#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a8m n GLY 42 N 0.00 -1.68 3.13 -0.02 0.00 -1.26 -0.87 105.19 104.49 2a8m n GLY 42 Ca 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 2a8m n GLY 42 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2a8m s PHE 43 N -2.79 0.74 -0.13 1.61 5.36 -0.20 -0.11 117.98 122.46 2a8m s PHE 43 Ca 0.00 -1.09 -0.14 0.00 -0.96 0.00 0.00 56.93 54.74 2a8m s PHE 43 Cb 0.00 -0.46 0.04 0.00 -0.34 0.00 0.00 43.02 42.26 2a8m s PHE 43 CO 0.00 -0.37 0.40 0.54 -1.46 0.00 0.00 175.22 174.33 2a8m s VAL 44 N -3.88 0.01 -0.02 3.12 0.11 -0.93 -2.48 120.40 116.33 2a8m s VAL 44 Ca 0.14 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 2a8m s VAL 44 Cb 0.07 -0.58 0.02 0.00 -1.53 0.00 0.00 36.38 34.37 2a8m s VAL 44 CO -0.05 -0.03 0.01 -0.22 -3.33 0.00 0.00 175.10 171.48 2a8m s LEU 45 N -0.01 1.29 0.33 2.54 2.96 -0.50 -1.91 118.68 123.37 2a8m s LEU 45 Ca -0.02 -0.00 0.05 0.00 -0.22 0.00 0.00 54.13 53.94 2a8m s LEU 45 Cb -0.03 -0.13 -0.03 0.00 0.50 0.00 0.00 46.19 46.49 2a8m s LEU 45 CO 0.01 -0.09 0.21 0.68 -1.32 0.00 0.00 176.35 175.84 2a8m s VAL 46 N 0.84 0.19 0.09 1.68 -7.23 -0.53 -0.16 120.40 115.28 2a8m s VAL 46 Ca -0.08 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 57.89 2a8m s VAL 46 Cb -0.11 -2.47 0.05 0.00 0.56 0.00 0.00 36.38 34.41 2a8m s VAL 46 CO -0.02 0.00 0.49 -1.38 -0.31 0.00 0.00 175.10 173.88 2a8m s HIS 47 N -3.51 -0.36 -0.26 2.82 -3.43 -0.71 -1.69 115.29 108.15 2a8m s HIS 47 Ca 0.36 0.23 0.09 0.00 -0.80 0.00 0.00 55.06 54.94 2a8m s HIS 47 Cb 0.03 0.34 0.45 0.00 -1.43 0.00 0.00 32.58 31.98 2a8m s HIS 47 CO 0.21 -0.69 1.31 0.00 -2.00 0.00 0.00 174.74 173.57 2a8m n ALA 48 N 0.06 4.17 0.00 -1.38 0.00 -0.67 -2.63 120.51 120.06 2a8m n ALA 48 Ca -0.17 -3.35 0.00 0.00 0.00 0.00 0.00 53.44 49.92 2a8m n ALA 48 Cb 0.62 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.57 2a8m n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a8m n GLY 49 N -1.05 2.38 3.32 0.00 0.00 -0.66 -4.78 105.19 104.41 2a8m n GLY 49 Ca 0.29 -1.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 2a8m n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8m s ALA 50 N -2.10 2.43 0.00 4.61 0.00 -1.26 -3.73 121.76 121.71 2a8m s ALA 50 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2a8m s ALA 50 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 22.12 2a8m s ALA 50 CO 0.00 0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.49 2a8m n GLY 51 N 3.32 -0.66 3.78 0.00 0.00 -0.40 -4.36 105.19 106.87 2a8m n GLY 51 Ca -0.18 0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2a8m n GLY 51 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2a8m s TYR 52 N -1.55 2.98 -0.22 1.61 4.12 -1.26 -0.88 117.35 122.15 2a8m s TYR 52 Ca 0.00 1.57 -0.19 0.00 0.02 0.00 0.00 57.07 58.46 2a8m s TYR 52 Cb 0.00 -3.29 -0.03 0.00 -1.52 0.00 0.00 41.96 37.13 2a8m s TYR 52 CO 0.00 -1.23 0.57 -1.58 0.02 0.00 0.00 175.55 173.33 2a8m s HIS 53 N -1.62 3.33 -0.54 2.71 5.65 -1.26 -4.76 115.29 118.81 2a8m s HIS 53 Ca 0.63 0.79 -0.03 0.00 0.25 0.00 0.00 55.06 56.70 2a8m s HIS 53 Cb -0.26 -2.75 0.14 0.00 -1.18 0.00 0.00 32.58 28.54 2a8m s HIS 53 CO 0.31 -0.20 0.35 0.45 -0.65 0.00 0.00 174.74 175.00 2a8m s SER 54 N 1.31 5.27 0.50 9.88 0.15 -1.26 -5.08 113.70 124.47 2a8m s SER 54 Ca 0.25 -2.51 -0.22 0.00 0.70 0.00 0.00 55.95 54.17 2a8m s SER 54 Cb -0.16 -1.85 -0.08 0.00 -1.71 0.00 0.00 66.02 62.23 2a8m s SER 54 CO 0.09 -0.45 1.15 -0.62 1.20 0.00 0.00 173.24 174.61 2a8m n GLU 55 N 3.96 1.46 0.00 5.44 1.02 -1.26 0.65 120.64 131.91 2a8m n GLU 55 Ca 0.03 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.71 2a8m n GLU 55 Cb 0.39 -2.29 0.00 0.00 -0.02 0.00 0.00 31.44 29.52 2a8m n GLU 55 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2a8m n SER 56 N -0.25 0.00 0.00 1.62 3.41 -1.26 -4.33 113.62 112.81 2a8m n SER 56 Ca 0.10 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.85 2a8m n SER 56 Cb 0.43 0.00 0.76 0.00 -0.26 0.00 0.00 64.21 65.14 2a8m n SER 56 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2a8m n LYS 57 N 0.00 0.55 0.01 4.33 4.81 -0.68 -3.10 118.16 124.09 2a8m n LYS 57 Ca 0.00 0.01 -0.07 0.00 -0.87 0.00 0.00 58.31 57.38 2a8m n LYS 57 Cb 0.00 -1.50 0.10 0.00 0.02 0.00 0.00 35.03 33.65 2a8m n LYS 57 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2a8m h ALA 58 N 3.48 0.82 0.00 3.14 0.00 0.02 -2.88 119.26 123.85 2a8m h ALA 58 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2a8m h ALA 58 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2a8m h ALA 58 CO 0.00 0.66 0.00 -0.22 0.00 0.00 0.00 179.25 179.69 2a8m h LYS 59 N 0.41 0.00 -0.00 0.00 1.63 -1.83 -2.81 116.57 113.97 2a8m h LYS 59 Ca 0.02 0.00 -0.19 0.00 -0.85 0.00 0.00 60.65 59.63 2a8m h LYS 59 Cb 0.97 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.59 2a8m h LYS 59 CO 0.09 0.00 -0.85 0.93 -3.45 0.00 0.00 179.45 176.17 2a8m h GLU 60 N 0.00 0.17 0.16 1.90 4.39 -1.70 -2.94 114.58 116.57 2a8m h GLU 60 Ca 0.00 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 2a8m h GLU 60 Cb 0.50 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2a8m h GLU 60 CO 0.00 0.92 -0.08 1.88 -1.16 0.00 0.00 179.01 180.57 2a8m h TYR 61 N 0.10 -0.20 -0.88 4.33 0.05 -1.56 -2.72 116.97 116.08 2a8m h TYR 61 Ca -0.04 -0.00 0.20 0.00 0.05 0.00 0.00 58.73 58.94 2a8m h TYR 61 Cb 1.47 0.07 -0.06 0.00 1.01 0.00 0.00 36.73 39.21 2a8m h TYR 61 CO 0.02 0.21 0.59 0.87 -1.05 0.00 0.00 178.16 178.81 2a8m h LYS 62 N -0.90 0.37 -0.26 4.88 1.57 -1.64 0.52 116.57 121.12 2a8m h LYS 62 Ca -0.02 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2a8m h LYS 62 Cb 0.51 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 2a8m h LYS 62 CO 0.04 0.25 -0.05 1.25 -0.57 0.00 0.00 179.45 180.36 2a8m h HIS 63 N 0.39 0.56 0.00 -1.35 2.76 -1.54 -2.57 115.15 113.40 2a8m h HIS 63 Ca 0.45 -0.12 -0.15 0.00 -2.20 0.00 0.00 60.37 58.36 2a8m h HIS 63 Cb 1.16 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.96 2a8m h HIS 63 CO -0.00 0.71 -0.70 -0.24 -1.30 0.00 0.00 177.93 176.39 2a8m h VAL 64 N 0.25 1.48 -0.63 5.26 3.04 -0.83 -2.86 116.25 121.96 2a8m h VAL 64 Ca 0.07 -2.43 -0.02 0.00 -1.01 0.00 0.00 66.70 63.30 2a8m h VAL 64 Cb 0.52 2.32 -0.03 0.00 -2.01 0.00 0.00 31.29 32.09 2a8m h VAL 64 CO 0.02 0.69 0.30 0.00 -1.01 0.00 0.00 177.57 177.57 2a8m h LYS 66 N 0.87 -0.70 -0.76 0.00 1.57 -1.34 -0.56 116.57 115.65 2a8m h LYS 66 Ca 0.22 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.13 2a8m h LYS 66 Cb 0.12 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 2a8m h LYS 66 CO -0.03 -0.44 0.50 0.00 -0.57 0.00 0.00 179.45 178.90 2a8m h ARG 67 N -0.78 0.68 0.07 3.15 3.08 -1.42 -1.15 114.38 118.01 2a8m h ARG 67 Ca -0.07 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2a8m h ARG 67 Cb 0.58 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2a8m h ARG 67 CO 0.12 0.45 -0.03 0.00 -1.07 0.00 0.00 179.97 179.44 2a8m h ALA 68 N 1.61 -0.09 -0.06 0.04 0.00 -0.64 -1.72 119.26 118.40 2a8m h ALA 68 Ca 0.34 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2a8m h ALA 68 Cb 0.41 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2a8m h ALA 68 CO -0.12 -0.45 -0.15 0.00 0.00 0.00 0.00 179.25 178.52 2a8m h GLN 70 N -0.23 -0.29 -0.86 0.00 4.20 -1.16 0.12 115.11 116.90 2a8m h GLN 70 Ca 0.07 0.02 0.22 0.00 0.06 0.00 0.00 58.65 59.01 2a8m h GLN 70 Cb 0.32 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.12 2a8m h GLN 70 CO -0.19 -0.19 0.59 0.87 -0.67 0.00 0.00 178.83 179.23 2a8m h LYS 71 N -0.30 0.22 0.29 1.46 6.56 -1.12 0.17 116.57 123.84 2a8m h LYS 71 Ca 0.13 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.69 2a8m h LYS 71 Cb 0.51 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.12 2a8m h LYS 71 CO -0.41 0.15 -0.14 0.00 -2.06 0.00 0.00 179.45 176.99 2a8m h ALA 72 N 1.61 -0.39 -0.55 3.86 0.00 -0.47 -1.73 119.26 121.60 2a8m h ALA 72 Ca 0.43 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2a8m h ALA 72 Cb 1.32 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.22 2a8m h ALA 72 CO -0.10 -0.47 0.28 0.82 0.00 0.00 0.00 179.25 179.78 2a8m h ILE 73 N -0.88 0.96 0.13 0.00 1.08 -0.38 0.39 117.51 118.80 2a8m h ILE 73 Ca -0.04 -0.19 0.01 0.00 -0.39 0.00 0.00 64.86 64.26 2a8m h ILE 73 Cb 0.51 0.37 -0.05 0.00 -3.07 0.00 0.00 36.82 34.58 2a8m h ILE 73 CO 0.06 0.10 -0.51 -0.33 -0.69 0.00 0.00 178.15 176.78 2a8m h GLU 74 N 0.54 -0.72 -0.01 2.37 5.08 -0.73 0.47 114.58 121.59 2a8m h GLU 74 Ca 0.24 0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.60 2a8m h GLU 74 Cb 0.15 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2a8m h GLU 74 CO -0.16 -0.48 -0.23 0.87 -1.00 0.00 0.00 179.01 178.01 2a8m h LYS 75 N -0.74 0.01 0.48 2.33 1.79 -1.07 -1.97 116.57 117.40 2a8m h LYS 75 Ca -0.00 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 2a8m h LYS 75 Cb 0.75 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 2a8m h LYS 75 CO -0.28 0.25 -0.23 1.25 -1.08 0.00 0.00 179.45 179.36 2a8m h LEU 76 N 0.01 -0.54 -1.39 2.94 5.85 0.10 -2.52 115.31 119.77 2a8m h LEU 76 Ca -0.00 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.88 2a8m h LEU 76 Cb 0.42 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 2a8m h LEU 76 CO 0.03 -0.31 0.55 1.56 -0.34 0.00 0.00 178.44 179.93 2a8m h GLN 77 N -0.79 0.59 0.00 1.25 4.20 -0.10 0.58 115.11 120.83 2a8m h GLN 77 Ca -0.07 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.61 2a8m h GLN 77 Cb 0.49 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.14 2a8m h GLN 77 CO 0.11 0.39 0.03 0.00 -0.67 0.00 0.00 178.83 178.68 2a8m n ALA 78 N -2.46 1.12 -2.59 3.87 0.00 -0.74 -4.72 120.51 114.98 2a8m n ALA 78 Ca 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 2a8m n ALA 78 Cb 0.48 -0.84 0.01 0.00 0.00 0.00 0.00 19.45 19.10 2a8m n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a8m n GLY 79 N -1.09 0.79 3.95 0.00 0.00 0.20 -5.07 105.19 103.97 2a8m n GLY 79 Ca 0.00 -0.58 -0.21 0.00 0.00 0.00 0.00 46.02 45.24 2a8m n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8m s ALA 80 N -3.03 3.96 0.76 4.61 0.00 -0.96 -5.06 121.76 122.04 2a8m s ALA 80 Ca 0.06 -1.32 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 2a8m s ALA 80 Cb -0.03 -1.65 0.05 0.00 0.00 0.00 0.00 23.12 21.50 2a8m s ALA 80 CO 0.07 0.17 1.20 1.28 0.00 0.00 0.00 175.76 178.49 2a8m n LEU 81 N -1.43 4.77 0.30 0.00 4.77 -1.26 -4.75 117.00 119.40 2a8m n LEU 81 Ca -0.07 0.66 0.17 0.00 -0.03 0.00 0.00 56.01 56.75 2a8m n LEU 81 Cb 0.57 -1.51 0.97 0.00 -2.33 0.00 0.00 43.42 41.12 2a8m n LEU 81 CO 0.44 -1.54 1.11 0.00 -1.33 0.00 0.00 177.39 176.07 2a8m h ALA 82 N -0.44 1.27 -0.54 -1.18 0.00 -1.94 -1.52 119.26 114.90 2a8m h ALA 82 Ca -0.48 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.33 2a8m h ALA 82 Cb 1.31 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2a8m h ALA 82 CO 0.48 0.03 0.02 1.15 0.00 0.00 0.00 179.25 180.93 2a8m h THR 83 N 0.00 1.26 0.00 0.00 2.02 -1.92 -2.72 112.91 111.55 2a8m h THR 83 Ca -0.00 -1.08 -0.14 0.00 0.77 0.00 0.00 66.41 65.96 2a8m h THR 83 Cb 0.10 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 2a8m h THR 83 CO 0.00 0.38 -0.65 0.44 0.37 0.00 0.00 175.52 176.06 2a8m h ASP 84 N 0.81 0.00 -0.20 4.18 3.32 -1.63 -2.48 116.42 120.43 2a8m h ASP 84 Ca 0.15 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 2a8m h ASP 84 Cb 0.51 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 2a8m h ASP 84 CO 0.02 0.65 0.04 0.00 -1.72 0.00 0.00 179.24 178.24 2a8m h ALA 85 N 1.35 0.26 -0.47 3.45 0.00 -1.29 0.20 119.26 122.77 2a8m h ALA 85 Ca -0.01 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2a8m h ALA 85 Cb 1.24 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2a8m h ALA 85 CO 0.09 -0.08 -0.18 -0.39 0.00 0.00 0.00 179.25 178.68 2a8m h VAL 86 N 0.13 1.27 -0.06 0.00 -1.51 -1.50 -2.00 116.25 112.58 2a8m h VAL 86 Ca 0.06 -1.34 -0.00 0.00 -1.23 0.00 0.00 66.70 64.19 2a8m h VAL 86 Cb 0.29 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 30.59 2a8m h VAL 86 CO 0.00 0.46 0.02 0.74 -1.23 0.00 0.00 177.57 177.57 2a8m h THR 87 N 0.79 1.14 -0.89 7.19 2.02 -1.38 0.15 112.91 121.94 2a8m h THR 87 Ca 0.11 -0.43 0.21 0.00 0.77 0.00 0.00 66.41 67.07 2a8m h THR 87 Cb 0.75 1.31 -0.12 0.00 -1.74 0.00 0.00 68.15 68.36 2a8m h THR 87 CO 0.06 0.12 0.41 0.00 0.37 0.00 0.00 175.52 176.48 2a8m h ALA 88 N 0.86 1.41 0.39 6.16 0.00 -0.47 0.20 119.26 127.81 2a8m h ALA 88 Ca 0.02 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2a8m h ALA 88 Cb 0.17 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2a8m h ALA 88 CO -0.00 -0.29 -0.19 0.00 0.00 0.00 0.00 179.25 178.78 2a8m h ALA 89 N 1.68 -0.52 -0.97 0.00 0.00 -0.80 -3.15 119.26 115.49 2a8m h ALA 89 Ca 0.54 -0.18 0.25 0.00 0.00 0.00 0.00 54.91 55.52 2a8m h ALA 89 Cb 0.98 0.20 -0.13 0.00 0.00 0.00 0.00 17.79 18.84 2a8m h ALA 89 CO -0.49 -0.55 0.54 -0.07 0.00 0.00 0.00 179.25 178.67 2a8m h LEU 90 N -1.00 0.56 0.07 0.00 -0.00 0.21 -0.43 115.31 114.73 2a8m h LEU 90 Ca -0.05 0.15 -0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2a8m h LEU 90 Cb 0.53 0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 41.26 2a8m h LEU 90 CO 0.09 0.05 -0.04 0.58 -0.00 0.00 0.00 178.44 179.12 2a8m h VAL 91 N 0.51 0.92 -0.90 1.22 2.07 -1.06 0.71 116.25 119.73 2a8m h VAL 91 Ca 0.63 0.00 0.12 0.00 0.82 0.00 0.00 66.70 68.27 2a8m h VAL 91 Cb 1.22 0.92 -0.08 0.00 -1.52 0.00 0.00 31.29 31.83 2a8m h VAL 91 CO -0.50 0.00 0.52 -0.08 0.02 0.00 0.00 177.57 177.53 2a8m h GLU 92 N -0.10 0.78 0.09 1.57 4.57 -1.06 0.42 114.58 120.85 2a8m h GLU 92 Ca -0.01 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2a8m h GLU 92 Cb 0.08 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2a8m h GLU 92 CO 0.01 0.52 -0.05 -0.07 -1.18 0.00 0.00 179.01 178.24 2a8m h LEU 93 N 0.81 -0.11 -1.94 1.64 -0.00 -0.57 -3.01 115.31 112.13 2a8m h LEU 93 Ca 0.46 -0.33 0.10 0.00 -0.00 0.00 0.00 57.88 58.11 2a8m h LEU 93 Cb 0.51 0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.19 2a8m h LEU 93 CO -0.29 0.28 0.45 -0.33 -0.00 0.00 0.00 178.44 178.55 2a8m h GLU 94 N -0.52 0.00 0.00 1.13 5.08 0.15 -1.33 114.58 119.09 2a8m h GLU 94 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2a8m h GLU 94 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2a8m h GLU 94 CO 0.02 0.00 -0.68 -0.44 -1.00 0.00 0.00 179.01 176.91 2a8m h ASP 95 N 0.00 0.00 -2.79 1.42 3.32 -0.82 0.54 116.42 118.09 2a8m h ASP 95 Ca 0.16 -0.07 -0.56 0.00 0.02 0.00 0.00 57.03 56.58 2a8m h ASP 95 Cb 1.05 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.57 2a8m h ASP 95 CO -0.00 0.03 0.97 -0.55 -1.72 0.00 0.00 179.24 177.98 2a8m s SER 96 N -5.10 6.83 0.00 6.45 0.15 -0.50 -4.78 113.70 116.75 2a8m s SER 96 Ca 0.03 1.93 0.02 0.00 0.70 0.00 0.00 55.95 58.64 2a8m s SER 96 Cb 0.10 -2.54 0.14 0.00 -1.71 0.00 0.00 66.02 62.01 2a8m s SER 96 CO 0.74 -0.82 0.44 -0.81 1.20 0.00 0.00 173.24 173.99 2a8m n PRO 97 N 6.75 0.23 -0.00 5.44 -0.04 -1.26 -1.83 135.00 144.30 2a8m n PRO 97 Ca 0.15 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.70 2a8m n PRO 97 Cb 0.44 -1.15 -0.11 0.00 -0.04 0.00 0.00 33.50 32.63 2a8m n PRO 97 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2a8m n PHE 98 N -0.65 0.00 -3.78 0.54 3.01 -1.26 -4.66 117.46 110.65 2a8m n PHE 98 Ca 0.02 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.11 2a8m n PHE 98 Cb 0.01 -0.12 -0.07 0.00 -0.01 0.00 0.00 39.48 39.30 2a8m n PHE 98 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2a8m s THR 99 N -2.88 5.43 -1.02 4.37 -4.23 -0.76 -5.00 115.64 111.55 2a8m s THR 99 Ca 0.03 0.28 -0.20 0.00 -1.18 0.00 0.00 61.69 60.62 2a8m s THR 99 Cb 0.13 -3.46 -0.09 0.00 1.34 0.00 0.00 72.50 70.42 2a8m s THR 99 CO 0.76 0.55 1.98 -3.20 -0.54 0.00 0.00 174.62 174.16 2a8m n ASN 100 N 2.52 3.07 -3.58 3.99 4.05 -1.26 -4.09 115.26 119.96 2a8m n ASN 100 Ca -0.18 -2.73 -0.08 0.00 0.45 0.00 0.00 54.58 52.04 2a8m n ASN 100 Cb 0.54 -1.37 -0.04 0.00 1.23 0.00 0.00 39.78 40.13 2a8m n ASN 100 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2a8m s ALA 101 N 5.56 -1.96 0.00 5.20 0.00 -1.26 -0.82 121.76 128.48 2a8m s ALA 101 Ca 0.57 1.53 0.00 0.00 0.00 0.00 0.00 51.96 54.06 2a8m s ALA 101 Cb 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.71 2a8m s ALA 101 CO 0.08 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.83 2a8m n GLY 102 N 0.39 2.75 3.70 0.00 0.00 -1.25 -4.12 105.19 106.65 2a8m n GLY 102 Ca -0.07 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2a8m n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2a8m s MET 103 N 0.00 4.39 0.00 1.61 -1.94 0.18 -3.28 119.30 120.27 2a8m s MET 103 Ca 0.00 1.75 0.00 0.00 -1.71 0.00 0.00 55.69 55.73 2a8m s MET 103 Cb 0.00 -3.45 0.00 0.00 2.01 0.00 0.00 34.83 33.39 2a8m s MET 103 CO 0.00 -0.35 0.00 0.41 -0.01 0.00 0.00 175.02 175.07 2a8m n GLY 104 N 3.31 0.85 3.81 -0.03 0.00 -1.26 -4.00 105.19 107.86 2a8m n GLY 104 Ca 0.10 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2a8m n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a8m s SER 105 N -2.09 6.46 0.47 1.61 0.01 -1.20 -4.51 113.70 114.45 2a8m s SER 105 Ca 0.00 1.83 -0.22 0.00 1.31 0.00 0.00 55.95 58.87 2a8m s SER 105 Cb 0.00 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.59 2a8m s SER 105 CO 0.00 -0.70 0.93 0.59 0.41 0.00 0.00 173.24 174.48 2a8m n ASN 106 N -1.03 0.84 -4.78 2.44 3.02 -1.26 -4.92 115.26 109.56 2a8m n ASN 106 Ca 0.08 0.95 -0.39 0.00 -0.03 0.00 0.00 54.58 55.20 2a8m n ASN 106 Cb 0.53 -1.33 -0.06 0.00 -0.61 0.00 0.00 39.78 38.31 2a8m n ASN 106 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2a8m s LEU 107 N -0.61 4.56 1.06 3.41 1.02 -1.26 -4.63 118.68 122.23 2a8m s LEU 107 Ca 0.66 1.50 -0.17 0.00 0.02 0.00 0.00 54.13 56.14 2a8m s LEU 107 Cb -0.52 -3.16 0.23 0.00 0.02 0.00 0.00 46.19 42.76 2a8m s LEU 107 CO 0.55 0.21 1.19 0.54 0.02 0.00 0.00 176.35 178.85 2a8m s ASN 108 N -1.00 2.21 0.34 2.29 2.20 0.27 -0.01 114.94 121.25 2a8m s ASN 108 Ca 0.34 0.57 0.10 0.00 -0.94 0.00 0.00 52.86 52.93 2a8m s ASN 108 Cb -0.22 -0.81 0.55 0.00 -2.00 0.00 0.00 41.25 38.77 2a8m s ASN 108 CO 0.23 -3.32 1.17 0.25 -2.94 0.00 0.00 177.10 172.49 2a8m h LEU 109 N -2.04 0.00 -3.07 3.54 5.85 0.31 0.18 115.31 120.08 2a8m h LEU 109 Ca -0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2a8m h LEU 109 Cb 1.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.31 2a8m h LEU 109 CO 0.41 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.69 2a8m n LEU 110 N -2.01 3.36 0.00 2.25 4.32 -1.26 -4.96 117.00 118.70 2a8m n LEU 110 Ca -0.01 -2.51 0.00 0.00 -0.02 0.00 0.00 56.01 53.48 2a8m n LEU 110 Cb 0.45 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 2a8m n LEU 110 CO 0.04 0.70 0.00 0.61 -1.22 0.00 0.00 177.39 177.52 2a8m n GLY 111 N -0.03 0.53 3.84 -0.72 0.00 0.62 -5.02 105.19 104.41 2a8m n GLY 111 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 2a8m n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a8m s GLU 112 N -0.25 2.68 -0.24 1.61 2.02 -1.26 -4.74 118.70 118.52 2a8m s GLU 112 Ca 0.00 -1.33 -0.09 0.00 0.02 0.00 0.00 54.97 53.57 2a8m s GLU 112 Cb 0.00 -2.44 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 2a8m s GLU 112 CO 0.00 0.09 0.11 0.42 0.02 0.00 0.00 175.26 175.89 2a8m s ILE 113 N -2.32 4.77 -0.13 -1.63 1.01 -1.26 0.97 121.20 122.61 2a8m s ILE 113 Ca 0.41 -0.02 -0.00 0.00 0.00 0.00 0.00 60.65 61.03 2a8m s ILE 113 Cb -0.05 -3.22 0.03 0.00 0.01 0.00 0.00 42.46 39.22 2a8m s ILE 113 CO 0.26 0.35 -0.07 -1.61 0.00 0.00 0.00 174.94 173.87 2a8m s GLU 114 N 1.29 1.50 0.09 2.79 2.02 -1.26 -4.32 118.70 120.81 2a8m s GLU 114 Ca 0.06 -0.32 0.05 0.00 0.02 0.00 0.00 54.97 54.78 2a8m s GLU 114 Cb -0.15 -1.69 -0.04 0.00 0.10 0.00 0.00 34.13 32.35 2a8m s GLU 114 CO 0.05 -0.31 -0.02 0.00 0.02 0.00 0.00 175.26 174.99 2a8m s ASP 116 N -2.24 3.53 -0.23 0.00 1.01 -0.24 -1.67 116.67 116.83 2a8m s ASP 116 Ca 0.24 -0.79 -0.29 0.00 0.71 0.00 0.00 52.55 52.42 2a8m s ASP 116 Cb -0.12 -0.32 0.16 0.00 1.01 0.00 0.00 42.92 43.66 2a8m s ASP 116 CO 0.17 0.13 1.20 0.00 0.21 0.00 0.00 175.17 176.88 2a8m s ALA 117 N -1.52 -2.04 0.24 5.23 0.00 -0.55 -0.60 121.76 122.50 2a8m s ALA 117 Ca 0.20 1.75 -0.13 0.00 0.00 0.00 0.00 51.96 53.78 2a8m s ALA 117 Cb -0.09 -1.20 -0.00 0.00 0.00 0.00 0.00 23.12 21.83 2a8m s ALA 117 CO 0.10 -0.26 0.47 -1.54 0.00 0.00 0.00 175.76 174.53 2a8m s SER 118 N -0.93 -0.10 -0.19 0.00 1.04 0.00 -1.18 113.70 112.34 2a8m s SER 118 Ca 0.04 -0.87 -0.19 0.00 0.48 0.00 0.00 55.95 55.41 2a8m s SER 118 Cb -0.01 0.58 0.05 0.00 0.10 0.00 0.00 66.02 66.74 2a8m s SER 118 CO -0.04 -1.12 0.55 -0.51 0.98 0.00 0.00 173.24 173.09 2a8m s ILE 119 N -4.00 0.00 -0.05 -1.02 2.07 -0.15 -1.23 121.20 116.83 2a8m s ILE 119 Ca 0.20 -0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.44 2a8m s ILE 119 Cb -0.01 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.84 2a8m s ILE 119 CO 0.07 -0.01 -0.05 -0.32 -1.91 0.00 0.00 174.94 172.72 2a8m s MET 120 N 0.20 0.92 -0.26 3.50 1.75 0.14 -1.56 119.30 123.98 2a8m s MET 120 Ca -0.01 -0.13 -0.18 0.00 -1.25 0.00 0.00 55.69 54.12 2a8m s MET 120 Cb -0.04 -0.91 -0.03 0.00 2.84 0.00 0.00 34.83 36.69 2a8m s MET 120 CO 0.01 -0.08 0.51 0.34 -0.65 0.00 0.00 175.02 175.15 2a8m s ASP 121 N 0.94 6.43 0.45 1.11 2.15 -0.91 -1.41 116.67 125.43 2a8m s ASP 121 Ca -0.11 0.52 0.30 0.00 0.43 0.00 0.00 52.55 53.70 2a8m s ASP 121 Cb -0.14 -2.28 1.23 0.00 -0.30 0.00 0.00 42.92 41.43 2a8m s ASP 121 CO 0.00 -0.28 1.89 1.23 -0.17 0.00 0.00 175.17 177.84 2a8m h GLY 122 N 8.76 0.00 0.00 2.66 0.00 -0.20 0.54 103.07 114.83 2a8m h GLY 122 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2a8m h GLY 122 CO 0.71 0.00 -0.19 1.70 0.00 0.00 0.00 176.54 178.77 2a8m h LYS 123 N 0.00 0.00 0.00 4.80 3.64 -1.88 0.94 116.57 124.07 2a8m h LYS 123 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2a8m h LYS 123 Cb 0.46 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2a8m h LYS 123 CO 0.00 0.00 -0.44 0.66 -2.27 0.00 0.00 179.45 177.40 2a8m h SER 124 N -0.98 0.00 -0.91 4.20 4.64 -1.95 -3.47 113.55 115.09 2a8m h SER 124 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2a8m h SER 124 Cb 0.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 2a8m h SER 124 CO 0.00 0.44 -0.20 0.18 -0.87 0.00 0.00 176.83 176.39 2a8m n LEU 125 N -3.30 -1.10 -4.93 5.97 4.77 0.19 -5.03 117.00 113.57 2a8m n LEU 125 Ca 0.01 0.08 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 2a8m n LEU 125 Cb 0.65 -1.49 0.07 0.00 -2.33 0.00 0.00 43.42 40.33 2a8m n LEU 125 CO 0.39 -0.23 0.62 0.20 -1.33 0.00 0.00 177.39 177.05 2a8m s ASN 126 N -2.73 4.84 -0.04 -1.43 -0.87 -1.20 -4.86 114.94 108.65 2a8m s ASN 126 Ca 0.00 0.49 -0.12 0.00 -1.57 0.00 0.00 52.86 51.67 2a8m s ASN 126 Cb 0.00 -1.15 0.02 0.00 -0.02 0.00 0.00 41.25 40.10 2a8m s ASN 126 CO 0.00 -1.59 0.26 0.12 -2.57 0.00 0.00 177.10 173.32 2a8m s PHE 127 N -3.26 -0.17 -0.03 2.20 5.36 -1.26 -2.13 117.98 118.69 2a8m s PHE 127 Ca 0.60 0.32 -0.01 0.00 -0.96 0.00 0.00 56.93 56.88 2a8m s PHE 127 Cb -0.11 0.07 0.03 0.00 -0.34 0.00 0.00 43.02 42.67 2a8m s PHE 127 CO 0.45 -0.30 0.05 0.20 -1.46 0.00 0.00 175.22 174.16 2a8m s GLY 128 N -0.92 0.15 0.00 13.12 0.00 -0.60 -4.43 107.32 114.64 2a8m s GLY 128 Ca -0.10 0.27 -0.02 0.00 0.00 0.00 0.00 44.72 44.86 2a8m s GLY 128 CO 0.03 1.09 0.04 0.00 0.00 0.00 0.00 173.10 174.26 2a8m s ALA 129 N 1.68 -0.07 0.02 3.20 0.00 0.13 -0.98 121.76 125.74 2a8m s ALA 129 Ca -0.01 -0.26 0.03 0.00 0.00 0.00 0.00 51.96 51.72 2a8m s ALA 129 Cb -0.12 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 2a8m s ALA 129 CO -0.03 -0.14 -0.10 0.14 0.00 0.00 0.00 175.76 175.64 2a8m s VAL 130 N -1.01 0.74 0.01 0.00 -7.23 -0.32 -1.87 120.40 110.71 2a8m s VAL 130 Ca -0.11 -0.65 0.03 0.00 -1.81 0.00 0.00 61.98 59.43 2a8m s VAL 130 Cb -0.07 -0.67 -0.01 0.00 0.56 0.00 0.00 36.38 36.19 2a8m s VAL 130 CO -0.00 0.02 -0.09 -0.83 -0.31 0.00 0.00 175.10 173.90 2a8m s GLY 131 N -0.70 0.46 -1.38 2.32 0.00 -0.72 -1.48 107.32 105.82 2a8m s GLY 131 Ca 0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 44.72 44.20 2a8m s GLY 131 CO 0.00 -0.46 0.71 0.00 0.00 0.00 0.00 173.10 173.35 2a8m n ALA 132 N 2.46 -1.85 -2.59 3.20 0.00 -0.67 -0.84 120.51 120.22 2a8m n ALA 132 Ca -0.16 -0.11 -0.38 0.00 0.00 0.00 0.00 53.44 52.79 2a8m n ALA 132 Cb 0.56 -2.42 -0.11 0.00 0.00 0.00 0.00 19.45 17.48 2a8m n ALA 132 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2a8m s LEU 133 N -6.87 4.05 0.20 0.00 2.96 -0.67 -2.75 118.68 115.60 2a8m s LEU 133 Ca 0.16 -0.02 0.10 0.00 -0.22 0.00 0.00 54.13 54.14 2a8m s LEU 133 Cb -0.08 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 2a8m s LEU 133 CO 0.83 -0.06 -0.13 -0.44 -1.32 0.00 0.00 176.35 175.23 2a8m s SER 134 N 1.75 4.05 0.00 3.68 0.01 -1.26 -1.95 113.70 119.98 2a8m s SER 134 Ca 0.07 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2a8m s SER 134 Cb -0.16 -0.60 0.00 0.00 0.21 0.00 0.00 66.02 65.47 2a8m s SER 134 CO 0.11 0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.46 2a8m n GLY 135 N -0.06 0.71 2.98 3.44 0.00 -1.26 -4.80 105.19 106.20 2a8m n GLY 135 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 2a8m n GLY 135 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a8m s ILE 136 N -2.08 1.00 0.17 -0.61 -1.09 -1.26 -2.74 121.20 114.59 2a8m s ILE 136 Ca 0.00 -0.38 -0.12 0.00 -2.23 0.00 0.00 60.65 57.92 2a8m s ILE 136 Cb 0.00 -0.95 0.07 0.00 -1.58 0.00 0.00 42.46 40.00 2a8m s ILE 136 CO 0.00 0.33 1.73 0.50 -1.23 0.00 0.00 174.94 176.28 2a8m h LYS 137 N 7.23 0.85 -3.60 2.79 3.64 -1.65 -3.39 116.57 122.44 2a8m h LYS 137 Ca -0.32 -0.14 -0.63 0.00 -1.27 0.00 0.00 60.65 58.29 2a8m h LYS 137 Cb 1.17 -0.14 -0.40 0.00 -0.41 0.00 0.00 32.23 32.45 2a8m h LYS 137 CO 0.46 0.72 -0.70 -0.80 -2.27 0.00 0.00 179.45 176.86 2a8m s ASN 138 N -6.04 4.19 0.25 4.20 -0.87 -1.26 -4.37 114.94 111.03 2a8m s ASN 138 Ca -0.13 -2.49 -0.04 0.00 -1.57 0.00 0.00 52.86 48.63 2a8m s ASN 138 Cb 0.13 -1.34 0.41 0.00 -0.02 0.00 0.00 41.25 40.42 2a8m s ASN 138 CO 0.79 -0.30 1.80 -0.65 -2.57 0.00 0.00 177.10 176.16 2a8m h PRO 139 N 7.07 0.73 -0.84 -0.60 0.11 -1.96 -1.72 132.00 134.79 2a8m h PRO 139 Ca -0.06 -0.04 0.17 0.00 0.11 0.00 0.00 66.00 66.18 2a8m h PRO 139 Cb 0.95 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 31.84 2a8m h PRO 139 CO 0.56 0.48 0.56 -0.24 -0.21 0.00 0.00 178.00 179.14 2a8m h VAL 140 N 0.75 0.74 -0.78 3.15 3.04 -1.91 -0.15 116.25 121.09 2a8m h VAL 140 Ca 0.40 -0.15 -0.01 0.00 -1.01 0.00 0.00 66.70 65.93 2a8m h VAL 140 Cb 0.40 0.27 -0.04 0.00 -2.01 0.00 0.00 31.29 29.91 2a8m h VAL 140 CO -0.26 0.08 0.44 0.28 -1.01 0.00 0.00 177.57 177.09 2a8m h SER 141 N 0.44 0.97 -0.23 3.17 0.02 -1.69 0.55 113.55 116.78 2a8m h SER 141 Ca 0.43 -0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 61.16 2a8m h SER 141 Cb 0.99 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 2a8m h SER 141 CO -0.15 0.78 -0.27 0.58 -1.14 0.00 0.00 176.83 176.62 2a8m h VAL 142 N 1.08 1.28 -0.06 2.27 2.07 -1.11 0.32 116.25 122.10 2a8m h VAL 142 Ca 0.28 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 2a8m h VAL 142 Cb 0.02 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2a8m h VAL 142 CO -0.05 0.46 0.02 0.00 0.02 0.00 0.00 177.57 178.02 2a8m h ALA 143 N 1.08 0.08 0.44 1.67 0.00 -0.48 -0.54 119.26 121.51 2a8m h ALA 143 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2a8m h ALA 143 Cb 0.78 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2a8m h ALA 143 CO 0.06 -0.33 -0.32 -0.97 0.00 0.00 0.00 179.25 177.69 2a8m h ASN 144 N -0.08 -0.84 -0.54 0.00 -0.73 0.37 -2.13 115.58 111.64 2a8m h ASN 144 Ca 0.02 0.06 0.09 0.00 1.87 0.00 0.00 56.30 58.34 2a8m h ASN 144 Cb 0.19 0.26 -0.10 0.00 0.27 0.00 0.00 38.32 38.93 2a8m h ASN 144 CO -0.00 -0.49 -0.39 0.03 -0.37 0.00 0.00 177.43 176.21 2a8m h ARG 145 N -0.75 -0.22 -1.00 6.67 2.47 -0.27 0.18 114.38 121.47 2a8m h ARG 145 Ca -0.04 0.01 0.21 0.00 -1.26 0.00 0.00 59.98 58.90 2a8m h ARG 145 Cb 0.64 0.05 -0.11 0.00 -1.65 0.00 0.00 29.97 28.90 2a8m h ARG 145 CO 0.01 -0.15 0.61 -0.07 0.56 0.00 0.00 179.97 180.94 2a8m h LEU 146 N -0.23 0.70 0.76 3.04 3.38 -0.89 -1.79 115.31 120.29 2a8m h LEU 146 Ca 0.19 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 2a8m h LEU 146 Cb 0.56 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.30 2a8m h LEU 146 CO -0.65 0.21 -0.36 0.25 0.09 0.00 0.00 178.44 177.97 2a8m h LEU 147 N 0.66 -0.86 -0.58 1.67 6.46 0.03 -2.79 115.31 119.90 2a8m h LEU 147 Ca 0.59 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 58.45 2a8m h LEU 147 Cb 1.06 0.22 -0.10 0.00 -0.73 0.00 0.00 40.66 41.11 2a8m h LEU 147 CO -0.38 -0.61 -0.51 0.00 -0.62 0.00 0.00 178.44 176.31 2a8m h GLU 149 N -0.26 0.00 0.32 0.00 4.39 -1.44 0.81 114.58 118.39 2a8m h GLU 149 Ca 0.13 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 2a8m h GLU 149 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2a8m h GLU 149 CO -0.69 0.00 -0.15 0.78 -1.16 0.00 0.00 179.01 177.78 2a8m h GLY 150 N 0.00 -0.45 -0.42 -3.84 0.00 0.78 -3.28 103.07 95.86 2a8m h GLY 150 Ca 0.46 0.17 0.20 0.00 0.00 0.00 0.00 47.33 48.16 2a8m h GLY 150 CO -0.00 -0.16 0.11 1.46 0.00 0.00 0.00 176.54 177.94 2a8m h GLN 151 N -0.99 0.15 0.00 4.80 4.20 0.09 -3.09 115.11 120.26 2a8m h GLN 151 Ca -0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2a8m h GLN 151 Cb 0.49 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2a8m h GLN 151 CO 0.07 0.10 0.00 1.63 -0.67 0.00 0.00 178.83 179.96 2a8m n LYS 152 N -5.30 0.00 0.00 1.46 5.02 -0.60 -4.96 118.16 113.79 2a8m n LYS 152 Ca 0.17 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.98 2a8m n LYS 152 Cb 0.57 -0.97 0.00 0.00 -0.02 0.00 0.00 35.03 34.61 2a8m n LYS 152 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2a8m n GLY 153 N -0.96 1.72 3.34 0.72 0.00 -1.17 -5.14 105.19 103.71 2a8m n GLY 153 Ca 0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 2a8m n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a8m s LYS 154 N 1.84 3.41 0.00 1.61 1.02 -1.26 -4.57 119.74 121.78 2a8m s LYS 154 Ca 0.00 -0.63 0.00 0.00 0.02 0.00 0.00 55.97 55.37 2a8m s LYS 154 Cb 0.00 -2.90 0.02 0.00 -0.52 0.00 0.00 37.83 34.43 2a8m s LYS 154 CO 0.00 -0.05 0.64 1.28 -0.92 0.00 0.00 175.35 176.30 2a8m n LEU 155 N 4.35 0.00 0.00 3.17 4.77 -1.26 -4.96 117.00 123.07 2a8m n LEU 155 Ca -0.18 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2a8m n LEU 155 Cb 0.51 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2a8m n LEU 155 CO 0.30 -0.12 0.00 -1.20 -1.33 0.00 0.00 177.39 175.04 2a8m n SER 156 N -1.12 0.00 -1.54 -1.43 7.64 -1.26 -5.08 113.62 110.83 2a8m n SER 156 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2a8m n SER 156 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2a8m n SER 156 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 2a8m n ARG 159 N -0.25 -3.79 -4.16 1.43 3.00 -1.26 -5.22 116.66 106.41 2a8m n ARG 159 Ca 0.00 2.83 -0.35 0.00 -0.00 0.00 0.00 57.85 60.34 2a8m n ARG 159 Cb 0.00 -2.89 -0.10 0.00 0.00 0.00 0.00 32.46 29.47 2a8m n ARG 159 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2a8m s ILE 160 N -0.47 4.56 0.73 5.15 2.07 -1.26 -4.68 121.20 127.30 2a8m s ILE 160 Ca 0.00 -0.13 -0.16 0.00 -1.41 0.00 0.00 60.65 58.95 2a8m s ILE 160 Cb 0.00 -3.01 -0.02 0.00 0.13 0.00 0.00 42.46 39.57 2a8m s ILE 160 CO 0.00 0.52 0.67 -2.65 -1.91 0.00 0.00 174.94 171.57 2a8m n PRO 161 N 3.04 0.33 -3.30 3.50 -0.02 -1.26 -4.96 135.00 132.32 2a8m n PRO 161 Ca -0.18 0.16 -0.38 0.00 -2.02 0.00 0.00 63.50 61.08 2a8m n PRO 161 Cb 0.53 -1.96 -0.06 0.00 -0.02 0.00 0.00 33.50 31.99 2a8m n PRO 161 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2a8m s PRO 162 N -2.99 4.30 -0.02 0.52 0.04 -1.26 -4.96 135.00 130.63 2a8m s PRO 162 Ca 0.68 0.52 0.17 0.00 0.04 0.00 0.00 61.00 62.41 2a8m s PRO 162 Cb -0.34 -3.40 -0.25 0.00 0.04 0.00 0.00 34.50 30.55 2a8m s PRO 162 CO 0.56 0.24 0.45 0.00 0.04 0.00 0.00 177.00 178.29 2a8m s PHE 164 N -3.06 1.48 -0.00 0.00 5.36 -1.26 0.23 117.98 120.73 2a8m s PHE 164 Ca -0.04 -1.03 0.06 0.00 -0.96 0.00 0.00 56.93 54.97 2a8m s PHE 164 Cb 0.11 -1.21 -0.02 0.00 -0.34 0.00 0.00 43.02 41.57 2a8m s PHE 164 CO 0.71 -0.61 -0.21 -0.51 -1.46 0.00 0.00 175.22 173.14 2a8m s LEU 165 N 1.70 2.06 0.23 6.12 1.43 -0.78 -5.02 118.68 124.43 2a8m s LEU 165 Ca -0.01 -0.40 0.10 0.00 -1.03 0.00 0.00 54.13 52.80 2a8m s LEU 165 Cb -0.16 -1.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.97 2a8m s LEU 165 CO -0.07 0.24 -0.18 0.68 0.23 0.00 0.00 176.35 177.24 2a8m s VAL 166 N -0.54 2.14 0.00 -1.59 -7.23 -1.26 -1.75 120.40 110.17 2a8m s VAL 166 Ca 0.08 -2.24 0.00 0.00 -1.81 0.00 0.00 61.98 58.01 2a8m s VAL 166 Cb -0.08 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.73 2a8m s VAL 166 CO -0.00 -0.42 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 2a8m n GLY 167 N -0.32 1.97 0.12 2.32 0.00 -0.02 -2.51 105.19 106.75 2a8m n GLY 167 Ca -0.08 0.11 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 2a8m n GLY 167 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2a8m n GLU 168 N 11.61 -0.13 -0.04 1.61 4.71 -1.26 -1.13 120.64 136.01 2a8m n GLU 168 Ca 0.00 1.07 0.03 0.00 -0.01 0.00 0.00 57.16 58.26 2a8m n GLU 168 Cb 0.00 -1.60 0.38 0.00 -1.01 0.00 0.00 31.44 29.21 2a8m n GLU 168 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2a8m h GLY 169 N 0.00 0.67 1.16 0.62 0.00 -1.99 -1.13 103.07 102.41 2a8m h GLY 169 Ca 0.05 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.17 2a8m h GLY 169 CO -0.27 0.25 0.44 0.00 0.00 0.00 0.00 176.54 176.96 2a8m h ALA 170 N 1.69 1.71 0.35 3.60 0.00 -0.82 0.77 119.26 126.56 2a8m h ALA 170 Ca 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2a8m h ALA 170 Cb -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2a8m h ALA 170 CO -0.04 0.20 -0.17 -0.92 0.00 0.00 0.00 179.25 178.33 2a8m h TYR 171 N 0.71 -0.43 -0.95 0.00 3.20 0.00 -2.14 116.97 117.37 2a8m h TYR 171 Ca 0.28 -0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.44 2a8m h TYR 171 Cb 0.19 0.14 -0.16 0.00 1.54 0.00 0.00 36.73 38.45 2a8m h TYR 171 CO -0.00 -0.27 0.36 -0.09 -1.64 0.00 0.00 178.16 176.52 2a8m h ARG 172 N -1.08 0.18 0.67 1.82 2.43 -1.15 0.23 114.38 117.48 2a8m h ARG 172 Ca -0.05 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2a8m h ARG 172 Cb 0.36 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.87 2a8m h ARG 172 CO 0.08 0.12 -0.32 2.35 -1.51 0.00 0.00 179.97 180.68 2a8m h TRP 173 N 0.18 -0.84 -0.98 2.20 7.01 -0.90 0.07 115.95 122.68 2a8m h TRP 173 Ca 0.67 -0.02 0.27 0.00 2.11 0.00 0.00 58.89 61.92 2a8m h TRP 173 Cb 1.50 0.28 -0.06 0.00 -2.10 0.00 0.00 29.16 28.78 2a8m h TRP 173 CO -0.17 -0.49 0.68 0.00 -2.79 0.00 0.00 178.44 175.67 2a8m h ALA 174 N -0.99 2.65 -0.09 2.65 0.00 -0.37 0.24 119.26 123.35 2a8m h ALA 174 Ca -0.09 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2a8m h ALA 174 Cb 0.73 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2a8m h ALA 174 CO 0.15 -0.96 -0.34 0.28 0.00 0.00 0.00 179.25 178.38 2a8m h VAL 175 N 0.16 1.40 0.00 0.00 2.07 -0.32 -1.47 116.25 118.09 2a8m h VAL 175 Ca 0.50 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 66.31 2a8m h VAL 175 Cb 1.68 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 2a8m h VAL 175 CO -0.10 0.50 0.00 0.47 0.02 0.00 0.00 177.57 178.46 2a8m n ASP 176 N -4.39 0.52 -1.39 0.57 8.00 0.04 -2.19 116.55 117.71 2a8m n ASP 176 Ca -0.08 -1.43 0.04 0.00 0.71 0.00 0.00 54.79 54.04 2a8m n ASP 176 Cb 0.51 -0.26 0.04 0.00 -0.02 0.00 0.00 41.12 41.39 2a8m n ASP 176 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2a8m n HIS 177 N -0.03 0.00 -4.13 1.24 8.25 -1.02 -5.01 115.22 114.53 2a8m n HIS 177 Ca 0.00 -0.62 -0.31 0.00 -0.26 0.00 0.00 57.72 56.53 2a8m n HIS 177 Cb 0.13 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.03 2a8m n HIS 177 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2a8m n GLY 178 N 0.30 -0.29 3.33 -1.41 0.00 -0.93 -4.94 105.19 101.25 2a8m n GLY 178 Ca 0.08 0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.92 2a8m n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a8m s ILE 179 N -4.08 4.02 -0.18 -0.61 1.01 -0.57 -5.05 121.20 115.75 2a8m s ILE 179 Ca 0.09 -0.88 -0.39 0.00 0.00 0.00 0.00 60.65 59.47 2a8m s ILE 179 Cb -0.04 -3.18 -0.18 0.00 0.01 0.00 0.00 42.46 39.06 2a8m s ILE 179 CO 0.95 -0.07 1.18 -0.81 0.00 0.00 0.00 174.94 176.19 2a8m n PRO 180 N 4.87 0.00 -3.80 2.79 -0.04 -1.26 -4.59 135.00 132.97 2a8m n PRO 180 Ca -0.13 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.12 2a8m n PRO 180 Cb 0.46 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 2a8m n PRO 180 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2a8m s SER 181 N 1.06 5.37 0.00 3.54 1.04 -1.26 -1.94 113.70 121.51 2a8m s SER 181 Ca 0.89 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.87 2a8m s SER 181 Cb -1.26 -1.02 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2a8m s SER 181 CO 0.62 -0.34 0.00 0.00 0.98 0.00 0.00 173.24 174.49 2a8m s SER 234 N 1.00 5.62 0.03 0.00 1.04 -1.03 -5.03 113.70 115.34 2a8m s SER 234 Ca 0.00 -0.11 0.06 0.00 0.48 0.00 0.00 55.95 56.38 2a8m s SER 234 Cb 0.00 -1.49 -0.02 0.00 0.10 0.00 0.00 66.02 64.60 2a8m s SER 234 CO 0.00 0.05 -0.17 0.68 0.98 0.00 0.00 173.24 174.78 2a8m s VAL 235 N -1.80 1.34 0.13 5.02 -7.23 0.29 -1.65 120.40 116.50 2a8m s VAL 235 Ca 0.32 -1.03 -0.05 0.00 -1.81 0.00 0.00 61.98 59.40 2a8m s VAL 235 Cb -0.10 -1.18 -0.02 0.00 0.56 0.00 0.00 36.38 35.64 2a8m s VAL 235 CO 0.24 0.12 0.15 -0.83 -0.31 0.00 0.00 175.10 174.48 2a8m s GLY 236 N -1.06 0.64 -0.28 2.32 0.00 -1.08 -0.57 107.32 107.29 2a8m s GLY 236 Ca 0.04 -1.12 -0.16 0.00 0.00 0.00 0.00 44.72 43.49 2a8m s GLY 236 CO 0.01 -1.09 0.77 0.00 0.00 0.00 0.00 173.10 172.80 2a8m s ALA 237 N -3.98 -2.00 -0.05 3.20 0.00 -0.86 -1.73 121.76 116.32 2a8m s ALA 237 Ca 0.18 2.36 0.05 0.00 0.00 0.00 0.00 51.96 54.55 2a8m s ALA 237 Cb 0.06 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.63 2a8m s ALA 237 CO -0.01 -0.40 -0.21 0.14 0.00 0.00 0.00 175.76 175.28 2a8m s VAL 238 N 1.61 2.43 0.13 0.00 -7.23 0.78 -1.93 120.40 116.19 2a8m s VAL 238 Ca -0.10 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.15 2a8m s VAL 238 Cb -0.05 -1.91 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 2a8m s VAL 238 CO -0.19 0.57 -0.02 -0.69 -0.31 0.00 0.00 175.10 174.47 2a8m s VAL 239 N -0.36 0.61 -0.08 1.32 1.01 -0.57 -1.42 120.40 120.91 2a8m s VAL 239 Ca 0.03 -1.95 -0.03 0.00 0.00 0.00 0.00 61.98 60.03 2a8m s VAL 239 Cb -0.12 -1.91 0.05 0.00 0.00 0.00 0.00 36.38 34.40 2a8m s VAL 239 CO 0.02 -0.66 0.16 0.54 0.00 0.00 0.00 175.10 175.16 2a8m s VAL 240 N -3.69 -0.24 0.68 2.92 0.11 -1.03 -2.14 120.40 117.02 2a8m s VAL 240 Ca 0.18 0.34 -0.08 0.00 -2.93 0.00 0.00 61.98 59.49 2a8m s VAL 240 Cb 0.06 -0.28 0.04 0.00 -1.53 0.00 0.00 36.38 34.66 2a8m s VAL 240 CO -0.00 0.14 1.02 1.51 -3.33 0.00 0.00 175.10 174.44 2a8m s ASP 241 N 2.17 5.12 0.38 3.54 -4.77 -0.62 -1.03 116.67 121.47 2a8m s ASP 241 Ca 0.02 0.70 0.11 0.00 -3.30 0.00 0.00 52.55 50.08 2a8m s ASP 241 Cb -0.12 -1.46 0.88 0.00 -1.09 0.00 0.00 42.92 41.13 2a8m s ASP 241 CO -0.06 -1.43 1.88 1.12 0.70 0.00 0.00 175.17 177.39 2a8m h HIS 242 N -0.54 0.72 0.00 2.11 2.07 -1.35 -0.21 115.15 117.96 2a8m h HIS 242 Ca -0.45 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 2a8m h HIS 242 Cb 1.29 -0.23 0.00 0.00 2.57 0.00 0.00 27.41 31.04 2a8m h HIS 242 CO 0.40 0.27 0.00 -1.91 -3.07 0.00 0.00 177.93 173.62 2a8m n GLU 243 N -4.54 0.11 -0.09 5.12 2.13 -1.26 -4.82 120.64 117.29 2a8m n GLU 243 Ca 0.16 0.23 0.00 0.00 0.66 0.00 0.00 57.16 58.21 2a8m n GLU 243 Cb 0.48 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.69 2a8m n GLU 243 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2a8m n GLY 244 N -0.47 0.51 3.79 8.31 0.00 -0.09 -5.07 105.19 112.17 2a8m n GLY 244 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 2a8m n GLY 244 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2a8m s ASN 245 N -2.84 5.39 0.14 1.61 0.01 -1.25 -4.82 114.94 113.18 2a8m s ASN 245 Ca 0.00 1.87 0.06 0.00 -0.71 0.00 0.00 52.86 54.08 2a8m s ASN 245 Cb 0.00 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 39.09 2a8m s ASN 245 CO 0.00 -1.44 -0.14 0.68 -1.51 0.00 0.00 177.10 174.69 2a8m s VAL 246 N -2.50 1.42 -0.09 1.60 -7.23 -1.26 -1.58 120.40 110.77 2a8m s VAL 246 Ca 0.64 -1.80 -0.14 0.00 -1.81 0.00 0.00 61.98 58.87 2a8m s VAL 246 Cb -0.18 -1.63 0.03 0.00 0.56 0.00 0.00 36.38 35.16 2a8m s VAL 246 CO 0.42 -0.43 0.35 0.00 -0.31 0.00 0.00 175.10 175.13 2a8m s ALA 247 N -2.25 -0.89 0.03 1.32 0.00 -0.91 0.36 121.76 119.42 2a8m s ALA 247 Ca 0.11 0.76 0.03 0.00 0.00 0.00 0.00 51.96 52.87 2a8m s ALA 247 Cb -0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 2a8m s ALA 247 CO 0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 175.76 175.48 2a8m s ALA 248 N -0.46 0.83 0.02 0.00 0.00 -0.50 -1.51 121.76 120.13 2a8m s ALA 248 Ca -0.06 -0.64 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 2a8m s ALA 248 Cb -0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 2a8m s ALA 248 CO 0.02 0.14 0.06 0.00 0.00 0.00 0.00 175.76 175.98 2a8m s ALA 249 N -0.76 -0.08 -0.05 0.00 0.00 -0.81 0.23 121.76 120.29 2a8m s ALA 249 Ca -0.01 -0.42 -0.12 0.00 0.00 0.00 0.00 51.96 51.41 2a8m s ALA 249 Cb -0.07 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.23 2a8m s ALA 249 CO 0.01 -0.21 0.28 0.54 0.00 0.00 0.00 175.76 176.37 2a8m s VAL 250 N -1.69 0.04 -0.12 0.00 0.11 -0.37 -2.03 120.40 116.34 2a8m s VAL 250 Ca -0.13 -0.33 -0.08 0.00 -2.93 0.00 0.00 61.98 58.52 2a8m s VAL 250 Cb -0.07 -0.51 0.04 0.00 -1.53 0.00 0.00 36.38 34.31 2a8m s VAL 250 CO -0.01 -0.18 0.29 -0.55 -3.33 0.00 0.00 175.10 171.32 2a8m s SER 251 N -0.76 -0.32 0.05 3.54 0.15 0.27 -0.82 113.70 115.81 2a8m s SER 251 Ca -0.09 0.60 -0.06 0.00 0.70 0.00 0.00 55.95 57.11 2a8m s SER 251 Cb -0.04 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.79 2a8m s SER 251 CO 0.02 -0.14 0.10 -0.55 1.20 0.00 0.00 173.24 173.87 2a8m s SER 252 N 0.86 0.22 0.00 5.45 0.15 0.23 0.10 113.70 120.70 2a8m s SER 252 Ca -0.06 -0.65 0.23 0.00 0.70 0.00 0.00 55.95 56.17 2a8m s SER 252 Cb -0.07 0.25 0.04 0.00 -1.71 0.00 0.00 66.02 64.54 2a8m s SER 252 CO -0.06 -0.58 1.11 0.61 1.20 0.00 0.00 173.24 175.52 2a8m n GLY 253 N 0.43 -0.23 0.39 9.45 0.00 0.00 -1.08 105.19 114.16 2a8m n GLY 253 Ca -0.17 -0.61 0.05 0.00 0.00 0.00 0.00 46.02 45.29 2a8m n GLY 253 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a8m n GLY 254 N 1.43 -1.95 3.63 -0.02 0.00 -1.26 -4.51 105.19 102.51 2a8m n GLY 254 Ca 0.09 -1.40 -0.44 0.00 0.00 0.00 0.00 46.02 44.26 2a8m n GLY 254 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2a8m n LEU 255 N -2.70 2.43 -4.75 0.99 7.94 -1.26 -4.64 117.00 115.01 2a8m n LEU 255 Ca -0.01 1.19 -0.41 0.00 -1.11 0.00 0.00 56.01 55.67 2a8m n LEU 255 Cb 0.18 -1.36 -0.03 0.00 0.53 0.00 0.00 43.42 42.74 2a8m n LEU 255 CO 0.01 -1.07 0.97 0.00 -1.11 0.00 0.00 177.39 176.19 2a8m s ALA 256 N -1.07 3.51 -1.60 1.96 0.00 -1.26 -2.77 121.76 120.52 2a8m s ALA 256 Ca 0.57 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2a8m s ALA 256 Cb -0.65 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2a8m s ALA 256 CO 0.61 -0.54 0.00 1.28 0.00 0.00 0.00 175.76 177.11 2a8m n LEU 257 N 1.87 -1.80 -4.78 0.00 4.77 0.99 -4.90 117.00 113.16 2a8m n LEU 257 Ca 0.03 0.02 -0.35 0.00 -0.03 0.00 0.00 56.01 55.68 2a8m n LEU 257 Cb 0.42 -2.64 -0.01 0.00 -2.33 0.00 0.00 43.42 38.86 2a8m n LEU 257 CO 0.58 -0.26 0.77 -1.59 -1.33 0.00 0.00 177.39 175.57 2a8m s LYS 258 N -4.81 3.54 0.24 3.23 -2.85 -1.12 -3.44 119.74 114.54 2a8m s LYS 258 Ca 0.00 1.57 -0.30 0.00 -1.00 0.00 0.00 55.97 56.24 2a8m s LYS 258 Cb 0.00 -2.10 -0.10 0.00 -2.06 0.00 0.00 37.83 33.57 2a8m s LYS 258 CO 0.00 -0.68 1.44 -1.58 0.10 0.00 0.00 175.35 174.62 2a8m s HIS 259 N -1.78 3.03 0.31 1.78 5.65 -1.26 0.75 115.29 123.77 2a8m s HIS 259 Ca 0.70 1.02 -0.25 0.00 0.25 0.00 0.00 55.06 56.78 2a8m s HIS 259 Cb -0.23 -3.81 -0.15 0.00 -1.18 0.00 0.00 32.58 27.21 2a8m s HIS 259 CO 0.26 -2.66 0.44 -2.30 -0.65 0.00 0.00 174.74 169.84 2a8m n PRO 260 N 2.40 0.25 -1.04 2.88 -0.02 -1.26 -2.17 135.00 136.03 2a8m n PRO 260 Ca 0.07 0.09 -0.01 0.00 -2.02 0.00 0.00 63.50 61.62 2a8m n PRO 260 Cb 0.40 -1.18 -0.01 0.00 -0.02 0.00 0.00 33.50 32.69 2a8m n PRO 260 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a8m n GLY 261 N 1.98 0.46 3.62 -1.23 0.00 -1.26 -4.98 105.19 103.78 2a8m n GLY 261 Ca 0.14 -0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2a8m n GLY 261 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a8m s ARG 262 N -1.06 3.93 -0.08 1.61 3.52 -0.92 -4.96 118.95 121.00 2a8m s ARG 262 Ca 0.00 0.74 -0.11 0.00 -0.13 0.00 0.00 55.73 56.23 2a8m s ARG 262 Cb 0.00 -3.78 -0.05 0.00 -1.56 0.00 0.00 34.95 29.57 2a8m s ARG 262 CO 0.00 -0.91 0.26 0.08 -0.81 0.00 0.00 175.30 173.91 2a8m s VAL 263 N 3.50 5.30 0.00 7.11 1.01 -1.26 -4.80 120.40 131.26 2a8m s VAL 263 Ca 0.40 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2a8m s VAL 263 Cb -0.12 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2a8m s VAL 263 CO 0.17 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.47 2a8m n GLY 264 N 2.03 4.07 0.22 4.51 0.00 -1.26 -5.00 105.19 109.77 2a8m n GLY 264 Ca -0.17 -2.19 -0.00 0.00 0.00 0.00 0.00 46.02 43.66 2a8m n GLY 264 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2a8m h GLN 265 N 0.00 0.19 0.00 1.61 -0.00 -1.94 -2.64 115.11 112.33 2a8m h GLN 265 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 2a8m h GLN 265 Cb 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 27.48 27.44 2a8m h GLN 265 CO 0.00 0.12 0.57 0.00 -0.00 0.00 0.00 178.83 179.53 2a8m h ALA 266 N 1.48 1.46 -0.00 0.06 0.00 -1.90 0.21 119.26 120.58 2a8m h ALA 266 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2a8m h ALA 266 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2a8m h ALA 266 CO -0.43 -0.46 -0.21 0.00 0.00 0.00 0.00 179.25 178.15 2a8m n ALA 267 N -1.50 2.67 -2.62 0.00 0.00 -1.00 -1.72 120.51 116.34 2a8m n ALA 267 Ca -0.01 -0.22 -0.37 0.00 0.00 0.00 0.00 53.44 52.84 2a8m n ALA 267 Cb 0.59 -0.20 -0.10 0.00 0.00 0.00 0.00 19.45 19.74 2a8m n ALA 267 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2a8m s LEU 268 N -1.97 4.06 0.16 0.00 1.43 0.73 -4.71 118.68 118.37 2a8m s LEU 268 Ca 0.03 0.05 -0.32 0.00 -1.03 0.00 0.00 54.13 52.85 2a8m s LEU 268 Cb 0.04 -2.12 -0.17 0.00 0.03 0.00 0.00 46.19 43.97 2a8m s LEU 268 CO 0.20 -0.01 0.90 0.00 0.23 0.00 0.00 176.35 177.67 2a8m n TYR 269 N 4.77 0.53 -0.66 0.29 9.36 -1.26 -0.83 117.16 129.36 2a8m n TYR 269 Ca -0.14 0.86 0.00 0.00 3.32 0.00 0.00 57.90 61.94 2a8m n TYR 269 Cb 0.52 -2.12 0.00 0.00 -0.63 0.00 0.00 39.34 37.11 2a8m n TYR 269 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2a8m n GLY 270 N 1.81 0.50 0.55 2.98 0.00 -1.26 -4.76 105.19 105.01 2a8m n GLY 270 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 2a8m n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8m h GLY 272 N -0.52 0.29 -2.67 0.00 0.00 -1.30 -3.08 103.07 95.79 2a8m h GLY 272 Ca -0.18 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.47 2a8m h GLY 272 CO -0.11 0.58 0.03 0.00 0.00 0.00 0.00 176.54 177.05 2a8m s TRP 274 N -3.86 -0.58 -0.22 0.00 -0.11 0.24 -3.99 118.94 110.42 2a8m s TRP 274 Ca 0.08 1.11 -0.09 0.00 1.22 0.00 0.00 56.10 58.42 2a8m s TRP 274 Cb -0.01 0.32 0.08 0.00 -1.50 0.00 0.00 33.47 32.36 2a8m s TRP 274 CO -0.04 -0.51 0.49 0.00 -4.62 0.00 0.00 176.95 172.27 2a8m s ALA 275 N -0.86 -1.36 -0.22 5.86 0.00 -1.26 0.67 121.76 124.60 2a8m s ALA 275 Ca -0.09 1.77 -0.05 0.00 0.00 0.00 0.00 51.96 53.60 2a8m s ALA 275 Cb -0.02 -1.28 0.12 0.00 0.00 0.00 0.00 23.12 21.94 2a8m s ALA 275 CO 0.07 -0.57 0.40 -2.00 0.00 0.00 0.00 175.76 173.66 2a8m s GLU 276 N 2.12 0.34 0.76 0.00 2.12 0.59 -3.87 118.70 120.78 2a8m s GLU 276 Ca -0.06 0.78 -0.14 0.00 0.36 0.00 0.00 54.97 55.91 2a8m s GLU 276 Cb -0.10 -0.07 0.06 0.00 0.26 0.00 0.00 34.13 34.28 2a8m s GLU 276 CO -0.15 -0.46 1.18 -0.80 -0.54 0.00 0.00 175.26 174.49 2a8m s ASN 277 N 2.59 4.04 0.41 -1.70 0.02 0.33 -0.57 114.94 120.05 2a8m s ASN 277 Ca 0.06 2.25 -0.25 0.00 -1.02 0.00 0.00 52.86 53.91 2a8m s ASN 277 Cb -0.14 -2.58 -0.11 0.00 0.02 0.00 0.00 41.25 38.45 2a8m s ASN 277 CO -0.15 -2.36 1.02 0.35 0.02 0.00 0.00 177.10 175.99 2a8m n THR 278 N -3.06 2.41 -4.19 1.60 -2.24 -1.25 -4.69 114.28 102.86 2a8m n THR 278 Ca 0.13 -0.50 -0.18 0.00 -2.27 0.00 0.00 64.05 61.23 2a8m n THR 278 Cb 0.51 -1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 67.51 2a8m n THR 278 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2a8m s GLY 279 N -0.71 1.99 0.59 3.38 0.00 0.29 -4.93 107.32 107.93 2a8m s GLY 279 Ca 0.63 -1.84 0.30 0.00 0.00 0.00 0.00 44.72 43.80 2a8m s GLY 279 CO 0.57 -1.25 1.74 0.00 0.00 0.00 0.00 173.10 174.17 2a8m h ALA 280 N 2.09 2.50 0.00 3.20 0.00 -2.00 -3.13 119.26 121.92 2a8m h ALA 280 Ca -0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2a8m h ALA 280 Cb 1.23 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2a8m h ALA 280 CO 0.37 -1.08 -0.75 0.72 0.00 0.00 0.00 179.25 178.51 2a8m n HIS 281 N -3.66 0.00 -2.57 0.00 8.25 -1.26 -4.91 115.22 111.07 2a8m n HIS 281 Ca 0.14 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.17 2a8m n HIS 281 Cb 0.96 -0.37 -0.02 0.00 1.12 0.00 0.00 29.99 31.69 2a8m n HIS 281 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2a8m s ASN 282 N -5.96 6.61 0.43 0.41 4.22 -1.18 -4.88 114.94 114.59 2a8m s ASN 282 Ca -0.21 0.52 0.11 0.00 -2.14 0.00 0.00 52.86 51.14 2a8m s ASN 282 Cb 0.03 -2.55 0.96 0.00 1.28 0.00 0.00 41.25 40.97 2a8m s ASN 282 CO 0.31 -1.27 2.02 -0.65 -2.04 0.00 0.00 177.10 175.47 2a8m h PRO 283 N 9.36 0.20 -5.71 3.55 0.11 -1.91 0.83 132.00 138.42 2a8m h PRO 283 Ca -0.23 -0.03 -0.66 0.00 0.11 0.00 0.00 66.00 65.18 2a8m h PRO 283 Cb 1.06 -0.04 -0.11 0.00 0.11 0.00 0.00 31.00 32.02 2a8m h PRO 283 CO 1.12 0.25 -0.55 0.71 -0.21 0.00 0.00 178.00 179.32 2a8m s TYR 284 N -4.96 3.38 -0.17 0.65 2.02 -1.26 -4.68 117.35 112.33 2a8m s TYR 284 Ca -0.06 0.33 -0.29 0.00 -0.37 0.00 0.00 57.07 56.68 2a8m s TYR 284 Cb 0.16 -1.91 -0.00 0.00 -0.40 0.00 0.00 41.96 39.81 2a8m s TYR 284 CO 0.71 0.54 1.09 -1.12 -1.57 0.00 0.00 175.55 175.20 2a8m s SER 285 N -0.74 7.10 0.07 2.29 0.01 -0.95 -3.93 113.70 117.55 2a8m s SER 285 Ca 0.12 1.51 0.07 0.00 1.31 0.00 0.00 55.95 58.97 2a8m s SER 285 Cb -0.12 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 2a8m s SER 285 CO 0.03 -0.62 -0.19 0.42 0.41 0.00 0.00 173.24 173.29 2a8m s THR 286 N 2.87 1.50 -0.02 1.44 -4.23 0.26 -0.86 115.64 116.61 2a8m s THR 286 Ca 0.48 -1.32 -0.00 0.00 -1.18 0.00 0.00 61.69 59.67 2a8m s THR 286 Cb -0.18 -1.36 0.02 0.00 1.34 0.00 0.00 72.50 72.33 2a8m s THR 286 CO 0.12 -0.00 0.04 0.00 -0.54 0.00 0.00 174.62 174.24 2a8m s ALA 287 N -1.03 0.01 0.01 3.99 0.00 -0.59 -0.30 121.76 123.85 2a8m s ALA 287 Ca 0.05 0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.30 2a8m s ALA 287 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2a8m s ALA 287 CO 0.03 -0.09 -0.03 0.08 0.00 0.00 0.00 175.76 175.75 2a8m s VAL 288 N 0.82 0.24 -0.02 0.00 1.01 0.21 -1.31 120.40 121.35 2a8m s VAL 288 Ca -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.61 2a8m s VAL 288 Cb -0.10 -0.24 0.01 0.00 0.00 0.00 0.00 36.38 36.06 2a8m s VAL 288 CO -0.03 -0.05 -0.02 -0.55 0.00 0.00 0.00 175.10 174.45 2a8m s SER 289 N -0.38 0.47 0.50 3.32 0.15 -0.51 0.79 113.70 118.04 2a8m s SER 289 Ca -0.02 -0.05 0.06 0.00 0.70 0.00 0.00 55.95 56.64 2a8m s SER 289 Cb -0.03 -0.16 0.02 0.00 -1.71 0.00 0.00 66.02 64.14 2a8m s SER 289 CO -0.00 -0.03 0.40 0.42 1.20 0.00 0.00 173.24 175.23 2a8m s THR 290 N 0.48 1.97 -0.01 6.45 -4.23 0.55 -1.48 115.64 119.37 2a8m s THR 290 Ca -0.05 -1.45 -0.29 0.00 -1.18 0.00 0.00 61.69 58.72 2a8m s THR 290 Cb -0.08 -2.42 0.10 0.00 1.34 0.00 0.00 72.50 71.44 2a8m s THR 290 CO -0.01 0.00 0.87 -0.55 -0.54 0.00 0.00 174.62 174.39 2a8m s SER 291 N -4.23 -0.40 0.00 3.99 0.15 -0.07 -4.74 113.70 108.40 2a8m s SER 291 Ca 0.39 0.09 0.00 0.00 0.70 0.00 0.00 55.95 57.13 2a8m s SER 291 Cb -0.02 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 2a8m s SER 291 CO 0.24 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.67 2a8m n GLY 292 N -0.08 -0.31 3.55 9.45 0.00 -1.26 -0.46 105.19 116.08 2a8m n GLY 292 Ca -0.10 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.45 2a8m n GLY 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8m h GLY 294 N 19.23 1.45 1.00 0.00 0.00 -1.92 -0.36 103.07 122.47 2a8m h GLY 294 Ca -0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 2a8m h GLY 294 CO 1.17 -0.34 0.38 0.83 0.00 0.00 0.00 176.54 178.57 2a8m h GLU 295 N 0.27 0.92 -0.92 4.80 4.39 -1.94 -0.98 114.58 121.12 2a8m h GLU 295 Ca 0.56 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 60.16 2a8m h GLU 295 Cb 1.13 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.55 2a8m h GLU 295 CO -0.61 0.68 0.56 0.45 -1.16 0.00 0.00 179.01 178.93 2a8m h HIS 296 N 0.91 1.20 -0.12 4.33 3.86 -1.43 -2.19 115.15 121.71 2a8m h HIS 296 Ca 0.24 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.24 2a8m h HIS 296 Cb 0.01 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 28.09 2a8m h HIS 296 CO -0.01 0.79 -0.76 -0.07 0.86 0.00 0.00 177.93 178.74 2a8m h LEU 297 N 1.26 0.76 0.11 2.43 3.38 -1.12 -3.17 115.31 118.97 2a8m h LEU 297 Ca 0.33 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2a8m h LEU 297 Cb -0.07 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.46 2a8m h LEU 297 CO -0.06 1.28 -0.05 0.58 0.09 0.00 0.00 178.44 180.27 2a8m h VAL 298 N 0.43 1.02 0.00 1.22 2.07 -0.94 -0.96 116.25 119.10 2a8m h VAL 298 Ca -0.04 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 2a8m h VAL 298 Cb 1.37 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.48 2a8m h VAL 298 CO 0.15 0.12 -0.02 0.03 0.02 0.00 0.00 177.57 177.87 2a8m h ARG 299 N -0.39 0.00 -0.01 1.57 3.08 -1.51 -1.18 114.38 115.94 2a8m h ARG 299 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2a8m h ARG 299 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2a8m h ARG 299 CO 0.03 0.02 -0.64 0.25 -1.07 0.00 0.00 179.97 178.55 2a8m n THR 300 N -3.21 0.00 -4.26 2.04 -2.24 -1.17 -4.94 114.28 100.51 2a8m n THR 300 Ca -0.02 -0.14 -0.37 0.00 -2.27 0.00 0.00 64.05 61.25 2a8m n THR 300 Cb 0.18 1.02 -0.05 0.00 -2.10 0.00 0.00 70.33 69.38 2a8m n THR 300 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2a8m n ILE 301 N -0.69 -0.55 -0.29 2.28 5.41 -0.39 -4.77 119.36 120.35 2a8m n ILE 301 Ca 0.07 0.00 0.04 0.00 1.00 0.00 0.00 62.75 63.87 2a8m n ILE 301 Cb 0.40 -1.14 0.13 0.00 -0.71 0.00 0.00 39.64 38.32 2a8m n ILE 301 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2a8m h LEU 302 N -1.15 -0.67 -0.14 1.39 5.85 -1.66 -2.30 115.31 116.64 2a8m h LEU 302 Ca -0.57 0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.44 2a8m h LEU 302 Cb 1.37 0.48 -0.06 0.00 0.37 0.00 0.00 40.66 42.81 2a8m h LEU 302 CO 0.79 -0.26 -0.31 0.00 -0.34 0.00 0.00 178.44 178.32 2a8m h ALA 303 N 1.82 -0.34 -0.13 1.25 0.00 -1.54 0.11 119.26 120.42 2a8m h ALA 303 Ca 0.41 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.25 2a8m h ALA 303 Cb 0.67 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2a8m h ALA 303 CO -0.82 -0.78 -0.36 -0.09 0.00 0.00 0.00 179.25 177.20 2a8m h ARG 304 N -0.38 0.28 -0.70 0.00 2.43 -0.96 -2.81 114.38 112.24 2a8m h ARG 304 Ca 0.10 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2a8m h ARG 304 Cb 0.53 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 2a8m h ARG 304 CO -0.35 0.61 0.32 1.49 -1.51 0.00 0.00 179.97 180.52 2a8m h GLU 305 N 0.24 1.01 -0.14 0.20 4.57 -0.76 -1.79 114.58 117.90 2a8m h GLU 305 Ca 0.03 -0.15 -0.11 0.00 -1.18 0.00 0.00 59.36 57.95 2a8m h GLU 305 Cb 0.75 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 2a8m h GLU 305 CO 0.06 0.79 -0.40 0.00 -1.18 0.00 0.00 179.01 178.28 2a8m h SER 307 N 0.26 0.57 -0.10 0.00 0.87 -1.14 -0.51 113.55 113.50 2a8m h SER 307 Ca 0.02 -0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.30 2a8m h SER 307 Cb 0.83 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2a8m h SER 307 CO 0.07 0.91 -0.07 0.45 -0.53 0.00 0.00 176.83 177.65 2a8m h HIS 308 N 0.44 0.26 -0.62 2.24 -0.00 -1.13 -3.24 115.15 113.11 2a8m h HIS 308 Ca 0.04 -0.07 0.01 0.00 -0.00 0.00 0.00 60.37 60.34 2a8m h HIS 308 Cb 0.89 -0.06 -0.03 0.00 -0.00 0.00 0.00 27.41 28.21 2a8m h HIS 308 CO 0.03 0.61 0.41 0.00 -0.00 0.00 0.00 177.93 178.98 2a8m h ALA 309 N 0.61 0.79 0.00 2.45 0.00 -1.17 -1.52 119.26 120.42 2a8m h ALA 309 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2a8m h ALA 309 Cb 0.55 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2a8m h ALA 309 CO 0.02 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.76 2a8m n LEU 310 N -4.66 0.00 -0.01 0.00 4.77 -0.21 -1.18 117.00 115.72 2a8m n LEU 310 Ca 0.05 0.23 0.14 0.00 -0.03 0.00 0.00 56.01 56.41 2a8m n LEU 310 Cb 0.02 -0.23 0.67 0.00 -2.33 0.00 0.00 43.42 41.55 2a8m n LEU 310 CO 0.35 -0.22 0.96 0.00 -1.33 0.00 0.00 177.39 177.15 2a8m n GLN 311 N -1.23 0.24 -1.52 3.23 1.13 -0.57 -4.80 117.38 113.85 2a8m n GLN 311 Ca 0.01 -0.02 -0.29 0.00 -1.94 0.00 0.00 57.00 54.76 2a8m n GLN 311 Cb 0.01 -1.50 0.16 0.00 0.11 0.00 0.00 30.24 29.03 2a8m n GLN 311 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2a8m s ALA 312 N -2.77 1.63 0.02 -1.58 0.00 -0.32 -4.93 121.76 113.80 2a8m s ALA 312 Ca 0.22 -0.73 -0.19 0.00 0.00 0.00 0.00 51.96 51.26 2a8m s ALA 312 Cb 0.20 -2.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.25 2a8m s ALA 312 CO 0.50 -2.57 1.06 1.49 0.00 0.00 0.00 175.76 176.25 2a8m h GLU 313 N -1.73 -0.66 -5.68 0.00 4.57 -1.89 -3.39 114.58 105.80 2a8m h GLU 313 Ca -0.48 0.04 -0.61 0.00 -1.18 0.00 0.00 59.36 57.13 2a8m h GLU 313 Cb 1.31 0.15 -0.13 0.00 -0.16 0.00 0.00 28.75 29.92 2a8m h GLU 313 CO 0.52 -0.44 0.67 0.34 -1.18 0.00 0.00 179.01 178.93 2a8m s ASP 314 N -3.58 6.17 0.13 1.04 2.15 -1.26 -4.92 116.67 116.41 2a8m s ASP 314 Ca -0.10 -0.85 -0.26 0.00 0.43 0.00 0.00 52.55 51.77 2a8m s ASP 314 Cb 0.01 -2.45 -0.03 0.00 -0.30 0.00 0.00 42.92 40.15 2a8m s ASP 314 CO 0.30 -1.54 1.61 0.00 -0.17 0.00 0.00 175.17 175.37 2a8m h ALA 315 N 9.68 -0.40 -0.75 3.66 0.00 -1.87 -0.33 119.26 129.25 2a8m h ALA 315 Ca -0.29 0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.79 2a8m h ALA 315 Cb 1.07 0.60 -0.10 0.00 0.00 0.00 0.00 17.79 19.35 2a8m h ALA 315 CO 1.21 -0.81 0.24 1.25 0.00 0.00 0.00 179.25 181.14 2a8m h HIS 316 N -0.41 0.40 -0.35 0.00 6.17 -1.98 0.45 115.15 119.42 2a8m h HIS 316 Ca 0.09 0.04 -0.09 0.00 0.71 0.00 0.00 60.37 61.11 2a8m h HIS 316 Cb 0.55 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.41 2a8m h HIS 316 CO -0.39 -0.02 -0.14 0.37 0.71 0.00 0.00 177.93 178.45 2a8m h GLN 317 N 0.35 0.72 0.33 5.26 5.75 -1.85 -2.34 115.11 123.32 2a8m h GLN 317 Ca 0.42 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 58.60 2a8m h GLN 317 Cb 0.70 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.23 2a8m h GLN 317 CO -0.47 0.91 -0.16 0.00 -2.65 0.00 0.00 178.83 176.46 2a8m h ALA 318 N 0.80 -0.44 -0.82 3.38 0.00 0.59 -1.51 119.26 121.25 2a8m h ALA 318 Ca 0.08 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2a8m h ALA 318 Cb 0.67 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 2a8m h ALA 318 CO 0.05 -0.73 0.46 1.25 0.00 0.00 0.00 179.25 180.28 2a8m h LEU 319 N -0.48 0.65 0.04 0.00 5.85 -0.20 -1.87 115.31 119.29 2a8m h LEU 319 Ca -0.05 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2a8m h LEU 319 Cb 0.36 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.32 2a8m h LEU 319 CO 0.07 0.36 -0.02 0.25 -0.34 0.00 0.00 178.44 178.77 2a8m h LEU 320 N 0.77 -0.04 -2.19 2.25 5.85 -1.24 -2.34 115.31 118.36 2a8m h LEU 320 Ca 0.40 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 2a8m h LEU 320 Cb 0.39 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 2a8m h LEU 320 CO -0.26 0.19 -0.04 -0.33 -0.34 0.00 0.00 178.44 177.67 2a8m h GLU 321 N -0.28 0.00 -0.00 1.25 5.08 -1.00 -1.63 114.58 118.00 2a8m h GLU 321 Ca -0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2a8m h GLU 321 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2a8m h GLU 321 CO 0.01 0.04 -0.00 1.15 -1.00 0.00 0.00 179.01 179.20 2a8m h THR 322 N 0.00 1.53 -0.06 1.13 2.02 -1.23 0.43 112.91 116.73 2a8m h THR 322 Ca -0.00 -1.58 0.02 0.00 0.77 0.00 0.00 66.41 65.62 2a8m h THR 322 Cb 0.08 2.60 -0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2a8m h THR 322 CO 0.00 0.41 0.07 0.24 0.37 0.00 0.00 175.52 176.62 2a8m h MET 323 N -0.66 0.00 0.00 6.66 2.86 -0.84 0.32 114.93 123.26 2a8m h MET 323 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2a8m h MET 323 Cb 0.67 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.33 2a8m h MET 323 CO 0.00 0.00 -0.48 1.04 1.06 0.00 0.00 176.91 178.53 2a8m n GLN 324 N -3.82 0.36 0.12 1.72 6.02 -0.67 -1.69 117.38 119.41 2a8m n GLN 324 Ca -0.01 0.39 -0.02 0.00 -0.01 0.00 0.00 57.00 57.34 2a8m n GLN 324 Cb 0.17 -1.41 0.09 0.00 1.02 0.00 0.00 30.24 30.11 2a8m n GLN 324 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2a8m h ASN 325 N -0.76 0.00 -0.40 1.08 2.35 -0.92 0.37 115.58 117.30 2a8m h ASN 325 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2a8m h ASN 325 Cb 0.48 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.85 2a8m h ASN 325 CO 0.00 0.72 0.00 0.29 -1.65 0.00 0.00 177.43 176.79 2a8m n LYS 326 N -3.63 2.92 0.00 0.81 4.76 0.11 -3.32 118.16 119.81 2a8m n LYS 326 Ca -0.01 -2.28 0.00 0.00 -2.87 0.00 0.00 58.31 53.16 2a8m n LYS 326 Cb 0.71 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.49 2a8m n LYS 326 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2a8m n PHE 327 N 0.56 0.00 0.01 2.13 7.35 -0.94 -4.64 117.46 121.94 2a8m n PHE 327 Ca 0.15 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.74 2a8m n PHE 327 Cb 0.54 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.33 2a8m n PHE 327 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 2a8m h ILE 328 N 0.00 0.38 -0.46 -2.13 2.04 -1.28 -2.09 117.51 113.97 2a8m h ILE 328 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2a8m h ILE 328 Cb 0.00 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2a8m h ILE 328 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 178.15 176.95 2a8m n SER 329 N -5.38 3.04 -4.71 1.72 7.64 0.13 -4.84 113.62 111.21 2a8m n SER 329 Ca -0.03 -2.16 -0.42 0.00 1.01 0.00 0.00 58.87 57.26 2a8m n SER 329 Cb 0.30 -0.41 -0.03 0.00 -1.01 0.00 0.00 64.21 63.06 2a8m n SER 329 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2a8m s SER 330 N -0.87 6.45 0.37 6.43 0.15 -0.79 -4.83 113.70 120.61 2a8m s SER 330 Ca 0.34 2.76 0.17 0.00 0.70 0.00 0.00 55.95 59.92 2a8m s SER 330 Cb 0.20 -2.59 1.09 0.00 -1.71 0.00 0.00 66.02 63.01 2a8m s SER 330 CO 0.19 -0.94 1.72 -0.65 1.20 0.00 0.00 173.24 174.76 2a8m h PRO 331 N 7.35 0.38 0.00 5.44 0.11 -1.90 0.15 132.00 143.53 2a8m h PRO 331 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2a8m h PRO 331 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2a8m h PRO 331 CO 0.94 0.25 0.00 1.19 -0.21 0.00 0.00 178.00 180.17 2a8m n PHE 332 N -4.78 0.80 -0.02 0.65 3.01 -1.26 -2.20 117.46 113.65 2a8m n PHE 332 Ca 0.29 0.35 0.02 0.00 1.01 0.00 0.00 57.45 59.11 2a8m n PHE 332 Cb 0.94 -1.06 0.04 0.00 -0.01 0.00 0.00 39.48 39.39 2a8m n PHE 332 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2a8m n LEU 333 N -2.26 2.12 0.32 4.37 4.77 0.50 -4.69 117.00 122.13 2a8m n LEU 333 Ca 0.01 -1.82 0.11 0.00 -0.03 0.00 0.00 56.01 54.27 2a8m n LEU 333 Cb 0.16 -0.06 0.58 0.00 -2.33 0.00 0.00 43.42 41.77 2a8m n LEU 333 CO 0.16 0.52 1.06 0.00 -1.33 0.00 0.00 177.39 177.81 2a8m h ALA 334 N 0.65 1.48 0.00 -1.18 0.00 -1.08 0.65 119.26 119.78 2a8m h ALA 334 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2a8m h ALA 334 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2a8m h ALA 334 CO 0.00 -0.48 -1.52 0.43 0.00 0.00 0.00 179.25 177.68 2a8m n SER 335 N -2.71 0.70 -4.67 0.00 7.64 -1.26 -4.84 113.62 108.48 2a8m n SER 335 Ca -0.01 0.31 -0.43 0.00 1.01 0.00 0.00 58.87 59.74 2a8m n SER 335 Cb 0.53 0.43 -0.02 0.00 -1.01 0.00 0.00 64.21 64.13 2a8m n SER 335 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2a8m s GLU 336 N -2.98 4.27 -0.95 1.43 0.41 0.23 -4.96 118.70 116.15 2a8m s GLU 336 Ca -0.04 1.60 -0.19 0.00 -0.41 0.00 0.00 54.97 55.93 2a8m s GLU 336 Cb 0.09 -3.69 0.13 0.00 -1.78 0.00 0.00 34.13 28.87 2a8m s GLU 336 CO 0.82 -0.62 1.16 0.16 -0.49 0.00 0.00 175.26 176.29 2a8m s ASP 337 N 1.70 6.64 0.00 -0.19 1.47 -1.26 -4.65 116.67 120.37 2a8m s ASP 337 Ca 0.53 -2.04 0.00 0.00 1.18 0.00 0.00 52.55 52.21 2a8m s ASP 337 Cb -0.21 -2.41 0.00 0.00 -0.34 0.00 0.00 42.92 39.96 2a8m s ASP 337 CO 0.15 -1.08 0.00 0.61 0.68 0.00 0.00 175.17 175.52 2a8m n GLY 338 N 5.53 1.46 3.48 2.12 0.00 -1.26 -5.08 105.19 111.44 2a8m n GLY 338 Ca 0.25 -0.97 -0.36 0.00 0.00 0.00 0.00 46.02 44.94 2a8m n GLY 338 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a8m s VAL 339 N 0.00 4.41 -0.18 1.61 1.01 -0.95 -4.97 120.40 121.33 2a8m s VAL 339 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.83 2a8m s VAL 339 Cb 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2a8m s VAL 339 CO 0.00 0.36 -0.13 -0.76 0.00 0.00 0.00 175.10 174.57 2a8m s LEU 340 N 1.38 2.51 -0.06 3.92 1.43 -1.26 -4.05 118.68 122.55 2a8m s LEU 340 Ca 0.05 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.35 2a8m s LEU 340 Cb -0.15 -1.59 0.11 0.00 0.03 0.00 0.00 46.19 44.59 2a8m s LEU 340 CO 0.04 0.03 1.08 -0.83 0.23 0.00 0.00 176.35 176.90 2a8m s GLY 341 N 1.14 -0.36 -0.00 -3.19 0.00 -1.26 -1.53 107.32 102.13 2a8m s GLY 341 Ca 0.01 1.09 -0.11 0.00 0.00 0.00 0.00 44.72 45.70 2a8m s GLY 341 CO -0.05 0.34 0.23 -0.32 0.00 0.00 0.00 173.10 173.31 2a8m s GLY 342 N -2.49 -0.06 0.00 0.20 0.00 0.39 -0.75 107.32 104.61 2a8m s GLY 342 Ca 0.09 0.08 -0.05 0.00 0.00 0.00 0.00 44.72 44.84 2a8m s GLY 342 CO -0.05 -0.10 0.09 -1.34 0.00 0.00 0.00 173.10 171.70 2a8m s VAL 343 N -1.51 0.08 -0.02 1.40 -7.23 0.16 -0.89 120.40 112.38 2a8m s VAL 343 Ca -0.13 -0.64 0.05 0.00 -1.81 0.00 0.00 61.98 59.46 2a8m s VAL 343 Cb -0.06 -0.35 -0.01 0.00 0.56 0.00 0.00 36.38 36.53 2a8m s VAL 343 CO 0.02 -0.35 -0.18 0.27 -0.31 0.00 0.00 175.10 174.55 2a8m s ILE 344 N -1.17 1.43 0.09 -0.62 -4.36 -0.55 -0.59 121.20 115.42 2a8m s ILE 344 Ca -0.13 -0.76 -0.08 0.00 -0.26 0.00 0.00 60.65 59.42 2a8m s ILE 344 Cb -0.07 -1.20 -0.00 0.00 1.25 0.00 0.00 42.46 42.44 2a8m s ILE 344 CO 0.01 0.41 0.18 0.68 0.24 0.00 0.00 174.94 176.45 2a8m s VAL 345 N -0.31 0.15 -0.01 8.37 -7.23 -0.39 -1.43 120.40 119.55 2a8m s VAL 345 Ca 0.04 -1.21 -0.03 0.00 -1.81 0.00 0.00 61.98 58.97 2a8m s VAL 345 Cb -0.08 -1.35 -0.00 0.00 0.56 0.00 0.00 36.38 35.50 2a8m s VAL 345 CO 0.00 -0.66 0.06 -1.48 -0.31 0.00 0.00 175.10 172.71 2a8m s LEU 346 N -2.87 1.82 -0.08 1.32 0.05 -0.43 -0.87 118.68 117.63 2a8m s LEU 346 Ca 0.05 -0.11 0.00 0.00 0.05 0.00 0.00 54.13 54.13 2a8m s LEU 346 Cb 0.05 0.31 0.02 0.00 -2.05 0.00 0.00 46.19 44.52 2a8m s LEU 346 CO -0.11 -0.18 -0.05 -0.60 -0.55 0.00 0.00 176.35 174.86 2a8m s ARG 347 N -0.69 1.14 0.42 1.48 3.52 0.12 -1.54 118.95 123.40 2a8m s ARG 347 Ca -0.08 -0.15 0.06 0.00 -0.13 0.00 0.00 55.73 55.44 2a8m s ARG 347 Cb -0.05 -1.22 -0.07 0.00 -1.56 0.00 0.00 34.95 32.06 2a8m s ARG 347 CO 0.00 -0.19 0.01 -1.54 -0.81 0.00 0.00 175.30 172.78 2a8m s SER 348 N 1.43 3.78 0.00 -2.12 1.04 -0.04 -0.94 113.70 116.86 2a8m s SER 348 Ca -0.02 -1.42 0.00 0.00 0.48 0.00 0.00 55.95 55.00 2a8m s SER 348 Cb -0.13 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.76 2a8m s SER 348 CO -0.04 -0.53 0.00 0.00 0.98 0.00 0.00 173.24 173.65 2a8m s ARG 350 N -1.34 4.65 0.00 0.00 3.00 -1.26 -1.57 118.95 122.43 2a8m s ARG 350 Ca 0.00 1.27 0.00 0.00 0.00 0.00 0.00 55.73 57.00 2a8m s ARG 350 Cb 0.00 -3.22 0.00 0.00 0.00 0.00 0.00 34.95 31.73 2a8m s ARG 350 CO 0.00 0.53 0.00 0.00 0.00 0.00 0.00 175.30 175.83 2a8m s GLN 362 N -1.94 3.13 0.21 0.00 -0.21 -1.26 -4.96 119.66 114.63 2a8m s GLN 362 Ca 0.00 -0.87 0.02 0.00 0.02 0.00 0.00 55.36 54.53 2a8m s GLN 362 Cb 0.00 -4.10 -0.05 0.00 1.00 0.00 0.00 33.01 29.86 2a8m s GLN 362 CO 0.00 -1.25 0.03 0.95 -2.12 0.00 0.00 175.29 172.90 2a8m s THR 363 N 2.70 0.72 -0.34 -0.19 -4.23 -1.26 -4.78 115.64 108.26 2a8m s THR 363 Ca 0.16 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.70 2a8m s THR 363 Cb -0.19 -2.32 0.10 0.00 1.34 0.00 0.00 72.50 71.43 2a8m s THR 363 CO 0.12 -0.30 0.06 -0.22 -0.54 0.00 0.00 174.62 173.74 2a8m s LEU 364 N -3.24 4.27 -0.29 4.79 2.96 -1.08 -4.34 118.68 121.74 2a8m s LEU 364 Ca 0.29 -2.08 -0.29 0.00 -0.22 0.00 0.00 54.13 51.83 2a8m s LEU 364 Cb 0.06 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.27 2a8m s LEU 364 CO 0.08 -0.38 1.26 -0.22 -1.32 0.00 0.00 176.35 175.77 2a8m s LEU 365 N 1.02 3.92 -0.18 -0.68 1.98 -0.61 -2.39 118.68 121.73 2a8m s LEU 365 Ca 0.11 1.24 -0.00 0.00 -2.89 0.00 0.00 54.13 52.58 2a8m s LEU 365 Cb -0.19 -3.54 0.01 0.00 0.66 0.00 0.00 46.19 43.13 2a8m s LEU 365 CO -0.11 -1.02 -0.15 -0.69 -1.89 0.00 0.00 176.35 172.49 2a8m s VAL 366 N 4.17 2.51 -0.17 1.68 1.01 -0.05 -2.60 120.40 126.95 2a8m s VAL 366 Ca 0.54 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.69 2a8m s VAL 366 Cb -0.17 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 2a8m s VAL 366 CO 0.21 0.51 -0.04 -1.61 0.00 0.00 0.00 175.10 174.16 2a8m s GLU 367 N 1.20 3.56 0.00 2.72 2.02 -0.12 -0.31 118.70 127.76 2a8m s GLU 367 Ca 0.02 -0.57 0.05 0.00 0.02 0.00 0.00 54.97 54.49 2a8m s GLU 367 Cb -0.14 -2.92 -0.01 0.00 0.10 0.00 0.00 34.13 31.15 2a8m s GLU 367 CO -0.07 0.10 -0.15 -0.59 0.02 0.00 0.00 175.26 174.58 2a8m s PHE 368 N 0.71 1.30 0.23 1.61 -0.12 -0.92 0.14 117.98 120.92 2a8m s PHE 368 Ca -0.02 -0.27 -0.00 0.00 -0.05 0.00 0.00 56.93 56.59 2a8m s PHE 368 Cb -0.15 -0.82 -0.04 0.00 -0.63 0.00 0.00 43.02 41.39 2a8m s PHE 368 CO 0.02 -0.01 0.18 -0.51 -0.05 0.00 0.00 175.22 174.85 2a8m s LEU 369 N -0.53 1.21 -0.07 -1.99 1.02 -0.05 -1.94 118.68 116.33 2a8m s LEU 369 Ca 0.05 -1.43 -0.06 0.00 0.02 0.00 0.00 54.13 52.71 2a8m s LEU 369 Cb -0.06 0.49 0.02 0.00 0.02 0.00 0.00 46.19 46.66 2a8m s LEU 369 CO -0.00 -0.90 0.17 -1.66 0.02 0.00 0.00 176.35 173.99 2a8m s TRP 370 N -4.02 -0.19 0.01 0.29 -2.14 -0.73 -1.26 118.94 110.89 2a8m s TRP 370 Ca 0.38 0.48 -0.07 0.00 2.66 0.00 0.00 56.10 59.55 2a8m s TRP 370 Cb 0.06 0.06 0.00 0.00 -3.10 0.00 0.00 33.47 30.49 2a8m s TRP 370 CO 0.15 -0.10 0.14 0.45 -2.66 0.00 0.00 176.95 174.93 2a8m s SER 371 N 0.17 0.05 -0.08 -2.66 0.15 0.24 -1.76 113.70 109.81 2a8m s SER 371 Ca -0.01 -0.28 -0.30 0.00 0.70 0.00 0.00 55.95 56.07 2a8m s SER 371 Cb -0.02 0.22 0.10 0.00 -1.71 0.00 0.00 66.02 64.61 2a8m s SER 371 CO -0.00 -0.42 0.86 -1.38 1.20 0.00 0.00 173.24 173.50 2a8m s HIS 372 N -1.73 -0.46 -1.42 3.44 -3.43 -0.42 0.35 115.29 111.61 2a8m s HIS 372 Ca -0.12 0.69 0.12 0.00 -0.80 0.00 0.00 55.06 54.95 2a8m s HIS 372 Cb -0.06 0.46 0.16 0.00 -1.43 0.00 0.00 32.58 31.71 2a8m s HIS 372 CO 0.00 -0.48 0.99 0.25 -2.00 0.00 0.00 174.74 173.50 2a8m n THR 373 N 0.55 0.25 -2.78 -5.38 -2.24 0.07 -0.91 114.28 103.85 2a8m n THR 373 Ca -0.13 -0.62 -0.25 0.00 -2.27 0.00 0.00 64.05 60.78 2a8m n THR 373 Cb 0.59 1.07 0.01 0.00 -2.10 0.00 0.00 70.33 69.90 2a8m n THR 373 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2a8m s THR 374 N -1.03 4.12 0.34 4.28 -4.23 -1.25 0.40 115.64 118.27 2a8m s THR 374 Ca 0.17 -0.23 0.12 0.00 -1.18 0.00 0.00 61.69 60.57 2a8m s THR 374 Cb 0.11 -3.56 0.34 0.00 1.34 0.00 0.00 72.50 70.73 2a8m s THR 374 CO 0.16 -0.47 1.75 -0.33 -0.54 0.00 0.00 174.62 175.19 2a8m h GLU 375 N 0.22 0.53 0.00 3.99 5.08 -1.90 -3.41 114.58 119.09 2a8m h GLU 375 Ca -0.46 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 57.83 2a8m h GLU 375 Cb 1.24 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2a8m h GLU 375 CO 0.59 0.35 0.20 -1.13 -1.00 0.00 0.00 179.01 178.03 2a8m n SER 376 N -4.78 -1.80 -3.45 1.42 3.41 -0.05 -2.47 113.62 105.90 2a8m n SER 376 Ca 0.26 -2.29 0.02 0.00 -0.26 0.00 0.00 58.87 56.60 2a8m n SER 376 Cb 0.76 3.02 -0.05 0.00 -0.26 0.00 0.00 64.21 67.67 2a8m n SER 376 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2a8m s MET 377 N -2.10 0.16 -0.30 4.33 1.75 -1.03 -1.28 119.30 120.84 2a8m s MET 377 Ca 0.13 0.34 -0.14 0.00 -1.25 0.00 0.00 55.69 54.78 2a8m s MET 377 Cb -0.04 0.13 -0.03 0.00 2.84 0.00 0.00 34.83 37.74 2a8m s MET 377 CO 0.10 -0.04 0.30 0.00 -0.65 0.00 0.00 175.02 174.73 2a8m s VAL 379 N 1.93 1.82 -0.28 0.00 -7.23 -0.46 -1.66 120.40 114.51 2a8m s VAL 379 Ca 0.11 -1.69 -0.09 0.00 -1.81 0.00 0.00 61.98 58.50 2a8m s VAL 379 Cb -0.16 -2.51 0.12 0.00 0.56 0.00 0.00 36.38 34.39 2a8m s VAL 379 CO 0.11 0.00 0.60 -0.83 -0.31 0.00 0.00 175.10 174.67 2a8m s GLY 380 N -4.03 -0.66 0.12 2.32 0.00 -0.68 -2.23 107.32 102.15 2a8m s GLY 380 Ca 0.31 2.14 0.10 0.00 0.00 0.00 0.00 44.72 47.26 2a8m s GLY 380 CO 0.18 2.94 -0.25 -2.52 0.00 0.00 0.00 173.10 173.45 2a8m s TYR 381 N 2.84 2.16 -0.27 1.90 1.13 -0.53 -1.46 117.35 123.11 2a8m s TYR 381 Ca -0.04 -0.39 -0.23 0.00 -1.41 0.00 0.00 57.07 55.01 2a8m s TYR 381 Cb -0.12 -1.18 0.08 0.00 -1.10 0.00 0.00 41.96 39.64 2a8m s TYR 381 CO -0.18 0.29 0.74 1.41 -2.51 0.00 0.00 175.55 175.30 2a8m s MET 382 N -1.97 0.78 0.39 -3.49 1.75 -0.80 -1.90 119.30 114.05 2a8m s MET 382 Ca 0.12 1.03 0.02 0.00 -1.25 0.00 0.00 55.69 55.60 2a8m s MET 382 Cb -0.10 0.33 -0.01 0.00 2.84 0.00 0.00 34.83 37.88 2a8m s MET 382 CO 0.05 -0.11 0.58 0.45 -0.65 0.00 0.00 175.02 175.34 2a8m s SER 383 N 0.70 6.02 0.00 1.11 0.15 -1.26 -2.19 113.70 118.23 2a8m s SER 383 Ca -0.02 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.85 2a8m s SER 383 Cb -0.05 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.63 2a8m s SER 383 CO -0.05 -0.50 0.05 0.00 1.20 0.00 0.00 173.24 173.94 2a8m n ALA 384 N -1.87 0.00 0.48 5.45 0.00 0.84 -1.96 120.51 123.45 2a8m n ALA 384 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.46 2a8m n ALA 384 Cb 0.57 0.02 0.17 0.00 0.00 0.00 0.00 19.45 20.21 2a8m n ALA 384 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2a8m n GLN 385 N -0.08 0.24 -0.25 0.00 3.00 -1.26 -3.09 117.38 115.94 2a8m n GLN 385 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.08 2a8m n GLN 385 Cb 0.00 -1.38 0.35 0.00 0.00 0.00 0.00 30.24 29.21 2a8m n GLN 385 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 2a8m h ASP 386 N 0.00 0.69 0.00 1.08 1.82 -1.78 -3.44 116.42 114.79 2a8m h ASP 386 Ca 0.00 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 2a8m h ASP 386 Cb 0.00 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 39.89 2a8m h ASP 386 CO 0.00 0.39 0.00 0.61 -1.61 0.00 0.00 179.24 178.63 2a8m n GLY 387 N -1.43 0.00 3.13 -0.78 0.00 -1.18 -4.88 105.19 100.05 2a8m n GLY 387 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 2a8m n GLY 387 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a8m s LYS 388 N -0.28 1.79 -0.21 1.61 -2.85 -1.26 -5.13 119.74 113.41 2a8m s LYS 388 Ca 0.00 -0.60 -0.08 0.00 -1.00 0.00 0.00 55.97 54.29 2a8m s LYS 388 Cb 0.00 -1.55 -0.04 0.00 -2.06 0.00 0.00 37.83 34.19 2a8m s LYS 388 CO 0.00 0.23 0.08 0.00 0.10 0.00 0.00 175.35 175.76 2a8m s ALA 389 N 0.08 3.35 -0.17 0.59 0.00 -1.26 -4.49 121.76 119.86 2a8m s ALA 389 Ca -0.05 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 50.96 2a8m s ALA 389 Cb -0.12 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.94 2a8m s ALA 389 CO 0.02 -0.10 0.01 0.15 0.00 0.00 0.00 175.76 175.84 2a8m s LYS 390 N 0.90 3.82 0.25 0.00 1.02 -0.80 -5.01 119.74 119.92 2a8m s LYS 390 Ca 0.04 -0.43 0.10 0.00 0.02 0.00 0.00 55.97 55.70 2a8m s LYS 390 Cb -0.14 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 2a8m s LYS 390 CO 0.03 0.27 -0.07 0.95 -0.92 0.00 0.00 175.35 175.60 2a8m s THR 391 N 0.34 3.14 -0.05 2.17 -4.23 -1.26 -1.45 115.64 114.30 2a8m s THR 391 Ca -0.01 -1.99 -0.27 0.00 -1.18 0.00 0.00 61.69 58.24 2a8m s THR 391 Cb -0.13 -2.65 0.06 0.00 1.34 0.00 0.00 72.50 71.12 2a8m s THR 391 CO 0.02 -0.33 0.60 -2.28 -0.54 0.00 0.00 174.62 172.09 2a8m s HIS 392 N -2.24 -0.56 -0.59 3.99 5.04 -0.95 -5.00 115.29 114.98 2a8m s HIS 392 Ca 0.30 0.96 -0.00 0.00 -1.54 0.00 0.00 55.06 54.78 2a8m s HIS 392 Cb -0.07 0.34 0.15 0.00 0.04 0.00 0.00 32.58 33.05 2a8m s HIS 392 CO 0.18 -0.56 0.38 0.42 -2.34 0.00 0.00 174.74 172.82 2a8m s ILE 393 N -1.18 3.31 0.36 0.89 -1.09 -1.26 -1.36 121.20 120.86 2a8m s ILE 393 Ca -0.11 -3.12 -0.28 0.00 -2.23 0.00 0.00 60.65 54.91 2a8m s ILE 393 Cb -0.01 -3.20 -0.11 0.00 -1.58 0.00 0.00 42.46 37.56 2a8m s ILE 393 CO 0.09 -0.85 1.52 -0.24 -1.23 0.00 0.00 174.94 174.22 2a8m n SER 394 N 3.32 3.87 -3.96 3.58 2.88 0.04 -4.84 113.62 118.50 2a8m n SER 394 Ca 0.07 1.21 -0.14 0.00 -1.33 0.00 0.00 58.87 58.68 2a8m n SER 394 Cb 0.36 -1.62 -0.14 0.00 -0.75 0.00 0.00 64.21 62.06 2a8m n SER 394 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2a8m s ARG 395 N -1.78 0.36 0.33 -1.46 6.06 -1.26 -2.45 118.95 118.76 2a8m s ARG 395 Ca 0.55 -0.29 -0.29 0.00 -2.50 0.00 0.00 55.73 53.21 2a8m s ARG 395 Cb -0.47 -0.28 -0.10 0.00 0.06 0.00 0.00 34.95 34.15 2a8m s ARG 395 CO 0.61 0.07 1.34 -0.51 -2.50 0.00 0.00 175.30 174.30 2a8m s LEU 396 N -0.46 4.41 0.03 -0.88 1.43 -1.03 -4.90 118.68 117.28 2a8m s LEU 396 Ca -0.02 2.74 -0.38 0.00 -1.03 0.00 0.00 54.13 55.44 2a8m s LEU 396 Cb -0.04 -3.65 -0.17 0.00 0.03 0.00 0.00 46.19 42.36 2a8m s LEU 396 CO -0.00 -0.59 1.31 -2.65 0.23 0.00 0.00 176.35 174.65 2a8m n PRO 397 N 0.83 0.85 -1.47 1.29 -0.02 -1.26 -4.74 135.00 130.48 2a8m n PRO 397 Ca 0.00 0.31 -0.57 0.00 -2.02 0.00 0.00 63.50 61.23 2a8m n PRO 397 Cb 0.41 -1.92 -0.07 0.00 -0.02 0.00 0.00 33.50 31.91 2a8m n PRO 397 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2a8m n PRO 398 N 2.52 0.00 -1.18 0.52 -0.02 -1.26 0.04 135.00 135.62 2a8m n PRO 398 Ca 0.20 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.61 2a8m n PRO 398 Cb 0.15 -1.41 -0.03 0.00 -0.02 0.00 0.00 33.50 32.20 2a8m n PRO 398 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a8m n GLY 399 N 1.55 0.85 3.31 -1.23 0.00 -1.26 -5.01 105.19 103.40 2a8m n GLY 399 Ca 0.19 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 2a8m n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a8m s ALA 400 N -2.21 2.99 0.27 4.61 0.00 0.11 -5.08 121.76 122.46 2a8m s ALA 400 Ca 0.00 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.17 2a8m s ALA 400 Cb 0.00 -2.07 -0.13 0.00 0.00 0.00 0.00 23.12 20.91 2a8m s ALA 400 CO 0.00 -0.95 1.32 0.28 0.00 0.00 0.00 175.76 176.41 2a8m n VAL 401 N 4.82 1.39 -2.90 0.00 0.31 -1.26 -4.77 118.33 115.93 2a8m n VAL 401 Ca -0.15 -0.35 -0.35 0.00 -0.01 0.00 0.00 64.34 63.49 2a8m n VAL 401 Cb 0.47 -1.43 -0.07 0.00 -0.91 0.00 0.00 33.84 31.91 2a8m n VAL 401 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2a8m s ALA 402 N -0.50 3.19 -0.22 3.52 0.00 -1.26 -1.89 121.76 124.60 2a8m s ALA 402 Ca 0.63 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.94 2a8m s ALA 402 Cb -0.64 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2a8m s ALA 402 CO 0.55 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.92 2a8m n GLY 403 N 0.00 0.51 0.00 0.00 0.00 0.16 -4.68 105.19 101.18 2a8m n GLY 403 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2a8m n GLY 403 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2a8m n GLN 404 N -2.00 2.16 -4.15 1.61 1.13 -1.20 -2.25 117.38 112.69 2a8m n GLN 404 Ca -0.02 0.00 -0.24 0.00 -1.94 0.00 0.00 57.00 54.80 2a8m n GLN 404 Cb 0.19 -0.53 -0.07 0.00 0.11 0.00 0.00 30.24 29.94 2a8m n GLN 404 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2a8m s SER 405 N -0.75 4.44 -0.07 1.08 0.01 -0.79 -5.01 113.70 112.61 2a8m s SER 405 Ca 0.00 -1.02 0.02 0.00 1.31 0.00 0.00 55.95 56.26 2a8m s SER 405 Cb 0.00 -0.52 0.02 0.00 0.21 0.00 0.00 66.02 65.72 2a8m s SER 405 CO 0.00 -0.47 -0.11 -0.69 0.41 0.00 0.00 173.24 172.39 2a8m s VAL 406 N -2.56 1.03 -0.08 3.43 1.01 -1.26 -4.20 120.40 117.77 2a8m s VAL 406 Ca 0.40 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2a8m s VAL 406 Cb 0.02 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 2a8m s VAL 406 CO 0.22 0.34 -0.08 0.00 0.00 0.00 0.00 175.10 175.57 2a8m s ALA 407 N 0.81 2.90 -0.16 5.51 0.00 -0.08 -4.94 121.76 125.78 2a8m s ALA 407 Ca -0.12 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 50.80 2a8m s ALA 407 Cb -0.15 -1.21 0.05 0.00 0.00 0.00 0.00 23.12 21.80 2a8m s ALA 407 CO 0.02 0.51 0.43 -1.50 0.00 0.00 0.00 175.76 175.22 2a8m s ILE 408 N -0.59 -0.01 0.33 0.00 2.07 -1.26 -1.30 121.20 120.45 2a8m s ILE 408 Ca 0.09 0.02 -0.00 0.00 -1.41 0.00 0.00 60.65 59.34 2a8m s ILE 408 Cb -0.12 -0.60 -0.01 0.00 0.13 0.00 0.00 42.46 41.86 2a8m s ILE 408 CO 0.02 0.01 0.41 -1.61 -1.91 0.00 0.00 174.94 171.86 2a8m s GLU 409 N 0.48 1.83 0.00 3.50 2.02 -0.72 -5.01 118.70 120.79 2a8m s GLU 409 Ca -0.02 -1.80 0.00 0.00 0.02 0.00 0.00 54.97 53.17 2a8m s GLU 409 Cb -0.04 0.41 0.00 0.00 0.10 0.00 0.00 34.13 34.60 2a8m s GLU 409 CO -0.02 -0.73 0.00 0.41 0.02 0.00 0.00 175.26 174.93 2a8m n GLY 410 N -0.56 4.00 0.52 -1.39 0.00 -1.26 -1.78 105.19 104.73 2a8m n GLY 410 Ca 0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 2a8m n GLY 410 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a8m n GLY 411 N -1.02 3.30 3.09 -0.02 0.00 -0.82 -4.93 105.19 104.79 2a8m n GLY 411 Ca 0.00 -2.20 -0.23 0.00 0.00 0.00 0.00 46.02 43.59 2a8m n GLY 411 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a8m s VAL 412 N -0.60 1.16 0.10 1.61 1.01 -1.26 -2.18 120.40 120.24 2a8m s VAL 412 Ca 0.03 -0.58 0.09 0.00 0.00 0.00 0.00 61.98 61.52 2a8m s VAL 412 Cb -0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 2a8m s VAL 412 CO 0.02 0.34 -0.22 0.00 0.00 0.00 0.00 175.10 175.24 2a8m s ARG 414 N -1.82 1.92 0.51 0.00 3.52 -1.26 -0.87 118.95 120.96 2a8m s ARG 414 Ca 0.08 -0.42 0.05 0.00 -0.13 0.00 0.00 55.73 55.32 2a8m s ARG 414 Cb -0.10 -1.81 0.01 0.00 -1.56 0.00 0.00 34.95 31.50 2a8m s ARG 414 CO 0.04 -0.20 0.31 -0.51 -0.81 0.00 0.00 175.30 174.13 2a8m s LEU 415 N 1.44 2.76 0.00 -0.88 1.02 -1.01 -4.95 118.68 117.07 2a8m s LEU 415 Ca 0.02 -1.24 0.00 0.00 0.02 0.00 0.00 54.13 52.93 2a8m s LEU 415 Cb -0.13 -1.23 0.00 0.00 0.02 0.00 0.00 46.19 44.85 2a8m s LEU 415 CO -0.07 -0.95 0.00 1.21 0.02 0.00 0.00 176.35 176.56