 3.32 -1.99 0.46 116.42 119.99 2o5j h ASP 81 Ca 0.00 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.14 2o5j h ASP 81 Cb 0.00 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 2o5j h ASP 81 CO 0.00 0.30 0.05 -0.08 -1.72 0.00 0.00 179.24 177.80 2o5j h GLU 82 N 0.77 0.06 0.00 3.56 4.81 -1.55 0.15 114.58 122.38 2o5j h GLU 82 Ca 0.55 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.78 2o5j h GLU 82 Cb 0.86 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.22 2o5j h GLU 82 CO -0.34 0.04 -0.12 0.00 -0.73 0.00 0.00 179.01 177.86 2o5j n ARG 84 N -1.59 0.73 0.36 0.00 1.74 -0.07 -1.80 116.66 116.02 2o5j n ARG 84 Ca 0.06 0.06 -0.16 0.00 -0.77 0.00 0.00 57.85 57.05 2o5j n ARG 84 Cb 0.35 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.21 2o5j n ARG 84 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2o5j h GLU 85 N 0.00 -0.89 -6.32 5.56 4.81 -0.87 -3.42 114.58 113.45 2o5j h GLU 85 Ca -0.54 0.06 -0.56 0.00 -0.13 0.00 0.00 59.36 58.19 2o5j h GLU 85 Cb 2.04 0.20 -0.04 0.00 0.63 0.00 0.00 28.75 31.59 2o5j h GLU 85 CO -0.03 -0.56 0.03 0.15 -0.73 0.00 0.00 179.01 177.87 2o5j s LYS 86 N -5.08 4.32 -0.74 1.92 1.02 -0.92 -4.97 119.74 115.28 2o5j s LYS 86 Ca -0.16 0.87 -0.26 0.00 0.02 0.00 0.00 55.97 56.45 2o5j s LYS 86 Cb 0.02 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.04 2o5j s LYS 86 CO 0.50 0.61 1.93 -0.51 -0.92 0.00 0.00 175.35 176.96 2o5j s ASP 87 N -1.08 5.15 0.20 2.83 1.01 -1.26 -4.34 116.67 119.18 2o5j s ASP 87 Ca 0.31 -0.10 0.04 0.00 0.71 0.00 0.00 52.55 53.52 2o5j s ASP 87 Cb -0.21 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.13 2o5j s ASP 87 CO 0.21 -2.60 -0.05 -0.76 0.21 0.00 0.00 175.17 172.19 2o5j s LEU 88 N 9.78 2.34 -0.30 1.23 2.01 -0.75 -4.83 118.68 128.17 2o5j s LEU 88 Ca 0.70 -1.14 -0.01 0.00 0.01 0.00 0.00 54.13 53.69 2o5j s LEU 88 Cb -0.10 -0.34 0.06 0.00 0.01 0.00 0.00 46.19 45.82 2o5j s LEU 88 CO 0.11 -0.42 -0.00 0.28 1.01 0.00 0.00 176.35 177.32 2o5j s THR 89 N -3.34 2.87 -0.65 5.49 -1.32 -1.20 -3.08 115.64 114.41 2o5j s THR 89 Ca 0.24 -1.49 -0.26 0.00 -1.21 0.00 0.00 61.69 58.98 2o5j s THR 89 Cb 0.04 -2.69 -0.05 0.00 -1.51 0.00 0.00 72.50 68.30 2o5j s THR 89 CO 0.06 -0.14 2.07 -0.47 -2.21 0.00 0.00 174.62 173.93 2o5j s TYR 90 N 1.21 1.48 -0.01 9.09 6.14 -1.05 -4.93 117.35 129.28 2o5j s TYR 90 Ca -0.05 1.08 0.00 0.00 0.64 0.00 0.00 57.07 58.75 2o5j s TYR 90 Cb -0.20 -3.89 0.01 0.00 0.42 0.00 0.00 41.96 38.30 2o5j s TYR 90 CO -0.02 -2.19 -0.01 -0.65 0.64 0.00 0.00 175.55 173.33 2o5j s GLN 91 N 7.54 0.12 0.44 4.97 -0.21 -1.26 -2.45 119.66 128.81 2o5j s GLN 91 Ca 0.78 0.00 -0.11 0.00 0.02 0.00 0.00 55.36 56.05 2o5j s GLN 91 Cb -0.13 -0.19 -0.06 0.00 1.00 0.00 0.00 33.01 33.63 2o5j s GLN 91 CO 0.17 -0.02 0.82 0.00 -2.12 0.00 0.00 175.29 174.14 2o5j s ALA 92 N 0.29 3.29 -0.02 6.09 0.00 0.28 -4.14 121.76 127.55 2o5j s ALA 92 Ca -0.03 -0.16 -0.20 0.00 0.00 0.00 0.00 51.96 51.57 2o5j s ALA 92 Cb -0.04 -2.78 -0.05 0.00 0.00 0.00 0.00 23.12 20.24 2o5j s ALA 92 CO -0.01 -0.12 0.56 -2.14 0.00 0.00 0.00 175.76 174.05 2o5j s PRO 93 N -4.06 4.28 -0.07 0.00 0.02 -1.26 -2.52 135.00 131.40 2o5j s PRO 93 Ca 0.52 0.66 0.04 0.00 0.02 0.00 0.00 61.00 62.24 2o5j s PRO 93 Cb -0.10 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 31.07 2o5j s PRO 93 CO 0.34 0.36 -0.19 -1.17 -0.33 0.00 0.00 177.00 176.01 2o5j s LEU 94 N -0.12 1.92 -0.25 -5.54 2.96 -1.23 -3.03 118.68 113.39 2o5j s LEU 94 Ca 0.30 -0.42 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 2o5j s LEU 94 Cb -0.18 -1.12 0.14 0.00 0.50 0.00 0.00 46.19 45.53 2o5j s LEU 94 CO 0.16 0.14 0.40 -0.72 -1.32 0.00 0.00 176.35 175.00 2o5j s TYR 95 N 0.24 -0.90 0.51 5.38 -0.85 -1.15 -3.22 117.35 117.36 2o5j s TYR 95 Ca -0.11 0.81 0.01 0.00 -0.52 0.00 0.00 57.07 57.26 2o5j s TYR 95 Cb -0.15 0.03 0.02 0.00 0.38 0.00 0.00 41.96 42.24 2o5j s TYR 95 CO 0.05 -0.77 0.74 0.00 -1.52 0.00 0.00 175.55 174.04 2o5j s ALA 96 N 2.57 3.82 0.33 9.51 0.00 -1.26 -3.92 121.76 132.81 2o5j s ALA 96 Ca 0.13 -1.20 -0.26 0.00 0.00 0.00 0.00 51.96 50.63 2o5j s ALA 96 Cb -0.15 -2.12 -0.10 0.00 0.00 0.00 0.00 23.12 20.76 2o5j s ALA 96 CO -0.18 -0.60 0.95 1.03 0.00 0.00 0.00 175.76 176.95 2o5j s ARG 97 N -4.68 4.56 -0.06 0.00 0.52 -0.51 -4.32 118.95 114.46 2o5j s ARG 97 Ca 0.54 1.32 -0.04 0.00 -0.52 0.00 0.00 55.73 57.03 2o5j s ARG 97 Cb -0.10 -2.77 0.02 0.00 0.52 0.00 0.00 34.95 32.62 2o5j s ARG 97 CO 0.38 0.26 0.15 -0.51 0.02 0.00 0.00 175.30 175.60 2o5j s LEU 98 N -2.11 1.19 -0.04 2.53 1.02 -1.18 -3.03 118.68 117.06 2o5j s LEU 98 Ca 0.51 0.30 -0.01 0.00 0.02 0.00 0.00 54.13 54.94 2o5j s LEU 98 Cb -0.18 0.45 0.03 0.00 0.02 0.00 0.00 46.19 46.51 2o5j s LEU 98 CO 0.23 -0.08 0.04 0.00 0.02 0.00 0.00 176.35 176.56 2o5j s GLN 99 N 0.47 0.03 -0.15 1.70 -2.07 -1.18 -2.57 119.66 115.87 2o5j s GLN 99 Ca -0.03 0.30 -0.13 0.00 -1.82 0.00 0.00 55.36 53.67 2o5j s GLN 99 Cb -0.05 -0.51 -0.05 0.00 -1.09 0.00 0.00 33.01 31.31 2o5j s GLN 99 CO -0.02 -0.29 0.28 -1.17 -1.32 0.00 0.00 175.29 172.77 2o5j s LEU 100 N 1.89 4.26 0.47 2.60 2.96 -0.83 -2.21 118.68 127.82 2o5j s LEU 100 Ca 0.02 0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 54.42 2o5j s LEU 100 Cb -0.12 -2.34 -0.00 0.00 0.50 0.00 0.00 46.19 44.22 2o5j s LEU 100 CO -0.03 0.13 0.71 -0.63 -1.32 0.00 0.00 176.35 175.21 2o5j s ILE 101 N 0.30 3.96 0.08 6.68 -1.09 0.18 -2.29 121.20 129.02 2o5j s ILE 101 Ca 0.16 -0.40 0.04 0.00 -2.23 0.00 0.00 60.65 58.22 2o5j s ILE 101 Cb -0.13 -3.48 -0.03 0.00 -1.58 0.00 0.00 42.46 37.24 2o5j s ILE 101 CO 0.04 -0.37 -0.10 -1.00 -1.23 0.00 0.00 174.94 172.28 2o5j s HIS 102 N -2.63 1.00 -0.86 3.97 3.76 -1.13 -4.02 115.29 115.38 2o5j s HIS 102 Ca 0.49 -0.59 0.27 0.00 -0.15 0.00 0.00 55.06 55.08 2o5j s HIS 102 Cb -0.10 -0.56 1.01 0.00 1.11 0.00 0.00 32.58 34.04 2o5j s HIS 102 CO 0.39 -0.01 1.84 1.63 -0.85 0.00 0.00 174.74 177.74 2o5j n LYS 103 N 0.87 0.13 -4.07 1.40 5.02 -1.26 -4.76 118.16 115.49 2o5j n LYS 103 Ca -0.18 0.12 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 2o5j n LYS 103 Cb 0.56 -1.66 -0.04 0.00 -0.02 0.00 0.00 35.03 33.87 2o5j n LYS 103 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2o5j s ASP 104 N -3.78 5.55 -0.40 4.39 3.84 -1.26 -5.03 116.67 119.98 2o5j s ASP 104 Ca 0.12 -0.26 -0.28 0.00 -0.00 0.00 0.00 52.55 52.13 2o5j s ASP 104 Cb 0.15 -1.39 -0.08 0.00 -1.38 0.00 0.00 42.92 40.23 2o5j s ASP 104 CO 0.55 -0.07 2.34 1.07 -0.00 0.00 0.00 175.17 179.06 2o5j n THR 105 N -1.22 0.11 0.00 2.11 5.66 -1.26 -4.76 114.28 114.92 2o5j n THR 105 Ca -0.07 -0.58 0.00 0.00 -3.05 0.00 0.00 64.05 60.35 2o5j n THR 105 Cb 0.58 -2.48 0.00 0.00 -1.55 0.00 0.00 70.33 66.88 2o5j n THR 105 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2o5j n GLY 106 N 6.01 3.78 2.61 1.09 0.00 -1.26 -5.09 105.19 112.33 2o5j n GLY 106 Ca 0.36 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2o5j n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o5j s LEU 107 N 0.00 0.33 -0.11 0.99 1.43 -1.26 -2.86 118.68 117.21 2o5j s LEU 107 Ca 0.00 -1.24 -0.20 0.00 -1.03 0.00 0.00 54.13 51.66 2o5j s LEU 107 Cb 0.00 -0.06 -0.04 0.00 0.03 0.00 0.00 46.19 46.12 2o5j s LEU 107 CO 0.00 -0.40 0.56 -0.63 0.23 0.00 0.00 176.35 176.10 2o5j s ILE 108 N 2.04 5.14 -0.41 -0.59 1.01 -0.97 -4.91 121.20 122.51 2o5j s ILE 108 Ca 0.10 1.12 -0.04 0.00 0.00 0.00 0.00 60.65 61.83 2o5j s ILE 108 Cb -0.16 -3.89 0.10 0.00 0.01 0.00 0.00 42.46 38.52 2o5j s ILE 108 CO -0.30 0.29 0.21 -0.75 0.00 0.00 0.00 174.94 174.39 2o5j s LYS 109 N 0.75 2.18 -0.85 2.79 2.47 -1.26 -1.97 119.74 123.85 2o5j s LYS 109 Ca 0.30 -1.71 -0.18 0.00 -1.56 0.00 0.00 55.97 52.82 2o5j s LYS 109 Cb -0.16 -3.61 0.15 0.00 -1.46 0.00 0.00 37.83 32.75 2o5j s LYS 109 CO 0.13 -1.03 0.96 -2.00 0.16 0.00 0.00 175.35 173.58 2o5j s GLU 110 N 1.22 3.51 0.04 4.03 -6.30 -1.06 -4.96 118.70 115.17 2o5j s GLU 110 Ca 0.06 -1.86 -0.09 0.00 -2.50 0.00 0.00 54.97 50.58 2o5j s GLU 110 Cb -0.23 -4.67 -0.02 0.00 0.00 0.00 0.00 34.13 29.21 2o5j s GLU 110 CO -0.03 -1.61 0.95 -0.25 0.02 0.00 0.00 175.26 174.35 2o5j n ASP 111 N 5.84 -0.29 -4.33 -1.70 8.00 -1.26 -4.02 116.55 118.79 2o5j n ASP 111 Ca 0.16 1.02 -0.28 0.00 0.71 0.00 0.00 54.79 56.40 2o5j n ASP 111 Cb 0.47 -0.33 -0.13 0.00 -0.02 0.00 0.00 41.12 41.11 2o5j n ASP 111 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2o5j s GLU 112 N -3.82 1.42 -0.28 -1.24 0.41 -1.26 -3.08 118.70 110.84 2o5j s GLU 112 Ca -0.03 -1.19 -0.02 0.00 -0.41 0.00 0.00 54.97 53.32 2o5j s GLU 112 Cb 0.03 -1.74 0.12 0.00 -1.78 0.00 0.00 34.13 30.77 2o5j s GLU 112 CO 0.17 0.42 0.25 0.08 -0.49 0.00 0.00 175.26 175.70 2o5j s VAL 113 N -0.98 -0.32 -0.90 2.63 1.01 -1.26 -5.06 120.40 115.51 2o5j s VAL 113 Ca 0.11 -0.52 -0.24 0.00 0.00 0.00 0.00 61.98 61.32 2o5j s VAL 113 Cb -0.10 -0.96 0.02 0.00 0.00 0.00 0.00 36.38 35.34 2o5j s VAL 113 CO 0.04 -0.51 1.57 0.72 0.00 0.00 0.00 175.10 176.92 2o5j s PHE 114 N 2.30 2.24 -0.26 5.22 -0.00 -1.26 -4.50 117.98 121.72 2o5j s PHE 114 Ca 0.09 -0.22 -0.04 0.00 -0.00 0.00 0.00 56.93 56.76 2o5j s PHE 114 Cb -0.15 -4.49 0.01 0.00 -0.00 0.00 0.00 43.02 38.40 2o5j s PHE 114 CO -0.32 -1.95 -0.00 -0.48 -0.00 0.00 0.00 175.22 172.46 2o5j s LEU 115 N 6.64 3.34 0.00 -1.99 0.05 -1.20 -4.97 118.68 120.55 2o5j s LEU 115 Ca 0.51 -0.65 0.00 0.00 0.05 0.00 0.00 54.13 54.04 2o5j s LEU 115 Cb -0.04 -1.77 0.00 0.00 -2.05 0.00 0.00 46.19 42.33 2o5j s LEU 115 CO -0.01 -0.12 0.00 0.61 -0.55 0.00 0.00 176.35 176.29 2o5j n GLY 116 N 4.78 -2.51 3.21 -3.48 0.00 -1.26 -4.71 105.19 101.23 2o5j n GLY 116 Ca -0.16 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.49 2o5j n GLY 116 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2o5j s HIS 117 N -0.46 3.43 -0.06 1.61 3.76 -1.26 -3.54 115.29 118.76 2o5j s HIS 117 Ca 0.00 -1.87 -0.12 0.00 -0.15 0.00 0.00 55.06 52.92 2o5j s HIS 117 Cb 0.00 -3.26 -0.05 0.00 1.11 0.00 0.00 32.58 30.38 2o5j s HIS 117 CO 0.00 -0.95 0.29 0.96 -0.85 0.00 0.00 174.74 174.19 2o5j s ILE 118 N 1.34 5.25 0.90 0.60 -4.36 -1.05 -4.83 121.20 119.05 2o5j s ILE 118 Ca 0.05 0.56 -0.11 0.00 -0.26 0.00 0.00 60.65 60.89 2o5j s ILE 118 Cb -0.25 -3.58 0.12 0.00 1.25 0.00 0.00 42.46 40.01 2o5j s ILE 118 CO -0.01 0.58 1.07 -2.65 0.24 0.00 0.00 174.94 174.17 2o5j n PRO 119 N 2.06 -0.29 -4.38 0.37 -0.02 -1.26 -0.55 135.00 130.92 2o5j n PRO 119 Ca -0.16 -0.02 -0.24 0.00 -2.02 0.00 0.00 63.50 61.06 2o5j n PRO 119 Cb 0.53 -2.32 -0.09 0.00 -0.02 0.00 0.00 33.50 31.60 2o5j n PRO 119 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2o5j s LEU 120 N -5.68 2.91 -0.11 2.45 1.43 -1.02 -4.68 118.68 113.97 2o5j s LEU 120 Ca 0.67 -0.89 -0.06 0.00 -1.03 0.00 0.00 54.13 52.82 2o5j s LEU 120 Cb -0.24 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 2o5j s LEU 120 CO 0.57 -0.06 0.12 -0.32 0.23 0.00 0.00 176.35 176.90 2o5j s MET 121 N -3.63 3.37 0.69 1.70 -2.45 -1.26 -4.52 119.30 113.20 2o5j s MET 121 Ca 0.32 -0.18 -0.11 0.00 -1.25 0.00 0.00 55.69 54.48 2o5j s MET 121 Cb -0.04 -3.13 0.00 0.00 1.25 0.00 0.00 34.83 32.91 2o5j s MET 121 CO 0.18 0.77 1.06 0.99 1.05 0.00 0.00 175.02 179.06 2o5j s THR 122 N -1.01 4.10 0.59 10.11 2.01 0.55 -4.92 115.64 127.07 2o5j s THR 122 Ca 0.15 0.68 0.29 0.00 0.31 0.00 0.00 61.69 63.12 2o5j s THR 122 Cb -0.12 -3.47 0.36 0.00 0.01 0.00 0.00 72.50 69.28 2o5j s THR 122 CO 0.04 -0.89 2.05 1.05 -0.69 0.00 0.00 174.62 176.18 2o5j h GLU 123 N -0.66 0.00 0.17 4.92 4.11 -1.99 -2.33 114.58 118.79 2o5j h GLU 123 Ca -0.44 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 58.72 2o5j h GLU 123 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 2o5j h GLU 123 CO 0.58 0.00 -1.27 -0.44 0.07 0.00 0.00 179.01 177.95 2o5j h ASP 124 N 0.00 0.55 0.00 3.06 5.19 -1.96 -3.49 116.42 119.77 2o5j h ASP 124 Ca 0.11 -0.91 0.00 0.00 -0.62 0.00 0.00 57.03 55.60 2o5j h ASP 124 Cb 0.64 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.97 2o5j h ASP 124 CO -0.00 1.59 0.00 0.61 -3.12 0.00 0.00 179.24 178.32 2o5j n GLY 125 N 1.73 -0.71 3.84 2.75 0.00 -0.88 -4.86 105.19 107.06 2o5j n GLY 125 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 2o5j n GLY 125 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o5j s SER 126 N 0.00 5.00 0.30 1.61 1.04 -1.26 -4.82 113.70 115.57 2o5j s SER 126 Ca 0.00 -0.73 0.02 0.00 0.48 0.00 0.00 55.95 55.72 2o5j s SER 126 Cb 0.00 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.48 2o5j s SER 126 CO 0.00 -0.54 0.19 0.49 0.98 0.00 0.00 173.24 174.36 2o5j n PHE 127 N -1.44 -0.70 -3.53 5.02 3.01 0.16 -0.33 117.46 119.65 2o5j n PHE 127 Ca 0.01 -1.32 -0.29 0.00 1.01 0.00 0.00 57.45 56.86 2o5j n PHE 127 Cb 0.62 -0.24 -0.14 0.00 -0.01 0.00 0.00 39.48 39.71 2o5j n PHE 127 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2o5j s ILE 128 N -1.62 0.17 0.00 4.37 1.01 -1.26 -1.55 121.20 122.32 2o5j s ILE 128 Ca 0.14 -1.32 0.00 0.00 0.00 0.00 0.00 60.65 59.48 2o5j s ILE 128 Cb -0.01 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 41.32 2o5j s ILE 128 CO 0.09 -0.85 0.00 -0.38 0.00 0.00 0.00 174.94 173.80 2o5j n ILE 129 N 4.60 0.00 -3.56 2.92 -0.00 -1.11 -2.54 119.36 119.67 2o5j n ILE 129 Ca 0.03 0.45 -0.29 0.00 -0.00 0.00 0.00 62.75 62.93 2o5j n ILE 129 Cb 0.39 -1.34 -0.15 0.00 -0.00 0.00 0.00 39.64 38.54 2o5j n ILE 129 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.55 176.75 2o5j s ASN 130 N -2.84 3.58 0.00 4.38 0.02 -1.26 -3.22 114.94 115.61 2o5j s ASN 130 Ca 0.00 -1.38 0.00 0.00 -1.02 0.00 0.00 52.86 50.46 2o5j s ASN 130 Cb 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 41.25 40.85 2o5j s ASN 130 CO 0.00 -0.43 0.00 0.61 0.02 0.00 0.00 177.10 177.30 2o5j n GLY 131 N 5.14 0.86 3.45 0.66 0.00 -1.18 -4.87 105.19 109.24 2o5j n GLY 131 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 2o5j n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 132 N 0.00 2.57 0.17 4.61 0.00 -1.26 -4.76 121.76 123.09 2o5j s ALA 132 Ca 0.00 -1.14 -0.31 0.00 0.00 0.00 0.00 51.96 50.51 2o5j s ALA 132 Cb 0.00 -0.77 -0.09 0.00 0.00 0.00 0.00 23.12 22.26 2o5j s ALA 132 CO 0.00 0.56 1.38 -0.51 0.00 0.00 0.00 175.76 177.19 2o5j s ASP 133 N -1.21 6.81 0.35 0.00 -0.00 -1.26 -2.76 116.67 118.62 2o5j s ASP 133 Ca 0.14 2.42 0.07 0.00 -0.00 0.00 0.00 52.55 55.17 2o5j s ASP 133 Cb -0.10 -2.60 -0.07 0.00 -0.00 0.00 0.00 42.92 40.14 2o5j s ASP 133 CO 0.04 -0.62 -0.01 -0.13 -0.00 0.00 0.00 175.17 174.44 2o5j s ARG 134 N 0.40 1.79 -0.03 8.23 0.52 -0.59 -3.58 118.95 125.69 2o5j s ARG 134 Ca 0.61 -1.97 0.02 0.00 -0.52 0.00 0.00 55.73 53.87 2o5j s ARG 134 Cb -0.38 -1.39 0.01 0.00 0.52 0.00 0.00 34.95 33.71 2o5j s ARG 134 CO 0.35 -0.03 -0.08 0.14 0.02 0.00 0.00 175.30 175.71 2o5j s VAL 135 N -2.87 0.70 -0.49 3.52 -7.23 -1.24 -0.66 120.40 112.12 2o5j s VAL 135 Ca 0.34 -0.30 -0.16 0.00 -1.81 0.00 0.00 61.98 60.05 2o5j s VAL 135 Cb 0.07 -0.64 0.08 0.00 0.56 0.00 0.00 36.38 36.45 2o5j s VAL 135 CO 0.16 0.23 0.44 -0.63 -0.31 0.00 0.00 175.10 174.99 2o5j s ILE 136 N 0.34 5.20 0.17 -0.62 -1.09 -1.26 -4.00 121.20 119.95 2o5j s ILE 136 Ca -0.05 -1.12 -0.29 0.00 -2.23 0.00 0.00 60.65 56.96 2o5j s ILE 136 Cb -0.10 -4.19 -0.07 0.00 -1.58 0.00 0.00 42.46 36.52 2o5j s ILE 136 CO 0.00 -0.66 0.90 0.68 -1.23 0.00 0.00 174.94 174.63 2o5j s VAL 137 N 1.71 4.32 1.34 2.92 -7.23 -1.26 -4.67 120.40 117.52 2o5j s VAL 137 Ca 0.05 1.96 -0.22 0.00 -1.81 0.00 0.00 61.98 61.96 2o5j s VAL 137 Cb -0.25 -4.27 0.34 0.00 0.56 0.00 0.00 36.38 32.76 2o5j s VAL 137 CO 0.06 0.44 1.02 -0.55 -0.31 0.00 0.00 175.10 175.76 2o5j s SER 138 N -0.71 -0.27 0.22 4.85 0.15 -1.26 -4.84 113.70 111.84 2o5j s SER 138 Ca 0.41 0.69 -0.12 0.00 0.70 0.00 0.00 55.95 57.63 2o5j s SER 138 Cb -0.24 -0.95 -0.00 0.00 -1.71 0.00 0.00 66.02 63.11 2o5j s SER 138 CO 0.29 -4.86 0.44 0.00 1.20 0.00 0.00 173.24 170.32 2o5j s GLN 139 N -5.28 1.45 0.20 5.44 -2.07 -0.86 -3.55 119.66 114.98 2o5j s GLN 139 Ca 0.70 -1.19 0.07 0.00 -1.82 0.00 0.00 55.36 53.12 2o5j s GLN 139 Cb -0.11 0.46 -0.05 0.00 -1.09 0.00 0.00 33.01 32.22 2o5j s GLN 139 CO 0.57 -0.59 -0.13 0.96 -1.32 0.00 0.00 175.29 174.78 2o5j s ILE 140 N -3.99 1.64 -0.05 3.63 -5.25 0.19 0.18 121.20 117.55 2o5j s ILE 140 Ca 0.20 -2.18 -0.30 0.00 -0.99 0.00 0.00 60.65 57.37 2o5j s ILE 140 Cb 0.00 -2.04 0.12 0.00 2.95 0.00 0.00 42.46 43.49 2o5j s ILE 140 CO 0.06 -0.60 1.34 -1.38 -1.79 0.00 0.00 174.94 172.57 2o5j s HIS 141 N -3.03 -0.00 0.19 1.37 -3.43 0.13 -4.71 115.29 105.80 2o5j s HIS 141 Ca 0.22 -0.06 -0.30 0.00 -0.80 0.00 0.00 55.06 54.12 2o5j s HIS 141 Cb 0.00 0.53 -0.08 0.00 -1.43 0.00 0.00 32.58 31.60 2o5j s HIS 141 CO 0.06 -0.17 1.24 1.03 -2.00 0.00 0.00 174.74 174.90 2o5j s ARG 142 N -2.14 4.45 0.93 -0.38 1.81 -1.26 0.18 118.95 122.54 2o5j s ARG 142 Ca 0.22 1.94 -0.15 0.00 -1.72 0.00 0.00 55.73 56.02 2o5j s ARG 142 Cb 0.03 -3.22 0.17 0.00 -0.45 0.00 0.00 34.95 31.48 2o5j s ARG 142 CO -0.04 -0.14 1.27 -1.54 -0.68 0.00 0.00 175.30 174.17 2o5j s SER 143 N 0.19 3.42 -0.43 0.23 1.04 -1.08 -4.73 113.70 112.34 2o5j s SER 143 Ca 0.54 0.46 -0.22 0.00 0.48 0.00 0.00 55.95 57.21 2o5j s SER 143 Cb -0.34 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.14 2o5j s SER 143 CO 0.37 -2.56 0.71 -2.84 0.98 0.00 0.00 173.24 169.91 2o5j s PRO 144 N -5.75 3.41 0.00 4.02 0.02 -1.26 -5.00 135.00 130.43 2o5j s PRO 144 Ca 0.70 -0.17 0.00 0.00 0.02 0.00 0.00 61.00 61.55 2o5j s PRO 144 Cb -0.07 -3.92 0.00 0.00 0.02 0.00 0.00 34.50 30.53 2o5j s PRO 144 CO 0.52 -1.02 0.00 0.41 -0.33 0.00 0.00 177.00 176.58 2o5j n GLY 145 N 4.94 2.73 2.83 0.52 0.00 -1.10 -4.71 105.19 110.42 2o5j n GLY 145 Ca 0.00 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 2o5j n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 146 N -1.54 0.35 0.18 1.61 1.01 -1.26 -0.20 120.40 120.55 2o5j s VAL 146 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2o5j s VAL 146 Cb 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 2o5j s VAL 146 CO 0.00 0.20 0.05 -0.31 0.00 0.00 0.00 175.10 175.04 2o5j s TYR 147 N 1.20 1.17 -0.29 5.22 1.51 -0.24 -4.79 117.35 121.14 2o5j s TYR 147 Ca -0.07 -1.14 -0.00 0.00 -1.01 0.00 0.00 57.07 54.85 2o5j s TYR 147 Cb -0.14 -0.66 0.09 0.00 -0.11 0.00 0.00 41.96 41.14 2o5j s TYR 147 CO -0.02 -0.36 0.06 -0.59 -1.11 0.00 0.00 175.55 173.53 2o5j s PHE 148 N -3.83 2.04 0.13 2.71 -0.12 -1.26 -0.39 117.98 117.27 2o5j s PHE 148 Ca 0.28 -1.81 0.06 0.00 -0.05 0.00 0.00 56.93 55.41 2o5j s PHE 148 Cb 0.07 -1.78 -0.04 0.00 -0.63 0.00 0.00 43.02 40.64 2o5j s PHE 148 CO 0.06 -0.84 -0.01 -0.08 -0.05 0.00 0.00 175.22 174.30 2o5j s THR 149 N 1.50 3.81 0.54 -4.49 -1.32 -0.97 -4.65 115.64 110.07 2o5j s THR 149 Ca 0.06 -1.23 -0.21 0.00 -1.21 0.00 0.00 61.69 59.10 2o5j s THR 149 Cb -0.18 -2.87 -0.06 0.00 -1.51 0.00 0.00 72.50 67.88 2o5j s THR 149 CO -0.17 0.00 1.05 -2.65 -2.21 0.00 0.00 174.62 170.64 2o5j n PRO 150 N 0.23 1.19 -1.81 7.08 -0.02 -1.26 -1.88 135.00 138.52 2o5j n PRO 150 Ca -0.11 0.44 -0.40 0.00 -2.02 0.00 0.00 63.50 61.42 2o5j n PRO 150 Cb 0.54 -2.22 0.01 0.00 -0.02 0.00 0.00 33.50 31.81 2o5j n PRO 150 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2o5j s ASP 151 N -1.03 6.02 0.00 2.55 -1.08 -1.24 -4.68 116.67 117.20 2o5j s ASP 151 Ca 0.71 2.94 0.00 0.00 -0.52 0.00 0.00 52.55 55.68 2o5j s ASP 151 Cb -0.45 -2.66 0.00 0.00 -1.46 0.00 0.00 42.92 38.35 2o5j s ASP 151 CO 0.50 -1.08 0.13 -2.65 0.52 0.00 0.00 175.17 172.59 2o5j n PRO 152 N -0.00 0.00 -0.08 4.34 -0.02 -1.26 -4.60 135.00 133.38 2o5j n PRO 152 Ca 0.04 0.09 -0.10 0.00 -2.02 0.00 0.00 63.50 61.50 2o5j n PRO 152 Cb 0.41 -0.63 -0.05 0.00 -0.02 0.00 0.00 33.50 33.21 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 -2.51 0.09 -1.86 3.55 0.00 -2.00 -3.47 119.26 113.06 2o5j h ALA 153 Ca 0.00 -0.71 -0.66 0.00 0.00 0.00 0.00 54.91 53.54 2o5j h ALA 153 Cb 0.00 0.53 0.04 0.00 0.00 0.00 0.00 17.79 18.35 2o5j h ALA 153 CO 0.00 0.51 0.80 2.89 0.00 0.00 0.00 179.25 183.46 2o5j n ARG 154 N -4.57 1.62 0.14 0.00 1.85 -1.26 -4.84 116.66 109.61 2o5j n ARG 154 Ca -0.15 0.59 0.12 0.00 -1.00 0.00 0.00 57.85 57.41 2o5j n ARG 154 Cb 0.39 -2.32 0.51 0.00 -1.05 0.00 0.00 32.46 30.00 2o5j n ARG 154 CO 0.00 0.00 0.00 -1.35 -0.01 0.00 0.00 177.63 176.27 2o5j h PRO 155 N 6.67 0.00 0.00 2.89 0.11 -1.91 -3.42 132.00 136.35 2o5j h PRO 155 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2o5j h PRO 155 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2o5j h PRO 155 CO 0.89 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.09 2o5j n GLY 156 N -0.00 -0.52 3.50 -0.55 0.00 -1.26 -4.95 105.19 101.41 2o5j n GLY 156 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 2o5j n GLY 156 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2o5j s ARG 157 N 0.00 1.82 0.57 1.61 3.52 -1.26 -4.97 118.95 120.24 2o5j s ARG 157 Ca 0.00 -1.26 -0.07 0.00 -0.13 0.00 0.00 55.73 54.27 2o5j s ARG 157 Cb 0.00 -2.08 -0.01 0.00 -1.56 0.00 0.00 34.95 31.30 2o5j s ARG 157 CO 0.00 0.45 0.90 0.71 -0.81 0.00 0.00 175.30 176.55 2o5j s TYR 158 N -1.39 3.38 0.18 5.12 1.51 -1.26 -3.71 117.35 121.17 2o5j s TYR 158 Ca 0.20 0.79 0.11 0.00 -1.01 0.00 0.00 57.07 57.16 2o5j s TYR 158 Cb -0.10 -2.65 -0.04 0.00 -0.11 0.00 0.00 41.96 39.06 2o5j s TYR 158 CO 0.12 -0.69 -0.23 0.96 -1.11 0.00 0.00 175.55 174.60 2o5j s ILE 159 N -2.97 2.19 0.34 2.71 -4.36 -0.79 -4.80 121.20 113.51 2o5j s ILE 159 Ca 0.53 -1.97 -0.03 0.00 -0.26 0.00 0.00 60.65 58.92 2o5j s ILE 159 Cb -0.11 -2.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.54 2o5j s ILE 159 CO 0.46 -0.15 0.59 0.00 0.24 0.00 0.00 174.94 176.08 2o5j s ALA 160 N -1.70 3.61 -0.11 2.27 0.00 -0.71 -2.28 121.76 122.83 2o5j s ALA 160 Ca 0.18 -0.67 -0.04 0.00 0.00 0.00 0.00 51.96 51.44 2o5j s ALA 160 Cb -0.08 -2.28 0.06 0.00 0.00 0.00 0.00 23.12 20.82 2o5j s ALA 160 CO 0.09 0.05 0.20 0.45 0.00 0.00 0.00 175.76 176.55 2o5j s SER 161 N -3.62 0.68 -0.34 0.00 0.15 0.48 -1.54 113.70 109.51 2o5j s SER 161 Ca 0.43 0.37 -0.13 0.00 0.70 0.00 0.00 55.95 57.33 2o5j s SER 161 Cb -0.10 0.43 -0.01 0.00 -1.71 0.00 0.00 66.02 64.62 2o5j s SER 161 CO 0.34 -0.25 0.24 -0.63 1.20 0.00 0.00 173.24 174.14 2o5j s ILE 162 N 2.34 5.22 -0.34 6.45 1.01 -0.33 -1.08 121.20 134.48 2o5j s ILE 162 Ca 0.03 -0.26 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 2o5j s ILE 162 Cb -0.12 -3.69 0.05 0.00 0.01 0.00 0.00 42.46 38.70 2o5j s ILE 162 CO -0.07 -0.02 0.09 0.27 0.00 0.00 0.00 174.94 175.21 2o5j s ILE 163 N 1.71 3.55 -0.29 2.92 -5.25 0.72 -2.66 121.20 121.89 2o5j s ILE 163 Ca 0.06 -1.29 -0.06 0.00 -0.99 0.00 0.00 60.65 58.38 2o5j s ILE 163 Cb -0.17 -3.06 0.02 0.00 2.95 0.00 0.00 42.46 42.19 2o5j s ILE 163 CO 0.10 -0.22 0.05 -2.84 -1.79 0.00 0.00 174.94 170.24 2o5j s PRO 164 N 1.34 2.99 0.04 0.37 0.02 -1.26 -2.70 135.00 135.80 2o5j s PRO 164 Ca -0.02 -0.91 0.02 0.00 0.02 0.00 0.00 61.00 60.11 2o5j s PRO 164 Cb -0.20 -3.29 -0.04 0.00 0.02 0.00 0.00 34.50 30.99 2o5j s PRO 164 CO 0.01 -0.45 0.04 -1.17 -0.33 0.00 0.00 177.00 175.10 2o5j s LEU 165 N 1.45 3.67 0.98 -5.54 2.96 -1.26 -4.68 118.68 116.26 2o5j s LEU 165 Ca 0.02 -0.01 -0.19 0.00 -0.22 0.00 0.00 54.13 53.73 2o5j s LEU 165 Cb -0.17 -2.23 -0.16 0.00 0.50 0.00 0.00 46.19 44.13 2o5j s LEU 165 CO 0.01 0.23 -0.92 -2.65 -1.32 0.00 0.00 176.35 171.69 2o5j n PRO 166 N 0.94 0.00 0.12 0.98 -0.02 -1.14 -4.21 135.00 131.68 2o5j n PRO 166 Ca -0.12 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.22 2o5j n PRO 166 Cb 0.52 -0.98 -0.08 0.00 -0.02 0.00 0.00 33.50 32.94 2o5j n PRO 166 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2o5j h LYS 167 N -0.98 -0.64 -6.40 -0.52 3.64 -1.91 -3.37 116.57 106.38 2o5j h LYS 167 Ca -0.42 0.04 -0.53 0.00 -1.27 0.00 0.00 60.65 58.47 2o5j h LYS 167 Cb 1.29 0.15 0.02 0.00 -0.41 0.00 0.00 32.23 33.27 2o5j h LYS 167 CO 0.22 -0.43 1.12 1.03 -2.27 0.00 0.00 179.45 179.12 2o5j s ARG 168 N -5.29 4.16 0.00 1.90 1.81 -1.26 -4.66 118.95 115.61 2o5j s ARG 168 Ca -0.14 2.47 0.00 0.00 -1.72 0.00 0.00 55.73 56.34 2o5j s ARG 168 Cb 0.05 -3.85 0.00 0.00 -0.45 0.00 0.00 34.95 30.69 2o5j s ARG 168 CO 0.50 -0.86 0.00 0.41 -0.68 0.00 0.00 175.30 174.67 2o5j n GLY 169 N 4.26 3.22 1.72 -3.53 0.00 -1.26 -4.34 105.19 105.27 2o5j n GLY 169 Ca 0.18 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.57 2o5j n GLY 169 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 170 N 0.00 0.00 -3.63 1.61 -0.02 -1.26 -4.76 135.00 126.95 2o5j n PRO 170 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 2o5j n PRO 170 Cb 0.00 -0.57 -0.14 0.00 -0.02 0.00 0.00 33.50 32.77 2o5j n PRO 170 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 2o5j s TRP 171 N -1.15 1.23 0.34 6.00 -0.11 -1.19 -4.15 118.94 119.92 2o5j s TRP 171 Ca 0.23 -1.66 -0.16 0.00 1.22 0.00 0.00 56.10 55.73 2o5j s TRP 171 Cb -0.09 -1.39 -0.09 0.00 -1.50 0.00 0.00 33.47 30.40 2o5j s TRP 171 CO 0.47 -0.84 0.78 0.42 -4.62 0.00 0.00 176.95 173.16 2o5j s ILE 172 N 1.34 4.62 -0.04 5.86 1.09 -1.09 -4.34 121.20 128.66 2o5j s ILE 172 Ca 0.13 1.05 -0.02 0.00 -1.10 0.00 0.00 60.65 60.71 2o5j s ILE 172 Cb -0.20 -3.61 0.03 0.00 -1.06 0.00 0.00 42.46 37.62 2o5j s ILE 172 CO -0.17 -0.21 0.08 -1.81 -0.10 0.00 0.00 174.94 172.74 2o5j s ASP 173 N -2.25 -0.03 -0.29 3.58 1.11 -1.11 -1.18 116.67 116.48 2o5j s ASP 173 Ca 0.56 0.16 0.02 0.00 0.18 0.00 0.00 52.55 53.46 2o5j s ASP 173 Cb -0.10 0.08 0.07 0.00 1.07 0.00 0.00 42.92 44.04 2o5j s ASP 173 CO 0.17 -0.11 -0.03 -0.76 1.18 0.00 0.00 175.17 175.62 2o5j s LEU 174 N 0.82 3.93 -0.04 1.23 1.02 -0.59 -2.14 118.68 122.91 2o5j s LEU 174 Ca -0.07 -1.55 0.03 0.00 0.02 0.00 0.00 54.13 52.56 2o5j s LEU 174 Cb -0.09 -1.62 0.00 0.00 0.02 0.00 0.00 46.19 44.50 2o5j s LEU 174 CO -0.03 -0.27 -0.13 -0.70 0.02 0.00 0.00 176.35 175.24 2o5j s GLU 175 N 1.10 1.51 -0.23 1.70 2.12 0.55 -1.74 118.70 123.71 2o5j s GLU 175 Ca -0.03 -0.46 -0.05 0.00 0.36 0.00 0.00 54.97 54.79 2o5j s GLU 175 Cb -0.20 -1.31 -0.02 0.00 0.26 0.00 0.00 34.13 32.86 2o5j s GLU 175 CO -0.05 0.14 0.01 0.14 -0.54 0.00 0.00 175.26 174.96 2o5j s VAL 176 N 0.28 3.78 -0.62 3.70 -7.23 -1.26 0.11 120.40 119.16 2o5j s VAL 176 Ca -0.07 -0.36 0.06 0.00 -1.81 0.00 0.00 61.98 59.80 2o5j s VAL 176 Cb -0.12 -2.75 0.26 0.00 0.56 0.00 0.00 36.38 34.33 2o5j s VAL 176 CO 0.02 0.38 0.77 1.21 -0.31 0.00 0.00 175.10 177.17 2o5j n GLU 177 N 4.85 2.58 0.09 4.82 0.00 -0.82 -5.01 120.64 127.14 2o5j n GLU 177 Ca -0.17 -4.66 0.00 0.00 0.00 0.00 0.00 57.16 52.33 2o5j n GLU 177 Cb 0.51 -2.23 0.00 0.00 0.00 0.00 0.00 31.44 29.72 2o5j n GLU 177 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2o5j n PRO 178 N 0.71 0.01 0.16 5.31 -0.02 -1.21 -3.10 135.00 136.86 2o5j n PRO 178 Ca 0.30 0.25 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 2o5j n PRO 178 Cb 0.41 -0.88 0.59 0.00 -0.02 0.00 0.00 33.50 33.60 2o5j n PRO 178 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2o5j h ASN 179 N 0.00 0.00 0.00 2.55 -0.73 -2.03 -3.41 115.58 111.96 2o5j h ASN 179 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2o5j h ASN 179 Cb 0.62 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.21 2o5j h ASN 179 CO 0.00 0.00 0.00 0.61 -0.37 0.00 0.00 177.43 177.67 2o5j n GLY 180 N -0.84 0.00 3.16 1.57 0.00 -1.24 -5.18 105.19 102.67 2o5j n GLY 180 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2o5j n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 181 N 0.00 0.14 0.12 1.61 1.01 -1.18 -4.97 120.40 117.14 2o5j s VAL 181 Ca 0.00 -1.18 0.07 0.00 0.00 0.00 0.00 61.98 60.87 2o5j s VAL 181 Cb 0.00 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2o5j s VAL 181 CO 0.00 -0.65 -0.17 -0.69 0.00 0.00 0.00 175.10 173.59 2o5j s VAL 182 N -3.23 1.55 -0.09 2.92 1.01 -1.26 -1.94 120.40 119.36 2o5j s VAL 182 Ca 0.00 -1.68 -0.02 0.00 0.00 0.00 0.00 61.98 60.29 2o5j s VAL 182 Cb 0.02 -1.57 0.03 0.00 0.00 0.00 0.00 36.38 34.86 2o5j s VAL 182 CO -0.07 -0.27 0.01 -0.55 0.00 0.00 0.00 175.10 174.22 2o5j s SER 183 N -2.28 1.73 -0.25 3.32 0.15 0.30 -4.71 113.70 111.96 2o5j s SER 183 Ca 0.09 -0.17 0.02 0.00 0.70 0.00 0.00 55.95 56.59 2o5j s SER 183 Cb -0.07 -0.44 0.06 0.00 -1.71 0.00 0.00 66.02 63.86 2o5j s SER 183 CO 0.04 -0.21 -0.10 -0.32 1.20 0.00 0.00 173.24 173.85 2o5j s MET 184 N 1.97 2.09 -0.24 5.44 1.75 -1.17 -0.33 119.30 128.81 2o5j s MET 184 Ca 0.04 -1.23 -0.05 0.00 -1.25 0.00 0.00 55.69 53.19 2o5j s MET 184 Cb -0.13 -2.79 -0.01 0.00 2.84 0.00 0.00 34.83 34.74 2o5j s MET 184 CO -0.06 -0.57 0.02 0.15 -0.65 0.00 0.00 175.02 173.91 2o5j s LYS 185 N 1.19 3.43 0.00 4.11 1.02 -0.91 -3.09 119.74 125.48 2o5j s LYS 185 Ca -0.08 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.30 2o5j s LYS 185 Cb -0.19 -3.18 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 2o5j s LYS 185 CO -0.06 -0.23 0.00 1.33 -0.92 0.00 0.00 175.35 175.47 2o5j n VAL 186 N 4.85 0.00 0.01 3.17 0.24 -1.26 -2.77 118.33 122.58 2o5j n VAL 186 Ca -0.17 0.23 -0.22 0.00 -2.04 0.00 0.00 64.34 62.15 2o5j n VAL 186 Cb 0.51 -0.78 -0.14 0.00 -1.47 0.00 0.00 33.84 31.95 2o5j n VAL 186 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2o5j h ASN 187 N 0.00 0.44 0.00 -1.34 -0.73 -1.95 -3.15 115.58 108.85 2o5j h ASN 187 Ca 0.00 -0.95 0.00 0.00 1.87 0.00 0.00 56.30 57.22 2o5j h ASN 187 Cb 0.00 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 38.45 2o5j h ASN 187 CO 0.00 1.85 0.00 0.29 -0.37 0.00 0.00 177.43 179.20 2o5j n LYS 188 N -3.49 0.00 -1.88 6.67 5.02 -1.26 -5.03 118.16 118.19 2o5j n LYS 188 Ca -0.31 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.56 2o5j n LYS 188 Cb 1.05 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 36.03 2o5j n LYS 188 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2o5j s ARG 189 N -0.42 4.19 0.38 1.97 6.06 -1.26 -4.64 118.95 125.23 2o5j s ARG 189 Ca 0.00 2.43 -0.25 0.00 -2.50 0.00 0.00 55.73 55.41 2o5j s ARG 189 Cb 0.00 -3.13 -0.09 0.00 0.06 0.00 0.00 34.95 31.80 2o5j s ARG 189 CO 0.00 -0.64 1.12 0.15 -2.50 0.00 0.00 175.30 173.43 2o5j s LYS 190 N 1.01 4.17 0.00 5.12 1.02 -1.26 -4.54 119.74 125.26 2o5j s LYS 190 Ca 0.71 1.73 0.00 0.00 0.02 0.00 0.00 55.97 58.43 2o5j s LYS 190 Cb -0.45 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 2o5j s LYS 190 CO 0.33 -0.19 0.00 1.97 -0.92 0.00 0.00 175.35 176.54 2o5j n PHE 191 N 0.19 0.00 -2.86 3.18 -1.74 -1.18 -4.92 117.46 110.12 2o5j n PHE 191 Ca 0.04 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.73 2o5j n PHE 191 Cb 0.47 0.00 0.06 0.00 1.52 0.00 0.00 39.48 41.53 2o5j n PHE 191 CO 0.00 0.00 0.00 -2.14 -0.56 0.00 0.00 176.76 174.06 2o5j s PRO 192 N 1.64 2.33 0.17 3.97 0.02 -1.26 -3.02 135.00 138.84 2o5j s PRO 192 Ca 0.00 -1.28 0.25 0.00 0.02 0.00 0.00 61.00 59.99 2o5j s PRO 192 Cb 0.00 -2.58 0.49 0.00 0.02 0.00 0.00 34.50 32.43 2o5j s PRO 192 CO 0.00 -0.83 1.48 -0.07 -0.33 0.00 0.00 177.00 177.25 2o5j h LEU 193 N 0.11 0.00 0.01 -5.54 4.07 -1.88 -3.31 115.31 108.77 2o5j h LEU 193 Ca -0.36 -0.12 -0.33 0.00 0.08 0.00 0.00 57.88 57.15 2o5j h LEU 193 Cb 1.28 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.97 2o5j h LEU 193 CO 0.44 0.06 -2.03 0.52 -1.08 0.00 0.00 178.44 176.35 2o5j n VAL 194 N -2.24 1.53 0.19 1.22 0.31 -1.26 -3.45 118.33 114.62 2o5j n VAL 194 Ca 0.04 -0.80 0.16 0.00 -0.01 0.00 0.00 64.34 63.72 2o5j n VAL 194 Cb 0.45 -0.87 0.78 0.00 -0.91 0.00 0.00 33.84 33.28 2o5j n VAL 194 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2o5j h LEU 195 N 0.00 0.00 0.10 7.52 5.85 -1.93 0.13 115.31 126.99 2o5j h LEU 195 Ca -0.41 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.08 2o5j h LEU 195 Cb 2.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.13 2o5j h LEU 195 CO 0.05 0.00 -1.13 0.25 -0.34 0.00 0.00 178.44 177.27 2o5j h LEU 196 N 0.00 0.33 -0.85 2.25 6.46 -1.73 -3.23 115.31 118.54 2o5j h LEU 196 Ca 0.09 -0.86 0.08 0.00 -0.12 0.00 0.00 57.88 57.07 2o5j h LEU 196 Cb 0.45 -0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.21 2o5j h LEU 196 CO -0.00 1.50 0.51 -0.07 -0.62 0.00 0.00 178.44 179.76 2o5j h LEU 197 N -0.44 0.78 -1.17 2.25 3.38 -1.31 -1.95 115.31 116.85 2o5j h LEU 197 Ca -0.24 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 2o5j h LEU 197 Cb 1.62 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 2o5j h LEU 197 CO 0.05 0.48 -0.16 0.03 0.09 0.00 0.00 178.44 178.93 2o5j h ARG 198 N 0.91 0.39 -0.47 1.13 2.47 -0.78 0.25 114.38 118.27 2o5j h ARG 198 Ca 0.39 -0.11 -0.07 0.00 -1.26 0.00 0.00 59.98 58.93 2o5j h ARG 198 Cb 0.25 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 2o5j h ARG 198 CO -0.20 0.54 0.04 0.28 0.56 0.00 0.00 179.97 181.18 2o5j h VAL 199 N 0.36 1.26 0.00 2.04 2.07 -1.38 -2.98 116.25 117.62 2o5j h VAL 199 Ca 0.07 -1.00 -0.13 0.00 0.82 0.00 0.00 66.70 66.46 2o5j h VAL 199 Cb 0.49 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 2o5j h VAL 199 CO 0.03 0.35 -0.61 -0.07 0.02 0.00 0.00 177.57 177.29 2o5j h LEU 200 N 0.67 0.00 0.00 2.57 3.38 -1.32 -3.45 115.31 117.17 2o5j h LEU 200 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2o5j h LEU 200 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2o5j h LEU 200 CO 0.02 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.76 2o5j n GLY 201 N 0.32 -0.61 3.50 0.83 0.00 -0.68 -4.67 105.19 103.88 2o5j n GLY 201 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2o5j n GLY 201 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2o5j s TYR 202 N -0.37 3.01 0.62 1.61 2.02 0.80 -4.95 117.35 120.09 2o5j s TYR 202 Ca 0.00 -0.19 -0.14 0.00 -0.37 0.00 0.00 57.07 56.38 2o5j s TYR 202 Cb 0.00 -3.54 -0.03 0.00 -0.40 0.00 0.00 41.96 37.99 2o5j s TYR 202 CO 0.00 -1.01 1.04 -0.51 -1.57 0.00 0.00 175.55 173.51 2o5j s ASP 203 N 2.36 5.86 0.24 2.29 -0.00 -1.26 -3.32 116.67 122.83 2o5j s ASP 203 Ca 0.22 1.65 -0.07 0.00 -0.00 0.00 0.00 52.55 54.35 2o5j s ASP 203 Cb -0.15 -2.51 0.23 0.00 -0.00 0.00 0.00 42.92 40.49 2o5j s ASP 203 CO 0.17 -1.11 1.91 1.56 -0.00 0.00 0.00 175.17 177.70 2o5j h GLN 204 N 0.04 1.23 0.00 8.23 1.08 -1.96 -2.08 115.11 121.65 2o5j h GLN 204 Ca -0.45 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 56.67 2o5j h GLN 204 Cb 1.21 -0.28 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 2o5j h GLN 204 CO 0.59 0.82 0.00 -0.85 -0.95 0.00 0.00 178.83 178.43 2o5j n GLU 205 N -4.43 0.00 -0.14 1.46 -0.00 -1.26 -2.10 120.64 114.17 2o5j n GLU 205 Ca 0.11 0.45 -0.03 0.00 -0.00 0.00 0.00 57.16 57.68 2o5j n GLU 205 Cb 0.01 -1.41 0.05 0.00 -0.00 0.00 0.00 31.44 30.10 2o5j n GLU 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2o5j h THR 206 N 0.00 0.69 0.24 3.84 1.03 -1.98 -2.39 112.91 114.34 2o5j h THR 206 Ca 0.00 -0.05 0.01 0.00 -0.01 0.00 0.00 66.41 66.35 2o5j h THR 206 Cb 0.00 0.52 -0.03 0.00 -1.07 0.00 0.00 68.15 67.56 2o5j h THR 206 CO 0.00 0.03 -0.39 0.25 -0.01 0.00 0.00 175.52 175.40 2o5j h LEU 207 N 0.16 -1.10 -0.35 0.00 6.46 -1.49 -1.97 115.31 117.03 2o5j h LEU 207 Ca 0.23 0.11 0.03 0.00 -0.12 0.00 0.00 57.88 58.13 2o5j h LEU 207 Cb 0.32 0.39 -0.03 0.00 -0.73 0.00 0.00 40.66 40.61 2o5j h LEU 207 CO -0.34 -0.50 0.16 0.00 -0.62 0.00 0.00 178.44 177.14 2o5j h ALA 208 N -0.23 0.42 -0.06 1.25 0.00 -1.29 -0.69 119.26 118.66 2o5j h ALA 208 Ca -0.00 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2o5j h ALA 208 Cb 0.68 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2o5j h ALA 208 CO -0.15 -0.22 -0.50 0.00 0.00 0.00 0.00 179.25 178.38 2o5j h ARG 209 N 0.33 0.14 0.13 0.00 -0.00 -1.35 0.16 114.38 113.79 2o5j h ARG 209 Ca 0.15 -0.08 -0.34 0.00 -0.50 0.00 0.00 59.98 59.21 2o5j h ARG 209 Cb 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.04 2o5j h ARG 209 CO -0.12 0.62 -1.80 0.93 0.00 0.00 0.00 179.97 179.59 2o5j h GLU 210 N 0.12 0.27 0.00 0.04 5.08 -1.24 -2.66 114.58 116.19 2o5j h GLU 210 Ca 0.00 -0.46 -0.11 0.00 -1.00 0.00 0.00 59.36 57.79 2o5j h GLU 210 Cb 0.93 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 2o5j h GLU 210 CO 0.07 1.22 -0.58 1.25 -1.00 0.00 0.00 179.01 179.97 2o5j h LEU 211 N -0.06 0.00 -2.98 1.33 5.85 -1.21 -3.35 115.31 114.90 2o5j h LEU 211 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2o5j h LEU 211 Cb 1.95 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.98 2o5j h LEU 211 CO 0.08 0.49 0.00 0.61 -0.34 0.00 0.00 178.44 179.28 2o5j n GLY 212 N 1.24 3.14 0.35 3.75 0.00 0.55 -4.47 105.19 109.75 2o5j n GLY 212 Ca 0.01 -0.46 0.02 0.00 0.00 0.00 0.00 46.02 45.59 2o5j n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j h ALA 213 N 1.49 1.51 0.00 4.61 0.00 -1.56 -2.64 119.26 122.67 2o5j h ALA 213 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 2o5j h ALA 213 Cb 0.82 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2o5j h ALA 213 CO 0.04 0.43 -1.04 0.10 0.00 0.00 0.00 179.25 178.77 2o5j h TYR 214 N 0.96 0.00 -1.06 0.00 -0.00 -1.86 -3.48 116.97 111.53 2o5j h TYR 214 Ca 0.29 0.00 -0.64 0.00 0.00 0.00 0.00 58.73 58.38 2o5j h TYR 214 Cb -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 36.73 36.58 2o5j h TYR 214 CO -0.00 0.55 -0.53 0.20 -0.00 0.00 0.00 178.16 178.38 2o5j s GLY 215 N -4.65 2.86 -0.00 0.10 0.00 -0.99 -5.07 107.32 99.56 2o5j s GLY 215 Ca -0.00 -0.79 0.08 0.00 0.00 0.00 0.00 44.72 44.01 2o5j s GLY 215 CO 0.79 -2.10 0.26 -2.21 0.00 0.00 0.00 173.10 169.84 2o5j n GLU 216 N -1.14 2.80 0.20 2.90 0.00 -1.26 -4.60 120.64 119.53 2o5j n GLU 216 Ca -0.15 -0.03 0.13 0.00 0.00 0.00 0.00 57.16 57.12 2o5j n GLU 216 Cb 0.67 -0.99 0.71 0.00 0.00 0.00 0.00 31.44 31.82 2o5j n GLU 216 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2o5j h LEU 217 N 0.00 0.00 -1.50 4.31 3.38 -1.95 -2.55 115.31 116.99 2o5j h LEU 217 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2o5j h LEU 217 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2o5j h LEU 217 CO 0.00 0.00 0.13 0.58 0.09 0.00 0.00 178.44 179.24 2o5j h VAL 218 N 0.00 0.00 0.00 1.22 2.07 -1.92 -1.75 116.25 115.87 2o5j h VAL 218 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2o5j h VAL 218 Cb 0.06 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2o5j h VAL 218 CO 0.00 0.00 0.00 1.56 0.02 0.00 0.00 177.57 179.15 2o5j h GLN 219 N 0.00 0.00 0.00 1.57 4.20 -1.84 -2.92 115.11 116.13 2o5j h GLN 219 Ca 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2o5j h GLN 219 Cb 0.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2o5j h GLN 219 CO 0.00 0.00 -0.87 0.78 -0.67 0.00 0.00 178.83 178.07 2o5j h GLY 220 N 3.63 0.00 1.08 3.46 0.00 -1.58 -3.28 103.07 106.38 2o5j h GLY 220 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 2o5j h GLY 220 CO 0.00 0.00 -0.95 0.17 0.00 0.00 0.00 176.54 175.76 2o5j h LEU 221 N 0.00 0.80 -0.11 3.11 8.10 -1.64 -3.26 115.31 122.31 2o5j h LEU 221 Ca -0.05 -0.76 0.00 0.00 0.11 0.00 0.00 57.88 57.17 2o5j h LEU 221 Cb 1.29 -0.25 0.00 0.00 -0.44 0.00 0.00 40.66 41.26 2o5j h LEU 221 CO 0.03 1.46 -0.02 0.23 -4.11 0.00 0.00 178.44 176.03 2o5j n MET 222 N -3.95 0.80 0.00 0.17 0.00 -1.16 -4.55 117.12 108.43 2o5j n MET 222 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 57.70 57.48 2o5j n MET 222 Cb 0.84 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.56 2o5j n MET 222 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2o5j n ASP 223 N -1.01 0.00 -3.93 7.83 2.03 -1.23 -3.49 116.55 116.75 2o5j n ASP 223 Ca 0.19 0.55 -0.40 0.00 0.52 0.00 0.00 54.79 55.64 2o5j n ASP 223 Cb 0.20 -0.05 -0.04 0.00 -0.72 0.00 0.00 41.12 40.51 2o5j n ASP 223 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2o5j n GLU 224 N -1.10 2.04 -0.07 -0.67 -0.58 -1.26 -4.73 120.64 114.26 2o5j n GLU 224 Ca 0.00 -2.30 0.03 0.00 -0.42 0.00 0.00 57.16 54.46 2o5j n GLU 224 Cb 0.00 -3.22 0.36 0.00 -0.57 0.00 0.00 31.44 28.00 2o5j n GLU 224 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2o5j h SER 225 N 7.73 0.60 -0.97 1.62 0.87 -1.92 -3.00 113.55 118.49 2o5j h SER 225 Ca 0.42 -0.02 0.18 0.00 -1.23 0.00 0.00 61.79 61.14 2o5j h SER 225 Cb 0.73 -0.15 -0.10 0.00 -0.44 0.00 0.00 62.40 62.44 2o5j h SER 225 CO 1.75 0.45 0.57 1.62 -0.53 0.00 0.00 176.83 180.70 2o5j h VAL 226 N 0.71 0.72 0.00 2.23 3.04 -1.93 -1.77 116.25 119.25 2o5j h VAL 226 Ca 0.19 -0.26 -0.17 0.00 -1.01 0.00 0.00 66.70 65.45 2o5j h VAL 226 Cb -0.06 -0.09 -0.03 0.00 -2.01 0.00 0.00 31.29 29.10 2o5j h VAL 226 CO -0.04 0.14 -1.24 -0.26 -1.01 0.00 0.00 177.57 175.16 2o5j h PHE 227 N 0.75 0.00 0.00 3.17 -1.00 -1.93 -3.34 116.94 114.58 2o5j h PHE 227 Ca 0.55 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.33 2o5j h PHE 227 Cb 0.82 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.38 2o5j h PHE 227 CO -0.02 0.63 0.00 0.00 -1.61 0.00 0.00 178.31 177.30 2o5j n ALA 228 N -2.37 1.93 1.49 2.45 0.00 -0.70 -3.03 120.51 120.28 2o5j n ALA 228 Ca -0.07 -0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.43 2o5j n ALA 228 Cb 0.84 -1.32 0.58 0.00 0.00 0.00 0.00 19.45 19.55 2o5j n ALA 228 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2o5j n MET 229 N -1.46 1.13 -3.88 0.00 2.81 -0.99 -4.72 117.12 110.01 2o5j n MET 229 Ca 0.06 -0.52 -0.29 0.00 -1.81 0.00 0.00 57.70 55.13 2o5j n MET 229 Cb 0.22 -1.49 -0.16 0.00 -0.71 0.00 0.00 33.22 31.08 2o5j n MET 229 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2o5j s ARG 230 N -2.23 1.35 0.00 0.03 0.52 -1.17 -5.10 118.95 112.34 2o5j s ARG 230 Ca 0.34 -0.68 0.00 0.00 -0.52 0.00 0.00 55.73 54.87 2o5j s ARG 230 Cb 0.21 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.42 2o5j s ARG 230 CO 0.42 -0.54 0.00 -2.30 0.02 0.00 0.00 175.30 172.90 2o5j n PRO 231 N 4.83 0.00 0.10 3.54 -0.02 -1.26 -3.19 135.00 139.00 2o5j n PRO 231 Ca -0.11 0.00 0.17 0.00 -2.02 0.00 0.00 63.50 61.54 2o5j n PRO 231 Cb 0.46 0.00 0.49 0.00 -0.02 0.00 0.00 33.50 34.43 2o5j n PRO 231 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2o5j h GLU 232 N 0.00 0.00 -0.07 -0.52 5.08 -1.86 0.49 114.58 117.69 2o5j h GLU 232 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 2o5j h GLU 232 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2o5j h GLU 232 CO 0.00 0.00 -0.62 1.49 -1.00 0.00 0.00 179.01 178.88 2o5j h GLU 233 N 0.00 0.26 0.00 2.33 4.22 -1.98 -2.83 114.58 116.58 2o5j h GLU 233 Ca 0.20 -0.19 0.00 0.00 0.08 0.00 0.00 59.36 59.46 2o5j h GLU 233 Cb 1.80 0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.08 2o5j h GLU 233 CO -0.00 0.80 0.00 0.00 -2.18 0.00 0.00 179.01 177.63 2o5j h ALA 234 N 1.16 1.00 -0.22 2.92 0.00 0.04 0.41 119.26 124.56 2o5j h ALA 234 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2o5j h ALA 234 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2o5j h ALA 234 CO 0.10 0.00 -0.47 1.25 0.00 0.00 0.00 179.25 180.13 2o5j h LEU 235 N 0.00 0.80 -0.12 0.00 6.46 -1.57 -1.79 115.31 119.09 2o5j h LEU 235 Ca 0.00 -0.55 -0.20 0.00 -0.12 0.00 0.00 57.88 57.01 2o5j h LEU 235 Cb 0.28 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 39.96 2o5j h LEU 235 CO 0.00 1.20 -0.95 0.40 -0.62 0.00 0.00 178.44 178.47 2o5j h ILE 236 N 0.42 1.65 -0.22 4.05 5.03 -1.37 -3.06 117.51 124.02 2o5j h ILE 236 Ca 0.00 -3.17 -0.13 0.00 -0.12 0.00 0.00 64.86 61.44 2o5j h ILE 236 Cb 1.08 2.73 -0.01 0.00 -3.03 0.00 0.00 36.82 37.59 2o5j h ILE 236 CO 0.10 0.91 -0.40 -0.09 -0.68 0.00 0.00 178.15 177.99 2o5j h ARG 237 N 0.01 0.52 -0.22 2.37 2.43 -0.93 -1.98 114.38 116.59 2o5j h ARG 237 Ca -0.02 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 58.83 2o5j h ARG 237 Cb 1.67 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.22 2o5j h ARG 237 CO 0.13 0.83 -0.12 -0.07 -1.51 0.00 0.00 179.97 179.23 2o5j h LEU 238 N 0.43 0.47 -1.32 3.80 4.07 -1.40 -2.16 115.31 119.20 2o5j h LEU 238 Ca 0.04 -0.42 0.18 0.00 0.08 0.00 0.00 57.88 57.76 2o5j h LEU 238 Cb 0.89 -0.13 -0.08 0.00 1.08 0.00 0.00 40.66 42.42 2o5j h LEU 238 CO 0.08 0.79 0.60 -0.26 -1.08 0.00 0.00 178.44 178.56 2o5j h PHE 239 N 0.16 0.75 -0.61 1.13 0.04 -1.40 0.17 116.94 117.17 2o5j h PHE 239 Ca 0.05 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.74 2o5j h PHE 239 Cb 0.62 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 2o5j h PHE 239 CO 0.07 0.22 -0.00 1.15 -0.60 0.00 0.00 178.31 179.14 2o5j h THR 240 N 0.58 1.27 -0.74 -1.55 2.02 -1.18 -3.05 112.91 110.26 2o5j h THR 240 Ca 0.49 -1.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 2o5j h THR 240 Cb 0.97 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 2o5j h THR 240 CO -0.23 0.42 0.43 0.25 0.37 0.00 0.00 175.52 176.76 2o5j h LEU 241 N 0.99 0.88-10.15 2.58 6.46 -0.01 -3.42 115.31 112.64 2o5j h LEU 241 Ca 0.17 -0.05 -0.47 0.00 -0.12 0.00 0.00 57.88 57.41 2o5j h LEU 241 Cb 0.57 -0.22 0.21 0.00 -0.73 0.00 0.00 40.66 40.48 2o5j h LEU 241 CO 0.03 0.69 0.03 0.18 -0.62 0.00 0.00 178.44 178.75 2o5j n LEU 242 N -4.38 0.12 -3.48 2.25 4.77 -0.95 -5.02 117.00 110.31 2o5j n LEU 242 Ca 0.08 0.04 -0.19 0.00 -0.03 0.00 0.00 56.01 55.91 2o5j n LEU 242 Cb 0.08 -1.32 -0.12 0.00 -2.33 0.00 0.00 43.42 39.72 2o5j n LEU 242 CO 0.37 -2.92 -0.21 0.00 -1.33 0.00 0.00 177.39 173.30 2o5j s ARG 243 N -4.44 0.21 0.00 3.23 1.70 -1.26 -4.81 118.95 113.58 2o5j s ARG 243 Ca 0.68 0.11 0.00 0.00 -0.47 0.00 0.00 55.73 56.05 2o5j s ARG 243 Cb -0.24 -1.12 0.00 0.00 -0.57 0.00 0.00 34.95 33.01 2o5j s ARG 243 CO 0.63 -0.73 0.00 -2.30 -1.08 0.00 0.00 175.30 171.82 2o5j n PRO 244 N 5.31 0.00 0.00 3.89 -0.02 -1.26 -5.06 135.00 137.86 2o5j n PRO 244 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 2o5j n PRO 244 Cb 0.49 -0.42 0.00 0.00 -0.02 0.00 0.00 33.50 33.54 2o5j n PRO 244 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 245 N 1.08 0.86 3.93 -1.23 0.00 -1.26 -5.14 105.19 103.43 2o5j n GLY 245 Ca 0.00 -0.80 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 2o5j n GLY 245 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o5j s ASP 246 N -1.90 5.79 0.18 1.61 1.01 -1.26 -5.06 116.67 117.03 2o5j s ASP 246 Ca 0.00 -0.24 -0.33 0.00 0.71 0.00 0.00 52.55 52.69 2o5j s ASP 246 Cb 0.00 -1.27 -0.13 0.00 1.01 0.00 0.00 42.92 42.53 2o5j s ASP 246 CO 0.00 -0.32 1.66 -2.65 0.21 0.00 0.00 175.17 174.07 2o5j n PRO 247 N -1.49 2.49 0.25 8.23 -0.02 -1.26 -4.88 135.00 138.32 2o5j n PRO 247 Ca -0.03 0.90 0.07 0.00 -2.02 0.00 0.00 63.50 62.43 2o5j n PRO 247 Cb 0.58 -2.71 0.61 0.00 -0.02 0.00 0.00 33.50 31.96 2o5j n PRO 247 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2o5j h PRO 248 N 6.44 0.01 -5.33 0.52 0.11 -1.97 -3.40 132.00 128.38 2o5j h PRO 248 Ca -0.44 -0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.05 2o5j h PRO 248 Cb 1.23 -0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.20 2o5j h PRO 248 CO 0.93 0.05 -0.03 0.15 -0.21 0.00 0.00 178.00 178.89 2o5j s LYS 249 N -4.98 3.99 -0.43 1.05 1.02 -1.26 -4.85 119.74 114.28 2o5j s LYS 249 Ca -0.05 0.23 0.01 0.00 0.02 0.00 0.00 55.97 56.18 2o5j s LYS 249 Cb 0.17 -3.68 0.21 0.00 -0.52 0.00 0.00 37.83 34.01 2o5j s LYS 249 CO 0.68 -0.41 0.93 -2.13 -0.92 0.00 0.00 175.35 173.50 2o5j n ARG 250 N 5.58 0.36 0.00 1.68 0.63 -1.26 -5.12 116.66 118.53 2o5j n ARG 250 Ca -0.04 -1.41 0.00 0.00 -0.92 0.00 0.00 57.85 55.48 2o5j n ARG 250 Cb 0.50 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.66 2o5j n ARG 250 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2o5j n ASP 251 N 2.55 0.00 -1.47 6.15 8.00 -1.26 -3.40 116.55 127.12 2o5j n ASP 251 Ca 0.13 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.67 2o5j n ASP 251 Cb 0.61 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.73 2o5j n ASP 251 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2o5j n LYS 252 N -0.55 0.00 0.00 -1.24 4.01 -1.26 -4.99 118.16 114.13 2o5j n LYS 252 Ca 0.00 -1.95 0.00 0.00 -0.51 0.00 0.00 58.31 55.85 2o5j n LYS 252 Cb 0.00 0.02 0.00 0.00 -0.51 0.00 0.00 35.03 34.54 2o5j n LYS 252 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2o5j n ALA 253 N 0.47 -0.38 0.26 7.82 0.00 -1.22 -2.90 120.51 124.57 2o5j n ALA 253 Ca 0.04 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.64 2o5j n ALA 253 Cb 1.13 0.00 0.58 0.00 0.00 0.00 0.00 19.45 21.15 2o5j n ALA 253 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2o5j h VAL 254 N 0.00 0.09 0.00 0.00 2.07 -1.94 -2.45 116.25 114.01 2o5j h VAL 254 Ca 0.00 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2o5j h VAL 254 Cb 0.00 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2o5j h VAL 254 CO 0.00 0.04 0.00 0.00 0.02 0.00 0.00 177.57 177.63 2o5j h ALA 255 N 1.96 1.00 -0.03 1.67 0.00 -1.93 -2.89 119.26 119.05 2o5j h ALA 255 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2o5j h ALA 255 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2o5j h ALA 255 CO 0.00 0.00 -0.14 1.88 0.00 0.00 0.00 179.25 180.99 2o5j h TYR 256 N 0.00 0.19 -0.85 0.00 0.05 -1.30 -3.09 116.97 111.97 2o5j h TYR 256 Ca 0.00 -0.09 0.10 0.00 0.05 0.00 0.00 58.73 58.80 2o5j h TYR 256 Cb 0.42 -0.03 -0.06 0.00 1.01 0.00 0.00 36.73 38.07 2o5j h TYR 256 CO 0.00 0.79 0.55 0.28 -1.05 0.00 0.00 178.16 178.73 2o5j h VAL 257 N -0.46 0.94 -0.67 -2.88 2.07 -1.59 0.39 116.25 114.04 2o5j h VAL 257 Ca -0.01 -0.27 -0.15 0.00 0.82 0.00 0.00 66.70 67.09 2o5j h VAL 257 Cb 0.81 0.08 -0.09 0.00 -1.52 0.00 0.00 31.29 30.58 2o5j h VAL 257 CO 0.03 0.14 0.19 -1.22 0.02 0.00 0.00 177.57 176.73 2o5j n TYR 258 N -4.52 2.28 0.00 1.57 0.53 -1.23 -4.01 117.16 111.78 2o5j n TYR 258 Ca 0.15 -1.09 0.00 0.00 -1.02 0.00 0.00 57.90 55.94 2o5j n TYR 258 Cb 0.34 -0.63 0.00 0.00 -1.03 0.00 0.00 39.34 38.02 2o5j n TYR 258 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2o5j n GLY 259 N -0.01 0.25 0.25 2.72 0.00 0.12 -4.87 105.19 103.65 2o5j n GLY 259 Ca 0.37 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 2o5j n GLY 259 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2o5j n LEU 260 N -0.35 2.28 -0.01 0.99 -0.00 -0.44 -2.87 117.00 116.60 2o5j n LEU 260 Ca 0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 56.01 56.01 2o5j n LEU 260 Cb 0.00 -0.40 -0.00 0.00 -0.00 0.00 0.00 43.42 43.01 2o5j n LEU 260 CO 0.00 0.55 -0.08 -0.38 -0.00 0.00 0.00 177.39 177.48 2o5j n ILE 261 N -3.10 0.22 0.00 1.47 -0.00 -1.26 -4.79 119.36 111.89 2o5j n ILE 261 Ca -0.23 0.45 0.00 0.00 -0.00 0.00 0.00 62.75 62.98 2o5j n ILE 261 Cb 0.71 -1.63 0.00 0.00 -0.00 0.00 0.00 39.64 38.72 2o5j n ILE 261 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2o5j n ALA 262 N -2.68 0.00 -0.40 -1.39 0.00 -1.26 -4.57 120.51 110.21 2o5j n ALA 262 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.37 2o5j n ALA 262 Cb 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.49 2o5j n ALA 262 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2o5j h ASP 263 N 0.00 -1.76 -0.88 0.00 3.45 -1.76 -3.39 116.42 112.08 2o5j h ASP 263 Ca 0.00 0.32 0.00 0.00 0.43 0.00 0.00 57.03 57.78 2o5j h ASP 263 Cb 0.00 0.85 0.00 0.00 -0.56 0.00 0.00 39.33 39.62 2o5j h ASP 263 CO 0.00 -0.26 0.00 -2.65 -1.57 0.00 0.00 179.24 174.76 2o5j n PRO 264 N -5.37 -1.50 -4.31 3.56 -0.02 -1.26 -2.87 135.00 123.22 2o5j n PRO 264 Ca 0.06 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.31 2o5j n PRO 264 Cb 0.34 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.69 2o5j n PRO 264 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2o5j s ARG 265 N -2.56 1.10 -0.03 -0.52 3.52 -1.26 -4.57 118.95 114.64 2o5j s ARG 265 Ca 0.00 -1.09 0.04 0.00 -0.13 0.00 0.00 55.73 54.55 2o5j s ARG 265 Cb 0.00 -1.31 0.18 0.00 -1.56 0.00 0.00 34.95 32.26 2o5j s ARG 265 CO 0.00 0.31 0.91 0.54 -0.81 0.00 0.00 175.30 176.25 2o5j n ARG 266 N 1.23 1.72 -1.84 5.12 5.12 -1.26 -4.36 116.66 122.38 2o5j n ARG 266 Ca -0.19 -0.69 -0.42 0.00 -1.93 0.00 0.00 57.85 54.62 2o5j n ARG 266 Cb 0.54 -1.48 -0.03 0.00 -1.16 0.00 0.00 32.46 30.33 2o5j n ARG 266 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2o5j s TYR 267 N -1.54 2.61 0.00 -1.55 -0.00 -1.26 -4.74 117.35 110.87 2o5j s TYR 267 Ca 0.12 0.32 0.00 0.00 -0.00 0.00 0.00 57.07 57.52 2o5j s TYR 267 Cb 0.08 -4.04 0.00 0.00 -0.00 0.00 0.00 41.96 38.01 2o5j s TYR 267 CO 0.05 -4.06 0.00 -0.25 -0.00 0.00 0.00 175.55 171.29 2o5j n ASP 268 N 4.90 0.00 -4.61 -0.18 8.00 -1.26 -4.70 116.55 118.70 2o5j n ASP 268 Ca 0.16 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.23 2o5j n ASP 268 Cb 0.38 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.46 2o5j n ASP 268 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2o5j s LEU 269 N 0.00 3.63 0.00 0.64 0.20 -1.26 -3.17 118.68 118.71 2o5j s LEU 269 Ca 0.00 1.52 0.00 0.00 0.69 0.00 0.00 54.13 56.34 2o5j s LEU 269 Cb 0.00 -3.53 0.00 0.00 -0.43 0.00 0.00 46.19 42.23 2o5j s LEU 269 CO 0.00 -1.60 0.00 0.61 -0.29 0.00 0.00 176.35 175.07 2o5j n GLY 270 N 5.25 2.65 0.00 7.98 0.00 -1.26 -4.91 105.19 114.90 2o5j n GLY 270 Ca 0.23 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.68 2o5j n GLY 270 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2o5j n GLU 271 N 0.00 2.66 0.00 1.61 -0.58 -1.25 -4.11 120.64 118.97 2o5j n GLU 271 Ca 0.00 -0.03 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2o5j n GLU 271 Cb 0.00 -1.01 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 2o5j n GLU 271 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2o5j n ALA 272 N -1.44 -0.42 -0.13 0.62 0.00 -1.19 -3.99 120.51 113.96 2o5j n ALA 272 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2o5j n ALA 272 Cb 0.16 0.06 -0.12 0.00 0.00 0.00 0.00 19.45 19.55 2o5j n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o5j n GLY 273 N -0.98 -0.39 0.30 0.00 0.00 -1.26 -4.46 105.19 98.39 2o5j n GLY 273 Ca 0.00 -0.18 0.12 0.00 0.00 0.00 0.00 46.02 45.96 2o5j n GLY 273 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2o5j h ARG 274 N 0.00 0.00 0.09 1.61 1.12 -1.79 0.20 114.38 115.61 2o5j h ARG 274 Ca -0.57 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.29 2o5j h ARG 274 Cb 1.91 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.87 2o5j h ARG 274 CO -0.08 0.00 -0.04 -0.92 -3.11 0.00 0.00 179.97 175.81 2o5j h TYR 275 N 0.00 -0.11 0.00 2.20 3.20 -1.71 -1.99 116.97 118.55 2o5j h TYR 275 Ca 0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2o5j h TYR 275 Cb 0.81 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.12 2o5j h TYR 275 CO 0.00 0.33 0.00 1.63 -1.64 0.00 0.00 178.16 178.48 2o5j n LYS 276 N -4.92 0.14 0.00 1.82 5.02 0.04 -3.30 118.16 116.96 2o5j n LYS 276 Ca -0.09 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.77 2o5j n LYS 276 Cb 0.25 -1.88 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 2o5j n LYS 276 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2o5j n ALA 277 N -1.74 0.00 -0.25 7.82 0.00 -1.03 -3.47 120.51 121.83 2o5j n ALA 277 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.50 2o5j n ALA 277 Cb 0.08 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.67 2o5j n ALA 277 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2o5j n GLU 278 N -0.61 -0.06 -0.00 0.00 4.07 -0.78 0.01 120.64 123.28 2o5j n GLU 278 Ca 0.00 1.08 -0.09 0.00 -0.06 0.00 0.00 57.16 58.09 2o5j n GLU 278 Cb 0.00 -1.66 -0.07 0.00 -0.06 0.00 0.00 31.44 29.65 2o5j n GLU 278 CO 0.00 0.00 0.00 1.05 -0.06 0.00 0.00 177.13 178.12 2o5j h GLU 279 N 0.00 -0.11 0.18 5.31 -0.00 -1.80 -3.41 114.58 114.76 2o5j h GLU 279 Ca 0.37 0.01 -0.01 0.00 -0.00 0.00 0.00 59.36 59.73 2o5j h GLU 279 Cb 0.65 0.03 0.00 0.00 -0.00 0.00 0.00 28.75 29.43 2o5j h GLU 279 CO -0.70 0.37 -0.09 0.87 -0.00 0.00 0.00 179.01 179.46 2o5j h LYS 280 N -0.93 -0.24 -2.91 1.06 1.57 -1.29 -3.48 116.57 110.35 2o5j h LYS 280 Ca -0.01 0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 2o5j h LYS 280 Cb 0.53 0.05 -0.17 0.00 0.08 0.00 0.00 32.23 32.73 2o5j h LYS 280 CO 0.02 0.17 -0.07 -0.48 -0.57 0.00 0.00 179.45 178.52 2o5j s LEU 281 N -9.04 0.26 0.58 2.94 2.34 0.10 -5.05 118.68 110.81 2o5j s LEU 281 Ca -0.12 0.09 0.00 0.00 0.06 0.00 0.00 54.13 54.15 2o5j s LEU 281 Cb 0.01 1.84 0.00 0.00 -0.56 0.00 0.00 46.19 47.48 2o5j s LEU 281 CO 0.47 -0.66 0.00 0.61 -1.06 0.00 0.00 176.35 175.71 2o5j n GLY 282 N 0.56 -3.78 0.16 -3.48 0.00 -1.26 -3.80 105.19 93.58 2o5j n GLY 282 Ca -0.19 -0.94 -0.24 0.00 0.00 0.00 0.00 46.02 44.65 2o5j n GLY 282 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2o5j n ILE 283 N -3.20 1.44 -4.45 -0.61 5.41 -1.26 -3.58 119.36 113.11 2o5j n ILE 283 Ca -0.03 -0.44 -0.23 0.00 1.00 0.00 0.00 62.75 63.05 2o5j n ILE 283 Cb 0.54 -1.67 -0.10 0.00 -0.71 0.00 0.00 39.64 37.69 2o5j n ILE 283 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 2o5j s ARG 284 N -2.49 1.61 -0.16 0.38 6.06 -1.26 -4.50 118.95 118.59 2o5j s ARG 284 Ca -0.36 -1.78 -0.03 0.00 -2.50 0.00 0.00 55.73 51.07 2o5j s ARG 284 Cb 0.12 -1.48 0.05 0.00 0.06 0.00 0.00 34.95 33.70 2o5j s ARG 284 CO 0.51 0.19 0.04 -0.48 -2.50 0.00 0.00 175.30 173.05 2o5j s LEU 285 N -3.48 0.95 -0.44 -0.88 2.34 -1.26 -4.55 118.68 111.35 2o5j s LEU 285 Ca 0.29 -0.64 -0.16 0.00 0.06 0.00 0.00 54.13 53.69 2o5j s LEU 285 Cb -0.00 -0.52 0.04 0.00 -0.56 0.00 0.00 46.19 45.15 2o5j s LEU 285 CO 0.13 -0.29 0.38 -0.55 -1.06 0.00 0.00 176.35 174.96 2o5j s SER 286 N 1.92 6.14 0.00 1.48 0.15 -1.26 -4.81 113.70 117.32 2o5j s SER 286 Ca 0.01 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 55.61 2o5j s SER 286 Cb -0.16 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2o5j s SER 286 CO -0.07 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.40 2o5j n GLY 287 N 5.17 -1.63 0.00 9.45 0.00 -1.26 -3.77 105.19 113.15 2o5j n GLY 287 Ca -0.11 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2o5j n GLY 287 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j n ARG 288 N 0.86 0.00 -2.91 1.61 1.74 -1.26 -4.20 116.66 112.50 2o5j n ARG 288 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 2o5j n ARG 288 Cb 0.00 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.49 2o5j n ARG 288 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2o5j s THR 289 N -0.07 2.50 -0.61 0.55 -4.23 -1.26 -4.87 115.64 107.64 2o5j s THR 289 Ca 0.00 -0.90 -0.11 0.00 -1.18 0.00 0.00 61.69 59.50 2o5j s THR 289 Cb 0.00 -2.60 -0.17 0.00 1.34 0.00 0.00 72.50 71.07 2o5j s THR 289 CO 0.00 0.00 1.75 0.00 -0.54 0.00 0.00 174.62 175.83 2o5j n LEU 290 N -2.21 -0.82 -4.19 4.79 -0.00 -1.26 -4.82 117.00 108.49 2o5j n LEU 290 Ca 0.12 -1.28 -0.24 0.00 -0.00 0.00 0.00 56.01 54.61 2o5j n LEU 290 Cb 0.60 -0.89 -0.14 0.00 -0.00 0.00 0.00 43.42 42.99 2o5j n LEU 290 CO 0.41 -2.00 -0.50 0.00 -0.00 0.00 0.00 177.39 175.30 2o5j s ALA 291 N 4.60 1.50 0.00 1.47 0.00 -1.14 -4.04 121.76 124.15 2o5j s ALA 291 Ca 0.70 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.76 2o5j s ALA 291 Cb -0.32 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.50 2o5j s ALA 291 CO 0.24 0.33 0.00 -2.13 0.00 0.00 0.00 175.76 174.20 2o5j n ARG 292 N 2.08 0.00 -1.49 0.00 0.63 -1.26 -4.64 116.66 111.98 2o5j n ARG 292 Ca -0.17 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.71 2o5j n ARG 292 Cb 0.54 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.44 2o5j n ARG 292 CO 0.00 0.00 0.00 1.97 -2.51 0.00 0.00 177.63 177.09 2o5j n PHE 293 N -0.09 -0.50 -0.00 -0.14 -1.74 -1.26 -4.67 117.46 109.07 2o5j n PHE 293 Ca 0.00 -0.84 -0.21 0.00 -0.56 0.00 0.00 57.45 55.84 2o5j n PHE 293 Cb 0.00 0.72 -0.14 0.00 1.52 0.00 0.00 39.48 41.58 2o5j n PHE 293 CO 0.00 0.00 0.00 -1.91 -0.56 0.00 0.00 176.76 174.29 2o5j n GLU 294 N -0.38 0.75 0.00 3.97 0.00 -1.26 -4.57 120.64 119.16 2o5j n GLU 294 Ca -0.23 0.26 0.01 0.00 0.00 0.00 0.00 57.16 57.20 2o5j n GLU 294 Cb 0.77 -1.70 -0.00 0.00 0.00 0.00 0.00 31.44 30.51 2o5j n GLU 294 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2o5j n ASP 295 N -3.46 0.65 0.00 4.31 10.43 -1.26 -4.97 116.55 122.26 2o5j n ASP 295 Ca -0.32 -0.83 0.00 0.00 2.57 0.00 0.00 54.79 56.21 2o5j n ASP 295 Cb 1.05 0.51 0.00 0.00 1.84 0.00 0.00 41.12 44.51 2o5j n ASP 295 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2o5j n GLY 296 N 0.60 3.05 3.60 0.44 0.00 -1.26 -4.98 105.19 106.63 2o5j n GLY 296 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 2o5j n GLY 296 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5j s GLU 297 N -0.28 3.90 0.43 1.61 0.41 -1.26 -4.94 118.70 118.57 2o5j s GLU 297 Ca 0.00 0.27 -0.07 0.00 -0.41 0.00 0.00 54.97 54.76 2o5j s GLU 297 Cb 0.00 -3.72 -0.05 0.00 -1.78 0.00 0.00 34.13 28.58 2o5j s GLU 297 CO 0.00 -0.55 0.75 -0.06 -0.49 0.00 0.00 175.26 174.91 2o5j s PHE 298 N 2.56 3.52 -0.10 1.61 0.40 -1.26 -4.82 117.98 119.89 2o5j s PHE 298 Ca 0.24 0.86 0.03 0.00 -0.60 0.00 0.00 56.93 57.46 2o5j s PHE 298 Cb -0.15 -2.32 0.01 0.00 0.51 0.00 0.00 43.02 41.07 2o5j s PHE 298 CO 0.12 -0.17 -0.21 -1.59 0.70 0.00 0.00 175.22 174.07 2o5j s LYS 299 N -4.32 2.70 -0.41 0.44 -2.85 -1.26 -4.80 119.74 109.23 2o5j s LYS 299 Ca 0.48 -0.75 0.02 0.00 -1.00 0.00 0.00 55.97 54.72 2o5j s LYS 299 Cb -0.10 -2.10 0.13 0.00 -2.06 0.00 0.00 37.83 33.69 2o5j s LYS 299 CO 0.39 0.10 0.21 0.16 0.10 0.00 0.00 175.35 176.30 2o5j s ASP 300 N 0.54 3.76 0.00 0.03 -4.77 -1.26 -4.25 116.67 110.71 2o5j s ASP 300 Ca -0.15 -2.44 0.18 0.00 -3.30 0.00 0.00 52.55 46.84 2o5j s ASP 300 Cb -0.17 -1.03 0.80 0.00 -1.09 0.00 0.00 42.92 41.43 2o5j s ASP 300 CO 0.05 -0.30 1.55 -0.62 0.70 0.00 0.00 175.17 176.56 2o5j n GLU 301 N 3.79 1.42 -0.06 2.11 1.02 -1.26 -3.86 120.64 123.80 2o5j n GLU 301 Ca 0.07 -0.63 -0.07 0.00 -0.02 0.00 0.00 57.16 56.50 2o5j n GLU 301 Cb 0.36 -1.32 -0.08 0.00 -0.02 0.00 0.00 31.44 30.38 2o5j n GLU 301 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2o5j n VAL 302 N -0.13 0.77 0.09 2.62 3.14 -1.26 -4.43 118.33 119.13 2o5j n VAL 302 Ca 0.14 -0.39 -0.03 0.00 -2.96 0.00 0.00 64.34 61.10 2o5j n VAL 302 Cb 0.21 -0.84 0.19 0.00 -1.06 0.00 0.00 33.84 32.34 2o5j n VAL 302 CO 0.00 0.00 0.00 0.15 -6.46 0.00 0.00 176.83 170.52 2o5j h PHE 303 N 0.00 0.29 0.12 1.45 3.57 -1.99 -2.94 116.94 117.44 2o5j h PHE 303 Ca -0.30 -0.09 -0.30 0.00 3.53 0.00 0.00 57.97 60.82 2o5j h PHE 303 Cb 1.58 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 40.26 2o5j h PHE 303 CO 0.01 0.66 -1.43 1.25 -2.23 0.00 0.00 178.31 176.57 2o5j h LEU 304 N 0.19 0.40 -1.68 0.59 6.46 -1.84 -3.34 115.31 116.10 2o5j h LEU 304 Ca 0.01 -0.51 -0.04 0.00 -0.12 0.00 0.00 57.88 57.23 2o5j h LEU 304 Cb 0.90 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.69 2o5j h LEU 304 CO 0.07 1.41 -0.18 -0.65 -0.62 0.00 0.00 178.44 178.48 2o5j h PRO 305 N 0.07 0.00 -0.38 5.25 0.11 -1.76 0.89 132.00 136.18 2o5j h PRO 305 Ca -0.21 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.86 2o5j h PRO 305 Cb 2.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 33.10 2o5j h PRO 305 CO 0.18 0.18 0.06 0.00 -0.21 0.00 0.00 178.00 178.20 2o5j h THR 306 N 0.00 1.24 0.00 -1.15 1.03 -1.63 -1.26 112.91 111.14 2o5j h THR 306 Ca -0.00 -0.86 -0.07 0.00 -0.01 0.00 0.00 66.41 65.47 2o5j h THR 306 Cb 0.33 1.06 -0.01 0.00 -1.07 0.00 0.00 68.15 68.46 2o5j h THR 306 CO 0.02 0.29 -0.33 0.25 -0.01 0.00 0.00 175.52 175.75 2o5j h LEU 307 N 0.48 0.00 -0.95 0.00 5.85 -1.66 -2.03 115.31 117.00 2o5j h LEU 307 Ca 0.12 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 2o5j h LEU 307 Cb 0.37 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2o5j h LEU 307 CO 0.01 0.33 -0.27 -0.09 -0.34 0.00 0.00 178.44 178.08 2o5j h ARG 308 N 0.00 0.45 0.00 1.25 2.43 -0.56 0.14 114.38 118.09 2o5j h ARG 308 Ca -0.00 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2o5j h ARG 308 Cb 1.19 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2o5j h ARG 308 CO 0.04 0.68 -0.61 0.98 -1.51 0.00 0.00 179.97 179.55 2o5j n TYR 309 N -4.11 0.22 0.00 2.20 9.36 -0.50 -2.05 117.16 122.28 2o5j n TYR 309 Ca -0.01 0.07 -0.18 0.00 3.32 0.00 0.00 57.90 61.10 2o5j n TYR 309 Cb 0.41 -0.41 -0.10 0.00 -0.63 0.00 0.00 39.34 38.61 2o5j n TYR 309 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2o5j h LEU 310 N 0.00 0.69 -1.21 2.98 5.85 -0.76 0.55 115.31 123.41 2o5j h LEU 310 Ca 0.00 -0.71 -0.07 0.00 0.84 0.00 0.00 57.88 57.94 2o5j h LEU 310 Cb 0.61 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2o5j h LEU 310 CO 0.00 1.31 -0.21 -0.26 -0.34 0.00 0.00 178.44 178.94 2o5j h PHE 311 N 0.14 0.31 0.17 1.25 0.05 -0.81 -2.00 116.94 116.04 2o5j h PHE 311 Ca -0.08 -0.05 -0.31 0.00 3.82 0.00 0.00 57.97 61.36 2o5j h PHE 311 Cb 1.38 -0.08 0.01 0.00 2.00 0.00 0.00 35.95 39.26 2o5j h PHE 311 CO 0.12 0.49 -1.41 0.00 -0.18 0.00 0.00 178.31 177.32 2o5j h ALA 312 N 1.52 0.06 -0.12 2.45 0.00 -1.37 -2.94 119.26 118.86 2o5j h ALA 312 Ca 0.05 -0.95 -0.15 0.00 0.00 0.00 0.00 54.91 53.85 2o5j h ALA 312 Cb 0.53 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2o5j h ALA 312 CO 0.04 0.94 -0.58 1.25 0.00 0.00 0.00 179.25 180.89 2o5j h LEU 313 N 0.10 0.45 0.00 0.00 5.85 0.19 -3.06 115.31 118.84 2o5j h LEU 313 Ca -0.21 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2o5j h LEU 313 Cb 2.05 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.95 2o5j h LEU 313 CO 0.21 0.93 -0.26 0.35 -0.34 0.00 0.00 178.44 179.34 2o5j n THR 314 N -3.92 0.18 -0.09 1.05 -2.24 -0.76 -4.42 114.28 104.09 2o5j n THR 314 Ca -0.03 -0.11 -0.16 0.00 -2.27 0.00 0.00 64.05 61.49 2o5j n THR 314 Cb 0.61 -0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 2o5j n THR 314 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2o5j n ALA 315 N -1.62 1.70 -2.14 6.98 0.00 -1.11 -4.97 120.51 119.35 2o5j n ALA 315 Ca 0.06 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2o5j n ALA 315 Cb 0.38 0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2o5j n ALA 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o5j n GLY 316 N 2.30 2.88 2.74 0.00 0.00 -1.16 -5.08 105.19 106.86 2o5j n GLY 316 Ca -0.33 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 2o5j n GLY 316 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2o5j n VAL 317 N 0.00 3.74 0.27 1.61 0.31 -1.26 -4.75 118.33 118.25 2o5j n VAL 317 Ca 0.00 -5.60 0.13 0.00 -0.01 0.00 0.00 64.34 58.85 2o5j n VAL 317 Cb 0.00 -1.74 0.74 0.00 -0.91 0.00 0.00 33.84 31.93 2o5j n VAL 317 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2o5j h PRO 318 N 3.93 0.00 -1.36 5.55 0.11 -1.98 -3.45 132.00 134.79 2o5j h PRO 318 Ca 0.23 0.00 0.39 0.00 0.11 0.00 0.00 66.00 66.73 2o5j h PRO 318 Cb 0.53 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 31.53 2o5j h PRO 318 CO 0.97 0.11 0.97 0.20 -0.21 0.00 0.00 178.00 180.03 2o5j s GLY 319 N -4.18 -0.41 -0.54 -0.55 0.00 -1.26 -5.11 107.32 95.26 2o5j s GLY 319 Ca -0.03 0.69 -0.18 0.00 0.00 0.00 0.00 44.72 45.20 2o5j s GLY 319 CO 0.59 2.03 0.59 0.30 0.00 0.00 0.00 173.10 176.61 2o5j s HIS 320 N -2.07 3.10 -1.30 1.90 0.09 -1.26 -4.97 115.29 110.79 2o5j s HIS 320 Ca 0.20 -0.95 -0.08 0.00 -0.00 0.00 0.00 55.06 54.23 2o5j s HIS 320 Cb 0.05 -3.74 0.15 0.00 -0.00 0.00 0.00 32.58 29.04 2o5j s HIS 320 CO -0.05 -1.10 2.04 -0.85 -0.00 0.00 0.00 174.74 174.78 2o5j n GLU 321 N 5.87 3.89 -3.96 1.40 0.00 -1.26 -4.85 120.64 121.73 2o5j n GLU 321 Ca -0.10 -3.47 -0.30 0.00 0.00 0.00 0.00 57.16 53.28 2o5j n GLU 321 Cb 0.43 -2.84 -0.16 0.00 0.00 0.00 0.00 31.44 28.87 2o5j n GLU 321 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2o5j s VAL 322 N 0.01 1.61 -0.26 3.84 -7.23 -1.26 -4.82 120.40 112.28 2o5j s VAL 322 Ca 0.44 -1.24 -0.16 0.00 -1.81 0.00 0.00 61.98 59.21 2o5j s VAL 322 Cb 0.12 -1.84 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 2o5j s VAL 322 CO -0.02 -0.07 0.40 -1.81 -0.31 0.00 0.00 175.10 173.29 2o5j s ASP 323 N 1.36 6.31 -0.98 4.85 1.01 -1.26 -5.00 116.67 122.97 2o5j s ASP 323 Ca -0.06 0.37 -0.24 0.00 0.71 0.00 0.00 52.55 53.33 2o5j s ASP 323 Cb -0.19 -2.23 0.04 0.00 1.01 0.00 0.00 42.92 41.56 2o5j s ASP 323 CO -0.06 -0.19 1.47 -1.81 0.21 0.00 0.00 175.17 174.79 2o5j s ASP 324 N 1.54 6.36 0.04 0.27 1.01 -1.26 -4.89 116.67 119.74 2o5j s ASP 324 Ca 0.17 -1.27 -0.07 0.00 0.71 0.00 0.00 52.55 52.08 2o5j s ASP 324 Cb -0.16 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.19 2o5j s ASP 324 CO 0.09 -1.64 0.64 -0.38 0.21 0.00 0.00 175.17 174.10 2o5j n ILE 325 N 6.90 -0.16 0.31 0.77 5.41 -1.26 0.88 119.36 132.22 2o5j n ILE 325 Ca 0.30 0.98 0.15 0.00 1.00 0.00 0.00 62.75 65.18 2o5j n ILE 325 Cb 0.51 -1.26 0.74 0.00 -0.71 0.00 0.00 39.64 38.92 2o5j n ILE 325 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2o5j h ASP 326 N 0.00 0.00 -2.04 4.38 3.32 -1.90 -3.32 116.42 116.86 2o5j h ASP 326 Ca 0.04 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 56.47 2o5j h ASP 326 Cb 0.10 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.68 2o5j h ASP 326 CO -0.22 0.00 0.90 1.41 -1.72 0.00 0.00 179.24 179.61 2o5j n HIS 327 N -2.95 2.20 0.37 4.55 8.25 0.26 -4.49 115.22 123.41 2o5j n HIS 327 Ca -0.01 0.22 0.03 0.00 -0.26 0.00 0.00 57.72 57.70 2o5j n HIS 327 Cb 0.47 -2.56 0.18 0.00 1.12 0.00 0.00 29.99 29.19 2o5j n HIS 327 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2o5j n LEU 328 N 4.85 0.00 -0.06 2.41 7.94 -1.26 -0.76 117.00 130.12 2o5j n LEU 328 Ca 0.20 0.09 0.05 0.00 -1.11 0.00 0.00 56.01 55.24 2o5j n LEU 328 Cb 0.27 -0.09 0.27 0.00 0.53 0.00 0.00 43.42 44.40 2o5j n LEU 328 CO 0.69 -0.07 0.67 0.61 -1.11 0.00 0.00 177.39 178.19 2o5j n GLY 329 N -0.64 -0.85 1.41 -3.96 0.00 -1.26 -4.17 105.19 95.71 2o5j n GLY 329 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2o5j n GLY 329 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2o5j n ASN 330 N -0.53 0.59 -4.68 1.61 4.05 0.06 -4.58 115.26 111.78 2o5j n ASN 330 Ca 0.07 0.27 -0.43 0.00 0.45 0.00 0.00 54.58 54.94 2o5j n ASN 330 Cb 0.06 -0.05 -0.02 0.00 1.23 0.00 0.00 39.78 41.00 2o5j n ASN 330 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2o5j s ARG 331 N -2.00 4.35 0.25 1.20 0.52 -1.23 -2.63 118.95 119.42 2o5j s ARG 331 Ca 0.00 1.46 -0.04 0.00 -0.52 0.00 0.00 55.73 56.62 2o5j s ARG 331 Cb 0.00 -3.59 -0.05 0.00 0.52 0.00 0.00 34.95 31.83 2o5j s ARG 331 CO 0.00 -0.46 0.50 0.50 0.02 0.00 0.00 175.30 175.86 2o5j s ARG 332 N 2.50 3.61 -0.24 3.54 3.52 0.47 -4.76 118.95 127.59 2o5j s ARG 332 Ca 0.49 -0.08 -0.05 0.00 -0.13 0.00 0.00 55.73 55.97 2o5j s ARG 332 Cb -0.19 -2.71 -0.01 0.00 -1.56 0.00 0.00 34.95 30.48 2o5j s ARG 332 CO 0.15 0.29 -0.00 0.42 -0.81 0.00 0.00 175.30 175.34 2o5j s ILE 333 N -1.98 3.61 -0.61 4.11 1.09 -0.84 0.19 121.20 126.76 2o5j s ILE 333 Ca 0.42 -0.48 -0.26 0.00 -1.10 0.00 0.00 60.65 59.24 2o5j s ILE 333 Cb -0.11 -2.69 0.04 0.00 -1.06 0.00 0.00 42.46 38.64 2o5j s ILE 333 CO 0.29 0.35 1.08 -0.13 -0.10 0.00 0.00 174.94 176.42 2o5j s ARG 334 N 1.50 3.32 0.82 2.79 0.52 0.47 -4.32 118.95 124.05 2o5j s ARG 334 Ca 0.05 -0.21 -0.11 0.00 -0.52 0.00 0.00 55.73 54.95 2o5j s ARG 334 Cb -0.15 -4.09 0.09 0.00 0.52 0.00 0.00 34.95 31.32 2o5j s ARG 334 CO -0.01 -1.71 1.11 0.95 0.02 0.00 0.00 175.30 175.66 2o5j s THR 335 N 4.57 2.85 0.09 0.02 -4.23 -1.26 -2.03 115.64 115.65 2o5j s THR 335 Ca 0.33 0.28 -0.18 0.00 -1.18 0.00 0.00 61.69 60.94 2o5j s THR 335 Cb -0.11 -2.61 -0.05 0.00 1.34 0.00 0.00 72.50 71.08 2o5j s THR 335 CO 0.19 -0.36 1.31 0.58 -0.54 0.00 0.00 174.62 175.80 2o5j h VAL 336 N -1.35 0.00 -0.26 2.29 2.07 -1.87 -2.69 116.25 114.44 2o5j h VAL 336 Ca -0.43 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.11 2o5j h VAL 336 Cb 1.25 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2o5j h VAL 336 CO 0.48 0.00 -0.15 0.61 0.02 0.00 0.00 177.57 178.52 2o5j n GLY 337 N -1.17 -2.13 0.31 2.17 0.00 -1.26 0.70 105.19 103.81 2o5j n GLY 337 Ca 0.00 0.58 0.10 0.00 0.00 0.00 0.00 46.02 46.71 2o5j n GLY 337 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2o5j h GLU 338 N 0.00 0.11 0.00 1.61 4.81 -1.85 0.98 114.58 120.23 2o5j h GLU 338 Ca 0.04 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 2o5j h GLU 338 Cb 0.11 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2o5j h GLU 338 CO -0.24 0.07 -0.30 -0.07 -0.73 0.00 0.00 179.01 177.73 2o5j h LEU 339 N 0.11 0.00 0.11 1.64 3.38 0.59 0.16 115.31 121.30 2o5j h LEU 339 Ca 0.51 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 58.17 2o5j h LEU 339 Cb 1.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 2o5j h LEU 339 CO -0.74 0.30 -1.60 -0.03 0.09 0.00 0.00 178.44 176.46 2o5j h MET 340 N 0.00 0.23 -0.44 1.13 4.05 0.21 -3.26 114.93 116.85 2o5j h MET 340 Ca -0.00 -0.40 -0.05 0.00 -0.28 0.00 0.00 59.70 58.97 2o5j h MET 340 Cb 0.56 0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 31.49 2o5j h MET 340 CO 0.04 1.08 0.08 0.00 0.23 0.00 0.00 176.91 178.34 2o5j h THR 341 N 0.06 1.21 0.03 -0.77 1.03 0.97 0.13 112.91 115.56 2o5j h THR 341 Ca -0.27 -0.76 -0.00 0.00 -0.01 0.00 0.00 66.41 65.37 2o5j h THR 341 Cb 2.02 0.78 0.00 0.00 -1.07 0.00 0.00 68.15 69.88 2o5j h THR 341 CO 0.15 0.28 -0.01 -0.78 -0.01 0.00 0.00 175.52 175.14 2o5j h ASP 342 N 0.65 -0.03 0.05 0.00 1.82 -1.07 0.11 116.42 117.95 2o5j h ASP 342 Ca 0.14 -0.10 -0.05 0.00 -0.39 0.00 0.00 57.03 56.63 2o5j h ASP 342 Cb 0.29 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.29 2o5j h ASP 342 CO 0.00 0.08 -0.15 -0.61 -1.61 0.00 0.00 179.24 176.96 2o5j h GLN 343 N -0.14 0.21 -0.67 0.28 5.75 -1.52 0.12 115.11 119.13 2o5j h GLN 343 Ca -0.00 -0.05 -0.06 0.00 -0.15 0.00 0.00 58.65 58.38 2o5j h GLN 343 Cb 0.13 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.62 2o5j h GLN 343 CO 0.01 0.37 0.18 0.35 -2.65 0.00 0.00 178.83 177.08 2o5j h PHE 344 N 0.20 1.10 0.00 3.99 3.04 -0.15 -0.90 116.94 124.22 2o5j h PHE 344 Ca 0.04 -0.12 -0.10 0.00 3.98 0.00 0.00 57.97 61.78 2o5j h PHE 344 Cb 0.40 -0.32 -0.01 0.00 2.56 0.00 0.00 35.95 38.58 2o5j h PHE 344 CO 0.01 0.89 -0.46 0.07 -2.02 0.00 0.00 178.31 176.80 2o5j h ARG 345 N 1.01 0.00 -0.13 1.11 0.11 0.19 -1.36 114.38 115.31 2o5j h ARG 345 Ca 0.22 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.18 2o5j h ARG 345 Cb 0.33 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.40 2o5j h ARG 345 CO -0.00 0.46 -0.43 0.28 0.10 0.00 0.00 179.97 180.38 2o5j h VAL 346 N 0.00 1.32 -0.01 0.08 2.07 -0.46 -2.21 116.25 117.04 2o5j h VAL 346 Ca -0.00 -1.58 -0.22 0.00 0.82 0.00 0.00 66.70 65.72 2o5j h VAL 346 Cb 1.21 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 2o5j h VAL 346 CO 0.06 0.47 -0.92 1.23 0.02 0.00 0.00 177.57 178.43 2o5j h GLY 347 N 1.22 0.45 1.18 2.17 0.00 -0.94 -2.91 103.07 104.24 2o5j h GLY 347 Ca 0.02 -0.78 -0.05 0.00 0.00 0.00 0.00 47.33 46.51 2o5j h GLY 347 CO 0.07 0.69 0.20 -2.00 0.00 0.00 0.00 176.54 175.50 2o5j h LEU 348 N 0.23 0.96 -0.50 3.11 5.85 -1.11 -1.48 115.31 122.38 2o5j h LEU 348 Ca -0.07 -0.17 -0.07 0.00 0.84 0.00 0.00 57.88 58.40 2o5j h LEU 348 Cb 1.55 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 2o5j h LEU 348 CO 0.16 0.90 0.03 0.00 -0.34 0.00 0.00 178.44 179.19 2o5j h ALA 349 N 1.22 0.66 -0.16 1.25 0.00 -1.41 -0.33 119.26 120.49 2o5j h ALA 349 Ca 0.22 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2o5j h ALA 349 Cb 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2o5j h ALA 349 CO -0.01 0.44 -0.02 0.00 0.00 0.00 0.00 179.25 179.66 2o5j h ARG 350 N 0.72 0.24 0.05 0.00 2.47 -1.28 0.61 114.38 117.18 2o5j h ARG 350 Ca 0.14 -0.04 -0.10 0.00 -1.26 0.00 0.00 59.98 58.73 2o5j h ARG 350 Cb 0.47 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.76 2o5j h ARG 350 CO 0.02 0.28 -0.43 1.25 0.56 0.00 0.00 179.97 181.65 2o5j h LEU 351 N 0.23 0.30 -2.30 3.04 5.85 -1.04 -3.22 115.31 118.16 2o5j h LEU 351 Ca 0.05 -0.88 -0.01 0.00 0.84 0.00 0.00 57.88 57.88 2o5j h LEU 351 Cb 0.20 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 2o5j h LEU 351 CO 0.01 1.15 -0.04 0.00 -0.34 0.00 0.00 178.44 179.22 2o5j h ALA 352 N 0.15 1.19 0.37 1.25 0.00 -0.82 -0.44 119.26 120.96 2o5j h ALA 352 Ca -0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2o5j h ALA 352 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2o5j h ALA 352 CO 0.08 0.05 -0.18 -0.09 0.00 0.00 0.00 179.25 179.12 2o5j h ARG 353 N 0.00 -0.48 -0.00 0.00 2.43 -0.91 -2.98 114.38 112.43 2o5j h ARG 353 Ca -0.00 0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.07 2o5j h ARG 353 Cb 0.19 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 2o5j h ARG 353 CO 0.01 -0.17 -0.63 0.78 -1.51 0.00 0.00 179.97 178.44 2o5j h GLY 354 N -0.81 0.01 1.17 2.80 0.00 -1.49 -3.19 103.07 101.56 2o5j h GLY 354 Ca -0.05 -0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 2o5j h GLY 354 CO 0.08 0.02 0.02 -0.24 0.00 0.00 0.00 176.54 176.42 2o5j h VAL 355 N 0.01 1.26 -0.46 4.60 3.04 -1.15 -2.83 116.25 120.72 2o5j h VAL 355 Ca -0.01 -1.09 0.03 0.00 -1.01 0.00 0.00 66.70 64.62 2o5j h VAL 355 Cb 1.12 0.79 -0.02 0.00 -2.01 0.00 0.00 31.29 31.16 2o5j h VAL 355 CO 0.08 0.40 0.31 -0.09 -1.01 0.00 0.00 177.57 177.26 2o5j h ARG 356 N 0.92 0.49 0.00 4.17 2.43 -1.51 -0.38 114.38 120.51 2o5j h ARG 356 Ca 0.17 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 2o5j h ARG 356 Cb 0.51 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2o5j h ARG 356 CO 0.02 0.33 -0.34 0.93 -1.51 0.00 0.00 179.97 179.40 2o5j h GLU 357 N 0.51 0.00 -0.00 0.20 5.08 -1.58 -2.88 114.58 115.91 2o5j h GLU 357 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2o5j h GLU 357 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2o5j h GLU 357 CO -0.05 0.34 -0.42 0.54 -1.00 0.00 0.00 179.01 178.43 2o5j n ARG 358 N -3.76 0.13 0.23 2.33 1.74 -0.20 -3.05 116.66 114.09 2o5j n ARG 358 Ca -0.01 -0.07 0.10 0.00 -0.77 0.00 0.00 57.85 57.10 2o5j n ARG 358 Cb 0.43 -1.50 0.54 0.00 -1.02 0.00 0.00 32.46 30.91 2o5j n ARG 358 CO 0.00 0.00 0.00 1.98 -1.52 0.00 0.00 177.63 178.09 2o5j h MET 359 N 0.18 0.00 0.00 5.56 4.05 -1.20 -2.60 114.93 120.92 2o5j h MET 359 Ca 0.00 0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.26 2o5j h MET 359 Cb 0.50 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.27 2o5j h MET 359 CO 0.00 0.20 -1.94 1.28 0.23 0.00 0.00 176.91 176.68 2o5j n LEU 360 N -3.49 0.24 -0.01 3.39 4.77 -1.22 -4.46 117.00 116.21 2o5j n LEU 360 Ca -0.01 0.10 -0.16 0.00 -0.03 0.00 0.00 56.01 55.91 2o5j n LEU 360 Cb 0.37 0.17 -0.11 0.00 -2.33 0.00 0.00 43.42 41.53 2o5j n LEU 360 CO 0.32 0.18 0.32 0.00 -1.33 0.00 0.00 177.39 176.89 2o5j h MET 361 N 0.00 0.35 -6.37 3.23 -0.00 -1.45 -3.45 114.93 107.25 2o5j h MET 361 Ca -0.21 -0.36 -0.56 0.00 -0.00 0.00 0.00 59.70 58.57 2o5j h MET 361 Cb 1.53 0.09 0.03 0.00 -0.00 0.00 0.00 31.60 33.25 2o5j h MET 361 CO 0.02 1.03 1.14 0.41 -0.00 0.00 0.00 176.91 179.51 2o5j n GLY 362 N 0.98 1.66 0.00 -3.00 0.00 -0.99 -4.94 105.19 98.90 2o5j n GLY 362 Ca -0.10 0.80 0.00 0.00 0.00 0.00 0.00 46.02 46.73 2o5j n GLY 362 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2o5j n SER 363 N 6.63 0.00 0.00 1.61 3.41 -1.26 -4.90 113.62 119.11 2o5j n SER 363 Ca 0.20 0.37 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 2o5j n SER 363 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 2o5j n SER 363 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2o5j n GLU 364 N -0.57 3.56 -0.33 4.33 -0.58 -1.26 -5.04 120.64 120.75 2o5j n GLU 364 Ca 0.00 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.86 2o5j n GLU 364 Cb 0.00 0.00 0.30 0.00 -0.57 0.00 0.00 31.44 31.17 2o5j n GLU 364 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2o5j h ASP 365 N 0.00 0.67 -0.62 1.62 1.82 -2.02 -3.37 116.42 114.51 2o5j h ASP 365 Ca 0.00 0.11 -0.33 0.00 -0.39 0.00 0.00 57.03 56.41 2o5j h ASP 365 Cb 0.00 -0.01 -0.05 0.00 0.68 0.00 0.00 39.33 39.96 2o5j h ASP 365 CO 0.00 0.22 0.95 -0.44 -1.61 0.00 0.00 179.24 178.36 2o5j s SER 366 N -5.37 5.19 0.00 2.28 0.01 -1.26 -4.39 113.70 110.15 2o5j s SER 366 Ca -0.11 -1.19 0.00 0.00 1.31 0.00 0.00 55.95 55.95 2o5j s SER 366 Cb 0.24 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.90 2o5j s SER 366 CO 0.79 -2.81 0.77 0.00 0.41 0.00 0.00 173.24 172.40 2o5j n LEU 367 N 13.83 0.00 0.16 2.44 -0.00 -1.26 -4.93 117.00 127.24 2o5j n LEU 367 Ca 0.42 -0.79 -0.07 0.00 -0.00 0.00 0.00 56.01 55.58 2o5j n LEU 367 Cb 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.86 2o5j n LEU 367 CO 0.64 0.34 0.25 0.74 -0.00 0.00 0.00 177.39 179.36 2o5j h THR 368 N 5.71 0.00 0.00 1.47 2.02 -1.92 -3.08 112.91 117.11 2o5j h THR 368 Ca 0.00 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.83 2o5j h THR 368 Cb 1.24 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2o5j h THR 368 CO 0.00 0.00 0.00 -0.81 0.37 0.00 0.00 175.52 175.08 2o5j n PRO 369 N -4.18 0.00 0.26 6.66 -0.04 -1.26 -3.64 135.00 132.80 2o5j n PRO 369 Ca -0.06 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.53 2o5j n PRO 369 Cb 0.18 0.00 0.69 0.00 -0.04 0.00 0.00 33.50 34.33 2o5j n PRO 369 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2o5j h ALA 370 N -2.36 1.26 0.00 0.55 0.00 -1.85 -2.36 119.26 114.50 2o5j h ALA 370 Ca 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2o5j h ALA 370 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2o5j h ALA 370 CO 0.00 0.17 -0.38 -0.22 0.00 0.00 0.00 179.25 178.82 2o5j h LYS 371 N 0.00 0.00 0.00 0.00 1.63 -1.76 -3.27 116.57 113.17 2o5j h LYS 371 Ca -0.00 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.64 2o5j h LYS 371 Cb 0.38 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 2o5j h LYS 371 CO 0.02 0.38 -1.96 1.28 -3.45 0.00 0.00 179.45 175.72 2o5j n LEU 372 N -4.02 0.00 -4.42 5.20 4.32 -1.08 -4.71 117.00 112.29 2o5j n LEU 372 Ca -0.02 0.00 -0.33 0.00 -0.02 0.00 0.00 56.01 55.65 2o5j n LEU 372 Cb 0.42 0.21 -0.14 0.00 -1.62 0.00 0.00 43.42 42.29 2o5j n LEU 372 CO 0.38 0.21 -0.47 -0.69 -1.22 0.00 0.00 177.39 175.61 2o5j s VAL 373 N -2.77 2.93 -0.14 4.08 1.01 -0.91 -4.40 120.40 120.20 2o5j s VAL 373 Ca -0.07 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.13 2o5j s VAL 373 Cb 0.08 -2.16 0.05 0.00 0.00 0.00 0.00 36.38 34.34 2o5j s VAL 373 CO 0.69 0.57 0.04 0.54 0.00 0.00 0.00 175.10 176.93 2o5j s ASN 374 N -0.36 2.26 0.00 3.32 4.22 -1.26 -4.58 114.94 118.54 2o5j s ASN 374 Ca 0.03 -0.49 0.18 0.00 -2.14 0.00 0.00 52.86 50.45 2o5j s ASN 374 Cb -0.12 -0.44 0.86 0.00 1.28 0.00 0.00 41.25 42.82 2o5j s ASN 374 CO 0.02 -0.28 1.56 -1.20 -2.04 0.00 0.00 177.10 175.17 2o5j n SER 375 N 5.15 0.00 0.05 3.54 7.64 -1.26 -4.04 113.62 124.70 2o5j n SER 375 Ca -0.08 0.21 -0.13 0.00 1.01 0.00 0.00 58.87 59.88 2o5j n SER 375 Cb 0.49 -0.37 -0.07 0.00 -1.01 0.00 0.00 64.21 63.25 2o5j n SER 375 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2o5j h ARG 376 N 0.00 -0.55 0.43 1.43 9.65 -2.00 -2.54 114.38 120.81 2o5j h ARG 376 Ca 0.00 0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 2o5j h ARG 376 Cb 0.22 0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.91 2o5j h ARG 376 CO 0.00 -0.36 -0.41 -1.35 2.80 0.00 0.00 179.97 180.64 2o5j h PRO 377 N -0.57 -0.83 -0.30 0.20 0.11 -1.92 -2.86 132.00 125.84 2o5j h PRO 377 Ca 0.05 0.06 0.07 0.00 0.11 0.00 0.00 66.00 66.28 2o5j h PRO 377 Cb 0.65 0.19 -0.07 0.00 0.11 0.00 0.00 31.00 31.87 2o5j h PRO 377 CO -0.32 -0.55 -0.22 1.25 -0.21 0.00 0.00 178.00 177.95 2o5j h LEU 378 N -0.86 -0.71 0.11 2.35 5.85 -1.75 -0.19 115.31 120.11 2o5j h LEU 378 Ca -0.04 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.83 2o5j h LEU 378 Cb 0.76 0.35 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 2o5j h LEU 378 CO -0.05 -0.25 -0.40 -0.08 -0.34 0.00 0.00 178.44 177.31 2o5j h GLU 379 N -0.19 -0.57 -0.98 1.25 4.57 -1.40 -1.28 114.58 115.98 2o5j h GLU 379 Ca 0.16 0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.45 2o5j h GLU 379 Cb 0.44 0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 29.09 2o5j h GLU 379 CO -0.41 -0.38 0.63 0.00 -1.18 0.00 0.00 179.01 177.67 2o5j h ALA 380 N -0.81 1.45 0.31 2.92 0.00 -1.37 0.56 119.26 122.33 2o5j h ALA 380 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2o5j h ALA 380 Cb 0.59 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2o5j h ALA 380 CO -0.21 0.38 -0.18 0.00 0.00 0.00 0.00 179.25 179.25 2o5j h ALA 381 N 1.48 -1.06 0.26 0.00 0.00 -0.54 0.93 119.26 120.34 2o5j h ALA 381 Ca 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2o5j h ALA 381 Cb 0.23 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2o5j h ALA 381 CO -0.18 -1.04 -0.25 0.82 0.00 0.00 0.00 179.25 178.60 2o5j h ILE 382 N -0.45 0.46 -0.77 0.00 2.04 -1.22 -2.61 117.51 114.96 2o5j h ILE 382 Ca -0.04 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.00 2o5j h ILE 382 Cb 0.36 0.46 -0.13 0.00 -0.74 0.00 0.00 36.82 36.77 2o5j h ILE 382 CO 0.05 0.00 0.05 -0.09 0.00 0.00 0.00 178.15 178.16 2o5j h ARG 383 N -0.54 0.13 -0.39 2.37 9.65 -0.89 0.18 114.38 124.88 2o5j h ARG 383 Ca -0.01 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2o5j h ARG 383 Cb 0.50 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.03 2o5j h ARG 383 CO -0.05 0.09 0.25 1.49 2.80 0.00 0.00 179.97 184.54 2o5j h GLU 384 N 0.13 0.52 -0.19 0.20 4.57 -0.45 -1.16 114.58 118.20 2o5j h GLU 384 Ca 0.43 -0.03 -0.14 0.00 -1.18 0.00 0.00 59.36 58.44 2o5j h GLU 384 Cb 0.78 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 2o5j h GLU 384 CO -0.65 0.35 -0.42 0.74 -1.18 0.00 0.00 179.01 177.85 2o5j h PHE 385 N 0.54 0.80 0.00 0.92 -1.00 -0.30 0.17 116.94 118.06 2o5j h PHE 385 Ca 0.14 -0.30 0.00 0.00 2.81 0.00 0.00 57.97 60.63 2o5j h PHE 385 Cb -0.05 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.37 2o5j h PHE 385 CO 0.00 1.06 -0.10 0.74 -1.61 0.00 0.00 178.31 178.40 2o5j h PHE 386 N 0.30 0.00 0.00 -0.55 -1.00 -1.05 -2.64 116.94 112.01 2o5j h PHE 386 Ca 0.00 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.59 2o5j h PHE 386 Cb 1.03 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.55 2o5j h PHE 386 CO 0.09 0.00 -1.78 0.43 -1.61 0.00 0.00 178.31 175.44 2o5j n SER 387 N -2.62 2.11 0.00 2.17 7.64 -0.48 -4.78 113.62 117.67 2o5j n SER 387 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2o5j n SER 387 Cb 0.48 0.87 0.00 0.00 -1.01 0.00 0.00 64.21 64.54 2o5j n SER 387 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2o5j n ARG 388 N -2.38 4.21 -1.73 1.43 3.00 -0.00 -5.03 116.66 116.16 2o5j n ARG 388 Ca -0.17 -0.13 -0.42 0.00 -0.01 0.00 0.00 57.85 57.12 2o5j n ARG 388 Cb 0.83 -0.59 -0.01 0.00 0.00 0.00 0.00 32.46 32.69 2o5j n ARG 388 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2o5j n SER 389 N -0.64 3.20 0.00 0.55 7.64 -0.90 -4.81 113.62 118.67 2o5j n SER 389 Ca 0.00 1.20 0.03 0.00 1.01 0.00 0.00 58.87 61.11 2o5j n SER 389 Cb 0.01 -1.53 0.17 0.00 -1.01 0.00 0.00 64.21 61.84 2o5j n SER 389 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2o5j n GLN 390 N 0.76 0.18 -0.06 1.43 6.02 -1.26 -2.96 117.38 121.50 2o5j n GLN 390 Ca 0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.03 2o5j n GLN 390 Cb 0.37 -1.50 -0.16 0.00 1.02 0.00 0.00 30.24 29.97 2o5j n GLN 390 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2o5j n LEU 391 N -1.00 0.00 -4.71 1.08 0.00 -1.26 -4.94 117.00 106.17 2o5j n LEU 391 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 56.01 55.66 2o5j n LEU 391 Cb 0.02 0.27 -0.05 0.00 0.00 0.00 0.00 43.42 43.65 2o5j n LEU 391 CO 0.03 0.27 0.30 -0.44 0.00 0.00 0.00 177.39 177.55 2o5j s SER 392 N -4.97 6.82 0.36 1.96 0.01 -1.15 -4.37 113.70 112.35 2o5j s SER 392 Ca -0.09 0.98 0.05 0.00 1.31 0.00 0.00 55.95 58.20 2o5j s SER 392 Cb 0.09 -2.35 -0.02 0.00 0.21 0.00 0.00 66.02 63.95 2o5j s SER 392 CO 0.83 -0.10 0.18 0.00 0.41 0.00 0.00 173.24 174.56 2o5j n GLN 393 N 3.95 0.53 -2.18 12.44 6.02 -1.26 -4.98 117.38 131.91 2o5j n GLN 393 Ca -0.04 -3.20 -0.42 0.00 -0.01 0.00 0.00 57.00 53.34 2o5j n GLN 393 Cb 0.51 2.00 -0.03 0.00 1.02 0.00 0.00 30.24 33.74 2o5j n GLN 393 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2o5j s PHE 394 N -3.07 2.80 0.02 1.08 5.99 -1.26 -3.66 117.98 119.88 2o5j s PHE 394 Ca 0.25 0.75 -0.32 0.00 0.00 0.00 0.00 56.93 57.60 2o5j s PHE 394 Cb 0.01 -3.71 -0.11 0.00 0.00 0.00 0.00 43.02 39.22 2o5j s PHE 394 CO 0.18 -2.66 1.89 1.17 -0.00 0.00 0.00 175.22 175.79 2o5j n LYS 395 N 5.35 2.59 -2.44 10.12 4.81 -1.23 -4.87 118.16 132.49 2o5j n LYS 395 Ca 0.13 0.95 -0.38 0.00 -0.87 0.00 0.00 58.31 58.14 2o5j n LYS 395 Cb 0.43 -2.84 -0.03 0.00 0.02 0.00 0.00 35.03 32.61 2o5j n LYS 395 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2o5j s ASP 396 N 3.75 6.23 -0.76 3.14 3.68 -1.26 -4.73 116.67 126.73 2o5j s ASP 396 Ca 0.88 -1.57 0.01 0.00 2.13 0.00 0.00 52.55 54.00 2o5j s ASP 396 Cb -0.54 -2.57 0.35 0.00 -1.45 0.00 0.00 42.92 38.71 2o5j s ASP 396 CO 0.44 -1.77 1.51 -0.62 0.13 0.00 0.00 175.17 174.86 2o5j n GLU 397 N 8.72 3.86 -0.29 4.34 4.71 -1.26 0.82 120.64 141.53 2o5j n GLU 397 Ca 0.39 -4.42 -0.01 0.00 -0.01 0.00 0.00 57.16 53.11 2o5j n GLU 397 Cb 0.49 -2.32 0.12 0.00 -1.01 0.00 0.00 31.44 28.72 2o5j n GLU 397 CO 0.00 0.00 0.00 1.15 0.09 0.00 0.00 177.13 178.37 2o5j h THR 398 N 2.43 1.07 -2.79 2.62 2.02 -1.80 -3.43 112.91 113.03 2o5j h THR 398 Ca 0.39 -0.33 -0.13 0.00 0.77 0.00 0.00 66.41 67.12 2o5j h THR 398 Cb 0.41 0.03 -0.24 0.00 -1.74 0.00 0.00 68.15 66.61 2o5j h THR 398 CO 1.08 0.17 -0.26 0.54 0.37 0.00 0.00 175.52 177.43 2o5j s ASN 399 N -5.78 -0.41 0.24 4.18 2.20 -1.23 -3.69 114.94 110.45 2o5j s ASN 399 Ca -0.13 0.78 0.07 0.00 -0.94 0.00 0.00 52.86 52.65 2o5j s ASN 399 Cb 0.17 0.79 0.72 0.00 -2.00 0.00 0.00 41.25 40.94 2o5j s ASN 399 CO 0.79 -0.14 1.14 -2.65 -2.94 0.00 0.00 177.10 173.30 2o5j n PRO 400 N 2.92 -0.05 -0.19 3.55 -0.02 -1.26 0.12 135.00 140.06 2o5j n PRO 400 Ca -0.13 1.05 -0.01 0.00 -2.02 0.00 0.00 63.50 62.39 2o5j n PRO 400 Cb 0.57 -1.76 0.06 0.00 -0.02 0.00 0.00 33.50 32.35 2o5j n PRO 400 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2o5j h LEU 401 N 0.00 -0.51 -0.46 2.45 5.85 -1.92 -0.90 115.31 119.83 2o5j h LEU 401 Ca 0.51 0.17 0.09 0.00 0.84 0.00 0.00 57.88 59.49 2o5j h LEU 401 Cb 1.19 0.35 -0.10 0.00 0.37 0.00 0.00 40.66 42.48 2o5j h LEU 401 CO -0.63 -0.18 -0.32 0.28 -0.34 0.00 0.00 178.44 177.24 2o5j h SER 402 N 0.01 -1.09 -0.23 1.25 0.02 0.70 -1.52 113.55 112.69 2o5j h SER 402 Ca 0.29 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 2o5j h SER 402 Cb 0.44 0.52 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 2o5j h SER 402 CO -0.59 -0.31 0.14 0.77 -1.14 0.00 0.00 176.83 175.70 2o5j h SER 403 N -0.22 0.26 -0.72 3.07 4.64 0.16 -1.71 113.55 119.03 2o5j h SER 403 Ca 0.19 -0.03 0.11 0.00 -0.47 0.00 0.00 61.79 61.60 2o5j h SER 403 Cb 0.54 -0.07 -0.08 0.00 -0.31 0.00 0.00 62.40 62.48 2o5j h SER 403 CO -0.58 0.21 0.32 0.25 -0.87 0.00 0.00 176.83 176.16 2o5j h LEU 404 N 0.29 0.36 -0.12 5.97 5.85 -0.66 -1.81 115.31 125.19 2o5j h LEU 404 Ca 0.08 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2o5j h LEU 404 Cb -0.01 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 2o5j h LEU 404 CO -0.02 0.18 0.02 -0.09 -0.34 0.00 0.00 178.44 178.19 2o5j h ARG 405 N 0.51 0.20 -0.35 1.25 1.12 -0.90 -2.46 114.38 113.75 2o5j h ARG 405 Ca 0.37 -0.05 0.10 0.00 -1.11 0.00 0.00 59.98 59.29 2o5j h ARG 405 Cb 0.49 -0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.41 2o5j h ARG 405 CO -0.33 0.40 0.35 1.25 -3.11 0.00 0.00 179.97 178.52 2o5j h HIS 406 N -0.02 0.00 0.00 2.20 2.76 -0.90 -0.62 115.15 118.56 2o5j h HIS 406 Ca 0.04 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.99 2o5j h HIS 406 Cb 0.29 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.22 2o5j h HIS 406 CO 0.02 0.00 -1.15 0.87 -1.30 0.00 0.00 177.93 176.37 2o5j h LYS 407 N 0.00 0.00 -0.34 5.26 1.57 -0.88 -3.33 116.57 118.85 2o5j h LYS 407 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2o5j h LYS 407 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2o5j h LYS 407 CO -0.00 0.81 0.00 2.89 -0.57 0.00 0.00 179.45 182.58 2o5j n ARG 408 N -3.25 2.29 -2.70 3.15 1.85 -0.33 -4.58 116.66 113.10 2o5j n ARG 408 Ca -0.04 -2.10 -0.42 0.00 -1.00 0.00 0.00 57.85 54.29 2o5j n ARG 408 Cb 0.95 -1.42 -0.03 0.00 -1.05 0.00 0.00 32.46 30.90 2o5j n ARG 408 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 2o5j s ARG 409 N -1.28 4.54 -0.07 2.89 1.70 -0.68 -0.46 118.95 125.59 2o5j s ARG 409 Ca 0.32 1.43 -0.25 0.00 -0.47 0.00 0.00 55.73 56.76 2o5j s ARG 409 Cb 0.19 -3.46 -0.03 0.00 -0.57 0.00 0.00 34.95 31.07 2o5j s ARG 409 CO 0.26 -0.09 0.79 0.42 -1.08 0.00 0.00 175.30 175.61 2o5j s ILE 410 N 1.12 4.97 0.17 4.99 1.01 0.17 -4.48 121.20 129.15 2o5j s ILE 410 Ca 0.52 1.62 0.10 0.00 0.00 0.00 0.00 60.65 62.90 2o5j s ILE 410 Cb -0.21 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.09 2o5j s ILE 410 CO 0.27 0.18 -0.23 -0.55 0.00 0.00 0.00 174.94 174.61 2o5j s SER 411 N 0.92 3.17 -0.14 3.58 0.15 -1.22 0.04 113.70 120.20 2o5j s SER 411 Ca 0.41 -0.83 -0.14 0.00 0.70 0.00 0.00 55.95 56.08 2o5j s SER 411 Cb -0.18 -0.22 -0.05 0.00 -1.71 0.00 0.00 66.02 63.86 2o5j s SER 411 CO 0.19 0.09 -0.28 0.00 1.20 0.00 0.00 173.24 174.44 2o5j n ALA 412 N 0.43 0.89 -1.33 5.45 0.00 -0.52 0.57 120.51 126.01 2o5j n ALA 412 Ca -0.14 -0.68 -0.38 0.00 0.00 0.00 0.00 53.44 52.24 2o5j n ALA 412 Cb 0.56 0.04 0.04 0.00 0.00 0.00 0.00 19.45 20.08 2o5j n ALA 412 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2o5j n LEU 413 N -4.11 -0.79 0.00 0.00 -0.00 -1.26 -4.43 117.00 106.42 2o5j n LEU 413 Ca -0.11 0.65 0.00 0.00 -0.00 0.00 0.00 56.01 56.55 2o5j n LEU 413 Cb 0.41 -1.07 0.00 0.00 -0.00 0.00 0.00 43.42 42.76 2o5j n LEU 413 CO 0.17 -3.70 0.00 0.61 -0.00 0.00 0.00 177.39 174.46 2o5j n GLY 414 N 2.04 -0.37 0.71 1.47 0.00 -1.26 -4.95 105.19 102.83 2o5j n GLY 414 Ca 0.09 0.32 0.53 0.00 0.00 0.00 0.00 46.02 46.97 2o5j n GLY 414 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2o5j h PRO 415 N 0.00 0.00 0.00 1.61 0.11 -1.93 -3.43 132.00 128.36 2o5j h PRO 415 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2o5j h PRO 415 Cb 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2o5j h PRO 415 CO 0.00 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.20 2o5j n GLY 416 N -1.92 3.10 0.26 -0.55 0.00 -1.26 -4.86 105.19 99.96 2o5j n GLY 416 Ca 0.44 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.33 2o5j n GLY 416 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2o5j h GLY 417 N 0.00 1.01 0.00 -0.02 0.00 -2.00 -3.41 103.07 98.65 2o5j h GLY 417 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 47.33 46.29 2o5j h GLY 417 CO 0.00 0.94 0.00 1.04 0.00 0.00 0.00 176.54 178.52 2o5j n LEU 418 N -4.07 0.00 -4.25 3.11 4.32 -1.26 -4.97 117.00 109.89 2o5j n LEU 418 Ca -0.02 0.00 -0.28 0.00 -0.02 0.00 0.00 56.01 55.68 2o5j n LEU 418 Cb 0.55 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 42.19 2o5j n LEU 418 CO 0.49 0.00 -0.54 0.28 -1.22 0.00 0.00 177.39 176.40 2o5j s THR 419 N 0.00 1.76 0.65 -5.08 -1.32 -1.26 -5.10 115.64 105.29 2o5j s THR 419 Ca 0.00 -0.96 0.03 0.00 -1.21 0.00 0.00 61.69 59.55 2o5j s THR 419 Cb 0.00 -1.46 0.12 0.00 -1.51 0.00 0.00 72.50 69.65 2o5j s THR 419 CO 0.00 0.50 0.89 0.54 -2.21 0.00 0.00 174.62 174.34 2o5j n ARG 420 N 2.52 0.14 0.01 7.08 1.74 -1.26 -4.14 116.66 122.75 2o5j n ARG 420 Ca -0.15 -2.71 -0.15 0.00 -0.77 0.00 0.00 57.85 54.06 2o5j n ARG 420 Cb 0.52 -0.51 -0.14 0.00 -1.02 0.00 0.00 32.46 31.32 2o5j n ARG 420 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2o5j h GLU 421 N 0.00 0.16 -1.01 5.56 4.57 -2.00 -3.36 114.58 118.50 2o5j h GLU 421 Ca -0.30 -0.27 -0.39 0.00 -1.18 0.00 0.00 59.36 57.23 2o5j h GLU 421 Cb 1.17 0.10 -0.23 0.00 -0.16 0.00 0.00 28.75 29.64 2o5j h GLU 421 CO 0.35 0.92 0.49 -2.13 -1.18 0.00 0.00 179.01 177.45 2o5j n ARG 422 N -3.31 1.93 -3.68 1.92 3.00 -1.26 -4.75 116.66 110.51 2o5j n ARG 422 Ca -0.23 -2.21 -0.28 0.00 -0.00 0.00 0.00 57.85 55.13 2o5j n ARG 422 Cb 1.05 -1.87 -0.16 0.00 0.00 0.00 0.00 32.46 31.48 2o5j n ARG 422 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2o5j s ALA 423 N -2.43 0.99 0.00 5.13 0.00 -1.26 -5.03 121.76 119.17 2o5j s ALA 423 Ca 0.42 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2o5j s ALA 423 Cb 0.35 -1.31 0.00 0.00 0.00 0.00 0.00 23.12 22.16 2o5j s ALA 423 CO 0.08 -1.39 0.00 0.41 0.00 0.00 0.00 175.76 174.86 2o5j n GLY 424 N 5.07 0.00 0.32 0.00 0.00 -1.26 -4.71 105.19 104.61 2o5j n GLY 424 Ca -0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 2o5j n GLY 424 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2o5j h PHE 425 N 0.00 0.00 0.00 1.61 -0.00 -1.98 0.12 116.94 116.68 2o5j h PHE 425 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.97 57.78 2o5j h PHE 425 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 35.92 2o5j h PHE 425 CO 0.00 0.00 -0.99 0.38 -0.00 0.00 0.00 178.31 177.70 2o5j h ASP 426 N 0.00 0.00 0.13 0.41 2.03 -1.96 -3.24 116.42 113.79 2o5j h ASP 426 Ca 0.10 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.18 2o5j h ASP 426 Cb 0.46 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.98 2o5j h ASP 426 CO -0.00 0.87 -0.95 0.58 -1.03 0.00 0.00 179.24 178.70 2o5j h VAL 427 N 0.00 1.42 -0.95 4.15 2.07 -1.56 -3.33 116.25 118.05 2o5j h VAL 427 Ca -0.05 -2.45 0.02 0.00 0.82 0.00 0.00 66.70 65.04 2o5j h VAL 427 Cb 1.70 2.95 -0.05 0.00 -1.52 0.00 0.00 31.29 34.38 2o5j h VAL 427 CO 0.11 0.71 0.62 0.03 0.02 0.00 0.00 177.57 179.06 2o5j h ARG 428 N -0.11 1.21 -7.10 1.57 3.08 -0.97 -3.44 114.38 108.62 2o5j h ARG 428 Ca -0.15 -0.07 -0.54 0.00 0.07 0.00 0.00 59.98 59.28 2o5j h ARG 428 Cb 1.71 -0.27 0.18 0.00 0.08 0.00 0.00 29.97 31.67 2o5j h ARG 428 CO 0.18 0.80 0.22 -0.25 -1.07 0.00 0.00 179.97 179.85 2o5j n ASP 429 N -4.45 0.71 -4.50 7.04 8.00 -1.22 -4.66 116.55 117.48 2o5j n ASP 429 Ca 0.12 0.60 -0.43 0.00 0.71 0.00 0.00 54.79 55.79 2o5j n ASP 429 Cb 0.05 -1.46 -0.04 0.00 -0.02 0.00 0.00 41.12 39.64 2o5j n ASP 429 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2o5j s VAL 430 N -2.03 4.31 0.75 2.53 0.11 -1.26 -5.02 120.40 119.79 2o5j s VAL 430 Ca 0.73 0.06 -0.11 0.00 -2.93 0.00 0.00 61.98 59.72 2o5j s VAL 430 Cb -0.30 -4.62 0.04 0.00 -1.53 0.00 0.00 36.38 29.97 2o5j s VAL 430 CO 0.51 -1.30 1.09 -2.28 -3.33 0.00 0.00 175.10 169.79 2o5j s HIS 431 N 4.13 2.68 0.15 1.54 2.46 -1.26 -4.92 115.29 120.06 2o5j s HIS 431 Ca 0.28 1.53 -0.31 0.00 0.47 0.00 0.00 55.06 57.03 2o5j s HIS 431 Cb -0.14 -3.02 -0.07 0.00 -0.13 0.00 0.00 32.58 29.22 2o5j s HIS 431 CO 0.16 -1.68 1.55 0.00 -2.47 0.00 0.00 174.74 172.29 2o5j h ARG 432 N -0.97 -0.23 0.00 2.88 2.47 -1.95 -1.23 114.38 115.35 2o5j h ARG 432 Ca -0.44 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.30 2o5j h ARG 432 Cb 1.23 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.60 2o5j h ARG 432 CO 0.52 -0.15 0.00 2.41 0.56 0.00 0.00 179.97 183.31 2o5j n THR 433 N -5.34 0.95 0.20 2.04 -1.04 -1.26 -2.64 114.28 107.18 2o5j n THR 433 Ca -0.01 0.24 0.01 0.00 -2.04 0.00 0.00 64.05 62.25 2o5j n THR 433 Cb 0.32 -1.05 0.06 0.00 -1.82 0.00 0.00 70.33 67.84 2o5j n THR 433 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2o5j n HIS 434 N -1.38 0.00 -1.75 -1.42 8.25 -0.46 -4.62 115.22 113.83 2o5j n HIS 434 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2o5j n HIS 434 Cb 0.11 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.19 2o5j n HIS 434 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2o5j s TYR 435 N -2.00 1.99 -1.32 4.41 6.14 -1.08 -1.17 117.35 124.32 2o5j s TYR 435 Ca 0.03 -0.06 0.00 0.00 0.64 0.00 0.00 57.07 57.68 2o5j s TYR 435 Cb 0.01 -4.15 0.00 0.00 0.42 0.00 0.00 41.96 38.24 2o5j s TYR 435 CO 0.02 -4.83 0.00 0.41 0.64 0.00 0.00 175.55 171.79 2o5j n GLY 436 N 4.26 1.19 0.00 8.97 0.00 -1.19 -4.62 105.19 113.80 2o5j n GLY 436 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2o5j n GLY 436 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j n ARG 437 N -1.52 2.49 -3.70 1.61 1.74 -1.00 -3.28 116.66 113.00 2o5j n ARG 437 Ca -0.12 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.85 2o5j n ARG 437 Cb 0.47 -0.82 -0.11 0.00 -1.02 0.00 0.00 32.46 30.98 2o5j n ARG 437 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2o5j s ILE 438 N -1.58 -0.06 0.37 0.55 1.01 -0.31 -4.04 121.20 117.14 2o5j s ILE 438 Ca 0.00 0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.48 2o5j s ILE 438 Cb 0.00 -0.56 -0.10 0.00 0.01 0.00 0.00 42.46 41.81 2o5j s ILE 438 CO 0.00 0.05 1.40 0.00 0.00 0.00 0.00 174.94 176.38 2o5j n PRO 440 N 0.46 1.05 -0.08 0.00 -0.04 -1.26 -4.35 135.00 130.79 2o5j n PRO 440 Ca 0.01 -0.77 -0.10 0.00 -0.04 0.00 0.00 63.50 62.60 2o5j n PRO 440 Cb 0.41 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 2o5j n PRO 440 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2o5j n VAL 441 N -0.30 0.88 0.14 0.52 0.31 -1.26 -4.61 118.33 114.00 2o5j n VAL 441 Ca 0.11 -0.36 0.05 0.00 -0.01 0.00 0.00 64.34 64.13 2o5j n VAL 441 Cb 0.41 -1.01 0.27 0.00 -0.91 0.00 0.00 33.84 32.61 2o5j n VAL 441 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2o5j n GLU 442 N -2.90 0.07 -1.56 5.55 4.07 -1.26 -4.53 120.64 120.08 2o5j n GLU 442 Ca -0.27 0.52 -0.45 0.00 -0.06 0.00 0.00 57.16 56.90 2o5j n GLU 442 Cb 0.80 -2.06 -0.04 0.00 -0.06 0.00 0.00 31.44 30.07 2o5j n GLU 442 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2o5j n THR 443 N -1.92 0.31 -1.72 6.31 -2.24 -1.24 -4.54 114.28 109.25 2o5j n THR 443 Ca -0.01 -0.38 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 2o5j n THR 443 Cb 0.35 -2.26 -0.01 0.00 -2.10 0.00 0.00 70.33 66.31 2o5j n THR 443 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2o5j n PRO 444 N 8.50 2.39 -2.54 -0.78 -0.02 -1.25 -4.80 135.00 136.48 2o5j n PRO 444 Ca 0.33 0.84 -0.37 0.00 -2.02 0.00 0.00 63.50 62.28 2o5j n PRO 444 Cb 0.38 -2.52 -0.04 0.00 -0.02 0.00 0.00 33.50 31.29 2o5j n PRO 444 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2o5j s GLU 445 N -1.29 4.23 0.00 -0.52 2.56 -1.26 -4.38 118.70 118.04 2o5j s GLU 445 Ca 0.60 1.54 0.00 0.00 0.00 0.00 0.00 54.97 57.10 2o5j s GLU 445 Cb -0.54 -2.62 0.00 0.00 2.00 0.00 0.00 34.13 32.97 2o5j s GLU 445 CO 0.57 -0.09 0.00 0.41 -0.56 0.00 0.00 175.26 175.59 2o5j n GLY 446 N 0.44 1.61 0.45 -1.50 0.00 -1.26 -4.91 105.19 100.02 2o5j n GLY 446 Ca 0.04 -2.06 -0.14 0.00 0.00 0.00 0.00 46.02 43.87 2o5j n GLY 446 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j h ALA 447 N 0.00 -0.77 -1.31 4.61 0.00 -2.05 -3.24 119.26 116.50 2o5j h ALA 447 Ca 0.00 -0.01 -0.48 0.00 0.00 0.00 0.00 54.91 54.41 2o5j h ALA 447 Cb 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 2o5j h ALA 447 CO 0.00 -1.04 1.20 -0.80 0.00 0.00 0.00 179.25 178.61 2o5j s ASN 448 N -4.98 5.54 0.04 0.00 -0.87 -1.26 -4.93 114.94 108.49 2o5j s ASN 448 Ca -0.15 -0.14 -0.01 0.00 -1.57 0.00 0.00 52.86 50.99 2o5j s ASN 448 Cb 0.08 -2.54 -0.03 0.00 -0.02 0.00 0.00 41.25 38.74 2o5j s ASN 448 CO 0.62 -2.25 -0.02 -0.51 -2.57 0.00 0.00 177.10 172.37 2o5j s ILE 449 N 8.18 0.18 0.00 0.60 2.07 -1.23 -4.65 121.20 126.36 2o5j s ILE 449 Ca 0.59 -1.52 0.00 0.00 -1.41 0.00 0.00 60.65 58.31 2o5j s ILE 449 Cb -0.10 -1.15 0.00 0.00 0.13 0.00 0.00 42.46 41.35 2o5j s ILE 449 CO 0.14 -0.84 0.00 0.61 -1.91 0.00 0.00 174.94 172.94 2o5j n GLY 450 N 0.54 1.02 0.22 1.50 0.00 -1.26 -4.47 105.19 102.73 2o5j n GLY 450 Ca -0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.95 2o5j n GLY 450 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2o5j h LEU 451 N 0.00 0.00 -8.02 0.99 3.38 -1.87 -3.43 115.31 106.36 2o5j h LEU 451 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 2o5j h LEU 451 Cb 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.40 2o5j h LEU 451 CO 0.00 0.20 -0.84 -0.63 0.09 0.00 0.00 178.44 177.26 2o5j s ILE 452 N -3.51 1.65 -0.30 1.22 1.09 -1.19 -1.44 121.20 118.72 2o5j s ILE 452 Ca 0.02 -0.72 -0.07 0.00 -1.10 0.00 0.00 60.65 58.78 2o5j s ILE 452 Cb 0.09 -1.50 0.16 0.00 -1.06 0.00 0.00 42.46 40.15 2o5j s ILE 452 CO 0.64 0.47 0.68 0.28 -0.10 0.00 0.00 174.94 176.91 2o5j s THR 453 N 1.09 -0.92 0.84 2.92 -1.32 0.11 -3.60 115.64 114.74 2o5j s THR 453 Ca -0.03 0.00 -0.14 0.00 -1.21 0.00 0.00 61.69 60.31 2o5j s THR 453 Cb -0.14 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.89 2o5j s THR 453 CO -0.04 0.00 0.77 -1.20 -2.21 0.00 0.00 174.62 171.94 2o5j n SER 454 N 5.40 -0.59 -4.30 8.08 7.64 -1.26 0.45 113.62 129.04 2o5j n SER 454 Ca -0.07 0.50 -0.29 0.00 1.01 0.00 0.00 58.87 60.02 2o5j n SER 454 Cb 0.50 -1.33 0.16 0.00 -1.01 0.00 0.00 64.21 62.53 2o5j n SER 454 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2o5j s LEU 455 N -2.82 2.75 0.89 -3.43 2.34 0.40 0.18 118.68 118.99 2o5j s LEU 455 Ca 0.66 0.19 -0.11 0.00 0.06 0.00 0.00 54.13 54.93 2o5j s LEU 455 Cb -0.28 -2.33 0.19 0.00 -0.56 0.00 0.00 46.19 43.21 2o5j s LEU 455 CO 0.58 -2.50 1.22 0.00 -1.06 0.00 0.00 176.35 174.60 2o5j s ALA 456 N -3.72 2.75 0.00 1.48 0.00 -1.26 -4.06 121.76 116.96 2o5j s ALA 456 Ca 0.71 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 51.19 2o5j s ALA 456 Cb -0.05 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 20.62 2o5j s ALA 456 CO 0.51 -2.18 0.53 0.00 0.00 0.00 0.00 175.76 174.62 2o5j n ALA 457 N -3.48 -0.01 1.61 0.00 0.00 0.35 -3.35 120.51 115.62 2o5j n ALA 457 Ca 0.16 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.75 2o5j n ALA 457 Cb 0.60 0.13 0.69 0.00 0.00 0.00 0.00 19.45 20.87 2o5j n ALA 457 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2o5j n TYR 458 N -0.85 0.00 -1.54 0.00 4.02 -1.26 -4.51 117.16 113.02 2o5j n TYR 458 Ca 0.00 0.00 -0.51 0.00 -0.01 0.00 0.00 57.90 57.38 2o5j n TYR 458 Cb 0.00 -0.08 -0.05 0.00 -0.02 0.00 0.00 39.34 39.20 2o5j n TYR 458 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2o5j n ALA 459 N -0.66 -1.54 -3.66 -0.72 0.00 -1.21 -4.68 120.51 108.04 2o5j n ALA 459 Ca 0.18 0.49 -0.10 0.00 0.00 0.00 0.00 53.44 54.01 2o5j n ALA 459 Cb 0.25 -1.93 -0.10 0.00 0.00 0.00 0.00 19.45 17.67 2o5j n ALA 459 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2o5j s ARG 460 N -0.36 0.47 -0.21 0.00 1.70 -1.17 -4.88 118.95 114.51 2o5j s ARG 460 Ca 0.75 0.88 -0.29 0.00 -0.47 0.00 0.00 55.73 56.60 2o5j s ARG 460 Cb -0.94 0.03 -0.03 0.00 -0.57 0.00 0.00 34.95 33.45 2o5j s ARG 460 CO 0.53 -0.15 1.60 0.08 -1.08 0.00 0.00 175.30 176.28 2o5j s VAL 461 N 1.37 3.72 0.00 4.99 1.01 -1.26 -2.86 120.40 127.36 2o5j s VAL 461 Ca -0.09 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.70 2o5j s VAL 461 Cb -0.07 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2o5j s VAL 461 CO -0.13 -0.28 0.00 -0.90 0.00 0.00 0.00 175.10 173.79 2o5j n ASP 462 N 8.28 0.00 -0.10 3.32 5.75 -1.25 -4.91 116.55 127.63 2o5j n ASP 462 Ca 0.18 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.81 2o5j n ASP 462 Cb 0.45 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.45 2o5j n ASP 462 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2o5j n GLU 463 N 0.00 0.49 -3.88 0.11 -0.58 -1.26 -4.91 120.64 110.61 2o5j n GLU 463 Ca 0.00 0.13 -0.28 0.00 -0.42 0.00 0.00 57.16 56.59 2o5j n GLU 463 Cb 0.00 -1.37 -0.16 0.00 -0.57 0.00 0.00 31.44 29.33 2o5j n GLU 463 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2o5j s LEU 464 N -6.37 1.74 0.00 -4.62 2.96 -1.26 -4.99 118.68 106.14 2o5j s LEU 464 Ca -0.28 -0.79 0.00 0.00 -0.22 0.00 0.00 54.13 52.84 2o5j s LEU 464 Cb 0.08 -0.92 0.00 0.00 0.50 0.00 0.00 46.19 45.85 2o5j s LEU 464 CO 0.45 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.87 2o5j n GLY 465 N 4.86 0.00 3.16 7.98 0.00 -1.26 -4.77 105.19 115.17 2o5j n GLY 465 Ca -0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 2o5j n GLY 465 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2o5j s PHE 466 N 0.00 3.49 -0.41 1.61 0.08 -1.26 -1.99 117.98 119.50 2o5j s PHE 466 Ca 0.00 -2.13 -0.27 0.00 0.12 0.00 0.00 56.93 54.65 2o5j s PHE 466 Cb 0.00 -3.13 -0.06 0.00 -0.57 0.00 0.00 43.02 39.26 2o5j s PHE 466 CO 0.00 -0.94 2.32 0.42 -0.10 0.00 0.00 175.22 176.92 2o5j s ILE 467 N 1.24 3.03 0.27 0.64 1.01 -1.26 -3.97 121.20 122.16 2o5j s ILE 467 Ca 0.06 0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.50 2o5j s ILE 467 Cb -0.23 -3.07 -0.09 0.00 0.01 0.00 0.00 42.46 39.08 2o5j s ILE 467 CO -0.02 -0.06 0.83 -0.13 0.00 0.00 0.00 174.94 175.56 2o5j s ARG 468 N 7.60 4.42 0.05 2.79 0.52 -1.14 -4.61 118.95 128.59 2o5j s ARG 468 Ca 0.97 1.10 0.06 0.00 -0.52 0.00 0.00 55.73 57.34 2o5j s ARG 468 Cb -0.22 -2.83 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 2o5j s ARG 468 CO 0.29 0.33 -0.14 -0.08 0.02 0.00 0.00 175.30 175.72 2o5j s THR 469 N -1.57 3.10 0.22 0.02 -1.32 -1.08 -3.04 115.64 111.96 2o5j s THR 469 Ca 0.47 -1.14 -0.30 0.00 -1.21 0.00 0.00 61.69 59.51 2o5j s THR 469 Cb -0.18 -2.35 -0.08 0.00 -1.51 0.00 0.00 72.50 68.38 2o5j s THR 469 CO 0.22 0.29 1.14 -2.16 -2.21 0.00 0.00 174.62 171.89 2o5j s PRO 470 N -1.64 4.57 -0.07 7.08 0.04 -1.26 -1.93 135.00 141.79 2o5j s PRO 470 Ca 0.17 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 62.98 2o5j s PRO 470 Cb -0.11 -3.23 0.04 0.00 0.04 0.00 0.00 34.50 31.24 2o5j s PRO 470 CO 0.08 0.06 0.15 0.71 0.04 0.00 0.00 177.00 178.04 2o5j s TYR 471 N -0.50 -0.17 0.19 0.56 4.12 -1.15 -3.66 117.35 116.74 2o5j s TYR 471 Ca 0.49 0.51 -0.15 0.00 0.02 0.00 0.00 57.07 57.94 2o5j s TYR 471 Cb -0.31 -0.12 -0.07 0.00 -1.52 0.00 0.00 41.96 39.94 2o5j s TYR 471 CO 0.38 -0.19 0.60 1.03 0.02 0.00 0.00 175.55 177.39 2o5j s ARG 472 N 1.39 4.01 0.36 -0.62 0.52 0.47 -1.13 118.95 123.94 2o5j s ARG 472 Ca -0.07 0.54 -0.25 0.00 -0.52 0.00 0.00 55.73 55.43 2o5j s ARG 472 Cb -0.12 -2.84 -0.09 0.00 0.52 0.00 0.00 34.95 32.42 2o5j s ARG 472 CO -0.06 0.41 1.02 0.50 0.02 0.00 0.00 175.30 177.19 2o5j s ARG 473 N -2.16 4.36 -0.29 3.54 6.06 -1.08 -0.58 118.95 128.80 2o5j s ARG 473 Ca 0.41 1.48 -0.03 0.00 -2.50 0.00 0.00 55.73 55.10 2o5j s ARG 473 Cb -0.14 -2.70 0.11 0.00 0.06 0.00 0.00 34.95 32.28 2o5j s ARG 473 CO 0.20 0.04 0.19 0.54 -2.50 0.00 0.00 175.30 173.77 2o5j s VAL 474 N -1.59 -0.17 -0.54 7.11 0.11 -0.96 0.51 120.40 124.87 2o5j s VAL 474 Ca 0.54 -0.70 -0.26 0.00 -2.93 0.00 0.00 61.98 58.63 2o5j s VAL 474 Cb -0.22 -0.98 0.03 0.00 -1.53 0.00 0.00 36.38 33.68 2o5j s VAL 474 CO 0.28 -0.65 1.03 -0.69 -3.33 0.00 0.00 175.10 171.74 2o5j s VAL 475 N 2.15 4.27 0.00 2.04 1.01 -0.20 -4.27 120.40 125.40 2o5j s VAL 475 Ca 0.09 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2o5j s VAL 475 Cb -0.15 -4.58 0.00 0.00 0.00 0.00 0.00 36.38 31.64 2o5j s VAL 475 CO -0.35 -1.13 0.00 0.61 0.00 0.00 0.00 175.10 174.24 2o5j n GLY 476 N 5.04 0.77 0.96 4.51 0.00 -1.26 -2.51 105.19 112.69 2o5j n GLY 476 Ca 0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.27 2o5j n GLY 476 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 477 N 0.00 2.06 3.22 -0.02 0.00 -1.26 -4.77 105.19 104.42 2o5j n GLY 477 Ca 0.00 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 2o5j n GLY 477 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 478 N -1.06 2.69 0.05 1.61 1.01 -1.05 -2.23 120.40 121.42 2o5j s VAL 478 Ca 0.11 -0.73 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 2o5j s VAL 478 Cb 0.09 -2.17 -0.06 0.00 0.00 0.00 0.00 36.38 34.23 2o5j s VAL 478 CO 0.03 0.49 0.47 0.68 0.00 0.00 0.00 175.10 176.76 2o5j s VAL 479 N 1.27 4.95 0.23 2.92 -7.23 0.20 -1.04 120.40 121.70 2o5j s VAL 479 Ca 0.03 0.85 0.07 0.00 -1.81 0.00 0.00 61.98 61.13 2o5j s VAL 479 Cb -0.14 -3.74 -0.04 0.00 0.56 0.00 0.00 36.38 33.02 2o5j s VAL 479 CO -0.07 0.47 0.13 -0.89 -0.31 0.00 0.00 175.10 174.43 2o5j s THR 480 N -1.21 4.21 -1.72 5.32 2.01 0.18 -4.52 115.64 119.91 2o5j s THR 480 Ca 0.29 -1.45 0.15 0.00 0.31 0.00 0.00 61.69 60.99 2o5j s THR 480 Cb -0.17 -3.23 0.47 0.00 0.01 0.00 0.00 72.50 69.58 2o5j s THR 480 CO 0.16 -0.29 1.37 0.47 -0.69 0.00 0.00 174.62 175.64 2o5j n ASP 481 N -0.90 3.02 -4.82 3.53 9.92 -1.26 -4.46 116.55 121.57 2o5j n ASP 481 Ca -0.08 -2.12 -0.36 0.00 -0.53 0.00 0.00 54.79 51.70 2o5j n ASP 481 Cb 0.57 -0.39 -0.06 0.00 -0.64 0.00 0.00 41.12 40.60 2o5j n ASP 481 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2o5j s GLU 482 N -1.48 4.15 0.06 -1.24 2.12 -1.26 -5.00 118.70 116.06 2o5j s GLU 482 Ca 0.35 0.71 0.04 0.00 0.36 0.00 0.00 54.97 56.43 2o5j s GLU 482 Cb 0.20 -2.98 -0.03 0.00 0.26 0.00 0.00 34.13 31.58 2o5j s GLU 482 CO 0.21 0.48 -0.12 0.08 -0.54 0.00 0.00 175.26 175.37 2o5j s VAL 483 N -1.41 0.93 -0.23 3.70 1.01 -1.26 -2.64 120.40 120.49 2o5j s VAL 483 Ca 0.38 -1.26 -0.00 0.00 0.00 0.00 0.00 61.98 61.10 2o5j s VAL 483 Cb -0.17 -0.95 0.06 0.00 0.00 0.00 0.00 36.38 35.32 2o5j s VAL 483 CO 0.20 -0.30 -0.02 -0.69 0.00 0.00 0.00 175.10 174.30 2o5j s VAL 484 N -1.39 1.25 -0.27 2.92 1.01 -0.29 -4.95 120.40 118.68 2o5j s VAL 484 Ca -0.04 -1.10 -0.29 0.00 0.00 0.00 0.00 61.98 60.55 2o5j s VAL 484 Cb -0.09 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 2o5j s VAL 484 CO 0.02 -0.19 1.82 -0.31 0.00 0.00 0.00 175.10 176.43 2o5j s TYR 485 N 1.51 1.77 0.07 5.22 1.51 -1.26 -2.95 117.35 123.22 2o5j s TYR 485 Ca -0.03 0.54 0.05 0.00 -1.01 0.00 0.00 57.07 56.62 2o5j s TYR 485 Cb -0.18 -4.07 -0.04 0.00 -0.11 0.00 0.00 41.96 37.56 2o5j s TYR 485 CO -0.08 -3.23 -0.03 -1.64 -1.11 0.00 0.00 175.55 169.46 2o5j s MET 486 N 5.44 2.49 0.65 -0.62 -1.94 -0.81 -4.78 119.30 119.73 2o5j s MET 486 Ca 0.81 -0.83 -0.16 0.00 -1.71 0.00 0.00 55.69 53.80 2o5j s MET 486 Cb -0.25 -2.50 -0.00 0.00 2.01 0.00 0.00 34.83 34.08 2o5j s MET 486 CO 0.33 0.55 1.17 0.99 -0.01 0.00 0.00 175.02 178.06 2o5j s THR 487 N -1.21 2.74 0.39 2.05 2.01 -1.26 -2.63 115.64 117.72 2o5j s THR 487 Ca 0.23 0.39 0.13 0.00 0.31 0.00 0.00 61.69 62.75 2o5j s THR 487 Cb -0.11 -3.00 0.12 0.00 0.01 0.00 0.00 72.50 69.51 2o5j s THR 487 CO 0.15 -0.16 1.87 0.00 -0.69 0.00 0.00 174.62 175.78 2o5j h ALA 488 N 0.27 1.47 -0.06 7.40 0.00 -1.81 -2.53 119.26 123.98 2o5j h ALA 488 Ca -0.48 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 2o5j h ALA 488 Cb 1.28 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2o5j h ALA 488 CO 0.53 0.40 -0.04 1.79 0.00 0.00 0.00 179.25 181.94 2o5j h THR 489 N 0.01 1.34 -0.17 0.00 1.35 -1.84 -3.15 112.91 110.44 2o5j h THR 489 Ca -0.00 -1.07 0.01 0.00 -0.55 0.00 0.00 66.41 64.80 2o5j h THR 489 Cb 0.57 1.93 -0.01 0.00 -1.73 0.00 0.00 68.15 68.90 2o5j h THR 489 CO 0.04 0.29 0.12 -0.33 -0.25 0.00 0.00 175.52 175.39 2o5j h GLU 490 N -0.26 0.19 -0.27 4.72 5.08 -1.92 -2.79 114.58 119.32 2o5j h GLU 490 Ca 0.01 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2o5j h GLU 490 Cb 0.49 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2o5j h GLU 490 CO 0.01 0.12 0.18 1.49 -1.00 0.00 0.00 179.01 179.81 2o5j h GLU 491 N 0.19 0.31 0.00 2.33 4.22 -1.41 -2.10 114.58 118.13 2o5j h GLU 491 Ca 0.07 -0.02 -0.06 0.00 0.08 0.00 0.00 59.36 59.43 2o5j h GLU 491 Cb 0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2o5j h GLU 491 CO -0.01 0.21 -0.28 -0.44 -2.18 0.00 0.00 179.01 176.30 2o5j h ASP 492 N 0.32 0.00 0.80 1.04 5.19 -1.61 -3.03 116.42 119.14 2o5j h ASP 492 Ca 0.10 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 2o5j h ASP 492 Cb 0.02 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.53 2o5j h ASP 492 CO -0.02 0.28 -0.03 0.03 -3.12 0.00 0.00 179.24 176.37 2o5j h ARG 493 N 0.00 0.00 -6.10 3.56 3.08 -1.52 -3.43 114.38 109.98 2o5j h ARG 493 Ca -0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.47 2o5j h ARG 493 Cb 0.90 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.85 2o5j h ARG 493 CO 0.04 0.03 -0.63 0.71 -1.07 0.00 0.00 179.97 179.05 2o5j s TYR 494 N -3.78 2.58 -0.52 3.04 1.51 -1.14 -5.09 117.35 113.94 2o5j s TYR 494 Ca -0.00 -0.36 -0.17 0.00 -1.01 0.00 0.00 57.07 55.53 2o5j s TYR 494 Cb 0.10 -1.39 0.10 0.00 -0.11 0.00 0.00 41.96 40.66 2o5j s TYR 494 CO 0.54 0.52 0.53 0.99 -1.11 0.00 0.00 175.55 177.01 2o5j s THR 495 N -2.45 5.09 0.13 -0.71 2.01 -1.26 -4.62 115.64 113.82 2o5j s THR 495 Ca 0.34 -1.11 0.04 0.00 0.31 0.00 0.00 61.69 61.27 2o5j s THR 495 Cb -0.03 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 2o5j s THR 495 CO 0.20 -0.82 0.14 -0.63 -0.69 0.00 0.00 174.62 172.82 2o5j s ILE 496 N 1.98 4.69 0.31 1.82 1.09 -1.23 -2.49 121.20 127.36 2o5j s ILE 496 Ca 0.07 -0.87 0.11 0.00 -1.10 0.00 0.00 60.65 58.86 2o5j s ILE 496 Cb -0.25 -3.34 -0.06 0.00 -1.06 0.00 0.00 42.46 37.74 2o5j s ILE 496 CO 0.06 -0.01 -0.15 0.00 -0.10 0.00 0.00 174.94 174.75 2o5j s ALA 497 N -1.61 2.82 0.86 9.38 0.00 0.11 0.91 121.76 134.24 2o5j s ALA 497 Ca 0.31 -1.98 -0.12 0.00 0.00 0.00 0.00 51.96 50.17 2o5j s ALA 497 Cb -0.11 -0.14 0.11 0.00 0.00 0.00 0.00 23.12 22.98 2o5j s ALA 497 CO 0.24 0.17 1.16 -1.14 0.00 0.00 0.00 175.76 176.19 2o5j s GLN 498 N -3.57 1.52 0.34 0.00 -0.44 -1.23 -0.06 119.66 116.22 2o5j s GLN 498 Ca 0.31 0.21 0.21 0.00 -2.50 0.00 0.00 55.36 53.59 2o5j s GLN 498 Cb -0.01 -1.89 0.19 0.00 -1.64 0.00 0.00 33.01 29.66 2o5j s GLN 498 CO 0.15 -1.92 1.42 0.00 0.50 0.00 0.00 175.29 175.44 2o5j h ALA 499 N -1.30 0.82 0.00 1.58 0.00 -1.94 -3.29 119.26 115.13 2o5j h ALA 499 Ca -0.48 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2o5j h ALA 499 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2o5j h ALA 499 CO 0.64 0.17 0.00 0.09 0.00 0.00 0.00 179.25 180.15 2o5j n ASN 500 N -3.03 0.00 -4.69 0.00 5.03 -1.26 -4.79 115.26 106.53 2o5j n ASN 500 Ca 0.02 0.46 -0.43 0.00 0.87 0.00 0.00 54.58 55.50 2o5j n ASN 500 Cb 0.59 -0.48 -0.03 0.00 -1.02 0.00 0.00 39.78 38.84 2o5j n ASN 500 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2o5j n THR 501 N -1.48 0.37 -1.69 3.41 -2.24 -1.24 -4.90 114.28 106.52 2o5j n THR 501 Ca 0.02 -0.07 -0.44 0.00 -2.27 0.00 0.00 64.05 61.29 2o5j n THR 501 Cb 0.09 -2.05 -0.04 0.00 -2.10 0.00 0.00 70.33 66.24 2o5j n THR 501 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2o5j n PRO 502 N 5.60 2.48 -4.24 -0.78 -0.02 -1.26 -4.90 135.00 131.87 2o5j n PRO 502 Ca 0.18 0.90 -0.18 0.00 -2.02 0.00 0.00 63.50 62.39 2o5j n PRO 502 Cb 0.36 -2.74 -0.15 0.00 -0.02 0.00 0.00 33.50 30.95 2o5j n PRO 502 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2o5j s LEU 503 N 2.10 1.90 0.00 2.45 0.20 -1.26 -0.62 118.68 123.45 2o5j s LEU 503 Ca 0.82 -0.13 0.25 0.00 0.69 0.00 0.00 54.13 55.76 2o5j s LEU 503 Cb -0.58 -0.37 0.48 0.00 -0.43 0.00 0.00 46.19 45.29 2o5j s LEU 503 CO 0.39 0.06 1.42 -0.62 -0.29 0.00 0.00 176.35 177.31 2o5j n GLU 504 N 3.10 1.97 0.00 1.98 -0.58 -0.90 -4.97 120.64 121.24 2o5j n GLU 504 Ca -0.15 -1.49 0.00 0.00 -0.42 0.00 0.00 57.16 55.10 2o5j n GLU 504 Cb 0.56 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2o5j n GLU 504 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2o5j n GLY 505 N 1.30 0.33 0.04 0.62 0.00 -1.26 -4.76 105.19 101.45 2o5j n GLY 505 Ca 0.15 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 46.17 2o5j n GLY 505 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2o5j n ASN 506 N 0.00 0.46 -4.64 1.61 4.13 -1.26 -4.71 115.26 110.84 2o5j n ASN 506 Ca 0.00 -0.73 -0.38 0.00 1.68 0.00 0.00 54.58 55.15 2o5j n ASN 506 Cb 0.00 0.87 -0.09 0.00 -1.54 0.00 0.00 39.78 39.02 2o5j n ASN 506 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2o5j s ARG 507 N -1.47 4.07 0.76 3.52 6.06 -1.25 0.59 118.95 131.23 2o5j s ARG 507 Ca 0.03 -0.10 -0.15 0.00 -2.50 0.00 0.00 55.73 53.01 2o5j s ARG 507 Cb 0.05 -3.58 0.03 0.00 0.06 0.00 0.00 34.95 31.52 2o5j s ARG 507 CO 0.24 -0.06 1.03 -0.89 -2.50 0.00 0.00 175.30 173.12 2o5j n ILE 508 N 4.55 2.50 0.11 4.11 2.08 -0.94 -2.11 119.36 129.65 2o5j n ILE 508 Ca -0.12 -0.31 0.02 0.00 0.56 0.00 0.00 62.75 62.89 2o5j n ILE 508 Cb 0.52 -1.13 -0.02 0.00 -0.75 0.00 0.00 39.64 38.26 2o5j n ILE 508 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2o5j n ALA 509 N -2.80 2.33 -3.28 -1.39 0.00 0.21 -4.80 120.51 110.78 2o5j n ALA 509 Ca 0.13 -0.09 -0.21 0.00 0.00 0.00 0.00 53.44 53.27 2o5j n ALA 509 Cb 0.50 -0.12 -0.16 0.00 0.00 0.00 0.00 19.45 19.67 2o5j n ALA 509 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2o5j s ALA 510 N -1.60 0.90 0.11 0.00 0.00 -1.26 -5.02 121.76 114.89 2o5j s ALA 510 Ca 0.00 -0.28 -0.31 0.00 0.00 0.00 0.00 51.96 51.38 2o5j s ALA 510 Cb 0.02 -0.40 -0.10 0.00 0.00 0.00 0.00 23.12 22.64 2o5j s ALA 510 CO 0.14 0.10 1.59 0.93 0.00 0.00 0.00 175.76 178.52 2o5j h GLU 511 N 6.71 -0.64 -4.87 0.00 5.08 -1.94 -3.25 114.58 115.66 2o5j h GLU 511 Ca -0.34 0.04 -0.71 0.00 -1.00 0.00 0.00 59.36 57.35 2o5j h GLU 511 Cb 1.17 0.14 -0.18 0.00 0.50 0.00 0.00 28.75 30.38 2o5j h GLU 511 CO 0.48 -0.43 0.98 1.03 -1.00 0.00 0.00 179.01 180.08 2o5j s ARG 512 N -5.93 3.78 0.04 2.33 0.52 -1.26 -3.53 118.95 114.88 2o5j s ARG 512 Ca -0.16 -2.09 0.08 0.00 -0.52 0.00 0.00 55.73 53.04 2o5j s ARG 512 Cb 0.07 -4.95 -0.03 0.00 0.52 0.00 0.00 34.95 30.56 2o5j s ARG 512 CO 0.63 -1.75 -0.22 0.54 0.02 0.00 0.00 175.30 174.53 2o5j s VAL 513 N 2.17 2.49 0.34 3.52 0.11 -0.96 -4.97 120.40 123.09 2o5j s VAL 513 Ca 0.36 -1.25 -0.29 0.00 -2.93 0.00 0.00 61.98 57.87 2o5j s VAL 513 Cb -0.04 -2.00 -0.10 0.00 -1.53 0.00 0.00 36.38 32.70 2o5j s VAL 513 CO -0.06 0.37 1.37 0.68 -3.33 0.00 0.00 175.10 174.13 2o5j s VAL 514 N -0.85 2.51 0.08 2.04 -7.23 -1.26 -2.20 120.40 113.50 2o5j s VAL 514 Ca 0.13 0.51 -0.22 0.00 -1.81 0.00 0.00 61.98 60.59 2o5j s VAL 514 Cb -0.10 -3.32 0.06 0.00 0.56 0.00 0.00 36.38 33.57 2o5j s VAL 514 CO 0.03 0.12 0.53 0.00 -0.31 0.00 0.00 175.10 175.48 2o5j s ALA 515 N -1.03 -1.37 -0.27 1.32 0.00 -0.22 -3.47 121.76 116.71 2o5j s ALA 515 Ca 0.51 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.99 2o5j s ALA 515 Cb -0.42 0.54 0.08 0.00 0.00 0.00 0.00 23.12 23.32 2o5j s ALA 515 CO 0.55 -0.59 0.03 1.03 0.00 0.00 0.00 175.76 176.78 2o5j s ARG 516 N -2.93 1.18 0.00 0.00 1.81 0.26 0.26 118.95 119.54 2o5j s ARG 516 Ca -0.03 -1.11 0.00 0.00 -1.72 0.00 0.00 55.73 52.88 2o5j s ARG 516 Cb -0.00 -2.44 0.00 0.00 -0.45 0.00 0.00 34.95 32.06 2o5j s ARG 516 CO -0.06 -0.79 0.63 -2.13 -0.68 0.00 0.00 175.30 172.27 2o5j n ARG 517 N 4.70 0.00 -3.48 3.54 0.63 -1.16 -3.55 116.66 117.35 2o5j n ARG 517 Ca -0.06 0.37 -0.27 0.00 -0.92 0.00 0.00 57.85 56.98 2o5j n ARG 517 Cb 0.43 -1.13 -0.13 0.00 0.45 0.00 0.00 32.46 32.09 2o5j n ARG 517 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2o5j s LYS 518 N -1.52 0.37 -0.91 -0.14 1.02 -1.26 -4.62 119.74 112.68 2o5j s LYS 518 Ca 0.00 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.19 2o5j s LYS 518 Cb 0.00 -1.11 0.00 0.00 -0.52 0.00 0.00 37.83 36.20 2o5j s LYS 518 CO 0.00 -1.11 0.00 0.41 -0.92 0.00 0.00 175.35 173.73 2o5j n GLY 519 N 4.74 0.82 2.97 -3.33 0.00 -1.26 -4.91 105.19 104.22 2o5j n GLY 519 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 2o5j n GLY 519 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5j s GLU 520 N -2.47 1.81 0.14 1.61 0.41 -1.26 -5.10 118.70 113.83 2o5j s GLU 520 Ca 0.00 -0.39 -0.31 0.00 -0.41 0.00 0.00 54.97 53.86 2o5j s GLU 520 Cb 0.00 -1.70 -0.11 0.00 -1.78 0.00 0.00 34.13 30.55 2o5j s GLU 520 CO 0.00 -0.18 1.83 -2.14 -0.49 0.00 0.00 175.26 174.28 2o5j s PRO 521 N 1.36 4.13 -0.02 0.39 0.02 -1.26 -2.96 135.00 136.67 2o5j s PRO 521 Ca -0.00 2.62 -0.00 0.00 0.02 0.00 0.00 61.00 63.63 2o5j s PRO 521 Cb -0.14 -3.54 0.02 0.00 0.02 0.00 0.00 34.50 30.87 2o5j s PRO 521 CO -0.06 -0.84 0.02 0.08 -0.33 0.00 0.00 177.00 175.88 2o5j s VAL 522 N 2.57 -0.05 -0.75 3.83 1.01 0.14 -4.94 120.40 122.21 2o5j s VAL 522 Ca 0.81 0.17 -0.23 0.00 0.00 0.00 0.00 61.98 62.73 2o5j s VAL 522 Cb -0.47 -0.07 0.07 0.00 0.00 0.00 0.00 36.38 35.91 2o5j s VAL 522 CO 0.36 0.07 1.12 -0.51 0.00 0.00 0.00 175.10 176.14 2o5j s ILE 523 N 0.84 4.17 0.37 2.22 2.07 -1.26 -1.06 121.20 128.56 2o5j s ILE 523 Ca -0.07 -0.35 0.05 0.00 -1.41 0.00 0.00 60.65 58.87 2o5j s ILE 523 Cb -0.10 -4.80 -0.01 0.00 0.13 0.00 0.00 42.46 37.68 2o5j s ILE 523 CO -0.02 -1.62 0.53 -0.69 -1.91 0.00 0.00 174.94 171.22 2o5j s VAL 524 N 4.43 3.95 0.15 4.00 1.01 -0.93 -4.91 120.40 128.10 2o5j s VAL 524 Ca 0.29 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 2o5j s VAL 524 Cb -0.11 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 2o5j s VAL 524 CO 0.07 -0.18 0.35 -0.94 0.00 0.00 0.00 175.10 174.39 2o5j s SER 525 N -4.20 6.42 0.59 3.32 1.04 -1.26 -2.27 113.70 117.35 2o5j s SER 525 Ca 0.47 0.45 0.29 0.00 0.48 0.00 0.00 55.95 57.63 2o5j s SER 525 Cb -0.10 -2.03 1.44 0.00 0.10 0.00 0.00 66.02 65.43 2o5j s SER 525 CO 0.33 0.04 1.85 -0.65 0.98 0.00 0.00 173.24 175.79 2o5j h PRO 526 N 2.58 0.00 0.00 4.02 0.11 -1.79 0.30 132.00 137.22 2o5j h PRO 526 Ca -0.46 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 2o5j h PRO 526 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2o5j h PRO 526 CO 0.72 0.00 -0.55 1.05 -0.21 0.00 0.00 178.00 179.00 2o5j h GLU 527 N 0.00 0.00 0.00 1.05 -0.00 -1.92 -3.18 114.58 110.53 2o5j h GLU 527 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.59 2o5j h GLU 527 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.06 2o5j h GLU 527 CO -0.00 0.55 -1.10 0.39 -0.00 0.00 0.00 179.01 178.85 2o5j n GLU 528 N -3.55 0.40 -1.56 1.06 1.02 0.07 -4.76 120.64 113.32 2o5j n GLU 528 Ca -0.00 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 2o5j n GLU 528 Cb 0.63 -1.65 -0.09 0.00 -0.02 0.00 0.00 31.44 30.32 2o5j n GLU 528 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2o5j n VAL 529 N -2.17 0.00 0.08 2.62 0.31 -1.06 -4.74 118.33 113.37 2o5j n VAL 529 Ca 0.01 -0.37 -0.17 0.00 -0.01 0.00 0.00 64.34 63.81 2o5j n VAL 529 Cb 0.48 -1.90 -0.09 0.00 -0.91 0.00 0.00 33.84 31.41 2o5j n VAL 529 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2o5j h GLU 530 N 12.32 0.46 -3.75 5.55 5.08 -1.67 -3.43 114.58 129.14 2o5j h GLU 530 Ca 0.00 -0.57 -0.13 0.00 -1.00 0.00 0.00 59.36 57.66 2o5j h GLU 530 Cb 1.00 0.18 -0.18 0.00 0.50 0.00 0.00 28.75 30.25 2o5j h GLU 530 CO 1.02 1.22 -0.52 -0.06 -1.00 0.00 0.00 179.01 179.66 2o5j s PHE 531 N -3.07 0.17 0.12 4.33 0.08 -1.09 -2.26 117.98 116.26 2o5j s PHE 531 Ca -0.07 -0.43 0.08 0.00 0.12 0.00 0.00 56.93 56.64 2o5j s PHE 531 Cb 0.07 -0.12 -0.04 0.00 -0.57 0.00 0.00 43.02 42.36 2o5j s PHE 531 CO 0.89 -0.34 -0.20 1.41 -0.10 0.00 0.00 175.22 176.88 2o5j s MET 532 N -2.30 1.16 0.80 0.44 -2.45 0.25 0.07 119.30 117.27 2o5j s MET 532 Ca -0.08 -1.22 -0.12 0.00 -1.25 0.00 0.00 55.69 53.02 2o5j s MET 532 Cb -0.03 -1.38 0.08 0.00 1.25 0.00 0.00 34.83 34.75 2o5j s MET 532 CO -0.03 0.31 1.15 -0.51 1.05 0.00 0.00 175.02 176.99 2o5j s ASP 533 N -2.10 3.91 -0.13 1.11 1.11 0.91 -0.40 116.67 121.08 2o5j s ASP 533 Ca 0.09 2.13 -0.23 0.00 0.18 0.00 0.00 52.55 54.72 2o5j s ASP 533 Cb -0.09 -2.56 -0.26 0.00 1.07 0.00 0.00 42.92 41.08 2o5j s ASP 533 CO 0.05 -2.44 0.63 0.58 1.18 0.00 0.00 175.17 175.17 2o5j h VAL 534 N -1.02 1.39 -2.10 -1.27 2.07 -1.91 -3.41 116.25 109.99 2o5j h VAL 534 Ca -0.45 -2.36 0.13 0.00 0.82 0.00 0.00 66.70 64.84 2o5j h VAL 534 Cb 1.27 2.96 -0.16 0.00 -1.52 0.00 0.00 31.29 33.83 2o5j h VAL 534 CO 0.48 0.59 0.54 -0.94 0.02 0.00 0.00 177.57 178.26 2o5j s SER 535 N -6.68 -0.33 0.48 0.57 1.04 -1.26 -4.72 113.70 102.80 2o5j s SER 535 Ca -0.20 0.04 0.15 0.00 0.48 0.00 0.00 55.95 56.41 2o5j s SER 535 Cb 0.01 0.34 1.12 0.00 0.10 0.00 0.00 66.02 67.60 2o5j s SER 535 CO 0.71 -0.54 2.08 -0.65 0.98 0.00 0.00 173.24 175.82 2o5j h PRO 536 N 2.05 0.05 -0.29 4.02 0.11 -1.99 -3.06 132.00 132.89 2o5j h PRO 536 Ca -0.20 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 2o5j h PRO 536 Cb 1.22 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2o5j h PRO 536 CO 0.30 0.11 0.18 0.87 -0.21 0.00 0.00 178.00 179.25 2o5j h LYS 537 N 0.05 0.39 -1.08 1.05 6.56 -1.96 -3.03 116.57 118.55 2o5j h LYS 537 Ca 0.01 -0.03 0.29 0.00 -1.06 0.00 0.00 60.65 59.87 2o5j h LYS 537 Cb 0.13 -0.08 -0.11 0.00 -0.57 0.00 0.00 32.23 31.60 2o5j h LYS 537 CO 0.01 0.29 0.68 -0.56 -2.06 0.00 0.00 179.45 177.81 2o5j h GLN 538 N 0.38 0.35 -0.97 3.15 -0.00 -1.92 0.23 115.11 116.33 2o5j h GLN 538 Ca 0.11 -0.02 0.17 0.00 -0.00 0.00 0.00 58.65 58.90 2o5j h GLN 538 Cb -0.01 -0.08 -0.10 0.00 -0.00 0.00 0.00 27.48 27.29 2o5j h GLN 538 CO -0.02 0.23 0.57 0.28 -0.00 0.00 0.00 178.83 179.89 2o5j h VAL 539 N 0.36 0.75 -0.53 1.86 2.07 -1.70 -3.16 116.25 115.90 2o5j h VAL 539 Ca 0.65 -0.26 -0.60 0.00 0.82 0.00 0.00 66.70 67.30 2o5j h VAL 539 Cb 1.66 -0.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.28 2o5j h VAL 539 CO -0.36 0.14 -0.33 -0.36 0.02 0.00 0.00 177.57 176.68 2o5j s PHE 540 N -5.90 1.65 0.70 1.57 2.99 0.82 -3.68 117.98 116.12 2o5j s PHE 540 Ca -0.12 -0.86 -0.05 0.00 0.00 0.00 0.00 56.93 55.91 2o5j s PHE 540 Cb 0.24 -1.87 0.08 0.00 0.00 0.00 0.00 43.02 41.46 2o5j s PHE 540 CO 0.80 -0.38 0.99 0.45 -0.00 0.00 0.00 175.22 177.08 2o5j s SER 541 N -4.23 4.68 0.07 1.36 0.15 -1.26 0.13 113.70 114.61 2o5j s SER 541 Ca 0.30 0.21 -0.31 0.00 0.70 0.00 0.00 55.95 56.85 2o5j s SER 541 Cb -0.02 -0.81 -0.18 0.00 -1.71 0.00 0.00 66.02 63.30 2o5j s SER 541 CO 0.19 -1.65 1.62 0.58 1.20 0.00 0.00 173.24 175.17 2o5j h VAL 542 N -0.55 0.45 -0.66 4.45 2.07 -1.83 0.70 116.25 120.89 2o5j h VAL 542 Ca -0.43 -0.03 0.13 0.00 0.82 0.00 0.00 66.70 67.19 2o5j h VAL 542 Cb 1.30 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 2o5j h VAL 542 CO 0.53 0.01 0.45 -1.13 0.02 0.00 0.00 177.57 177.45 2o5j h ASN 543 N -0.76 0.33 0.57 0.57 -0.00 -1.93 -1.79 115.58 112.56 2o5j h ASN 543 Ca -0.08 0.01 -0.29 0.00 -0.00 0.00 0.00 56.30 55.95 2o5j h ASN 543 Cb 0.58 -0.05 -0.00 0.00 -0.00 0.00 0.00 38.32 38.84 2o5j h ASN 543 CO 0.12 0.18 -1.36 0.71 -0.00 0.00 0.00 177.43 177.08 2o5j h THR 544 N 0.36 1.35 0.00 -3.57 1.35 -1.85 -3.25 112.91 107.30 2o5j h THR 544 Ca 0.32 -2.96 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 2o5j h THR 544 Cb 0.74 2.86 0.00 0.00 -1.73 0.00 0.00 68.15 70.02 2o5j h THR 544 CO -0.09 0.86 0.00 -3.20 -0.25 0.00 0.00 175.52 172.84 2o5j n ASN 545 N -3.48 0.00 -0.34 5.36 2.85 0.21 -1.20 115.26 118.66 2o5j n ASN 545 Ca -0.12 0.31 0.11 0.00 -0.11 0.00 0.00 54.58 54.77 2o5j n ASN 545 Cb 1.03 -0.34 0.47 0.00 1.24 0.00 0.00 39.78 42.18 2o5j n ASN 545 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2o5j n LEU 546 N -1.34 1.02 -4.67 1.20 4.77 -1.20 -4.71 117.00 112.07 2o5j n LEU 546 Ca 0.01 -0.42 -0.40 0.00 -0.03 0.00 0.00 56.01 55.17 2o5j n LEU 546 Cb 0.02 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.00 2o5j n LEU 546 CO 0.02 0.21 0.45 -0.63 -1.33 0.00 0.00 177.39 176.11 2o5j s ILE 547 N -1.88 4.98 0.00 -0.08 1.01 -0.34 -4.61 121.20 120.28 2o5j s ILE 547 Ca 0.32 1.34 0.00 0.00 0.00 0.00 0.00 60.65 62.30 2o5j s ILE 547 Cb 0.16 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.62 2o5j s ILE 547 CO 0.25 0.09 0.00 -2.65 0.00 0.00 0.00 174.94 172.64 2o5j n PRO 548 N 5.05 0.00 -2.64 2.79 -0.02 -1.26 -3.70 135.00 135.21 2o5j n PRO 548 Ca 0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.06 2o5j n PRO 548 Cb 0.49 -0.22 0.01 0.00 -0.02 0.00 0.00 33.50 33.76 2o5j n PRO 548 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2o5j n PHE 549 N 0.00 2.55 0.33 6.00 3.72 -1.26 -4.49 117.46 124.31 2o5j n PHE 549 Ca 0.00 -2.66 0.22 0.00 -0.05 0.00 0.00 57.45 54.95 2o5j n PHE 549 Cb 0.00 -1.56 1.17 0.00 -0.94 0.00 0.00 39.48 38.15 2o5j n PHE 549 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2o5j h LEU 550 N 6.27 0.00 -1.59 4.37 5.85 -1.75 -1.56 115.31 126.89 2o5j h LEU 550 Ca 0.34 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.01 2o5j h LEU 550 Cb 0.57 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2o5j h LEU 550 CO 1.45 0.00 -0.22 1.05 -0.34 0.00 0.00 178.44 180.38 2o5j h GLU 551 N 0.00 0.00 -0.20 1.25 4.11 -1.86 -2.96 114.58 114.92 2o5j h GLU 551 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2o5j h GLU 551 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2o5j h GLU 551 CO 0.00 0.22 0.00 0.72 0.07 0.00 0.00 179.01 180.02 2o5j n HIS 552 N -3.98 0.24 -4.34 2.06 8.25 -0.59 -4.94 115.22 111.92 2o5j n HIS 552 Ca -0.02 -0.13 -0.34 0.00 -0.26 0.00 0.00 57.72 56.97 2o5j n HIS 552 Cb 0.30 -0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.32 2o5j n HIS 552 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2o5j s ASP 553 N -1.68 5.23 0.01 0.41 1.01 -1.12 -2.93 116.67 117.60 2o5j s ASP 553 Ca 0.32 0.11 -0.30 0.00 0.71 0.00 0.00 52.55 53.39 2o5j s ASP 553 Cb 0.21 -1.44 -0.07 0.00 1.01 0.00 0.00 42.92 42.62 2o5j s ASP 553 CO 0.30 0.35 1.68 -0.62 0.21 0.00 0.00 175.17 177.08 2o5j s ASP 554 N -1.10 6.63 0.23 0.27 2.15 0.14 -4.84 116.67 120.15 2o5j s ASP 554 Ca 0.15 2.38 -0.01 0.00 0.43 0.00 0.00 52.55 55.50 2o5j s ASP 554 Cb -0.11 -2.55 0.51 0.00 -0.30 0.00 0.00 42.92 40.47 2o5j s ASP 554 CO 0.05 -0.91 1.17 0.00 -0.17 0.00 0.00 175.17 175.30 2o5j n ALA 555 N 6.49 0.32 -0.19 3.66 0.00 -1.26 0.27 120.51 129.81 2o5j n ALA 555 Ca 0.17 0.81 -0.09 0.00 0.00 0.00 0.00 53.44 54.33 2o5j n ALA 555 Cb 0.42 -0.56 0.01 0.00 0.00 0.00 0.00 19.45 19.32 2o5j n ALA 555 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2o5j h ASN 556 N 0.00 0.82 1.44 0.00 -1.24 -1.97 -1.97 115.58 112.67 2o5j h ASN 556 Ca 0.43 -0.24 0.00 0.00 0.71 0.00 0.00 56.30 57.19 2o5j h ASN 556 Cb 0.82 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 39.65 2o5j h ASN 556 CO -0.72 0.86 0.00 0.03 -1.29 0.00 0.00 177.43 176.31 2o5j h ARG 557 N 0.75 0.00 0.00 6.67 2.47 -0.51 -2.86 114.38 120.90 2o5j h ARG 557 Ca 0.16 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.68 2o5j h ARG 557 Cb 0.37 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.68 2o5j h ARG 557 CO 0.01 0.00 -0.89 0.00 0.56 0.00 0.00 179.97 179.64 2o5j h ALA 558 N 2.05 0.48 -0.19 0.04 0.00 -0.66 -3.17 119.26 117.81 2o5j h ALA 558 Ca 0.00 -0.72 0.05 0.00 0.00 0.00 0.00 54.91 54.24 2o5j h ALA 558 Cb 0.72 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.38 2o5j h ALA 558 CO 0.00 0.90 -0.34 1.25 0.00 0.00 0.00 179.25 181.06 2o5j h LEU 559 N 0.13 -1.06 -1.31 0.00 6.46 -1.13 0.85 115.31 119.26 2o5j h LEU 559 Ca -0.05 0.16 0.24 0.00 -0.12 0.00 0.00 57.88 58.10 2o5j h LEU 559 Cb 1.52 0.46 -0.09 0.00 -0.73 0.00 0.00 40.66 41.82 2o5j h LEU 559 CO 0.14 -0.36 0.64 0.24 -0.62 0.00 0.00 178.44 178.48 2o5j h MET 560 N -0.38 0.47 0.49 1.25 2.86 -1.62 0.14 114.93 118.14 2o5j h MET 560 Ca 0.11 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.70 2o5j h MET 560 Cb 0.55 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2o5j h MET 560 CO -0.40 0.31 -0.24 0.78 1.06 0.00 0.00 176.91 178.42 2o5j h GLY 561 N 0.48 -0.69 0.81 8.32 0.00 -0.87 0.44 103.07 111.55 2o5j h GLY 561 Ca 0.57 0.26 0.04 0.00 0.00 0.00 0.00 47.33 48.19 2o5j h GLY 561 CO -0.29 -0.25 0.33 0.23 0.00 0.00 0.00 176.54 176.55 2o5j h SER 562 N -0.76 0.52 -0.40 0.19 0.87 0.52 -2.27 113.55 112.21 2o5j h SER 562 Ca -0.07 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2o5j h SER 562 Cb 0.55 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 2o5j h SER 562 CO 0.11 0.36 0.25 0.78 -0.53 0.00 0.00 176.83 177.80 2o5j h ASN 563 N 0.64 0.48 -0.91 6.23 4.21 -0.69 -2.73 115.58 122.81 2o5j h ASN 563 Ca 0.24 -0.05 0.14 0.00 1.21 0.00 0.00 56.30 57.84 2o5j h ASN 563 Cb 0.07 -0.12 -0.09 0.00 -1.12 0.00 0.00 38.32 37.06 2o5j h ASN 563 CO -0.13 0.38 0.52 0.00 -1.29 0.00 0.00 177.43 176.92 2o5j h MET 564 N 0.54 0.75 -0.64 0.81 -0.00 0.45 -1.12 114.93 115.70 2o5j h MET 564 Ca 0.15 -0.04 0.04 0.00 -0.00 0.00 0.00 59.70 59.84 2o5j h MET 564 Cb -0.01 -0.17 -0.05 0.00 -0.00 0.00 0.00 31.60 31.37 2o5j h MET 564 CO -0.03 0.49 0.37 1.96 -0.00 0.00 0.00 176.91 179.71 2o5j h GLN 565 N 0.77 0.69 0.00 -0.10 4.20 -1.16 0.21 115.11 119.73 2o5j h GLN 565 Ca 0.48 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.15 2o5j h GLN 565 Cb 0.62 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.24 2o5j h GLN 565 CO -0.32 0.46 0.04 2.41 -0.67 0.00 0.00 178.83 180.74 2o5j n THR 566 N -4.76 1.65 -0.86 -0.54 -1.04 -0.43 -0.75 114.28 107.54 2o5j n THR 566 Ca 0.07 0.56 0.08 0.00 -2.04 0.00 0.00 64.05 62.72 2o5j n THR 566 Cb 0.13 -1.56 0.17 0.00 -1.82 0.00 0.00 70.33 67.26 2o5j n THR 566 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2o5j n GLN 567 N -1.64 2.22 -2.44 -2.82 1.13 0.72 -4.38 117.38 110.17 2o5j n GLN 567 Ca -0.00 -2.53 -0.42 0.00 -1.94 0.00 0.00 57.00 52.10 2o5j n GLN 567 Cb 0.05 -1.57 -0.03 0.00 0.11 0.00 0.00 30.24 28.80 2o5j n GLN 567 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2o5j s ALA 568 N -2.52 3.44 -0.03 -1.58 0.00 0.07 0.23 121.76 121.36 2o5j s ALA 568 Ca 0.32 0.73 -0.15 0.00 0.00 0.00 0.00 51.96 52.86 2o5j s ALA 568 Cb 0.26 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 2o5j s ALA 568 CO 0.06 -0.60 0.42 0.54 0.00 0.00 0.00 175.76 176.17 2o5j s VAL 569 N 1.67 5.06 -0.13 0.00 0.11 -0.87 -3.53 120.40 122.72 2o5j s VAL 569 Ca 0.57 0.85 -0.29 0.00 -2.93 0.00 0.00 61.98 60.18 2o5j s VAL 569 Cb -0.27 -3.73 -0.05 0.00 -1.53 0.00 0.00 36.38 30.80 2o5j s VAL 569 CO 0.26 0.52 1.89 -2.84 -3.33 0.00 0.00 175.10 171.60 2o5j s PRO 570 N -0.68 3.74 0.07 1.54 0.02 -1.24 -4.68 135.00 133.77 2o5j s PRO 570 Ca 0.24 2.08 -0.18 0.00 0.02 0.00 0.00 61.00 63.16 2o5j s PRO 570 Cb -0.16 -4.16 -0.07 0.00 0.02 0.00 0.00 34.50 30.13 2o5j s PRO 570 CO 0.12 -1.38 0.54 -0.51 -0.33 0.00 0.00 177.00 175.44 2o5j s LEU 571 N 5.74 4.51 0.30 -5.54 1.02 -1.26 -3.76 118.68 119.70 2o5j s LEU 571 Ca 0.85 1.21 0.06 0.00 0.02 0.00 0.00 54.13 56.26 2o5j s LEU 571 Cb -0.33 -2.87 0.73 0.00 0.02 0.00 0.00 46.19 43.74 2o5j s LEU 571 CO 0.35 0.27 1.78 0.16 0.02 0.00 0.00 176.35 178.93 2o5j h ILE 572 N 3.52 0.72 -2.96 -0.59 3.07 -1.49 -3.22 117.51 116.57 2o5j h ILE 572 Ca -0.50 -0.27 -0.72 0.00 1.55 0.00 0.00 64.86 64.92 2o5j h ILE 572 Cb 1.21 -0.13 -0.21 0.00 -0.27 0.00 0.00 36.82 37.43 2o5j h ILE 572 CO 0.63 0.14 0.02 -0.60 -1.05 0.00 0.00 178.15 177.30 2o5j s ARG 573 N -5.86 3.03 -0.18 0.16 3.52 -1.26 -5.04 118.95 113.32 2o5j s ARG 573 Ca -0.11 -1.44 -0.15 0.00 -0.13 0.00 0.00 55.73 53.89 2o5j s ARG 573 Cb 0.25 -4.28 -0.04 0.00 -1.56 0.00 0.00 34.95 29.31 2o5j s ARG 573 CO 0.80 -1.48 0.35 0.00 -0.81 0.00 0.00 175.30 174.16 2o5j s ALA 574 N 2.36 3.57 -0.10 6.12 0.00 -1.22 -4.84 121.76 127.64 2o5j s ALA 574 Ca 0.09 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.56 2o5j s ALA 574 Cb -0.26 -2.52 0.02 0.00 0.00 0.00 0.00 23.12 20.36 2o5j s ALA 574 CO 0.05 -0.12 -0.11 -1.14 0.00 0.00 0.00 175.76 174.44 2o5j s GLN 575 N 0.91 1.82 0.73 0.00 0.74 -1.23 -4.12 119.66 118.51 2o5j s GLN 575 Ca 0.18 -0.40 -0.13 0.00 0.05 0.00 0.00 55.36 55.05 2o5j s GLN 575 Cb -0.14 -1.65 0.04 0.00 1.10 0.00 0.00 33.01 32.36 2o5j s GLN 575 CO 0.06 -0.12 1.13 0.00 -0.55 0.00 0.00 175.29 175.81 2o5j s ALA 576 N 1.19 2.23 0.55 1.58 0.00 -1.26 -4.22 121.76 121.83 2o5j s ALA 576 Ca -0.04 0.56 -0.21 0.00 0.00 0.00 0.00 51.96 52.27 2o5j s ALA 576 Cb -0.14 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2o5j s ALA 576 CO -0.03 -1.69 1.24 -2.30 0.00 0.00 0.00 175.76 172.97 2o5j n PRO 577 N -2.96 1.47 0.28 0.00 -0.02 -1.26 -4.53 135.00 127.97 2o5j n PRO 577 Ca 0.11 0.54 0.15 0.00 -2.02 0.00 0.00 63.50 62.28 2o5j n PRO 577 Cb 0.52 -2.43 0.79 0.00 -0.02 0.00 0.00 33.50 32.36 2o5j n PRO 577 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2o5j h VAL 578 N 1.21 0.40 -3.25 -1.45 -1.51 -1.92 -3.39 116.25 106.34 2o5j h VAL 578 Ca -0.50 -0.46 -0.48 0.00 -1.23 0.00 0.00 66.70 64.04 2o5j h VAL 578 Cb 1.32 1.32 -0.39 0.00 -2.13 0.00 0.00 31.29 31.41 2o5j h VAL 578 CO 0.56 0.08 -0.76 0.54 -1.23 0.00 0.00 177.57 176.75 2o5j s VAL 579 N -4.10 0.42 0.48 7.19 0.11 -1.26 -3.82 120.40 119.42 2o5j s VAL 579 Ca -0.02 -0.24 0.06 0.00 -2.93 0.00 0.00 61.98 58.85 2o5j s VAL 579 Cb 0.12 -0.79 -0.00 0.00 -1.53 0.00 0.00 36.38 34.19 2o5j s VAL 579 CO 0.55 -0.01 0.30 -0.04 -3.33 0.00 0.00 175.10 172.58 2o5j s MET 580 N 1.93 2.29 -0.25 1.54 1.00 -1.19 -4.79 119.30 119.83 2o5j s MET 580 Ca 0.02 -1.92 -0.05 0.00 0.00 0.00 0.00 55.69 53.73 2o5j s MET 580 Cb -0.15 -2.06 -0.17 0.00 0.00 0.00 0.00 34.83 32.45 2o5j s MET 580 CO -0.07 -0.39 -0.16 0.25 0.00 0.00 0.00 175.02 174.65 2o5j n THR 581 N -1.54 1.54 0.00 2.05 -2.24 -1.26 -2.81 114.28 110.03 2o5j n THR 581 Ca -0.02 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2o5j n THR 581 Cb 0.64 -1.64 0.00 0.00 -2.10 0.00 0.00 70.33 67.23 2o5j n THR 581 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2o5j n GLY 582 N 1.87 -0.08 0.44 3.38 0.00 -1.26 -4.48 105.19 105.05 2o5j n GLY 582 Ca -0.46 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.61 2o5j n GLY 582 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o5j n LEU 583 N 0.00 1.96 -0.27 0.99 4.32 -1.26 -4.60 117.00 118.14 2o5j n LEU 583 Ca 0.00 -1.07 0.03 0.00 -0.02 0.00 0.00 56.01 54.94 2o5j n LEU 583 Cb 0.00 -0.02 0.16 0.00 -1.62 0.00 0.00 43.42 41.94 2o5j n LEU 583 CO 0.00 0.39 1.09 1.05 -1.22 0.00 0.00 177.39 178.70 2o5j h GLU 584 N 2.08 0.64 0.77 3.23 9.09 -1.95 0.20 114.58 128.63 2o5j h GLU 584 Ca 0.00 -0.04 -0.04 0.00 0.05 0.00 0.00 59.36 59.33 2o5j h GLU 584 Cb 0.46 -0.14 0.01 0.00 -1.65 0.00 0.00 28.75 27.43 2o5j h GLU 584 CO 0.00 0.42 -0.37 0.93 0.05 0.00 0.00 179.01 180.04 2o5j h GLU 585 N 0.66 -1.00 -0.92 1.06 5.08 -1.81 -2.58 114.58 115.07 2o5j h GLU 585 Ca 0.38 0.07 0.14 0.00 -1.00 0.00 0.00 59.36 58.95 2o5j h GLU 585 Cb 0.41 0.23 -0.08 0.00 0.50 0.00 0.00 28.75 29.81 2o5j h GLU 585 CO -0.28 -0.66 0.59 0.00 -1.00 0.00 0.00 179.01 177.66 2o5j h ARG 586 N -1.07 0.72 0.13 2.33 2.47 -1.72 -2.16 114.38 115.08 2o5j h ARG 586 Ca -0.11 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.57 2o5j h ARG 586 Cb 0.80 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.96 2o5j h ARG 586 CO 0.17 0.47 -0.08 0.28 0.56 0.00 0.00 179.97 181.38 2o5j h VAL 587 N 0.74 0.00 -0.69 2.04 2.07 -0.54 0.18 116.25 120.06 2o5j h VAL 587 Ca 0.47 0.00 0.15 0.00 0.82 0.00 0.00 66.70 68.14 2o5j h VAL 587 Cb 0.71 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2o5j h VAL 587 CO -0.23 0.00 0.47 -0.37 0.02 0.00 0.00 177.57 177.46 2o5j h VAL 588 N -0.19 0.78 0.03 2.57 -1.51 -1.37 0.37 116.25 116.93 2o5j h VAL 588 Ca -0.02 -0.10 -0.07 0.00 -1.23 0.00 0.00 66.70 65.28 2o5j h VAL 588 Cb 0.16 0.46 0.01 0.00 -2.13 0.00 0.00 31.29 29.78 2o5j h VAL 588 CO 0.02 0.05 -0.30 -0.09 -1.23 0.00 0.00 177.57 176.02 2o5j h ARG 589 N 0.30 0.15 0.00 5.19 2.43 -1.27 -3.06 114.38 118.13 2o5j h ARG 589 Ca 0.33 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 2o5j h ARG 589 Cb 0.89 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.49 2o5j h ARG 589 CO -0.08 1.01 -0.47 -0.44 -1.51 0.00 0.00 179.97 178.48 2o5j h ASP 590 N -0.61 0.00 -4.39 -3.80 3.32 -0.27 -3.41 116.42 107.26 2o5j h ASP 590 Ca -0.05 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.52 2o5j h ASP 590 Cb 1.14 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.78 2o5j h ASP 590 CO 0.06 0.47 0.37 -0.94 -1.72 0.00 0.00 179.24 177.48 2o5j s SER 591 N -6.69 4.89 -0.79 6.45 1.04 0.13 -4.81 113.70 113.92 2o5j s SER 591 Ca -0.01 1.19 0.01 0.00 0.48 0.00 0.00 55.95 57.61 2o5j s SER 591 Cb 0.12 -1.93 0.35 0.00 0.10 0.00 0.00 66.02 64.67 2o5j s SER 591 CO 0.72 -1.70 1.63 0.18 0.98 0.00 0.00 173.24 175.05 2o5j n LEU 592 N -3.25 6.50 0.04 2.42 4.77 -1.26 -4.72 117.00 121.50 2o5j n LEU 592 Ca 0.07 -5.21 -0.02 0.00 -0.03 0.00 0.00 56.01 50.82 2o5j n LEU 592 Cb 0.57 -0.91 -0.01 0.00 -2.33 0.00 0.00 43.42 40.74 2o5j n LEU 592 CO 0.57 2.03 0.21 0.00 -1.33 0.00 0.00 177.39 178.87 2o5j h ALA 593 N 3.29 -0.45 -2.31 -1.18 0.00 -1.85 -3.47 119.26 113.29 2o5j h ALA 593 Ca 0.44 -0.02 -0.49 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 593 Cb 0.35 0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.21 2o5j h ALA 593 CO 1.16 -0.44 0.17 0.00 0.00 0.00 0.00 179.25 180.14 2o5j s ALA 594 N -3.18 3.32 -0.40 0.00 0.00 -1.26 -3.55 121.76 116.69 2o5j s ALA 594 Ca -0.01 -0.28 -0.14 0.00 0.00 0.00 0.00 51.96 51.53 2o5j s ALA 594 Cb 0.00 -2.74 0.02 0.00 0.00 0.00 0.00 23.12 20.40 2o5j s ALA 594 CO 0.04 -0.26 0.27 -0.51 0.00 0.00 0.00 175.76 175.31 2o5j s LEU 595 N -4.40 4.98 0.20 0.00 1.02 -0.83 -4.87 118.68 114.77 2o5j s LEU 595 Ca 0.51 -0.91 -0.05 0.00 0.02 0.00 0.00 54.13 53.70 2o5j s LEU 595 Cb -0.10 -2.12 -0.06 0.00 0.02 0.00 0.00 46.19 43.93 2o5j s LEU 595 CO 0.40 -0.42 0.45 -0.31 0.02 0.00 0.00 176.35 176.49 2o5j s TYR 596 N 1.65 3.46 0.11 0.29 1.51 -1.26 -1.10 117.35 122.01 2o5j s TYR 596 Ca 0.04 0.61 -0.30 0.00 -1.01 0.00 0.00 57.07 56.41 2o5j s TYR 596 Cb -0.19 -2.06 -0.06 0.00 -0.11 0.00 0.00 41.96 39.54 2o5j s TYR 596 CO 0.09 0.34 1.14 0.00 -1.11 0.00 0.00 175.55 176.01 2o5j s ALA 597 N -1.81 3.37 -0.00 3.71 0.00 -0.55 -4.88 121.76 121.59 2o5j s ALA 597 Ca 0.43 0.82 -0.01 0.00 0.00 0.00 0.00 51.96 53.19 2o5j s ALA 597 Cb -0.11 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 2o5j s ALA 597 CO 0.26 -0.33 0.54 0.93 0.00 0.00 0.00 175.76 177.16 2o5j h GLU 598 N 6.04 -0.05 -5.84 0.00 5.08 -1.92 -0.23 114.58 117.66 2o5j h GLU 598 Ca -0.43 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.35 2o5j h GLU 598 Cb 1.21 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.37 2o5j h GLU 598 CO 0.77 -0.03 -0.54 -2.00 -1.00 0.00 0.00 179.01 176.20 2o5j s GLU 599 N -2.17 2.13 0.54 2.33 2.12 -1.26 -4.19 118.70 118.19 2o5j s GLU 599 Ca -0.01 -1.91 -0.20 0.00 0.36 0.00 0.00 54.97 53.21 2o5j s GLU 599 Cb 0.00 -1.87 -0.06 0.00 0.26 0.00 0.00 34.13 32.46 2o5j s GLU 599 CO 0.02 -0.07 1.13 -0.51 -0.54 0.00 0.00 175.26 175.29 2o5j s ASP 600 N -3.82 5.76 0.00 -1.70 1.01 -1.26 -4.60 116.67 112.05 2o5j s ASP 600 Ca 0.38 2.17 0.00 0.00 0.71 0.00 0.00 52.55 55.82 2o5j s ASP 600 Cb 0.05 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.40 2o5j s ASP 600 CO 0.21 -1.19 0.00 0.61 0.21 0.00 0.00 175.17 175.00 2o5j n GLY 601 N 0.15 -0.74 3.45 0.21 0.00 -0.96 -1.94 105.19 105.37 2o5j n GLY 601 Ca 0.11 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 2o5j n GLY 601 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 602 N -0.40 1.61 -0.09 1.61 2.56 0.16 0.16 118.70 124.31 2o5j s GLU 602 Ca 0.00 -1.78 -0.14 0.00 0.00 0.00 0.00 54.97 53.05 2o5j s GLU 602 Cb 0.00 -1.47 -0.05 0.00 2.00 0.00 0.00 34.13 34.61 2o5j s GLU 602 CO 0.00 0.18 0.36 0.08 -0.56 0.00 0.00 175.26 175.32 2o5j s VAL 603 N -2.75 5.20 -0.08 3.70 1.01 -0.77 0.64 120.40 127.35 2o5j s VAL 603 Ca 0.29 0.71 -0.07 0.00 0.00 0.00 0.00 61.98 62.90 2o5j s VAL 603 Cb -0.00 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2o5j s VAL 603 CO 0.13 0.46 -0.14 0.00 0.00 0.00 0.00 175.10 175.55 2o5j n ALA 604 N 2.88 0.35 -2.52 5.51 0.00 -0.30 -0.82 120.51 125.61 2o5j n ALA 604 Ca -0.12 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.59 2o5j n ALA 604 Cb 0.52 0.01 -0.16 0.00 0.00 0.00 0.00 19.45 19.82 2o5j n ALA 604 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2o5j s LYS 605 N -1.80 2.01 -0.55 0.00 3.01 -0.93 -4.43 119.74 117.05 2o5j s LYS 605 Ca -0.12 -0.81 0.04 0.00 -1.01 0.00 0.00 55.97 54.07 2o5j s LYS 605 Cb 0.02 -1.85 0.15 0.00 -1.01 0.00 0.00 37.83 35.13 2o5j s LYS 605 CO 0.17 0.44 0.34 0.08 0.51 0.00 0.00 175.35 176.88 2o5j s VAL 606 N -0.38 2.27 0.74 3.17 1.01 -1.26 -0.94 120.40 125.01 2o5j s VAL 606 Ca 0.04 -3.41 -0.04 0.00 0.00 0.00 0.00 61.98 58.57 2o5j s VAL 606 Cb -0.10 -2.54 0.12 0.00 0.00 0.00 0.00 36.38 33.85 2o5j s VAL 606 CO 0.01 -0.92 1.03 -0.62 0.00 0.00 0.00 175.10 174.60 2o5j s ASP 607 N -0.50 4.34 0.00 3.32 2.15 0.16 -4.96 116.67 121.18 2o5j s ASP 607 Ca 0.21 -0.05 0.27 0.00 0.43 0.00 0.00 52.55 53.41 2o5j s ASP 607 Cb -0.17 -0.39 0.87 0.00 -0.30 0.00 0.00 42.92 42.93 2o5j s ASP 607 CO -0.07 -1.87 1.64 0.61 -0.17 0.00 0.00 175.17 175.31 2o5j n GLY 608 N -2.95 -0.90 0.00 2.66 0.00 -1.26 -3.81 105.19 98.93 2o5j n GLY 608 Ca 0.13 -0.33 0.02 0.00 0.00 0.00 0.00 46.02 45.83 2o5j n GLY 608 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2o5j n ASN 609 N -0.97 3.41 -3.59 1.61 5.03 -1.26 -4.90 115.26 114.59 2o5j n ASN 609 Ca 0.11 -0.11 -0.12 0.00 0.87 0.00 0.00 54.58 55.33 2o5j n ASN 609 Cb 0.32 1.13 -0.06 0.00 -1.02 0.00 0.00 39.78 40.15 2o5j n ASN 609 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 2o5j s ARG 610 N -2.07 0.67 -0.37 3.52 3.52 -1.25 -1.18 118.95 121.79 2o5j s ARG 610 Ca -0.01 0.40 0.04 0.00 -0.13 0.00 0.00 55.73 56.03 2o5j s ARG 610 Cb 0.02 0.32 0.11 0.00 -1.56 0.00 0.00 34.95 33.84 2o5j s ARG 610 CO 0.15 -0.16 0.09 0.42 -0.81 0.00 0.00 175.30 174.98 2o5j s ILE 611 N -0.52 2.26 -0.67 4.11 1.01 -1.06 0.40 121.20 126.72 2o5j s ILE 611 Ca -0.02 -2.47 -0.26 0.00 0.00 0.00 0.00 60.65 57.90 2o5j s ILE 611 Cb -0.02 -2.66 0.04 0.00 0.01 0.00 0.00 42.46 39.83 2o5j s ILE 611 CO 0.00 -0.64 1.18 -0.69 0.00 0.00 0.00 174.94 174.80 2o5j s VAL 612 N 0.74 3.95 0.47 2.92 1.01 -0.11 -3.17 120.40 126.20 2o5j s VAL 612 Ca 0.12 0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 2o5j s VAL 612 Cb -0.20 -4.80 -0.03 0.00 0.00 0.00 0.00 36.38 31.35 2o5j s VAL 612 CO -0.07 -1.59 0.75 0.68 0.00 0.00 0.00 175.10 174.87 2o5j s VAL 613 N 5.12 4.76 -0.29 2.92 -7.23 -0.72 -1.14 120.40 123.82 2o5j s VAL 613 Ca 0.35 0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.58 2o5j s VAL 613 Cb -0.10 -3.80 0.08 0.00 0.56 0.00 0.00 36.38 33.12 2o5j s VAL 613 CO 0.17 -0.74 -0.03 -0.60 -0.31 0.00 0.00 175.10 173.60 2o5j s ARG 614 N -4.69 1.79 0.63 4.82 3.52 0.21 -1.70 118.95 123.52 2o5j s ARG 614 Ca 0.47 -1.50 -0.14 0.00 -0.13 0.00 0.00 55.73 54.42 2o5j s ARG 614 Cb -0.10 -2.94 -0.02 0.00 -1.56 0.00 0.00 34.95 30.33 2o5j s ARG 614 CO 0.43 -0.74 1.07 0.71 -0.81 0.00 0.00 175.30 175.96 2o5j s TYR 615 N 1.08 2.94 -1.63 5.12 4.12 0.16 0.39 117.35 129.53 2o5j s TYR 615 Ca 0.00 1.50 0.20 0.00 0.02 0.00 0.00 57.07 58.80 2o5j s TYR 615 Cb -0.19 -3.01 1.10 0.00 -1.52 0.00 0.00 41.96 38.34 2o5j s TYR 615 CO -0.07 -1.26 1.63 0.39 0.02 0.00 0.00 175.55 176.26 2o5j n GLU 616 N -2.37 0.42 0.00 -0.62 -0.58 -0.82 -2.61 120.64 114.06 2o5j n GLU 616 Ca 0.09 0.06 0.16 0.00 -0.42 0.00 0.00 57.16 57.05 2o5j n GLU 616 Cb 0.53 -1.50 0.88 0.00 -0.57 0.00 0.00 31.44 30.78 2o5j n GLU 616 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2o5j n ASP 617 N -1.18 0.24 0.00 1.62 9.92 -1.26 -4.86 116.55 121.02 2o5j n ASP 617 Ca 0.12 -1.06 0.00 0.00 -0.53 0.00 0.00 54.79 53.32 2o5j n ASP 617 Cb 0.13 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.60 2o5j n ASP 617 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2o5j n GLY 618 N 1.03 0.82 3.41 0.44 0.00 -1.07 -5.08 105.19 104.75 2o5j n GLY 618 Ca 0.23 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 2o5j n GLY 618 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j s ARG 619 N -0.65 1.49 -0.03 1.61 0.52 -1.23 -5.00 118.95 115.67 2o5j s ARG 619 Ca 0.00 -1.39 0.01 0.00 -0.52 0.00 0.00 55.73 53.82 2o5j s ARG 619 Cb 0.00 -1.91 0.02 0.00 0.52 0.00 0.00 34.95 33.59 2o5j s ARG 619 CO 0.00 0.43 -0.01 -0.48 0.02 0.00 0.00 175.30 175.27 2o5j s LEU 620 N -2.30 1.27 0.00 2.53 2.34 -1.26 0.37 118.68 121.64 2o5j s LEU 620 Ca 0.17 -0.03 0.07 0.00 0.06 0.00 0.00 54.13 54.40 2o5j s LEU 620 Cb -0.09 -0.22 -0.02 0.00 -0.56 0.00 0.00 46.19 45.29 2o5j s LEU 620 CO 0.08 -0.08 -0.23 -0.69 -1.06 0.00 0.00 176.35 174.37 2o5j s VAL 621 N 0.88 1.83 -0.31 1.48 1.01 -0.69 -4.97 120.40 119.64 2o5j s VAL 621 Ca -0.09 -1.08 -0.22 0.00 0.00 0.00 0.00 61.98 60.59 2o5j s VAL 621 Cb -0.12 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 2o5j s VAL 621 CO -0.01 0.43 0.72 -0.70 0.00 0.00 0.00 175.10 175.53 2o5j s GLU 622 N -0.77 3.94 -0.65 2.72 2.12 -1.26 -1.76 118.70 123.04 2o5j s GLU 622 Ca 0.09 0.46 -0.10 0.00 0.36 0.00 0.00 54.97 55.78 2o5j s GLU 622 Cb -0.09 -3.73 0.17 0.00 0.26 0.00 0.00 34.13 30.74 2o5j s GLU 622 CO 0.00 -0.63 0.54 0.71 -0.54 0.00 0.00 175.26 175.34 2o5j s TYR 623 N 2.80 3.52 0.67 5.30 4.12 -1.19 -4.98 117.35 127.59 2o5j s TYR 623 Ca 0.29 -2.03 -0.17 0.00 0.02 0.00 0.00 57.07 55.18 2o5j s TYR 623 Cb -0.14 -3.59 0.00 0.00 -1.52 0.00 0.00 41.96 36.71 2o5j s TYR 623 CO 0.12 -0.96 1.23 -2.14 0.02 0.00 0.00 175.55 173.81 2o5j s PRO 624 N 0.63 2.50 -0.17 -1.71 0.02 -1.26 -2.57 135.00 132.44 2o5j s PRO 624 Ca 0.12 1.84 0.01 0.00 0.02 0.00 0.00 61.00 62.99 2o5j s PRO 624 Cb -0.20 -1.87 0.01 0.00 0.02 0.00 0.00 34.50 32.47 2o5j s PRO 624 CO -0.04 -1.58 -0.17 -0.51 -0.33 0.00 0.00 177.00 174.37 2o5j s LEU 625 N -4.64 2.32 -0.78 -5.54 1.43 -0.33 -4.94 118.68 106.20 2o5j s LEU 625 Ca 0.77 -0.56 -0.24 0.00 -1.03 0.00 0.00 54.13 53.08 2o5j s LEU 625 Cb -0.31 -1.53 -0.16 0.00 0.03 0.00 0.00 46.19 44.22 2o5j s LEU 625 CO 0.40 0.04 2.39 0.54 0.23 0.00 0.00 176.35 179.95 2o5j n ARG 626 N 4.37 0.53 0.00 1.70 5.12 -1.26 -4.80 116.66 122.31 2o5j n ARG 626 Ca -0.20 -0.58 0.00 0.00 -1.93 0.00 0.00 57.85 55.14 2o5j n ARG 626 Cb 0.51 -3.20 0.00 0.00 -1.16 0.00 0.00 32.46 28.61 2o5j n ARG 626 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 2o5j n ARG 627 N 8.35 0.00 -3.62 5.56 1.85 -1.26 -2.82 116.66 124.72 2o5j n ARG 627 Ca 0.49 0.24 -0.29 0.00 -1.00 0.00 0.00 57.85 57.29 2o5j n ARG 627 Cb 0.39 -0.74 -0.15 0.00 -1.05 0.00 0.00 32.46 30.91 2o5j n ARG 627 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2o5j s PHE 628 N -0.48 0.72 0.23 2.89 0.08 -1.26 -3.94 117.98 116.22 2o5j s PHE 628 Ca 0.00 -1.01 0.09 0.00 0.12 0.00 0.00 56.93 56.14 2o5j s PHE 628 Cb 0.00 -1.08 -0.04 0.00 -0.57 0.00 0.00 43.02 41.32 2o5j s PHE 628 CO 0.00 -0.77 -0.06 0.71 -0.10 0.00 0.00 175.22 175.00 2o5j s TYR 629 N 1.96 2.65 -0.38 0.36 1.51 -1.18 -4.96 117.35 117.31 2o5j s TYR 629 Ca 0.07 -0.22 -0.21 0.00 -1.01 0.00 0.00 57.07 55.69 2o5j s TYR 629 Cb -0.16 -1.23 0.01 0.00 -0.11 0.00 0.00 41.96 40.47 2o5j s TYR 629 CO -0.27 0.58 0.68 0.50 -1.11 0.00 0.00 175.55 175.93 2o5j s ARG 630 N -3.28 3.62 0.60 -0.62 6.06 -1.26 -3.14 118.95 120.92 2o5j s ARG 630 Ca 0.28 0.04 -0.16 0.00 -2.50 0.00 0.00 55.73 53.39 2o5j s ARG 630 Cb -0.07 -3.84 -0.04 0.00 0.06 0.00 0.00 34.95 31.06 2o5j s ARG 630 CO 0.18 -0.83 1.06 -1.54 -2.50 0.00 0.00 175.30 171.66 2o5j s SER 631 N 1.86 5.77 0.28 -2.12 1.04 -1.05 -4.89 113.70 114.60 2o5j s SER 631 Ca 0.26 1.81 0.02 0.00 0.48 0.00 0.00 55.95 58.53 2o5j s SER 631 Cb -0.14 -2.53 0.67 0.00 0.10 0.00 0.00 66.02 64.12 2o5j s SER 631 CO 0.16 -1.17 1.72 0.78 0.98 0.00 0.00 173.24 175.71 2o5j h ASN 632 N 0.41 0.41 -0.07 7.02 2.35 -1.90 0.42 115.58 124.21 2o5j h ASN 632 Ca -0.47 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 2o5j h ASN 632 Cb 1.22 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.68 2o5j h ASN 632 CO 0.57 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 176.43 2o5j n GLN 633 N -4.98 1.35 -2.18 0.81 1.13 -1.26 -4.91 117.38 107.33 2o5j n GLN 633 Ca 0.21 -0.52 -0.02 0.00 -1.94 0.00 0.00 57.00 54.72 2o5j n GLN 633 Cb 0.58 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.58 2o5j n GLN 633 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2o5j n GLY 634 N 0.96 0.43 3.86 1.08 0.00 0.15 -5.04 105.19 106.63 2o5j n GLY 634 Ca 0.16 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 45.20 2o5j n GLY 634 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2o5j s THR 635 N -2.33 4.66 0.14 2.61 -4.23 -1.26 -3.30 115.64 111.92 2o5j s THR 635 Ca 0.01 -1.27 -0.23 0.00 -1.18 0.00 0.00 61.69 59.02 2o5j s THR 635 Cb -0.01 -3.51 -0.08 0.00 1.34 0.00 0.00 72.50 70.25 2o5j s THR 635 CO 0.02 -0.32 0.71 0.00 -0.54 0.00 0.00 174.62 174.48 2o5j s ALA 636 N -2.06 3.50 -0.38 3.99 0.00 -1.18 -2.51 121.76 123.10 2o5j s ALA 636 Ca 0.33 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.56 2o5j s ALA 636 Cb -0.08 -2.85 0.11 0.00 0.00 0.00 0.00 23.12 20.30 2o5j s ALA 636 CO 0.26 0.33 0.13 -0.51 0.00 0.00 0.00 175.76 175.97 2o5j s LEU 637 N -1.16 3.58 -0.02 0.00 1.02 -1.19 -4.84 118.68 116.08 2o5j s LEU 637 Ca 0.34 -2.24 0.06 0.00 0.02 0.00 0.00 54.13 52.30 2o5j s LEU 637 Cb -0.22 -1.30 -0.02 0.00 0.02 0.00 0.00 46.19 44.68 2o5j s LEU 637 CO 0.24 -0.34 -0.20 -0.62 0.02 0.00 0.00 176.35 175.44 2o5j s ASP 638 N 0.80 2.39 -0.45 2.29 -1.08 -1.25 -3.13 116.67 116.25 2o5j s ASP 638 Ca 0.13 -0.37 -0.13 0.00 -0.52 0.00 0.00 52.55 51.66 2o5j s ASP 638 Cb -0.21 -0.28 0.07 0.00 -1.46 0.00 0.00 42.92 41.04 2o5j s ASP 638 CO -0.10 0.25 0.34 -1.10 0.52 0.00 0.00 175.17 175.08 2o5j s GLN 639 N -0.46 2.86 -0.46 4.34 -0.21 -1.13 -3.49 119.66 121.12 2o5j s GLN 639 Ca 0.07 -1.34 -0.24 0.00 0.02 0.00 0.00 55.36 53.87 2o5j s GLN 639 Cb -0.08 -3.99 0.03 0.00 1.00 0.00 0.00 33.01 29.96 2o5j s GLN 639 CO -0.01 -0.97 0.84 1.03 -2.12 0.00 0.00 175.29 174.07 2o5j s ARG 640 N 1.58 3.44 0.28 2.91 0.52 -0.97 -4.78 118.95 121.94 2o5j s ARG 640 Ca 0.04 -0.03 -0.30 0.00 -0.52 0.00 0.00 55.73 54.92 2o5j s ARG 640 Cb -0.23 -3.94 -0.13 0.00 0.52 0.00 0.00 34.95 31.16 2o5j s ARG 640 CO 0.06 -1.18 1.33 -2.30 0.02 0.00 0.00 175.30 173.22 2o5j n PRO 641 N 6.93 2.01 0.00 3.54 -0.02 -1.26 -1.19 135.00 145.01 2o5j n PRO 641 Ca 0.04 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2o5j n PRO 641 Cb 0.48 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 2o5j n PRO 641 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2o5j n ARG 642 N 1.33 1.77 -4.83 -0.52 5.12 -0.05 -4.87 116.66 114.61 2o5j n ARG 642 Ca 0.09 -1.10 -0.33 0.00 -1.93 0.00 0.00 57.85 54.58 2o5j n ARG 642 Cb 0.33 -0.86 -0.14 0.00 -1.16 0.00 0.00 32.46 30.63 2o5j n ARG 642 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2o5j s VAL 643 N -0.62 3.00 0.77 1.55 1.01 -1.22 -5.02 120.40 119.87 2o5j s VAL 643 Ca 0.00 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2o5j s VAL 643 Cb 0.00 -2.23 0.06 0.00 0.00 0.00 0.00 36.38 34.21 2o5j s VAL 643 CO 0.00 0.54 1.15 0.68 0.00 0.00 0.00 175.10 177.47 2o5j s VAL 644 N 0.05 2.55 0.32 2.92 -7.23 -1.26 -4.91 120.40 112.84 2o5j s VAL 644 Ca -0.05 0.18 -0.29 0.00 -1.81 0.00 0.00 61.98 60.01 2o5j s VAL 644 Cb -0.15 -3.18 -0.11 0.00 0.56 0.00 0.00 36.38 33.51 2o5j s VAL 644 CO 0.04 -0.23 1.50 0.68 -0.31 0.00 0.00 175.10 176.77 2o5j s VAL 645 N -3.50 2.25 -0.39 1.32 -7.23 -1.26 -4.11 120.40 107.47 2o5j s VAL 645 Ca 0.61 0.23 -0.13 0.00 -1.81 0.00 0.00 61.98 60.87 2o5j s VAL 645 Cb -0.11 -3.14 0.02 0.00 0.56 0.00 0.00 36.38 33.70 2o5j s VAL 645 CO 0.50 0.04 0.44 0.61 -0.31 0.00 0.00 175.10 176.38 2o5j n GLY 646 N 1.43 -1.99 2.98 2.32 0.00 -0.00 -4.95 105.19 104.98 2o5j n GLY 646 Ca 0.04 1.04 -0.14 0.00 0.00 0.00 0.00 46.02 46.97 2o5j n GLY 646 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2o5j s GLN 647 N -2.32 0.14 -0.16 1.61 -0.44 -1.25 -4.73 119.66 112.50 2o5j s GLN 647 Ca 0.19 0.53 -0.29 0.00 -2.50 0.00 0.00 55.36 53.29 2o5j s GLN 647 Cb -0.05 -0.15 -0.04 0.00 -1.64 0.00 0.00 33.01 31.13 2o5j s GLN 647 CO 0.77 -0.21 1.76 1.03 0.50 0.00 0.00 175.29 179.13 2o5j s ARG 648 N 1.62 3.81 -0.09 1.67 0.52 -1.26 -1.85 118.95 123.36 2o5j s ARG 648 Ca -0.05 1.92 -0.02 0.00 -0.52 0.00 0.00 55.73 57.06 2o5j s ARG 648 Cb -0.11 -4.09 -0.03 0.00 0.52 0.00 0.00 34.95 31.23 2o5j s ARG 648 CO -0.07 -1.29 -0.01 0.14 0.02 0.00 0.00 175.30 174.09 2o5j s VAL 649 N 5.36 4.24 0.40 3.52 -7.23 0.43 -4.94 120.40 122.18 2o5j s VAL 649 Ca 0.78 -0.27 -0.23 0.00 -1.81 0.00 0.00 61.98 60.45 2o5j s VAL 649 Cb -0.30 -2.79 -0.10 0.00 0.56 0.00 0.00 36.38 33.76 2o5j s VAL 649 CO 0.32 0.59 0.99 0.00 -0.31 0.00 0.00 175.10 176.69 2o5j s ARG 650 N -0.74 4.25 -0.05 4.82 1.70 -1.26 -2.27 118.95 125.41 2o5j s ARG 650 Ca 0.11 1.34 -0.29 0.00 -0.47 0.00 0.00 55.73 56.42 2o5j s ARG 650 Cb -0.12 -2.46 -0.07 0.00 -0.57 0.00 0.00 34.95 31.73 2o5j s ARG 650 CO 0.02 -0.03 2.01 0.21 -1.08 0.00 0.00 175.30 176.43 2o5j s LYS 651 N -2.64 3.83 0.00 3.89 2.20 -1.26 -2.42 119.74 123.34 2o5j s LYS 651 Ca 0.58 2.38 0.00 0.00 -0.36 0.00 0.00 55.97 58.57 2o5j s LYS 651 Cb -0.17 -4.21 0.00 0.00 -1.51 0.00 0.00 37.83 31.94 2o5j s LYS 651 CO 0.22 -1.30 0.00 0.41 -0.36 0.00 0.00 175.35 174.32 2o5j n GLY 652 N 4.89 0.97 3.50 5.54 0.00 -0.10 -4.99 105.19 115.00 2o5j n GLY 652 Ca 0.23 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 2o5j n GLY 652 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2o5j s ASP 653 N -2.63 4.07 -0.00 1.61 -1.08 -1.01 -4.77 116.67 112.86 2o5j s ASP 653 Ca 0.00 -0.28 -0.30 0.00 -0.52 0.00 0.00 52.55 51.45 2o5j s ASP 653 Cb 0.00 -0.80 -0.06 0.00 -1.46 0.00 0.00 42.92 40.60 2o5j s ASP 653 CO 0.00 0.29 1.56 -1.48 0.52 0.00 0.00 175.17 176.06 2o5j s LEU 654 N -1.20 4.33 -0.15 -1.34 2.34 -1.26 -1.48 118.68 119.91 2o5j s LEU 654 Ca 0.14 2.25 0.03 0.00 0.06 0.00 0.00 54.13 56.61 2o5j s LEU 654 Cb -0.11 -3.55 -0.23 0.00 -0.56 0.00 0.00 46.19 41.74 2o5j s LEU 654 CO 0.04 -0.84 0.25 0.18 -1.06 0.00 0.00 176.35 174.92 2o5j n LEU 655 N 6.06 1.96 -3.91 1.48 4.77 -0.26 -4.73 117.00 122.37 2o5j n LEU 655 Ca 0.15 0.14 -0.11 0.00 -0.03 0.00 0.00 56.01 56.17 2o5j n LEU 655 Cb 0.42 -0.56 -0.13 0.00 -2.33 0.00 0.00 43.42 40.83 2o5j n LEU 655 CO 0.61 0.72 -0.36 0.00 -1.33 0.00 0.00 177.39 177.03 2o5j s ALA 656 N -2.55 0.06 0.18 -1.18 0.00 -1.22 -0.87 121.76 116.18 2o5j s ALA 656 Ca -0.20 -0.23 -0.12 0.00 0.00 0.00 0.00 51.96 51.41 2o5j s ALA 656 Cb 0.07 0.05 -0.07 0.00 0.00 0.00 0.00 23.12 23.18 2o5j s ALA 656 CO 0.75 -0.06 0.54 -0.51 0.00 0.00 0.00 175.76 176.48 2o5j s ASP 657 N -0.56 6.73 1.37 0.00 1.01 -0.33 -1.97 116.67 122.92 2o5j s ASP 657 Ca -0.06 1.00 -0.22 0.00 0.71 0.00 0.00 52.55 53.97 2o5j s ASP 657 Cb -0.04 -2.26 0.34 0.00 1.01 0.00 0.00 42.92 41.98 2o5j s ASP 657 CO -0.00 0.03 0.97 0.61 0.21 0.00 0.00 175.17 176.99 2o5j n GLY 658 N 0.41 -3.39 0.34 0.21 0.00 -1.23 -2.28 105.19 99.25 2o5j n GLY 658 Ca -0.03 -1.39 0.15 0.00 0.00 0.00 0.00 46.02 44.75 2o5j n GLY 658 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2o5j h PRO 659 N 0.00 0.60 0.00 1.61 0.11 -1.76 -2.99 132.00 129.58 2o5j h PRO 659 Ca -0.40 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.64 2o5j h PRO 659 Cb 1.28 -0.14 -0.08 0.00 0.11 0.00 0.00 31.00 32.17 2o5j h PRO 659 CO 0.25 0.40 -0.53 0.00 -0.21 0.00 0.00 178.00 177.91 2o5j n ALA 660 N -2.35 3.03 -2.78 -0.75 0.00 -1.26 -4.75 120.51 111.65 2o5j n ALA 660 Ca 0.24 -2.83 -0.35 0.00 0.00 0.00 0.00 53.44 50.50 2o5j n ALA 660 Cb 0.65 -0.45 -0.08 0.00 0.00 0.00 0.00 19.45 19.57 2o5j n ALA 660 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2o5j s SER 661 N -2.76 5.70 -0.09 0.00 1.04 -1.13 -1.37 113.70 115.10 2o5j s SER 661 Ca 0.33 0.23 -0.08 0.00 0.48 0.00 0.00 55.95 56.92 2o5j s SER 661 Cb 0.33 -1.79 -0.06 0.00 0.10 0.00 0.00 66.02 64.60 2o5j s SER 661 CO -0.07 0.34 0.29 -0.08 0.98 0.00 0.00 173.24 174.70 2o5j h GLU 662 N 5.50 -0.13 -1.46 4.02 4.81 -1.69 -3.42 114.58 122.21 2o5j h GLU 662 Ca -0.48 0.01 -0.34 0.00 -0.13 0.00 0.00 59.36 58.42 2o5j h GLU 662 Cb 1.20 0.03 -0.25 0.00 0.63 0.00 0.00 28.75 30.36 2o5j h GLU 662 CO 0.60 0.05 -0.70 0.09 -0.73 0.00 0.00 179.01 178.31 2o5j n ASN 663 N -4.85 -2.14 0.00 1.04 4.13 -1.26 -4.89 115.26 107.29 2o5j n ASN 663 Ca -0.03 -2.74 0.00 0.00 1.68 0.00 0.00 54.58 53.48 2o5j n ASN 663 Cb 0.12 0.80 0.00 0.00 -1.54 0.00 0.00 39.78 39.16 2o5j n ASN 663 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2o5j n GLY 664 N 2.70 0.73 3.88 7.41 0.00 -1.26 -4.92 105.19 113.72 2o5j n GLY 664 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2o5j n GLY 664 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2o5j s PHE 665 N -1.77 3.61 0.24 1.61 2.99 -1.26 -4.32 117.98 119.07 2o5j s PHE 665 Ca 0.00 0.56 -0.30 0.00 0.00 0.00 0.00 56.93 57.19 2o5j s PHE 665 Cb 0.00 -1.97 -0.10 0.00 0.00 0.00 0.00 43.02 40.95 2o5j s PHE 665 CO 0.00 0.70 1.45 -1.17 -0.00 0.00 0.00 175.22 176.20 2o5j s LEU 666 N -1.24 4.38 -0.13 -0.37 2.96 -0.99 -2.99 118.68 120.31 2o5j s LEU 666 Ca 0.19 2.65 -0.04 0.00 -0.22 0.00 0.00 54.13 56.71 2o5j s LEU 666 Cb -0.13 -3.62 0.06 0.00 0.50 0.00 0.00 46.19 43.01 2o5j s LEU 666 CO 0.08 -0.71 0.20 0.00 -1.32 0.00 0.00 176.35 174.60 2o5j s ALA 667 N 0.12 -0.27 -0.37 5.97 0.00 -0.47 -4.42 121.76 122.32 2o5j s ALA 667 Ca 0.60 0.55 0.01 0.00 0.00 0.00 0.00 51.96 53.12 2o5j s ALA 667 Cb -0.42 -1.01 0.14 0.00 0.00 0.00 0.00 23.12 21.83 2o5j s ALA 667 CO 0.42 -0.77 0.22 -0.48 0.00 0.00 0.00 175.76 175.15 2o5j s LEU 668 N 2.33 1.30 0.00 0.00 0.05 -1.26 -4.44 118.68 116.66 2o5j s LEU 668 Ca 0.04 -2.32 0.00 0.00 0.05 0.00 0.00 54.13 51.90 2o5j s LEU 668 Cb -0.13 -0.51 0.00 0.00 -2.05 0.00 0.00 46.19 43.50 2o5j s LEU 668 CO -0.08 -0.29 0.00 0.61 -0.55 0.00 0.00 176.35 176.04 2o5j n GLY 669 N 3.88 1.52 3.23 -3.48 0.00 -1.26 -4.29 105.19 104.79 2o5j n GLY 669 Ca 0.13 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.94 2o5j n GLY 669 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2o5j s GLN 670 N -1.84 1.00 -0.35 1.61 -0.21 -0.84 -3.54 119.66 115.49 2o5j s GLN 670 Ca 0.00 -1.42 -0.29 0.00 0.02 0.00 0.00 55.36 53.67 2o5j s GLN 670 Cb 0.00 -0.52 0.01 0.00 1.00 0.00 0.00 33.01 33.50 2o5j s GLN 670 CO 0.00 0.05 1.19 -0.80 -2.12 0.00 0.00 175.29 173.61 2o5j s ASN 671 N -3.13 6.75 0.03 5.90 0.02 -1.26 -2.96 114.94 120.29 2o5j s ASN 671 Ca 0.15 0.98 0.04 0.00 -1.02 0.00 0.00 52.86 53.01 2o5j s ASN 671 Cb 0.03 -2.54 -0.02 0.00 0.02 0.00 0.00 41.25 38.74 2o5j s ASN 671 CO -0.01 -1.06 -0.12 0.68 0.02 0.00 0.00 177.10 176.62 2o5j s VAL 672 N 4.17 0.90 0.27 1.60 -7.23 -0.75 -4.93 120.40 114.43 2o5j s VAL 672 Ca 0.51 -0.92 -0.31 0.00 -1.81 0.00 0.00 61.98 59.45 2o5j s VAL 672 Cb -0.13 -0.84 -0.12 0.00 0.56 0.00 0.00 36.38 35.86 2o5j s VAL 672 CO 0.22 -0.06 1.64 -0.22 -0.31 0.00 0.00 175.10 176.37 2o5j s LEU 673 N -1.10 4.35 -0.04 1.32 0.20 -1.26 -2.01 118.68 120.14 2o5j s LEU 673 Ca -0.01 2.95 -0.02 0.00 0.69 0.00 0.00 54.13 57.74 2o5j s LEU 673 Cb -0.08 -3.63 0.02 0.00 -0.43 0.00 0.00 46.19 42.08 2o5j s LEU 673 CO 0.01 -0.94 0.08 0.54 -0.29 0.00 0.00 176.35 175.75 2o5j s VAL 674 N 0.33 -0.03 -0.22 1.68 0.11 0.17 -1.41 120.40 121.02 2o5j s VAL 674 Ca 0.67 0.12 -0.13 0.00 -2.93 0.00 0.00 61.98 59.70 2o5j s VAL 674 Cb -0.49 -0.14 -0.04 0.00 -1.53 0.00 0.00 36.38 34.18 2o5j s VAL 674 CO 0.44 0.05 0.28 0.00 -3.33 0.00 0.00 175.10 172.53 2o5j s ALA 675 N 0.67 3.59 -1.12 1.54 0.00 -0.69 -0.67 121.76 125.09 2o5j s ALA 675 Ca -0.05 -0.70 -0.05 0.00 0.00 0.00 0.00 51.96 51.15 2o5j s ALA 675 Cb -0.07 -2.47 0.28 0.00 0.00 0.00 0.00 23.12 20.86 2o5j s ALA 675 CO -0.03 -0.23 1.52 1.51 0.00 0.00 0.00 175.76 178.53 2o5j n ILE 676 N 4.28 5.11 -4.25 0.00 0.00 -1.06 -1.95 119.36 121.49 2o5j n ILE 676 Ca -0.12 -5.63 -0.14 0.00 0.00 0.00 0.00 62.75 56.87 2o5j n ILE 676 Cb 0.52 -2.17 -0.10 0.00 0.00 0.00 0.00 39.64 37.88 2o5j n ILE 676 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2o5j s MET 677 N -2.09 1.25 -0.08 9.51 0.23 -0.87 -4.61 119.30 122.63 2o5j s MET 677 Ca 0.33 -1.66 -0.15 0.00 -1.03 0.00 0.00 55.69 53.18 2o5j s MET 677 Cb 0.04 -0.03 -0.05 0.00 -1.53 0.00 0.00 34.83 33.27 2o5j s MET 677 CO 0.07 -0.30 0.38 -1.25 -2.03 0.00 0.00 175.02 171.89 2o5j s PRO 678 N -4.06 4.10 0.10 3.16 0.04 -1.26 -4.13 135.00 132.95 2o5j s PRO 678 Ca 0.35 0.31 0.02 0.00 0.04 0.00 0.00 61.00 61.71 2o5j s PRO 678 Cb 0.07 -3.34 0.02 0.00 0.04 0.00 0.00 34.50 31.29 2o5j s PRO 678 CO 0.11 0.42 0.14 0.34 0.04 0.00 0.00 177.00 178.05 2o5j n PHE 679 N 2.83 -2.77 0.00 0.56 7.35 -1.26 -5.06 117.46 119.11 2o5j n PHE 679 Ca -0.12 -0.38 0.00 0.00 -0.76 0.00 0.00 57.45 56.20 2o5j n PHE 679 Cb 0.52 -0.10 0.00 0.00 0.35 0.00 0.00 39.48 40.25 2o5j n PHE 679 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2o5j n ASP 680 N -2.82 0.00 0.00 -2.13 9.92 -1.26 -4.55 116.55 115.71 2o5j n ASP 680 Ca 0.03 0.27 0.00 0.00 -0.53 0.00 0.00 54.79 54.56 2o5j n ASP 680 Cb 0.11 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.59 2o5j n ASP 680 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2o5j n GLY 681 N -0.52 -0.20 0.32 0.44 0.00 -1.26 -4.90 105.19 99.08 2o5j n GLY 681 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 2o5j n GLY 681 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2o5j h TYR 682 N 0.00 -0.75 -1.85 1.61 0.05 -1.96 -3.25 116.97 110.82 2o5j h TYR 682 Ca 0.00 -0.00 -0.66 0.00 0.05 0.00 0.00 58.73 58.12 2o5j h TYR 682 Cb 0.67 0.28 -0.14 0.00 1.01 0.00 0.00 36.73 38.55 2o5j h TYR 682 CO 0.00 -0.42 1.17 0.54 -1.05 0.00 0.00 178.16 178.40 2o5j s ASN 683 N -4.66 6.62 1.06 3.88 2.20 -1.26 -4.31 114.94 118.47 2o5j s ASN 683 Ca -0.16 -1.90 -0.11 0.00 -0.94 0.00 0.00 52.86 49.74 2o5j s ASN 683 Cb 0.06 -2.47 0.16 0.00 -2.00 0.00 0.00 41.25 37.00 2o5j s ASN 683 CO 0.64 -1.21 0.77 0.33 -2.94 0.00 0.00 177.10 174.69 2o5j n PHE 684 N 7.43 -3.83 -0.35 1.54 7.35 -0.59 -4.68 117.46 124.33 2o5j n PHE 684 Ca 0.29 -0.69 0.06 0.00 -0.76 0.00 0.00 57.45 56.35 2o5j n PHE 684 Cb 0.49 -0.67 0.14 0.00 0.35 0.00 0.00 39.48 39.79 2o5j n PHE 684 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2o5j n GLU 685 N -3.07 -0.09 -0.01 -4.13 0.28 -1.26 -1.56 120.64 110.80 2o5j n GLU 685 Ca 0.10 1.52 0.07 0.00 -0.16 0.00 0.00 57.16 58.69 2o5j n GLU 685 Cb 0.36 -2.27 -0.10 0.00 1.43 0.00 0.00 31.44 30.85 2o5j n GLU 685 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2o5j n ASP 686 N -5.59 1.77 -4.77 -1.84 10.43 -1.26 -4.08 116.55 111.21 2o5j n ASP 686 Ca 0.16 -0.06 -0.38 0.00 2.57 0.00 0.00 54.79 57.08 2o5j n ASP 686 Cb 0.49 1.59 -0.04 0.00 1.84 0.00 0.00 41.12 45.00 2o5j n ASP 686 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2o5j s ALA 687 N -2.91 3.16 0.11 2.24 0.00 -0.60 -4.01 121.76 119.75 2o5j s ALA 687 Ca -0.04 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.72 2o5j s ALA 687 Cb 0.09 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2o5j s ALA 687 CO 0.57 -0.25 -0.08 0.42 0.00 0.00 0.00 175.76 176.42 2o5j s ILE 688 N -1.52 0.83 0.65 0.00 1.01 -0.18 -1.55 121.20 120.44 2o5j s ILE 688 Ca 0.55 -1.92 0.05 0.00 0.00 0.00 0.00 60.65 59.33 2o5j s ILE 688 Cb -0.25 -1.66 0.11 0.00 0.01 0.00 0.00 42.46 40.66 2o5j s ILE 688 CO 0.32 -0.80 0.89 -0.69 0.00 0.00 0.00 174.94 174.66 2o5j s VAL 689 N -3.38 2.14 -0.19 2.92 1.01 -1.22 -0.59 120.40 121.10 2o5j s VAL 689 Ca 0.12 -0.80 -0.27 0.00 0.00 0.00 0.00 61.98 61.02 2o5j s VAL 689 Cb 0.03 -2.34 0.08 0.00 0.00 0.00 0.00 36.38 34.16 2o5j s VAL 689 CO -0.03 0.00 0.75 -0.51 0.00 0.00 0.00 175.10 175.31 2o5j s ILE 690 N -2.90 0.00 -0.15 2.22 2.07 -1.05 -4.34 121.20 117.05 2o5j s ILE 690 Ca 0.64 0.00 -0.17 0.00 -1.41 0.00 0.00 60.65 59.71 2o5j s ILE 690 Cb -0.05 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.50 2o5j s ILE 690 CO 0.42 0.00 0.45 -0.55 -1.91 0.00 0.00 174.94 173.35 2o5j s SER 691 N -0.28 6.59 0.53 4.50 0.15 0.32 -1.49 113.70 124.01 2o5j s SER 691 Ca -0.04 0.70 0.32 0.00 0.70 0.00 0.00 55.95 57.63 2o5j s SER 691 Cb -0.03 -2.27 1.47 0.00 -1.71 0.00 0.00 66.02 63.48 2o5j s SER 691 CO 0.04 -0.04 1.87 -0.08 1.20 0.00 0.00 173.24 176.23 2o5j h GLU 692 N 6.98 0.03 -0.12 5.44 4.81 -1.09 0.43 114.58 131.05 2o5j h GLU 692 Ca -0.39 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.88 2o5j h GLU 692 Cb 1.17 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2o5j h GLU 692 CO 0.75 0.02 0.11 1.49 -0.73 0.00 0.00 179.01 180.64 2o5j h GLU 693 N 0.03 0.00 0.00 1.92 4.57 -1.93 -0.60 114.58 118.57 2o5j h GLU 693 Ca 0.46 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.58 2o5j h GLU 693 Cb 1.77 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.36 2o5j h GLU 693 CO -0.02 0.00 -0.24 -0.07 -1.18 0.00 0.00 179.01 177.50 2o5j h LEU 694 N 0.00 0.00 0.14 1.64 3.38 -0.43 -2.82 115.31 117.22 2o5j h LEU 694 Ca 0.06 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.71 2o5j h LEU 694 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2o5j h LEU 694 CO -0.00 0.24 -1.55 0.25 0.09 0.00 0.00 178.44 177.47 2o5j h LEU 695 N 0.00 0.45 -0.01 1.67 5.85 -1.24 -2.71 115.31 119.32 2o5j h LEU 695 Ca -0.00 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 58.11 2o5j h LEU 695 Cb 0.70 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 2o5j h LEU 695 CO 0.03 1.51 -0.03 0.11 -0.34 0.00 0.00 178.44 179.72 2o5j h LYS 696 N 0.08 -0.03 -6.28 1.25 1.57 -1.21 -3.29 116.57 108.66 2o5j h LYS 696 Ca -0.25 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.97 2o5j h LYS 696 Cb 2.04 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 34.32 2o5j h LYS 696 CO 0.17 -0.02 0.64 -0.98 -0.57 0.00 0.00 179.45 178.69 2o5j s ARG 697 N -3.16 4.38 -0.95 3.15 1.70 -1.17 -4.88 118.95 118.03 2o5j s ARG 697 Ca -0.01 1.52 -0.25 0.00 -0.47 0.00 0.00 55.73 56.53 2o5j s ARG 697 Cb 0.00 -3.55 -0.20 0.00 -0.57 0.00 0.00 34.95 30.63 2o5j s ARG 697 CO 0.04 -0.39 2.13 -0.25 -1.08 0.00 0.00 175.30 175.75 2o5j n ASP 698 N 5.14 1.19 -0.02 -2.89 10.43 -1.24 -4.52 116.55 124.65 2o5j n ASP 698 Ca 0.10 -2.12 -0.17 0.00 2.57 0.00 0.00 54.79 55.17 2o5j n ASP 698 Cb 0.47 -1.63 -0.14 0.00 1.84 0.00 0.00 41.12 41.67 2o5j n ASP 698 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 2o5j n PHE 699 N 18.55 0.96 -3.69 1.24 -0.00 -1.02 -4.55 117.46 128.94 2o5j n PHE 699 Ca 0.41 0.24 -0.28 0.00 -0.00 0.00 0.00 57.45 57.82 2o5j n PHE 699 Cb 0.45 -1.14 -0.12 0.00 -0.00 0.00 0.00 39.48 38.68 2o5j n PHE 699 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.76 177.47 2o5j s TYR 700 N -2.56 2.38 -0.01 -5.13 1.51 -1.26 -4.74 117.35 107.55 2o5j s TYR 700 Ca -0.18 -2.79 0.01 0.00 -1.01 0.00 0.00 57.07 53.09 2o5j s TYR 700 Cb 0.07 -1.93 0.01 0.00 -0.11 0.00 0.00 41.96 39.99 2o5j s TYR 700 CO 0.77 -0.70 -0.02 0.95 -1.11 0.00 0.00 175.55 175.44 2o5j s THR 701 N -0.51 0.22 0.06 -0.71 -4.23 -1.26 -1.18 115.64 108.03 2o5j s THR 701 Ca 0.26 -0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.67 2o5j s THR 701 Cb -0.07 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.51 2o5j s THR 701 CO -0.13 0.09 0.03 -0.94 -0.54 0.00 0.00 174.62 173.13 2o5j s SER 702 N 0.25 0.37 -0.10 3.99 1.04 -1.04 -1.14 113.70 117.07 2o5j s SER 702 Ca -0.02 -0.87 -0.02 0.00 0.48 0.00 0.00 55.95 55.52 2o5j s SER 702 Cb -0.05 0.23 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 2o5j s SER 702 CO -0.01 -0.62 -0.02 0.27 0.98 0.00 0.00 173.24 173.84 2o5j s ILE 703 N -3.76 4.08 -0.08 -1.02 -5.25 -1.25 -2.27 121.20 111.65 2o5j s ILE 703 Ca 0.05 -0.32 0.00 0.00 -0.99 0.00 0.00 60.65 59.39 2o5j s ILE 703 Cb 0.06 -2.73 0.02 0.00 2.95 0.00 0.00 42.46 42.77 2o5j s ILE 703 CO -0.10 0.57 -0.06 -1.00 -1.79 0.00 0.00 174.94 172.56 2o5j s HIS 704 N -0.48 1.16 -0.09 1.37 3.76 -1.25 -3.13 115.29 116.62 2o5j s HIS 704 Ca 0.08 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.52 2o5j s HIS 704 Cb -0.12 -1.00 -0.02 0.00 1.11 0.00 0.00 32.58 32.55 2o5j s HIS 704 CO 0.02 -0.37 -0.10 0.96 -0.85 0.00 0.00 174.74 174.40 2o5j s ILE 705 N 1.44 3.35 0.12 0.60 -5.25 -1.21 -3.06 121.20 117.20 2o5j s ILE 705 Ca -0.01 -0.58 0.11 0.00 -0.99 0.00 0.00 60.65 59.17 2o5j s ILE 705 Cb -0.13 -2.38 -0.04 0.00 2.95 0.00 0.00 42.46 42.85 2o5j s ILE 705 CO -0.04 0.56 -0.26 -0.70 -1.79 0.00 0.00 174.94 172.71 2o5j s GLU 706 N -0.26 1.39 -0.86 0.37 2.56 -0.42 -4.66 118.70 116.82 2o5j s GLU 706 Ca 0.02 -1.31 -0.00 0.00 0.00 0.00 0.00 54.97 53.69 2o5j s GLU 706 Cb -0.13 -1.84 0.23 0.00 2.00 0.00 0.00 34.13 34.39 2o5j s GLU 706 CO 0.03 0.44 0.85 -2.13 -0.56 0.00 0.00 175.26 173.88 2o5j n ARG 707 N 1.00 2.79 -2.23 4.30 0.63 -1.26 -1.13 116.66 120.75 2o5j n ARG 707 Ca -0.18 -4.53 -0.41 0.00 -0.92 0.00 0.00 57.85 51.82 2o5j n ARG 707 Cb 0.53 -2.39 -0.03 0.00 0.45 0.00 0.00 32.46 31.02 2o5j n ARG 707 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2o5j s TYR 708 N -1.77 3.23 0.01 -0.14 1.51 -1.07 -4.83 117.35 114.29 2o5j s TYR 708 Ca 0.30 1.49 0.01 0.00 -1.01 0.00 0.00 57.07 57.86 2o5j s TYR 708 Cb -0.01 -3.55 -0.01 0.00 -0.11 0.00 0.00 41.96 38.28 2o5j s TYR 708 CO -0.08 -1.45 -0.03 -2.00 -1.11 0.00 0.00 175.55 170.87 2o5j s GLU 709 N -1.56 0.27 0.02 -0.62 2.12 -1.26 0.15 118.70 117.83 2o5j s GLU 709 Ca 0.48 -0.30 0.00 0.00 0.36 0.00 0.00 54.97 55.52 2o5j s GLU 709 Cb -0.37 -0.14 -0.02 0.00 0.26 0.00 0.00 34.13 33.86 2o5j s GLU 709 CO 0.48 0.03 -0.04 -1.50 -0.54 0.00 0.00 175.26 173.69 2o5j s ILE 710 N -0.55 0.19 0.02 -3.70 2.07 0.71 -4.96 121.20 114.98 2o5j s ILE 710 Ca -0.04 -0.90 0.07 0.00 -1.41 0.00 0.00 60.65 58.37 2o5j s ILE 710 Cb -0.04 -0.32 -0.02 0.00 0.13 0.00 0.00 42.46 42.21 2o5j s ILE 710 CO -0.00 -0.45 -0.21 -1.61 -1.91 0.00 0.00 174.94 170.76 2o5j s GLU 711 N -1.41 1.51 -1.00 3.50 2.02 -1.26 0.16 118.70 122.21 2o5j s GLU 711 Ca -0.14 -0.88 -0.19 0.00 0.02 0.00 0.00 54.97 53.78 2o5j s GLU 711 Cb -0.10 -1.57 0.12 0.00 0.10 0.00 0.00 34.13 32.69 2o5j s GLU 711 CO -0.01 0.41 1.25 0.00 0.02 0.00 0.00 175.26 176.94 2o5j s ALA 712 N -0.69 3.36 0.69 5.21 0.00 0.60 -4.96 121.76 125.97 2o5j s ALA 712 Ca 0.08 -2.79 -0.11 0.00 0.00 0.00 0.00 51.96 49.14 2o5j s ALA 712 Cb -0.09 -4.16 0.01 0.00 0.00 0.00 0.00 23.12 18.88 2o5j s ALA 712 CO 0.01 -3.07 1.06 0.50 0.00 0.00 0.00 175.76 174.26 2o5j s ARG 713 N 2.94 2.94 -0.46 0.00 3.52 -1.26 0.16 118.95 126.80 2o5j s ARG 713 Ca 0.37 0.97 -0.11 0.00 -0.13 0.00 0.00 55.73 56.83 2o5j s ARG 713 Cb -0.03 -1.99 0.10 0.00 -1.56 0.00 0.00 34.95 31.46 2o5j s ARG 713 CO -0.07 -1.09 0.35 0.34 -0.81 0.00 0.00 175.30 174.01 2o5j s ASP 714 N -3.74 5.84 0.08 -2.12 -1.08 0.44 -1.64 116.67 114.45 2o5j s ASP 714 Ca 0.58 -1.62 -0.05 0.00 -0.52 0.00 0.00 52.55 50.94 2o5j s ASP 714 Cb -0.14 -2.07 -0.05 0.00 -1.46 0.00 0.00 42.92 39.20 2o5j s ASP 714 CO 0.54 -0.65 0.31 -0.89 0.52 0.00 0.00 175.17 175.00 2o5j s THR 715 N 1.48 5.25 -2.00 1.71 2.01 -1.26 -4.88 115.64 117.95 2o5j s THR 715 Ca 0.04 0.03 0.18 0.00 0.31 0.00 0.00 61.69 62.24 2o5j s THR 715 Cb -0.25 -3.61 0.51 0.00 0.01 0.00 0.00 72.50 69.16 2o5j s THR 715 CO 0.02 0.18 1.47 0.29 -0.69 0.00 0.00 174.62 175.90 2o5j n LYS 716 N 0.52 0.59 0.07 4.92 5.02 -1.26 -1.12 118.16 126.91 2o5j n LYS 716 Ca -0.06 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.34 2o5j n LYS 716 Cb 0.52 -1.47 0.06 0.00 -0.02 0.00 0.00 35.03 34.11 2o5j n LYS 716 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2o5j n LEU 717 N -0.97 0.74 0.00 -0.35 4.77 -1.26 -5.02 117.00 114.91 2o5j n LEU 717 Ca 0.13 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.35 2o5j n LEU 717 Cb 0.06 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2o5j n LEU 717 CO 0.10 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2o5j n GLY 718 N 1.26 4.65 3.64 -0.72 0.00 -0.28 -4.86 105.19 108.89 2o5j n GLY 718 Ca 0.01 -0.84 -0.46 0.00 0.00 0.00 0.00 46.02 44.74 2o5j n GLY 718 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 719 N -1.08 1.72 -2.36 1.61 -0.02 -1.26 -3.98 135.00 129.63 2o5j n PRO 719 Ca 0.00 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.67 2o5j n PRO 719 Cb 0.00 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.27 2o5j n PRO 719 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2o5j s GLU 720 N -0.58 3.41 0.25 -0.52 2.02 -0.65 -4.84 118.70 117.78 2o5j s GLU 720 Ca 0.68 0.68 -0.12 0.00 0.02 0.00 0.00 54.97 56.23 2o5j s GLU 720 Cb -0.71 -4.08 -0.08 0.00 0.10 0.00 0.00 34.13 29.36 2o5j s GLU 720 CO 0.52 -1.78 0.61 0.50 0.02 0.00 0.00 175.26 175.13 2o5j s ARG 721 N 5.28 3.89 -0.43 1.61 3.52 -0.73 -4.53 118.95 127.56 2o5j s ARG 721 Ca 0.57 0.43 -0.13 0.00 -0.13 0.00 0.00 55.73 56.47 2o5j s ARG 721 Cb -0.12 -2.62 0.06 0.00 -1.56 0.00 0.00 34.95 30.70 2o5j s ARG 721 CO 0.29 0.29 0.31 -1.50 -0.81 0.00 0.00 175.30 173.88 2o5j s ILE 722 N -1.82 4.89 0.11 4.11 2.07 -1.26 0.42 121.20 129.72 2o5j s ILE 722 Ca 0.48 -1.03 -0.16 0.00 -1.41 0.00 0.00 60.65 58.54 2o5j s ILE 722 Cb -0.11 -3.86 0.03 0.00 0.13 0.00 0.00 42.46 38.64 2o5j s ILE 722 CO 0.20 -0.45 0.38 0.28 -1.91 0.00 0.00 174.94 173.44 2o5j s THR 723 N 1.58 0.07 -0.68 4.00 -1.32 -1.11 -4.77 115.64 113.42 2o5j s THR 723 Ca 0.04 -0.61 0.09 0.00 -1.21 0.00 0.00 61.69 60.00 2o5j s THR 723 Cb -0.22 -1.14 0.09 0.00 -1.51 0.00 0.00 72.50 69.72 2o5j s THR 723 CO 0.06 -0.34 1.28 -1.14 -2.21 0.00 0.00 174.62 172.28 2o5j n ARG 724 N -0.07 0.06 -2.53 7.08 0.63 -1.26 -4.45 116.66 116.13 2o5j n ARG 724 Ca -0.16 0.55 -0.43 0.00 -0.92 0.00 0.00 57.85 56.89 2o5j n ARG 724 Cb 0.63 -1.69 -0.02 0.00 0.45 0.00 0.00 32.46 31.83 2o5j n ARG 724 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2o5j s ASP 725 N -3.43 6.50 -0.87 6.15 1.01 -1.26 -4.88 116.67 119.89 2o5j s ASP 725 Ca -0.01 0.47 -0.00 0.00 0.71 0.00 0.00 52.55 53.72 2o5j s ASP 725 Cb 0.03 -2.55 0.23 0.00 1.01 0.00 0.00 42.92 41.64 2o5j s ASP 725 CO 0.09 -1.37 0.85 -0.38 0.21 0.00 0.00 175.17 174.57 2o5j n ILE 726 N 6.88 3.13 0.00 0.77 -0.00 -1.26 -4.77 119.36 124.11 2o5j n ILE 726 Ca 0.13 -5.23 0.00 0.00 -0.00 0.00 0.00 62.75 57.65 2o5j n ILE 726 Cb 0.49 -2.28 0.00 0.00 -0.00 0.00 0.00 39.64 37.85 2o5j n ILE 726 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 176.55 173.90 2o5j n PRO 727 N 1.90 0.00 -0.03 0.38 -0.02 -1.26 -3.77 135.00 132.20 2o5j n PRO 727 Ca 0.24 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.68 2o5j n PRO 727 Cb 0.37 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.79 2o5j n PRO 727 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2o5j n HIS 728 N -2.02 0.00 0.00 6.00 8.25 -1.26 -4.96 115.22 121.22 2o5j n HIS 728 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2o5j n HIS 728 Cb 0.00 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 30.76 2o5j n HIS 728 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2o5j n LEU 729 N -2.26 0.37 -4.00 2.41 7.94 -1.25 -5.14 117.00 115.07 2o5j n LEU 729 Ca -0.12 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.69 2o5j n LEU 729 Cb 0.73 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.60 2o5j n LEU 729 CO 0.15 -0.12 -0.10 -0.94 -1.11 0.00 0.00 177.39 175.27 2o5j s SER 730 N -4.05 0.12 0.01 1.96 1.04 -1.26 -5.00 113.70 106.52 2o5j s SER 730 Ca 0.00 -0.94 0.12 0.00 0.48 0.00 0.00 55.95 55.61 2o5j s SER 730 Cb 0.00 0.39 -0.21 0.00 0.10 0.00 0.00 66.02 66.29 2o5j s SER 730 CO 0.00 -0.83 0.82 -0.08 0.98 0.00 0.00 173.24 174.13 2o5j h GLU 731 N 2.66 0.00 -0.31 4.02 4.57 -1.98 -3.35 114.58 120.19 2o5j h GLU 731 Ca -0.33 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 57.94 2o5j h GLU 731 Cb 1.22 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 2o5j h GLU 731 CO 0.52 0.58 0.24 0.00 -1.18 0.00 0.00 179.01 179.17 2o5j h ALA 732 N 1.04 2.20 -0.02 2.92 0.00 -2.03 0.19 119.26 123.56 2o5j h ALA 732 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2o5j h ALA 732 Cb 1.92 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.73 2o5j h ALA 732 CO 0.09 -0.40 -0.00 0.00 0.00 0.00 0.00 179.25 178.93 2o5j n ALA 733 N -2.54 2.54 0.60 0.00 0.00 -1.25 -4.06 120.51 115.79 2o5j n ALA 733 Ca 0.04 -0.55 0.07 0.00 0.00 0.00 0.00 53.44 53.01 2o5j n ALA 733 Cb 0.41 -1.02 0.05 0.00 0.00 0.00 0.00 19.45 18.89 2o5j n ALA 733 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2o5j n LEU 734 N 0.65 2.06 0.23 0.00 4.32 0.64 -4.58 117.00 120.33 2o5j n LEU 734 Ca 0.17 -0.96 -0.09 0.00 -0.02 0.00 0.00 56.01 55.11 2o5j n LEU 734 Cb 0.46 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.21 2o5j n LEU 734 CO 0.16 0.38 0.51 0.03 -1.22 0.00 0.00 177.39 177.25 2o5j h ARG 735 N 2.58 -0.56 -1.09 3.23 3.08 -1.65 -2.94 114.38 117.03 2o5j h ARG 735 Ca 0.00 0.04 0.30 0.00 0.07 0.00 0.00 59.98 60.39 2o5j h ARG 735 Cb 0.57 0.13 -0.08 0.00 0.08 0.00 0.00 29.97 30.67 2o5j h ARG 735 CO 0.00 -0.38 0.73 -0.44 -1.07 0.00 0.00 179.97 178.81 2o5j h ASP 736 N -0.59 0.30 -0.34 7.04 3.45 -1.87 -2.08 116.42 122.32 2o5j h ASP 736 Ca -0.06 0.06 -0.70 0.00 0.43 0.00 0.00 57.03 56.76 2o5j h ASP 736 Cb 0.45 0.02 -0.06 0.00 -0.56 0.00 0.00 39.33 39.18 2o5j h ASP 736 CO 0.10 0.04 2.79 -0.11 -1.57 0.00 0.00 179.24 180.50 2o5j n LEU 737 N -4.50 6.26 0.01 1.55 0.00 -1.11 -1.00 117.00 118.21 2o5j n LEU 737 Ca 0.26 -4.10 -0.01 0.00 0.00 0.00 0.00 56.01 52.17 2o5j n LEU 737 Cb 1.01 -1.68 -0.00 0.00 0.00 0.00 0.00 43.42 42.75 2o5j n LEU 737 CO 0.30 0.82 0.16 -0.78 0.00 0.00 0.00 177.39 177.89 2o5j h ASP 738 N 6.48 -0.04 -3.05 1.96 3.58 -1.42 -3.44 116.42 120.49 2o5j h ASP 738 Ca 0.52 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 57.42 2o5j h ASP 738 Cb 0.71 0.01 0.08 0.00 1.72 0.00 0.00 39.33 41.86 2o5j h ASP 738 CO 1.74 0.01 0.77 -1.84 -2.88 0.00 0.00 179.24 177.04 2o5j n GLU 739 N -2.32 2.43 -1.50 0.28 0.00 -1.22 -4.71 120.64 113.60 2o5j n GLU 739 Ca -0.01 0.87 -0.41 0.00 0.00 0.00 0.00 57.16 57.61 2o5j n GLU 739 Cb 0.02 -2.60 -0.12 0.00 0.00 0.00 0.00 31.44 28.75 2o5j n GLU 739 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2o5j n GLU 740 N 2.07 0.30 0.00 3.44 2.13 -1.26 -1.72 120.64 125.59 2o5j n GLU 740 Ca 0.10 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.92 2o5j n GLU 740 Cb 0.35 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.03 2o5j n GLU 740 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2o5j n GLY 741 N 6.42 2.79 3.87 8.31 0.00 -1.26 -4.59 105.19 120.74 2o5j n GLY 741 Ca 0.57 -0.69 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2o5j n GLY 741 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 742 N 0.00 4.73 0.06 1.61 1.01 -0.70 -3.32 120.40 123.79 2o5j s VAL 742 Ca 0.00 0.80 -0.19 0.00 0.00 0.00 0.00 61.98 62.59 2o5j s VAL 742 Cb 0.00 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 2o5j s VAL 742 CO 0.00 -1.05 0.55 0.54 0.00 0.00 0.00 175.10 175.15 2o5j s VAL 743 N -3.04 4.77 0.31 2.92 0.11 -1.21 -3.45 120.40 120.79 2o5j s VAL 743 Ca 0.54 1.18 -0.28 0.00 -2.93 0.00 0.00 61.98 60.49 2o5j s VAL 743 Cb -0.11 -3.88 -0.09 0.00 -1.53 0.00 0.00 36.38 30.77 2o5j s VAL 743 CO 0.50 0.56 1.12 0.00 -3.33 0.00 0.00 175.10 173.95 2o5j s ARG 744 N -1.09 4.51 0.29 1.54 1.70 -0.17 -4.88 118.95 120.85 2o5j s ARG 744 Ca 0.28 1.82 -0.29 0.00 -0.47 0.00 0.00 55.73 57.07 2o5j s ARG 744 Cb -0.19 -3.06 -0.10 0.00 -0.57 0.00 0.00 34.95 31.02 2o5j s ARG 744 CO 0.18 0.09 1.31 0.42 -1.08 0.00 0.00 175.30 176.22 2o5j s ILE 745 N -1.23 2.86 0.00 4.99 1.09 -1.26 -2.90 121.20 124.74 2o5j s ILE 745 Ca 0.47 0.82 0.00 0.00 -1.10 0.00 0.00 60.65 60.84 2o5j s ILE 745 Cb -0.32 -3.52 0.00 0.00 -1.06 0.00 0.00 42.46 37.56 2o5j s ILE 745 CO 0.41 0.17 0.00 0.61 -0.10 0.00 0.00 174.94 176.03 2o5j n GLY 746 N 1.30 0.56 3.66 6.18 0.00 0.29 -5.01 105.19 112.18 2o5j n GLY 746 Ca 0.02 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 2o5j n GLY 746 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 747 N -2.00 3.51 -0.54 4.61 0.00 -1.14 -4.83 121.76 121.37 2o5j s ALA 747 Ca 0.00 -0.76 -0.28 0.00 0.00 0.00 0.00 51.96 50.92 2o5j s ALA 747 Cb 0.00 -2.06 0.01 0.00 0.00 0.00 0.00 23.12 21.07 2o5j s ALA 747 CO 0.00 0.09 1.50 -2.00 0.00 0.00 0.00 175.76 175.36 2o5j s GLU 748 N 0.51 3.24 -0.29 0.00 -6.30 -1.26 0.12 118.70 114.73 2o5j s GLU 748 Ca 0.05 0.59 -0.10 0.00 -2.50 0.00 0.00 54.97 53.01 2o5j s GLU 748 Cb -0.12 -4.16 -0.03 0.00 0.00 0.00 0.00 34.13 29.82 2o5j s GLU 748 CO 0.00 -2.00 0.15 0.14 0.02 0.00 0.00 175.26 173.57 2o5j s VAL 749 N 6.45 4.82 0.43 3.70 -7.23 0.40 -4.94 120.40 124.03 2o5j s VAL 749 Ca 0.57 -0.15 0.02 0.00 -1.81 0.00 0.00 61.98 60.61 2o5j s VAL 749 Cb -0.12 -3.35 -0.00 0.00 0.56 0.00 0.00 36.38 33.46 2o5j s VAL 749 CO 0.26 0.19 0.64 -0.54 -0.31 0.00 0.00 175.10 175.33 2o5j s LYS 750 N 1.67 3.04 0.14 4.82 1.02 -1.26 -2.23 119.74 126.94 2o5j s LYS 750 Ca 0.06 -0.62 -0.32 0.00 0.02 0.00 0.00 55.97 55.11 2o5j s LYS 750 Cb -0.16 -2.61 -0.12 0.00 -0.52 0.00 0.00 37.83 34.42 2o5j s LYS 750 CO 0.07 -0.23 1.74 -2.30 -0.92 0.00 0.00 175.35 173.71 2o5j n PRO 751 N -2.00 2.56 0.00 -1.68 -0.02 -1.26 -2.24 135.00 130.35 2o5j n PRO 751 Ca 0.01 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 2o5j n PRO 751 Cb 0.58 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 2o5j n PRO 751 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 752 N 3.94 0.84 3.96 -1.23 0.00 0.51 -4.91 105.19 108.30 2o5j n GLY 752 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2o5j n GLY 752 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o5j s ASP 753 N -2.31 6.19 -0.33 1.61 1.01 -0.95 -4.55 116.67 117.33 2o5j s ASP 753 Ca 0.00 0.25 -0.26 0.00 0.71 0.00 0.00 52.55 53.24 2o5j s ASP 753 Cb 0.00 -1.81 0.01 0.00 1.01 0.00 0.00 42.92 42.13 2o5j s ASP 753 CO 0.00 -0.32 0.93 -0.63 0.21 0.00 0.00 175.17 175.36 2o5j s ILE 754 N -2.25 4.62 -0.04 0.77 -1.09 -1.26 -1.15 121.20 120.80 2o5j s ILE 754 Ca 0.40 1.37 -0.10 0.00 -2.23 0.00 0.00 60.65 60.09 2o5j s ILE 754 Cb -0.09 -4.31 -0.31 0.00 -1.58 0.00 0.00 42.46 36.17 2o5j s ILE 754 CO 0.34 -0.43 0.70 -0.07 -1.23 0.00 0.00 174.94 174.25 2o5j h LEU 755 N 9.89 0.61 -7.35 2.97 3.38 -1.85 -3.43 115.31 119.54 2o5j h LEU 755 Ca -0.23 -0.90 -0.14 0.00 0.09 0.00 0.00 57.88 56.71 2o5j h LEU 755 Cb 1.08 -0.20 -0.26 0.00 0.09 0.00 0.00 40.66 41.37 2o5j h LEU 755 CO 0.97 1.75 -0.34 -0.69 0.09 0.00 0.00 178.44 180.23 2o5j s VAL 756 N -2.58 -0.01 -0.13 1.22 1.01 -1.23 -3.36 120.40 115.31 2o5j s VAL 756 Ca -0.15 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 2o5j s VAL 756 Cb 0.05 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 2o5j s VAL 756 CO 0.86 0.02 0.07 -0.83 0.00 0.00 0.00 175.10 175.22 2o5j s GLY 757 N 0.56 1.97 0.02 4.51 0.00 -1.21 -2.12 107.32 111.06 2o5j s GLY 757 Ca -0.03 -0.73 -0.02 0.00 0.00 0.00 0.00 44.72 43.94 2o5j s GLY 757 CO -0.03 -0.26 0.02 -1.60 0.00 0.00 0.00 173.10 171.22 2o5j s ARG 758 N -0.44 0.41 -0.17 2.90 3.52 -1.26 -2.75 118.95 121.16 2o5j s ARG 758 Ca 0.10 -0.64 -0.01 0.00 -0.13 0.00 0.00 55.73 55.04 2o5j s ARG 758 Cb -0.12 0.15 0.05 0.00 -1.56 0.00 0.00 34.95 33.47 2o5j s ARG 758 CO 0.02 -0.08 -0.01 0.95 -0.81 0.00 0.00 175.30 175.36 2o5j s THR 759 N -1.83 0.87 0.23 4.11 -4.23 0.17 -3.42 115.64 111.54 2o5j s THR 759 Ca -0.12 -0.60 0.02 0.00 -1.18 0.00 0.00 61.69 59.81 2o5j s THR 759 Cb -0.07 -1.18 0.02 0.00 1.34 0.00 0.00 72.50 72.62 2o5j s THR 759 CO -0.02 -0.01 0.19 -1.54 -0.54 0.00 0.00 174.62 172.70 2o5j n SER 760 N 4.94 1.61 -4.86 3.99 3.41 -1.23 -1.78 113.62 119.70 2o5j n SER 760 Ca -0.10 -1.76 -0.35 0.00 -0.26 0.00 0.00 58.87 56.39 2o5j n SER 760 Cb 0.47 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.33 2o5j n SER 760 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2o5j s PHE 761 N -1.04 3.51 0.09 7.33 0.40 -1.26 -1.95 117.98 125.05 2o5j s PHE 761 Ca 0.14 0.40 -0.30 0.00 -0.60 0.00 0.00 56.93 56.58 2o5j s PHE 761 Cb -0.01 -1.86 -0.13 0.00 0.51 0.00 0.00 43.02 41.53 2o5j s PHE 761 CO 0.09 0.66 1.48 -0.22 0.70 0.00 0.00 175.22 177.93 2o5j h LYS 762 N 4.46 -0.65 0.00 0.44 1.63 -1.90 -3.45 116.57 117.10 2o5j h LYS 762 Ca -0.52 0.04 -0.13 0.00 -0.85 0.00 0.00 60.65 59.20 2o5j h LYS 762 Cb 1.21 0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.98 2o5j h LYS 762 CO 0.62 -0.44 -0.05 0.41 -3.45 0.00 0.00 179.45 176.55 2o5j n GLY 763 N -1.43 2.64 0.14 5.01 0.00 -1.26 -5.00 105.19 105.29 2o5j n GLY 763 Ca -0.08 -2.19 -0.16 0.00 0.00 0.00 0.00 46.02 43.59 2o5j n GLY 763 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2o5j h GLU 764 N 0.00 0.37 0.00 1.61 4.39 -1.96 -3.45 114.58 115.55 2o5j h GLU 764 Ca -0.08 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2o5j h GLU 764 Cb 0.30 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2o5j h GLU 764 CO 0.12 1.03 0.00 0.43 -1.16 0.00 0.00 179.01 179.43 2o5j n SER 765 N -4.31 0.00 -4.46 1.42 7.64 -1.26 -4.95 113.62 107.71 2o5j n SER 765 Ca -0.09 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.49 2o5j n SER 765 Cb 0.60 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.68 2o5j n SER 765 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2o5j s GLU 766 N -0.11 1.65 0.00 1.43 4.04 -1.26 -5.15 118.70 119.30 2o5j s GLU 766 Ca 0.00 -1.26 0.00 0.00 0.04 0.00 0.00 54.97 53.75 2o5j s GLU 766 Cb 0.00 -2.03 0.00 0.00 0.02 0.00 0.00 34.13 32.12 2o5j s GLU 766 CO 0.00 0.46 0.00 -2.30 -1.84 0.00 0.00 175.26 171.58 2o5j n PRO 767 N 0.78 1.96 -3.77 -4.83 -0.02 -1.26 -4.40 135.00 123.47 2o5j n PRO 767 Ca -0.16 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.08 2o5j n PRO 767 Cb 0.53 0.00 -0.17 0.00 -0.02 0.00 0.00 33.50 33.84 2o5j n PRO 767 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2o5j s THR 768 N 0.00 0.42 0.38 3.45 2.01 -1.26 -4.97 115.64 115.67 2o5j s THR 768 Ca 0.00 -0.05 0.05 0.00 0.31 0.00 0.00 61.69 62.00 2o5j s THR 768 Cb 0.00 -0.66 0.27 0.00 0.01 0.00 0.00 72.50 72.11 2o5j s THR 768 CO 0.00 0.15 2.03 -0.65 -0.69 0.00 0.00 174.62 175.46 2o5j h PRO 769 N 8.31 0.70 0.17 4.92 0.11 -1.98 0.19 132.00 144.41 2o5j h PRO 769 Ca -0.19 -0.04 -0.26 0.00 0.11 0.00 0.00 66.00 65.62 2o5j h PRO 769 Cb 1.12 -0.16 0.03 0.00 0.11 0.00 0.00 31.00 32.10 2o5j h PRO 769 CO 0.28 0.47 -1.11 0.93 -0.21 0.00 0.00 178.00 178.36 2o5j h GLU 770 N 0.72 0.45 0.00 1.05 4.39 -2.01 -3.25 114.58 115.94 2o5j h GLU 770 Ca 0.21 -0.71 0.00 0.00 0.34 0.00 0.00 59.36 59.19 2o5j h GLU 770 Cb -0.05 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2o5j h GLU 770 CO -0.05 1.33 0.00 -1.91 -1.16 0.00 0.00 179.01 177.22 2o5j n GLU 771 N -3.93 0.09 0.09 2.33 2.13 -1.13 -2.89 120.64 117.32 2o5j n GLU 771 Ca -0.15 0.22 -0.16 0.00 0.66 0.00 0.00 57.16 57.74 2o5j n GLU 771 Cb 0.94 -1.64 -0.09 0.00 0.27 0.00 0.00 31.44 30.92 2o5j n GLU 771 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 2o5j h ARG 772 N 0.00 0.40 -0.07 5.31 9.65 -0.66 -2.52 114.38 126.49 2o5j h ARG 772 Ca 0.00 -0.51 -0.20 0.00 -1.10 0.00 0.00 59.98 58.16 2o5j h ARG 772 Cb 0.42 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.17 2o5j h ARG 772 CO 0.00 1.19 -0.80 -0.07 2.80 0.00 0.00 179.97 183.09 2o5j h LEU 773 N 0.18 0.60 -0.15 3.80 3.38 -1.57 -2.90 115.31 118.65 2o5j h LEU 773 Ca -0.12 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.41 2o5j h LEU 773 Cb 1.77 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2o5j h LEU 773 CO 0.19 1.19 0.01 0.25 0.09 0.00 0.00 178.44 180.17 2o5j h LEU 774 N 0.32 0.25 0.04 1.67 6.46 -1.60 -2.43 115.31 120.03 2o5j h LEU 774 Ca -0.05 -0.28 0.02 0.00 -0.12 0.00 0.00 57.88 57.44 2o5j h LEU 774 Cb 1.40 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 41.24 2o5j h LEU 774 CO 0.14 0.47 -0.14 0.03 -0.62 0.00 0.00 178.44 178.32 2o5j h ARG 775 N 0.03 -0.25 -0.76 1.25 2.47 -1.52 -3.14 114.38 112.45 2o5j h ARG 775 Ca 0.05 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.79 2o5j h ARG 775 Cb 0.33 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.67 2o5j h ARG 775 CO 0.01 -0.17 0.50 0.77 0.56 0.00 0.00 179.97 181.63 2o5j h SER 776 N -0.26 0.85 0.04 7.04 0.02 -1.52 0.84 113.55 120.56 2o5j h SER 776 Ca 0.04 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2o5j h SER 776 Cb 0.30 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 2o5j h SER 776 CO -0.11 0.61 -0.24 0.40 -1.14 0.00 0.00 176.83 176.35 2o5j h ILE 777 N 1.01 0.44 0.00 3.27 2.04 -1.39 -3.18 117.51 119.71 2o5j h ILE 777 Ca 0.28 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.90 2o5j h ILE 777 Cb -0.09 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.39 2o5j h ILE 777 CO -0.07 0.00 -1.54 -0.26 0.00 0.00 0.00 178.15 176.28 2o5j h PHE 778 N -0.40 0.00 0.00 1.37 -1.00 -1.60 -3.47 116.94 111.84 2o5j h PHE 778 Ca 0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.83 2o5j h PHE 778 Cb 0.47 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.03 2o5j h PHE 778 CO -0.26 0.85 0.00 0.41 -1.61 0.00 0.00 178.31 177.69 2o5j n GLY 779 N 1.48 -1.44 0.33 -1.45 0.00 -0.14 -5.05 105.19 98.92 2o5j n GLY 779 Ca -0.13 0.86 0.13 0.00 0.00 0.00 0.00 46.02 46.89 2o5j n GLY 779 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2o5j h GLU 780 N 0.00 0.06 -5.23 1.61 -0.00 -0.91 -3.27 114.58 106.83 2o5j h GLU 780 Ca 0.00 -0.00 -0.34 0.00 -0.00 0.00 0.00 59.36 59.02 2o5j h GLU 780 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 28.73 2o5j h GLU 780 CO 0.00 0.04 1.09 0.36 -0.00 0.00 0.00 179.01 180.50 2o5j n LYS 781 N -5.41 1.26 -4.80 1.06 2.85 -1.26 -4.62 118.16 107.23 2o5j n LYS 781 Ca 0.22 -2.18 -0.30 0.00 -1.05 0.00 0.00 58.31 55.00 2o5j n LYS 781 Cb 0.72 -3.59 -0.17 0.00 -0.65 0.00 0.00 35.03 31.34 2o5j n LYS 781 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2o5j s ALA 782 N 11.07 1.87 -0.86 0.58 0.00 -1.23 -5.04 121.76 128.15 2o5j s ALA 782 Ca 0.69 -0.81 -0.21 0.00 0.00 0.00 0.00 51.96 51.62 2o5j s ALA 782 Cb 0.02 -0.80 -0.22 0.00 0.00 0.00 0.00 23.12 22.12 2o5j s ALA 782 CO 0.15 0.10 2.39 -2.13 0.00 0.00 0.00 175.76 176.28 2o5j n ARG 783 N 3.85 0.32 -0.28 0.00 0.63 -1.26 -4.69 116.66 115.24 2o5j n ARG 783 Ca -0.20 -0.23 0.30 0.00 -0.92 0.00 0.00 57.85 56.80 2o5j n ARG 783 Cb 0.52 -2.24 0.46 0.00 0.45 0.00 0.00 32.46 31.65 2o5j n ARG 783 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2o5j n ASP 784 N 11.88 0.00 -4.75 6.15 2.03 -1.26 -4.57 116.55 126.03 2o5j n ASP 784 Ca 0.57 0.74 -0.38 0.00 0.52 0.00 0.00 54.79 56.23 2o5j n ASP 784 Cb 0.26 -0.28 0.04 0.00 -0.72 0.00 0.00 41.12 40.43 2o5j n ASP 784 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2o5j s VAL 785 N -4.33 2.05 0.23 5.18 1.01 -1.26 -4.27 120.40 119.02 2o5j s VAL 785 Ca -0.03 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2o5j s VAL 785 Cb 0.15 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2o5j s VAL 785 CO 0.50 -0.00 0.41 -0.75 0.00 0.00 0.00 175.10 175.25 2o5j s LYS 786 N -2.93 3.49 -0.56 2.72 2.20 -0.82 -4.88 119.74 118.95 2o5j s LYS 786 Ca 0.72 -0.44 -0.23 0.00 -0.36 0.00 0.00 55.97 55.65 2o5j s LYS 786 Cb -0.41 -2.82 0.05 0.00 -1.51 0.00 0.00 37.83 33.14 2o5j s LYS 786 CO 0.48 0.37 0.91 0.34 -0.36 0.00 0.00 175.35 177.09 2o5j s ASP 787 N -3.50 6.31 -0.64 1.43 3.68 -1.26 -3.58 116.67 119.11 2o5j s ASP 787 Ca 0.38 -0.48 0.05 0.00 2.13 0.00 0.00 52.55 54.63 2o5j s ASP 787 Cb -0.10 -2.42 0.20 0.00 -1.45 0.00 0.00 42.92 39.15 2o5j s ASP 787 CO 0.30 -1.22 0.58 0.35 0.13 0.00 0.00 175.17 175.31 2o5j n THR 788 N 6.10 1.51 -4.74 1.71 -2.24 -1.22 -5.04 114.28 110.36 2o5j n THR 788 Ca 0.00 -4.82 -0.32 0.00 -2.27 0.00 0.00 64.05 56.64 2o5j n THR 788 Cb 0.47 -2.09 -0.12 0.00 -2.10 0.00 0.00 70.33 66.48 2o5j n THR 788 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2o5j s SER 789 N -1.69 4.19 -0.14 3.42 0.01 -1.26 -3.98 113.70 114.25 2o5j s SER 789 Ca 0.32 -0.20 -0.29 0.00 1.31 0.00 0.00 55.95 57.09 2o5j s SER 789 Cb 0.05 -0.90 -0.05 0.00 0.21 0.00 0.00 66.02 65.33 2o5j s SER 789 CO -0.11 0.32 1.90 -0.22 0.41 0.00 0.00 173.24 175.54 2o5j s LEU 790 N -0.97 3.92 0.27 2.44 2.96 -0.90 -4.97 118.68 121.42 2o5j s LEU 790 Ca 0.13 2.01 0.10 0.00 -0.22 0.00 0.00 54.13 56.15 2o5j s LEU 790 Cb -0.11 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 2o5j s LEU 790 CO 0.03 -1.41 -0.01 -0.13 -1.32 0.00 0.00 176.35 173.51 2o5j s ARG 791 N 5.11 2.28 -0.28 1.98 0.52 -1.26 -2.55 118.95 124.74 2o5j s ARG 791 Ca 0.85 -1.43 -0.29 0.00 -0.52 0.00 0.00 55.73 54.35 2o5j s ARG 791 Cb -0.33 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 32.98 2o5j s ARG 791 CO 0.35 0.36 1.65 0.08 0.02 0.00 0.00 175.30 177.76 2o5j s VAL 792 N -2.33 3.64 0.63 3.52 1.01 -0.30 -4.84 120.40 121.74 2o5j s VAL 792 Ca 0.31 0.70 -0.19 0.00 0.00 0.00 0.00 61.98 62.80 2o5j s VAL 792 Cb -0.06 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 2o5j s VAL 792 CO 0.20 -0.39 1.31 -2.84 0.00 0.00 0.00 175.10 173.37 2o5j s PRO 793 N 5.05 2.63 0.78 2.72 0.02 -1.26 -0.36 135.00 144.58 2o5j s PRO 793 Ca 0.73 2.11 -0.15 0.00 0.02 0.00 0.00 61.00 63.71 2o5j s PRO 793 Cb -0.23 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.39 2o5j s PRO 793 CO 0.31 -1.55 0.70 -2.30 -0.33 0.00 0.00 177.00 173.84 2o5j n PRO 794 N -1.77 0.21 0.00 5.54 -0.02 -1.26 -4.05 135.00 133.65 2o5j n PRO 794 Ca 0.15 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2o5j n PRO 794 Cb 0.47 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 2o5j n PRO 794 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 795 N 1.33 0.59 3.65 -1.23 0.00 -1.26 -5.02 105.19 103.25 2o5j n GLY 795 Ca 0.11 -1.17 -0.09 0.00 0.00 0.00 0.00 46.02 44.87 2o5j n GLY 795 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5j s GLU 796 N 0.00 1.58 0.20 1.61 2.02 -1.26 -4.73 118.70 118.12 2o5j s GLU 796 Ca 0.00 -1.09 -0.01 0.00 0.02 0.00 0.00 54.97 53.89 2o5j s GLU 796 Cb 0.00 0.52 -0.04 0.00 0.10 0.00 0.00 34.13 34.71 2o5j s GLU 796 CO 0.00 -0.68 0.13 0.20 0.02 0.00 0.00 175.26 174.93 2o5j s GLY 797 N -2.96 1.44 0.00 -1.39 0.00 -1.26 -4.85 107.32 98.31 2o5j s GLY 797 Ca 0.16 -1.70 0.00 0.00 0.00 0.00 0.00 44.72 43.18 2o5j s GLY 797 CO 0.06 -1.40 0.00 0.61 0.00 0.00 0.00 173.10 172.37 2o5j n GLY 798 N -0.27 3.66 3.63 0.20 0.00 -0.95 -4.72 105.19 106.74 2o5j n GLY 798 Ca 0.02 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 2o5j n GLY 798 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o5j s ILE 799 N 3.55 3.91 -0.08 -0.61 -1.09 0.95 0.15 121.20 127.98 2o5j s ILE 799 Ca 0.00 -0.57 -0.30 0.00 -2.23 0.00 0.00 60.65 57.55 2o5j s ILE 799 Cb 0.00 -2.68 -0.04 0.00 -1.58 0.00 0.00 42.46 38.17 2o5j s ILE 799 CO 0.00 0.47 1.36 -0.69 -1.23 0.00 0.00 174.94 174.85 2o5j s VAL 800 N -0.96 3.98 -0.20 2.92 1.01 0.33 -1.70 120.40 125.80 2o5j s VAL 800 Ca 0.16 1.27 -0.00 0.00 0.00 0.00 0.00 61.98 63.41 2o5j s VAL 800 Cb -0.11 -3.82 -0.12 0.00 0.00 0.00 0.00 36.38 32.33 2o5j s VAL 800 CO 0.06 -0.06 -0.19 1.33 0.00 0.00 0.00 175.10 176.25 2o5j n VAL 801 N 5.04 1.12 -4.03 2.92 0.24 -0.70 0.11 118.33 123.03 2o5j n VAL 801 Ca 0.14 -0.41 -0.09 0.00 -2.04 0.00 0.00 64.34 61.93 2o5j n VAL 801 Cb 0.44 -1.27 -0.11 0.00 -1.47 0.00 0.00 33.84 31.44 2o5j n VAL 801 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2o5j s ARG 802 N -2.39 0.44 -0.00 7.34 3.52 -1.21 -4.62 118.95 122.02 2o5j s ARG 802 Ca -0.27 -0.80 0.00 0.00 -0.13 0.00 0.00 55.73 54.54 2o5j s ARG 802 Cb 0.07 0.03 0.00 0.00 -1.56 0.00 0.00 34.95 33.50 2o5j s ARG 802 CO 0.44 -0.04 -0.01 0.95 -0.81 0.00 0.00 175.30 175.83 2o5j s THR 803 N -2.04 0.07 -0.06 4.11 -4.23 -1.26 -1.50 115.64 110.73 2o5j s THR 803 Ca -0.09 -0.02 0.03 0.00 -1.18 0.00 0.00 61.69 60.43 2o5j s THR 803 Cb -0.06 -0.08 0.01 0.00 1.34 0.00 0.00 72.50 73.71 2o5j s THR 803 CO -0.03 0.03 -0.14 -0.69 -0.54 0.00 0.00 174.62 173.26 2o5j s VAL 804 N 0.09 1.24 -0.04 2.29 1.01 -0.67 -4.99 120.40 119.32 2o5j s VAL 804 Ca -0.01 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.42 2o5j s VAL 804 Cb -0.02 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.28 2o5j s VAL 804 CO -0.00 0.37 -0.03 -0.60 0.00 0.00 0.00 175.10 174.84 2o5j s ARG 805 N 0.47 0.71 -0.33 2.72 3.00 -1.26 -0.56 118.95 123.70 2o5j s ARG 805 Ca -0.12 -0.05 0.01 0.00 -1.00 0.00 0.00 55.73 54.57 2o5j s ARG 805 Cb -0.14 -0.79 0.08 0.00 0.00 0.00 0.00 34.95 34.10 2o5j s ARG 805 CO 0.04 -0.12 0.05 -0.51 0.00 0.00 0.00 175.30 174.76 2o5j s LEU 806 N 1.06 4.45 0.00 -0.88 1.43 -1.06 -5.02 118.68 118.66 2o5j s LEU 806 Ca -0.09 -1.78 0.00 0.00 -1.03 0.00 0.00 54.13 51.23 2o5j s LEU 806 Cb -0.14 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.40 2o5j s LEU 806 CO -0.01 -0.36 0.00 0.54 0.23 0.00 0.00 176.35 176.75 2o5j n ARG 807 N 4.46 0.67 0.00 1.70 3.00 -1.26 -3.05 116.66 122.18 2o5j n ARG 807 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.79 2o5j n ARG 807 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.88 2o5j n ARG 807 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2o5j n ARG 808 N -0.97 0.00 -2.01 5.56 5.12 -1.26 -3.62 116.66 119.48 2o5j n ARG 808 Ca 0.00 0.54 -0.36 0.00 -1.93 0.00 0.00 57.85 56.10 2o5j n ARG 808 Cb 0.00 -0.94 -0.04 0.00 -1.16 0.00 0.00 32.46 30.32 2o5j n ARG 808 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2o5j n GLY 809 N -0.94 2.03 3.71 -0.13 0.00 -1.26 -4.96 105.19 103.65 2o5j n GLY 809 Ca 0.00 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 2o5j n GLY 809 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o5j s ASP 810 N 5.29 6.42 0.05 1.61 1.01 -1.24 -4.96 116.67 124.86 2o5j s ASP 810 Ca 0.61 2.80 -0.28 0.00 0.71 0.00 0.00 52.55 56.39 2o5j s ASP 810 Cb 0.05 -2.59 -0.15 0.00 1.01 0.00 0.00 42.92 41.24 2o5j s ASP 810 CO 0.10 -0.96 1.43 -0.65 0.21 0.00 0.00 175.17 175.30 2o5j h PRO 811 N 7.29 -0.90 0.00 8.23 0.11 -1.92 -3.42 132.00 141.39 2o5j h PRO 811 Ca -0.44 0.06 -0.10 0.00 0.11 0.00 0.00 66.00 65.63 2o5j h PRO 811 Cb 1.20 0.20 -0.10 0.00 0.11 0.00 0.00 31.00 32.42 2o5j h PRO 811 CO 0.95 -0.60 -0.21 0.41 -0.21 0.00 0.00 178.00 178.34 2o5j n GLY 812 N -1.48 0.50 3.97 -0.55 0.00 -1.26 -5.14 105.19 101.23 2o5j n GLY 812 Ca -0.11 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 2o5j n GLY 812 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s VAL 813 N 0.02 4.93 -0.65 1.61 0.11 -1.26 -5.07 120.40 120.10 2o5j s VAL 813 Ca 0.02 -0.86 -0.04 0.00 -2.93 0.00 0.00 61.98 58.16 2o5j s VAL 813 Cb 0.08 -3.75 0.17 0.00 -1.53 0.00 0.00 36.38 31.35 2o5j s VAL 813 CO -0.02 -0.34 0.48 -1.61 -3.33 0.00 0.00 175.10 170.27 2o5j s GLU 814 N -4.12 2.69 -0.15 1.54 0.41 -1.26 -5.01 118.70 112.82 2o5j s GLU 814 Ca 0.38 -2.51 -0.29 0.00 -0.41 0.00 0.00 54.97 52.14 2o5j s GLU 814 Cb -0.09 -3.82 -0.01 0.00 -1.78 0.00 0.00 34.13 28.43 2o5j s GLU 814 CO 0.31 -1.19 1.00 -1.17 -0.49 0.00 0.00 175.26 173.73 2o5j s LEU 815 N -0.02 4.20 0.92 1.80 2.96 -1.26 -4.88 118.68 122.40 2o5j s LEU 815 Ca 0.17 1.46 -0.11 0.00 -0.22 0.00 0.00 54.13 55.43 2o5j s LEU 815 Cb -0.19 -3.52 0.15 0.00 0.50 0.00 0.00 46.19 43.12 2o5j s LEU 815 CO -0.04 -0.51 1.11 -0.54 -1.32 0.00 0.00 176.35 175.06 2o5j s LYS 816 N 2.36 0.99 0.60 1.98 3.01 -1.26 -4.93 119.74 122.49 2o5j s LYS 816 Ca 0.46 1.29 -0.18 0.00 -1.01 0.00 0.00 55.97 56.52 2o5j s LYS 816 Cb -0.17 -1.74 -0.03 0.00 -1.01 0.00 0.00 37.83 34.87 2o5j s LYS 816 CO 0.14 -2.56 1.19 -2.14 0.51 0.00 0.00 175.35 172.49 2o5j s PRO 817 N -4.70 2.96 0.00 -1.68 0.02 -1.26 -2.44 135.00 127.90 2o5j s PRO 817 Ca 0.65 1.77 0.00 0.00 0.02 0.00 0.00 61.00 63.44 2o5j s PRO 817 Cb -0.21 -1.94 0.00 0.00 0.02 0.00 0.00 34.50 32.37 2o5j s PRO 817 CO 0.58 -1.20 0.00 0.41 -0.33 0.00 0.00 177.00 176.47 2o5j n GLY 818 N 0.39 1.53 3.58 0.52 0.00 -1.26 -4.91 105.19 105.05 2o5j n GLY 818 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2o5j n GLY 818 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 819 N 0.00 3.44 -0.03 1.61 1.01 -1.02 0.17 120.40 125.58 2o5j s VAL 819 Ca 0.00 0.40 -0.26 0.00 0.00 0.00 0.00 61.98 62.12 2o5j s VAL 819 Cb 0.00 -3.73 -0.20 0.00 0.00 0.00 0.00 36.38 32.45 2o5j s VAL 819 CO 0.00 -0.55 1.24 -0.09 0.00 0.00 0.00 175.10 175.70 2o5j h ARG 820 N 13.65 0.02 -2.06 2.72 2.43 0.14 -3.42 114.38 127.85 2o5j h ARG 820 Ca -0.31 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.81 2o5j h ARG 820 Cb 1.17 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.53 2o5j h ARG 820 CO 1.09 0.53 0.23 -2.00 -1.51 0.00 0.00 179.97 178.31 2o5j s GLU 821 N -4.13 1.04 0.33 0.20 2.12 -1.07 -4.56 118.70 112.62 2o5j s GLU 821 Ca -0.16 0.17 0.08 0.00 0.36 0.00 0.00 54.97 55.42 2o5j s GLU 821 Cb 0.02 0.49 -0.04 0.00 0.26 0.00 0.00 34.13 34.85 2o5j s GLU 821 CO 0.68 -0.34 0.12 0.14 -0.54 0.00 0.00 175.26 175.32 2o5j s VAL 822 N -1.46 3.07 -0.24 3.70 -7.23 -1.17 0.22 120.40 117.28 2o5j s VAL 822 Ca -0.09 -1.74 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 2o5j s VAL 822 Cb -0.00 -2.96 0.12 0.00 0.56 0.00 0.00 36.38 34.11 2o5j s VAL 822 CO 0.07 -0.21 0.32 -0.69 -0.31 0.00 0.00 175.10 174.28 2o5j s VAL 823 N -2.42 -0.49 0.13 1.32 1.01 0.42 -2.56 120.40 117.81 2o5j s VAL 823 Ca 0.37 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 62.02 2o5j s VAL 823 Cb -0.03 -0.82 -0.07 0.00 0.00 0.00 0.00 36.38 35.46 2o5j s VAL 823 CO 0.22 -0.22 0.54 -0.13 0.00 0.00 0.00 175.10 175.51 2o5j s ARG 824 N 2.45 3.99 -0.34 2.72 0.52 0.28 -0.21 118.95 128.36 2o5j s ARG 824 Ca 0.10 0.50 -0.01 0.00 -0.52 0.00 0.00 55.73 55.80 2o5j s ARG 824 Cb -0.15 -2.98 0.12 0.00 0.52 0.00 0.00 34.95 32.47 2o5j s ARG 824 CO -0.19 0.51 0.17 0.14 0.02 0.00 0.00 175.30 175.95 2o5j s VAL 825 N -1.41 0.35 -0.07 3.52 -7.23 0.41 -1.67 120.40 114.30 2o5j s VAL 825 Ca 0.36 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.76 2o5j s VAL 825 Cb -0.15 -1.27 -0.03 0.00 0.56 0.00 0.00 36.38 35.48 2o5j s VAL 825 CO 0.19 -0.85 1.18 -0.31 -0.31 0.00 0.00 175.10 175.00 2o5j s TYR 826 N 1.39 3.22 -0.07 2.82 1.51 -0.56 -2.60 117.35 123.07 2o5j s TYR 826 Ca 0.14 1.26 0.04 0.00 -1.01 0.00 0.00 57.07 57.49 2o5j s TYR 826 Cb -0.20 -3.39 0.00 0.00 -0.11 0.00 0.00 41.96 38.26 2o5j s TYR 826 CO -0.15 -1.19 -0.18 0.08 -1.11 0.00 0.00 175.55 173.00 2o5j s VAL 827 N 2.24 1.58 0.22 0.71 1.01 -0.28 -1.72 120.40 124.15 2o5j s VAL 827 Ca 0.55 -0.77 0.10 0.00 0.00 0.00 0.00 61.98 61.86 2o5j s VAL 827 Cb -0.24 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2o5j s VAL 827 CO 0.21 0.45 -0.15 0.00 0.00 0.00 0.00 175.10 175.61 2o5j s ALA 828 N 0.26 2.81 -0.15 5.51 0.00 -0.69 -1.30 121.76 128.20 2o5j s ALA 828 Ca -0.11 -1.64 -0.19 0.00 0.00 0.00 0.00 51.96 50.03 2o5j s ALA 828 Cb -0.15 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.51 2o5j s ALA 828 CO 0.04 0.38 0.50 1.14 0.00 0.00 0.00 175.76 177.83 2o5j s GLN 829 N -3.06 0.65 -0.17 0.00 0.00 -1.17 -0.04 119.66 115.87 2o5j s GLN 829 Ca 0.26 0.55 -0.23 0.00 -0.00 0.00 0.00 55.36 55.94 2o5j s GLN 829 Cb -0.07 0.31 -0.02 0.00 0.00 0.00 0.00 33.01 33.23 2o5j s GLN 829 CO 0.14 -0.11 0.73 0.21 0.00 0.00 0.00 175.29 176.26 2o5j s LYS 830 N -0.08 4.28 -0.27 9.60 2.20 -1.26 -3.85 119.74 130.37 2o5j s LYS 830 Ca -0.03 0.83 -0.08 0.00 -0.36 0.00 0.00 55.97 56.33 2o5j s LYS 830 Cb -0.03 -3.56 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 2o5j s LYS 830 CO 0.02 -0.23 0.11 1.03 -0.36 0.00 0.00 175.35 175.92 2o5j s ARG 831 N 1.84 3.64 -0.15 4.03 1.81 -0.96 -5.03 118.95 124.12 2o5j s ARG 831 Ca 0.34 -0.50 -0.11 0.00 -1.72 0.00 0.00 55.73 53.74 2o5j s ARG 831 Cb -0.16 -3.44 -0.05 0.00 -0.45 0.00 0.00 34.95 30.85 2o5j s ARG 831 CO 0.12 -0.24 0.20 0.15 -0.68 0.00 0.00 175.30 174.86 2o5j s LYS 832 N 1.64 4.00 -0.29 3.54 1.02 -1.26 -2.50 119.74 125.89 2o5j s LYS 832 Ca 0.06 -0.05 -0.40 0.00 0.02 0.00 0.00 55.97 55.60 2o5j s LYS 832 Cb -0.16 -3.35 -0.16 0.00 -0.52 0.00 0.00 37.83 33.65 2o5j s LYS 832 CO 0.06 0.43 1.77 -0.11 -0.92 0.00 0.00 175.35 176.58 2o5j n LEU 833 N 3.02 2.37 -4.56 3.17 7.94 -0.32 -4.94 117.00 123.66 2o5j n LEU 833 Ca -0.16 1.05 -0.27 0.00 -1.11 0.00 0.00 56.01 55.52 2o5j n LEU 833 Cb 0.53 -1.14 -0.08 0.00 0.53 0.00 0.00 43.42 43.25 2o5j n LEU 833 CO 0.36 -0.44 -0.22 0.00 -1.11 0.00 0.00 177.39 175.99 2o5j s GLN 834 N 3.70 1.96 0.17 1.96 -2.07 -1.26 -4.98 119.66 119.14 2o5j s GLN 834 Ca 0.99 -2.20 -0.17 0.00 -1.82 0.00 0.00 55.36 52.17 2o5j s GLN 834 Cb -1.07 -0.87 0.10 0.00 -1.09 0.00 0.00 33.01 30.08 2o5j s GLN 834 CO 0.66 -0.41 1.68 -0.24 -1.32 0.00 0.00 175.29 175.65 2o5j h VAL 835 N 1.73 0.62 -0.29 3.63 3.04 -1.92 -2.48 116.25 120.57 2o5j h VAL 835 Ca -0.38 -0.01 0.06 0.00 -1.01 0.00 0.00 66.70 65.36 2o5j h VAL 835 Cb 1.28 0.60 -0.01 0.00 -2.01 0.00 0.00 31.29 31.14 2o5j h VAL 835 CO 0.63 0.00 0.20 1.23 -1.01 0.00 0.00 177.57 178.62 2o5j h GLY 836 N 0.02 0.16 -1.19 3.17 0.00 -1.98 -3.17 103.07 100.08 2o5j h GLY 836 Ca 0.19 -0.05 -0.48 0.00 0.00 0.00 0.00 47.33 46.99 2o5j h GLY 836 CO -0.39 0.04 0.14 0.99 0.00 0.00 0.00 176.54 177.32 2o5j s ASP 837 N -6.65 2.19 -0.03 0.19 1.11 -0.94 -4.71 116.67 107.83 2o5j s ASP 837 Ca -0.06 1.84 0.04 0.00 0.18 0.00 0.00 52.55 54.55 2o5j s ASP 837 Cb 0.18 -2.42 -0.00 0.00 1.07 0.00 0.00 42.92 41.75 2o5j s ASP 837 CO 0.71 -3.50 -0.14 -1.59 1.18 0.00 0.00 175.17 171.82 2o5j s LYS 838 N -4.60 1.40 0.21 8.23 -2.85 -1.26 -1.71 119.74 119.16 2o5j s LYS 838 Ca 0.67 -0.50 0.05 0.00 -1.00 0.00 0.00 55.97 55.19 2o5j s LYS 838 Cb -0.23 -1.27 -0.05 0.00 -2.06 0.00 0.00 37.83 34.22 2o5j s LYS 838 CO 0.61 0.22 -0.07 -0.51 0.10 0.00 0.00 175.35 175.70 2o5j s LEU 839 N -0.00 2.41 -0.17 2.77 1.43 0.08 -1.29 118.68 123.90 2o5j s LEU 839 Ca -0.01 -1.12 -0.28 0.00 -1.03 0.00 0.00 54.13 51.69 2o5j s LEU 839 Cb -0.09 -0.44 0.10 0.00 0.03 0.00 0.00 46.19 45.79 2o5j s LEU 839 CO 0.01 -0.36 0.87 0.00 0.23 0.00 0.00 176.35 177.09 2o5j s ALA 840 N -3.23 -1.87 0.48 4.21 0.00 0.15 -1.93 121.76 119.56 2o5j s ALA 840 Ca 0.24 1.65 -0.05 0.00 0.00 0.00 0.00 51.96 53.80 2o5j s ALA 840 Cb 0.03 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 2o5j s ALA 840 CO 0.07 -0.31 0.78 0.54 0.00 0.00 0.00 175.76 176.83 2o5j s ASN 841 N -0.58 6.26 0.64 0.00 6.03 -1.11 -1.80 114.94 124.38 2o5j s ASN 841 Ca -0.03 0.91 0.35 0.00 -1.03 0.00 0.00 52.86 53.05 2o5j s ASN 841 Cb -0.02 -2.23 1.89 0.00 -3.03 0.00 0.00 41.25 37.86 2o5j s ASN 841 CO 0.02 -0.57 2.06 0.03 -2.03 0.00 0.00 177.10 176.61 2o5j h ARG 842 N 0.24 0.00 0.07 3.55 3.08 -1.91 -2.97 114.38 116.44 2o5j h ARG 842 Ca -0.47 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.49 2o5j h ARG 842 Cb 1.21 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.27 2o5j h ARG 842 CO 0.62 0.00 -0.39 0.45 -1.07 0.00 0.00 179.97 179.58 2o5j h HIS 843 N 0.00 0.26 0.00 3.04 3.86 -1.92 -3.39 115.15 117.00 2o5j h HIS 843 Ca 0.00 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 2o5j h HIS 843 Cb 0.37 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.83 2o5j h HIS 843 CO 0.00 1.15 0.00 0.41 0.86 0.00 0.00 177.93 180.35 2o5j n GLY 844 N 1.63 0.00 3.60 2.45 0.00 -1.12 -3.89 105.19 107.86 2o5j n GLY 844 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2o5j n GLY 844 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2o5j s ASN 845 N 0.00 5.64 0.18 1.61 3.84 -1.26 -4.87 114.94 120.08 2o5j s ASN 845 Ca 0.00 1.64 0.07 0.00 0.21 0.00 0.00 52.86 54.77 2o5j s ASN 845 Cb 0.00 -2.52 -0.04 0.00 -0.55 0.00 0.00 41.25 38.14 2o5j s ASN 845 CO 0.00 -1.85 0.07 -0.75 -2.79 0.00 0.00 177.10 171.78 2o5j s LYS 846 N 6.05 2.64 0.00 0.43 2.47 -1.26 -2.76 119.74 127.31 2o5j s LYS 846 Ca 0.92 -1.03 0.00 0.00 -1.56 0.00 0.00 55.97 54.30 2o5j s LYS 846 Cb -0.28 -2.48 0.00 0.00 -1.46 0.00 0.00 37.83 33.61 2o5j s LYS 846 CO 0.34 0.46 0.00 0.41 0.16 0.00 0.00 175.35 176.72 2o5j n GLY 847 N -0.36 0.98 3.90 5.54 0.00 -0.81 -4.73 105.19 109.71 2o5j n GLY 847 Ca -0.09 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 2o5j n GLY 847 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 848 N -2.00 4.94 -0.13 1.61 1.01 -1.26 -0.74 120.40 123.82 2o5j s VAL 848 Ca 0.00 -1.03 -0.29 0.00 0.00 0.00 0.00 61.98 60.65 2o5j s VAL 848 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2o5j s VAL 848 CO 0.00 -0.24 1.13 -0.69 0.00 0.00 0.00 175.10 175.31 2o5j s VAL 849 N -1.92 4.48 -0.20 2.92 1.01 -0.69 -1.01 120.40 124.99 2o5j s VAL 849 Ca 0.33 1.78 0.05 0.00 0.00 0.00 0.00 61.98 64.14 2o5j s VAL 849 Cb -0.09 -4.15 -0.21 0.00 0.00 0.00 0.00 36.38 31.93 2o5j s VAL 849 CO 0.27 -0.07 0.04 0.00 0.00 0.00 0.00 175.10 175.34 2o5j n ALA 850 N 5.71 1.34 -3.63 5.51 0.00 0.25 -4.40 120.51 125.28 2o5j n ALA 850 Ca 0.11 -1.02 -0.09 0.00 0.00 0.00 0.00 53.44 52.44 2o5j n ALA 850 Cb 0.46 -0.31 -0.08 0.00 0.00 0.00 0.00 19.45 19.53 2o5j n ALA 850 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2o5j s LYS 851 N -2.53 0.69 -0.82 0.00 2.20 -1.26 -5.00 119.74 113.03 2o5j s LYS 851 Ca -0.24 1.11 -0.19 0.00 -0.36 0.00 0.00 55.97 56.29 2o5j s LYS 851 Cb 0.08 0.18 0.12 0.00 -1.51 0.00 0.00 37.83 36.70 2o5j s LYS 851 CO 0.71 -0.14 1.01 0.96 -0.36 0.00 0.00 175.35 177.53 2o5j s ILE 852 N 1.31 4.70 0.34 5.43 -4.36 -1.26 -2.52 121.20 124.84 2o5j s ILE 852 Ca -0.08 -1.28 -0.25 0.00 -0.26 0.00 0.00 60.65 58.78 2o5j s ILE 852 Cb -0.05 -4.70 -0.10 0.00 1.25 0.00 0.00 42.46 38.86 2o5j s ILE 852 CO -0.14 -1.42 0.95 -0.76 0.24 0.00 0.00 174.94 173.81 2o5j s LEU 853 N 2.84 4.29 0.28 0.37 1.02 -0.56 -4.72 118.68 122.22 2o5j s LEU 853 Ca 0.26 1.83 -0.29 0.00 0.02 0.00 0.00 54.13 55.96 2o5j s LEU 853 Cb -0.10 -4.07 -0.09 0.00 0.02 0.00 0.00 46.19 41.94 2o5j s LEU 853 CO -0.03 -0.11 1.04 -2.84 0.02 0.00 0.00 176.35 174.42 2o5j s PRO 854 N -2.18 4.65 0.56 1.29 0.02 -1.26 -0.53 135.00 137.55 2o5j s PRO 854 Ca 0.52 1.65 0.36 0.00 0.02 0.00 0.00 61.00 63.54 2o5j s PRO 854 Cb -0.18 -3.12 1.48 0.00 0.02 0.00 0.00 34.50 32.70 2o5j s PRO 854 CO 0.23 0.27 1.72 -0.24 -0.33 0.00 0.00 177.00 178.65 2o5j h VAL 855 N 2.98 0.29 -0.89 3.83 3.04 -1.94 -2.41 116.25 121.15 2o5j h VAL 855 Ca -0.46 0.00 0.16 0.00 -1.01 0.00 0.00 66.70 65.38 2o5j h VAL 855 Cb 1.21 0.34 -0.16 0.00 -2.01 0.00 0.00 31.29 30.67 2o5j h VAL 855 CO 0.67 0.00 -0.31 -0.33 -1.01 0.00 0.00 177.57 176.58 2o5j h GLU 856 N 0.00 -0.03 0.00 4.17 3.07 -1.94 -3.17 114.58 116.68 2o5j h GLU 856 Ca 0.54 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.40 2o5j h GLU 856 Cb 2.36 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 30.28 2o5j h GLU 856 CO -0.01 -0.02 -0.03 -0.25 -1.40 0.00 0.00 179.01 177.31 2o5j n ASP 857 N -5.51 1.68 -4.85 1.42 8.00 -0.91 -4.71 116.55 111.67 2o5j n ASP 857 Ca 0.11 -2.08 -0.30 0.00 0.71 0.00 0.00 54.79 53.23 2o5j n ASP 857 Cb 0.42 -0.10 0.08 0.00 -0.02 0.00 0.00 41.12 41.50 2o5j n ASP 857 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2o5j s MET 858 N -1.19 2.24 0.02 -1.24 -1.94 -1.20 -3.19 119.30 112.80 2o5j s MET 858 Ca 0.07 0.46 -0.36 0.00 -1.71 0.00 0.00 55.69 54.14 2o5j s MET 858 Cb 0.06 -1.95 -0.15 0.00 2.01 0.00 0.00 34.83 34.80 2o5j s MET 858 CO 0.01 -1.47 1.59 -2.30 -0.01 0.00 0.00 175.02 172.84 2o5j n PRO 859 N -3.30 1.67 -4.48 2.03 -0.02 -1.22 -4.34 135.00 125.34 2o5j n PRO 859 Ca 0.07 0.61 -0.23 0.00 -2.02 0.00 0.00 63.50 61.93 2o5j n PRO 859 Cb 0.58 -2.33 -0.14 0.00 -0.02 0.00 0.00 33.50 31.59 2o5j n PRO 859 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2o5j s HIS 860 N 1.81 1.55 0.76 6.00 -3.43 -1.08 -1.62 115.29 119.28 2o5j s HIS 860 Ca 0.86 -0.37 -0.11 0.00 -0.80 0.00 0.00 55.06 54.64 2o5j s HIS 860 Cb -0.84 -0.91 0.05 0.00 -1.43 0.00 0.00 32.58 29.45 2o5j s HIS 860 CO 0.48 0.08 1.08 -0.51 -2.00 0.00 0.00 174.74 173.87 2o5j s LEU 861 N -1.24 2.84 0.24 5.38 1.43 -0.98 -1.88 118.68 124.47 2o5j s LEU 861 Ca 0.05 1.51 -0.10 0.00 -1.03 0.00 0.00 54.13 54.55 2o5j s LEU 861 Cb -0.09 -4.22 0.36 0.00 0.03 0.00 0.00 46.19 42.27 2o5j s LEU 861 CO 0.02 -1.82 1.60 -0.65 0.23 0.00 0.00 176.35 175.73 2o5j h PRO 862 N -0.98 0.01 -6.86 1.29 0.11 -1.90 -3.35 132.00 120.32 2o5j h PRO 862 Ca -0.45 -0.00 -0.48 0.00 0.11 0.00 0.00 66.00 65.17 2o5j h PRO 862 Cb 1.24 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2o5j h PRO 862 CO 0.57 0.01 0.38 0.16 -0.21 0.00 0.00 178.00 178.90 2o5j s ASP 863 N -5.23 7.28 0.07 -2.05 3.84 -1.26 -4.91 116.67 114.41 2o5j s ASP 863 Ca -0.14 1.95 0.00 0.00 -0.00 0.00 0.00 52.55 54.36 2o5j s ASP 863 Cb 0.23 -2.59 0.01 0.00 -1.38 0.00 0.00 42.92 39.19 2o5j s ASP 863 CO 0.75 -0.11 0.59 0.61 -0.00 0.00 0.00 175.17 177.01 2o5j n GLY 864 N 0.78 -0.08 3.61 2.12 0.00 -1.26 -4.68 105.19 105.68 2o5j n GLY 864 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 2o5j n GLY 864 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2o5j s THR 865 N -2.26 3.22 0.49 2.61 -1.32 -1.26 -4.76 115.64 112.36 2o5j s THR 865 Ca -0.00 0.23 -0.07 0.00 -1.21 0.00 0.00 61.69 60.64 2o5j s THR 865 Cb 0.00 -3.27 -0.04 0.00 -1.51 0.00 0.00 72.50 67.68 2o5j s THR 865 CO 0.00 -0.15 0.82 -2.84 -2.21 0.00 0.00 174.62 170.24 2o5j s PRO 866 N 5.78 3.60 0.47 7.08 0.02 -1.26 -2.33 135.00 148.36 2o5j s PRO 866 Ca 0.90 0.35 -0.20 0.00 0.02 0.00 0.00 61.00 62.07 2o5j s PRO 866 Cb -0.30 -2.33 -0.09 0.00 0.02 0.00 0.00 34.50 31.80 2o5j s PRO 866 CO 0.35 -0.23 1.00 0.14 -0.33 0.00 0.00 177.00 177.93 2o5j s VAL 867 N -2.74 4.07 -0.17 3.83 -7.23 -0.64 -4.94 120.40 112.57 2o5j s VAL 867 Ca 0.49 1.25 -0.23 0.00 -1.81 0.00 0.00 61.98 61.68 2o5j s VAL 867 Cb -0.10 -3.52 -0.21 0.00 0.56 0.00 0.00 36.38 33.11 2o5j s VAL 867 CO 0.44 -0.32 0.45 0.44 -0.31 0.00 0.00 175.10 175.79 2o5j h ASP 868 N 1.57 0.00 -4.51 4.85 5.19 -1.59 -3.45 116.42 118.48 2o5j h ASP 868 Ca -0.49 -0.69 -0.35 0.00 -0.62 0.00 0.00 57.03 54.88 2o5j h ASP 868 Cb 1.20 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 40.49 2o5j h ASP 868 CO 0.60 1.18 -0.76 0.54 -3.12 0.00 0.00 179.24 177.68 2o5j s VAL 869 N -2.25 0.80 -0.31 -1.35 0.11 -1.13 -0.52 120.40 115.75 2o5j s VAL 869 Ca -0.22 -1.04 -0.03 0.00 -2.93 0.00 0.00 61.98 57.76 2o5j s VAL 869 Cb 0.01 -0.79 0.05 0.00 -1.53 0.00 0.00 36.38 34.12 2o5j s VAL 869 CO 0.59 -0.21 0.03 0.27 -3.33 0.00 0.00 175.10 172.45 2o5j s ILE 870 N -1.11 3.24 -0.01 7.04 -4.36 -1.26 -1.70 121.20 123.04 2o5j s ILE 870 Ca -0.04 -1.29 -0.14 0.00 -0.26 0.00 0.00 60.65 58.92 2o5j s ILE 870 Cb -0.09 -2.84 -0.06 0.00 1.25 0.00 0.00 42.46 40.72 2o5j s ILE 870 CO 0.01 -0.12 0.39 -0.76 0.24 0.00 0.00 174.94 174.70 2o5j s LEU 871 N 1.30 4.46 0.00 0.37 1.43 -0.82 -3.42 118.68 122.01 2o5j s LEU 871 Ca -0.04 0.92 -0.30 0.00 -1.03 0.00 0.00 54.13 53.68 2o5j s LEU 871 Cb -0.20 -2.54 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 2o5j s LEU 871 CO 0.00 0.32 1.24 0.21 0.23 0.00 0.00 176.35 178.35 2o5j s ASN 872 N -1.02 7.02 0.07 2.29 3.04 -1.26 -2.06 114.94 123.03 2o5j s ASN 872 Ca 0.23 1.95 -0.23 0.00 0.04 0.00 0.00 52.86 54.85 2o5j s ASN 872 Cb -0.16 -2.57 -0.14 0.00 -1.54 0.00 0.00 41.25 36.84 2o5j s ASN 872 CO 0.12 -0.57 1.64 -0.65 -3.04 0.00 0.00 177.10 174.61 2o5j h PRO 873 N 7.27 0.06 -1.70 0.43 0.11 -1.81 -3.12 132.00 133.24 2o5j h PRO 873 Ca -0.38 -0.01 0.49 0.00 0.11 0.00 0.00 66.00 66.22 2o5j h PRO 873 Cb 1.18 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.21 2o5j h PRO 873 CO 0.86 0.15 1.22 -0.07 -0.21 0.00 0.00 178.00 179.95 2o5j h LEU 874 N -0.04 0.01 0.00 2.35 4.07 -1.93 0.12 115.31 119.89 2o5j h LEU 874 Ca 0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.98 2o5j h LEU 874 Cb 0.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2o5j h LEU 874 CO -0.00 -0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.96 2o5j n GLY 875 N -1.87 -0.61 0.00 0.83 0.00 -1.18 -3.18 105.19 99.19 2o5j n GLY 875 Ca 0.38 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 46.32 2o5j n GLY 875 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2o5j n VAL 876 N -0.90 0.00 0.12 1.61 0.31 0.42 -4.41 118.33 115.47 2o5j n VAL 876 Ca 0.12 -0.12 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2o5j n VAL 876 Cb 0.05 0.46 -0.02 0.00 -0.91 0.00 0.00 33.84 33.42 2o5j n VAL 876 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2o5j h PRO 877 N 0.00 -0.31 -0.75 5.55 0.11 -1.67 -3.30 132.00 131.63 2o5j h PRO 877 Ca 0.00 0.02 0.15 0.00 0.11 0.00 0.00 66.00 66.28 2o5j h PRO 877 Cb 0.17 0.07 -0.10 0.00 0.11 0.00 0.00 31.00 31.25 2o5j h PRO 877 CO 0.00 -0.21 0.26 0.77 -0.21 0.00 0.00 178.00 178.61 2o5j h SER 878 N -0.52 0.18 -3.64 -2.05 0.02 -1.88 -3.39 113.55 102.27 2o5j h SER 878 Ca -0.03 0.13 -0.51 0.00 -0.84 0.00 0.00 61.79 60.54 2o5j h SER 878 Cb 0.25 0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 2o5j h SER 878 CO 0.05 0.04 0.36 -0.13 -1.14 0.00 0.00 176.83 176.02 2o5j s ARG 879 N -6.02 4.76 -0.56 3.45 0.52 -1.24 -5.02 118.95 114.85 2o5j s ARG 879 Ca -0.12 1.48 -0.11 0.00 -0.52 0.00 0.00 55.73 56.46 2o5j s ARG 879 Cb 0.21 -3.33 0.14 0.00 0.52 0.00 0.00 34.95 32.49 2o5j s ARG 879 CO 0.76 0.34 0.45 -1.64 0.02 0.00 0.00 175.30 175.23 2o5j s MET 880 N -0.51 2.76 -0.47 3.54 -1.94 -1.26 -4.65 119.30 116.78 2o5j s MET 880 Ca 0.44 -1.95 0.06 0.00 -1.71 0.00 0.00 55.69 52.54 2o5j s MET 880 Cb -0.25 -4.06 0.27 0.00 2.01 0.00 0.00 34.83 32.81 2o5j s MET 880 CO 0.31 -1.24 0.93 0.27 -0.01 0.00 0.00 175.02 175.28 2o5j n ASN 881 N 4.67 -2.27 0.00 3.03 2.04 -1.26 0.26 115.26 121.73 2o5j n ASN 881 Ca -0.04 -3.38 0.06 0.00 -0.44 0.00 0.00 54.58 50.78 2o5j n ASN 881 Cb 0.41 1.54 0.28 0.00 -2.53 0.00 0.00 39.78 39.48 2o5j n ASN 881 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2o5j n LEU 882 N 1.11 0.00 -0.17 -4.53 4.77 -1.15 -2.58 117.00 114.45 2o5j n LEU 882 Ca 0.10 0.47 0.11 0.00 -0.03 0.00 0.00 56.01 56.66 2o5j n LEU 882 Cb 0.65 -0.47 0.42 0.00 -2.33 0.00 0.00 43.42 41.69 2o5j n LEU 882 CO 0.06 -0.27 1.21 1.23 -1.33 0.00 0.00 177.39 178.29 2o5j h GLY 883 N 2.17 0.87 0.83 -0.72 0.00 -1.82 0.04 103.07 104.43 2o5j h GLY 883 Ca 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 2o5j h GLY 883 CO 0.00 0.13 0.01 1.46 0.00 0.00 0.00 176.54 178.14 2o5j h GLN 884 N 0.59 0.03 0.00 4.80 4.20 -1.84 0.13 115.11 123.02 2o5j h GLN 884 Ca 0.34 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 59.05 2o5j h GLN 884 Cb 0.55 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.32 2o5j h GLN 884 CO -0.12 0.20 -0.00 0.82 -0.67 0.00 0.00 178.83 179.06 2o5j h ILE 885 N -0.14 0.12 0.01 2.54 1.08 -1.42 -0.49 117.51 119.21 2o5j h ILE 885 Ca 0.01 -0.05 -0.25 0.00 -0.39 0.00 0.00 64.86 64.18 2o5j h ILE 885 Cb 0.18 1.04 -0.03 0.00 -3.07 0.00 0.00 36.82 34.94 2o5j h ILE 885 CO -0.00 0.00 -1.28 0.25 -0.69 0.00 0.00 178.15 176.44 2o5j h LEU 886 N 0.00 0.05 -0.52 1.44 5.85 0.07 -3.17 115.31 119.02 2o5j h LEU 886 Ca -0.00 -0.06 -0.16 0.00 0.84 0.00 0.00 57.88 58.50 2o5j h LEU 886 Cb 0.04 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2o5j h LEU 886 CO 0.00 1.05 -0.59 -0.08 -0.34 0.00 0.00 178.44 178.48 2o5j h GLU 887 N 0.01 0.47 -0.01 1.25 4.81 0.81 -3.10 114.58 118.81 2o5j h GLU 887 Ca -0.12 -0.31 -0.13 0.00 -0.13 0.00 0.00 59.36 58.67 2o5j h GLU 887 Cb 1.87 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 31.28 2o5j h GLU 887 CO 0.12 0.92 -0.59 1.15 -0.73 0.00 0.00 179.01 179.88 2o5j h THR 888 N 0.35 1.42 0.01 0.32 2.02 -1.41 -2.02 112.91 113.60 2o5j h THR 888 Ca -0.00 -2.01 -0.00 0.00 0.77 0.00 0.00 66.41 65.17 2o5j h THR 888 Cb 1.13 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 2o5j h THR 888 CO 0.11 0.58 -0.00 0.45 0.37 0.00 0.00 175.52 177.02 2o5j h HIS 889 N 0.01 -0.01 -0.13 3.16 3.86 -1.52 -1.55 115.15 118.97 2o5j h HIS 889 Ca -0.01 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 2o5j h HIS 889 Cb 1.04 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.51 2o5j h HIS 889 CO 0.00 0.58 -0.21 1.25 0.86 0.00 0.00 177.93 180.41 2o5j h LEU 890 N -0.60 0.22 -0.52 2.43 6.46 -1.61 -2.53 115.31 119.15 2o5j h LEU 890 Ca -0.00 -0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 2o5j h LEU 890 Cb 0.59 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.44 2o5j h LEU 890 CO 0.00 0.45 0.22 1.23 -0.62 0.00 0.00 178.44 179.72 2o5j h GLY 891 N 0.88 0.83 0.15 3.75 0.00 -1.36 -0.31 103.07 107.01 2o5j h GLY 891 Ca 0.04 -0.44 0.13 0.00 0.00 0.00 0.00 47.33 47.06 2o5j h GLY 891 CO 0.03 0.41 0.23 -2.00 0.00 0.00 0.00 176.54 175.22 2o5j h LEU 892 N 0.70 0.16 0.32 3.11 5.85 -0.84 -0.12 115.31 124.50 2o5j h LEU 892 Ca 0.18 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.99 2o5j h LEU 892 Cb 0.17 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.32 2o5j h LEU 892 CO -0.02 0.06 -0.16 0.00 -0.34 0.00 0.00 178.44 177.99 2o5j h ALA 893 N 1.53 -0.44 -0.67 1.25 0.00 -1.28 -2.70 119.26 116.94 2o5j h ALA 893 Ca 0.38 -0.12 0.18 0.00 0.00 0.00 0.00 54.91 55.35 2o5j h ALA 893 Cb 0.58 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2o5j h ALA 893 CO -0.41 -0.70 0.48 0.78 0.00 0.00 0.00 179.25 179.40 2o5j h GLY 894 N -0.52 0.14 0.77 0.00 0.00 -0.27 0.36 103.07 103.56 2o5j h GLY 894 Ca -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 2o5j h GLY 894 CO 0.07 0.01 0.01 -1.82 0.00 0.00 0.00 176.54 174.81 2o5j h TYR 895 N 0.08 0.14 0.00 5.60 3.20 -0.71 0.56 116.97 125.84 2o5j h TYR 895 Ca 0.32 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.17 2o5j h TYR 895 Cb 1.17 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.40 2o5j h TYR 895 CO -0.00 0.35 -0.87 1.19 -1.64 0.00 0.00 178.16 177.20 2o5j n PHE 896 N -4.87 0.59 0.92 -3.82 3.01 -0.90 -3.63 117.46 108.76 2o5j n PHE 896 Ca -0.06 0.17 0.12 0.00 1.01 0.00 0.00 57.45 58.69 2o5j n PHE 896 Cb 0.17 -0.69 0.25 0.00 -0.01 0.00 0.00 39.48 39.20 2o5j n PHE 896 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2o5j n LEU 897 N -2.24 2.66 -3.85 4.37 4.77 0.12 -4.86 117.00 117.96 2o5j n LEU 897 Ca 0.02 -1.01 -0.35 0.00 -0.03 0.00 0.00 56.01 54.64 2o5j n LEU 897 Cb 0.47 -0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.49 2o5j n LEU 897 CO 0.39 0.51 -0.14 0.61 -1.33 0.00 0.00 177.39 177.42 2o5j n GLY 898 N 1.33 -1.03 3.56 -0.72 0.00 0.14 -4.91 105.19 103.56 2o5j n GLY 898 Ca 0.17 0.45 -0.15 0.00 0.00 0.00 0.00 46.02 46.49 2o5j n GLY 898 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2o5j s GLN 899 N -6.16 0.89 0.26 1.61 -2.07 -0.93 -3.68 119.66 109.57 2o5j s GLN 899 Ca 0.32 0.39 0.03 0.00 -1.82 0.00 0.00 55.36 54.28 2o5j s GLN 899 Cb -0.16 0.42 -0.03 0.00 -1.09 0.00 0.00 33.01 32.15 2o5j s GLN 899 CO 0.92 -0.24 0.41 0.50 -1.32 0.00 0.00 175.29 175.55 2o5j s ARG 900 N -0.81 3.46 0.29 9.60 6.06 0.37 -4.38 118.95 133.54 2o5j s ARG 900 Ca -0.06 -0.61 0.02 0.00 -2.50 0.00 0.00 55.73 52.59 2o5j s ARG 900 Cb -0.01 -2.83 -0.04 0.00 0.06 0.00 0.00 34.95 32.13 2o5j s ARG 900 CO 0.06 0.36 0.15 0.71 -2.50 0.00 0.00 175.30 174.07 2o5j s TYR 901 N -2.05 1.55 -0.28 5.12 1.51 -1.25 -2.99 117.35 118.96 2o5j s TYR 901 Ca 0.36 -1.34 -0.03 0.00 -1.01 0.00 0.00 57.07 55.05 2o5j s TYR 901 Cb -0.09 -0.84 0.10 0.00 -0.11 0.00 0.00 41.96 41.01 2o5j s TYR 901 CO 0.31 -0.50 0.11 0.42 -1.11 0.00 0.00 175.55 174.78 2o5j s ILE 902 N -3.68 0.23 -0.45 2.71 1.01 -0.74 -3.17 121.20 117.11 2o5j s ILE 902 Ca 0.36 -0.90 -0.16 0.00 0.00 0.00 0.00 60.65 59.95 2o5j s ILE 902 Cb 0.06 -1.16 0.04 0.00 0.01 0.00 0.00 42.46 41.41 2o5j s ILE 902 CO 0.16 -0.66 0.41 -0.44 0.00 0.00 0.00 174.94 174.41 2o5j s SER 903 N 1.95 6.16 1.16 3.58 0.01 -1.12 -2.72 113.70 122.72 2o5j s SER 903 Ca 0.08 -0.99 -0.17 0.00 1.31 0.00 0.00 55.95 56.19 2o5j s SER 903 Cb -0.16 -2.20 0.19 0.00 0.21 0.00 0.00 66.02 64.06 2o5j s SER 903 CO -0.31 -0.61 0.39 -2.65 0.41 0.00 0.00 173.24 170.48 2o5j n PRO 904 N 5.41 -2.15 0.00 12.44 -0.02 -1.26 -4.66 135.00 144.76 2o5j n PRO 904 Ca -0.10 -0.61 0.00 0.00 -2.02 0.00 0.00 63.50 60.77 2o5j n PRO 904 Cb 0.46 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 2o5j n PRO 904 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2o5j n ILE 905 N -4.73 0.00 0.11 4.25 -0.00 -1.26 -2.71 119.36 115.01 2o5j n ILE 905 Ca 0.02 1.32 0.05 0.00 -0.00 0.00 0.00 62.75 64.14 2o5j n ILE 905 Cb 0.59 -2.06 -0.08 0.00 -0.00 0.00 0.00 39.64 38.09 2o5j n ILE 905 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 2o5j n PHE 906 N -1.88 0.00 0.28 1.39 3.01 -1.26 -3.95 117.46 115.05 2o5j n PHE 906 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.57 2o5j n PHE 906 Cb 0.00 -0.19 -0.03 0.00 -0.01 0.00 0.00 39.48 39.24 2o5j n PHE 906 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2o5j n ASP 907 N -1.74 0.54 0.85 4.37 2.03 -1.26 -4.98 116.55 116.36 2o5j n ASP 907 Ca -0.01 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2o5j n ASP 907 Cb 0.26 0.98 0.00 0.00 -0.72 0.00 0.00 41.12 41.64 2o5j n ASP 907 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2o5j n GLY 908 N 1.28 0.00 3.82 0.27 0.00 -1.10 -2.90 105.19 106.56 2o5j n GLY 908 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2o5j n GLY 908 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 909 N -2.89 2.76 0.08 4.61 0.00 -1.26 -3.46 121.76 121.60 2o5j s ALA 909 Ca 0.00 0.12 0.05 0.00 0.00 0.00 0.00 51.96 52.14 2o5j s ALA 909 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 2o5j s ALA 909 CO 0.00 -1.03 -0.14 0.21 0.00 0.00 0.00 175.76 174.80 2o5j s LYS 910 N -4.83 0.84 0.23 0.00 2.47 -1.26 -5.03 119.74 112.16 2o5j s LYS 910 Ca 0.59 -0.99 -0.03 0.00 -1.56 0.00 0.00 55.97 53.98 2o5j s LYS 910 Cb -0.14 -0.83 0.48 0.00 -1.46 0.00 0.00 37.83 35.88 2o5j s LYS 910 CO 0.50 0.18 1.25 -1.91 0.16 0.00 0.00 175.35 175.53 2o5j n GLU 911 N 1.18 -0.07 0.16 4.03 2.13 -1.26 -0.32 120.64 126.49 2o5j n GLU 911 Ca -0.20 1.22 -0.14 0.00 0.66 0.00 0.00 57.16 58.69 2o5j n GLU 911 Cb 0.54 -1.88 -0.08 0.00 0.27 0.00 0.00 31.44 30.30 2o5j n GLU 911 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 2o5j h PRO 912 N 0.00 -0.33 -0.90 5.31 0.11 -1.99 -1.63 132.00 132.56 2o5j h PRO 912 Ca 0.43 0.02 0.13 0.00 0.11 0.00 0.00 66.00 66.69 2o5j h PRO 912 Cb 0.78 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.89 2o5j h PRO 912 CO -0.79 -0.20 0.58 0.93 -0.21 0.00 0.00 178.00 178.31 2o5j h GLU 913 N -0.36 0.75 -0.14 1.05 5.08 -1.08 -1.27 114.58 118.60 2o5j h GLU 913 Ca -0.04 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2o5j h GLU 913 Cb 0.28 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2o5j h GLU 913 CO 0.06 0.50 -0.13 0.82 -1.00 0.00 0.00 179.01 179.26 2o5j h ILE 914 N 0.77 1.35 -0.70 3.13 5.03 -1.19 -2.11 117.51 123.79 2o5j h ILE 914 Ca 0.45 -1.27 0.16 0.00 -0.12 0.00 0.00 64.86 64.07 2o5j h ILE 914 Cb 0.62 1.88 -0.04 0.00 -3.03 0.00 0.00 36.82 36.25 2o5j h ILE 914 CO -0.21 0.37 0.48 0.11 -0.68 0.00 0.00 178.15 178.22 2o5j h LYS 915 N -0.05 0.24 0.43 2.37 1.79 -0.35 0.28 116.57 121.29 2o5j h LYS 915 Ca 0.02 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 2o5j h LYS 915 Cb 0.65 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 2o5j h LYS 915 CO 0.03 0.16 -0.21 1.49 -1.08 0.00 0.00 179.45 179.85 2o5j h GLU 916 N 0.25 -0.56 -0.71 3.15 4.57 -0.99 -0.03 114.58 120.26 2o5j h GLU 916 Ca 0.34 0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.61 2o5j h GLU 916 Cb 0.97 0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.65 2o5j h GLU 916 CO -0.08 -0.27 0.46 -0.07 -1.18 0.00 0.00 179.01 177.88 2o5j h LEU 917 N -0.81 0.67 -0.81 1.64 3.38 -0.63 0.01 115.31 118.76 2o5j h LEU 917 Ca -0.06 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2o5j h LEU 917 Cb 0.55 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 2o5j h LEU 917 CO 0.10 0.44 0.34 0.25 0.09 0.00 0.00 178.44 179.66 2o5j h LEU 918 N 0.76 1.09 -1.52 1.67 5.85 -0.81 -0.29 115.31 122.07 2o5j h LEU 918 Ca 0.30 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.88 2o5j h LEU 918 Cb 0.21 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2o5j h LEU 918 CO -0.10 0.95 0.35 0.00 -0.34 0.00 0.00 178.44 179.31 2o5j h ALA 919 N 1.18 1.70 -0.02 1.25 0.00 0.96 -0.97 119.26 123.35 2o5j h ALA 919 Ca 0.27 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.98 2o5j h ALA 919 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2o5j h ALA 919 CO -0.03 0.26 -0.76 1.96 0.00 0.00 0.00 179.25 180.68 2o5j h GLN 920 N 0.64 0.17 -0.02 0.00 4.20 -0.75 -3.14 115.11 116.23 2o5j h GLN 920 Ca 0.20 -0.16 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 2o5j h GLN 920 Cb 0.03 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2o5j h GLN 920 CO -0.05 0.85 -0.70 0.00 -0.67 0.00 0.00 178.83 178.26 2o5j h ALA 921 N 1.10 0.78 -0.67 3.87 0.00 -0.24 -3.19 119.26 120.91 2o5j h ALA 921 Ca -0.02 -0.62 0.03 0.00 0.00 0.00 0.00 54.91 54.29 2o5j h ALA 921 Cb 1.34 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2o5j h ALA 921 CO 0.11 0.83 0.42 0.35 0.00 0.00 0.00 179.25 180.96 2o5j h PHE 922 N 0.08 0.78 -0.68 0.00 3.57 -1.15 0.27 116.94 119.81 2o5j h PHE 922 Ca -0.02 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2o5j h PHE 922 Cb 1.25 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 2o5j h PHE 922 CO 0.01 0.44 0.32 1.49 -2.23 0.00 0.00 178.31 178.35 2o5j h GLU 923 N 0.82 0.97 -0.10 1.11 4.57 -1.63 1.16 114.58 121.47 2o5j h GLU 923 Ca 0.27 -0.13 -0.14 0.00 -1.18 0.00 0.00 59.36 58.18 2o5j h GLU 923 Cb 0.03 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 2o5j h GLU 923 CO -0.11 0.75 -0.56 0.28 -1.18 0.00 0.00 179.01 178.19 2o5j h VAL 924 N 0.96 1.36 0.18 0.32 2.07 -1.27 0.54 116.25 120.40 2o5j h VAL 924 Ca 0.23 -1.86 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 2o5j h VAL 924 Cb 0.11 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2o5j h VAL 924 CO -0.03 0.56 -0.08 0.22 0.02 0.00 0.00 177.57 178.25 2o5j h TYR 925 N 0.23 -0.22 0.00 1.57 -0.00 0.48 -3.33 116.97 115.70 2o5j h TYR 925 Ca 0.00 -0.01 -0.05 0.00 -0.00 0.00 0.00 58.73 58.68 2o5j h TYR 925 Cb 1.05 0.07 -0.01 0.00 -0.00 0.00 0.00 36.73 37.85 2o5j h TYR 925 CO 0.03 -0.14 -0.83 0.35 -0.00 0.00 0.00 178.16 177.57 2o5j h PHE 926 N -0.78 0.00 -0.32 -3.82 3.57 0.12 -3.33 116.94 112.39 2o5j h PHE 926 Ca -0.02 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 2o5j h PHE 926 Cb 0.18 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2o5j h PHE 926 CO 0.02 0.18 -0.11 0.78 -2.23 0.00 0.00 178.31 176.94 2o5j h GLY 927 N 3.89 0.69 1.51 2.40 0.00 0.15 -2.01 103.07 109.69 2o5j h GLY 927 Ca -0.03 -0.60 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 2o5j h GLY 927 CO 0.02 0.54 0.06 1.70 0.00 0.00 0.00 176.54 178.86 2o5j h LYS 928 N 0.41 0.62 -0.56 4.80 3.64 -1.66 -2.73 116.57 121.09 2o5j h LYS 928 Ca 0.08 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2o5j h LYS 928 Cb 0.62 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 2o5j h LYS 928 CO 0.04 0.60 0.24 0.00 -2.27 0.00 0.00 179.45 178.05 2o5j h ARG 929 N 0.60 0.83 -0.25 1.90 2.47 -1.62 0.67 114.38 118.98 2o5j h ARG 929 Ca 0.13 -0.14 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 2o5j h ARG 929 Cb 0.29 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.46 2o5j h ARG 929 CO 0.00 0.71 0.13 0.87 0.56 0.00 0.00 179.97 182.24 2o5j h LYS 930 N 0.77 0.35 -0.08 0.04 1.57 -1.12 -2.49 116.57 115.61 2o5j h LYS 930 Ca 0.19 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.69 2o5j h LYS 930 Cb 0.18 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.43 2o5j h LYS 930 CO -0.02 0.33 -0.87 0.78 -0.57 0.00 0.00 179.45 179.10 2o5j h GLY 931 N 0.28 0.77 1.61 3.86 0.00 -1.34 -3.11 103.07 105.14 2o5j h GLY 931 Ca 0.09 -1.19 0.02 0.00 0.00 0.00 0.00 47.33 46.25 2o5j h GLY 931 CO -0.01 1.05 0.18 0.83 0.00 0.00 0.00 176.54 178.59 2o5j h GLU 932 N 0.44 0.00 0.00 4.80 5.08 0.36 -3.45 114.58 121.81 2o5j h GLU 932 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2o5j h GLU 932 Cb 1.51 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2o5j h GLU 932 CO 0.17 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.59 2o5j n GLY 933 N -1.23 1.16 3.34 -3.84 0.00 -1.15 -5.07 105.19 98.41 2o5j n GLY 933 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2o5j n GLY 933 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2o5j s PHE 934 N -1.17 1.66 0.00 1.61 0.40 -0.95 -5.03 117.98 114.50 2o5j s PHE 934 Ca 0.00 -0.68 0.00 0.00 -0.60 0.00 0.00 56.93 55.65 2o5j s PHE 934 Cb 0.00 -0.85 0.00 0.00 0.51 0.00 0.00 43.02 42.68 2o5j s PHE 934 CO 0.00 0.24 0.00 0.41 0.70 0.00 0.00 175.22 176.57 2o5j n GLY 935 N -0.39 1.03 3.88 4.36 0.00 -1.26 -3.75 105.19 109.06 2o5j n GLY 935 Ca -0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 2o5j n GLY 935 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2o5j s VAL 936 N 3.52 5.20 0.60 1.61 -7.23 -1.26 -5.00 120.40 117.84 2o5j s VAL 936 Ca 0.00 -0.43 -0.08 0.00 -1.81 0.00 0.00 61.98 59.66 2o5j s VAL 936 Cb 0.00 -3.51 -0.01 0.00 0.56 0.00 0.00 36.38 33.43 2o5j s VAL 936 CO 0.00 0.18 0.94 -1.81 -0.31 0.00 0.00 175.10 174.10 2o5j s ASP 937 N -2.36 5.82 0.30 4.85 1.11 -1.26 -4.96 116.67 120.17 2o5j s ASP 937 Ca 0.32 0.99 0.04 0.00 0.18 0.00 0.00 52.55 54.08 2o5j s ASP 937 Cb -0.13 -2.02 0.47 0.00 1.07 0.00 0.00 42.92 42.31 2o5j s ASP 937 CO 0.25 -0.98 1.75 0.50 1.18 0.00 0.00 175.17 177.86 2o5j h LYS 938 N -0.22 0.42 0.74 8.23 3.64 -2.00 -1.70 116.57 125.68 2o5j h LYS 938 Ca -0.45 -0.15 -0.04 0.00 -1.27 0.00 0.00 60.65 58.74 2o5j h LYS 938 Cb 1.23 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 33.03 2o5j h LYS 938 CO 0.62 0.64 -0.36 0.00 -2.27 0.00 0.00 179.45 178.08 2o5j h ARG 939 N 0.37 -0.96 -0.89 1.90 2.47 -1.98 0.54 114.38 115.84 2o5j h ARG 939 Ca 0.06 0.07 0.20 0.00 -1.26 0.00 0.00 59.98 59.04 2o5j h ARG 939 Cb 0.64 0.22 -0.07 0.00 -1.65 0.00 0.00 29.97 29.11 2o5j h ARG 939 CO 0.05 -0.63 0.59 0.93 0.56 0.00 0.00 179.97 181.46 2o5j h GLU 940 N -1.26 0.39 0.16 0.04 5.08 -1.92 0.50 114.58 117.58 2o5j h GLU 940 Ca -0.10 -0.02 -0.31 0.00 -1.00 0.00 0.00 59.36 57.92 2o5j h GLU 940 Cb 0.77 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.94 2o5j h GLU 940 CO 0.17 0.26 -1.47 0.28 -1.00 0.00 0.00 179.01 177.25 2o5j h VAL 941 N 0.41 1.25 -0.49 3.13 2.07 -1.30 -3.06 116.25 118.26 2o5j h VAL 941 Ca 0.46 -2.81 0.01 0.00 0.82 0.00 0.00 66.70 65.18 2o5j h VAL 941 Cb 1.15 2.87 -0.03 0.00 -1.52 0.00 0.00 31.29 33.77 2o5j h VAL 941 CO -0.17 0.84 0.31 -0.08 0.02 0.00 0.00 177.57 178.49 2o5j h GLU 942 N 0.09 0.60 0.00 1.57 4.57 0.99 -0.84 114.58 121.56 2o5j h GLU 942 Ca -0.23 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 57.88 2o5j h GLU 942 Cb 2.05 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 30.50 2o5j h GLU 942 CO 0.20 0.40 -0.18 -0.24 -1.18 0.00 0.00 179.01 178.01 2o5j h VAL 943 N 0.62 1.05 -0.44 0.32 3.04 -1.10 -2.40 116.25 117.34 2o5j h VAL 943 Ca 0.19 -0.64 -0.09 0.00 -1.01 0.00 0.00 66.70 65.14 2o5j h VAL 943 Cb -0.03 1.35 -0.01 0.00 -2.01 0.00 0.00 31.29 30.59 2o5j h VAL 943 CO -0.06 0.18 -0.09 -0.07 -1.01 0.00 0.00 177.57 176.51 2o5j h LEU 944 N 0.00 0.84 0.10 3.16 3.38 -1.08 -1.60 115.31 120.11 2o5j h LEU 944 Ca -0.00 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.62 2o5j h LEU 944 Cb 0.34 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2o5j h LEU 944 CO 0.02 1.00 -0.32 -0.09 0.09 0.00 0.00 178.44 179.15 2o5j h ARG 945 N 0.67 -0.46 -0.25 1.13 2.43 -0.79 0.25 114.38 117.36 2o5j h ARG 945 Ca 0.11 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.39 2o5j h ARG 945 Cb 0.63 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 2o5j h ARG 945 CO 0.04 -0.30 0.28 0.00 -1.51 0.00 0.00 179.97 178.48 2o5j h ARG 946 N -0.47 0.00 0.07 0.20 3.08 -1.57 -0.76 114.38 114.93 2o5j h ARG 946 Ca -0.01 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.78 2o5j h ARG 946 Cb 0.47 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.53 2o5j h ARG 946 CO -0.16 0.00 -1.11 0.00 -1.07 0.00 0.00 179.97 177.63 2o5j h ALA 947 N 1.67 0.18 -0.08 0.04 0.00 -0.02 -2.52 119.26 118.52 2o5j h ALA 947 Ca 0.12 -0.77 -0.21 0.00 0.00 0.00 0.00 54.91 54.05 2o5j h ALA 947 Cb 0.68 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2o5j h ALA 947 CO -0.00 0.82 -0.79 0.93 0.00 0.00 0.00 179.25 180.20 2o5j h GLU 948 N 0.21 0.53 0.00 0.00 5.08 0.53 -1.86 114.58 119.06 2o5j h GLU 948 Ca -0.13 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 2o5j h GLU 948 Cb 1.78 0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.14 2o5j h GLU 948 CO 0.20 1.09 0.00 1.63 -1.00 0.00 0.00 179.01 180.93 2o5j n LYS 949 N -3.85 0.14 -0.09 2.33 5.02 -0.40 -3.10 118.16 118.21 2o5j n LYS 949 Ca -0.06 0.39 -0.22 0.00 -2.02 0.00 0.00 58.31 56.40 2o5j n LYS 949 Cb 0.75 -1.77 -0.12 0.00 -0.02 0.00 0.00 35.03 33.86 2o5j n LYS 949 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2o5j n LEU 950 N -2.04 2.00 0.00 -0.35 -0.00 -0.95 -5.03 117.00 110.63 2o5j n LEU 950 Ca 0.02 0.38 0.00 0.00 -0.00 0.00 0.00 56.01 56.41 2o5j n LEU 950 Cb 0.20 -0.99 0.00 0.00 -0.00 0.00 0.00 43.42 42.64 2o5j n LEU 950 CO 0.17 0.39 0.00 0.61 -0.00 0.00 0.00 177.39 178.57 2o5j n GLY 951 N 1.52 1.92 0.05 -3.96 0.00 -0.74 -5.04 105.19 98.94 2o5j n GLY 951 Ca -0.33 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.68 2o5j n GLY 951 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o5j n LEU 952 N 0.00 0.00 -4.04 0.99 7.99 -0.97 -4.97 117.00 116.00 2o5j n LEU 952 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 56.01 55.75 2o5j n LEU 952 Cb 0.00 0.21 -0.16 0.00 -0.11 0.00 0.00 43.42 43.36 2o5j n LEU 952 CO 0.00 0.21 -0.47 0.68 -1.51 0.00 0.00 177.39 176.30 2o5j s VAL 953 N -2.66 1.17 -0.11 4.08 -7.23 -1.25 -4.68 120.40 109.71 2o5j s VAL 953 Ca -0.07 -0.51 -0.30 0.00 -1.81 0.00 0.00 61.98 59.30 2o5j s VAL 953 Cb 0.07 -1.05 -0.07 0.00 0.56 0.00 0.00 36.38 35.88 2o5j s VAL 953 CO 0.62 0.36 2.10 0.35 -0.31 0.00 0.00 175.10 178.22 2o5j n THR 954 N 3.69 0.54 -1.75 5.32 -2.24 -1.26 -4.61 114.28 113.96 2o5j n THR 954 Ca -0.22 -0.30 -0.42 0.00 -2.27 0.00 0.00 64.05 60.85 2o5j n THR 954 Cb 0.52 -2.39 -0.01 0.00 -2.10 0.00 0.00 70.33 66.35 2o5j n THR 954 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2o5j n PRO 955 N 8.09 2.65 0.00 -0.78 -0.02 -1.26 -3.23 135.00 140.46 2o5j n PRO 955 Ca 0.26 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.67 2o5j n PRO 955 Cb 0.41 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 2o5j n PRO 955 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 956 N 1.38 0.55 3.89 -1.23 0.00 -1.26 -5.10 105.19 103.42 2o5j n GLY 956 Ca 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 2o5j n GLY 956 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2o5j s LYS 957 N -0.75 3.21 0.54 1.61 2.20 -1.20 -5.08 119.74 120.26 2o5j s LYS 957 Ca 0.00 -0.79 -0.22 0.00 -0.36 0.00 0.00 55.97 54.60 2o5j s LYS 957 Cb 0.00 -2.79 -0.05 0.00 -1.51 0.00 0.00 37.83 33.48 2o5j s LYS 957 CO 0.00 0.47 1.31 -0.08 -0.36 0.00 0.00 175.35 176.69 2o5j s THR 958 N -1.87 2.29 0.42 3.43 -1.32 -1.26 -4.68 115.64 112.64 2o5j s THR 958 Ca 0.33 0.21 0.17 0.00 -1.21 0.00 0.00 61.69 61.19 2o5j s THR 958 Cb -0.10 -3.11 0.37 0.00 -1.51 0.00 0.00 72.50 68.16 2o5j s THR 958 CO 0.27 -0.01 1.89 -0.65 -2.21 0.00 0.00 174.62 173.91 2o5j h PRO 959 N 1.51 0.40 -0.22 7.08 0.11 -1.98 0.40 132.00 139.31 2o5j h PRO 959 Ca -0.51 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 2o5j h PRO 959 Cb 1.29 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2o5j h PRO 959 CO 0.58 0.27 0.11 1.49 -0.21 0.00 0.00 178.00 180.23 2o5j h GLU 960 N 0.41 0.32 -0.13 1.05 4.57 -2.00 -1.15 114.58 117.66 2o5j h GLU 960 Ca 0.42 -0.05 -0.18 0.00 -1.18 0.00 0.00 59.36 58.37 2o5j h GLU 960 Cb 1.02 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.55 2o5j h GLU 960 CO -0.15 0.33 -0.68 0.93 -1.18 0.00 0.00 179.01 178.26 2o5j h GLU 961 N 0.23 0.52 -0.11 1.92 4.39 -1.47 -3.04 114.58 117.01 2o5j h GLU 961 Ca 0.08 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.37 2o5j h GLU 961 Cb 0.11 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2o5j h GLU 961 CO -0.01 1.01 -0.01 1.96 -1.16 0.00 0.00 179.01 180.80 2o5j h GLN 962 N 0.37 0.21 -0.80 2.33 1.08 -0.21 -2.25 115.11 115.85 2o5j h GLN 962 Ca -0.02 -0.07 0.05 0.00 -1.45 0.00 0.00 58.65 57.16 2o5j h GLN 962 Cb 1.25 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 28.62 2o5j h GLN 962 CO 0.12 0.48 0.52 -0.07 -0.95 0.00 0.00 178.83 178.94 2o5j h LEU 963 N -0.08 0.79 0.34 1.46 3.38 -1.29 0.12 115.31 120.03 2o5j h LEU 963 Ca 0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2o5j h LEU 963 Cb 0.40 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2o5j h LEU 963 CO 0.01 0.52 -0.19 0.50 0.09 0.00 0.00 178.44 179.37 2o5j h LYS 964 N 0.91 -0.47 -0.84 1.13 3.64 -1.39 0.57 116.57 120.11 2o5j h LYS 964 Ca 0.33 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.89 2o5j h LYS 964 Cb 0.16 0.11 -0.09 0.00 -0.41 0.00 0.00 32.23 32.00 2o5j h LYS 964 CO -0.11 -0.32 0.42 1.49 -2.27 0.00 0.00 179.45 178.66 2o5j h GLU 965 N -0.49 0.57 -0.11 1.90 4.57 -0.74 0.91 114.58 121.19 2o5j h GLU 965 Ca -0.04 -0.03 -0.15 0.00 -1.18 0.00 0.00 59.36 57.95 2o5j h GLU 965 Cb 0.40 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 2o5j h GLU 965 CO 0.05 0.38 -0.58 -0.07 -1.18 0.00 0.00 179.01 177.61 2o5j h LEU 966 N 0.59 0.41 -0.41 1.64 4.07 -0.35 -3.01 115.31 118.24 2o5j h LEU 966 Ca 0.46 -0.23 -0.15 0.00 0.08 0.00 0.00 57.88 58.04 2o5j h LEU 966 Cb 0.66 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.28 2o5j h LEU 966 CO -0.37 0.90 -0.33 0.15 -1.08 0.00 0.00 178.44 177.70 2o5j h PHE 967 N 0.27 1.13 -0.41 1.13 3.57 0.17 -2.83 116.94 119.97 2o5j h PHE 967 Ca -0.00 -0.32 0.07 0.00 3.53 0.00 0.00 57.97 61.25 2o5j h PHE 967 Cb 1.10 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2o5j h PHE 967 CO 0.03 1.15 0.28 -0.07 -2.23 0.00 0.00 178.31 177.47 2o5j h LEU 968 N 0.78 0.20 0.00 0.59 3.38 -0.82 0.32 115.31 119.77 2o5j h LEU 968 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2o5j h LEU 968 Cb 0.93 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2o5j h LEU 968 CO 0.09 0.13 0.00 0.00 0.09 0.00 0.00 178.44 178.75 2o5j n GLN 969 N -4.47 0.04 -0.38 1.13 1.13 -1.08 -4.79 117.38 108.96 2o5j n GLN 969 Ca 0.06 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2o5j n GLN 969 Cb 0.31 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2o5j n GLN 969 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2o5j n GLY 970 N -0.15 0.73 3.32 1.08 0.00 0.11 -5.02 105.19 105.26 2o5j n GLY 970 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 2o5j n GLY 970 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 971 N -0.62 1.57 0.18 1.61 1.02 -1.17 -3.38 119.74 118.94 2o5j s LYS 971 Ca 0.00 -1.10 0.05 0.00 0.02 0.00 0.00 55.97 54.94 2o5j s LYS 971 Cb 0.00 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.48 2o5j s LYS 971 CO 0.00 0.45 -0.09 0.14 -0.92 0.00 0.00 175.35 174.93 2o5j s VAL 972 N -0.87 1.28 0.26 3.17 -7.23 -0.83 -3.34 120.40 112.84 2o5j s VAL 972 Ca 0.10 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.89 2o5j s VAL 972 Cb -0.10 -1.99 -0.09 0.00 0.56 0.00 0.00 36.38 34.77 2o5j s VAL 972 CO 0.03 -0.63 0.98 -0.69 -0.31 0.00 0.00 175.10 174.47 2o5j s VAL 973 N -3.26 3.94 0.02 1.32 1.01 -1.26 -2.39 120.40 119.78 2o5j s VAL 973 Ca 0.20 1.93 0.03 0.00 0.00 0.00 0.00 61.98 64.14 2o5j s VAL 973 Cb 0.02 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 2o5j s VAL 973 CO 0.03 0.44 -0.09 -0.22 0.00 0.00 0.00 175.10 175.27 2o5j s LEU 974 N -1.31 2.11 0.19 3.92 2.96 -1.26 -4.13 118.68 121.15 2o5j s LEU 974 Ca 0.43 -0.30 -0.03 0.00 -0.22 0.00 0.00 54.13 54.01 2o5j s LEU 974 Cb -0.27 -0.36 -0.05 0.00 0.50 0.00 0.00 46.19 46.02 2o5j s LEU 974 CO 0.33 0.00 0.40 -0.31 -1.32 0.00 0.00 176.35 175.45 2o5j s TYR 975 N -0.61 3.48 0.22 5.38 2.02 -0.79 -0.14 117.35 126.92 2o5j s TYR 975 Ca -0.01 0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 57.07 2o5j s TYR 975 Cb -0.06 -1.94 0.26 0.00 -0.40 0.00 0.00 41.96 39.83 2o5j s TYR 975 CO 0.00 0.38 1.85 0.22 -1.57 0.00 0.00 175.55 176.43 2o5j h ASP 976 N 2.30 0.77 0.00 2.29 1.82 0.82 -2.86 116.42 121.57 2o5j h ASP 976 Ca -0.47 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.18 2o5j h ASP 976 Cb 1.18 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 41.04 2o5j h ASP 976 CO 0.70 0.51 0.00 0.61 -1.61 0.00 0.00 179.24 179.45 2o5j n GLY 977 N -1.31 2.84 0.09 -0.78 0.00 -1.26 -3.44 105.19 101.32 2o5j n GLY 977 Ca 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 2o5j n GLY 977 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j n ARG 978 N -0.17 0.65 0.00 1.61 1.74 -1.19 -4.18 116.66 115.12 2o5j n ARG 978 Ca 0.00 0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2o5j n ARG 978 Cb 0.00 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 29.77 2o5j n ARG 978 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 2o5j n THR 979 N -2.84 0.00 -0.55 0.55 5.66 -1.26 -4.99 114.28 110.84 2o5j n THR 979 Ca -0.21 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.46 2o5j n THR 979 Cb 1.02 0.92 0.00 0.00 -1.55 0.00 0.00 70.33 70.72 2o5j n THR 979 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2o5j n GLY 980 N 0.89 1.53 3.82 1.09 0.00 -1.26 -4.99 105.19 106.27 2o5j n GLY 980 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2o5j n GLY 980 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 981 N -0.09 3.81 0.90 1.61 2.56 -1.26 -4.59 118.70 121.63 2o5j s GLU 981 Ca 0.00 1.11 -0.14 0.00 0.00 0.00 0.00 54.97 55.94 2o5j s GLU 981 Cb 0.00 -2.11 0.16 0.00 2.00 0.00 0.00 34.13 34.18 2o5j s GLU 981 CO 0.00 -0.40 1.25 -1.25 -0.56 0.00 0.00 175.26 174.31 2o5j s PRO 982 N -3.80 1.10 -0.54 4.30 0.04 -1.26 0.13 135.00 134.97 2o5j s PRO 982 Ca 0.62 -0.31 -0.14 0.00 0.04 0.00 0.00 61.00 61.21 2o5j s PRO 982 Cb -0.12 -1.91 0.13 0.00 0.04 0.00 0.00 34.50 32.64 2o5j s PRO 982 CO 0.28 -2.10 0.48 0.42 0.04 0.00 0.00 177.00 176.12 2o5j s ILE 983 N -3.74 5.01 -0.82 0.56 1.01 0.80 -4.62 121.20 119.40 2o5j s ILE 983 Ca 0.70 -1.62 -0.34 0.00 0.00 0.00 0.00 60.65 59.38 2o5j s ILE 983 Cb -0.06 -4.22 -0.20 0.00 0.01 0.00 0.00 42.46 37.98 2o5j s ILE 983 CO 0.51 -0.86 2.52 -0.62 0.00 0.00 0.00 174.94 176.49 2o5j n GLU 984 N 5.10 0.08 0.00 2.79 1.02 -1.26 -4.36 120.64 124.00 2o5j n GLU 984 Ca -0.11 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 2o5j n GLU 984 Cb 0.40 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.22 2o5j n GLU 984 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2o5j n GLY 985 N 6.76 2.83 3.77 0.62 0.00 -1.26 -5.04 105.19 112.86 2o5j n GLY 985 Ca 0.61 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 2o5j n GLY 985 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2o5j s PRO 986 N -5.30 4.33 -0.11 1.61 0.04 -1.26 -4.85 135.00 129.46 2o5j s PRO 986 Ca 0.00 2.11 0.03 0.00 0.04 0.00 0.00 61.00 63.18 2o5j s PRO 986 Cb 0.00 -3.02 0.01 0.00 0.04 0.00 0.00 34.50 31.53 2o5j s PRO 986 CO 0.00 -0.17 -0.21 0.42 0.04 0.00 0.00 177.00 177.08 2o5j s ILE 987 N -1.18 1.86 0.63 0.56 1.01 -1.01 -4.87 121.20 118.21 2o5j s ILE 987 Ca 0.50 -0.88 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 2o5j s ILE 987 Cb -0.38 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 40.44 2o5j s ILE 987 CO 0.49 0.51 1.14 0.54 0.00 0.00 0.00 174.94 177.63 2o5j s VAL 988 N 0.61 2.98 0.10 2.92 0.11 -1.26 -1.96 120.40 123.90 2o5j s VAL 988 Ca -0.13 0.52 -0.14 0.00 -2.93 0.00 0.00 61.98 59.30 2o5j s VAL 988 Cb -0.17 -3.09 0.02 0.00 -1.53 0.00 0.00 36.38 31.62 2o5j s VAL 988 CO 0.04 -0.22 0.32 -0.69 -3.33 0.00 0.00 175.10 171.22 2o5j s VAL 989 N -2.04 0.09 -0.94 2.04 1.01 -1.22 -2.56 120.40 116.79 2o5j s VAL 989 Ca 0.71 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.92 2o5j s VAL 989 Cb -0.24 -1.18 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2o5j s VAL 989 CO 0.37 -0.43 0.00 0.61 0.00 0.00 0.00 175.10 175.66 2o5j n GLY 990 N -0.03 -1.39 3.43 4.51 0.00 0.16 -4.53 105.19 107.35 2o5j n GLY 990 Ca -0.16 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 2o5j n GLY 990 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2o5j s GLN 991 N -1.57 3.09 -0.12 1.61 -0.21 -1.25 0.42 119.66 121.63 2o5j s GLN 991 Ca 0.00 -0.96 -0.03 0.00 0.02 0.00 0.00 55.36 54.39 2o5j s GLN 991 Cb 0.00 -4.24 -0.03 0.00 1.00 0.00 0.00 33.01 29.74 2o5j s GLN 991 CO 0.00 -1.74 -0.02 1.41 -2.12 0.00 0.00 175.29 172.82 2o5j s MET 992 N 3.68 3.34 -0.33 2.91 -2.45 -0.85 -4.40 119.30 121.21 2o5j s MET 992 Ca 0.19 -0.47 -0.24 0.00 -1.25 0.00 0.00 55.69 53.92 2o5j s MET 992 Cb -0.19 -2.85 0.00 0.00 1.25 0.00 0.00 34.83 33.04 2o5j s MET 992 CO 0.09 0.45 0.81 0.12 1.05 0.00 0.00 175.02 177.54 2o5j s PHE 993 N -0.21 3.17 -0.03 4.11 2.19 -1.26 -1.82 117.98 124.13 2o5j s PHE 993 Ca 0.04 0.76 0.05 0.00 0.33 0.00 0.00 56.93 58.11 2o5j s PHE 993 Cb -0.13 -3.31 -0.01 0.00 -1.31 0.00 0.00 43.02 38.26 2o5j s PHE 993 CO 0.02 -0.63 -0.19 0.42 1.83 0.00 0.00 175.22 176.67 2o5j s ILE 994 N 3.05 1.57 0.25 3.12 1.01 -1.15 -4.26 121.20 124.79 2o5j s ILE 994 Ca 0.33 -0.82 0.09 0.00 0.00 0.00 0.00 60.65 60.25 2o5j s ILE 994 Cb -0.14 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 2o5j s ILE 994 CO 0.14 0.45 0.03 -0.04 0.00 0.00 0.00 174.94 175.52 2o5j s MET 995 N -0.19 2.42 -0.21 2.79 -1.94 -0.75 -1.99 119.30 119.44 2o5j s MET 995 Ca 0.01 -1.30 -0.09 0.00 -1.71 0.00 0.00 55.69 52.61 2o5j s MET 995 Cb -0.10 -2.27 -0.04 0.00 2.01 0.00 0.00 34.83 34.43 2o5j s MET 995 CO 0.01 0.39 0.10 0.21 -0.01 0.00 0.00 175.02 175.72 2o5j s LYS 996 N -3.56 3.98 0.19 2.03 2.20 -1.26 -0.67 119.74 122.64 2o5j s LYS 996 Ca 0.31 -0.33 -0.15 0.00 -0.36 0.00 0.00 55.97 55.43 2o5j s LYS 996 Cb -0.07 -3.35 -0.07 0.00 -1.51 0.00 0.00 37.83 32.83 2o5j s LYS 996 CO 0.20 0.14 0.61 -0.51 -0.36 0.00 0.00 175.35 175.44 2o5j s LEU 997 N 0.76 4.31 -0.03 5.43 2.01 -0.41 -2.04 118.68 128.70 2o5j s LEU 997 Ca 0.05 1.17 -0.36 0.00 0.01 0.00 0.00 54.13 55.00 2o5j s LEU 997 Cb -0.13 -3.44 -0.14 0.00 0.01 0.00 0.00 46.19 42.48 2o5j s LEU 997 CO 0.02 0.05 1.64 0.00 1.01 0.00 0.00 176.35 179.07 2o5j n TYR 998 N 0.63 2.05 -2.78 0.29 9.36 0.14 -4.70 117.16 122.15 2o5j n TYR 998 Ca -0.03 0.35 -0.43 0.00 3.32 0.00 0.00 57.90 61.11 2o5j n TYR 998 Cb 0.52 -2.51 -0.03 0.00 -0.63 0.00 0.00 39.34 36.69 2o5j n TYR 998 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 2o5j s HIS 999 N 2.31 2.67 1.05 2.98 3.76 -1.26 -5.03 115.29 121.77 2o5j s HIS 999 Ca 0.89 -0.66 -0.16 0.00 -0.15 0.00 0.00 55.06 54.97 2o5j s HIS 999 Cb -0.84 -4.40 0.22 0.00 1.11 0.00 0.00 32.58 28.66 2o5j s HIS 999 CO 0.50 -1.73 1.16 -1.64 -0.85 0.00 0.00 174.74 172.19 2o5j s MET 1000N 4.20 0.01 0.00 1.40 1.00 -1.26 -4.90 119.30 119.75 2o5j s MET 1000Ca 0.29 0.02 0.25 0.00 0.00 0.00 0.00 55.69 56.26 2o5j s MET 1000Cb -0.11 -1.73 1.50 0.00 0.00 0.00 0.00 34.83 34.49 2o5j s MET 1000CO 0.05 -2.91 1.87 0.28 0.00 0.00 0.00 175.02 174.31 2o5j n VAL 1001N -4.21 0.02 0.33 -6.03 0.31 -1.26 -1.94 118.33 105.55 2o5j n VAL 1001Ca 0.11 0.01 0.12 0.00 -0.01 0.00 0.00 64.34 64.57 2o5j n VAL 1001Cb 0.59 -0.61 0.22 0.00 -0.91 0.00 0.00 33.84 33.14 2o5j n VAL 1001CO 0.00 0.00 0.00 1.05 -1.32 0.00 0.00 176.83 176.56 2o5j h GLU 1002N 0.00 0.00 0.08 5.55 4.11 -1.99 -3.32 114.58 119.01 2o5j h GLU 1002Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2o5j h GLU 1002Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2o5j h GLU 1002CO 0.00 0.00 -0.04 0.22 0.07 0.00 0.00 179.01 179.26 2o5j h ASP 1003N 0.00 -0.09 -1.17 3.06 1.82 -1.74 -3.42 116.42 114.88 2o5j h ASP 1003Ca 0.00 -0.06 -0.40 0.00 -0.39 0.00 0.00 57.03 56.18 2o5j h ASP 1003Cb 0.92 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.95 2o5j h ASP 1003CO 0.00 0.42 1.43 0.29 -1.61 0.00 0.00 179.24 179.77 2o5j n LYS 1004N -4.84 0.81 -0.83 0.28 4.76 -1.24 -4.87 118.16 112.22 2o5j n LYS 1004Ca -0.02 -0.13 -0.34 0.00 -2.87 0.00 0.00 58.31 54.95 2o5j n LYS 1004Cb 0.07 -3.17 0.11 0.00 -1.84 0.00 0.00 35.03 30.19 2o5j n LYS 1004CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2o5j n MET 1005N 8.82 -0.47 -3.98 1.97 0.00 -1.26 -4.91 117.12 117.29 2o5j n MET 1005Ca 0.43 -0.11 -0.22 0.00 0.00 0.00 0.00 57.70 57.79 2o5j n MET 1005Cb 0.45 -1.56 -0.17 0.00 0.00 0.00 0.00 33.22 31.95 2o5j n MET 1005CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 2o5j s HIS 1006N -2.24 0.86 -0.15 3.17 3.76 -1.26 -5.07 115.29 114.35 2o5j s HIS 1006Ca 0.51 -0.29 -0.02 0.00 -0.15 0.00 0.00 55.06 55.12 2o5j s HIS 1006Cb -0.16 -0.82 0.04 0.00 1.11 0.00 0.00 32.58 32.75 2o5j s HIS 1006CO 0.71 -0.30 -0.01 0.00 -0.85 0.00 0.00 174.74 174.29 2o5j s ALA 1007N 1.46 1.10 -0.14 -1.40 0.00 -1.26 -5.07 121.76 116.45 2o5j s ALA 1007Ca -0.02 -0.60 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 2o5j s ALA 1007Cb -0.13 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 2o5j s ALA 1007CO -0.03 -0.84 -0.11 0.50 0.00 0.00 0.00 175.76 175.28 2o5j s ARG 1008N 1.80 3.44 -0.05 0.00 3.52 -1.26 -4.82 118.95 121.59 2o5j s ARG 1008Ca 0.01 -0.65 -0.03 0.00 -0.13 0.00 0.00 55.73 54.93 2o5j s ARG 1008Cb -0.15 -2.71 -0.01 0.00 -1.56 0.00 0.00 34.95 30.52 2o5j s ARG 1008CO -0.07 0.19 -0.06 0.45 -0.81 0.00 0.00 175.30 175.00 2o5j n SER 1009N 3.62 0.60 -3.82 -2.12 2.88 -1.26 -5.00 113.62 108.51 2o5j n SER 1009Ca -0.18 0.36 -0.12 0.00 -1.33 0.00 0.00 58.87 57.60 2o5j n SER 1009Cb 0.52 -0.62 -0.10 0.00 -0.75 0.00 0.00 64.21 63.27 2o5j n SER 1009CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2o5j s THR 1010N -1.42 0.05 0.00 2.46 2.01 -1.26 -5.15 115.64 112.33 2o5j s THR 1010Ca -0.05 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.51 2o5j s THR 1010Cb 0.01 -0.46 0.00 0.00 0.01 0.00 0.00 72.50 72.06 2o5j s THR 1010CO 0.08 -0.24 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 2o5j n GLY 1011N 1.81 1.85 3.53 4.40 0.00 -1.26 -5.03 105.19 110.50 2o5j n GLY 1011Ca -0.20 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 2o5j n GLY 1011CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2o5j s PRO 1012N 2.43 -0.68 0.05 1.61 0.02 -1.25 -4.94 135.00 132.23 2o5j s PRO 1012Ca 0.00 0.74 -0.05 0.00 0.02 0.00 0.00 61.00 61.71 2o5j s PRO 1012Cb 0.00 -1.59 -0.02 0.00 0.02 0.00 0.00 34.50 32.92 2o5j s PRO 1012CO 0.00 -3.54 0.08 0.71 -0.33 0.00 0.00 177.00 173.92 2o5j s TYR 1013N -2.58 0.26 0.44 6.54 2.02 -1.26 -2.83 117.35 119.95 2o5j s TYR 1013Ca 0.68 -0.63 -0.21 0.00 -0.37 0.00 0.00 57.07 56.54 2o5j s TYR 1013Cb -0.23 -0.18 -0.09 0.00 -0.40 0.00 0.00 41.96 41.05 2o5j s TYR 1013CO 0.63 -0.38 1.01 -1.12 -1.57 0.00 0.00 175.55 174.11 2o5j s SER 1014N -2.35 6.66 0.02 2.29 0.01 0.26 -4.80 113.70 115.79 2o5j s SER 1014Ca -0.02 1.87 -0.29 0.00 1.31 0.00 0.00 55.95 58.82 2o5j s SER 1014Cb 0.01 -2.56 -0.16 0.00 0.21 0.00 0.00 66.02 63.52 2o5j s SER 1014CO -0.06 -0.56 1.19 0.25 0.41 0.00 0.00 173.24 174.47 2o5j h LEU 1015N 1.93 -0.85 0.07 2.44 5.85 -1.98 -3.37 115.31 119.39 2o5j h LEU 1015Ca -0.49 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2o5j h LEU 1015Cb 1.20 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.46 2o5j h LEU 1015CO 0.61 -0.48 -0.03 0.16 -0.34 0.00 0.00 178.44 178.35 2o5j h ILE 1016N -1.25 0.58 -3.93 4.05 -2.65 -2.00 -3.44 117.51 108.87 2o5j h ILE 1016Ca -0.10 -1.31 -0.46 0.00 1.03 0.00 0.00 64.86 64.02 2o5j h ILE 1016Cb 0.78 1.06 -0.02 0.00 -2.05 0.00 0.00 36.82 36.59 2o5j h ILE 1016CO 0.17 0.18 0.25 0.28 0.03 0.00 0.00 178.15 179.06 2o5j s THR 1017N -2.22 4.51 -0.48 0.16 -1.32 -1.26 -4.94 115.64 110.10 2o5j s THR 1017Ca -0.08 1.25 0.03 0.00 -1.21 0.00 0.00 61.69 61.69 2o5j s THR 1017Cb -0.01 -3.61 0.63 0.00 -1.51 0.00 0.00 72.50 68.01 2o5j s THR 1017CO 0.27 -0.30 1.92 0.00 -2.21 0.00 0.00 174.62 174.31 2o5j n GLN 1018N -0.61 2.31 -3.09 7.08 1.13 -1.26 -3.51 117.38 119.44 2o5j n GLN 1018Ca 0.06 -3.06 -0.33 0.00 -1.94 0.00 0.00 57.00 51.73 2o5j n GLN 1018Cb 0.54 -2.19 -0.06 0.00 0.11 0.00 0.00 30.24 28.64 2o5j n GLN 1018CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2o5j s GLN 1019N -3.38 4.05 0.32 -1.09 -1.52 -1.26 -4.48 119.66 112.30 2o5j s GLN 1019Ca 0.58 0.75 -0.29 0.00 -1.95 0.00 0.00 55.36 54.45 2o5j s GLN 1019Cb 0.48 -2.41 -0.11 0.00 -0.22 0.00 0.00 33.01 30.76 2o5j s GLN 1019CO 0.09 0.13 1.47 -2.14 -0.25 0.00 0.00 175.29 174.59 2o5j s PRO 1020N -2.98 4.19 -0.05 2.91 0.02 -1.26 -0.58 135.00 137.26 2o5j s PRO 1020Ca 0.55 2.45 -0.14 0.00 0.02 0.00 0.00 61.00 63.87 2o5j s PRO 1020Cb -0.10 -3.03 0.03 0.00 0.02 0.00 0.00 34.50 31.41 2o5j s PRO 1020CO 0.17 -0.47 0.33 -0.51 -0.33 0.00 0.00 177.00 176.20 2o5j s LEU 1021N -1.27 0.74 0.00 -5.54 1.02 -1.13 -4.33 118.68 108.18 2o5j s LEU 1021Ca 0.56 0.31 0.00 0.00 0.02 0.00 0.00 54.13 55.02 2o5j s LEU 1021Cb -0.44 1.29 0.00 0.00 0.02 0.00 0.00 46.19 47.05 2o5j s LEU 1021CO 0.53 -0.35 0.00 0.61 0.02 0.00 0.00 176.35 177.16 2o5j n GLY 1022N 1.78 1.79 0.00 -3.19 0.00 -1.26 -3.75 105.19 100.57 2o5j n GLY 1022Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2o5j n GLY 1022CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 1023N 5.00 1.20 0.00 -0.02 0.00 -0.85 -4.92 105.19 105.60 2o5j n GLY 1023Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2o5j n GLY 1023CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2o5j n LYS 1024N 0.00 0.00 -0.07 1.61 5.02 -1.26 -4.71 118.16 118.75 2o5j n LYS 1024Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 2o5j n LYS 1024Cb 0.00 -0.89 -0.11 0.00 -0.02 0.00 0.00 35.03 34.02 2o5j n LYS 1024CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2o5j n ALA 1025N -0.78 1.64 -2.59 7.82 0.00 -1.26 -4.89 120.51 120.46 2o5j n ALA 1025Ca 0.00 -0.93 -0.43 0.00 0.00 0.00 0.00 53.44 52.08 2o5j n ALA 1025Cb 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 19.45 19.35 2o5j n ALA 1025CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2o5j s GLN 1026N -2.35 3.29 0.06 0.00 1.11 -1.26 -4.59 119.66 115.92 2o5j s GLN 1026Ca -0.09 -0.37 -0.11 0.00 0.01 0.00 0.00 55.36 54.80 2o5j s GLN 1026Cb 0.05 -3.99 -0.02 0.00 -1.01 0.00 0.00 33.01 28.03 2o5j s GLN 1026CO 0.57 -1.15 0.55 1.19 0.01 0.00 0.00 175.29 176.46 2o5j n PHE 1027N 6.56 -0.16 0.00 0.91 3.72 -1.26 -2.00 117.46 125.23 2o5j n PHE 1027Ca -0.01 0.45 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 2o5j n PHE 1027Cb 0.47 -0.52 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 2o5j n PHE 1027CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2o5j n GLY 1028N -1.09 2.43 3.84 1.37 0.00 -1.26 -3.95 105.19 106.52 2o5j n GLY 1028Ca 0.01 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.17 2o5j n GLY 1028CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2o5j s GLY 1029N 0.00 1.81 0.51 -0.02 0.00 -1.26 -4.67 107.32 103.69 2o5j s GLY 1029Ca 0.00 0.09 -0.16 0.00 0.00 0.00 0.00 44.72 44.65 2o5j s GLY 1029CO 0.00 0.38 0.98 1.20 0.00 0.00 0.00 173.10 175.66 2o5j s GLN 1030N -4.75 3.92 0.17 2.90 1.11 -1.26 -4.96 119.66 116.79 2o5j s GLN 1030Ca 0.58 0.91 -0.19 0.00 0.01 0.00 0.00 55.36 56.67 2o5j s GLN 1030Cb -0.12 -2.15 -0.08 0.00 -1.01 0.00 0.00 33.01 29.65 2o5j s GLN 1030CO 0.47 -0.28 0.67 0.50 0.01 0.00 0.00 175.29 176.67 2o5j s ARG 1031N -4.13 4.23 0.00 2.91 3.52 -1.26 -4.99 118.95 119.24 2o5j s ARG 1031Ca 0.58 0.81 0.20 0.00 -0.13 0.00 0.00 55.73 57.19 2o5j s ARG 1031Cb -0.10 -3.00 -0.07 0.00 -1.56 0.00 0.00 34.95 30.22 2o5j s ARG 1031CO 0.33 0.48 0.95 0.34 -0.81 0.00 0.00 175.30 176.58 2o5j n PHE 1032N 1.03 0.00 -0.84 5.12 7.35 -1.26 -5.09 117.46 123.77 2o5j n PHE 1032Ca -0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 2o5j n PHE 1032Cb 0.51 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.34 2o5j n PHE 1032CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2o5j n GLY 1033N 1.36 0.00 0.34 7.13 0.00 -1.26 -3.77 105.19 108.99 2o5j n GLY 1033Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 2o5j n GLY 1033CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2o5j h GLU 1034N 0.25 0.94 -1.00 1.61 4.11 -1.98 -0.84 114.58 117.66 2o5j h GLU 1034Ca 0.00 -0.09 0.20 0.00 0.07 0.00 0.00 59.36 59.54 2o5j h GLU 1034Cb 0.00 -0.20 -0.10 0.00 0.50 0.00 0.00 28.75 28.95 2o5j h GLU 1034CO 0.00 0.67 0.61 0.52 0.07 0.00 0.00 179.01 180.88 2o5j h MET 1035N 0.95 0.69 0.08 1.06 2.86 -2.00 0.17 114.93 118.74 2o5j h MET 1035Ca 0.25 -0.04 -0.26 0.00 -2.06 0.00 0.00 59.70 57.59 2o5j h MET 1035Cb -0.01 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 31.50 2o5j h MET 1035CO -0.04 0.46 -1.12 0.93 1.06 0.00 0.00 176.91 178.19 2o5j h GLU 1036N 0.71 0.36 -0.01 1.72 3.07 -1.38 -2.83 114.58 116.23 2o5j h GLU 1036Ca 0.57 -0.50 0.03 0.00 -0.50 0.00 0.00 59.36 58.97 2o5j h GLU 1036Cb 0.96 0.17 -0.05 0.00 -0.84 0.00 0.00 28.75 28.99 2o5j h GLU 1036CO -0.36 1.19 -0.35 0.28 -1.40 0.00 0.00 179.01 178.37 2o5j h VAL 1037N 0.16 0.26 -1.00 3.13 2.07 0.32 -0.77 116.25 120.40 2o5j h VAL 1037Ca -0.12 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.67 2o5j h VAL 1037Cb 1.80 0.26 -0.13 0.00 -1.52 0.00 0.00 31.29 31.69 2o5j h VAL 1037CO 0.19 0.00 0.59 -0.50 0.02 0.00 0.00 177.57 177.87 2o5j h TRP 1038N -0.50 0.99 0.20 1.57 6.55 -0.74 0.27 115.95 124.30 2o5j h TRP 1038Ca 0.06 0.04 0.01 0.00 0.95 0.00 0.00 58.89 59.94 2o5j h TRP 1038Cb 0.59 -0.28 -0.02 0.00 -0.86 0.00 0.00 29.16 28.59 2o5j h TRP 1038CO -0.37 -0.00 -0.22 0.00 -1.05 0.00 0.00 178.44 176.79 2o5j h ALA 1039N 1.77 -0.44 -0.52 1.49 0.00 -0.90 0.45 119.26 121.11 2o5j h ALA 1039Ca 0.67 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.42 2o5j h ALA 1039Cb 1.35 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.45 2o5j h ALA 1039CO -0.51 -0.78 -0.08 -0.07 0.00 0.00 0.00 179.25 177.80 2o5j h LEU 1040N -0.47 0.94 -0.65 0.00 4.07 -0.35 -2.71 115.31 116.14 2o5j h LEU 1040Ca 0.00 -0.29 0.09 0.00 0.08 0.00 0.00 57.88 57.76 2o5j h LEU 1040Cb 0.44 -0.25 -0.07 0.00 1.08 0.00 0.00 40.66 41.86 2o5j h LEU 1040CO -0.07 1.04 0.30 -0.33 -1.08 0.00 0.00 178.44 178.30 2o5j h GLU 1041N 0.85 0.50 -0.27 1.13 5.08 -0.00 -0.99 114.58 120.88 2o5j h GLU 1041Ca 0.14 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 2o5j h GLU 1041Cb 0.62 -0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 2o5j h GLU 1041CO 0.04 0.33 -0.11 0.00 -1.00 0.00 0.00 179.01 178.28 2o5j h ALA 1042N 1.41 0.13 -2.37 3.43 0.00 0.16 -3.41 119.26 118.62 2o5j h ALA 1042Ca 0.32 0.11 -0.46 0.00 0.00 0.00 0.00 54.91 54.88 2o5j h ALA 1042Cb 0.35 0.28 0.16 0.00 0.00 0.00 0.00 17.79 18.57 2o5j h ALA 1042CO -0.27 -0.51 0.21 0.71 0.00 0.00 0.00 179.25 179.39 2o5j s TYR 1043N -6.19 2.15 -0.81 0.00 1.51 -0.38 -4.87 117.35 108.77 2o5j s TYR 1043Ca -0.14 1.00 0.04 0.00 -1.01 0.00 0.00 57.07 56.96 2o5j s TYR 1043Cb 0.12 -3.26 0.21 0.00 -0.11 0.00 0.00 41.96 38.92 2o5j s TYR 1043CO 0.69 -2.81 0.82 0.41 -1.11 0.00 0.00 175.55 173.55 2o5j n GLY 1044N -1.18 1.88 3.45 0.71 0.00 -1.26 -4.71 105.19 104.07 2o5j n GLY 1044Ca 0.05 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2o5j n GLY 1044CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j n ALA 1045N 0.16 1.40 -0.81 4.61 0.00 -1.22 -4.68 120.51 119.97 2o5j n ALA 1045Ca 0.07 -2.77 0.00 0.00 0.00 0.00 0.00 53.44 50.74 2o5j n ALA 1045Cb 0.49 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.37 2o5j n ALA 1045CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2o5j n ALA 1046N 12.50 -0.05 -0.35 0.00 0.00 -1.26 -2.56 120.51 128.78 2o5j n ALA 1046Ca 0.46 0.00 0.14 0.00 0.00 0.00 0.00 53.44 54.04 2o5j n ALA 1046Cb 0.44 0.00 0.34 0.00 0.00 0.00 0.00 19.45 20.23 2o5j n ALA 1046CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2o5j h HIS 1047N 0.00 1.04 -0.78 0.00 3.86 -1.99 0.75 115.15 118.03 2o5j h HIS 1047Ca 0.00 0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.33 2o5j h HIS 1047Cb 0.00 -0.31 -0.05 0.00 1.06 0.00 0.00 27.41 28.11 2o5j h HIS 1047CO 0.02 0.17 0.51 1.15 0.86 0.00 0.00 177.93 180.65 2o5j h THR 1048N 0.69 0.97 -0.06 2.45 2.02 -1.93 0.33 112.91 117.38 2o5j h THR 1048Ca 0.60 -0.26 -0.25 0.00 0.77 0.00 0.00 66.41 67.28 2o5j h THR 1048Cb 1.01 0.16 0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2o5j h THR 1048CO -0.42 0.14 -0.93 0.25 0.37 0.00 0.00 175.52 174.93 2o5j h LEU 1049N 0.75 0.91 0.51 2.58 5.85 0.68 -3.02 115.31 123.56 2o5j h LEU 1049Ca 0.36 -0.67 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 2o5j h LEU 1049Cb 0.40 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 2o5j h LEU 1049CO -0.13 1.47 -0.30 -0.61 -0.34 0.00 0.00 178.44 178.53 2o5j h GLN 1050N 0.45 -0.73 -0.85 1.25 4.15 0.21 -2.36 115.11 117.23 2o5j h GLN 1050Ca -0.10 0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.53 2o5j h GLN 1050Cb 1.57 0.17 -0.15 0.00 0.21 0.00 0.00 27.48 29.28 2o5j h GLN 1050CO 0.19 -0.49 -0.30 0.93 -1.93 0.00 0.00 178.83 177.23 2o5j h GLU 1051N -0.76 -0.04 -0.96 1.69 5.08 -0.47 0.74 114.58 119.87 2o5j h GLU 1051Ca -0.06 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2o5j h GLU 1051Cb 0.61 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2o5j h GLU 1051CO 0.07 -0.02 0.63 0.52 -1.00 0.00 0.00 179.01 179.21 2o5j h MET 1052N -0.04 1.21 0.00 2.33 2.86 -1.38 0.16 114.93 120.07 2o5j h MET 1052Ca 0.36 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.92 2o5j h MET 1052Cb 0.61 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.99 2o5j h MET 1052CO -0.88 0.80 -0.47 -0.07 1.06 0.00 0.00 176.91 177.35 2o5j h LEU 1053N 1.25 0.00 0.00 1.22 3.38 0.13 -3.34 115.31 117.95 2o5j h LEU 1053Ca 0.37 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2o5j h LEU 1053Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2o5j h LEU 1053CO -0.10 0.01 0.00 0.35 0.09 0.00 0.00 178.44 178.78 2o5j n THR 1054N -2.80 0.00 -0.36 0.22 -2.24 0.22 -3.94 114.28 105.37 2o5j n THR 1054Ca 0.02 0.00 0.30 0.00 -2.27 0.00 0.00 64.05 62.10 2o5j n THR 1054Cb 0.53 -0.16 0.61 0.00 -2.10 0.00 0.00 70.33 69.20 2o5j n THR 1054CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2o5j h LEU 1055N 0.00 0.28 0.00 3.22 3.38 -1.59 -0.26 115.31 120.35 2o5j h LEU 1055Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2o5j h LEU 1055Cb 0.00 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2o5j h LEU 1055CO 0.00 0.00 -1.09 0.29 0.09 0.00 0.00 178.44 177.74 2o5j n LYS 1056N -4.52 0.33 0.00 1.13 5.02 0.50 -4.07 118.16 116.55 2o5j n LYS 1056Ca 0.29 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2o5j n LYS 1056Cb 1.12 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.53 2o5j n LYS 1056CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2o5j n SER 1057N -2.03 0.02 -0.03 4.39 3.41 -0.21 -4.88 113.62 114.29 2o5j n SER 1057Ca 0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.59 2o5j n SER 1057Cb 0.45 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.36 2o5j n SER 1057CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2o5j n ASP 1058N -2.62 3.58 -4.55 4.04 4.64 -0.92 -4.28 116.55 116.44 2o5j n ASP 1058Ca 0.00 -0.01 -0.13 0.00 -1.38 0.00 0.00 54.79 53.27 2o5j n ASP 1058Cb 0.13 0.50 -0.09 0.00 -1.04 0.00 0.00 41.12 40.62 2o5j n ASP 1058CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 2o5j n ASP 1059N -2.30 1.52 -0.04 1.67 2.03 -0.59 -3.09 116.55 115.75 2o5j n ASP 1059Ca -0.10 -1.62 -0.05 0.00 0.52 0.00 0.00 54.79 53.54 2o5j n ASP 1059Cb 0.68 -1.61 -0.04 0.00 -0.72 0.00 0.00 41.12 39.43 2o5j n ASP 1059CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2o5j h ILE 1060N 7.48 0.00 -0.46 5.18 2.10 -1.88 0.17 117.51 130.10 2o5j h ILE 1060Ca 0.00 0.00 0.04 0.00 1.08 0.00 0.00 64.86 65.98 2o5j h ILE 1060Cb 1.01 0.00 -0.02 0.00 -1.09 0.00 0.00 36.82 36.71 2o5j h ILE 1060CO 1.03 0.00 0.30 -0.33 -1.08 0.00 0.00 178.15 178.08 2o5j h GLU 1061N -0.15 0.47 0.88 2.19 3.07 -1.89 -3.08 114.58 116.06 2o5j h GLU 1061Ca 0.02 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 2o5j h GLU 1061Cb 0.22 -0.11 0.01 0.00 -0.84 0.00 0.00 28.75 28.03 2o5j h GLU 1061CO -0.21 0.31 -0.45 0.78 -1.40 0.00 0.00 179.01 178.04 2o5j h GLY 1062N 0.48 -1.29 0.09 -3.84 0.00 -1.27 -1.89 103.07 95.35 2o5j h GLY 1062Ca 0.19 0.49 0.16 0.00 0.00 0.00 0.00 47.33 48.17 2o5j h GLY 1062CO -0.05 -0.46 0.36 0.07 0.00 0.00 0.00 176.54 176.46 2o5j h ARG 1063N -1.21 0.47 0.66 4.80 0.11 -0.71 1.09 114.38 119.58 2o5j h ARG 1063Ca -0.12 -0.03 -0.03 0.00 0.10 0.00 0.00 59.98 59.90 2o5j h ARG 1063Cb 0.94 -0.11 0.01 0.00 1.11 0.00 0.00 29.97 31.92 2o5j h ARG 1063CO 0.18 0.31 -0.33 -0.97 0.10 0.00 0.00 179.97 179.26 2o5j h ASN 1064N 0.48 -0.78 -0.52 0.08 -0.73 -1.44 0.28 115.58 112.96 2o5j h ASN 1064Ca 0.46 0.03 -0.01 0.00 1.87 0.00 0.00 56.30 58.65 2o5j h ASN 1064Cb 0.73 0.21 -0.03 0.00 0.27 0.00 0.00 38.32 39.50 2o5j h ASN 1064CO -0.42 -0.55 0.29 0.00 -0.37 0.00 0.00 177.43 176.38 2o5j h ALA 1065N -0.56 1.49 0.06 1.57 0.00 -0.53 -2.55 119.26 118.74 2o5j h ALA 1065Ca -0.09 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2o5j h ALA 1065Cb 0.70 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2o5j h ALA 1065CO 0.14 0.42 -0.45 0.00 0.00 0.00 0.00 179.25 179.36 2o5j h ALA 1066N 1.57 -0.79 0.14 0.00 0.00 0.19 -0.73 119.26 119.64 2o5j h ALA 1066Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2o5j h ALA 1066Cb 0.03 0.78 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2o5j h ALA 1066CO -0.03 -1.02 -0.33 -0.92 0.00 0.00 0.00 179.25 176.95 2o5j h TYR 1067N -0.65 -0.95 -0.80 0.00 3.20 -0.57 -1.79 116.97 115.41 2o5j h TYR 1067Ca 0.03 0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.10 2o5j h TYR 1067Cb 0.69 0.40 -0.14 0.00 1.54 0.00 0.00 36.73 39.22 2o5j h TYR 1067CO -0.42 -0.39 -0.03 1.49 -1.64 0.00 0.00 178.16 177.17 2o5j h GLU 1068N -0.52 0.07 -0.23 1.82 4.81 -1.40 0.15 114.58 119.28 2o5j h GLU 1068Ca -0.01 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.27 2o5j h GLU 1068Cb 0.50 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.79 2o5j h GLU 1068CO -0.15 0.05 -0.21 0.00 -0.73 0.00 0.00 179.01 177.97 2o5j h ALA 1069N 1.77 -0.09 -0.72 2.92 0.00 -0.63 0.04 119.26 122.56 2o5j h ALA 1069Ca 0.44 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.37 2o5j h ALA 1069Cb 0.78 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2o5j h ALA 1069CO -0.74 -0.64 0.21 0.82 0.00 0.00 0.00 179.25 178.91 2o5j h ILE 1070N -0.22 1.26 -0.82 0.00 2.04 -0.14 0.55 117.51 120.17 2o5j h ILE 1070Ca 0.13 -0.91 0.09 0.00 1.00 0.00 0.00 64.86 65.18 2o5j h ILE 1070Cb 0.43 0.48 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 2o5j h ILE 1070CO -0.36 0.35 0.47 0.40 0.00 0.00 0.00 178.15 179.01 2o5j h ILE 1071N 1.07 0.91 0.00 -0.67 1.08 0.04 -0.68 117.51 119.26 2o5j h ILE 1071Ca 0.23 -0.27 -0.06 0.00 -0.39 0.00 0.00 64.86 64.37 2o5j h ILE 1071Cb 0.31 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.10 2o5j h ILE 1071CO -0.01 0.14 -0.28 0.50 -0.69 0.00 0.00 178.15 177.82 2o5j h LYS 1072N 0.79 0.00 -0.60 2.37 3.64 -0.05 -3.47 116.57 119.26 2o5j h LYS 1072Ca 0.40 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.71 2o5j h LYS 1072Cb 0.36 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2o5j h LYS 1072CO -0.24 0.28 -0.08 0.41 -2.27 0.00 0.00 179.45 177.54 2o5j n GLY 1073N 0.50 0.30 3.99 5.01 0.00 0.14 -5.04 105.19 110.09 2o5j n GLY 1073Ca 0.01 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 45.09 2o5j n GLY 1073CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 1074N -4.28 2.42 -0.38 1.61 2.56 0.14 -4.99 118.70 115.79 2o5j s GLU 1074Ca 0.01 -1.05 -0.22 0.00 0.00 0.00 0.00 54.97 53.71 2o5j s GLU 1074Cb -0.00 -2.54 0.01 0.00 2.00 0.00 0.00 34.13 33.60 2o5j s GLU 1074CO 0.01 -0.77 0.72 -0.51 -0.56 0.00 0.00 175.26 174.16 2o5j s ASP 1075N -4.49 6.47 0.04 -1.70 -0.00 -1.26 -4.46 116.67 111.26 2o5j s ASP 1075Ca 0.59 0.16 -0.30 0.00 -0.00 0.00 0.00 52.55 53.01 2o5j s ASP 1075Cb -0.09 -2.36 -0.15 0.00 -0.00 0.00 0.00 42.92 40.31 2o5j s ASP 1075CO 0.38 -0.71 0.74 1.33 -0.00 0.00 0.00 175.17 176.91 2o5j n VAL 1076N 5.77 0.44 -0.77 -1.27 0.24 -1.26 -4.93 118.33 116.55 2o5j n VAL 1076Ca 0.01 -0.11 -0.30 0.00 -2.04 0.00 0.00 64.34 61.90 2o5j n VAL 1076Cb 0.48 0.00 0.25 0.00 -1.47 0.00 0.00 33.84 33.10 2o5j n VAL 1076CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 2o5j s PRO 1077N -0.22 -1.47 -0.19 7.34 0.02 -1.26 -4.97 135.00 134.25 2o5j s PRO 1077Ca 0.67 0.25 -0.21 0.00 0.02 0.00 0.00 61.00 61.73 2o5j s PRO 1077Cb -0.95 -1.54 -0.03 0.00 0.02 0.00 0.00 34.50 32.01 2o5j s PRO 1077CO 0.46 -3.94 0.64 -1.21 -0.33 0.00 0.00 177.00 172.62 2o5j s GLU 1078N -5.05 4.23 0.07 5.54 0.41 -1.26 -4.99 118.70 117.65 2o5j s GLU 1078Ca 0.69 0.65 -0.21 0.00 -0.41 0.00 0.00 54.97 55.69 2o5j s GLU 1078Cb -0.15 -3.57 -0.12 0.00 -1.78 0.00 0.00 34.13 28.51 2o5j s GLU 1078CO 0.59 -0.22 0.48 -2.30 -0.49 0.00 0.00 175.26 173.32 2o5j n PRO 1079N 4.97 0.00 -2.86 0.39 -0.02 -1.26 -5.02 135.00 131.20 2o5j n PRO 1079Ca -0.01 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.26 2o5j n PRO 1079Cb 0.50 -0.77 0.06 0.00 -0.02 0.00 0.00 33.50 33.27 2o5j n PRO 1079CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2o5j s SER 1080N -0.36 4.99 0.43 2.55 0.01 -1.26 -5.05 113.70 115.01 2o5j s SER 1080Ca 0.48 -0.55 -0.25 0.00 1.31 0.00 0.00 55.95 56.93 2o5j s SER 1080Cb -0.68 -0.07 -0.08 0.00 0.21 0.00 0.00 66.02 65.40 2o5j s SER 1080CO 0.36 -1.38 1.37 -0.69 0.41 0.00 0.00 173.24 173.31 2o5j s VAL 1081N -2.76 2.33 -0.03 3.43 1.01 -1.26 -4.87 120.40 118.24 2o5j s VAL 1081Ca 0.62 0.29 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 2o5j s VAL 1081Cb -0.07 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 2o5j s VAL 1081CO 0.39 0.04 1.10 -2.84 0.00 0.00 0.00 175.10 173.79 2o5j s PRO 1082N -2.38 4.44 0.51 2.72 0.02 -1.26 -4.55 135.00 134.50 2o5j s PRO 1082Ca 0.60 1.56 0.35 0.00 0.02 0.00 0.00 61.00 63.52 2o5j s PRO 1082Cb -0.41 -3.49 1.49 0.00 0.02 0.00 0.00 34.50 32.12 2o5j s PRO 1082CO 0.52 -0.28 1.77 0.93 -0.33 0.00 0.00 177.00 179.61 2o5j h GLU 1083N 7.07 0.07 -0.71 5.54 4.39 -1.91 0.40 114.58 129.43 2o5j h GLU 1083Ca -0.36 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.34 2o5j h GLU 1083Cb 1.18 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 2o5j h GLU 1083CO 0.83 0.04 0.47 0.66 -1.16 0.00 0.00 179.01 179.85 2o5j h SER 1084N 0.07 0.80 -0.16 1.42 4.64 -1.92 0.87 113.55 119.27 2o5j h SER 1084Ca 0.62 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.89 2o5j h SER 1084Cb 2.31 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 64.20 2o5j h SER 1084CO -0.08 0.57 -0.04 0.15 -0.87 0.00 0.00 176.83 176.57 2o5j h PHE 1085N 0.95 0.35 -0.24 4.77 -0.00 -0.61 0.69 116.94 122.85 2o5j h PHE 1085Ca 0.26 -0.07 0.06 0.00 -0.00 0.00 0.00 57.97 58.22 2o5j h PHE 1085Cb -0.09 -0.08 -0.06 0.00 -0.00 0.00 0.00 35.95 35.72 2o5j h PHE 1085CO -0.03 0.58 -0.17 0.00 -0.00 0.00 0.00 178.31 178.70 2o5j h ARG 1086N 0.01 -0.15 -0.02 1.11 3.08 -1.02 0.46 114.38 117.84 2o5j h ARG 1086Ca 0.04 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2o5j h ARG 1086Cb 0.47 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 2o5j h ARG 1086CO 0.02 -0.10 -0.11 -0.24 -1.07 0.00 0.00 179.97 178.46 2o5j h VAL 1087N -0.16 1.10 0.54 2.04 3.04 0.84 -1.73 116.25 121.92 2o5j h VAL 1087Ca 0.13 -0.45 -0.03 0.00 -1.01 0.00 0.00 66.70 65.35 2o5j h VAL 1087Cb 0.36 1.21 0.01 0.00 -2.01 0.00 0.00 31.29 30.85 2o5j h VAL 1087CO -0.33 0.13 -0.26 0.25 -1.01 0.00 0.00 177.57 176.35 2o5j h LEU 1088N 0.03 -0.62 -0.69 3.16 6.46 0.13 0.17 115.31 123.97 2o5j h LEU 1088Ca 0.01 -0.05 0.09 0.00 -0.12 0.00 0.00 57.88 57.81 2o5j h LEU 1088Cb 0.22 0.16 -0.11 0.00 -0.73 0.00 0.00 40.66 40.20 2o5j h LEU 1088CO 0.02 -0.26 -0.48 0.58 -0.62 0.00 0.00 178.44 177.68 2o5j h VAL 1089N -1.01 0.05 -0.47 1.05 2.07 0.16 0.39 116.25 118.49 2o5j h VAL 1089Ca -0.07 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2o5j h VAL 1089Cb 0.63 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2o5j h VAL 1089CO 0.12 0.00 0.17 0.11 0.02 0.00 0.00 177.57 177.99 2o5j h LYS 1090N -0.18 0.71 -0.95 1.57 1.79 -1.36 0.43 116.57 118.58 2o5j h LYS 1090Ca 0.18 -0.14 0.15 0.00 -2.18 0.00 0.00 60.65 58.65 2o5j h LYS 1090Cb 0.54 -0.11 -0.08 0.00 -1.58 0.00 0.00 32.23 31.00 2o5j h LYS 1090CO -0.76 0.67 0.60 0.93 -1.08 0.00 0.00 179.45 179.81 2o5j h GLU 1091N 0.62 0.77 -0.11 3.15 5.08 0.69 0.54 114.58 125.31 2o5j h GLU 1091Ca 0.15 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 2o5j h GLU 1091Cb 0.23 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2o5j h GLU 1091CO -0.01 0.51 -0.64 -0.07 -1.00 0.00 0.00 179.01 177.80 2o5j h LEU 1092N 0.79 0.48 -1.51 1.33 3.38 0.76 -2.58 115.31 117.96 2o5j h LEU 1092Ca 0.49 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2o5j h LEU 1092Cb 0.70 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2o5j h LEU 1092CO -0.25 0.99 -0.25 1.56 0.09 0.00 0.00 178.44 180.58 2o5j h GLN 1093N 0.30 0.00 -0.84 1.13 4.20 0.30 -1.73 115.11 118.48 2o5j h GLN 1093Ca -0.01 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.80 2o5j h GLN 1093Cb 1.18 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.88 2o5j h GLN 1093CO 0.11 0.25 0.47 0.00 -0.67 0.00 0.00 178.83 178.99 2o5j h ALA 1094N 1.75 1.21 -2.23 3.87 0.00 0.32 -3.39 119.26 120.79 2o5j h ALA 1094Ca -0.00 0.04 -0.48 0.00 0.00 0.00 0.00 54.91 54.47 2o5j h ALA 1094Cb 0.50 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.19 2o5j h ALA 1094CO 0.03 0.07 0.28 -0.51 0.00 0.00 0.00 179.25 179.12 2o5j s LEU 1095N -10.29 3.72 0.18 0.00 1.43 -0.65 -4.94 118.68 108.13 2o5j s LEU 1095Ca -0.12 1.43 -0.08 0.00 -1.03 0.00 0.00 54.13 54.32 2o5j s LEU 1095Cb 0.20 -4.34 0.26 0.00 0.03 0.00 0.00 46.19 42.34 2o5j s LEU 1095CO 0.78 -0.50 1.07 0.00 0.23 0.00 0.00 176.35 177.93 2o5j n ALA 1096N -1.41 0.08 -1.38 4.21 0.00 -1.26 -4.65 120.51 116.10 2o5j n ALA 1096Ca 0.05 0.73 -0.46 0.00 0.00 0.00 0.00 53.44 53.76 2o5j n ALA 1096Cb 0.54 -0.40 -0.02 0.00 0.00 0.00 0.00 19.45 19.57 2o5j n ALA 1096CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2o5j n LEU 1097N -5.08 -1.57 -4.09 0.00 7.99 -1.26 -4.92 117.00 108.07 2o5j n LEU 1097Ca 0.10 1.04 -0.32 0.00 -0.01 0.00 0.00 56.01 56.81 2o5j n LEU 1097Cb 0.32 -0.95 -0.16 0.00 -0.11 0.00 0.00 43.42 42.53 2o5j n LEU 1097CO -0.09 -3.27 -0.50 -0.62 -1.51 0.00 0.00 177.39 171.40 2o5j s ASP 1098N -0.98 3.71 -0.24 -1.43 2.15 -1.26 -3.79 116.67 114.83 2o5j s ASP 1098Ca 0.62 -0.99 -0.05 0.00 0.43 0.00 0.00 52.55 52.57 2o5j s ASP 1098Cb -0.83 -1.50 -0.00 0.00 -0.30 0.00 0.00 42.92 40.28 2o5j s ASP 1098CO 0.58 -0.09 -0.00 -0.69 -0.17 0.00 0.00 175.17 174.80 2o5j s VAL 1099N 1.21 3.57 -0.03 1.11 1.01 -1.26 -5.08 120.40 120.94 2o5j s VAL 1099Ca -0.01 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.48 2o5j s VAL 1099Cb -0.16 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2o5j s VAL 1099CO -0.09 0.32 -0.20 -1.58 0.00 0.00 0.00 175.10 173.55 2o5j s GLN 1100N 1.49 1.84 0.44 2.72 2.00 -1.26 -5.05 119.66 121.84 2o5j s GLN 1100Ca 0.05 -0.71 -0.22 0.00 -2.00 0.00 0.00 55.36 52.47 2o5j s GLN 1100Cb -0.15 -1.67 -0.09 0.00 0.80 0.00 0.00 33.01 31.90 2o5j s GLN 1100CO -0.01 0.36 1.04 -0.08 -0.50 0.00 0.00 175.29 176.10 2o5j s THR 1101N -0.24 3.78 0.19 -0.34 -1.32 -1.26 -5.06 115.64 111.38 2o5j s THR 1101Ca 0.02 1.23 0.03 0.00 -1.21 0.00 0.00 61.69 61.75 2o5j s THR 1101Cb -0.10 -3.57 -0.05 0.00 -1.51 0.00 0.00 72.50 67.27 2o5j s THR 1101CO 0.01 -0.12 -0.01 -0.76 -2.21 0.00 0.00 174.62 171.53 2o5j s LEU 1102N -3.06 2.18 0.00 9.08 1.02 -1.26 -3.26 118.68 123.38 2o5j s LEU 1102Ca 0.62 -1.17 0.00 0.00 0.02 0.00 0.00 54.13 53.61 2o5j s LEU 1102Cb -0.19 -0.14 0.00 0.00 0.02 0.00 0.00 46.19 45.88 2o5j s LEU 1102CO 0.23 -0.53 0.00 0.47 0.02 0.00 0.00 176.35 176.54 2o5j n ASP 1103N -0.28 0.00 0.12 2.29 8.00 0.67 -4.73 116.55 122.61 2o5j n ASP 1103Ca -0.07 -0.96 -0.09 0.00 0.71 0.00 0.00 54.79 54.39 2o5j n ASP 1103Cb 0.63 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.68 2o5j n ASP 1103CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2o5j h GLU 1104N 0.00 -0.45 -6.57 -1.24 4.39 -1.93 -3.38 114.58 105.40 2o5j h GLU 1104Ca 0.00 0.03 -0.52 0.00 0.34 0.00 0.00 59.36 59.22 2o5j h GLU 1104Cb 0.00 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 2o5j h GLU 1104CO 0.00 -0.30 0.33 0.15 -1.16 0.00 0.00 179.01 178.03 2o5j s LYS 1105N -4.40 4.70 -0.85 2.33 1.02 -1.26 -4.88 119.74 116.40 2o5j s LYS 1105Ca -0.09 1.40 -0.15 0.00 0.02 0.00 0.00 55.97 57.16 2o5j s LYS 1105Cb 0.02 -3.35 -0.24 0.00 -0.52 0.00 0.00 37.83 33.74 2o5j s LYS 1105CO 0.30 0.29 2.14 -0.25 -0.92 0.00 0.00 175.35 176.91 2o5j n ASP 1106N 2.52 -0.26 -3.83 2.83 8.00 -1.26 -4.79 116.55 119.76 2o5j n ASP 1106Ca 0.01 -1.05 -0.11 0.00 0.71 0.00 0.00 54.79 54.34 2o5j n ASP 1106Cb 0.49 -0.99 -0.08 0.00 -0.02 0.00 0.00 41.12 40.52 2o5j n ASP 1106CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2o5j s ASN 1107N 4.16 -0.01 0.98 -2.24 0.01 -1.26 -4.91 114.94 111.67 2o5j s ASN 1107Ca 1.05 -0.28 -0.13 0.00 -0.71 0.00 0.00 52.86 52.79 2o5j s ASN 1107Cb -0.49 0.29 0.09 0.00 0.41 0.00 0.00 41.25 41.55 2o5j s ASN 1107CO 0.33 -0.53 0.58 -2.65 -1.51 0.00 0.00 177.10 173.33 2o5j n PRO 1108N 0.84 -0.64 -3.70 -0.60 -0.02 -1.26 0.24 135.00 129.85 2o5j n PRO 1108Ca -0.20 -0.14 -0.14 0.00 -2.02 0.00 0.00 63.50 61.00 2o5j n PRO 1108Cb 0.58 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.99 2o5j n PRO 1108CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2o5j s VAL 1109N -2.44 0.03 -0.16 -1.45 1.01 -1.20 -4.02 120.40 112.17 2o5j s VAL 1109Ca 0.60 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.38 2o5j s VAL 1109Cb -0.21 -0.70 0.02 0.00 0.00 0.00 0.00 36.38 35.49 2o5j s VAL 1109CO 0.65 -0.12 -0.20 -1.81 0.00 0.00 0.00 175.10 173.62 2o5j s ASP 1110N -0.73 3.06 -0.02 3.32 -0.00 -1.26 -4.54 116.67 116.49 2o5j s ASP 1110Ca -0.08 -0.61 -0.09 0.00 -0.00 0.00 0.00 52.55 51.77 2o5j s ASP 1110Cb -0.03 -1.42 -0.05 0.00 -0.00 0.00 0.00 42.92 41.41 2o5j s ASP 1110CO 0.04 0.03 0.55 0.16 -0.00 0.00 0.00 175.17 175.95 2o5j h ILE 1111N 5.90 0.00 -1.82 0.77 -0.00 -2.02 -3.40 117.51 116.95 2o5j h ILE 1111Ca -0.39 -0.31 -0.48 0.00 -0.00 0.00 0.00 64.86 63.68 2o5j h ILE 1111Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 36.82 37.96 2o5j h ILE 1111CO 0.59 0.00 1.43 -0.36 -0.00 0.00 0.00 178.15 179.81 2o5j s PHE 1112N -2.68 1.46 0.18 0.16 2.99 -1.26 -4.84 117.98 113.99 2o5j s PHE 1112Ca -0.04 1.06 -0.06 0.00 0.00 0.00 0.00 56.93 57.89 2o5j s PHE 1112Cb 0.00 -3.91 0.29 0.00 0.00 0.00 0.00 43.02 39.41 2o5j s PHE 1112CO 0.13 -2.37 1.05 0.39 -0.00 0.00 0.00 175.22 174.43 2o5j n GLU 1113N 9.12 -0.07 -0.08 0.44 -0.58 -1.26 -4.16 120.64 124.05 2o5j n GLU 1113Ca 0.26 1.05 0.00 0.00 -0.42 0.00 0.00 57.16 58.06 2o5j n GLU 1113Cb 0.53 -1.57 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 2o5j n GLU 1113CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2o5j n GLY 1114N -1.41 0.53 0.65 0.62 0.00 -1.26 -4.95 105.19 99.37 2o5j n GLY 1114Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 2o5j n GLY 1114CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o5j n LEU 1115N 0.00 2.03 0.07 0.99 4.32 -1.26 -4.06 117.00 119.09 2o5j n LEU 1115Ca 0.00 -0.69 -0.20 0.00 -0.02 0.00 0.00 56.01 55.09 2o5j n LEU 1115Cb 0.26 -0.01 -0.15 0.00 -1.62 0.00 0.00 43.42 41.91 2o5j n LEU 1115CO 0.00 0.35 -0.43 0.00 -1.22 0.00 0.00 177.39 176.08 2o5j h ALA 1116N 4.46 0.18 -2.51 -1.18 0.00 -1.93 -3.46 119.26 114.83 2o5j h ALA 1116Ca 0.00 -1.11 -0.58 0.00 0.00 0.00 0.00 54.91 53.22 2o5j h ALA 1116Cb 0.67 0.36 0.15 0.00 0.00 0.00 0.00 17.79 18.98 2o5j h ALA 1116CO 0.00 1.05 -0.09 -1.13 0.00 0.00 0.00 179.25 179.08 2o5j n SER 1117N -3.54 0.16 -4.85 0.00 3.41 -1.26 -4.90 113.62 102.65 2o5j n SER 1117Ca -0.21 0.86 -0.37 0.00 -0.26 0.00 0.00 58.87 58.89 2o5j n SER 1117Cb 1.07 -1.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.68 2o5j n SER 1117CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2o5j s LYS 1118N -2.18 3.75 0.00 4.33 -2.85 -1.26 -5.12 119.74 116.40 2o5j s LYS 1118Ca 0.68 0.16 0.00 0.00 -1.00 0.00 0.00 55.97 55.82 2o5j s LYS 1118Cb -0.49 -3.23 0.00 0.00 -2.06 0.00 0.00 37.83 32.05 2o5j s LYS 1118CO 0.53 0.69 0.00 0.54 0.10 0.00 0.00 175.35 177.21