#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofr s GLU 21 N 0.00 0.71 -1.28 5.31 2.12 -1.26 -4.83 118.70 119.48 1ofr s GLU 21 Ca 0.00 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 54.81 1ofr s GLU 21 Cb 0.00 -0.66 0.00 0.00 0.26 0.00 0.00 34.13 33.73 1ofr s GLU 21 CO 0.00 0.17 0.00 -0.25 -0.54 0.00 0.00 175.26 174.64 1ofr n ASP 22 N 2.32 -4.42 0.24 -1.70 8.00 -1.26 -4.90 116.55 114.84 1ofr n ASP 22 Ca -0.16 0.08 0.11 0.00 0.71 0.00 0.00 54.79 55.53 1ofr n ASP 22 Cb 0.56 -3.47 0.55 0.00 -0.02 0.00 0.00 41.12 38.75 1ofr n ASP 22 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1ofr h VAL 23 N 0.00 0.56 -0.47 2.53 -1.51 -2.05 -2.55 116.25 112.75 1ofr h VAL 23 Ca -0.32 -0.92 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1ofr h VAL 23 Cb 1.16 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 31.94 1ofr h VAL 23 CO 0.40 0.19 0.00 0.54 -1.23 0.00 0.00 177.57 177.47 1ofr n ARG 24 N -3.47 2.95 -3.61 5.19 1.74 -1.26 -4.87 116.66 113.33 1ofr n ARG 24 Ca -0.01 -2.38 -0.40 0.00 -0.77 0.00 0.00 57.85 54.29 1ofr n ARG 24 Cb 0.36 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 30.22 1ofr n ARG 24 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ofr s ILE 25 N -1.27 4.43 -0.32 0.55 -1.09 -0.96 -4.97 121.20 117.57 1ofr s ILE 25 Ca 0.35 -1.01 0.27 0.00 -2.23 0.00 0.00 60.65 58.03 1ofr s ILE 25 Cb 0.20 -3.53 0.31 0.00 -1.58 0.00 0.00 42.46 37.86 1ofr s ILE 25 CO 0.21 -0.29 1.80 -0.07 -1.23 0.00 0.00 174.94 175.35 1ofr h LEU 26 N 8.42 0.00 0.00 2.97 3.38 -1.89 -3.48 115.31 124.70 1ofr h LEU 26 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1ofr h LEU 26 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1ofr h LEU 26 CO 0.68 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.82 1ofr n GLY 27 N 0.37 3.48 3.40 0.83 0.00 -1.26 -5.12 105.19 106.89 1ofr n GLY 27 Ca 0.02 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 1ofr n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ofr s TYR 28 N -2.00 2.85 0.05 1.61 1.51 -1.26 -5.12 117.35 114.99 1ofr s TYR 28 Ca 0.00 -0.56 0.01 0.00 -1.01 0.00 0.00 57.07 55.51 1ofr s TYR 28 Cb 0.00 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 1ofr s TYR 28 CO 0.00 -0.16 0.10 -0.51 -1.11 0.00 0.00 175.55 173.87 1ofr s ASP 29 N 0.31 5.71 0.34 2.29 1.01 -1.26 -5.07 116.67 120.00 1ofr s ASP 29 Ca -0.09 0.08 -0.28 0.00 0.71 0.00 0.00 52.55 52.97 1ofr s ASP 29 Cb -0.15 -1.61 -0.10 0.00 1.01 0.00 0.00 42.92 42.07 1ofr s ASP 29 CO 0.05 0.20 1.35 -2.16 0.21 0.00 0.00 175.17 174.82 1ofr s PRO 30 N -2.21 4.29 -0.19 8.23 0.04 -1.26 -5.01 135.00 138.89 1ofr s PRO 30 Ca 0.28 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1ofr s PRO 30 Cb -0.12 -3.04 0.04 0.00 0.04 0.00 0.00 34.50 31.42 1ofr s PRO 30 CO 0.20 -0.27 -0.09 -1.17 0.04 0.00 0.00 177.00 175.71 1ofr s LEU 31 N -1.88 2.13 0.20 -3.56 2.96 -1.26 -4.94 118.68 112.33 1ofr s LEU 31 Ca 0.50 -0.85 -0.32 0.00 -0.22 0.00 0.00 54.13 53.23 1ofr s LEU 31 Cb -0.41 -1.15 -0.14 0.00 0.50 0.00 0.00 46.19 44.99 1ofr s LEU 31 CO 0.55 -0.16 1.36 0.00 -1.32 0.00 0.00 176.35 176.78 1ofr n ALA 32 N 4.73 0.46 -1.51 5.97 0.00 -1.26 -4.94 120.51 123.96 1ofr n ALA 32 Ca -0.14 0.44 -0.29 0.00 0.00 0.00 0.00 53.44 53.45 1ofr n ALA 32 Cb 0.47 -2.20 0.12 0.00 0.00 0.00 0.00 19.45 17.84 1ofr n ALA 32 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ofr s SER 33 N 0.30 3.86 0.07 0.00 1.04 -1.26 -4.84 113.70 112.88 1ofr s SER 33 Ca 0.72 1.13 -0.35 0.00 0.48 0.00 0.00 55.95 57.93 1ofr s SER 33 Cb -0.73 -1.78 -0.18 0.00 0.10 0.00 0.00 66.02 63.42 1ofr s SER 33 CO 0.49 -2.35 1.59 -0.65 0.98 0.00 0.00 173.24 173.30 1ofr h PRO 34 N -1.35 -1.03 -0.92 4.02 0.11 -1.83 -0.91 132.00 130.09 1ofr h PRO 34 Ca -0.49 0.07 0.24 0.00 0.11 0.00 0.00 66.00 65.93 1ofr h PRO 34 Cb 1.30 0.24 -0.13 0.00 0.11 0.00 0.00 31.00 32.52 1ofr h PRO 34 CO 0.60 -0.69 0.40 0.00 -0.21 0.00 0.00 178.00 178.10 1ofr h ALA 35 N -0.88 1.51 -0.15 -0.75 0.00 -0.93 0.61 119.26 118.66 1ofr h ALA 35 Ca -0.09 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ofr h ALA 35 Cb 0.86 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1ofr h ALA 35 CO 0.09 -0.40 0.03 1.25 0.00 0.00 0.00 179.25 180.23 1ofr h LEU 36 N 0.36 0.24 -0.65 0.00 5.85 -1.70 -2.87 115.31 116.54 1ofr h LEU 36 Ca 0.59 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 59.03 1ofr h LEU 36 Cb 1.18 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1ofr h LEU 36 CO -0.56 0.42 0.25 0.25 -0.34 0.00 0.00 178.44 178.46 1ofr h LEU 37 N 0.05 0.90 -1.89 2.25 7.12 0.76 -1.71 115.31 122.77 1ofr h LEU 37 Ca 0.05 -0.17 0.00 0.00 0.13 0.00 0.00 57.88 57.88 1ofr h LEU 37 Cb 0.28 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.18 1ofr h LEU 37 CO 0.00 0.83 0.00 1.56 -0.13 0.00 0.00 178.44 180.70 1ofr h GLN 38 N 0.91 0.00 0.06 1.25 4.20 0.13 -0.32 115.11 121.35 1ofr h GLN 38 Ca 0.21 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.56 1ofr h GLN 38 Cb 0.21 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 1ofr h GLN 38 CO -0.02 0.00 -2.07 0.28 -0.67 0.00 0.00 178.83 176.35 1ofr n VAL 39 N -2.62 1.64 0.03 -0.54 0.31 -0.85 -3.45 118.33 112.85 1ofr n VAL 39 Ca -0.01 -0.51 0.01 0.00 -0.01 0.00 0.00 64.34 63.82 1ofr n VAL 39 Cb 0.10 -1.71 0.34 0.00 -0.91 0.00 0.00 33.84 31.66 1ofr n VAL 39 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1ofr h GLN 40 N -0.22 0.46 -2.61 5.55 4.20 -0.83 -3.28 115.11 118.37 1ofr h GLN 40 Ca -0.48 -0.08 -0.60 0.00 0.06 0.00 0.00 58.65 57.54 1ofr h GLN 40 Cb 1.84 -0.07 -0.40 0.00 0.30 0.00 0.00 27.48 29.15 1ofr h GLN 40 CO -0.06 0.47 -0.78 -0.89 -0.67 0.00 0.00 178.83 176.90 1ofr n ILE 41 N -4.32 0.41 -1.96 2.54 5.41 -0.17 -5.10 119.36 116.16 1ofr n ILE 41 Ca 0.01 -4.27 -0.35 0.00 1.00 0.00 0.00 62.75 59.14 1ofr n ILE 41 Cb 0.22 -1.95 0.03 0.00 -0.71 0.00 0.00 39.64 37.23 1ofr n ILE 41 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1ofr s PRO 42 N -0.97 2.97 -0.16 0.38 0.04 -1.22 -4.62 135.00 131.42 1ofr s PRO 42 Ca 0.31 1.61 -0.20 0.00 0.04 0.00 0.00 61.00 62.76 1ofr s PRO 42 Cb 0.03 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 1ofr s PRO 42 CO -0.16 -1.16 0.56 0.00 0.04 0.00 0.00 177.00 176.28 1ofr s ALA 43 N -1.92 3.50 0.78 8.56 0.00 -1.26 -5.03 121.76 126.38 1ofr s ALA 43 Ca 0.72 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.32 1ofr s ALA 43 Cb -0.25 -2.83 0.06 0.00 0.00 0.00 0.00 23.12 20.10 1ofr s ALA 43 CO 0.35 -0.32 1.11 0.95 0.00 0.00 0.00 175.76 177.85 1ofr s THR 44 N 1.35 3.07 0.51 0.00 -4.23 -1.26 -4.80 115.64 110.28 1ofr s THR 44 Ca 0.27 0.38 0.15 0.00 -1.18 0.00 0.00 61.69 61.31 1ofr s THR 44 Cb -0.16 -2.80 0.27 0.00 1.34 0.00 0.00 72.50 71.16 1ofr s THR 44 CO 0.11 -0.43 2.13 -0.65 -0.54 0.00 0.00 174.62 175.24 1ofr h PRO 45 N -1.05 0.07 -0.07 3.99 0.11 -1.99 -1.41 132.00 131.65 1ofr h PRO 45 Ca -0.44 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 1ofr h PRO 45 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ofr h PRO 45 CO 0.50 0.04 -0.06 1.15 -0.21 0.00 0.00 178.00 179.43 1ofr h THR 46 N 0.07 1.35 -0.25 -1.15 2.02 -1.92 -2.26 112.91 110.77 1ofr h THR 46 Ca 0.03 -1.15 0.05 0.00 0.77 0.00 0.00 66.41 66.11 1ofr h THR 46 Cb 0.03 1.96 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 1ofr h THR 46 CO -0.00 0.32 -0.08 0.28 0.37 0.00 0.00 175.52 176.41 1ofr h SER 47 N -0.24 -0.27 0.28 4.18 0.02 -1.43 0.10 113.55 116.19 1ofr h SER 47 Ca 0.01 0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 1ofr h SER 47 Cb 0.54 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 1ofr h SER 47 CO 0.01 -0.10 -0.14 -0.07 -1.14 0.00 0.00 176.83 175.40 1ofr h LEU 48 N -0.02 0.00 0.02 5.07 3.38 -1.31 -2.10 115.31 120.35 1ofr h LEU 48 Ca 0.12 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1ofr h LEU 48 Cb 0.21 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ofr h LEU 48 CO -0.27 0.14 -0.43 -0.08 0.09 0.00 0.00 178.44 177.89 1ofr h GLU 49 N 0.00 0.25 -0.75 1.13 4.57 -0.57 -2.85 114.58 116.36 1ofr h GLU 49 Ca -0.00 -0.30 0.10 0.00 -1.18 0.00 0.00 59.36 57.97 1ofr h GLU 49 Cb 0.32 0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 28.92 1ofr h GLU 49 CO 0.02 1.03 0.39 1.15 -1.18 0.00 0.00 179.01 180.42 1ofr h THR 50 N -0.40 0.86 -0.70 0.32 2.02 -0.58 -0.58 112.91 113.85 1ofr h THR 50 Ca -0.06 -0.22 -0.05 0.00 0.77 0.00 0.00 66.41 66.85 1ofr h THR 50 Cb 1.20 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 1ofr h THR 50 CO 0.08 0.12 0.26 0.00 0.37 0.00 0.00 175.52 176.35 1ofr h ALA 51 N 1.44 0.91 -0.12 6.16 0.00 -1.44 -1.39 119.26 124.83 1ofr h ALA 51 Ca 0.37 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1ofr h ALA 51 Cb 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ofr h ALA 51 CO -0.27 0.55 -0.50 0.87 0.00 0.00 0.00 179.25 179.91 1ofr h LYS 52 N 1.01 0.32 0.30 0.00 1.57 -1.10 -2.74 116.57 115.93 1ofr h LYS 52 Ca 0.23 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1ofr h LYS 52 Cb 0.24 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1ofr h LYS 52 CO -0.01 0.75 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.38 1ofr h ARG 53 N 0.25 -0.38 -0.84 3.15 2.43 -0.89 -2.55 114.38 115.55 1ofr h ARG 53 Ca 0.01 0.03 0.19 0.00 -0.81 0.00 0.00 59.98 59.40 1ofr h ARG 53 Cb 0.97 0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 30.49 1ofr h ARG 53 CO 0.08 -0.08 0.32 0.78 -1.51 0.00 0.00 179.97 179.57 1ofr h GLY 54 N -0.71 1.34 1.60 2.80 0.00 -1.24 0.19 103.07 107.05 1ofr h GLY 54 Ca -0.04 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 1ofr h GLY 54 CO 0.07 -0.22 -0.10 3.21 0.00 0.00 0.00 176.54 179.50 1ofr h ARG 55 N 0.38 0.48 0.13 4.80 3.08 -1.43 0.23 114.38 122.05 1ofr h ARG 55 Ca 0.50 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.41 1ofr h ARG 55 Cb 0.89 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1ofr h ARG 55 CO -0.50 0.59 -0.06 0.00 -1.07 0.00 0.00 179.97 178.92 1ofr h ARG 56 N 0.45 -0.17 -0.10 0.04 3.08 -0.25 -1.40 114.38 116.04 1ofr h ARG 56 Ca 0.09 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.17 1ofr h ARG 56 Cb 0.45 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 1ofr h ARG 56 CO 0.03 0.22 -0.02 0.93 -1.07 0.00 0.00 179.97 180.05 1ofr h GLU 57 N -0.59 0.00 -0.71 0.04 5.08 -1.03 -0.84 114.58 116.53 1ofr h GLU 57 Ca -0.02 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1ofr h GLU 57 Cb 0.46 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.64 1ofr h GLU 57 CO 0.03 0.00 0.37 0.00 -1.00 0.00 0.00 179.01 178.41 1ofr h ALA 58 N 1.10 0.97 -0.55 3.43 0.00 -0.98 -1.14 119.26 122.08 1ofr h ALA 58 Ca 0.05 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ofr h ALA 58 Cb 0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1ofr h ALA 58 CO -0.10 -0.01 0.18 0.82 0.00 0.00 0.00 179.25 180.14 1ofr h ILE 59 N 0.64 1.23 -0.53 0.00 2.04 -0.66 -2.02 117.51 118.20 1ofr h ILE 59 Ca 0.34 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 1ofr h ILE 59 Cb 0.32 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1ofr h ILE 59 CO -0.24 0.29 0.18 0.44 0.00 0.00 0.00 178.15 178.82 1ofr h ASP 60 N 0.77 0.76 -0.09 1.72 3.32 -0.58 -1.90 116.42 120.43 1ofr h ASP 60 Ca 0.18 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1ofr h ASP 60 Cb 0.27 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1ofr h ASP 60 CO -0.01 0.75 0.02 0.40 -1.72 0.00 0.00 179.24 178.69 1ofr h ILE 61 N 0.73 1.19 0.00 0.35 2.04 -1.11 0.32 117.51 121.03 1ofr h ILE 61 Ca 0.17 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1ofr h ILE 61 Cb 0.25 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 1ofr h ILE 61 CO -0.01 0.17 0.00 0.16 0.00 0.00 0.00 178.15 178.47 1ofr h ILE 62 N -0.07 0.00 -0.02 -0.67 3.07 -1.35 -2.98 117.51 115.50 1ofr h ILE 62 Ca 0.03 -0.55 0.00 0.00 1.55 0.00 0.00 64.86 65.89 1ofr h ILE 62 Cb 0.25 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.29 1ofr h ILE 62 CO 0.00 0.00 -0.13 0.35 -1.05 0.00 0.00 178.15 177.32 1ofr n THR 63 N -2.85 0.00 -0.38 0.16 -2.24 -0.72 -1.16 114.28 107.08 1ofr n THR 63 Ca 0.02 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1ofr n THR 63 Cb 0.34 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 1ofr n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ofr n GLY 64 N 1.31 0.70 0.21 3.38 0.00 -0.96 -4.94 105.19 104.90 1ofr n GLY 64 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1ofr n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ofr h LYS 65 N 4.10 0.00 -5.30 1.61 1.57 -1.21 -3.45 116.57 113.90 1ofr h LYS 65 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1ofr h LYS 65 Cb 0.00 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 32.01 1ofr h LYS 65 CO 0.00 0.00 -0.82 0.34 -0.57 0.00 0.00 179.45 178.40 1ofr s ASP 66 N -5.91 1.85 0.00 0.86 2.15 -0.86 -4.95 116.67 109.81 1ofr s ASP 66 Ca 0.07 -0.29 0.26 0.00 0.43 0.00 0.00 52.55 53.02 1ofr s ASP 66 Cb 0.06 -0.34 1.38 0.00 -0.30 0.00 0.00 42.92 43.73 1ofr s ASP 66 CO 0.65 0.16 1.91 -0.90 -0.17 0.00 0.00 175.17 176.82 1ofr n ASP 67 N 2.91 0.52 -4.34 -0.34 5.68 -1.26 -4.52 116.55 115.19 1ofr n ASP 67 Ca -0.16 -1.30 -0.30 0.00 -0.50 0.00 0.00 54.79 52.54 1ofr n ASP 67 Cb 0.54 -0.01 0.16 0.00 -1.14 0.00 0.00 41.12 40.67 1ofr n ASP 67 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ofr s ARG 68 N -1.97 0.84 -0.13 0.11 0.52 -1.26 -4.99 118.95 112.07 1ofr s ARG 68 Ca 0.39 -0.20 0.01 0.00 -0.52 0.00 0.00 55.73 55.41 1ofr s ARG 68 Cb 0.19 -1.85 -0.01 0.00 0.52 0.00 0.00 34.95 33.80 1ofr s ARG 68 CO 0.31 -2.31 -0.16 0.08 0.02 0.00 0.00 175.30 173.23 1ofr s VAL 69 N -3.69 2.73 -0.06 3.52 1.01 -0.95 -4.91 120.40 118.06 1ofr s VAL 69 Ca 0.70 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 1ofr s VAL 69 Cb -0.07 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1ofr s VAL 69 CO 0.52 0.53 1.13 -0.22 0.00 0.00 0.00 175.10 177.07 1ofr s LEU 70 N 0.41 4.28 -0.25 3.92 2.96 0.18 -1.83 118.68 128.35 1ofr s LEU 70 Ca -0.12 1.74 0.01 0.00 -0.22 0.00 0.00 54.13 55.54 1ofr s LEU 70 Cb -0.16 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.03 1ofr s LEU 70 CO 0.06 -0.52 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.83 1ofr s VAL 71 N 2.01 1.65 -0.64 1.68 1.01 -0.07 0.23 120.40 126.27 1ofr s VAL 71 Ca 0.54 -1.37 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 1ofr s VAL 71 Cb -0.23 -1.93 0.11 0.00 0.00 0.00 0.00 36.38 34.34 1ofr s VAL 71 CO 0.22 -0.15 0.75 -0.63 0.00 0.00 0.00 175.10 175.28 1ofr s ILE 72 N 1.33 4.85 0.01 2.22 -1.09 -0.81 -1.54 121.20 126.16 1ofr s ILE 72 Ca -0.05 -1.13 0.06 0.00 -2.23 0.00 0.00 60.65 57.30 1ofr s ILE 72 Cb -0.19 -4.52 -0.02 0.00 -1.58 0.00 0.00 42.46 36.16 1ofr s ILE 72 CO -0.07 -1.16 -0.18 0.54 -1.23 0.00 0.00 174.94 172.84 1ofr s VAL 73 N 2.55 1.44 0.00 2.92 0.11 -0.99 -1.37 120.40 125.05 1ofr s VAL 73 Ca 0.14 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 1ofr s VAL 73 Cb -0.22 -1.22 0.00 0.00 -1.53 0.00 0.00 36.38 33.41 1ofr s VAL 73 CO 0.04 0.31 0.00 0.61 -3.33 0.00 0.00 175.10 172.73 1ofr n GLY 74 N 2.38 0.25 3.21 6.54 0.00 -0.90 -1.01 105.19 115.66 1ofr n GLY 74 Ca -0.16 -1.23 -0.34 0.00 0.00 0.00 0.00 46.02 44.29 1ofr n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ofr n PRO 75 N -0.99 -0.18 0.05 1.61 -0.02 -0.58 -1.71 135.00 133.18 1ofr n PRO 75 Ca 0.00 -0.03 -0.04 0.00 -2.02 0.00 0.00 63.50 61.41 1ofr n PRO 75 Cb 0.00 -1.44 0.17 0.00 -0.02 0.00 0.00 33.50 32.21 1ofr n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ofr s SER 77 N -6.87 -0.39 -0.00 0.00 1.04 -1.26 -4.64 113.70 101.57 1ofr s SER 77 Ca -0.06 0.75 -0.19 0.00 0.48 0.00 0.00 55.95 56.94 1ofr s SER 77 Cb 0.13 0.76 -0.06 0.00 0.10 0.00 0.00 66.02 66.95 1ofr s SER 77 CO 0.79 -0.14 0.53 -0.63 0.98 0.00 0.00 173.24 174.78 1ofr s ILE 78 N 0.16 4.94 0.00 -1.02 -1.09 -0.98 -4.69 121.20 118.51 1ofr s ILE 78 Ca 0.04 1.11 0.00 0.00 -2.23 0.00 0.00 60.65 59.57 1ofr s ILE 78 Cb -0.05 -3.86 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 1ofr s ILE 78 CO -0.07 0.47 0.01 0.00 -1.23 0.00 0.00 174.94 174.11 1ofr n HIS 79 N 2.48 0.00 -3.84 3.97 1.44 -1.26 -4.58 115.22 113.44 1ofr n HIS 79 Ca -0.09 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.32 1ofr n HIS 79 Cb 0.51 0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.47 1ofr n HIS 79 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1ofr s ASP 80 N -0.13 3.88 0.59 4.39 -1.08 -1.26 -4.93 116.67 118.12 1ofr s ASP 80 Ca 0.00 -1.42 0.36 0.00 -0.52 0.00 0.00 52.55 50.96 1ofr s ASP 80 Cb 0.00 -1.02 1.78 0.00 -1.46 0.00 0.00 42.92 42.22 1ofr s ASP 80 CO 0.00 -0.34 2.15 -0.07 0.52 0.00 0.00 175.17 177.44 1ofr h LEU 81 N 8.01 0.00 0.33 -1.34 4.07 -1.98 -1.30 115.31 123.11 1ofr h LEU 81 Ca -0.14 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.80 1ofr h LEU 81 Cb 1.05 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.79 1ofr h LEU 81 CO 0.44 0.04 -0.16 -0.08 -1.08 0.00 0.00 178.44 177.59 1ofr h GLU 82 N 0.00 -0.43 -0.76 1.13 4.57 -1.99 -2.84 114.58 114.26 1ofr h GLU 82 Ca -0.00 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 1ofr h GLU 82 Cb 0.27 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.92 1ofr h GLU 82 CO 0.00 -0.25 0.50 0.00 -1.18 0.00 0.00 179.01 178.08 1ofr h ALA 83 N -1.04 1.50 0.00 2.92 0.00 -1.97 -0.85 119.26 119.82 1ofr h ALA 83 Ca -0.05 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1ofr h ALA 83 Cb 0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ofr h ALA 83 CO 0.08 0.44 -0.26 0.00 0.00 0.00 0.00 179.25 179.51 1ofr h ALA 84 N 1.54 1.55 0.01 0.00 0.00 -1.33 -1.75 119.26 119.28 1ofr h ALA 84 Ca 0.29 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1ofr h ALA 84 Cb -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ofr h ALA 84 CO -0.07 0.32 -1.00 0.37 0.00 0.00 0.00 179.25 178.87 1ofr h GLN 85 N 0.00 0.52 -0.01 0.00 5.75 -0.92 -2.14 115.11 118.32 1ofr h GLN 85 Ca -0.00 -0.57 -0.00 0.00 -0.15 0.00 0.00 58.65 57.92 1ofr h GLN 85 Cb 0.46 0.16 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 1ofr h GLN 85 CO 0.03 1.20 0.00 1.49 -2.65 0.00 0.00 178.83 178.91 1ofr h GLU 86 N 0.29 0.01 -0.59 1.69 4.81 -0.96 -2.30 114.58 117.52 1ofr h GLU 86 Ca -0.10 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.19 1ofr h GLU 86 Cb 1.64 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.96 1ofr h GLU 86 CO 0.18 0.14 0.28 -0.92 -0.73 0.00 0.00 179.01 177.96 1ofr h TYR 87 N -0.12 0.50 -1.00 0.92 5.03 -1.36 -1.82 116.97 119.12 1ofr h TYR 87 Ca 0.00 0.03 0.06 0.00 2.58 0.00 0.00 58.73 61.40 1ofr h TYR 87 Cb 0.13 -0.14 -0.07 0.00 1.55 0.00 0.00 36.73 38.21 1ofr h TYR 87 CO -0.03 0.20 0.65 0.00 -1.32 0.00 0.00 178.16 177.66 1ofr h ALA 88 N 1.35 1.38 0.07 1.82 0.00 -1.14 -0.30 119.26 122.44 1ofr h ALA 88 Ca 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ofr h ALA 88 Cb 0.25 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ofr h ALA 88 CO -0.22 0.46 -0.03 -0.07 0.00 0.00 0.00 179.25 179.38 1ofr h LEU 89 N 1.19 -0.08 0.44 0.00 -0.00 -0.77 0.21 115.31 116.30 1ofr h LEU 89 Ca 0.43 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.30 1ofr h LEU 89 Cb 0.14 0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 40.80 1ofr h LEU 89 CO -0.17 -0.05 -0.38 0.03 -0.00 0.00 0.00 178.44 177.87 1ofr h ARG 90 N -0.10 -0.80 -0.23 1.13 3.08 -1.06 -1.63 114.38 114.77 1ofr h ARG 90 Ca -0.01 0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.16 1ofr h ARG 90 Cb 0.08 0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1ofr h ARG 90 CO 0.02 -0.53 0.23 1.25 -1.07 0.00 0.00 179.97 179.86 1ofr h LEU 91 N -0.83 0.00 0.12 3.04 5.85 -0.94 -1.81 115.31 120.73 1ofr h LEU 91 Ca -0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1ofr h LEU 91 Cb 0.72 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.75 1ofr h LEU 91 CO -0.03 0.00 -0.06 0.50 -0.34 0.00 0.00 178.44 178.51 1ofr h LYS 92 N 0.00 -0.15 0.04 1.25 1.63 0.34 -2.59 116.57 117.08 1ofr h LYS 92 Ca 0.11 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.94 1ofr h LYS 92 Cb 0.57 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.19 1ofr h LYS 92 CO -0.00 0.29 -0.25 0.87 -3.45 0.00 0.00 179.45 176.90 1ofr h LYS 93 N -0.68 -0.40 -0.09 1.90 1.57 -0.70 0.15 116.57 118.31 1ofr h LYS 93 Ca -0.02 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1ofr h LYS 93 Cb 0.51 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 1ofr h LYS 93 CO 0.03 -0.27 0.40 1.25 -0.57 0.00 0.00 179.45 180.29 1ofr h LEU 94 N -0.41 0.00 0.02 2.94 5.85 -1.44 0.30 115.31 122.56 1ofr h LEU 94 Ca 0.05 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.54 1ofr h LEU 94 Cb 0.48 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1ofr h LEU 94 CO -0.20 0.00 -1.17 0.28 -0.34 0.00 0.00 178.44 177.01 1ofr h SER 95 N 0.00 0.06 0.86 1.25 0.02 -0.55 -2.97 113.55 112.21 1ofr h SER 95 Ca 0.04 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 1ofr h SER 95 Cb 0.84 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.35 1ofr h SER 95 CO -0.00 1.05 -0.28 0.44 -1.14 0.00 0.00 176.83 176.90 1ofr h ASP 96 N 0.01 0.00 0.00 3.07 3.32 -0.10 0.32 116.42 123.04 1ofr h ASP 96 Ca -0.08 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 1ofr h ASP 96 Cb 1.84 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.39 1ofr h ASP 96 CO 0.13 0.28 -0.00 -0.08 -1.72 0.00 0.00 179.24 177.85 1ofr h GLU 97 N 0.00 -0.00 -0.13 3.56 4.81 -1.54 -3.36 114.58 117.92 1ofr h GLU 97 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ofr h GLU 97 Cb 0.78 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1ofr h GLU 97 CO 0.04 0.80 0.00 1.28 -0.73 0.00 0.00 179.01 180.40 1ofr n LEU 98 N -4.65 2.12 0.07 1.64 4.77 -1.12 -4.36 117.00 115.48 1ofr n LEU 98 Ca -0.08 -0.81 0.04 0.00 -0.03 0.00 0.00 56.01 55.13 1ofr n LEU 98 Cb 0.39 -0.08 0.20 0.00 -2.33 0.00 0.00 43.42 41.61 1ofr n LEU 98 CO 0.28 0.41 0.64 2.29 -1.33 0.00 0.00 177.39 179.67 1ofr n LYS 99 N 0.64 0.05 0.12 3.23 -0.00 0.11 0.16 118.16 122.48 1ofr n LYS 99 Ca 0.17 0.48 0.12 0.00 -0.00 0.00 0.00 58.31 59.08 1ofr n LYS 99 Cb 0.43 -1.80 0.17 0.00 -0.00 0.00 0.00 35.03 33.82 1ofr n LYS 99 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1ofr h GLY 100 N 0.00 0.00 0.00 2.58 0.00 -1.83 -3.39 103.07 100.43 1ofr h GLY 100 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1ofr h GLY 100 CO 0.00 0.00 -1.05 1.22 0.00 0.00 0.00 176.54 176.71 1ofr n ASP 101 N -2.56 4.39 -4.33 0.19 8.00 0.12 -4.95 116.55 117.41 1ofr n ASP 101 Ca 0.03 -0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.22 1ofr n ASP 101 Cb 0.49 0.26 -0.15 0.00 -0.02 0.00 0.00 41.12 41.70 1ofr n ASP 101 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ofr s LEU 102 N -4.54 2.12 -0.41 0.64 1.43 0.64 -2.24 118.68 116.31 1ofr s LEU 102 Ca -0.01 -0.54 -0.12 0.00 -1.03 0.00 0.00 54.13 52.43 1ofr s LEU 102 Cb 0.00 -1.31 0.05 0.00 0.03 0.00 0.00 46.19 44.96 1ofr s LEU 102 CO 0.02 0.28 0.28 -0.55 0.23 0.00 0.00 176.35 176.61 1ofr s SER 103 N -1.00 5.85 -0.25 2.29 0.15 -0.76 -4.08 113.70 115.91 1ofr s SER 103 Ca 0.11 -1.20 -0.12 0.00 0.70 0.00 0.00 55.95 55.44 1ofr s SER 103 Cb -0.10 -2.07 -0.05 0.00 -1.71 0.00 0.00 66.02 62.10 1ofr s SER 103 CO 0.01 -0.49 0.24 -0.63 1.20 0.00 0.00 173.24 173.56 1ofr s ILE 104 N 1.56 5.30 -0.04 6.45 1.01 -1.26 -0.89 121.20 133.32 1ofr s ILE 104 Ca 0.03 0.32 0.04 0.00 0.00 0.00 0.00 60.65 61.04 1ofr s ILE 104 Cb -0.21 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1ofr s ILE 104 CO 0.06 0.28 -0.15 -0.63 0.00 0.00 0.00 174.94 174.51 1ofr s ILE 105 N 1.38 3.04 -0.00 2.92 1.01 -0.59 -4.45 121.20 124.51 1ofr s ILE 105 Ca 0.10 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.88 1ofr s ILE 105 Cb -0.15 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1ofr s ILE 105 CO 0.07 0.58 0.36 -0.32 0.00 0.00 0.00 174.94 175.63 1ofr s MET 106 N -0.77 3.79 -0.22 2.79 -2.45 0.47 -2.35 119.30 120.56 1ofr s MET 106 Ca 0.12 0.25 -0.29 0.00 -1.25 0.00 0.00 55.69 54.52 1ofr s MET 106 Cb -0.11 -3.17 -0.00 0.00 1.25 0.00 0.00 34.83 32.80 1ofr s MET 106 CO 0.01 0.68 1.23 1.03 1.05 0.00 0.00 175.02 179.02 1ofr s ARG 107 N -1.27 4.14 -0.39 4.11 0.52 -0.18 -0.19 118.95 125.69 1ofr s ARG 107 Ca 0.24 1.47 0.12 0.00 -0.52 0.00 0.00 55.73 57.05 1ofr s ARG 107 Cb -0.15 -3.78 0.41 0.00 0.52 0.00 0.00 34.95 31.95 1ofr s ARG 107 CO 0.13 -0.83 0.92 0.00 0.02 0.00 0.00 175.30 175.55 1ofr n ALA 108 N 6.88 3.53 -1.77 2.13 0.00 -0.70 -4.04 120.51 126.55 1ofr n ALA 108 Ca 0.14 -3.63 -0.39 0.00 0.00 0.00 0.00 53.44 49.55 1ofr n ALA 108 Cb 0.46 -0.83 -0.04 0.00 0.00 0.00 0.00 19.45 19.04 1ofr n ALA 108 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1ofr s TYR 109 N -3.07 3.38 -0.30 0.00 1.51 -1.26 -4.65 117.35 112.96 1ofr s TYR 109 Ca 0.37 1.64 0.20 0.00 -1.01 0.00 0.00 57.07 58.27 1ofr s TYR 109 Cb 0.40 -3.32 0.18 0.00 -0.11 0.00 0.00 41.96 39.11 1ofr s TYR 109 CO -0.06 -0.83 1.44 -0.07 -1.11 0.00 0.00 175.55 174.92 1ofr h LEU 110 N 3.34 0.00 0.00 -1.29 -0.00 -1.89 -2.61 115.31 112.85 1ofr h LEU 110 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.40 1ofr h LEU 110 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 1ofr h LEU 110 CO 0.65 0.20 0.00 -1.84 -0.00 0.00 0.00 178.44 177.45 1ofr n GLU 111 N -3.08 0.00 -3.76 1.13 0.00 -1.26 -0.66 120.64 113.00 1ofr n GLU 111 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 57.16 56.94 1ofr n GLU 111 Cb 0.62 0.00 -0.17 0.00 0.00 0.00 0.00 31.44 31.89 1ofr n GLU 111 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 1ofr s LYS 112 N -1.48 0.63 -0.82 3.44 2.47 -1.26 -4.83 119.74 117.89 1ofr s LYS 112 Ca 0.00 -0.02 -0.20 0.00 -1.56 0.00 0.00 55.97 54.19 1ofr s LYS 112 Cb 0.00 -1.25 -0.19 0.00 -1.46 0.00 0.00 37.83 34.94 1ofr s LYS 112 CO 0.00 -0.38 2.14 -0.35 0.16 0.00 0.00 175.35 176.92 1ofr n PRO 113 N 5.12 0.28 -0.45 4.03 -0.04 -1.26 -4.94 135.00 137.74 1ofr n PRO 113 Ca -0.08 -0.82 0.00 0.00 -0.04 0.00 0.00 63.50 62.56 1ofr n PRO 113 Cb 0.49 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 30.98 1ofr n PRO 113 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ofr n ARG 114 N 7.56 2.83 -3.68 0.54 1.74 -1.26 -5.12 116.66 119.27 1ofr n ARG 114 Ca 0.44 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.36 1ofr n ARG 114 Cb 0.39 0.00 -0.15 0.00 -1.02 0.00 0.00 32.46 31.68 1ofr n ARG 114 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1ofr s VAL 117 N 1.10 -0.24 0.00 1.55 -7.23 -1.26 -5.11 120.40 109.21 1ofr s VAL 117 Ca 0.00 0.32 0.00 0.00 -1.81 0.00 0.00 61.98 60.49 1ofr s VAL 117 Cb 0.00 -0.30 0.00 0.00 0.56 0.00 0.00 36.38 36.64 1ofr s VAL 117 CO 0.00 0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 1ofr n GLY 118 N 5.16 5.54 2.94 2.32 0.00 -1.26 -5.08 105.19 114.81 1ofr n GLY 118 Ca -0.08 -0.93 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 1ofr n GLY 118 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1ofr n TRP 119 N 0.00 0.69 -0.19 1.61 -0.00 -1.26 -4.81 117.44 113.49 1ofr n TRP 119 Ca 0.00 0.46 0.26 0.00 -0.00 0.00 0.00 57.50 58.23 1ofr n TRP 119 Cb 0.00 -2.03 0.68 0.00 -0.00 0.00 0.00 31.31 29.96 1ofr n TRP 119 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 1ofr h LYS 120 N 9.33 0.08 0.00 5.87 1.79 -1.92 -3.43 116.57 128.29 1ofr h LYS 120 Ca -0.06 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1ofr h LYS 120 Cb 1.17 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 1ofr h LYS 120 CO 1.10 0.05 0.00 0.41 -1.08 0.00 0.00 179.45 179.93 1ofr n GLY 121 N -1.67 0.25 0.16 3.86 0.00 -1.26 -4.69 105.19 101.84 1ofr n GLY 121 Ca 0.18 -1.73 0.12 0.00 0.00 0.00 0.00 46.02 44.59 1ofr n GLY 121 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ofr h LEU 122 N 0.00 0.00 0.00 0.99 5.85 -1.11 -2.86 115.31 118.18 1ofr h LEU 122 Ca 0.00 -0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1ofr h LEU 122 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1ofr h LEU 122 CO 0.00 0.00 -0.79 -0.38 -0.34 0.00 0.00 178.44 176.93 1ofr n ILE 123 N -2.86 1.45 -0.37 4.05 5.41 -1.26 -3.23 119.36 122.56 1ofr n ILE 123 Ca 0.02 0.14 0.03 0.00 1.00 0.00 0.00 62.75 63.93 1ofr n ILE 123 Cb 0.54 -2.30 0.18 0.00 -0.71 0.00 0.00 39.64 37.35 1ofr n ILE 123 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 1ofr h ASN 124 N -1.00 1.04 -2.39 4.38 2.35 -1.84 -3.31 115.58 114.81 1ofr h ASN 124 Ca -0.10 0.01 -0.59 0.00 -0.55 0.00 0.00 56.30 55.07 1ofr h ASN 124 Cb 0.77 -0.21 -0.38 0.00 0.05 0.00 0.00 38.32 38.54 1ofr h ASN 124 CO -0.06 0.66 -0.96 -0.62 -1.65 0.00 0.00 177.43 174.80 1ofr s ASP 125 N -5.92 1.59 0.17 5.81 3.68 -1.08 -2.82 116.67 118.10 1ofr s ASP 125 Ca -0.12 -2.97 -0.14 0.00 2.13 0.00 0.00 52.55 51.45 1ofr s ASP 125 Cb 0.20 -0.43 0.09 0.00 -1.45 0.00 0.00 42.92 41.33 1ofr s ASP 125 CO 0.81 -0.19 1.80 1.55 0.13 0.00 0.00 175.17 179.27 1ofr h PRO 126 N 5.79 0.50 -0.62 4.34 0.13 -1.69 -2.90 132.00 137.55 1ofr h PRO 126 Ca 0.24 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1ofr h PRO 126 Cb 0.92 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1ofr h PRO 126 CO 0.36 0.33 0.00 -0.25 -0.23 0.00 0.00 178.00 178.21 1ofr n ASP 127 N -4.86 3.10 -3.34 1.44 8.00 -1.26 -4.96 116.55 114.67 1ofr n ASP 127 Ca 0.03 -2.31 -0.30 0.00 0.71 0.00 0.00 54.79 52.92 1ofr n ASP 127 Cb 0.10 -0.47 0.02 0.00 -0.02 0.00 0.00 41.12 40.74 1ofr n ASP 127 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1ofr n VAL 128 N 0.51 -3.10 -2.28 2.53 3.14 -1.09 -4.63 118.33 113.42 1ofr n VAL 128 Ca 0.15 0.03 -0.05 0.00 -2.96 0.00 0.00 64.34 61.52 1ofr n VAL 128 Cb 0.61 -2.81 0.01 0.00 -1.06 0.00 0.00 33.84 30.59 1ofr n VAL 128 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 1ofr n ASN 129 N -0.85 -1.07 0.00 6.55 0.23 -1.26 -4.03 115.26 114.83 1ofr n ASN 129 Ca -0.16 -2.08 0.00 0.00 -0.53 0.00 0.00 54.58 51.81 1ofr n ASN 129 Cb 0.60 0.41 0.00 0.00 -2.08 0.00 0.00 39.78 38.71 1ofr n ASN 129 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1ofr n ASN 130 N -0.57 0.00 -4.77 0.53 5.15 -1.26 -4.93 115.26 109.41 1ofr n ASN 130 Ca -0.23 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.36 1ofr n ASN 130 Cb 0.78 -1.40 -0.06 0.00 -0.53 0.00 0.00 39.78 38.57 1ofr n ASN 130 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1ofr s THR 131 N -1.30 4.41 0.10 -0.44 2.01 -1.26 -5.06 115.64 114.10 1ofr s THR 131 Ca 0.00 1.72 -0.02 0.00 0.31 0.00 0.00 61.69 63.70 1ofr s THR 131 Cb 0.00 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 1ofr s THR 131 CO 0.00 0.49 0.28 -0.36 -0.69 0.00 0.00 174.62 174.34 1ofr s PHE 132 N -0.96 3.50 -0.33 4.92 0.40 -1.26 -4.45 117.98 119.80 1ofr s PHE 132 Ca 0.37 0.36 0.03 0.00 -0.60 0.00 0.00 56.93 57.09 1ofr s PHE 132 Cb -0.23 -1.85 0.14 0.00 0.51 0.00 0.00 43.02 41.60 1ofr s PHE 132 CO 0.26 0.52 1.14 -1.71 0.70 0.00 0.00 175.22 176.13 1ofr n ASN 133 N 0.15 -1.30 -0.38 1.36 5.15 -1.13 -5.02 115.26 114.09 1ofr n ASN 133 Ca -0.04 -1.84 0.33 0.00 -0.60 0.00 0.00 54.58 52.43 1ofr n ASN 133 Cb 0.51 1.04 0.56 0.00 -0.53 0.00 0.00 39.78 41.37 1ofr n ASN 133 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1ofr n ILE 134 N -0.42 -0.23 -0.05 -1.44 -0.00 -1.25 -0.06 119.36 115.92 1ofr n ILE 134 Ca -0.21 1.53 -0.11 0.00 -0.00 0.00 0.00 62.75 63.97 1ofr n ILE 134 Cb 0.69 -2.51 -0.05 0.00 -0.00 0.00 0.00 39.64 37.77 1ofr n ILE 134 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.55 177.33 1ofr h ASN 135 N 0.00 0.24 0.73 4.38 2.35 -1.92 0.46 115.58 121.82 1ofr h ASN 135 Ca 0.74 -0.14 -0.09 0.00 -0.55 0.00 0.00 56.30 56.26 1ofr h ASN 135 Cb 2.34 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 40.63 1ofr h ASN 135 CO -0.42 0.32 -0.42 0.50 -1.65 0.00 0.00 177.43 175.76 1ofr h LYS 136 N 0.15 0.00 -0.07 0.81 3.64 -0.83 -2.20 116.57 118.06 1ofr h LYS 136 Ca 0.06 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1ofr h LYS 136 Cb 0.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1ofr h LYS 136 CO -0.01 0.42 0.02 0.78 -2.27 0.00 0.00 179.45 178.39 1ofr h GLY 137 N 1.87 0.13 1.82 5.01 0.00 -0.38 -1.05 103.07 110.46 1ofr h GLY 137 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 1ofr h GLY 137 CO 0.05 0.08 -0.05 1.41 0.00 0.00 0.00 176.54 178.03 1ofr h LEU 138 N -0.10 0.21 -0.27 3.11 3.38 0.10 0.15 115.31 121.89 1ofr h LEU 138 Ca 0.02 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1ofr h LEU 138 Cb 0.26 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1ofr h LEU 138 CO 0.00 0.31 -0.11 1.56 0.09 0.00 0.00 178.44 180.29 1ofr h GLN 139 N 0.23 0.55 0.12 1.13 4.20 -1.10 -0.01 115.11 120.22 1ofr h GLN 139 Ca 0.05 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 1ofr h GLN 139 Cb 0.25 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1ofr h GLN 139 CO 0.01 0.78 -0.06 0.77 -0.67 0.00 0.00 178.83 179.66 1ofr h SER 140 N 0.29 -0.14 -0.05 1.46 0.02 -0.77 0.21 113.55 114.57 1ofr h SER 140 Ca 0.06 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1ofr h SER 140 Cb 0.60 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 1ofr h SER 140 CO 0.03 0.04 -0.19 0.00 -1.14 0.00 0.00 176.83 175.58 1ofr h ALA 141 N 0.55 -0.58 -0.64 3.77 0.00 -0.65 0.34 119.26 122.05 1ofr h ALA 141 Ca -0.02 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.97 1ofr h ALA 141 Cb 0.25 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 1ofr h ALA 141 CO 0.03 -0.65 0.26 -0.09 0.00 0.00 0.00 179.25 178.80 1ofr h ARG 142 N -0.20 0.44 -0.13 0.00 2.43 -0.95 -1.13 114.38 114.85 1ofr h ARG 142 Ca 0.01 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1ofr h ARG 142 Cb 0.23 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 1ofr h ARG 142 CO -0.15 0.29 -0.10 0.37 -1.51 0.00 0.00 179.97 178.87 1ofr h GLN 143 N 0.45 -0.11 0.03 0.20 5.75 -0.06 -1.16 115.11 120.22 1ofr h GLN 143 Ca 0.32 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.85 1ofr h GLN 143 Cb 0.39 0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.91 1ofr h GLN 143 CO -0.30 -0.07 -0.51 1.25 -2.65 0.00 0.00 178.83 176.55 1ofr h LEU 144 N -0.11 -1.57 -1.07 -2.39 5.85 0.59 0.14 115.31 116.76 1ofr h LEU 144 Ca 0.08 0.17 0.23 0.00 0.84 0.00 0.00 57.88 59.21 1ofr h LEU 144 Cb 0.23 0.59 -0.11 0.00 0.37 0.00 0.00 40.66 41.74 1ofr h LEU 144 CO -0.19 -0.51 0.61 -0.26 -0.34 0.00 0.00 178.44 177.75 1ofr h PHE 145 N -0.67 0.97 -0.17 1.25 -1.00 -1.00 -0.22 116.94 116.12 1ofr h PHE 145 Ca 0.01 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.78 1ofr h PHE 145 Cb 0.70 -0.28 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 1ofr h PHE 145 CO -0.50 0.12 -0.07 0.28 -1.61 0.00 0.00 178.31 176.54 1ofr h VAL 146 N 0.61 1.30 -0.53 -0.55 2.07 0.10 -1.72 116.25 117.53 1ofr h VAL 146 Ca 0.62 -1.08 0.08 0.00 0.82 0.00 0.00 66.70 67.13 1ofr h VAL 146 Cb 1.17 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 32.54 1ofr h VAL 146 CO -0.42 0.32 0.19 0.78 0.02 0.00 0.00 177.57 178.46 1ofr h ASN 147 N 0.03 0.19 0.59 0.57 2.35 0.88 0.54 115.58 120.73 1ofr h ASN 147 Ca 0.04 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1ofr h ASN 147 Cb 0.53 0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.95 1ofr h ASN 147 CO 0.02 0.13 -0.28 -0.07 -1.65 0.00 0.00 177.43 175.58 1ofr h LEU 148 N 0.37 -0.67 -2.57 1.61 3.38 -1.13 -2.98 115.31 113.32 1ofr h LEU 148 Ca 0.26 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1ofr h LEU 148 Cb 0.29 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ofr h LEU 148 CO -0.27 -0.30 0.00 0.71 0.09 0.00 0.00 178.44 178.68 1ofr h THR 149 N -1.11 0.00 0.00 0.22 1.35 -1.27 -1.55 112.91 110.55 1ofr h THR 149 Ca -0.08 -0.02 -0.05 0.00 -0.55 0.00 0.00 66.41 65.71 1ofr h THR 149 Cb 0.66 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.96 1ofr h THR 149 CO 0.13 0.00 -0.26 -1.13 -0.25 0.00 0.00 175.52 174.01 1ofr h ASN 150 N 0.00 0.00 -0.57 5.36 -1.24 -0.73 -2.63 115.58 115.77 1ofr h ASN 150 Ca 0.00 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.98 1ofr h ASN 150 Cb 0.02 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.05 1ofr h ASN 150 CO 0.00 0.26 0.04 2.30 -1.29 0.00 0.00 177.43 178.74 1ofr n ILE 151 N -3.46 2.65 -1.00 2.57 -5.35 -0.59 -4.70 119.36 109.48 1ofr n ILE 151 Ca -0.00 -1.36 -0.00 0.00 -0.27 0.00 0.00 62.75 61.12 1ofr n ILE 151 Cb 0.44 -0.31 -0.00 0.00 -1.74 0.00 0.00 39.64 38.03 1ofr n ILE 151 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ofr n GLY 152 N 0.49 0.46 3.38 3.28 0.00 -0.99 -5.03 105.19 106.78 1ofr n GLY 152 Ca 0.28 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1ofr n GLY 152 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ofr s LEU 153 N -0.02 4.15 0.82 0.99 2.96 -1.22 -4.96 118.68 121.40 1ofr s LEU 153 Ca 0.00 -0.71 -0.12 0.00 -0.22 0.00 0.00 54.13 53.08 1ofr s LEU 153 Cb 0.00 -1.96 0.09 0.00 0.50 0.00 0.00 46.19 44.83 1ofr s LEU 153 CO 0.00 -0.24 1.16 -2.84 -1.32 0.00 0.00 176.35 173.11 1ofr s PRO 154 N 1.55 1.64 0.09 0.98 0.02 -1.26 -3.58 135.00 134.45 1ofr s PRO 154 Ca 0.03 1.56 0.04 0.00 0.02 0.00 0.00 61.00 62.65 1ofr s PRO 154 Cb -0.18 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 1ofr s PRO 154 CO 0.05 -2.17 -0.11 0.96 -0.33 0.00 0.00 177.00 175.40 1ofr s ILE 155 N -2.45 0.98 0.09 2.83 -4.36 -1.26 -0.39 121.20 116.63 1ofr s ILE 155 Ca 0.69 -1.57 0.07 0.00 -0.26 0.00 0.00 60.65 59.57 1ofr s ILE 155 Cb -0.24 -1.29 -0.03 0.00 1.25 0.00 0.00 42.46 42.14 1ofr s ILE 155 CO 0.53 -0.49 -0.19 -0.83 0.24 0.00 0.00 174.94 174.20 1ofr s GLY 156 N -2.31 1.11 0.16 6.27 0.00 0.74 -1.51 107.32 111.78 1ofr s GLY 156 Ca 0.04 -1.14 -0.06 0.00 0.00 0.00 0.00 44.72 43.56 1ofr s GLY 156 CO 0.01 -1.14 0.22 -0.45 0.00 0.00 0.00 173.10 171.73 1ofr s SER 157 N -1.75 0.12 -0.10 1.64 0.15 -0.27 -1.72 113.70 111.76 1ofr s SER 157 Ca 0.04 -1.02 -0.17 0.00 0.70 0.00 0.00 55.95 55.50 1ofr s SER 157 Cb -0.10 0.40 -0.04 0.00 -1.71 0.00 0.00 66.02 64.57 1ofr s SER 157 CO 0.03 -0.86 0.45 -0.70 1.20 0.00 0.00 173.24 173.37 1ofr s GLU 158 N -4.01 4.28 -1.07 5.44 2.12 -1.26 -1.67 118.70 122.53 1ofr s GLU 158 Ca 0.21 0.42 -0.21 0.00 0.36 0.00 0.00 54.97 55.76 1ofr s GLU 158 Cb 0.05 -3.40 0.07 0.00 0.26 0.00 0.00 34.13 31.10 1ofr s GLU 158 CO 0.02 0.24 1.46 -1.64 -0.54 0.00 0.00 175.26 174.81 1ofr s MET 159 N 0.36 3.70 0.00 4.30 -1.94 -1.00 -4.89 119.30 119.82 1ofr s MET 159 Ca 0.25 -1.46 0.00 0.00 -1.71 0.00 0.00 55.69 52.77 1ofr s MET 159 Cb -0.15 -5.32 0.00 0.00 2.01 0.00 0.00 34.83 31.37 1ofr s MET 159 CO 0.10 -2.14 0.99 1.28 -0.01 0.00 0.00 175.02 175.25 1ofr n LEU 160 N 8.32 0.00 0.00 -0.03 7.99 -1.26 -4.82 117.00 127.20 1ofr n LEU 160 Ca 0.35 0.99 0.00 0.00 -0.01 0.00 0.00 56.01 57.34 1ofr n LEU 160 Cb 0.49 -0.49 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1ofr n LEU 160 CO 0.66 -0.49 0.00 -0.90 -1.51 0.00 0.00 177.39 175.15 1ofr n ASP 161 N -2.00 1.60 -1.51 -1.43 5.68 -1.26 -5.04 116.55 112.59 1ofr n ASP 161 Ca 0.00 -0.42 0.08 0.00 -0.50 0.00 0.00 54.79 53.95 1ofr n ASP 161 Cb 0.00 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.33 1ofr n ASP 161 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1ofr n THR 162 N -0.09 2.29 0.01 2.12 -2.24 -1.26 -4.55 114.28 110.57 1ofr n THR 162 Ca 0.00 -1.44 0.00 0.00 -2.27 0.00 0.00 64.05 60.34 1ofr n THR 162 Cb 0.00 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 1ofr n THR 162 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1ofr n ILE 163 N 0.51 0.12 -0.35 2.28 5.41 -1.26 -4.51 119.36 121.56 1ofr n ILE 163 Ca 0.25 0.04 0.23 0.00 1.00 0.00 0.00 62.75 64.27 1ofr n ILE 163 Cb 1.00 -1.32 0.47 0.00 -0.71 0.00 0.00 39.64 39.08 1ofr n ILE 163 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1ofr h SER 164 N 0.00 0.53 -0.73 4.38 0.02 -1.99 0.16 113.55 115.91 1ofr h SER 164 Ca 0.00 0.15 0.08 0.00 -0.84 0.00 0.00 61.79 61.18 1ofr h SER 164 Cb 0.71 0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.28 1ofr h SER 164 CO 0.00 -0.02 0.48 -0.65 -1.14 0.00 0.00 176.83 175.50 1ofr h PRO 165 N 0.40 0.66 -0.11 3.45 0.11 -1.87 -1.59 132.00 133.05 1ofr h PRO 165 Ca 0.69 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.75 1ofr h PRO 165 Cb 1.59 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.54 1ofr h PRO 165 CO -0.48 0.44 0.04 1.96 -0.21 0.00 0.00 178.00 179.74 1ofr h GLN 166 N 0.68 0.15 0.00 1.05 1.08 -1.27 1.20 115.11 117.99 1ofr h GLN 166 Ca 0.33 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1ofr h GLN 166 Cb 0.39 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1ofr h GLN 166 CO -0.11 0.13 -0.15 0.66 -0.95 0.00 0.00 178.83 178.41 1ofr n TYR 167 N -4.48 0.55 0.00 2.96 4.02 -0.61 -4.43 117.16 115.17 1ofr n TYR 167 Ca -0.01 0.16 0.00 0.00 -0.01 0.00 0.00 57.90 58.04 1ofr n TYR 167 Cb 0.11 -0.72 0.00 0.00 -0.02 0.00 0.00 39.34 38.71 1ofr n TYR 167 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1ofr n LEU 168 N -1.98 0.00 -0.32 7.72 4.77 -0.69 -4.83 117.00 121.68 1ofr n LEU 168 Ca 0.06 -0.06 0.19 0.00 -0.03 0.00 0.00 56.01 56.16 1ofr n LEU 168 Cb 0.40 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.87 1ofr n LEU 168 CO 0.31 0.00 0.99 0.00 -1.33 0.00 0.00 177.39 177.36 1ofr h ALA 169 N 0.00 1.57 0.00 -1.18 0.00 0.12 -0.88 119.26 118.90 1ofr h ALA 169 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ofr h ALA 169 Cb 0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ofr h ALA 169 CO 0.00 -0.57 0.11 0.38 0.00 0.00 0.00 179.25 179.17 1ofr h ASP 170 N 0.19 0.00 -0.00 0.00 2.03 -1.89 -2.49 116.42 114.27 1ofr h ASP 170 Ca 0.65 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.95 1ofr h ASP 170 Cb 1.44 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.94 1ofr h ASP 170 CO -0.69 0.00 -0.56 0.18 -1.03 0.00 0.00 179.24 177.13 1ofr n LEU 171 N -2.73 0.58 -4.76 0.15 4.77 -0.34 -4.85 117.00 109.81 1ofr n LEU 171 Ca -0.02 -0.50 -0.39 0.00 -0.03 0.00 0.00 56.01 55.06 1ofr n LEU 171 Cb 0.16 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1ofr n LEU 171 CO 0.14 0.14 0.39 -0.69 -1.33 0.00 0.00 177.39 176.05 1ofr s VAL 172 N -2.13 4.73 -0.08 4.08 1.01 -0.94 -4.56 120.40 122.50 1ofr s VAL 172 Ca 0.05 1.48 0.15 0.00 0.00 0.00 0.00 61.98 63.66 1ofr s VAL 172 Cb 0.09 -4.04 -0.23 0.00 0.00 0.00 0.00 36.38 32.20 1ofr s VAL 172 CO 0.49 0.43 0.23 -1.20 0.00 0.00 0.00 175.10 175.05 1ofr n SER 173 N 2.45 1.19 -3.86 3.32 7.64 -0.57 -4.87 113.62 118.92 1ofr n SER 173 Ca -0.05 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.71 1ofr n SER 173 Cb 0.50 1.39 -0.13 0.00 -1.01 0.00 0.00 64.21 64.96 1ofr n SER 173 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1ofr s PHE 174 N -2.82 -0.03 -0.01 1.43 5.36 -1.14 -4.10 117.98 116.67 1ofr s PHE 174 Ca -0.07 0.08 0.03 0.00 -0.96 0.00 0.00 56.93 56.01 1ofr s PHE 174 Cb 0.08 0.00 -0.00 0.00 -0.34 0.00 0.00 43.02 42.76 1ofr s PHE 174 CO 0.67 -0.05 -0.09 0.20 -1.46 0.00 0.00 175.22 174.49 1ofr s GLY 175 N -0.15 0.46 -0.08 13.12 0.00 -0.53 -1.12 107.32 119.03 1ofr s GLY 175 Ca -0.02 -0.37 0.02 0.00 0.00 0.00 0.00 44.72 44.36 1ofr s GLY 175 CO 0.00 -0.26 -0.15 0.00 0.00 0.00 0.00 173.10 172.69 1ofr s ALA 176 N -0.10 1.50 -0.16 3.20 0.00 -0.67 0.33 121.76 125.86 1ofr s ALA 176 Ca 0.02 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.19 1ofr s ALA 176 Cb -0.05 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 1ofr s ALA 176 CO -0.00 0.11 0.66 0.42 0.00 0.00 0.00 175.76 176.95 1ofr s ILE 177 N 0.68 5.02 1.14 0.00 -1.09 0.16 -2.38 121.20 124.71 1ofr s ILE 177 Ca -0.14 1.29 -0.16 0.00 -2.23 0.00 0.00 60.65 59.42 1ofr s ILE 177 Cb -0.16 -3.98 0.19 0.00 -1.58 0.00 0.00 42.46 36.92 1ofr s ILE 177 CO 0.04 0.14 0.50 0.61 -1.23 0.00 0.00 174.94 175.00 1ofr n GLY 178 N 3.55 -2.23 0.17 6.18 0.00 -1.26 -3.12 105.19 108.49 1ofr n GLY 178 Ca -0.01 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.07 1ofr n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ofr h ALA 179 N -2.33 1.22 -0.00 4.61 0.00 -1.86 -2.65 119.26 118.25 1ofr h ALA 179 Ca -0.57 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 53.94 1ofr h ALA 179 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1ofr h ALA 179 CO 0.43 0.56 -0.01 0.54 0.00 0.00 0.00 179.25 180.77 1ofr n ARG 180 N -3.94 1.05 0.00 0.00 1.74 -1.26 -3.84 116.66 110.42 1ofr n ARG 180 Ca -0.02 -0.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.90 1ofr n ARG 180 Cb 0.48 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1ofr n ARG 180 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1ofr n THR 181 N -0.83 0.00 -0.15 0.55 -2.24 -1.07 -4.78 114.28 105.76 1ofr n THR 181 Ca 0.22 -0.35 0.24 0.00 -2.27 0.00 0.00 64.05 61.89 1ofr n THR 181 Cb 0.17 1.07 0.66 0.00 -2.10 0.00 0.00 70.33 70.13 1ofr n THR 181 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1ofr h THR 182 N 0.07 0.63 0.00 4.28 2.02 -1.58 0.10 112.91 118.43 1ofr h THR 182 Ca 0.00 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.11 1ofr h THR 182 Cb 0.04 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1ofr h THR 182 CO 0.00 0.02 -0.43 -0.33 0.37 0.00 0.00 175.52 175.15 1ofr h GLU 183 N 0.10 0.00 -6.25 6.66 5.08 -1.86 -3.43 114.58 114.89 1ofr h GLU 183 Ca 0.39 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 58.20 1ofr h GLU 183 Cb 1.40 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.66 1ofr h GLU 183 CO -0.05 0.13 1.27 0.45 -1.00 0.00 0.00 179.01 179.81 1ofr s SER 184 N -6.05 6.22 0.18 1.42 0.15 0.36 -4.89 113.70 111.09 1ofr s SER 184 Ca 0.04 2.29 -0.13 0.00 0.70 0.00 0.00 55.95 58.85 1ofr s SER 184 Cb 0.07 -2.53 0.17 0.00 -1.71 0.00 0.00 66.02 62.02 1ofr s SER 184 CO 0.72 -1.29 1.73 -0.61 1.20 0.00 0.00 173.24 174.99 1ofr h GLN 185 N 11.59 0.27 -1.00 5.44 5.75 -1.89 -1.51 115.11 133.76 1ofr h GLN 185 Ca -0.44 -0.02 0.20 0.00 -0.15 0.00 0.00 58.65 58.24 1ofr h GLN 185 Cb 1.22 -0.06 -0.11 0.00 1.07 0.00 0.00 27.48 29.60 1ofr h GLN 185 CO 0.96 0.18 0.61 1.25 -2.65 0.00 0.00 178.83 179.18 1ofr h LEU 186 N 0.28 0.75 0.00 -2.39 5.85 -1.94 0.12 115.31 117.98 1ofr h LEU 186 Ca 0.23 0.10 0.00 0.00 0.84 0.00 0.00 57.88 59.06 1ofr h LEU 186 Cb 0.28 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1ofr h LEU 186 CO -0.28 0.24 -0.17 0.45 -0.34 0.00 0.00 178.44 178.34 1ofr h HIS 187 N 0.71 0.00 -0.00 1.25 3.86 -1.58 -2.29 115.15 117.10 1ofr h HIS 187 Ca 0.59 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.69 1ofr h HIS 187 Cb 0.99 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.47 1ofr h HIS 187 CO -0.00 0.00 -0.44 0.00 0.86 0.00 0.00 177.93 178.35 1ofr h ARG 188 N 0.00 0.30 -0.77 2.45 3.08 -0.52 -2.24 114.38 116.68 1ofr h ARG 188 Ca 0.00 -0.32 -0.04 0.00 0.07 0.00 0.00 59.98 59.69 1ofr h ARG 188 Cb 0.92 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 31.03 1ofr h ARG 188 CO 0.00 1.02 0.31 0.93 -1.07 0.00 0.00 179.97 181.16 1ofr h GLU 189 N -0.29 1.15 -0.90 0.04 5.08 -1.28 -1.09 114.58 117.29 1ofr h GLU 189 Ca -0.05 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1ofr h GLU 189 Cb 1.17 -0.19 -0.05 0.00 0.50 0.00 0.00 28.75 30.18 1ofr h GLU 189 CO 0.09 0.94 0.59 1.25 -1.00 0.00 0.00 179.01 180.88 1ofr h LEU 190 N 1.12 0.99 -0.62 1.33 5.85 -1.40 -2.13 115.31 120.45 1ofr h LEU 190 Ca 0.26 -0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.81 1ofr h LEU 190 Cb 0.21 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1ofr h LEU 190 CO -0.02 0.69 -0.60 0.00 -0.34 0.00 0.00 178.44 178.17 1ofr h ALA 191 N 1.46 0.81 0.00 1.25 0.00 -0.74 -2.72 119.26 119.33 1ofr h ALA 191 Ca 0.35 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ofr h ALA 191 Cb -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ofr h ALA 191 CO -0.10 0.72 0.00 -1.13 0.00 0.00 0.00 179.25 178.75 1ofr n SER 192 N -3.88 0.00 0.00 0.00 3.41 -0.48 -2.31 113.62 110.35 1ofr n SER 192 Ca -0.03 -0.37 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 1ofr n SER 192 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 1ofr n SER 192 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ofr n GLY 193 N -0.30 -0.57 3.82 5.00 0.00 -1.04 -1.06 105.19 111.05 1ofr n GLY 193 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1ofr n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofr s LEU 194 N -0.16 3.90 -0.09 0.99 1.43 -0.98 -4.96 118.68 118.82 1ofr s LEU 194 Ca 0.00 1.69 0.04 0.00 -1.03 0.00 0.00 54.13 54.83 1ofr s LEU 194 Cb 0.00 -4.54 0.25 0.00 0.03 0.00 0.00 46.19 41.93 1ofr s LEU 194 CO 0.00 -0.41 0.97 -1.20 0.23 0.00 0.00 176.35 175.94 1ofr n SER 195 N -0.75 2.63 -3.22 2.29 7.64 -1.26 -4.90 113.62 116.05 1ofr n SER 195 Ca 0.07 -2.33 -0.12 0.00 1.01 0.00 0.00 58.87 57.50 1ofr n SER 195 Cb 0.54 -0.57 -0.02 0.00 -1.01 0.00 0.00 64.21 63.15 1ofr n SER 195 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1ofr s PHE 196 N -1.45 0.71 0.29 1.43 -0.12 -1.26 -5.06 117.98 112.52 1ofr s PHE 196 Ca 0.17 -1.09 -0.29 0.00 -0.05 0.00 0.00 56.93 55.67 1ofr s PHE 196 Cb 0.13 0.22 -0.10 0.00 -0.63 0.00 0.00 43.02 42.65 1ofr s PHE 196 CO 0.05 -1.26 1.17 -2.14 -0.05 0.00 0.00 175.22 172.99 1ofr s PRO 197 N -2.92 4.54 -0.13 1.99 0.02 -1.26 -4.88 135.00 132.35 1ofr s PRO 197 Ca 0.25 1.94 0.03 0.00 0.02 0.00 0.00 61.00 63.24 1ofr s PRO 197 Cb -0.02 -3.15 0.01 0.00 0.02 0.00 0.00 34.50 31.35 1ofr s PRO 197 CO 0.17 0.06 -0.22 0.08 -0.33 0.00 0.00 177.00 176.76 1ofr s VAL 198 N -1.07 2.14 -0.22 3.83 1.01 -0.86 -1.45 120.40 123.77 1ofr s VAL 198 Ca 0.46 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 1ofr s VAL 198 Cb -0.35 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1ofr s VAL 198 CO 0.45 0.55 0.14 -0.83 0.00 0.00 0.00 175.10 175.40 1ofr s GLY 199 N 0.71 2.01 -0.25 4.51 0.00 0.15 -2.13 107.32 112.32 1ofr s GLY 199 Ca -0.09 -0.79 -0.10 0.00 0.00 0.00 0.00 44.72 43.74 1ofr s GLY 199 CO 0.01 0.26 0.16 -1.36 0.00 0.00 0.00 173.10 172.16 1ofr s PHE 200 N 0.69 3.26 0.41 1.90 0.08 -0.31 -0.67 117.98 123.34 1ofr s PHE 200 Ca 0.08 0.13 -0.22 0.00 0.12 0.00 0.00 56.93 57.03 1ofr s PHE 200 Cb -0.12 -2.31 -0.11 0.00 -0.57 0.00 0.00 43.02 39.91 1ofr s PHE 200 CO 0.01 -0.06 0.95 0.15 -0.10 0.00 0.00 175.22 176.17 1ofr s LYS 201 N 1.36 4.29 0.73 0.44 1.02 -1.18 -0.66 119.74 125.74 1ofr s LYS 201 Ca 0.07 1.16 -0.13 0.00 0.02 0.00 0.00 55.97 57.09 1ofr s LYS 201 Cb -0.15 -2.29 0.04 0.00 -0.52 0.00 0.00 37.83 34.91 1ofr s LYS 201 CO 0.07 0.02 1.11 0.54 -0.92 0.00 0.00 175.35 176.17 1ofr s ASN 202 N -2.08 4.69 0.54 2.83 4.22 -0.79 -4.56 114.94 119.79 1ofr s ASN 202 Ca 0.60 1.93 -0.19 0.00 -2.14 0.00 0.00 52.86 53.06 1ofr s ASN 202 Cb -0.11 -2.54 -0.10 0.00 1.28 0.00 0.00 41.25 39.79 1ofr s ASN 202 CO 0.15 -1.91 0.48 0.61 -2.04 0.00 0.00 177.10 174.39 1ofr n GLY 203 N -0.81 -1.61 0.00 0.45 0.00 -0.35 -4.78 105.19 98.09 1ofr n GLY 203 Ca 0.10 -0.13 0.04 0.00 0.00 0.00 0.00 46.02 46.03 1ofr n GLY 203 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ofr n THR 204 N -1.53 1.05 -1.35 2.61 -2.24 -1.26 -1.85 114.28 109.71 1ofr n THR 204 Ca 0.11 0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.93 1ofr n THR 204 Cb 0.46 -1.13 0.15 0.00 -2.10 0.00 0.00 70.33 67.72 1ofr n THR 204 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ofr n ASP 205 N -1.36 4.48 0.00 3.42 5.75 -1.26 -3.40 116.55 124.18 1ofr n ASP 205 Ca 0.03 -3.70 0.00 0.00 -0.01 0.00 0.00 54.79 51.11 1ofr n ASP 205 Cb 0.08 -0.80 0.00 0.00 -1.03 0.00 0.00 41.12 39.36 1ofr n ASP 205 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ofr n GLY 206 N -1.07 1.05 3.80 6.12 0.00 -0.77 -4.03 105.19 110.28 1ofr n GLY 206 Ca 0.54 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.22 1ofr n GLY 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ofr s THR 207 N -1.30 3.89 -1.92 2.61 -4.23 -1.26 -4.84 115.64 108.61 1ofr s THR 207 Ca 0.00 1.28 0.17 0.00 -1.18 0.00 0.00 61.69 61.96 1ofr s THR 207 Cb 0.00 -3.57 0.08 0.00 1.34 0.00 0.00 72.50 70.35 1ofr s THR 207 CO 0.00 -0.16 0.98 -0.11 -0.54 0.00 0.00 174.62 174.79 1ofr n LEU 208 N -0.56 2.13 -0.03 4.79 7.94 -1.26 -1.21 117.00 128.80 1ofr n LEU 208 Ca 0.07 -0.90 -0.12 0.00 -1.11 0.00 0.00 56.01 53.95 1ofr n LEU 208 Cb 0.52 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.40 1ofr n LEU 208 CO 0.41 0.39 0.75 0.78 -1.11 0.00 0.00 177.39 178.60 1ofr h ASN 209 N 2.79 0.18 -0.80 1.96 4.21 -2.00 -2.94 115.58 118.98 1ofr h ASN 209 Ca 0.00 -0.29 0.05 0.00 1.21 0.00 0.00 56.30 57.26 1ofr h ASN 209 Cb 0.66 -0.05 -0.05 0.00 -1.12 0.00 0.00 38.32 37.77 1ofr h ASN 209 CO 0.00 0.43 0.52 -0.37 -1.29 0.00 0.00 177.43 176.72 1ofr h VAL 210 N -0.07 1.09 -0.09 2.81 -1.51 -1.97 -1.18 116.25 115.34 1ofr h VAL 210 Ca 0.03 -0.32 -0.14 0.00 -1.23 0.00 0.00 66.70 65.04 1ofr h VAL 210 Cb 0.33 0.07 -0.01 0.00 -2.13 0.00 0.00 31.29 29.56 1ofr h VAL 210 CO 0.00 0.17 -0.57 0.00 -1.23 0.00 0.00 177.57 175.94 1ofr h ALA 211 N 1.55 0.86 -0.15 5.19 0.00 -1.79 -0.72 119.26 124.20 1ofr h ALA 211 Ca 0.33 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1ofr h ALA 211 Cb 0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ofr h ALA 211 CO -0.10 0.71 -0.44 0.28 0.00 0.00 0.00 179.25 179.69 1ofr h VAL 212 N 0.21 1.32 0.00 0.00 2.07 -1.19 -2.29 116.25 116.37 1ofr h VAL 212 Ca -0.00 -1.61 -0.16 0.00 0.82 0.00 0.00 66.70 65.75 1ofr h VAL 212 Cb 1.07 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1ofr h VAL 212 CO 0.09 0.49 -0.77 0.44 0.02 0.00 0.00 177.57 177.84 1ofr h ASP 213 N 0.29 0.00 0.09 0.57 3.32 -0.94 -2.31 116.42 117.45 1ofr h ASP 213 Ca 0.02 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ofr h ASP 213 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1ofr h ASP 213 CO 0.07 0.77 -0.04 0.00 -1.72 0.00 0.00 179.24 178.32 1ofr h ALA 214 N 1.23 -0.13 -0.95 3.45 0.00 -0.87 -1.05 119.26 120.94 1ofr h ALA 214 Ca -0.01 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1ofr h ALA 214 Cb 1.37 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 19.14 1ofr h ALA 214 CO 0.10 -0.49 0.61 0.00 0.00 0.00 0.00 179.25 179.47 1ofr h GLN 216 N 1.10 0.17 0.10 0.00 1.08 -1.16 -2.77 115.11 113.63 1ofr h GLN 216 Ca 0.42 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.60 1ofr h GLN 216 Cb 0.18 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1ofr h GLN 216 CO -0.18 0.13 -0.05 0.00 -0.95 0.00 0.00 178.83 177.78 1ofr h ALA 217 N 1.03 -0.13 0.00 3.87 0.00 -0.38 -2.81 119.26 120.84 1ofr h ALA 217 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ofr h ALA 217 Cb -0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ofr h ALA 217 CO -0.01 -0.47 0.20 0.00 0.00 0.00 0.00 179.25 178.97 1ofr h ALA 218 N 0.53 1.19 0.00 0.00 0.00 -0.91 0.97 119.26 121.04 1ofr h ALA 218 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ofr h ALA 218 Cb 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ofr h ALA 218 CO 0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 179.25 178.66 1ofr h ALA 219 N 1.59 0.92 -2.34 0.00 0.00 -1.21 0.59 119.26 118.81 1ofr h ALA 219 Ca 0.00 -0.38 -0.46 0.00 0.00 0.00 0.00 54.91 54.07 1ofr h ALA 219 Cb 0.39 -0.07 0.08 0.00 0.00 0.00 0.00 17.79 18.19 1ofr h ALA 219 CO 0.00 0.53 0.25 -1.01 0.00 0.00 0.00 179.25 179.02 1ofr s HIS 220 N -3.47 2.94 0.04 0.00 3.76 0.33 -4.00 115.29 114.89 1ofr s HIS 220 Ca 0.01 0.50 -0.22 0.00 -0.15 0.00 0.00 55.06 55.20 1ofr s HIS 220 Cb 0.10 -3.21 -0.06 0.00 1.11 0.00 0.00 32.58 30.52 1ofr s HIS 220 CO 0.70 -1.42 0.66 0.45 -0.85 0.00 0.00 174.74 174.27 1ofr s SER 221 N -4.51 7.11 0.20 1.40 0.15 -1.26 -3.64 113.70 113.14 1ofr s SER 221 Ca 0.60 1.32 0.08 0.00 0.70 0.00 0.00 55.95 58.65 1ofr s SER 221 Cb -0.11 -2.41 -0.05 0.00 -1.71 0.00 0.00 66.02 61.75 1ofr s SER 221 CO 0.45 0.13 -0.16 -1.00 1.20 0.00 0.00 173.24 173.86 1ofr s HIS 222 N -0.45 1.80 -0.34 3.44 3.76 -1.23 -4.93 115.29 117.34 1ofr s HIS 222 Ca 0.33 -0.51 0.03 0.00 -0.15 0.00 0.00 55.06 54.76 1ofr s HIS 222 Cb -0.20 -0.85 0.10 0.00 1.11 0.00 0.00 32.58 32.74 1ofr s HIS 222 CO 0.20 0.38 0.07 -1.01 -0.85 0.00 0.00 174.74 173.53 1ofr s HIS 223 N -2.59 3.24 0.30 1.40 3.76 -1.26 -0.78 115.29 119.36 1ofr s HIS 223 Ca 0.21 -2.70 0.03 0.00 -0.15 0.00 0.00 55.06 52.45 1ofr s HIS 223 Cb -0.03 -2.62 -0.06 0.00 1.11 0.00 0.00 32.58 30.98 1ofr s HIS 223 CO 0.07 -0.93 0.06 -0.59 -0.85 0.00 0.00 174.74 172.51 1ofr s PHE 224 N 1.05 1.85 -0.32 1.40 -0.12 -0.42 -4.95 117.98 116.47 1ofr s PHE 224 Ca 0.11 -1.00 -0.16 0.00 -0.05 0.00 0.00 56.93 55.83 1ofr s PHE 224 Cb -0.19 -1.17 -0.02 0.00 -0.63 0.00 0.00 43.02 41.01 1ofr s PHE 224 CO -0.12 -0.07 0.41 -1.64 -0.05 0.00 0.00 175.22 173.76 1ofr s MET 225 N -3.92 3.73 0.00 1.99 -1.94 -1.26 0.92 119.30 118.82 1ofr s MET 225 Ca 0.36 -0.19 0.00 0.00 -1.71 0.00 0.00 55.69 54.16 1ofr s MET 225 Cb 0.08 -3.76 0.00 0.00 2.01 0.00 0.00 34.83 33.17 1ofr s MET 225 CO 0.15 -0.48 0.00 0.41 -0.01 0.00 0.00 175.02 175.09 1ofr n GLY 226 N 4.81 4.60 3.39 -0.03 0.00 -0.31 -4.92 105.19 112.74 1ofr n GLY 226 Ca -0.07 -1.80 -0.31 0.00 0.00 0.00 0.00 46.02 43.84 1ofr n GLY 226 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ofr s VAL 227 N -1.30 2.42 0.92 1.61 -7.23 -1.26 -0.19 120.40 115.36 1ofr s VAL 227 Ca 0.00 -1.23 -0.15 0.00 -1.81 0.00 0.00 61.98 58.79 1ofr s VAL 227 Cb 0.00 -1.96 0.17 0.00 0.56 0.00 0.00 36.38 35.15 1ofr s VAL 227 CO 0.00 0.40 1.28 0.42 -0.31 0.00 0.00 175.10 176.89 1ofr s THR 228 N -0.82 2.01 -0.21 5.32 -4.23 0.71 -4.86 115.64 113.55 1ofr s THR 228 Ca 0.12 -0.02 0.24 0.00 -1.18 0.00 0.00 61.69 60.86 1ofr s THR 228 Cb -0.10 -2.99 0.25 0.00 1.34 0.00 0.00 72.50 71.00 1ofr s THR 228 CO 0.03 0.00 1.73 0.11 -0.54 0.00 0.00 174.62 175.95 1ofr h LYS 229 N -1.47 0.00 -0.87 3.99 1.79 -1.96 -1.92 116.57 116.13 1ofr h LYS 229 Ca -0.45 0.00 -0.42 0.00 -2.18 0.00 0.00 60.65 57.60 1ofr h LYS 229 Cb 1.26 0.00 -0.25 0.00 -1.58 0.00 0.00 32.23 31.66 1ofr h LYS 229 CO 0.45 0.00 0.50 0.72 -1.08 0.00 0.00 179.45 180.04 1ofr n HIS 230 N -2.34 2.73 -1.77 -1.35 8.25 -1.26 -0.21 115.22 119.27 1ofr n HIS 230 Ca -0.00 -1.70 -0.21 0.00 -0.26 0.00 0.00 57.72 55.55 1ofr n HIS 230 Cb 0.10 -0.85 -0.07 0.00 1.12 0.00 0.00 29.99 30.29 1ofr n HIS 230 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ofr n GLY 231 N -0.96 1.48 3.51 -1.41 0.00 -0.72 -4.97 105.19 102.12 1ofr n GLY 231 Ca 0.53 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 46.22 1ofr n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ofr s VAL 232 N -2.83 3.24 0.16 1.61 1.01 -1.26 -4.85 120.40 117.48 1ofr s VAL 232 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.98 1ofr s VAL 232 Cb 0.00 -2.30 -0.08 0.00 0.00 0.00 0.00 36.38 34.00 1ofr s VAL 232 CO 0.00 0.56 1.31 0.00 0.00 0.00 0.00 175.10 176.97 1ofr s ALA 233 N -0.78 3.52 0.07 5.51 0.00 -1.26 -0.21 121.76 128.61 1ofr s ALA 233 Ca 0.12 1.06 -0.15 0.00 0.00 0.00 0.00 51.96 52.99 1ofr s ALA 233 Cb -0.11 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.55 1ofr s ALA 233 CO 0.02 -0.53 0.36 0.00 0.00 0.00 0.00 175.76 175.61 1ofr s ALA 234 N 0.50 -0.82 -0.66 0.00 0.00 0.73 -4.91 121.76 116.60 1ofr s ALA 234 Ca 0.59 0.03 -0.27 0.00 0.00 0.00 0.00 51.96 52.30 1ofr s ALA 234 Cb -0.35 0.46 0.02 0.00 0.00 0.00 0.00 23.12 23.25 1ofr s ALA 234 CO 0.35 -0.51 1.41 0.42 0.00 0.00 0.00 175.76 177.43 1ofr s ILE 235 N -3.05 3.69 0.29 0.00 1.01 -1.26 -1.16 121.20 120.72 1ofr s ILE 235 Ca -0.02 0.48 -0.22 0.00 0.00 0.00 0.00 60.65 60.89 1ofr s ILE 235 Cb 0.01 -4.61 -0.09 0.00 0.01 0.00 0.00 42.46 37.78 1ofr s ILE 235 CO -0.07 -1.47 0.83 -0.89 0.00 0.00 0.00 174.94 173.34 1ofr s THR 236 N 6.36 4.41 -0.10 2.92 2.01 0.26 -4.91 115.64 126.60 1ofr s THR 236 Ca 0.46 1.50 0.00 0.00 0.31 0.00 0.00 61.69 63.96 1ofr s THR 236 Cb -0.09 -3.88 0.02 0.00 0.01 0.00 0.00 72.50 68.55 1ofr s THR 236 CO 0.19 0.11 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.27 1ofr s THR 237 N -1.64 0.97 0.24 -0.82 2.01 -1.26 -1.30 115.64 113.84 1ofr s THR 237 Ca 0.48 -0.28 0.05 0.00 0.31 0.00 0.00 61.69 62.26 1ofr s THR 237 Cb -0.16 -0.98 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 1ofr s THR 237 CO 0.21 0.35 0.35 0.42 -0.69 0.00 0.00 174.62 175.26 1ofr s THR 238 N 1.52 5.19 -0.01 -0.82 -4.23 0.04 -4.96 115.64 112.37 1ofr s THR 238 Ca 0.01 -1.02 0.03 0.00 -1.18 0.00 0.00 61.69 59.53 1ofr s THR 238 Cb -0.13 -3.82 -0.25 0.00 1.34 0.00 0.00 72.50 69.64 1ofr s THR 238 CO -0.06 -0.33 0.78 0.50 -0.54 0.00 0.00 174.62 174.98 1ofr h LYS 239 N 1.20 0.13 0.00 3.99 3.64 -1.87 -3.26 116.57 120.41 1ofr h LYS 239 Ca -0.52 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 58.63 1ofr h LYS 239 Cb 1.23 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 1ofr h LYS 239 CO 0.61 0.90 0.00 0.41 -2.27 0.00 0.00 179.45 179.10 1ofr n GLY 240 N 1.63 3.18 3.44 5.01 0.00 -0.22 -4.08 105.19 114.14 1ofr n GLY 240 Ca -0.16 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 1ofr n GLY 240 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ofr s ASN 241 N 0.00 4.89 0.00 1.61 3.84 0.21 -4.85 114.94 120.64 1ofr s ASN 241 Ca 0.00 -0.21 0.21 0.00 0.21 0.00 0.00 52.86 53.07 1ofr s ASN 241 Cb 0.00 -1.85 0.58 0.00 -0.55 0.00 0.00 41.25 39.43 1ofr s ASN 241 CO 0.00 0.03 1.49 -1.84 -2.79 0.00 0.00 177.10 173.99 1ofr n GLU 242 N 4.47 2.71 -2.08 0.43 0.00 -1.26 -3.29 120.64 121.62 1ofr n GLU 242 Ca -0.17 -2.55 -0.29 0.00 0.00 0.00 0.00 57.16 54.15 1ofr n GLU 242 Cb 0.52 -1.53 0.02 0.00 0.00 0.00 0.00 31.44 30.45 1ofr n GLU 242 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1ofr n HIS 243 N 1.50 3.11 -3.95 -1.84 8.25 -1.26 -4.90 115.22 116.13 1ofr n HIS 243 Ca 0.22 -2.69 -0.35 0.00 -0.26 0.00 0.00 57.72 54.64 1ofr n HIS 243 Cb 0.60 -0.53 -0.12 0.00 1.12 0.00 0.00 29.99 31.06 1ofr n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ofr s PHE 245 N 1.03 2.10 -0.05 0.00 -0.71 -0.90 -4.55 117.98 114.90 1ofr s PHE 245 Ca 0.03 -0.91 -0.08 0.00 -1.04 0.00 0.00 56.93 54.93 1ofr s PHE 245 Cb -0.14 -1.49 -0.05 0.00 -1.21 0.00 0.00 43.02 40.14 1ofr s PHE 245 CO 0.03 0.15 0.23 0.08 -1.34 0.00 0.00 175.22 174.36 1ofr s VAL 246 N -3.02 5.36 -0.10 -2.49 1.01 -1.25 -1.17 120.40 118.74 1ofr s VAL 246 Ca 0.29 0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.58 1ofr s VAL 246 Cb 0.07 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 1ofr s VAL 246 CO 0.14 0.52 -0.17 -0.63 0.00 0.00 0.00 175.10 174.96 1ofr s ILE 247 N -1.14 2.71 -0.26 2.22 1.01 0.17 -1.17 121.20 124.74 1ofr s ILE 247 Ca 0.21 -0.80 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 1ofr s ILE 247 Cb -0.13 -2.09 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1ofr s ILE 247 CO 0.10 0.55 0.23 -0.76 0.00 0.00 0.00 174.94 175.05 1ofr s LEU 248 N 0.14 4.06 -0.05 2.97 1.43 -0.39 -1.88 118.68 124.95 1ofr s LEU 248 Ca -0.09 0.10 0.09 0.00 -1.03 0.00 0.00 54.13 53.21 1ofr s LEU 248 Cb -0.15 -2.19 0.16 0.00 0.03 0.00 0.00 46.19 44.03 1ofr s LEU 248 CO 0.05 -0.04 1.08 -2.11 0.23 0.00 0.00 176.35 175.56 1ofr n ARG 249 N 4.86 0.46 0.00 1.70 -4.01 -1.26 0.51 116.66 118.92 1ofr n ARG 249 Ca -0.13 -1.71 0.00 0.00 -1.04 0.00 0.00 57.85 54.97 1ofr n ARG 249 Cb 0.52 -0.80 0.00 0.00 -3.04 0.00 0.00 32.46 29.14 1ofr n ARG 249 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1ofr n GLY 250 N -0.42 -1.47 0.00 2.89 0.00 -1.26 -0.79 105.19 104.14 1ofr n GLY 250 Ca 0.06 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1ofr n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ofr n GLY 251 N 0.00 -0.72 0.14 -0.02 0.00 -1.23 -4.14 105.19 99.21 1ofr n GLY 251 Ca 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 46.02 45.62 1ofr n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ofr h LYS 252 N 0.00 -0.24 -1.30 1.61 1.79 -1.73 -3.24 116.57 113.46 1ofr h LYS 252 Ca 0.00 0.02 0.46 0.00 -2.18 0.00 0.00 60.65 58.95 1ofr h LYS 252 Cb 0.00 0.05 -0.15 0.00 -1.58 0.00 0.00 32.23 30.56 1ofr h LYS 252 CO 0.00 -0.14 0.82 -0.22 -1.08 0.00 0.00 179.45 178.83 1ofr h LYS 253 N -1.06 0.02 0.00 3.15 3.64 -1.89 -3.46 116.57 116.97 1ofr h LYS 253 Ca -0.03 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1ofr h LYS 253 Cb 0.21 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1ofr h LYS 253 CO 0.04 0.01 0.00 0.41 -2.27 0.00 0.00 179.45 177.64 1ofr n GLY 254 N -1.47 3.91 3.61 5.01 0.00 -1.22 -5.08 105.19 109.95 1ofr n GLY 254 Ca 0.40 -1.69 -0.49 0.00 0.00 0.00 0.00 46.02 44.23 1ofr n GLY 254 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ofr n THR 255 N -1.55 0.23 -1.67 2.61 -2.24 -1.25 -3.98 114.28 106.43 1ofr n THR 255 Ca 0.00 -0.06 -0.09 0.00 -2.27 0.00 0.00 64.05 61.63 1ofr n THR 255 Cb 0.00 -1.05 0.14 0.00 -2.10 0.00 0.00 70.33 67.32 1ofr n THR 255 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1ofr n ASN 256 N 2.62 3.33 0.09 3.42 0.23 -1.26 -4.69 115.26 119.00 1ofr n ASN 256 Ca 0.17 -3.82 0.13 0.00 -0.53 0.00 0.00 54.58 50.53 1ofr n ASN 256 Cb 0.23 -0.53 0.39 0.00 -2.08 0.00 0.00 39.78 37.79 1ofr n ASN 256 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ofr n TYR 257 N -0.98 0.82 -1.17 -2.53 0.18 -1.26 -4.30 117.16 107.91 1ofr n TYR 257 Ca 0.34 0.24 -0.26 0.00 1.88 0.00 0.00 57.90 60.10 1ofr n TYR 257 Cb 0.88 -0.87 0.21 0.00 -0.38 0.00 0.00 39.34 39.18 1ofr n TYR 257 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 1ofr n ASP 258 N -2.19 -1.51 0.08 9.48 5.75 -1.26 -4.65 116.55 122.26 1ofr n ASP 258 Ca 0.05 -1.16 0.01 0.00 -0.01 0.00 0.00 54.79 53.68 1ofr n ASP 258 Cb 0.42 -0.89 -0.04 0.00 -1.03 0.00 0.00 41.12 39.59 1ofr n ASP 258 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ofr h ALA 259 N -2.47 0.64 -0.03 2.12 0.00 -1.90 -2.51 119.26 115.11 1ofr h ALA 259 Ca -0.37 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 53.87 1ofr h ALA 259 Cb 1.09 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ofr h ALA 259 CO 0.24 0.80 -0.02 -0.22 0.00 0.00 0.00 179.25 180.05 1ofr h LYS 260 N 0.00 0.07 -0.45 0.00 3.64 -1.96 -1.79 116.57 116.08 1ofr h LYS 260 Ca -0.08 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 1ofr h LYS 260 Cb 1.50 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.30 1ofr h LYS 260 CO 0.06 0.51 0.22 0.66 -2.27 0.00 0.00 179.45 178.63 1ofr h SER 261 N -0.38 0.59 -0.85 4.20 4.64 -1.88 -1.65 113.55 118.22 1ofr h SER 261 Ca 0.01 -0.12 0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1ofr h SER 261 Cb 0.50 -0.15 -0.05 0.00 -0.31 0.00 0.00 62.40 62.38 1ofr h SER 261 CO 0.01 0.55 0.56 0.58 -0.87 0.00 0.00 176.83 177.65 1ofr h VAL 262 N 0.59 1.07 -0.13 0.95 2.07 -1.45 0.24 116.25 119.59 1ofr h VAL 262 Ca 0.16 -0.33 -0.15 0.00 0.82 0.00 0.00 66.70 67.19 1ofr h VAL 262 Cb 0.11 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.89 1ofr h VAL 262 CO -0.02 0.18 -0.57 0.00 0.02 0.00 0.00 177.57 177.18 1ofr h ALA 263 N 1.53 0.77 -0.29 1.67 0.00 -0.81 0.68 119.26 122.81 1ofr h ALA 263 Ca 0.36 -0.52 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 1ofr h ALA 263 Cb 0.17 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ofr h ALA 263 CO -0.13 0.70 -0.52 1.05 0.00 0.00 0.00 179.25 180.36 1ofr h GLU 264 N 0.31 0.84 0.14 0.00 4.11 -0.56 -2.78 114.58 116.64 1ofr h GLU 264 Ca 0.00 -0.51 0.02 0.00 0.07 0.00 0.00 59.36 58.94 1ofr h GLU 264 Cb 1.09 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1ofr h GLU 264 CO 0.10 1.15 -0.36 0.00 0.07 0.00 0.00 179.01 179.96 1ofr h ALA 265 N 0.75 -0.65 -0.84 1.06 0.00 -0.26 -1.49 119.26 117.84 1ofr h ALA 265 Ca 0.02 -0.07 0.22 0.00 0.00 0.00 0.00 54.91 55.09 1ofr h ALA 265 Cb 1.11 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 19.46 1ofr h ALA 265 CO 0.11 -0.92 0.59 0.87 0.00 0.00 0.00 179.25 179.90 1ofr h LYS 266 N -0.61 0.12 0.00 0.00 1.57 -0.75 -0.36 116.57 116.54 1ofr h LYS 266 Ca 0.02 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1ofr h LYS 266 Cb 0.63 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1ofr h LYS 266 CO -0.20 0.08 -0.36 0.00 -0.57 0.00 0.00 179.45 178.40 1ofr h ALA 267 N 1.60 0.96 0.02 3.86 0.00 -0.99 -3.10 119.26 121.61 1ofr h ALA 267 Ca 0.41 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.77 1ofr h ALA 267 Cb 1.43 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1ofr h ALA 267 CO -0.06 0.45 -1.06 1.96 0.00 0.00 0.00 179.25 180.55 1ofr h GLN 268 N 0.00 0.05 -6.41 0.00 4.20 -0.84 -3.45 115.11 108.66 1ofr h GLN 268 Ca -0.00 -0.09 -0.57 0.00 0.06 0.00 0.00 58.65 58.05 1ofr h GLN 268 Cb 0.93 0.03 0.03 0.00 0.30 0.00 0.00 27.48 28.77 1ofr h GLN 268 CO 0.05 1.04 1.06 1.28 -0.67 0.00 0.00 178.83 181.58 1ofr n LEU 269 N -3.38 3.66 -4.97 1.46 4.77 -1.12 -4.99 117.00 112.42 1ofr n LEU 269 Ca -0.02 0.99 -0.23 0.00 -0.03 0.00 0.00 56.01 56.73 1ofr n LEU 269 Cb 0.96 -1.46 0.07 0.00 -2.33 0.00 0.00 43.42 40.66 1ofr n LEU 269 CO 0.48 0.00 0.47 -2.16 -1.33 0.00 0.00 177.39 174.85 1ofr s PRO 270 N 3.04 2.18 0.48 3.23 0.04 -1.26 -5.00 135.00 137.71 1ofr s PRO 270 Ca 0.86 -0.82 -0.19 0.00 0.04 0.00 0.00 61.00 60.88 1ofr s PRO 270 Cb -0.59 -2.39 -0.13 0.00 0.04 0.00 0.00 34.50 31.43 1ofr s PRO 270 CO 0.43 -1.05 0.20 0.00 0.04 0.00 0.00 177.00 176.62 1ofr n ALA 271 N -2.60 -2.28 -2.65 8.56 0.00 -1.26 -2.42 120.51 117.85 1ofr n ALA 271 Ca 0.10 0.03 -0.19 0.00 0.00 0.00 0.00 53.44 53.39 1ofr n ALA 271 Cb 0.60 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1ofr n ALA 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ofr n GLY 272 N 2.16 -0.50 3.84 0.00 0.00 -1.26 -4.96 105.19 104.47 1ofr n GLY 272 Ca 0.10 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1ofr n GLY 272 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ofr s SER 273 N -2.25 6.41 0.48 1.61 0.15 -1.02 -5.10 113.70 113.97 1ofr s SER 273 Ca 0.11 0.48 0.00 0.00 0.70 0.00 0.00 55.95 57.24 1ofr s SER 273 Cb -0.05 -2.10 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 1ofr s SER 273 CO 0.13 0.35 0.00 0.59 1.20 0.00 0.00 173.24 175.51 1ofr n ASN 274 N 2.28 -0.15 -2.68 5.45 3.02 -1.26 -5.04 115.26 116.88 1ofr n ASN 274 Ca -0.18 -0.40 -0.09 0.00 -0.03 0.00 0.00 54.58 53.87 1ofr n ASN 274 Cb 0.54 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.78 1ofr n ASN 274 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofr n GLY 275 N 4.23 -1.69 3.50 7.41 0.00 -0.31 -4.91 105.19 113.43 1ofr n GLY 275 Ca 0.00 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 44.08 1ofr n GLY 275 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofr s LEU 276 N 0.00 2.84 0.25 0.99 1.02 -0.18 -3.81 118.68 119.78 1ofr s LEU 276 Ca 0.23 -0.17 0.10 0.00 0.02 0.00 0.00 54.13 54.31 1ofr s LEU 276 Cb -0.01 -1.60 -0.04 0.00 0.02 0.00 0.00 46.19 44.56 1ofr s LEU 276 CO 0.17 0.34 -0.05 -0.32 0.02 0.00 0.00 176.35 176.51 1ofr s MET 277 N -0.84 2.16 -0.09 1.70 -2.45 -0.32 -1.53 119.30 117.94 1ofr s MET 277 Ca 0.12 -1.43 -0.03 0.00 -1.25 0.00 0.00 55.69 53.10 1ofr s MET 277 Cb -0.11 -2.11 0.04 0.00 1.25 0.00 0.00 34.83 33.91 1ofr s MET 277 CO 0.01 0.38 0.10 0.42 1.05 0.00 0.00 175.02 176.98 1ofr s ILE 278 N -2.20 -0.15 -0.14 10.11 1.01 -0.85 -1.26 121.20 127.72 1ofr s ILE 278 Ca 0.30 0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.90 1ofr s ILE 278 Cb -0.07 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.09 1ofr s ILE 278 CO 0.18 0.05 1.04 -0.62 0.00 0.00 0.00 174.94 175.59 1ofr s ASP 279 N 2.20 7.18 0.20 3.58 -1.08 0.18 -1.55 116.67 127.38 1ofr s ASP 279 Ca 0.04 1.52 0.25 0.00 -0.52 0.00 0.00 52.55 53.85 1ofr s ASP 279 Cb -0.13 -2.55 0.89 0.00 -1.46 0.00 0.00 42.92 39.66 1ofr s ASP 279 CO -0.05 -0.53 1.76 -1.22 0.52 0.00 0.00 175.17 175.65 1ofr n TYR 280 N 5.43 0.80 -3.35 -5.34 4.01 -0.87 -4.58 117.16 113.25 1ofr n TYR 280 Ca 0.10 0.25 -0.09 0.00 -0.16 0.00 0.00 57.90 58.01 1ofr n TYR 280 Cb 0.48 -0.91 0.01 0.00 -0.31 0.00 0.00 39.34 38.61 1ofr n TYR 280 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1ofr n SER 281 N -2.17 1.24 0.00 7.72 7.64 -1.26 -4.24 113.62 122.55 1ofr n SER 281 Ca 0.05 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.29 1ofr n SER 281 Cb 0.36 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1ofr n SER 281 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1ofr n HIS 282 N -1.21 0.00 0.00 1.43 8.25 -1.26 -2.64 115.22 119.79 1ofr n HIS 282 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1ofr n HIS 282 Cb 0.23 0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.37 1ofr n HIS 282 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ofr n GLY 283 N 0.00 -0.11 0.92 -1.41 0.00 0.03 -1.18 105.19 103.44 1ofr n GLY 283 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1ofr n GLY 283 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ofr n ASN 284 N -1.00 2.46 -0.50 1.61 3.02 -1.08 -3.51 115.26 116.26 1ofr n ASN 284 Ca 0.00 -3.66 -0.00 0.00 -0.03 0.00 0.00 54.58 50.89 1ofr n ASN 284 Cb 0.21 -0.59 -0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1ofr n ASN 284 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ofr n SER 285 N -1.08 -0.00 -3.95 6.41 3.41 -0.32 -4.66 113.62 113.43 1ofr n SER 285 Ca 0.27 -1.37 -0.31 0.00 -0.26 0.00 0.00 58.87 57.20 1ofr n SER 285 Cb 0.91 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.78 1ofr n SER 285 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ofr n ASN 286 N 0.00 -1.90 -3.63 4.04 4.13 -1.26 -0.74 115.26 115.91 1ofr n ASN 286 Ca -0.00 -0.95 -0.27 0.00 1.68 0.00 0.00 54.58 55.04 1ofr n ASN 286 Cb 0.57 -1.15 0.02 0.00 -1.54 0.00 0.00 39.78 37.68 1ofr n ASN 286 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1ofr n LYS 287 N -3.86 -4.65 -3.69 3.52 4.01 -1.26 -4.97 118.16 107.26 1ofr n LYS 287 Ca -0.13 0.59 -0.10 0.00 -0.51 0.00 0.00 58.31 58.16 1ofr n LYS 287 Cb 0.44 -5.41 -0.10 0.00 -0.51 0.00 0.00 35.03 29.44 1ofr n LYS 287 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1ofr s ASP 288 N -3.03 -0.55 0.00 4.39 3.68 0.08 -5.03 116.67 116.21 1ofr s ASP 288 Ca 0.54 0.94 0.26 0.00 2.13 0.00 0.00 52.55 56.42 1ofr s ASP 288 Cb -0.27 0.82 1.39 0.00 -1.45 0.00 0.00 42.92 43.41 1ofr s ASP 288 CO 0.66 -0.20 1.88 2.22 0.13 0.00 0.00 175.17 179.87 1ofr n PHE 289 N 4.26 0.00 1.02 -5.34 -1.74 -1.26 -2.82 117.46 111.57 1ofr n PHE 289 Ca -0.23 0.00 0.13 0.00 -0.56 0.00 0.00 57.45 56.78 1ofr n PHE 289 Cb 0.56 -0.18 0.34 0.00 1.52 0.00 0.00 39.48 41.72 1ofr n PHE 289 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1ofr n ARG 290 N -1.18 0.04 0.19 3.97 1.74 -1.26 -3.54 116.66 116.63 1ofr n ARG 290 Ca 0.15 -0.02 0.09 0.00 -0.77 0.00 0.00 57.85 57.30 1ofr n ARG 290 Cb 0.16 -1.50 0.12 0.00 -1.02 0.00 0.00 32.46 30.22 1ofr n ARG 290 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1ofr h ASN 291 N 0.05 0.00 0.28 0.55 4.21 -1.79 -3.34 115.58 115.54 1ofr h ASN 291 Ca 0.00 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.51 1ofr h ASN 291 Cb 0.50 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 1ofr h ASN 291 CO 0.00 0.15 -0.23 1.56 -1.29 0.00 0.00 177.43 177.63 1ofr h GLN 292 N 0.00 -0.50 -0.85 0.81 4.20 -1.75 0.30 115.11 117.32 1ofr h GLN 292 Ca -0.00 0.03 0.23 0.00 0.06 0.00 0.00 58.65 58.97 1ofr h GLN 292 Cb 1.12 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.97 1ofr h GLN 292 CO 0.02 -0.33 0.59 -1.35 -0.67 0.00 0.00 178.83 177.09 1ofr h PRO 293 N -0.52 0.14 0.10 1.46 0.11 -1.80 0.34 132.00 131.84 1ofr h PRO 293 Ca -0.02 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1ofr h PRO 293 Cb 0.46 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.54 1ofr h PRO 293 CO -0.02 0.10 -0.05 0.87 -0.21 0.00 0.00 178.00 178.69 1ofr h LYS 294 N 0.15 -0.13 -0.97 1.05 1.57 -1.48 -2.94 116.57 113.82 1ofr h LYS 294 Ca 0.42 0.01 0.25 0.00 -1.87 0.00 0.00 60.65 59.45 1ofr h LYS 294 Cb 1.42 0.03 -0.13 0.00 0.08 0.00 0.00 32.23 33.63 1ofr h LYS 294 CO -0.07 0.39 0.53 0.28 -0.57 0.00 0.00 179.45 180.01 1ofr h VAL 295 N -0.84 0.50 0.03 0.50 2.07 0.21 0.10 116.25 118.81 1ofr h VAL 295 Ca -0.01 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1ofr h VAL 295 Cb 0.57 -0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 1ofr h VAL 295 CO 0.02 0.09 -0.23 -1.13 0.02 0.00 0.00 177.57 176.35 1ofr h ASN 296 N 0.50 -0.66 -0.55 0.57 -1.24 -0.43 -2.01 115.58 111.76 1ofr h ASN 296 Ca 0.63 0.09 0.09 0.00 0.71 0.00 0.00 56.30 57.81 1ofr h ASN 296 Cb 1.22 0.27 -0.07 0.00 0.73 0.00 0.00 38.32 40.47 1ofr h ASN 296 CO -0.50 -0.30 0.18 0.44 -1.29 0.00 0.00 177.43 175.96 1ofr h ASP 297 N -0.37 0.15 0.14 1.15 3.45 -0.65 0.86 116.42 121.16 1ofr h ASP 297 Ca 0.05 0.08 -0.02 0.00 0.43 0.00 0.00 57.03 57.57 1ofr h ASP 297 Cb 0.44 0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.28 1ofr h ASP 297 CO -0.19 0.10 -0.10 0.58 -1.57 0.00 0.00 179.24 178.06 1ofr h VAL 298 N 0.34 0.90 0.02 -1.35 2.07 -1.05 -2.47 116.25 114.72 1ofr h VAL 298 Ca 0.28 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.30 1ofr h VAL 298 Cb 0.34 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1ofr h VAL 298 CO -0.30 0.10 -0.70 0.58 0.02 0.00 0.00 177.57 177.27 1ofr h VAL 299 N 0.00 1.35 -0.98 2.57 2.07 -0.25 -3.25 116.25 117.75 1ofr h VAL 299 Ca -0.00 -2.30 0.21 0.00 0.82 0.00 0.00 66.70 65.43 1ofr h VAL 299 Cb 0.20 2.85 -0.09 0.00 -1.52 0.00 0.00 31.29 32.73 1ofr h VAL 299 CO 0.01 0.51 0.62 0.00 0.02 0.00 0.00 177.57 178.74 1ofr h GLU 301 N 0.56 0.52 0.00 0.00 4.81 -1.57 0.42 114.58 119.32 1ofr h GLU 301 Ca 0.55 -0.20 -0.13 0.00 -0.13 0.00 0.00 59.36 59.45 1ofr h GLU 301 Cb 1.14 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 1ofr h GLU 301 CO -0.30 0.73 -0.61 1.96 -0.73 0.00 0.00 179.01 180.06 1ofr h GLN 302 N 0.46 0.00 0.21 1.92 4.20 -0.72 -2.74 115.11 118.43 1ofr h GLN 302 Ca 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1ofr h GLN 302 Cb 0.69 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1ofr h GLN 302 CO 0.05 0.61 -0.10 0.82 -0.67 0.00 0.00 178.83 179.54 1ofr h ILE 303 N 0.00 0.24 -0.19 2.54 2.04 -0.82 0.64 117.51 121.96 1ofr h ILE 303 Ca -0.01 -0.91 0.06 0.00 1.00 0.00 0.00 64.86 65.00 1ofr h ILE 303 Cb 1.13 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1ofr h ILE 303 CO 0.08 0.07 0.38 0.00 0.00 0.00 0.00 178.15 178.68 1ofr h ALA 304 N -0.89 1.71 -0.55 1.87 0.00 -0.23 0.37 119.26 121.53 1ofr h ALA 304 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ofr h ALA 304 Cb 0.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ofr h ALA 304 CO 0.05 -0.48 0.00 0.09 0.00 0.00 0.00 179.25 178.91 1ofr n ASN 305 N -3.31 4.73 0.00 0.00 3.02 -1.03 -4.23 115.26 114.45 1ofr n ASN 305 Ca 0.02 -2.61 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1ofr n ASN 305 Cb 0.49 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1ofr n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofr n GLY 306 N 0.71 0.86 3.61 7.41 0.00 0.13 -5.04 105.19 112.87 1ofr n GLY 306 Ca 0.25 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1ofr n GLY 306 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ofr s GLU 307 N -0.54 3.73 0.00 1.61 2.56 0.22 -4.88 118.70 121.39 1ofr s GLU 307 Ca 0.00 0.74 0.26 0.00 0.00 0.00 0.00 54.97 55.97 1ofr s GLU 307 Cb 0.00 -3.92 0.62 0.00 2.00 0.00 0.00 34.13 32.83 1ofr s GLU 307 CO 0.00 -1.37 1.48 0.09 -0.56 0.00 0.00 175.26 174.90 1ofr n ASN 308 N 8.00 0.89 0.02 -1.70 4.13 -1.26 -3.99 115.26 121.35 1ofr n ASN 308 Ca 0.13 -0.71 0.12 0.00 1.68 0.00 0.00 54.58 55.81 1ofr n ASN 308 Cb 0.48 0.21 0.25 0.00 -1.54 0.00 0.00 39.78 39.19 1ofr n ASN 308 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ofr n ALA 309 N -0.93 3.22 -2.84 5.41 0.00 -1.26 -4.56 120.51 119.56 1ofr n ALA 309 Ca 0.10 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 1ofr n ALA 309 Cb 0.35 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 1ofr n ALA 309 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ofr s ILE 310 N -3.06 4.61 -0.21 0.00 1.01 -1.26 -1.01 121.20 121.29 1ofr s ILE 310 Ca 0.10 -1.77 0.19 0.00 0.00 0.00 0.00 60.65 59.16 1ofr s ILE 310 Cb 0.16 -4.91 0.02 0.00 0.01 0.00 0.00 42.46 37.75 1ofr s ILE 310 CO 0.69 -1.66 1.16 0.71 0.00 0.00 0.00 174.94 175.84 1ofr h THR 311 N 5.65 0.40 -3.41 2.92 1.35 -1.52 -3.48 112.91 114.82 1ofr h THR 311 Ca 0.24 -1.66 -0.03 0.00 -0.55 0.00 0.00 66.41 64.41 1ofr h THR 311 Cb 0.96 2.00 -0.09 0.00 -1.73 0.00 0.00 68.15 69.29 1ofr h THR 311 CO 1.23 0.23 -0.01 -0.83 -0.25 0.00 0.00 175.52 175.89 1ofr s GLY 312 N -4.51 0.11 -0.08 5.82 0.00 -0.75 -0.65 107.32 107.27 1ofr s GLY 312 Ca 0.01 -0.46 -0.06 0.00 0.00 0.00 0.00 44.72 44.21 1ofr s GLY 312 CO 0.77 -0.38 0.21 -1.34 0.00 0.00 0.00 173.10 172.36 1ofr s VAL 313 N -3.92 -0.02 0.10 1.40 -7.23 0.13 -2.01 120.40 108.86 1ofr s VAL 313 Ca 0.13 0.06 -0.09 0.00 -1.81 0.00 0.00 61.98 60.27 1ofr s VAL 313 Cb -0.01 -0.32 -0.06 0.00 0.56 0.00 0.00 36.38 36.55 1ofr s VAL 313 CO 0.02 0.02 0.41 -0.32 -0.31 0.00 0.00 175.10 174.92 1ofr s MET 314 N 0.53 3.74 -0.13 4.82 1.75 -0.60 -1.93 119.30 127.48 1ofr s MET 314 Ca -0.03 0.13 -0.05 0.00 -1.25 0.00 0.00 55.69 54.48 1ofr s MET 314 Cb -0.05 -2.94 0.06 0.00 2.84 0.00 0.00 34.83 34.74 1ofr s MET 314 CO -0.03 0.52 0.28 0.42 -0.65 0.00 0.00 175.02 175.56 1ofr s ILE 315 N -1.49 -0.27 -1.13 10.11 1.01 -0.47 -2.06 121.20 126.90 1ofr s ILE 315 Ca 0.36 0.22 -0.16 0.00 0.00 0.00 0.00 60.65 61.07 1ofr s ILE 315 Cb -0.13 -0.45 0.14 0.00 0.01 0.00 0.00 42.46 42.03 1ofr s ILE 315 CO 0.20 0.09 1.38 -1.61 0.00 0.00 0.00 174.94 175.00 1ofr s GLU 316 N 1.97 3.93 0.68 2.79 2.02 -1.26 -2.12 118.70 126.71 1ofr s GLU 316 Ca -0.03 -2.24 0.03 0.00 0.02 0.00 0.00 54.97 52.75 1ofr s GLU 316 Cb -0.11 -5.09 0.12 0.00 0.10 0.00 0.00 34.13 29.15 1ofr s GLU 316 CO -0.09 -1.84 0.94 0.45 0.02 0.00 0.00 175.26 174.74 1ofr s SER 317 N 3.29 4.54 0.04 -0.19 0.15 -0.70 -2.29 113.70 118.54 1ofr s SER 317 Ca 0.41 -0.59 -0.27 0.00 0.70 0.00 0.00 55.95 56.21 1ofr s SER 317 Cb -0.02 0.20 0.09 0.00 -1.71 0.00 0.00 66.02 64.58 1ofr s SER 317 CO -0.02 -1.74 1.21 0.21 1.20 0.00 0.00 173.24 174.10 1ofr s ASN 318 N -4.74 0.00 0.19 5.45 3.84 -0.97 -1.52 114.94 117.19 1ofr s ASN 318 Ca 0.66 -0.34 -0.00 0.00 0.21 0.00 0.00 52.86 53.38 1ofr s ASN 318 Cb -0.05 0.25 0.09 0.00 -0.55 0.00 0.00 41.25 40.99 1ofr s ASN 318 CO 0.43 -0.49 1.46 0.40 -2.79 0.00 0.00 177.10 176.10 1ofr h ILE 319 N 2.00 1.38 -3.91 -5.21 2.04 -1.84 -1.75 117.51 110.22 1ofr h ILE 319 Ca -0.24 -2.11 -0.36 0.00 1.00 0.00 0.00 64.86 63.15 1ofr h ILE 319 Cb 1.19 2.09 -0.21 0.00 -0.74 0.00 0.00 36.82 39.15 1ofr h ILE 319 CO 0.33 0.63 -0.76 0.20 0.00 0.00 0.00 178.15 178.55 1ofr s ASN 320 N -6.95 1.43 0.80 1.72 0.01 -0.57 -2.63 114.94 108.74 1ofr s ASN 320 Ca -0.05 -0.63 -0.11 0.00 -0.71 0.00 0.00 52.86 51.36 1ofr s ASN 320 Cb 0.11 -0.02 0.07 0.00 0.41 0.00 0.00 41.25 41.82 1ofr s ASN 320 CO 0.83 -0.14 1.09 -1.83 -1.51 0.00 0.00 177.10 175.55 1ofr s GLU 321 N -1.85 2.07 0.00 -0.60 -1.05 -1.26 -4.29 118.70 111.72 1ofr s GLU 321 Ca -0.03 1.08 0.00 0.00 -0.15 0.00 0.00 54.97 55.87 1ofr s GLU 321 Cb -0.09 -1.88 0.00 0.00 -0.44 0.00 0.00 34.13 31.72 1ofr s GLU 321 CO 0.01 -1.75 0.00 0.41 0.95 0.00 0.00 175.26 174.89 1ofr n GLY 322 N -1.24 0.13 0.00 -3.83 0.00 -0.38 -4.85 105.19 95.03 1ofr n GLY 322 Ca 0.09 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1ofr n GLY 322 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ofr n ASN 323 N 0.00 0.00 -3.23 1.61 6.94 -1.26 -0.35 115.26 118.97 1ofr n ASN 323 Ca 0.00 0.00 -0.20 0.00 -0.02 0.00 0.00 54.58 54.36 1ofr n ASN 323 Cb 0.00 0.00 0.17 0.00 -2.36 0.00 0.00 39.78 37.59 1ofr n ASN 323 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ofr n GLN 324 N 0.00 -2.20 -4.36 -3.83 10.64 -0.50 -4.87 117.38 112.26 1ofr n GLN 324 Ca 0.00 -1.22 -0.30 0.00 -1.83 0.00 0.00 57.00 53.65 1ofr n GLN 324 Cb 0.00 -1.08 -0.05 0.00 -0.86 0.00 0.00 30.24 28.25 1ofr n GLN 324 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 1ofr s GLY 325 N -4.03 2.72 -0.85 2.61 0.00 -1.26 -4.59 107.32 101.93 1ofr s GLY 325 Ca 0.49 -0.80 -0.14 0.00 0.00 0.00 0.00 44.72 44.27 1ofr s GLY 325 CO 0.37 -2.08 0.79 -0.42 0.00 0.00 0.00 173.10 171.76 1ofr s ILE 326 N -2.82 5.64 0.78 0.90 1.01 -1.26 -4.94 121.20 120.50 1ofr s ILE 326 Ca 0.19 -2.54 -0.11 0.00 0.00 0.00 0.00 60.65 58.19 1ofr s ILE 326 Cb -0.00 -4.47 0.06 0.00 0.01 0.00 0.00 42.46 38.06 1ofr s ILE 326 CO 0.11 -1.04 1.09 -2.16 0.00 0.00 0.00 174.94 172.94 1ofr s PRO 327 N 0.06 2.20 0.09 2.79 0.04 -1.26 -4.88 135.00 134.04 1ofr s PRO 327 Ca 0.19 1.02 -0.07 0.00 0.04 0.00 0.00 61.00 62.18 1ofr s PRO 327 Cb -0.10 -1.90 0.09 0.00 0.04 0.00 0.00 34.50 32.63 1ofr s PRO 327 CO -0.09 -1.64 0.60 0.00 0.04 0.00 0.00 177.00 175.92 1ofr n ALA 328 N -3.50 -0.05 -0.58 8.56 0.00 -1.26 -1.29 120.51 122.39 1ofr n ALA 328 Ca 0.08 0.39 -0.06 0.00 0.00 0.00 0.00 53.44 53.85 1ofr n ALA 328 Cb 0.54 -0.17 -0.08 0.00 0.00 0.00 0.00 19.45 19.74 1ofr n ALA 328 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ofr n GLU 329 N -4.57 1.16 0.00 0.00 0.28 -1.26 -4.92 120.64 111.33 1ofr n GLU 329 Ca 0.04 -0.47 0.00 0.00 -0.16 0.00 0.00 57.16 56.57 1ofr n GLU 329 Cb 0.15 -1.62 0.00 0.00 1.43 0.00 0.00 31.44 31.41 1ofr n GLU 329 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ofr n GLY 330 N 2.32 1.55 0.07 -1.84 0.00 -0.41 0.38 105.19 107.26 1ofr n GLY 330 Ca 0.20 0.35 0.12 0.00 0.00 0.00 0.00 46.02 46.69 1ofr n GLY 330 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ofr n LYS 331 N 6.19 0.29 0.00 1.61 0.00 -1.26 -3.88 118.16 121.12 1ofr n LYS 331 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 58.31 58.47 1ofr n LYS 331 Cb 0.00 -1.70 0.23 0.00 0.00 0.00 0.00 35.03 33.56 1ofr n LYS 331 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ofr n ALA 332 N -1.82 1.48 -2.32 3.14 0.00 0.16 -3.20 120.51 117.96 1ofr n ALA 332 Ca 0.04 -0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.18 1ofr n ALA 332 Cb 0.44 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.72 1ofr n ALA 332 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ofr n GLY 333 N -0.41 6.10 3.54 0.00 0.00 -1.12 -5.03 105.19 108.26 1ofr n GLY 333 Ca 0.02 -2.73 -0.25 0.00 0.00 0.00 0.00 46.02 43.07 1ofr n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofr s LEU 334 N -3.58 2.83 -0.27 0.99 1.02 -1.19 -4.65 118.68 113.83 1ofr s LEU 334 Ca 0.49 -0.76 -0.19 0.00 0.02 0.00 0.00 54.13 53.69 1ofr s LEU 334 Cb 0.41 -1.44 -0.02 0.00 0.02 0.00 0.00 46.19 45.15 1ofr s LEU 334 CO -0.13 0.07 0.58 -0.54 0.02 0.00 0.00 176.35 176.34 1ofr s LYS 335 N -3.18 4.05 -0.88 1.70 1.02 -1.26 -4.98 119.74 116.21 1ofr s LYS 335 Ca 0.27 0.41 -0.24 0.00 0.02 0.00 0.00 55.97 56.42 1ofr s LYS 335 Cb -0.07 -3.67 -0.18 0.00 -0.52 0.00 0.00 37.83 33.39 1ofr s LYS 335 CO 0.15 -0.42 2.24 0.98 -0.92 0.00 0.00 175.35 177.38 1ofr n TYR 336 N 5.67 0.95 0.00 3.18 9.36 -1.26 -1.59 117.16 133.48 1ofr n TYR 336 Ca -0.02 -0.07 0.00 0.00 3.32 0.00 0.00 57.90 61.13 1ofr n TYR 336 Cb 0.49 -2.41 0.00 0.00 -0.63 0.00 0.00 39.34 36.79 1ofr n TYR 336 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ofr n GLY 337 N 6.40 0.34 3.42 2.98 0.00 -1.26 -4.82 105.19 112.24 1ofr n GLY 337 Ca 0.44 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.06 1ofr n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ofr s VAL 338 N -0.80 4.67 0.86 1.61 1.01 -0.62 -1.51 120.40 125.62 1ofr s VAL 338 Ca 0.00 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 1ofr s VAL 338 Cb 0.00 -3.50 -0.07 0.00 0.00 0.00 0.00 36.38 32.81 1ofr s VAL 338 CO 0.00 -0.10 -0.04 -0.24 0.00 0.00 0.00 175.10 174.72 1ofr n SER 339 N 5.01 -3.41 -2.65 3.32 2.88 -1.26 -4.33 113.62 113.18 1ofr n SER 339 Ca -0.13 0.38 -0.23 0.00 -1.33 0.00 0.00 58.87 57.57 1ofr n SER 339 Cb 0.48 -1.01 -0.00 0.00 -0.75 0.00 0.00 64.21 62.92 1ofr n SER 339 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1ofr n ILE 340 N -2.67 2.07 -0.39 2.46 -5.35 -1.26 -1.42 119.36 112.80 1ofr n ILE 340 Ca 0.05 -4.68 0.00 0.00 -0.27 0.00 0.00 62.75 57.84 1ofr n ILE 340 Cb 0.53 -0.85 0.00 0.00 -1.74 0.00 0.00 39.64 37.57 1ofr n ILE 340 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ofr n THR 341 N -0.30 0.00 -1.53 7.28 -2.24 -1.26 -4.96 114.28 111.26 1ofr n THR 341 Ca 0.31 0.00 -0.55 0.00 -2.27 0.00 0.00 64.05 61.54 1ofr n THR 341 Cb 0.64 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.80 1ofr n THR 341 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ofr n ASP 342 N 0.00 0.53 -4.72 3.42 8.00 -1.26 -4.80 116.55 117.72 1ofr n ASP 342 Ca 0.00 1.14 -0.42 0.00 0.71 0.00 0.00 54.79 56.22 1ofr n ASP 342 Cb 0.00 -1.04 -0.03 0.00 -0.02 0.00 0.00 41.12 40.03 1ofr n ASP 342 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ofr s ALA 343 N 0.01 3.77 0.35 2.24 0.00 -1.26 -4.65 121.76 122.22 1ofr s ALA 343 Ca 0.84 1.36 0.07 0.00 0.00 0.00 0.00 51.96 54.23 1ofr s ALA 343 Cb -1.09 -3.62 -0.01 0.00 0.00 0.00 0.00 23.12 18.40 1ofr s ALA 343 CO 0.53 -0.77 0.42 0.00 0.00 0.00 0.00 175.76 175.94 1ofr s ILE 345 N -2.26 5.05 1.13 0.00 -4.36 -0.97 -1.25 121.20 118.55 1ofr s ILE 345 Ca 0.45 0.26 -0.18 0.00 -0.26 0.00 0.00 60.65 60.92 1ofr s ILE 345 Cb -0.08 -3.62 0.26 0.00 1.25 0.00 0.00 42.46 40.27 1ofr s ILE 345 CO 0.30 -0.00 1.18 -0.83 0.24 0.00 0.00 174.94 175.82 1ofr s GLY 346 N -2.37 1.65 0.08 6.27 0.00 -1.26 -2.29 107.32 109.41 1ofr s GLY 346 Ca 0.44 -1.04 -0.31 0.00 0.00 0.00 0.00 44.72 43.81 1ofr s GLY 346 CO 0.23 -0.19 1.64 -0.25 0.00 0.00 0.00 173.10 174.53 1ofr h TRP 347 N -2.31 -0.77 -0.82 1.90 2.91 -1.07 -3.02 115.95 112.77 1ofr h TRP 347 Ca -0.44 -0.01 0.09 0.00 1.13 0.00 0.00 58.89 59.66 1ofr h TRP 347 Cb 1.27 0.28 -0.07 0.00 -0.51 0.00 0.00 29.16 30.13 1ofr h TRP 347 CO -1.90 -0.45 0.47 1.05 -1.03 0.00 0.00 178.44 176.59 1ofr h GLU 348 N -0.72 0.78 -0.57 2.65 9.09 -1.89 0.18 114.58 124.10 1ofr h GLU 348 Ca -0.05 -0.05 0.05 0.00 0.05 0.00 0.00 59.36 59.36 1ofr h GLU 348 Cb 0.59 -0.18 -0.05 0.00 -1.65 0.00 0.00 28.75 27.47 1ofr h GLU 348 CO 0.04 0.51 0.30 1.15 0.05 0.00 0.00 179.01 181.07 1ofr h THR 349 N 0.80 0.97 -0.37 -1.06 2.02 -1.93 0.44 112.91 113.78 1ofr h THR 349 Ca 0.39 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 1ofr h THR 349 Cb 0.33 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 1ofr h THR 349 CO -0.24 0.11 0.20 0.74 0.37 0.00 0.00 175.52 176.70 1ofr h THR 350 N 0.58 1.15 -1.01 3.16 2.02 -1.01 0.81 112.91 118.60 1ofr h THR 350 Ca 0.25 -0.38 0.06 0.00 0.77 0.00 0.00 66.41 67.10 1ofr h THR 350 Cb 0.14 0.73 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 1ofr h THR 350 CO -0.16 0.15 0.65 -0.08 0.37 0.00 0.00 175.52 176.45 1ofr h GLU 351 N 0.47 1.17 0.20 6.66 4.81 -0.19 0.11 114.58 127.81 1ofr h GLU 351 Ca 0.13 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1ofr h GLU 351 Cb 0.06 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.18 1ofr h GLU 351 CO -0.02 0.78 -0.10 -0.44 -0.73 0.00 0.00 179.01 178.50 1ofr h ASP 352 N 1.21 -0.23 -1.27 1.04 5.19 0.35 -2.04 116.42 120.67 1ofr h ASP 352 Ca 0.42 0.01 0.43 0.00 -0.62 0.00 0.00 57.03 57.27 1ofr h ASP 352 Cb 0.12 0.06 -0.14 0.00 0.18 0.00 0.00 39.33 39.55 1ofr h ASP 352 CO -0.16 -0.16 0.80 0.58 -3.12 0.00 0.00 179.24 177.18 1ofr h VAL 353 N -0.29 0.10 0.03 -1.35 2.07 0.93 0.41 116.25 118.16 1ofr h VAL 353 Ca -0.03 -0.03 -0.24 0.00 0.82 0.00 0.00 66.70 67.22 1ofr h VAL 353 Cb 0.21 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.97 1ofr h VAL 353 CO 0.05 0.01 -1.19 -0.07 0.02 0.00 0.00 177.57 176.39 1ofr h LEU 354 N 0.08 0.10 -0.40 2.57 3.38 -0.73 -2.49 115.31 117.81 1ofr h LEU 354 Ca 0.83 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.60 1ofr h LEU 354 Cb 2.51 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 43.21 1ofr h LEU 354 CO -0.48 1.09 -0.05 0.03 0.09 0.00 0.00 178.44 179.12 1ofr h ARG 355 N 0.02 0.74 -0.78 1.13 2.47 -0.17 0.10 114.38 117.88 1ofr h ARG 355 Ca -0.09 -0.26 -0.03 0.00 -1.26 0.00 0.00 59.98 58.33 1ofr h ARG 355 Cb 1.86 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 30.09 1ofr h ARG 355 CO 0.14 0.86 0.36 0.87 0.56 0.00 0.00 179.97 182.75 1ofr h LYS 356 N 0.56 1.14 -0.20 0.04 1.57 -1.48 0.52 116.57 118.71 1ofr h LYS 356 Ca 0.11 -0.18 -0.13 0.00 -1.87 0.00 0.00 60.65 58.58 1ofr h LYS 356 Cb 0.56 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1ofr h LYS 356 CO 0.03 0.89 -0.41 1.25 -0.57 0.00 0.00 179.45 180.64 1ofr h LEU 357 N 1.11 0.51 -0.42 2.94 5.85 -1.18 0.19 115.31 124.31 1ofr h LEU 357 Ca 0.27 -0.23 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 1ofr h LEU 357 Cb 0.14 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1ofr h LEU 357 CO -0.03 0.87 -0.07 0.00 -0.34 0.00 0.00 178.44 178.87 1ofr h ALA 358 N 1.16 0.58 -0.11 1.25 0.00 -0.38 -2.10 119.26 119.66 1ofr h ALA 358 Ca 0.03 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ofr h ALA 358 Cb 0.89 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1ofr h ALA 358 CO 0.08 0.43 -0.03 0.00 0.00 0.00 0.00 179.25 179.72 1ofr h ALA 359 N 0.87 0.07 -0.26 0.00 0.00 -0.53 -1.65 119.26 117.74 1ofr h ALA 359 Ca 0.11 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ofr h ALA 359 Cb 0.58 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ofr h ALA 359 CO 0.03 -0.49 0.18 0.00 0.00 0.00 0.00 179.25 178.97 1ofr h ALA 360 N 1.10 1.87 -0.12 0.00 0.00 -0.82 0.24 119.26 121.53 1ofr h ALA 360 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ofr h ALA 360 Cb 0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ofr h ALA 360 CO -0.12 0.10 -0.02 0.28 0.00 0.00 0.00 179.25 179.50 1ofr h VAL 361 N 0.31 1.28 -0.26 0.00 2.07 -0.73 -0.37 116.25 118.54 1ofr h VAL 361 Ca 0.10 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 66.76 1ofr h VAL 361 Cb 0.04 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1ofr h VAL 361 CO -0.02 0.26 0.00 0.03 0.02 0.00 0.00 177.57 177.86 1ofr h ARG 362 N -0.08 0.08 -0.64 1.57 3.08 -0.47 -2.08 114.38 115.84 1ofr h ARG 362 Ca 0.03 -0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.14 1ofr h ARG 362 Cb 0.41 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.39 1ofr h ARG 362 CO 0.01 0.05 0.33 0.37 -1.07 0.00 0.00 179.97 179.67 1ofr h GLN 363 N 0.08 0.59 0.00 0.04 5.75 -0.85 0.11 115.11 120.83 1ofr h GLN 363 Ca 0.12 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1ofr h GLN 363 Cb 0.15 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.57 1ofr h GLN 363 CO -0.20 0.39 -0.01 -0.09 -2.65 0.00 0.00 178.83 176.27 1ofr h ARG 364 N 0.61 0.00 0.70 1.69 2.43 -0.40 -2.10 114.38 117.31 1ofr h ARG 364 Ca 0.30 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.43 1ofr h ARG 364 Cb 0.23 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1ofr h ARG 364 CO -0.21 0.01 -0.34 0.00 -1.51 0.00 0.00 179.97 177.93 1ofr h ARG 365 N 0.00 -0.91 -0.95 0.20 3.08 -0.25 -0.82 114.38 114.72 1ofr h ARG 365 Ca -0.00 0.06 0.04 0.00 0.07 0.00 0.00 59.98 60.15 1ofr h ARG 365 Cb 0.02 0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.23 1ofr h ARG 365 CO 0.00 -0.60 0.62 0.93 -1.07 0.00 0.00 179.97 179.85 1ofr h GLU 366 N -0.96 1.17 -0.38 0.04 4.39 -1.36 -0.64 114.58 116.84 1ofr h GLU 366 Ca -0.10 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.57 1ofr h GLU 366 Cb 0.73 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1ofr h GLU 366 CO 0.16 0.77 0.26 0.28 -1.16 0.00 0.00 179.01 179.32 1ofr h VAL 367 N 1.20 1.01 0.05 3.13 2.07 -1.05 -2.76 116.25 119.90 1ofr h VAL 367 Ca 0.38 -0.13 -0.28 0.00 0.82 0.00 0.00 66.70 67.48 1ofr h VAL 367 Cb 0.01 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1ofr h VAL 367 CO -0.12 0.07 -1.51 0.78 0.02 0.00 0.00 177.57 176.82 1ofr h ASN 368 N 0.38 0.17 0.41 0.57 2.35 0.30 -3.38 115.58 116.38 1ofr h ASN 368 Ca 0.16 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1ofr h ASN 368 Cb 0.16 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1ofr h ASN 368 CO -0.04 1.22 -0.20 0.07 -1.65 0.00 0.00 177.43 176.84 1ofr h LYS 369 N 0.03 -0.53 0.00 0.81 2.10 -0.98 -3.51 116.57 114.49 1ofr h LYS 369 Ca -0.22 0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 1ofr h LYS 369 Cb 1.96 0.12 0.00 0.00 -0.90 0.00 0.00 32.23 33.41 1ofr h LYS 369 CO 0.12 -0.24 0.00 1.63 -2.00 0.00 0.00 179.45 178.96