#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofr n GLU 21 N 0.00 0.63 -0.48 5.31 1.02 -1.26 -4.91 120.64 120.96 1ofr n GLU 21 Ca 0.00 -2.13 0.00 0.00 -0.02 0.00 0.00 57.16 55.01 1ofr n GLU 21 Cb 0.00 2.16 0.00 0.00 -0.02 0.00 0.00 31.44 33.58 1ofr n GLU 21 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ofr n ASP 22 N -1.66 -1.70 0.19 1.62 9.92 -1.26 -4.73 116.55 118.92 1ofr n ASP 22 Ca -0.01 0.00 0.18 0.00 -0.53 0.00 0.00 54.79 54.43 1ofr n ASP 22 Cb 0.47 -2.04 0.74 0.00 -0.64 0.00 0.00 41.12 39.65 1ofr n ASP 22 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 1ofr h VAL 23 N 0.00 0.21 -0.42 2.53 -1.51 -2.05 1.18 116.25 116.18 1ofr h VAL 23 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1ofr h VAL 23 Cb 0.28 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.06 1ofr h VAL 23 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 176.88 1ofr n ARG 24 N -3.34 2.91 -3.58 5.19 1.74 -1.26 -4.88 116.66 113.44 1ofr n ARG 24 Ca 0.04 -2.28 -0.41 0.00 -0.77 0.00 0.00 57.85 54.43 1ofr n ARG 24 Cb 0.56 -1.41 -0.11 0.00 -1.02 0.00 0.00 32.46 30.48 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 -1.22 4.53 -0.29 0.55 -1.09 0.41 -4.96 121.20 119.12 1ofr s ILE 25 Ca 0.31 -1.04 0.28 0.00 -2.23 0.00 0.00 60.65 57.97 1ofr s ILE 25 Cb 0.18 -3.61 0.32 0.00 -1.58 0.00 0.00 42.46 37.76 1ofr s ILE 25 CO 0.19 -0.34 1.81 -0.07 -1.23 0.00 0.00 174.94 175.30 1ofr h LEU 26 N 8.46 0.00 0.00 2.97 3.38 -1.90 -3.48 115.31 124.73 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 0.71 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.85 1ofr n GLY 27 N 0.32 3.56 3.41 0.83 0.00 -1.26 -5.12 105.19 106.93 1ofr n GLY 27 Ca 0.02 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 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 2.83 0.05 1.61 1.51 -1.26 -5.12 117.35 114.97 1ofr s TYR 28 Ca 0.00 -0.50 0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1ofr s TYR 28 Cb 0.00 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 1ofr s TYR 28 CO 0.00 -0.11 0.05 -0.51 -1.11 0.00 0.00 175.55 173.87 1ofr s ASP 29 N 0.14 5.38 0.39 2.29 1.01 -1.26 -5.07 116.67 119.55 1ofr s ASP 29 Ca -0.06 -0.01 -0.27 0.00 0.71 0.00 0.00 52.55 52.92 1ofr s ASP 29 Cb -0.15 -1.43 -0.10 0.00 1.01 0.00 0.00 42.92 42.26 1ofr s ASP 29 CO 0.04 0.21 1.38 -2.16 0.21 0.00 0.00 175.17 174.86 1ofr s PRO 30 N -2.09 4.05 -0.19 8.23 0.04 -1.26 -5.01 135.00 138.77 1ofr s PRO 30 Ca 0.26 2.34 -0.00 0.00 0.04 0.00 0.00 61.00 63.64 1ofr s PRO 30 Cb -0.12 -2.87 0.05 0.00 0.04 0.00 0.00 34.50 31.59 1ofr s PRO 30 CO 0.18 -0.49 -0.06 -1.17 0.04 0.00 0.00 177.00 175.49 1ofr s LEU 31 N -2.24 1.94 0.23 -3.56 2.96 -1.26 -4.93 118.68 111.82 1ofr s LEU 31 Ca 0.55 -0.82 -0.31 0.00 -0.22 0.00 0.00 54.13 53.32 1ofr s LEU 31 Cb -0.42 -1.03 -0.14 0.00 0.50 0.00 0.00 46.19 45.10 1ofr s LEU 31 CO 0.55 -0.19 1.26 0.00 -1.32 0.00 0.00 176.35 176.65 1ofr n ALA 32 N 4.80 0.30 -1.56 5.97 0.00 -1.26 -4.94 120.51 123.81 1ofr n ALA 32 Ca -0.12 0.42 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1ofr n ALA 32 Cb 0.47 -2.15 0.11 0.00 0.00 0.00 0.00 19.45 17.87 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 0.02 4.14 0.08 0.00 1.04 -1.26 -4.84 113.70 112.88 1ofr s SER 33 Ca 0.67 1.16 -0.30 0.00 0.48 0.00 0.00 55.95 57.97 1ofr s SER 33 Cb -0.72 -1.83 -0.16 0.00 0.10 0.00 0.00 66.02 63.41 1ofr s SER 33 CO 0.53 -2.18 1.65 -0.65 0.98 0.00 0.00 173.24 173.57 1ofr h PRO 34 N -1.24 -0.62 -0.82 4.02 0.11 -1.83 -0.91 132.00 130.71 1ofr h PRO 34 Ca -0.48 0.04 0.18 0.00 0.11 0.00 0.00 66.00 65.85 1ofr h PRO 34 Cb 1.29 0.14 -0.11 0.00 0.11 0.00 0.00 31.00 32.43 1ofr h PRO 34 CO 0.61 -0.42 0.31 0.00 -0.21 0.00 0.00 178.00 178.29 1ofr h ALA 35 N -0.10 1.20 -0.11 -0.75 0.00 -0.82 0.52 119.26 119.19 1ofr h ALA 35 Ca -0.05 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ofr h ALA 35 Cb 0.53 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ofr h ALA 35 CO 0.05 -0.30 0.05 1.25 0.00 0.00 0.00 179.25 180.30 1ofr h LEU 36 N 0.38 0.15 -0.77 0.00 5.85 -1.70 -2.77 115.31 116.46 1ofr h LEU 36 Ca 0.48 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 59.02 1ofr h LEU 36 Cb 0.84 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1ofr h LEU 36 CO -0.49 0.25 0.31 0.25 -0.34 0.00 0.00 178.44 178.42 1ofr h LEU 37 N 0.04 1.07 -1.59 2.25 7.12 0.46 -1.63 115.31 123.03 1ofr h LEU 37 Ca 0.04 -0.17 0.00 0.00 0.13 0.00 0.00 57.88 57.87 1ofr h LEU 37 Cb 0.14 -0.28 0.00 0.00 -0.53 0.00 0.00 40.66 39.99 1ofr h LEU 37 CO -0.00 0.95 0.00 1.56 -0.13 0.00 0.00 178.44 180.82 1ofr h GLN 38 N 1.12 0.00 0.04 1.25 4.20 0.08 -0.37 115.11 121.43 1ofr h GLN 38 Ca 0.26 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.61 1ofr h GLN 38 Cb 0.22 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 -2.00 0.28 -0.67 0.00 0.00 178.83 176.42 1ofr n VAL 39 N -2.52 1.61 0.03 -0.54 0.31 -0.85 -3.53 118.33 112.84 1ofr n VAL 39 Ca -0.01 -0.42 0.03 0.00 -0.01 0.00 0.00 64.34 63.92 1ofr n VAL 39 Cb 0.12 -1.78 0.39 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 -0.41 0.46 -2.66 5.55 4.20 -0.86 -3.26 115.11 118.12 1ofr h GLN 40 Ca -0.49 -0.06 -0.60 0.00 0.06 0.00 0.00 58.65 57.56 1ofr h GLN 40 Cb 1.74 -0.09 -0.40 0.00 0.30 0.00 0.00 27.48 29.03 1ofr h GLN 40 CO -0.12 0.41 -0.78 -0.89 -0.67 0.00 0.00 178.83 176.78 1ofr n ILE 41 N -4.38 0.29 -1.97 2.54 5.41 -0.19 -5.10 119.36 115.97 1ofr n ILE 41 Ca 0.02 -4.21 -0.34 0.00 1.00 0.00 0.00 62.75 59.22 1ofr n ILE 41 Cb 0.16 -1.93 0.03 0.00 -0.71 0.00 0.00 39.64 37.18 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 -0.84 3.02 -0.16 0.38 0.04 -1.23 -4.61 135.00 131.60 1ofr s PRO 42 Ca 0.30 1.51 -0.19 0.00 0.04 0.00 0.00 61.00 62.67 1ofr s PRO 42 Cb 0.02 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 1ofr s PRO 42 CO -0.17 -1.10 0.51 0.00 0.04 0.00 0.00 177.00 176.28 1ofr s ALA 43 N -2.06 3.50 0.78 8.56 0.00 -1.26 -5.03 121.76 126.25 1ofr s ALA 43 Ca 0.70 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.27 1ofr s ALA 43 Cb -0.23 -2.74 0.07 0.00 0.00 0.00 0.00 23.12 20.22 1ofr s ALA 43 CO 0.35 -0.22 1.11 0.95 0.00 0.00 0.00 175.76 177.94 1ofr s THR 44 N 1.13 3.08 0.48 0.00 -4.23 -1.26 -4.81 115.64 110.03 1ofr s THR 44 Ca 0.26 0.37 0.13 0.00 -1.18 0.00 0.00 61.69 61.27 1ofr s THR 44 Cb -0.15 -2.78 0.28 0.00 1.34 0.00 0.00 72.50 71.18 1ofr s THR 44 CO 0.10 -0.44 2.11 -0.65 -0.54 0.00 0.00 174.62 175.20 1ofr h PRO 45 N -1.11 0.19 -0.21 3.99 0.11 -1.99 -1.45 132.00 131.53 1ofr h PRO 45 Ca -0.44 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 1ofr h PRO 45 Cb 1.24 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ofr h PRO 45 CO 0.50 0.13 -0.16 1.15 -0.21 0.00 0.00 178.00 179.41 1ofr h THR 46 N 0.20 1.32 -0.17 -1.15 2.02 -1.92 -1.99 112.91 111.22 1ofr h THR 46 Ca 0.07 -1.29 0.03 0.00 0.77 0.00 0.00 66.41 65.99 1ofr h THR 46 Cb 0.05 1.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 1ofr h THR 46 CO -0.01 0.39 -0.02 0.28 0.37 0.00 0.00 175.52 176.53 1ofr h SER 47 N 0.16 -0.11 0.26 4.18 0.02 -1.41 0.04 113.55 116.70 1ofr h SER 47 Ca 0.04 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1ofr h SER 47 Cb 0.69 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 1ofr h SER 47 CO 0.04 -0.03 -0.18 -0.07 -1.14 0.00 0.00 176.83 175.45 1ofr h LEU 48 N 0.03 0.00 -0.03 5.07 3.38 -1.33 -2.12 115.31 120.31 1ofr h LEU 48 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1ofr h LEU 48 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1ofr h LEU 48 CO -0.15 0.18 -0.28 -0.08 0.09 0.00 0.00 178.44 178.19 1ofr h GLU 49 N 0.00 0.24 -0.93 1.13 4.57 -0.54 -2.79 114.58 116.27 1ofr h GLU 49 Ca -0.00 -0.22 0.09 0.00 -1.18 0.00 0.00 59.36 58.04 1ofr h GLU 49 Cb 0.36 0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 28.93 1ofr h GLU 49 CO 0.02 0.91 0.58 1.15 -1.18 0.00 0.00 179.01 180.49 1ofr h THR 50 N -0.34 0.99 -0.61 0.32 2.02 -0.77 -0.55 112.91 113.97 1ofr h THR 50 Ca -0.03 -0.34 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 1ofr h THR 50 Cb 0.98 -0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1ofr h THR 50 CO 0.06 0.18 0.13 0.00 0.37 0.00 0.00 175.52 176.26 1ofr h ALA 51 N 1.47 0.80 -0.27 6.16 0.00 -1.42 -1.52 119.26 124.49 1ofr h ALA 51 Ca 0.43 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 1ofr h ALA 51 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ofr h ALA 51 CO -0.21 0.52 -0.39 0.87 0.00 0.00 0.00 179.25 180.04 1ofr h LYS 52 N 0.89 0.62 0.25 0.00 1.57 -1.05 -2.62 116.57 116.23 1ofr h LYS 52 Ca 0.19 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1ofr h LYS 52 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1ofr h LYS 52 CO 0.01 0.91 -0.12 -0.09 -0.57 0.00 0.00 179.45 179.58 1ofr h ARG 53 N 0.51 -0.33 -0.86 3.15 2.43 -0.97 -2.40 114.38 115.92 1ofr h ARG 53 Ca 0.05 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.40 1ofr h ARG 53 Cb 0.90 0.07 -0.10 0.00 -0.42 0.00 0.00 29.97 30.43 1ofr h ARG 53 CO 0.08 -0.10 0.43 0.78 -1.51 0.00 0.00 179.97 179.65 1ofr h GLY 54 N -0.51 1.42 1.47 2.80 0.00 -1.23 0.15 103.07 107.17 1ofr h GLY 54 Ca -0.03 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 1ofr h GLY 54 CO 0.06 -0.10 -0.08 3.21 0.00 0.00 0.00 176.54 179.64 1ofr h ARG 55 N 0.57 0.64 0.19 4.80 3.08 -1.34 -0.26 114.38 122.06 1ofr h ARG 55 Ca 0.49 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 1ofr h ARG 55 Cb 0.76 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1ofr h ARG 55 CO -0.40 0.71 -0.09 0.00 -1.07 0.00 0.00 179.97 179.12 1ofr h ARG 56 N 0.59 -0.25 -0.20 0.04 3.08 -0.26 -1.22 114.38 116.15 1ofr h ARG 56 Ca 0.11 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.21 1ofr h ARG 56 Cb 0.49 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1ofr h ARG 56 CO 0.03 0.09 0.01 0.93 -1.07 0.00 0.00 179.97 179.96 1ofr h GLU 57 N -0.63 0.08 -0.78 0.04 5.08 -1.04 -0.77 114.58 116.56 1ofr h GLU 57 Ca -0.03 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1ofr h GLU 57 Cb 0.46 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 1ofr h GLU 57 CO 0.04 0.05 0.45 0.00 -1.00 0.00 0.00 179.01 178.56 1ofr h ALA 58 N 1.16 1.09 -0.52 3.43 0.00 -1.06 -1.34 119.26 122.02 1ofr h ALA 58 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1ofr h ALA 58 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ofr h ALA 58 CO -0.15 0.12 0.13 0.82 0.00 0.00 0.00 179.25 180.17 1ofr h ILE 59 N 0.80 1.24 -0.57 0.00 2.04 -0.57 -1.99 117.51 118.46 1ofr h ILE 59 Ca 0.36 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 1ofr h ILE 59 Cb 0.27 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1ofr h ILE 59 CO -0.21 0.31 0.22 0.44 0.00 0.00 0.00 178.15 178.91 1ofr h ASP 60 N 0.73 0.80 -0.04 1.72 3.32 -0.51 -1.96 116.42 120.47 1ofr h ASP 60 Ca 0.16 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 1ofr h ASP 60 Cb 0.33 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 1ofr h ASP 60 CO 0.00 0.76 0.01 0.40 -1.72 0.00 0.00 179.24 178.69 1ofr h ILE 61 N 0.79 1.19 0.00 0.35 2.04 -1.15 0.11 117.51 120.84 1ofr h ILE 61 Ca 0.19 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1ofr h ILE 61 Cb 0.22 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.81 1ofr h ILE 61 CO -0.01 0.16 0.00 0.16 0.00 0.00 0.00 178.15 178.46 1ofr h ILE 62 N -0.16 0.00 -0.02 -0.67 3.07 -1.31 -2.92 117.51 115.50 1ofr h ILE 62 Ca 0.01 -0.54 0.00 0.00 1.55 0.00 0.00 64.86 65.88 1ofr h ILE 62 Cb 0.25 1.50 0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1ofr h ILE 62 CO 0.00 0.00 -0.11 0.35 -1.05 0.00 0.00 178.15 177.34 1ofr n THR 63 N -2.93 0.00 -0.42 0.16 -2.24 -0.74 -0.02 114.28 108.10 1ofr n THR 63 Ca 0.02 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1ofr n THR 63 Cb 0.33 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 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 1.30 0.71 0.21 3.38 0.00 -0.98 -4.94 105.19 104.87 1ofr n GLY 64 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 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 -5.36 1.61 1.57 -1.24 -3.44 116.57 113.81 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 -5.87 1.89 0.00 0.86 2.15 -0.92 -4.95 116.67 109.82 1ofr s ASP 66 Ca 0.07 -0.30 0.24 0.00 0.43 0.00 0.00 52.55 52.99 1ofr s ASP 66 Cb 0.07 -0.33 1.25 0.00 -0.30 0.00 0.00 42.92 43.61 1ofr s ASP 66 CO 0.64 0.17 1.83 -0.90 -0.17 0.00 0.00 175.17 176.74 1ofr n ASP 67 N 2.87 0.59 -4.39 -0.34 5.68 -1.26 -4.52 116.55 115.18 1ofr n ASP 67 Ca -0.16 -1.37 -0.30 0.00 -0.50 0.00 0.00 54.79 52.46 1ofr n ASP 67 Cb 0.54 -0.02 0.16 0.00 -1.14 0.00 0.00 41.12 40.66 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 -1.96 0.97 -0.12 0.11 0.52 -1.26 -4.96 118.95 112.25 1ofr s ARG 68 Ca 0.36 -0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.39 1ofr s ARG 68 Cb 0.18 -1.86 -0.01 0.00 0.52 0.00 0.00 34.95 33.77 1ofr s ARG 68 CO 0.29 -2.22 -0.15 0.08 0.02 0.00 0.00 175.30 173.32 1ofr s VAL 69 N -3.71 2.89 -0.12 3.52 1.01 -0.68 -4.91 120.40 118.40 1ofr s VAL 69 Ca 0.70 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1ofr s VAL 69 Cb -0.07 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.10 1ofr s VAL 69 CO 0.52 0.53 1.08 -0.22 0.00 0.00 0.00 175.10 177.01 1ofr s LEU 70 N 0.34 4.22 -0.27 3.92 2.96 0.35 -1.71 118.68 128.48 1ofr s LEU 70 Ca -0.12 1.58 0.02 0.00 -0.22 0.00 0.00 54.13 55.40 1ofr s LEU 70 Cb -0.16 -3.55 0.07 0.00 0.50 0.00 0.00 46.19 43.05 1ofr s LEU 70 CO 0.06 -0.55 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.80 1ofr s VAL 71 N 2.42 1.95 -0.69 1.68 1.01 -0.13 -0.62 120.40 126.01 1ofr s VAL 71 Ca 0.50 -1.65 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 1ofr s VAL 71 Cb -0.19 -2.19 0.12 0.00 0.00 0.00 0.00 36.38 34.12 1ofr s VAL 71 CO 0.16 -0.19 0.81 -0.63 0.00 0.00 0.00 175.10 175.25 1ofr s ILE 72 N 1.17 4.88 0.00 2.22 -1.09 -0.74 -0.37 121.20 127.28 1ofr s ILE 72 Ca -0.03 -1.27 0.07 0.00 -2.23 0.00 0.00 60.65 57.18 1ofr s ILE 72 Cb -0.19 -4.56 -0.02 0.00 -1.58 0.00 0.00 42.46 36.11 1ofr s ILE 72 CO -0.07 -1.21 -0.20 0.54 -1.23 0.00 0.00 174.94 172.77 1ofr s VAL 73 N 2.42 1.63 0.00 2.92 0.11 -0.55 -1.21 120.40 125.72 1ofr s VAL 73 Ca 0.17 -0.98 0.00 0.00 -2.93 0.00 0.00 61.98 58.24 1ofr s VAL 73 Cb -0.18 -1.37 0.00 0.00 -1.53 0.00 0.00 36.38 33.30 1ofr s VAL 73 CO 0.01 0.37 0.00 0.61 -3.33 0.00 0.00 175.10 172.76 1ofr n GLY 74 N 2.33 0.47 3.19 6.54 0.00 -0.88 -1.38 105.19 115.47 1ofr n GLY 74 Ca -0.16 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.02 -0.13 0.06 1.61 -0.02 -0.46 -1.69 135.00 133.36 1ofr n PRO 75 Ca 0.00 -0.02 -0.04 0.00 -2.02 0.00 0.00 63.50 61.43 1ofr n PRO 75 Cb 0.00 -1.39 0.19 0.00 -0.02 0.00 0.00 33.50 32.28 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 -6.86 -0.39 0.00 0.00 1.04 -1.26 -4.68 113.70 101.54 1ofr s SER 77 Ca -0.05 0.75 -0.20 0.00 0.48 0.00 0.00 55.95 56.93 1ofr s SER 77 Cb 0.13 0.76 -0.06 0.00 0.10 0.00 0.00 66.02 66.96 1ofr s SER 77 CO 0.79 -0.13 0.56 -0.63 0.98 0.00 0.00 173.24 174.80 1ofr s ILE 78 N 0.17 4.90 0.00 -1.02 -1.09 -1.07 -4.81 121.20 118.29 1ofr s ILE 78 Ca 0.04 1.18 0.00 0.00 -2.23 0.00 0.00 60.65 59.63 1ofr s ILE 78 Cb -0.05 -3.89 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 1ofr s ILE 78 CO -0.07 0.46 0.01 0.00 -1.23 0.00 0.00 174.94 174.10 1ofr n HIS 79 N 2.50 0.00 -3.83 3.97 1.44 -1.26 -4.32 115.22 113.72 1ofr n HIS 79 Ca -0.08 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.33 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 -0.11 3.84 0.57 4.39 -1.08 -1.26 -4.99 116.67 118.02 1ofr s ASP 80 Ca 0.00 -1.40 0.33 0.00 -0.52 0.00 0.00 52.55 50.96 1ofr s ASP 80 Cb 0.00 -0.99 1.68 0.00 -1.46 0.00 0.00 42.92 42.15 1ofr s ASP 80 CO 0.00 -0.34 2.13 -0.07 0.52 0.00 0.00 175.17 177.41 1ofr h LEU 81 N 8.03 0.00 0.24 -1.34 4.07 -1.98 -1.17 115.31 123.15 1ofr h LEU 81 Ca -0.14 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.81 1ofr h LEU 81 Cb 1.05 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 1ofr h LEU 81 CO 0.43 0.06 -0.12 -0.08 -1.08 0.00 0.00 178.44 177.66 1ofr h GLU 82 N 0.00 -0.31 -0.57 1.13 4.57 -1.99 -2.75 114.58 114.66 1ofr h GLU 82 Ca -0.00 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1ofr h GLU 82 Cb 0.29 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.92 1ofr h GLU 82 CO 0.01 0.02 0.17 0.00 -1.18 0.00 0.00 179.01 178.02 1ofr h ALA 83 N -0.59 1.22 -0.01 2.92 0.00 -1.98 -2.00 119.26 118.83 1ofr h ALA 83 Ca -0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1ofr h ALA 83 Cb 0.47 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1ofr h ALA 83 CO 0.05 0.55 -0.23 0.00 0.00 0.00 0.00 179.25 179.62 1ofr h ALA 84 N 1.34 1.60 0.00 0.00 0.00 -1.30 -1.83 119.26 119.08 1ofr h ALA 84 Ca 0.19 -0.22 -0.23 0.00 0.00 0.00 0.00 54.91 54.65 1ofr h ALA 84 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ofr h ALA 84 CO -0.01 0.30 -0.95 0.37 0.00 0.00 0.00 179.25 178.96 1ofr h GLN 85 N 0.01 0.41 -0.09 0.00 5.75 -1.06 -2.15 115.11 117.99 1ofr h GLN 85 Ca -0.00 -0.45 -0.01 0.00 -0.15 0.00 0.00 58.65 58.04 1ofr h GLN 85 Cb 0.42 0.13 -0.00 0.00 1.07 0.00 0.00 27.48 29.10 1ofr h GLN 85 CO 0.03 1.12 0.03 1.49 -2.65 0.00 0.00 178.83 178.84 1ofr h GLU 86 N 0.23 0.14 -0.58 1.69 4.81 -1.01 -2.41 114.58 117.45 1ofr h GLU 86 Ca -0.08 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1ofr h GLU 86 Cb 1.59 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.90 1ofr h GLU 86 CO 0.17 0.30 0.30 -0.92 -0.73 0.00 0.00 179.01 178.13 1ofr h TYR 87 N -0.06 0.55 -0.97 0.92 5.03 -1.38 -1.98 116.97 119.08 1ofr h TYR 87 Ca 0.03 0.02 0.07 0.00 2.58 0.00 0.00 58.73 61.43 1ofr h TYR 87 Cb 0.23 -0.16 -0.07 0.00 1.55 0.00 0.00 36.73 38.28 1ofr h TYR 87 CO -0.00 0.26 0.62 0.00 -1.32 0.00 0.00 178.16 177.72 1ofr h ALA 88 N 1.32 1.35 -0.07 1.82 0.00 -1.18 -0.31 119.26 122.19 1ofr h ALA 88 Ca 0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1ofr h ALA 88 Cb 0.18 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ofr h ALA 88 CO -0.18 0.40 0.04 -0.07 0.00 0.00 0.00 179.25 179.44 1ofr h LEU 89 N 1.13 0.08 0.58 0.00 -0.00 -0.86 0.18 115.31 116.42 1ofr h LEU 89 Ca 0.42 -0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 58.25 1ofr h LEU 89 Cb 0.18 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1ofr h LEU 89 CO -0.18 0.09 -0.40 0.03 -0.00 0.00 0.00 178.44 177.98 1ofr h ARG 90 N 0.07 -0.91 -0.39 1.13 3.08 -1.08 -1.21 114.38 115.07 1ofr h ARG 90 Ca 0.02 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.25 1ofr h ARG 90 Cb 0.02 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1ofr h ARG 90 CO -0.00 -0.61 0.33 1.25 -1.07 0.00 0.00 179.97 179.87 1ofr h LEU 91 N -0.94 0.00 0.16 3.04 5.85 -0.95 -1.73 115.31 120.73 1ofr h LEU 91 Ca -0.07 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1ofr h LEU 91 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1ofr h LEU 91 CO 0.04 0.00 -0.08 0.50 -0.34 0.00 0.00 178.44 178.56 1ofr h LYS 92 N 0.00 -0.20 -0.82 1.25 1.63 0.08 -0.92 116.57 117.59 1ofr h LYS 92 Ca 0.18 0.01 0.17 0.00 -0.85 0.00 0.00 60.65 60.17 1ofr h LYS 92 Cb 0.84 0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 32.45 1ofr h LYS 92 CO -0.00 0.23 0.54 0.87 -3.45 0.00 0.00 179.45 177.64 1ofr h LYS 93 N -0.77 0.39 -0.00 1.90 6.56 -0.40 -1.70 116.57 122.55 1ofr h LYS 93 Ca -0.02 -0.02 -0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1ofr h LYS 93 Cb 0.53 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1ofr h LYS 93 CO 0.04 0.26 -0.00 1.25 -2.06 0.00 0.00 179.45 178.93 1ofr h LEU 94 N 0.40 0.00 -1.95 2.94 5.85 -1.33 -3.20 115.31 118.03 1ofr h LEU 94 Ca 0.41 -0.76 0.25 0.00 0.84 0.00 0.00 57.88 58.61 1ofr h LEU 94 Cb 0.99 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 1ofr h LEU 94 CO -0.14 0.77 0.67 -1.28 -0.34 0.00 0.00 178.44 178.12 1ofr h SER 95 N -0.76 0.00 -0.10 1.25 0.87 -0.29 0.31 113.55 114.83 1ofr h SER 95 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1ofr h SER 95 Cb 0.77 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.72 1ofr h SER 95 CO 0.00 0.00 0.01 0.44 -0.53 0.00 0.00 176.83 176.75 1ofr h ASP 96 N 0.00 0.17 -0.39 6.23 3.32 -1.38 -2.10 116.42 122.27 1ofr h ASP 96 Ca 0.41 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1ofr h ASP 96 Cb 1.75 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 41.24 1ofr h ASP 96 CO -0.00 0.41 -0.05 -0.08 -1.72 0.00 0.00 179.24 177.79 1ofr h GLU 97 N -0.07 0.80 -0.47 3.56 4.81 -0.46 -3.08 114.58 119.67 1ofr h GLU 97 Ca 0.03 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 1ofr h GLU 97 Cb 0.31 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1ofr h GLU 97 CO 0.00 0.84 0.05 1.28 -0.73 0.00 0.00 179.01 180.45 1ofr n LEU 98 N -4.19 5.03 0.13 1.64 4.77 -0.63 -4.49 117.00 119.25 1ofr n LEU 98 Ca 0.02 -3.07 0.12 0.00 -0.03 0.00 0.00 56.01 53.05 1ofr n LEU 98 Cb 0.33 -0.64 0.49 0.00 -2.33 0.00 0.00 43.42 41.27 1ofr n LEU 98 CO 0.42 0.71 0.86 2.29 -1.33 0.00 0.00 177.39 180.34 1ofr n LYS 99 N -0.05 0.20 0.21 3.23 2.85 -0.79 0.10 118.16 123.91 1ofr n LYS 99 Ca 0.28 0.42 0.10 0.00 -1.05 0.00 0.00 58.31 58.06 1ofr n LYS 99 Cb 1.11 -1.87 0.27 0.00 -0.65 0.00 0.00 35.03 33.88 1ofr n LYS 99 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1ofr h GLY 100 N 2.29 0.00 0.00 2.58 0.00 -1.83 -3.38 103.07 102.74 1ofr h GLY 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ofr h GLY 100 CO 0.00 0.00 -0.62 1.22 0.00 0.00 0.00 176.54 177.14 1ofr n ASP 101 N -3.19 3.09 -4.11 0.19 8.00 -0.90 -4.90 116.55 114.74 1ofr n ASP 101 Ca 0.02 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.26 1ofr n ASP 101 Cb 0.53 0.47 -0.16 0.00 -0.02 0.00 0.00 41.12 41.93 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 -2.35 1.84 -0.41 0.64 1.43 0.28 -1.69 118.68 118.42 1ofr s LEU 102 Ca 0.00 -0.37 -0.10 0.00 -1.03 0.00 0.00 54.13 52.63 1ofr s LEU 102 Cb 0.00 -1.00 0.07 0.00 0.03 0.00 0.00 46.19 45.29 1ofr s LEU 102 CO 0.00 0.11 0.25 -0.55 0.23 0.00 0.00 176.35 176.38 1ofr s SER 103 N 0.35 5.65 -0.19 2.29 0.15 -0.70 -3.88 113.70 117.38 1ofr s SER 103 Ca -0.11 -1.40 -0.16 0.00 0.70 0.00 0.00 55.95 54.98 1ofr s SER 103 Cb -0.15 -1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 62.13 1ofr s SER 103 CO 0.04 -0.51 0.39 -0.63 1.20 0.00 0.00 173.24 173.74 1ofr s ILE 104 N 1.45 5.21 -0.11 6.45 1.01 -1.26 -0.96 121.20 133.00 1ofr s ILE 104 Ca 0.03 0.72 0.01 0.00 0.00 0.00 0.00 60.65 61.41 1ofr s ILE 104 Cb -0.22 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.51 1ofr s ILE 104 CO 0.03 0.28 -0.15 -0.63 0.00 0.00 0.00 174.94 174.47 1ofr s ILE 105 N 1.11 2.88 0.14 2.92 1.01 0.50 -4.55 121.20 125.21 1ofr s ILE 105 Ca 0.20 -0.74 -0.27 0.00 0.00 0.00 0.00 60.65 59.84 1ofr s ILE 105 Cb -0.15 -2.17 -0.07 0.00 0.01 0.00 0.00 42.46 40.08 1ofr s ILE 105 CO 0.08 0.54 0.83 -0.32 0.00 0.00 0.00 174.94 176.07 1ofr s MET 106 N 0.11 4.62 -0.23 2.79 -2.45 -0.44 -1.48 119.30 122.22 1ofr s MET 106 Ca -0.07 1.24 -0.29 0.00 -1.25 0.00 0.00 55.69 55.32 1ofr s MET 106 Cb -0.15 -3.31 -0.00 0.00 1.25 0.00 0.00 34.83 32.62 1ofr s MET 106 CO 0.05 0.44 1.19 1.03 1.05 0.00 0.00 175.02 178.78 1ofr s ARG 107 N -0.73 4.15 -0.41 4.11 0.52 -0.48 -0.46 118.95 125.64 1ofr s ARG 107 Ca 0.39 1.42 0.11 0.00 -0.52 0.00 0.00 55.73 57.12 1ofr s ARG 107 Cb -0.23 -3.76 0.40 0.00 0.52 0.00 0.00 34.95 31.89 1ofr s ARG 107 CO 0.27 -0.81 0.96 0.00 0.02 0.00 0.00 175.30 175.74 1ofr n ALA 108 N 6.80 3.89 -1.76 2.13 0.00 -0.57 -4.00 120.51 127.00 1ofr n ALA 108 Ca 0.13 -3.84 -0.38 0.00 0.00 0.00 0.00 53.44 49.36 1ofr n ALA 108 Cb 0.46 -0.78 0.01 0.00 0.00 0.00 0.00 19.45 19.14 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 -3.18 2.63 -0.38 0.00 1.51 -1.26 -4.68 117.35 111.98 1ofr s TYR 109 Ca 0.40 1.45 0.07 0.00 -1.01 0.00 0.00 57.07 57.97 1ofr s TYR 109 Cb 0.39 -3.60 0.68 0.00 -0.11 0.00 0.00 41.96 39.31 1ofr s TYR 109 CO -0.09 -2.17 1.83 1.28 -1.11 0.00 0.00 175.55 175.28 1ofr n LEU 110 N -0.58 6.20 0.00 -1.29 7.99 -1.26 -2.61 117.00 125.45 1ofr n LEU 110 Ca 0.08 -3.48 0.00 0.00 -0.01 0.00 0.00 56.01 52.60 1ofr n LEU 110 Cb 0.46 -0.78 0.00 0.00 -0.11 0.00 0.00 43.42 42.99 1ofr n LEU 110 CO 0.51 0.98 0.00 -1.84 -1.51 0.00 0.00 177.39 175.53 1ofr n GLU 111 N -0.77 0.00 -3.63 3.23 0.28 -1.26 -2.00 120.64 116.49 1ofr n GLU 111 Ca 0.50 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 57.41 1ofr n GLU 111 Cb 1.49 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 34.30 1ofr n GLU 111 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 1ofr s LYS 112 N -1.77 0.44 -1.21 3.44 2.36 -1.26 -4.56 119.74 117.17 1ofr s LYS 112 Ca 0.00 0.38 -0.20 0.00 -2.55 0.00 0.00 55.97 53.60 1ofr s LYS 112 Cb 0.00 0.21 -0.03 0.00 -1.05 0.00 0.00 37.83 36.96 1ofr s LYS 112 CO 0.00 -0.08 1.88 -0.35 1.55 0.00 0.00 175.35 178.35 1ofr n PRO 113 N 1.69 2.30 -0.57 4.03 -0.04 -1.26 -4.93 135.00 136.22 1ofr n PRO 113 Ca -0.11 -2.73 -0.30 0.00 -0.04 0.00 0.00 63.50 60.32 1ofr n PRO 113 Cb 0.57 -3.53 0.22 0.00 -0.04 0.00 0.00 33.50 30.71 1ofr n PRO 113 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1ofr n ARG 114 N 8.03 -2.03 -0.02 0.54 0.00 -1.26 -5.13 116.66 116.79 1ofr n ARG 114 Ca 0.47 -0.57 -0.01 0.00 -0.00 0.00 0.00 57.85 57.75 1ofr n ARG 114 Cb 0.45 -1.98 -0.05 0.00 -0.00 0.00 0.00 32.46 30.88 1ofr n ARG 114 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1ofr n THR 116 N -4.71 0.26 -0.47 8.89 -1.04 -1.26 -5.04 114.28 110.91 1ofr n THR 116 Ca 0.02 -0.22 -0.29 0.00 -2.04 0.00 0.00 64.05 61.52 1ofr n THR 116 Cb 0.57 -0.38 0.25 0.00 -1.82 0.00 0.00 70.33 68.95 1ofr n THR 116 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1ofr n VAL 117 N -2.04 0.00 0.00 12.58 0.31 -1.26 -4.92 118.33 123.00 1ofr n VAL 117 Ca -0.07 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1ofr n VAL 117 Cb 0.50 -0.91 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 1ofr n VAL 117 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ofr n GLY 118 N 1.39 0.30 3.69 2.92 0.00 -1.26 -5.08 105.19 107.15 1ofr n GLY 118 Ca 0.03 -2.30 -0.29 0.00 0.00 0.00 0.00 46.02 43.46 1ofr n GLY 118 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1ofr s TRP 119 N -0.04 2.16 -0.03 1.61 -0.00 -1.26 -5.03 118.94 116.35 1ofr s TRP 119 Ca 0.00 1.05 0.09 0.00 -0.00 0.00 0.00 56.10 57.25 1ofr s TRP 119 Cb 0.00 -3.24 -0.14 0.00 -0.00 0.00 0.00 33.47 30.09 1ofr s TRP 119 CO 0.00 -2.77 0.17 1.63 -0.00 0.00 0.00 176.95 175.98 1ofr n LYS 120 N -4.11 0.76 0.00 5.86 4.76 -1.26 -4.81 118.16 119.37 1ofr n LYS 120 Ca 0.06 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1ofr n LYS 120 Cb 0.57 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 32.53 1ofr n LYS 120 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ofr n GLY 121 N 2.06 3.25 0.25 0.72 0.00 -1.26 -4.46 105.19 105.75 1ofr n GLY 121 Ca -0.04 -1.80 0.09 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.59 0.19 115.31 120.75 1ofr h LEU 122 Ca 0.00 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.35 1ofr h LEU 122 Cb 0.00 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 1ofr h LEU 122 CO 0.00 0.00 -2.39 -0.38 -0.34 0.00 0.00 178.44 175.33 1ofr n ILE 123 N -2.42 1.39 0.02 4.05 5.41 -1.26 -3.74 119.36 122.81 1ofr n ILE 123 Ca -0.01 -0.76 -0.12 0.00 1.00 0.00 0.00 62.75 62.85 1ofr n ILE 123 Cb 0.45 -0.73 -0.14 0.00 -0.71 0.00 0.00 39.64 38.51 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 0.00 0.18 -2.15 4.38 4.21 -1.33 -3.34 115.58 117.53 1ofr h ASN 124 Ca -0.55 -0.29 -0.55 0.00 1.21 0.00 0.00 56.30 56.12 1ofr h ASN 124 Cb 2.13 -0.06 -0.37 0.00 -1.12 0.00 0.00 38.32 38.90 1ofr h ASN 124 CO -0.00 1.25 -0.99 -0.67 -1.29 0.00 0.00 177.43 175.73 1ofr n ASP 125 N -3.29 -0.49 0.26 5.81 -0.08 0.51 -2.92 116.55 116.36 1ofr n ASP 125 Ca -0.15 -2.51 0.12 0.00 -1.51 0.00 0.00 54.79 50.74 1ofr n ASP 125 Cb 1.03 -0.42 0.73 0.00 2.34 0.00 0.00 41.12 44.79 1ofr n ASP 125 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1ofr h PRO 126 N 5.09 0.00 -0.06 -0.67 0.13 -1.70 -2.71 132.00 132.09 1ofr h PRO 126 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1ofr h PRO 126 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1ofr h PRO 126 CO 0.38 0.11 0.00 -0.25 -0.23 0.00 0.00 178.00 178.01 1ofr n ASP 127 N -3.76 2.34 -3.61 1.44 8.00 -1.26 -4.98 116.55 114.72 1ofr n ASP 127 Ca -0.02 -1.78 -0.25 0.00 0.71 0.00 0.00 54.79 53.45 1ofr n ASP 127 Cb 0.22 -0.03 0.04 0.00 -0.02 0.00 0.00 41.12 41.33 1ofr n ASP 127 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1ofr n VAL 128 N 0.82 -6.06 -2.22 2.53 0.31 -1.02 -4.66 118.33 108.03 1ofr n VAL 128 Ca 0.17 -0.90 -0.04 0.00 -0.01 0.00 0.00 64.34 63.56 1ofr n VAL 128 Cb 0.48 -4.58 -0.02 0.00 -0.91 0.00 0.00 33.84 28.81 1ofr n VAL 128 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1ofr n ASN 129 N -2.91 -0.49 -0.93 4.52 2.04 -1.26 -4.16 115.26 112.08 1ofr n ASN 129 Ca -0.16 -2.02 -0.09 0.00 -0.44 0.00 0.00 54.58 51.87 1ofr n ASN 129 Cb 0.63 0.17 -0.04 0.00 -2.53 0.00 0.00 39.78 38.01 1ofr n ASN 129 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1ofr n ASN 130 N -0.07 -3.73 -4.17 0.53 4.13 -1.26 -4.86 115.26 105.83 1ofr n ASN 130 Ca -0.18 0.23 -0.40 0.00 1.68 0.00 0.00 54.58 55.91 1ofr n ASN 130 Cb 0.83 -3.06 -0.07 0.00 -1.54 0.00 0.00 39.78 35.93 1ofr n ASN 130 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1ofr s THR 131 N -1.65 4.36 0.25 3.41 2.01 -1.26 -5.06 115.64 117.69 1ofr s THR 131 Ca 0.00 -2.86 -0.31 0.00 0.31 0.00 0.00 61.69 58.83 1ofr s THR 131 Cb 0.00 -3.77 -0.13 0.00 0.01 0.00 0.00 72.50 68.61 1ofr s THR 131 CO 0.00 -0.94 1.42 0.49 -0.69 0.00 0.00 174.62 174.90 1ofr n PHE 132 N 3.57 2.23 -2.89 4.92 0.99 -1.26 -4.74 117.46 120.29 1ofr n PHE 132 Ca 0.10 0.42 -0.13 0.00 -0.00 0.00 0.00 57.45 57.85 1ofr n PHE 132 Cb 0.41 -2.47 0.02 0.00 -1.00 0.00 0.00 39.48 36.43 1ofr n PHE 132 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 1ofr n ASN 133 N 2.10 -1.90 -0.18 4.37 2.85 -1.15 -5.04 115.26 116.32 1ofr n ASN 133 Ca 0.11 -3.15 -0.01 0.00 -0.11 0.00 0.00 54.58 51.42 1ofr n ASN 133 Cb 0.32 1.07 0.07 0.00 1.24 0.00 0.00 39.78 42.49 1ofr n ASN 133 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1ofr h ILE 134 N 2.66 0.54 -0.50 -1.44 5.03 -1.76 0.24 117.51 122.27 1ofr h ILE 134 Ca -0.08 -0.03 0.08 0.00 -0.12 0.00 0.00 64.86 64.71 1ofr h ILE 134 Cb 0.99 0.43 -0.06 0.00 -3.03 0.00 0.00 36.82 35.15 1ofr h ILE 134 CO 0.36 0.02 0.15 0.78 -0.68 0.00 0.00 178.15 178.77 1ofr h ASN 135 N 0.10 0.11 0.57 1.72 2.35 -1.92 0.47 115.58 118.99 1ofr h ASN 135 Ca 0.28 0.07 -0.10 0.00 -0.55 0.00 0.00 56.30 56.01 1ofr h ASN 135 Cb 0.44 0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1ofr h ASN 135 CO -0.48 0.09 -0.48 0.50 -1.65 0.00 0.00 177.43 175.41 1ofr h LYS 136 N 0.30 0.00 -0.01 0.81 3.64 -1.74 -2.26 116.57 117.31 1ofr h LYS 136 Ca 0.25 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1ofr h LYS 136 Cb 0.30 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 1ofr h LYS 136 CO -0.28 0.48 0.01 0.78 -2.27 0.00 0.00 179.45 178.16 1ofr h GLY 137 N 1.63 0.02 1.80 5.01 0.00 0.26 -0.70 103.07 111.08 1ofr h GLY 137 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 1ofr h GLY 137 CO 0.06 0.01 -0.03 1.41 0.00 0.00 0.00 176.54 178.00 1ofr h LEU 138 N -0.09 0.24 -0.32 3.11 3.38 -0.05 0.18 115.31 121.76 1ofr h LEU 138 Ca 0.01 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1ofr h LEU 138 Cb 0.11 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ofr h LEU 138 CO -0.00 0.31 -0.24 1.56 0.09 0.00 0.00 178.44 180.16 1ofr h GLN 139 N 0.26 0.73 -0.08 1.13 4.20 -1.01 0.24 115.11 120.58 1ofr h GLN 139 Ca 0.06 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.40 1ofr h GLN 139 Cb 0.22 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1ofr h GLN 139 CO 0.01 0.97 0.01 0.77 -0.67 0.00 0.00 178.83 179.92 1ofr h SER 140 N 0.50 0.13 -0.00 1.46 0.02 -0.62 0.17 113.55 115.20 1ofr h SER 140 Ca 0.06 -0.26 0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1ofr h SER 140 Cb 0.80 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.28 1ofr h SER 140 CO 0.06 0.36 -0.24 0.00 -1.14 0.00 0.00 176.83 175.87 1ofr h ALA 141 N 0.77 -0.70 -0.68 3.77 0.00 -0.57 0.33 119.26 122.20 1ofr h ALA 141 Ca 0.02 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.98 1ofr h ALA 141 Cb 0.29 0.71 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 1ofr h ALA 141 CO 0.00 -0.77 0.33 -0.09 0.00 0.00 0.00 179.25 178.72 1ofr h ARG 142 N -0.30 0.55 -0.12 0.00 2.43 -0.91 -1.09 114.38 114.94 1ofr h ARG 142 Ca 0.01 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1ofr h ARG 142 Cb 0.32 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 1ofr h ARG 142 CO -0.16 0.36 -0.05 0.37 -1.51 0.00 0.00 179.97 178.98 1ofr h GLN 143 N 0.56 -0.03 0.04 0.20 5.75 -0.26 -1.21 115.11 120.16 1ofr h GLN 143 Ca 0.33 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.85 1ofr h GLN 143 Cb 0.35 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.86 1ofr h GLN 143 CO -0.27 -0.02 -0.49 1.25 -2.65 0.00 0.00 178.83 176.65 1ofr h LEU 144 N -0.03 -1.50 -0.99 -2.39 5.85 0.57 0.11 115.31 116.92 1ofr h LEU 144 Ca 0.06 0.16 0.23 0.00 0.84 0.00 0.00 57.88 59.17 1ofr h LEU 144 Cb 0.13 0.57 -0.12 0.00 0.37 0.00 0.00 40.66 41.61 1ofr h LEU 144 CO -0.14 -0.49 0.58 -0.26 -0.34 0.00 0.00 178.44 177.78 1ofr h PHE 145 N -0.64 0.99 -0.37 1.25 -1.00 -1.04 0.68 116.94 116.80 1ofr h PHE 145 Ca 0.00 0.04 -0.07 0.00 2.81 0.00 0.00 57.97 60.75 1ofr h PHE 145 Cb 0.68 -0.28 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 1ofr h PHE 145 CO -0.48 0.10 -0.06 0.28 -1.61 0.00 0.00 178.31 176.53 1ofr h VAL 146 N 0.62 1.27 -0.50 -0.55 2.07 -0.11 -1.74 116.25 117.31 1ofr h VAL 146 Ca 0.61 -1.12 0.03 0.00 0.82 0.00 0.00 66.70 67.05 1ofr h VAL 146 Cb 1.11 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 1ofr h VAL 146 CO -0.45 0.37 0.28 0.78 0.02 0.00 0.00 177.57 178.57 1ofr h ASN 147 N 0.49 0.44 0.58 0.57 2.35 0.14 -0.10 115.58 120.05 1ofr h ASN 147 Ca 0.10 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1ofr h ASN 147 Cb 0.56 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.86 1ofr h ASN 147 CO 0.03 0.31 -0.28 -0.07 -1.65 0.00 0.00 177.43 175.77 1ofr h LEU 148 N 0.56 -0.66 -2.66 1.61 3.38 -1.10 -3.03 115.31 113.41 1ofr h LEU 148 Ca 0.21 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1ofr h LEU 148 Cb 0.07 0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ofr h LEU 148 CO -0.12 -0.28 0.02 0.71 0.09 0.00 0.00 178.44 178.87 1ofr h THR 149 N -1.13 0.00 0.00 0.22 1.35 -1.31 -1.38 112.91 110.66 1ofr h THR 149 Ca -0.08 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.72 1ofr h THR 149 Cb 0.64 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 1ofr h THR 149 CO 0.13 0.00 -0.27 -1.13 -0.25 0.00 0.00 175.52 174.00 1ofr h ASN 150 N 0.00 0.00 -0.54 5.36 -1.24 -0.88 -2.57 115.58 115.72 1ofr h ASN 150 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1ofr h ASN 150 Cb 0.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.10 1ofr h ASN 150 CO 0.00 0.27 0.00 2.30 -1.29 0.00 0.00 177.43 178.71 1ofr n ILE 151 N -3.46 2.37 -1.01 2.57 -5.35 -0.52 -4.70 119.36 109.26 1ofr n ILE 151 Ca -0.00 -1.24 -0.00 0.00 -0.27 0.00 0.00 62.75 61.23 1ofr n ILE 151 Cb 0.44 -0.23 -0.00 0.00 -1.74 0.00 0.00 39.64 38.11 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 0.67 0.45 3.35 3.28 0.00 -0.97 -5.04 105.19 106.93 1ofr n GLY 152 Ca 0.25 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.08 4.00 0.85 0.99 2.96 -1.22 -4.97 118.68 121.20 1ofr s LEU 153 Ca 0.00 -0.77 -0.11 0.00 -0.22 0.00 0.00 54.13 53.03 1ofr s LEU 153 Cb 0.00 -1.90 0.11 0.00 0.50 0.00 0.00 46.19 44.89 1ofr s LEU 153 CO 0.00 -0.22 1.14 -2.84 -1.32 0.00 0.00 176.35 173.10 1ofr s PRO 154 N 1.50 1.53 0.09 0.98 0.02 -1.26 -3.59 135.00 134.27 1ofr s PRO 154 Ca 0.02 1.46 0.04 0.00 0.02 0.00 0.00 61.00 62.54 1ofr s PRO 154 Cb -0.18 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 1ofr s PRO 154 CO 0.03 -2.24 -0.10 0.96 -0.33 0.00 0.00 177.00 175.32 1ofr s ILE 155 N -2.64 0.92 0.11 2.83 -4.36 -1.26 -1.33 121.20 115.47 1ofr s ILE 155 Ca 0.66 -1.56 0.07 0.00 -0.26 0.00 0.00 60.65 59.56 1ofr s ILE 155 Cb -0.22 -1.27 -0.04 0.00 1.25 0.00 0.00 42.46 42.18 1ofr s ILE 155 CO 0.56 -0.52 -0.18 -0.83 0.24 0.00 0.00 174.94 174.21 1ofr s GLY 156 N -2.31 1.14 0.15 6.27 0.00 0.39 -1.62 107.32 111.34 1ofr s GLY 156 Ca 0.03 -1.24 -0.09 0.00 0.00 0.00 0.00 44.72 43.43 1ofr s GLY 156 CO 0.00 -1.26 0.27 -0.45 0.00 0.00 0.00 173.10 171.65 1ofr s SER 157 N -2.10 0.06 -0.06 1.64 0.15 -0.37 -1.50 113.70 111.51 1ofr s SER 157 Ca 0.06 -0.84 -0.19 0.00 0.70 0.00 0.00 55.95 55.68 1ofr s SER 157 Cb -0.08 0.42 -0.05 0.00 -1.71 0.00 0.00 66.02 64.60 1ofr s SER 157 CO 0.04 -0.87 0.53 -0.70 1.20 0.00 0.00 173.24 173.44 1ofr s GLU 158 N -3.95 4.30 -1.06 5.44 2.12 -1.26 -1.78 118.70 122.50 1ofr s GLU 158 Ca 0.16 0.58 -0.20 0.00 0.36 0.00 0.00 54.97 55.86 1ofr s GLU 158 Cb 0.04 -3.38 0.08 0.00 0.26 0.00 0.00 34.13 31.12 1ofr s GLU 158 CO -0.02 0.28 1.42 -1.64 -0.54 0.00 0.00 175.26 174.76 1ofr s MET 159 N 0.19 3.70 0.01 4.30 -1.94 -1.01 -4.88 119.30 119.67 1ofr s MET 159 Ca 0.28 -1.54 -0.07 0.00 -1.71 0.00 0.00 55.69 52.66 1ofr s MET 159 Cb -0.17 -5.27 -0.04 0.00 2.01 0.00 0.00 34.83 31.37 1ofr s MET 159 CO 0.14 -2.08 1.10 -0.07 -0.01 0.00 0.00 175.02 174.09 1ofr h LEU 160 N 11.97 -0.21 0.00 -0.03 -0.00 -1.95 -3.46 115.31 121.64 1ofr h LEU 160 Ca 0.24 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.13 1ofr h LEU 160 Cb 0.98 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.69 1ofr h LEU 160 CO 1.35 -0.15 0.00 -0.90 -0.00 0.00 0.00 178.44 178.74 1ofr n ASP 161 N -2.66 1.82 -1.52 -0.43 5.68 -1.26 -5.04 116.55 113.14 1ofr n ASP 161 Ca -0.03 -0.54 0.09 0.00 -0.50 0.00 0.00 54.79 53.81 1ofr n ASP 161 Cb 0.09 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.42 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 -0.05 2.06 0.01 2.12 -2.24 -1.26 -4.53 114.28 110.39 1ofr n THR 162 Ca 0.00 -1.32 0.00 0.00 -2.27 0.00 0.00 64.05 60.46 1ofr n THR 162 Cb 0.00 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 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 0.79 0.12 -0.33 2.28 5.41 -1.26 -4.54 119.36 121.82 1ofr n ILE 163 Ca 0.25 0.04 0.21 0.00 1.00 0.00 0.00 62.75 64.25 1ofr n ILE 163 Cb 0.94 -1.38 0.43 0.00 -0.71 0.00 0.00 39.64 38.92 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 0.49 -0.77 4.38 0.02 -1.99 0.14 113.55 115.81 1ofr h SER 164 Ca 0.00 0.18 0.10 0.00 -0.84 0.00 0.00 61.79 61.23 1ofr h SER 164 Cb 0.78 0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.40 1ofr h SER 164 CO 0.00 -0.08 0.50 -0.65 -1.14 0.00 0.00 176.83 175.46 1ofr h PRO 165 N 0.37 0.63 0.00 3.45 0.11 -1.87 -1.59 132.00 133.10 1ofr h PRO 165 Ca 0.69 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.76 1ofr h PRO 165 Cb 1.50 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.46 1ofr h PRO 165 CO -0.58 0.42 -0.01 1.96 -0.21 0.00 0.00 178.00 179.57 1ofr h GLN 166 N 0.65 0.00 0.00 1.05 1.08 -1.28 1.16 115.11 117.77 1ofr h GLN 166 Ca 0.36 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 1ofr h GLN 166 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1ofr h GLN 166 CO -0.13 0.01 -0.26 0.66 -0.95 0.00 0.00 178.83 178.16 1ofr n TYR 167 N -4.49 0.50 0.00 2.96 4.02 -0.60 -4.44 117.16 115.11 1ofr n TYR 167 Ca -0.03 0.15 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 1ofr n TYR 167 Cb 0.10 -0.67 0.00 0.00 -0.02 0.00 0.00 39.34 38.75 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 -1.96 0.00 -0.32 7.72 4.77 -0.64 -4.84 117.00 121.73 1ofr n LEU 168 Ca 0.05 -0.04 0.16 0.00 -0.03 0.00 0.00 56.01 56.15 1ofr n LEU 168 Cb 0.40 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.82 1ofr n LEU 168 CO 0.32 0.00 0.90 0.00 -1.33 0.00 0.00 177.39 177.28 1ofr h ALA 169 N 0.00 1.35 0.00 -1.18 0.00 0.11 -0.67 119.26 118.87 1ofr h ALA 169 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ofr h ALA 169 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ofr h ALA 169 CO 0.00 -0.58 0.17 0.38 0.00 0.00 0.00 179.25 179.22 1ofr h ASP 170 N 0.09 0.00 0.00 0.00 2.03 -1.89 -2.19 116.42 114.46 1ofr h ASP 170 Ca 0.61 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.91 1ofr h ASP 170 Cb 1.31 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.81 1ofr h ASP 170 CO -0.78 0.00 -0.67 0.18 -1.03 0.00 0.00 179.24 176.93 1ofr n LEU 171 N -2.67 0.50 -4.75 0.15 4.77 -0.26 -4.85 117.00 109.88 1ofr n LEU 171 Ca -0.02 -0.44 -0.40 0.00 -0.03 0.00 0.00 56.01 55.12 1ofr n LEU 171 Cb 0.22 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1ofr n LEU 171 CO 0.13 0.12 0.42 -0.69 -1.33 0.00 0.00 177.39 176.04 1ofr s VAL 172 N -2.21 4.77 -0.06 4.08 1.01 -0.83 -4.57 120.40 122.60 1ofr s VAL 172 Ca 0.03 1.52 0.18 0.00 0.00 0.00 0.00 61.98 63.71 1ofr s VAL 172 Cb 0.09 -4.06 -0.27 0.00 0.00 0.00 0.00 36.38 32.13 1ofr s VAL 172 CO 0.49 0.38 0.33 -1.20 0.00 0.00 0.00 175.10 175.11 1ofr n SER 173 N 2.75 0.75 -3.83 3.32 7.64 -0.64 -4.87 113.62 118.74 1ofr n SER 173 Ca -0.04 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.72 1ofr n SER 173 Cb 0.50 1.65 -0.12 0.00 -1.01 0.00 0.00 64.21 65.23 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 -3.11 -0.13 -0.01 1.43 5.36 -1.15 -4.16 117.98 116.21 1ofr s PHE 174 Ca -0.07 0.31 0.03 0.00 -0.96 0.00 0.00 56.93 56.24 1ofr s PHE 174 Cb 0.10 0.04 -0.01 0.00 -0.34 0.00 0.00 43.02 42.82 1ofr s PHE 174 CO 0.76 -0.10 -0.09 0.20 -1.46 0.00 0.00 175.22 174.53 1ofr s GLY 175 N -0.11 0.42 -0.07 13.12 0.00 -0.58 -1.24 107.32 118.87 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 -0.30 -0.13 0.00 0.00 0.00 0.00 173.10 172.67 1ofr s ALA 176 N -0.19 1.33 -0.13 3.20 0.00 -0.73 -0.12 121.76 125.12 1ofr s ALA 176 Ca 0.03 -0.46 -0.21 0.00 0.00 0.00 0.00 51.96 51.33 1ofr s ALA 176 Cb -0.04 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 1ofr s ALA 176 CO -0.00 0.13 0.60 0.42 0.00 0.00 0.00 175.76 176.91 1ofr s ILE 177 N 0.63 5.08 1.19 0.00 -1.09 -0.01 -2.39 121.20 124.61 1ofr s ILE 177 Ca -0.15 1.20 -0.13 0.00 -2.23 0.00 0.00 60.65 59.34 1ofr s ILE 177 Cb -0.16 -3.94 0.28 0.00 -1.58 0.00 0.00 42.46 37.07 1ofr s ILE 177 CO 0.04 0.23 0.93 0.61 -1.23 0.00 0.00 174.94 175.52 1ofr n GLY 178 N 3.40 -2.12 0.20 6.18 0.00 -1.26 -3.13 105.19 108.45 1ofr n GLY 178 Ca -0.03 -1.17 -0.01 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.69 1.19 -0.02 4.61 0.00 -1.86 -2.70 119.26 117.79 1ofr h ALA 179 Ca -0.62 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 53.90 1ofr h ALA 179 Cb 1.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ofr h ALA 179 CO 0.49 0.55 0.00 2.89 0.00 0.00 0.00 179.25 183.18 1ofr n ARG 180 N -4.05 1.19 0.00 0.00 1.85 -1.26 -3.83 116.66 110.56 1ofr n ARG 180 Ca -0.01 -0.28 0.00 0.00 -1.00 0.00 0.00 57.85 56.56 1ofr n ARG 180 Cb 0.45 -1.44 0.00 0.00 -1.05 0.00 0.00 32.46 30.42 1ofr n ARG 180 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1ofr n THR 181 N -0.62 0.00 -0.16 8.89 -2.24 -1.09 -4.77 114.28 114.30 1ofr n THR 181 Ca 0.20 -0.41 0.23 0.00 -2.27 0.00 0.00 64.05 61.80 1ofr n THR 181 Cb 0.16 1.01 0.64 0.00 -2.10 0.00 0.00 70.33 70.04 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 0.01 0.64 0.00 4.28 2.02 -1.59 0.17 112.91 118.44 1ofr h THR 182 Ca 0.00 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1ofr h THR 182 Cb 0.00 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1ofr h THR 182 CO 0.00 0.03 -0.26 -0.33 0.37 0.00 0.00 175.52 175.32 1ofr h GLU 183 N 0.15 0.00 -6.24 6.66 5.08 -1.86 -3.43 114.58 114.94 1ofr h GLU 183 Ca 0.40 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 58.21 1ofr h GLU 183 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1ofr h GLU 183 CO -0.07 0.07 1.25 0.45 -1.00 0.00 0.00 179.01 179.71 1ofr s SER 184 N -6.08 6.23 0.17 1.42 0.15 0.60 -4.89 113.70 111.29 1ofr s SER 184 Ca 0.05 2.20 -0.16 0.00 0.70 0.00 0.00 55.95 58.75 1ofr s SER 184 Cb 0.06 -2.53 0.12 0.00 -1.71 0.00 0.00 66.02 61.96 1ofr s SER 184 CO 0.70 -1.29 1.70 -0.61 1.20 0.00 0.00 173.24 174.94 1ofr h GLN 185 N 11.51 0.11 -1.01 5.44 5.75 -1.88 -1.36 115.11 133.66 1ofr h GLN 185 Ca -0.43 -0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.31 1ofr h GLN 185 Cb 1.21 -0.02 -0.12 0.00 1.07 0.00 0.00 27.48 29.62 1ofr h GLN 185 CO 0.96 0.07 0.60 1.25 -2.65 0.00 0.00 178.83 179.06 1ofr h LEU 186 N 0.11 0.66 0.00 -2.39 5.85 -1.94 0.12 115.31 117.72 1ofr h LEU 186 Ca 0.20 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.05 1ofr h LEU 186 Cb 0.28 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.34 1ofr h LEU 186 CO -0.33 0.11 -0.28 0.45 -0.34 0.00 0.00 178.44 178.05 1ofr h HIS 187 N 0.58 0.00 0.01 1.25 3.86 -1.55 -2.38 115.15 116.92 1ofr h HIS 187 Ca 0.64 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.76 1ofr h HIS 187 Cb 1.23 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.71 1ofr h HIS 187 CO -0.01 0.00 -0.36 0.00 0.86 0.00 0.00 177.93 178.43 1ofr h ARG 188 N 0.00 0.22 -0.83 2.45 3.08 -0.25 -2.47 114.38 116.58 1ofr h ARG 188 Ca 0.00 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 1ofr h ARG 188 Cb 0.83 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.92 1ofr h ARG 188 CO 0.00 0.99 0.37 0.93 -1.07 0.00 0.00 179.97 181.19 1ofr h GLU 189 N -0.43 1.21 -0.91 0.04 5.08 -1.33 -1.24 114.58 117.00 1ofr h GLU 189 Ca -0.05 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1ofr h GLU 189 Cb 1.12 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.12 1ofr h GLU 189 CO 0.07 0.95 0.60 1.25 -1.00 0.00 0.00 179.01 180.88 1ofr h LEU 190 N 1.19 1.05 -0.70 1.33 5.85 -1.45 -2.15 115.31 120.43 1ofr h LEU 190 Ca 0.28 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.83 1ofr h LEU 190 Cb 0.16 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1ofr h LEU 190 CO -0.03 0.77 -0.48 0.00 -0.34 0.00 0.00 178.44 178.36 1ofr h ALA 191 N 1.42 0.88 0.00 1.25 0.00 -0.90 -2.82 119.26 119.09 1ofr h ALA 191 Ca 0.33 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ofr h ALA 191 Cb -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ofr h ALA 191 CO -0.07 0.66 0.00 -1.13 0.00 0.00 0.00 179.25 178.71 1ofr n SER 192 N -3.98 0.00 0.00 0.00 3.41 -0.53 -2.27 113.62 110.25 1ofr n SER 192 Ca -0.02 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1ofr n SER 192 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 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 -0.29 -0.59 3.83 5.00 0.00 -1.07 -1.15 105.19 110.91 1ofr n GLY 193 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.13 3.92 -0.12 0.99 1.43 -0.96 -4.96 118.68 118.86 1ofr s LEU 194 Ca 0.00 1.64 0.03 0.00 -1.03 0.00 0.00 54.13 54.77 1ofr s LEU 194 Cb 0.00 -4.49 0.25 0.00 0.03 0.00 0.00 46.19 41.98 1ofr s LEU 194 CO 0.00 -0.37 1.12 -1.20 0.23 0.00 0.00 176.35 176.13 1ofr n SER 195 N -0.71 2.93 -3.25 2.29 7.64 -1.26 -4.90 113.62 116.37 1ofr n SER 195 Ca 0.07 -2.43 -0.11 0.00 1.01 0.00 0.00 58.87 57.41 1ofr n SER 195 Cb 0.54 -0.59 -0.01 0.00 -1.01 0.00 0.00 64.21 63.14 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 -1.36 0.49 0.26 1.43 -0.12 -1.26 -5.05 117.98 112.36 1ofr s PHE 196 Ca 0.19 -0.94 -0.29 0.00 -0.05 0.00 0.00 56.93 55.83 1ofr s PHE 196 Cb 0.15 0.39 -0.09 0.00 -0.63 0.00 0.00 43.02 42.84 1ofr s PHE 196 CO 0.05 -1.31 1.21 -2.14 -0.05 0.00 0.00 175.22 172.97 1ofr s PRO 197 N -2.93 4.50 -0.14 1.99 0.02 -1.26 -4.88 135.00 132.30 1ofr s PRO 197 Ca 0.22 1.96 0.02 0.00 0.02 0.00 0.00 61.00 63.22 1ofr s PRO 197 Cb -0.03 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.32 1ofr s PRO 197 CO 0.14 -0.03 -0.20 0.08 -0.33 0.00 0.00 177.00 176.67 1ofr s VAL 198 N -0.70 2.30 -0.22 3.83 1.01 -0.94 -1.52 120.40 124.15 1ofr s VAL 198 Ca 0.49 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 1ofr s VAL 198 Cb -0.35 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.05 1ofr s VAL 198 CO 0.43 0.54 0.15 -0.83 0.00 0.00 0.00 175.10 175.38 1ofr s GLY 199 N 0.75 2.01 -0.23 4.51 0.00 0.83 -2.18 107.32 113.00 1ofr s GLY 199 Ca -0.08 -0.80 -0.10 0.00 0.00 0.00 0.00 44.72 43.74 1ofr s GLY 199 CO 0.00 0.29 0.15 -1.36 0.00 0.00 0.00 173.10 172.18 1ofr s PHE 200 N 0.77 3.33 0.34 1.90 0.08 -0.14 -0.83 117.98 123.43 1ofr s PHE 200 Ca 0.08 0.23 -0.19 0.00 0.12 0.00 0.00 56.93 57.16 1ofr s PHE 200 Cb -0.12 -2.24 -0.10 0.00 -0.57 0.00 0.00 43.02 39.99 1ofr s PHE 200 CO 0.02 0.10 0.84 0.15 -0.10 0.00 0.00 175.22 176.23 1ofr s LYS 201 N 0.92 4.21 0.75 0.44 1.02 -1.18 -0.38 119.74 125.51 1ofr s LYS 201 Ca 0.07 0.95 -0.12 0.00 0.02 0.00 0.00 55.97 56.90 1ofr s LYS 201 Cb -0.13 -2.48 0.05 0.00 -0.52 0.00 0.00 37.83 34.75 1ofr s LYS 201 CO 0.03 0.15 1.11 0.54 -0.92 0.00 0.00 175.35 176.26 1ofr s ASN 202 N -2.04 4.55 0.51 2.83 4.22 -0.77 -4.59 114.94 119.64 1ofr s ASN 202 Ca 0.54 1.93 -0.20 0.00 -2.14 0.00 0.00 52.86 53.00 1ofr s ASN 202 Cb -0.12 -2.54 -0.10 0.00 1.28 0.00 0.00 41.25 39.77 1ofr s ASN 202 CO 0.17 -2.01 0.53 0.61 -2.04 0.00 0.00 177.10 174.36 1ofr n GLY 203 N -0.81 -1.50 0.00 0.45 0.00 -0.24 -4.78 105.19 98.31 1ofr n GLY 203 Ca 0.10 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.34 0.90 -1.33 2.61 -2.24 -1.26 -1.78 114.28 109.84 1ofr n THR 204 Ca 0.11 0.23 -0.20 0.00 -2.27 0.00 0.00 64.05 61.91 1ofr n THR 204 Cb 0.44 -1.07 0.17 0.00 -2.10 0.00 0.00 70.33 67.77 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 -1.32 3.95 0.00 3.42 5.75 -1.26 -3.09 116.55 123.99 1ofr n ASP 205 Ca 0.04 -3.69 0.00 0.00 -0.01 0.00 0.00 54.79 51.13 1ofr n ASP 205 Cb 0.08 -0.79 0.00 0.00 -1.03 0.00 0.00 41.12 39.38 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 -1.10 1.25 3.80 6.12 0.00 -0.73 -3.91 105.19 110.62 1ofr n GLY 206 Ca 0.53 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.41 3.89 -1.94 2.61 -4.23 -1.26 -4.81 115.64 108.49 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 -3.58 0.09 0.00 1.34 0.00 0.00 72.50 70.35 1ofr s THR 207 CO 0.00 -0.15 0.99 -0.11 -0.54 0.00 0.00 174.62 174.80 1ofr n LEU 208 N -0.54 2.16 -0.04 4.79 7.94 -1.26 -1.08 117.00 128.98 1ofr n LEU 208 Ca 0.07 -0.91 -0.12 0.00 -1.11 0.00 0.00 56.01 53.94 1ofr n LEU 208 Cb 0.52 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.40 1ofr n LEU 208 CO 0.41 0.39 0.74 0.78 -1.11 0.00 0.00 177.39 178.60 1ofr h ASN 209 N 2.85 0.22 -0.56 1.96 4.21 -2.00 -2.97 115.58 119.30 1ofr h ASN 209 Ca 0.00 -0.31 0.03 0.00 1.21 0.00 0.00 56.30 57.23 1ofr h ASN 209 Cb 0.67 -0.06 -0.03 0.00 -1.12 0.00 0.00 38.32 37.78 1ofr h ASN 209 CO 0.00 0.48 0.37 -0.37 -1.29 0.00 0.00 177.43 176.62 1ofr h VAL 210 N -0.04 1.07 -0.02 2.81 -1.51 -1.97 -1.56 116.25 115.03 1ofr h VAL 210 Ca 0.04 -0.22 -0.17 0.00 -1.23 0.00 0.00 66.70 65.11 1ofr h VAL 210 Cb 0.36 0.36 -0.01 0.00 -2.13 0.00 0.00 31.29 29.87 1ofr h VAL 210 CO 0.01 0.12 -0.76 0.00 -1.23 0.00 0.00 177.57 175.71 1ofr h ALA 211 N 1.67 0.69 -0.17 5.19 0.00 -1.80 -1.23 119.26 123.62 1ofr h ALA 211 Ca 0.23 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 1ofr h ALA 211 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ofr h ALA 211 CO -0.06 0.85 -0.45 0.28 0.00 0.00 0.00 179.25 179.87 1ofr h VAL 212 N 0.11 1.32 0.00 0.00 2.07 -1.24 -2.32 116.25 116.18 1ofr h VAL 212 Ca -0.02 -1.64 -0.13 0.00 0.82 0.00 0.00 66.70 65.73 1ofr h VAL 212 Cb 1.33 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1ofr h VAL 212 CO 0.11 0.50 -0.62 0.44 0.02 0.00 0.00 177.57 178.03 1ofr h ASP 213 N 0.34 0.00 0.14 0.57 3.32 -1.12 -2.07 116.42 117.60 1ofr h ASP 213 Ca 0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1ofr h ASP 213 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1ofr h ASP 213 CO 0.08 0.62 -0.07 0.00 -1.72 0.00 0.00 179.24 178.15 1ofr h ALA 214 N 1.38 -0.18 -0.94 3.45 0.00 -0.95 -1.24 119.26 120.78 1ofr h ALA 214 Ca -0.01 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ofr h ALA 214 Cb 1.24 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 1ofr h ALA 214 CO 0.08 -0.45 0.59 0.00 0.00 0.00 0.00 179.25 179.47 1ofr h GLN 216 N 1.04 -0.16 -0.03 0.00 1.08 -1.17 -2.71 115.11 113.15 1ofr h GLN 216 Ca 0.42 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.63 1ofr h GLN 216 Cb 0.25 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1ofr h GLN 216 CO -0.20 -0.11 0.01 0.00 -0.95 0.00 0.00 178.83 177.59 1ofr h ALA 217 N 0.77 0.04 0.00 3.87 0.00 -0.48 -2.65 119.26 120.81 1ofr h ALA 217 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ofr h ALA 217 Cb 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ofr h ALA 217 CO -0.05 -0.40 0.09 0.00 0.00 0.00 0.00 179.25 178.89 1ofr h ALA 218 N 0.88 1.09 0.00 0.00 0.00 -0.86 -0.17 119.26 120.20 1ofr h ALA 218 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1ofr h ALA 218 Cb 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ofr h ALA 218 CO -0.00 -0.09 -0.31 0.00 0.00 0.00 0.00 179.25 178.85 1ofr h ALA 219 N 1.79 0.89 -2.20 0.00 0.00 -1.14 0.68 119.26 119.28 1ofr h ALA 219 Ca 0.00 -0.28 -0.46 0.00 0.00 0.00 0.00 54.91 54.17 1ofr h ALA 219 Cb 0.19 -0.05 0.09 0.00 0.00 0.00 0.00 17.79 18.02 1ofr h ALA 219 CO 0.00 0.39 0.24 -1.01 0.00 0.00 0.00 179.25 178.87 1ofr s HIS 220 N -3.37 2.68 0.01 0.00 3.76 -0.08 -4.02 115.29 114.28 1ofr s HIS 220 Ca 0.02 0.38 -0.18 0.00 -0.15 0.00 0.00 55.06 55.13 1ofr s HIS 220 Cb 0.09 -3.27 -0.06 0.00 1.11 0.00 0.00 32.58 30.45 1ofr s HIS 220 CO 0.68 -1.56 0.52 0.45 -0.85 0.00 0.00 174.74 173.98 1ofr s SER 221 N -4.57 6.93 0.21 1.40 0.15 -1.26 -3.56 113.70 113.00 1ofr s SER 221 Ca 0.62 1.10 0.08 0.00 0.70 0.00 0.00 55.95 58.45 1ofr s SER 221 Cb -0.10 -2.32 -0.05 0.00 -1.71 0.00 0.00 66.02 61.84 1ofr s SER 221 CO 0.46 0.21 -0.15 -1.00 1.20 0.00 0.00 173.24 173.95 1ofr s HIS 222 N -0.64 1.77 -0.35 3.44 3.76 -1.23 -4.93 115.29 117.12 1ofr s HIS 222 Ca 0.28 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.66 1ofr s HIS 222 Cb -0.18 -0.82 0.10 0.00 1.11 0.00 0.00 32.58 32.80 1ofr s HIS 222 CO 0.16 0.40 0.09 -1.01 -0.85 0.00 0.00 174.74 173.52 1ofr s HIS 223 N -2.92 3.01 0.30 1.40 3.76 -1.26 -0.46 115.29 119.12 1ofr s HIS 223 Ca 0.23 -2.60 0.03 0.00 -0.15 0.00 0.00 55.06 52.58 1ofr s HIS 223 Cb -0.01 -2.50 -0.06 0.00 1.11 0.00 0.00 32.58 31.12 1ofr s HIS 223 CO 0.08 -0.91 0.06 -0.59 -0.85 0.00 0.00 174.74 172.53 1ofr s PHE 224 N 1.03 1.86 -0.31 1.40 -0.12 -0.36 -4.95 117.98 116.54 1ofr s PHE 224 Ca 0.11 -0.98 -0.17 0.00 -0.05 0.00 0.00 56.93 55.84 1ofr s PHE 224 Cb -0.19 -1.18 -0.02 0.00 -0.63 0.00 0.00 43.02 41.00 1ofr s PHE 224 CO -0.13 -0.05 0.44 -1.64 -0.05 0.00 0.00 175.22 173.80 1ofr s MET 225 N -3.91 3.80 0.00 1.99 -1.94 -1.26 0.98 119.30 118.96 1ofr s MET 225 Ca 0.36 -0.07 0.00 0.00 -1.71 0.00 0.00 55.69 54.27 1ofr s MET 225 Cb 0.08 -3.74 0.00 0.00 2.01 0.00 0.00 34.83 33.19 1ofr s MET 225 CO 0.15 -0.46 0.00 0.41 -0.01 0.00 0.00 175.02 175.10 1ofr n GLY 226 N 4.73 4.71 3.35 -0.03 0.00 -0.33 -4.92 105.19 112.70 1ofr n GLY 226 Ca -0.07 -1.77 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.25 2.19 0.91 1.61 -7.23 -1.26 -0.15 120.40 115.22 1ofr s VAL 227 Ca 0.00 -1.31 -0.15 0.00 -1.81 0.00 0.00 61.98 58.71 1ofr s VAL 227 Cb 0.00 -1.84 0.16 0.00 0.56 0.00 0.00 36.38 35.26 1ofr s VAL 227 CO 0.00 0.41 1.27 0.42 -0.31 0.00 0.00 175.10 176.89 1ofr s THR 228 N -0.77 2.00 -0.36 5.32 -4.23 0.84 -4.87 115.64 113.57 1ofr s THR 228 Ca 0.12 -0.00 0.19 0.00 -1.18 0.00 0.00 61.69 60.82 1ofr s THR 228 Cb -0.10 -3.00 0.19 0.00 1.34 0.00 0.00 72.50 70.93 1ofr s THR 228 CO 0.02 0.00 1.59 0.29 -0.54 0.00 0.00 174.62 175.98 1ofr n LYS 229 N -3.61 0.13 -1.03 3.99 4.76 -1.26 -1.71 118.16 119.43 1ofr n LYS 229 Ca 0.13 0.58 -0.13 0.00 -2.87 0.00 0.00 58.31 56.02 1ofr n LYS 229 Cb 0.60 -1.88 0.22 0.00 -1.84 0.00 0.00 35.03 32.13 1ofr n LYS 229 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1ofr n HIS 230 N -2.15 2.30 -1.88 2.13 8.25 -1.26 -0.07 115.22 122.54 1ofr n HIS 230 Ca -0.01 -1.57 -0.21 0.00 -0.26 0.00 0.00 57.72 55.68 1ofr n HIS 230 Cb 0.07 -0.73 -0.06 0.00 1.12 0.00 0.00 29.99 30.38 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 -0.86 1.11 3.50 -1.41 0.00 -0.69 -4.97 105.19 101.87 1ofr n GLY 231 Ca 0.46 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.86 3.17 0.14 1.61 1.01 -1.26 -4.85 120.40 117.36 1ofr s VAL 232 Ca 0.00 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 1ofr s VAL 232 Cb 0.00 -2.27 -0.08 0.00 0.00 0.00 0.00 36.38 34.03 1ofr s VAL 232 CO 0.00 0.54 1.29 0.00 0.00 0.00 0.00 175.10 176.93 1ofr s ALA 233 N -0.79 3.50 0.05 5.51 0.00 -1.26 -0.11 121.76 128.66 1ofr s ALA 233 Ca 0.13 1.03 -0.16 0.00 0.00 0.00 0.00 51.96 52.96 1ofr s ALA 233 Cb -0.11 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.56 1ofr s ALA 233 CO 0.02 -0.51 0.36 0.00 0.00 0.00 0.00 175.76 175.63 1ofr s ALA 234 N 0.57 -0.84 -0.60 0.00 0.00 0.79 -4.91 121.76 116.76 1ofr s ALA 234 Ca 0.59 0.11 -0.27 0.00 0.00 0.00 0.00 51.96 52.39 1ofr s ALA 234 Cb -0.34 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1ofr s ALA 234 CO 0.34 -0.46 1.49 0.42 0.00 0.00 0.00 175.76 177.55 1ofr s ILE 235 N -2.71 3.67 0.25 0.00 1.01 -1.26 -1.19 121.20 120.97 1ofr s ILE 235 Ca -0.04 0.51 -0.18 0.00 0.00 0.00 0.00 60.65 60.93 1ofr s ILE 235 Cb -0.00 -4.41 -0.08 0.00 0.01 0.00 0.00 42.46 37.97 1ofr s ILE 235 CO -0.04 -1.24 0.73 -0.89 0.00 0.00 0.00 174.94 173.49 1ofr s THR 236 N 6.66 4.60 -0.09 2.92 2.01 0.28 -4.92 115.64 127.10 1ofr s THR 236 Ca 0.53 1.19 -0.00 0.00 0.31 0.00 0.00 61.69 63.72 1ofr s THR 236 Cb -0.11 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.64 1ofr s THR 236 CO 0.22 0.10 -0.06 -0.89 -0.69 0.00 0.00 174.62 173.30 1ofr s THR 237 N -1.65 0.81 0.24 -0.82 2.01 -1.26 -1.22 115.64 113.74 1ofr s THR 237 Ca 0.46 -0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.32 1ofr s THR 237 Cb -0.15 -0.84 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 1ofr s THR 237 CO 0.20 0.32 0.35 0.42 -0.69 0.00 0.00 174.62 175.22 1ofr s THR 238 N 1.50 5.23 -0.00 -0.82 -4.23 0.39 -4.95 115.64 112.76 1ofr s THR 238 Ca -0.00 -0.99 -0.01 0.00 -1.18 0.00 0.00 61.69 59.51 1ofr s THR 238 Cb -0.13 -3.84 -0.27 0.00 1.34 0.00 0.00 72.50 69.61 1ofr s THR 238 CO -0.04 -0.32 0.83 0.50 -0.54 0.00 0.00 174.62 175.05 1ofr h LYS 239 N 1.24 0.20 0.00 3.99 3.64 -1.87 -3.26 116.57 120.52 1ofr h LYS 239 Ca -0.52 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 58.52 1ofr h LYS 239 Cb 1.23 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1ofr h LYS 239 CO 0.61 1.03 0.00 0.41 -2.27 0.00 0.00 179.45 179.24 1ofr n GLY 240 N 1.65 3.23 3.41 5.01 0.00 -0.30 -4.07 105.19 114.11 1ofr n GLY 240 Ca -0.16 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 43.98 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 4.73 0.00 1.61 3.84 0.24 -4.85 114.94 120.51 1ofr s ASN 241 Ca 0.00 -0.26 0.21 0.00 0.21 0.00 0.00 52.86 53.03 1ofr s ASN 241 Cb 0.00 -1.82 0.58 0.00 -0.55 0.00 0.00 41.25 39.47 1ofr s ASN 241 CO 0.00 0.02 1.49 -1.84 -2.79 0.00 0.00 177.10 173.98 1ofr n GLU 242 N 4.51 2.71 -1.99 0.43 0.00 -1.26 -3.33 120.64 121.71 1ofr n GLU 242 Ca -0.17 -2.55 -0.29 0.00 0.00 0.00 0.00 57.16 54.14 1ofr n GLU 242 Cb 0.51 -1.53 0.03 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 1.51 3.06 -3.88 -1.84 8.25 -1.26 -4.97 115.22 116.08 1ofr n HIS 243 Ca 0.22 -2.64 -0.36 0.00 -0.26 0.00 0.00 57.72 54.69 1ofr n HIS 243 Cb 0.60 -0.61 -0.11 0.00 1.12 0.00 0.00 29.99 30.99 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 1.05 2.14 -0.09 0.00 -0.71 -0.93 -4.56 117.98 114.87 1ofr s PHE 245 Ca 0.04 -0.88 -0.07 0.00 -1.04 0.00 0.00 56.93 54.99 1ofr s PHE 245 Cb -0.14 -1.54 -0.04 0.00 -1.21 0.00 0.00 43.02 40.09 1ofr s PHE 245 CO 0.03 0.20 0.16 0.08 -1.34 0.00 0.00 175.22 174.35 1ofr s VAL 246 N -2.96 5.47 -0.11 -2.49 1.01 -1.26 -0.97 120.40 119.10 1ofr s VAL 246 Ca 0.27 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.44 1ofr s VAL 246 Cb 0.07 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1ofr s VAL 246 CO 0.13 0.56 -0.18 -0.63 0.00 0.00 0.00 175.10 174.98 1ofr s ILE 247 N -1.09 2.63 -0.28 2.22 1.01 0.49 -0.69 121.20 125.49 1ofr s ILE 247 Ca 0.18 -0.82 -0.13 0.00 0.00 0.00 0.00 60.65 59.88 1ofr s ILE 247 Cb -0.12 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1ofr s ILE 247 CO 0.07 0.55 0.27 -0.76 0.00 0.00 0.00 174.94 175.07 1ofr s LEU 248 N 0.20 4.05 -0.06 2.97 1.43 0.17 -1.85 118.68 125.59 1ofr s LEU 248 Ca -0.11 0.10 0.12 0.00 -1.03 0.00 0.00 54.13 53.21 1ofr s LEU 248 Cb -0.16 -2.25 0.22 0.00 0.03 0.00 0.00 46.19 44.03 1ofr s LEU 248 CO 0.06 -0.12 1.10 -2.11 0.23 0.00 0.00 176.35 175.52 1ofr n ARG 249 N 5.18 0.55 -0.07 1.70 -4.01 -1.26 -0.23 116.66 118.53 1ofr n ARG 249 Ca -0.11 -1.94 0.01 0.00 -1.04 0.00 0.00 57.85 54.77 1ofr n ARG 249 Cb 0.51 -0.81 -0.00 0.00 -3.04 0.00 0.00 32.46 29.12 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 -0.43 -1.76 0.00 2.89 0.00 -1.26 -2.21 105.19 102.41 1ofr n GLY 250 Ca 0.08 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.30 -1.27 0.18 -0.02 0.00 -1.22 -4.19 105.19 98.37 1ofr n GLY 251 Ca 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 46.02 44.93 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 0.27 -0.05 1.61 1.57 -1.71 0.04 116.57 118.31 1ofr h LYS 252 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ofr h LYS 252 Cb 0.00 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1ofr h LYS 252 CO 0.00 0.18 0.00 1.17 -0.57 0.00 0.00 179.45 180.23 1ofr n LYS 253 N -5.05 0.09 0.00 3.15 4.81 -1.25 -4.87 118.16 115.04 1ofr n LYS 253 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 1ofr n LYS 253 Cb 0.19 -1.02 0.00 0.00 0.02 0.00 0.00 35.03 34.21 1ofr n LYS 253 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ofr n GLY 254 N 0.03 -0.94 3.48 3.14 0.00 0.00 -4.97 105.19 105.94 1ofr n GLY 254 Ca 0.00 -1.62 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.73 0.00 -2.34 2.61 -2.24 -1.26 -3.42 114.28 106.90 1ofr n THR 255 Ca 0.00 -0.15 0.03 0.00 -2.27 0.00 0.00 64.05 61.66 1ofr n THR 255 Cb 0.00 -0.74 0.01 0.00 -2.10 0.00 0.00 70.33 67.50 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 -2.29 0.68 -0.20 3.42 0.23 -1.26 -4.88 115.26 110.95 1ofr n ASN 256 Ca 0.08 -2.00 0.06 0.00 -0.53 0.00 0.00 54.58 52.19 1ofr n ASN 256 Cb 0.54 -0.27 0.30 0.00 -2.08 0.00 0.00 39.78 38.27 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 0.34 0.11 -4.05 -2.53 0.18 -1.26 -4.25 117.16 105.70 1ofr n TYR 257 Ca 0.04 -0.06 -0.30 0.00 1.88 0.00 0.00 57.90 59.46 1ofr n TYR 257 Cb 1.01 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.90 1ofr n TYR 257 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1ofr s ASP 258 N -1.32 5.51 0.18 9.48 -4.77 -1.26 -4.52 116.67 119.98 1ofr s ASP 258 Ca 0.20 -0.03 -0.03 0.00 -3.30 0.00 0.00 52.55 49.39 1ofr s ASP 258 Cb 0.10 -1.47 0.36 0.00 -1.09 0.00 0.00 42.92 40.82 1ofr s ASP 258 CO 0.15 0.16 0.99 0.00 0.70 0.00 0.00 175.17 177.18 1ofr n ALA 259 N 0.37 0.22 -0.20 2.11 0.00 -1.26 0.14 120.51 121.89 1ofr n ALA 259 Ca -0.09 0.69 -0.03 0.00 0.00 0.00 0.00 53.44 54.01 1ofr n ALA 259 Cb 0.52 -0.45 0.07 0.00 0.00 0.00 0.00 19.45 19.59 1ofr n ALA 259 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1ofr h LYS 260 N 0.00 0.59 -0.19 0.00 1.63 -1.95 0.50 116.57 117.16 1ofr h LYS 260 Ca 0.33 -0.04 -0.19 0.00 -0.85 0.00 0.00 60.65 59.91 1ofr h LYS 260 Cb 0.58 -0.13 0.01 0.00 -0.60 0.00 0.00 32.23 32.09 1ofr h LYS 260 CO -0.63 0.39 -0.61 0.77 -3.45 0.00 0.00 179.45 175.92 1ofr h SER 261 N 0.61 0.87 -0.69 4.20 0.02 0.95 -2.35 113.55 117.15 1ofr h SER 261 Ca 0.25 -0.59 0.11 0.00 -0.84 0.00 0.00 61.79 60.72 1ofr h SER 261 Cb 0.12 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 1ofr h SER 261 CO -0.15 1.31 0.46 0.58 -1.14 0.00 0.00 176.83 177.89 1ofr h VAL 262 N 0.47 0.88 0.08 2.27 2.07 -0.54 0.12 116.25 121.61 1ofr h VAL 262 Ca -0.02 -0.17 -0.26 0.00 0.82 0.00 0.00 66.70 67.07 1ofr h VAL 262 Cb 1.24 0.35 0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1ofr h VAL 262 CO 0.13 0.09 -1.07 0.00 0.02 0.00 0.00 177.57 176.74 1ofr h ALA 263 N 1.66 0.02 -0.98 1.67 0.00 -0.80 -0.83 119.26 120.00 1ofr h ALA 263 Ca 0.32 -0.72 0.05 0.00 0.00 0.00 0.00 54.91 54.57 1ofr h ALA 263 Cb 0.60 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 1ofr h ALA 263 CO -0.10 0.60 0.64 0.93 0.00 0.00 0.00 179.25 181.32 1ofr h GLU 264 N 0.18 1.16 0.53 0.00 5.08 -0.79 -0.95 114.58 119.79 1ofr h GLU 264 Ca -0.16 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 1ofr h GLU 264 Cb 1.76 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 30.75 1ofr h GLU 264 CO 0.21 0.77 -0.25 0.00 -1.00 0.00 0.00 179.01 178.73 1ofr h ALA 265 N 1.45 -1.13 -1.06 3.43 0.00 -0.74 -2.78 119.26 118.44 1ofr h ALA 265 Ca 0.41 -0.15 0.34 0.00 0.00 0.00 0.00 54.91 55.51 1ofr h ALA 265 Cb 0.09 0.27 -0.14 0.00 0.00 0.00 0.00 17.79 18.01 1ofr h ALA 265 CO -0.14 -1.08 0.62 0.87 0.00 0.00 0.00 179.25 179.52 1ofr h LYS 266 N -0.74 0.26 -0.19 0.00 1.57 -0.93 1.40 116.57 117.94 1ofr h LYS 266 Ca -0.07 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1ofr h LYS 266 Cb 0.54 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1ofr h LYS 266 CO 0.12 0.17 0.09 0.00 -0.57 0.00 0.00 179.45 179.26 1ofr h ALA 267 N 1.81 1.81 0.00 3.86 0.00 -1.00 -2.86 119.26 122.88 1ofr h ALA 267 Ca 0.75 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.59 1ofr h ALA 267 Cb 1.86 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 1ofr h ALA 267 CO -0.57 0.17 -1.11 1.04 0.00 0.00 0.00 179.25 178.78 1ofr n GLN 268 N -4.47 0.61 -1.79 0.00 6.02 0.47 -4.90 117.38 113.32 1ofr n GLN 268 Ca -0.00 0.12 -0.42 0.00 -0.01 0.00 0.00 57.00 56.69 1ofr n GLN 268 Cb 0.10 -1.81 -0.03 0.00 1.02 0.00 0.00 30.24 29.52 1ofr n GLN 268 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ofr s LEU 269 N -5.38 4.38 0.00 1.08 1.43 -0.74 -4.99 118.68 114.46 1ofr s LEU 269 Ca -0.01 2.69 -0.16 0.00 -1.03 0.00 0.00 54.13 55.61 1ofr s LEU 269 Cb 0.10 -3.57 0.23 0.00 0.03 0.00 0.00 46.19 42.98 1ofr s LEU 269 CO 0.80 -0.95 0.96 -0.81 0.23 0.00 0.00 176.35 176.57 1ofr n PRO 270 N 5.29 -2.28 -1.98 1.29 -0.04 -1.26 -4.94 135.00 131.08 1ofr n PRO 270 Ca 0.17 -1.52 -0.41 0.00 -0.04 0.00 0.00 63.50 61.70 1ofr n PRO 270 Cb 0.38 -1.29 -0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1ofr n PRO 270 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ofr s ALA 271 N -3.29 3.54 -0.88 0.55 0.00 -1.26 -3.18 121.76 117.24 1ofr s ALA 271 Ca 0.60 1.39 -0.00 0.00 0.00 0.00 0.00 51.96 53.95 1ofr s ALA 271 Cb -0.05 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1ofr s ALA 271 CO 0.45 -0.82 0.01 0.41 0.00 0.00 0.00 175.76 175.81 1ofr n GLY 272 N 0.79 -0.05 3.87 0.00 0.00 -1.26 -5.02 105.19 103.52 1ofr n GLY 272 Ca 0.01 -0.45 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 1ofr n GLY 272 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ofr s SER 273 N -2.55 6.49 0.75 1.61 0.01 -1.19 -5.08 113.70 113.74 1ofr s SER 273 Ca 0.01 1.20 -0.00 0.00 1.31 0.00 0.00 55.95 58.46 1ofr s SER 273 Cb -0.00 -2.35 0.15 0.00 0.21 0.00 0.00 66.02 64.02 1ofr s SER 273 CO 0.01 -0.48 1.03 0.20 0.41 0.00 0.00 173.24 174.40 1ofr s ASN 274 N -3.33 4.18 0.18 2.44 0.01 -1.26 -5.04 114.94 112.12 1ofr s ASN 274 Ca 0.52 -0.50 -0.30 0.00 -0.71 0.00 0.00 52.86 51.87 1ofr s ASN 274 Cb -0.10 0.23 -0.09 0.00 0.41 0.00 0.00 41.25 41.70 1ofr s ASN 274 CO 0.35 -2.00 1.34 -0.83 -1.51 0.00 0.00 177.10 174.45 1ofr s GLY 275 N -4.81 2.32 0.50 0.66 0.00 0.98 -4.84 107.32 102.14 1ofr s GLY 275 Ca 0.68 1.13 -0.23 0.00 0.00 0.00 0.00 44.72 46.30 1ofr s GLY 275 CO 0.45 2.16 1.31 1.08 0.00 0.00 0.00 173.10 178.10 1ofr s LEU 276 N 0.18 3.95 -0.04 0.66 1.43 -0.45 -4.60 118.68 119.81 1ofr s LEU 276 Ca 0.59 2.65 0.06 0.00 -1.03 0.00 0.00 54.13 56.40 1ofr s LEU 276 Cb -0.37 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 41.63 1ofr s LEU 276 CO 0.37 -1.30 -0.20 -0.32 0.23 0.00 0.00 176.35 175.13 1ofr s MET 277 N -2.75 2.34 -0.23 1.70 -2.45 0.14 -1.10 119.30 116.95 1ofr s MET 277 Ca 0.67 -0.80 -0.00 0.00 -1.25 0.00 0.00 55.69 54.31 1ofr s MET 277 Cb -0.38 -2.23 0.03 0.00 1.25 0.00 0.00 34.83 33.51 1ofr s MET 277 CO 0.45 0.58 -0.11 0.42 1.05 0.00 0.00 175.02 177.42 1ofr s ILE 278 N -0.65 2.54 -0.31 10.11 1.01 0.73 0.42 121.20 135.05 1ofr s ILE 278 Ca 0.10 -1.09 -0.25 0.00 0.00 0.00 0.00 60.65 59.40 1ofr s ILE 278 Cb -0.10 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.11 1ofr s ILE 278 CO -0.00 0.26 0.89 -0.62 0.00 0.00 0.00 174.94 175.47 1ofr s ASP 279 N 1.28 6.76 0.03 3.58 2.15 0.68 -1.20 116.67 129.95 1ofr s ASP 279 Ca 0.00 0.79 -0.30 0.00 0.43 0.00 0.00 52.55 53.47 1ofr s ASP 279 Cb -0.16 -2.46 -0.17 0.00 -0.30 0.00 0.00 42.92 39.83 1ofr s ASP 279 CO -0.07 -0.72 1.30 1.88 -0.17 0.00 0.00 175.17 177.39 1ofr h TYR 280 N 8.12 -0.93 -1.44 -5.34 0.05 -1.09 -3.42 116.97 112.92 1ofr h TYR 280 Ca -0.23 -0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.48 1ofr h TYR 280 Cb 1.08 0.31 0.03 0.00 1.01 0.00 0.00 36.73 39.16 1ofr h TYR 280 CO 0.80 -0.56 -0.01 0.45 -1.05 0.00 0.00 178.16 177.79 1ofr n SER 281 N -5.46 -1.88 0.00 3.88 2.88 -1.26 -3.96 113.62 107.83 1ofr n SER 281 Ca -0.13 -0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 1ofr n SER 281 Cb 0.41 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 1ofr n SER 281 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1ofr n HIS 282 N -3.18 0.00 0.19 0.66 8.25 -1.26 -3.20 115.22 116.68 1ofr n HIS 282 Ca 0.02 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.56 1ofr n HIS 282 Cb 0.08 0.03 0.44 0.00 1.12 0.00 0.00 29.99 31.66 1ofr n HIS 282 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ofr h GLY 283 N 0.00 0.00 -3.84 -1.41 0.00 -1.77 0.51 103.07 96.57 1ofr h GLY 283 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1ofr h GLY 283 CO 0.00 0.00 0.64 0.70 0.00 0.00 0.00 176.54 177.88 1ofr n ASN 284 N -2.18 4.37 0.00 0.19 3.02 -1.18 -4.11 115.26 115.36 1ofr n ASN 284 Ca -0.01 -3.51 0.00 0.00 -0.03 0.00 0.00 54.58 51.03 1ofr n ASN 284 Cb 0.30 -0.84 0.00 0.00 -0.61 0.00 0.00 39.78 38.63 1ofr n ASN 284 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ofr n SER 285 N -0.95 0.00 -3.34 6.41 7.64 0.16 -4.65 113.62 118.88 1ofr n SER 285 Ca 0.55 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 60.28 1ofr n SER 285 Cb 1.41 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 64.62 1ofr n SER 285 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ofr n ASN 286 N 0.00 -6.50 -3.99 6.43 4.13 -1.16 -2.73 115.26 111.43 1ofr n ASN 286 Ca 0.00 -0.29 -0.31 0.00 1.68 0.00 0.00 54.58 55.66 1ofr n ASN 286 Cb 0.00 -3.57 -0.06 0.00 -1.54 0.00 0.00 39.78 34.61 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 -1.60 -1.38 -3.41 3.52 4.76 -1.26 -4.89 118.16 113.91 1ofr n LYS 287 Ca -0.10 0.11 -0.18 0.00 -2.87 0.00 0.00 58.31 55.27 1ofr n LYS 287 Cb 0.59 -4.67 -0.10 0.00 -1.84 0.00 0.00 35.03 29.00 1ofr n LYS 287 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1ofr s ASP 288 N -2.92 1.76 0.63 4.39 3.68 -1.11 -5.01 116.67 118.10 1ofr s ASP 288 Ca 0.61 -0.80 0.42 0.00 2.13 0.00 0.00 52.55 54.91 1ofr s ASP 288 Cb -0.36 0.47 2.16 0.00 -1.45 0.00 0.00 42.92 43.75 1ofr s ASP 288 CO 0.75 -0.39 2.27 2.19 0.13 0.00 0.00 175.17 180.12 1ofr h PHE 289 N 8.24 0.00 0.00 -5.34 -0.00 -1.86 -1.60 116.94 116.38 1ofr h PHE 289 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.84 1ofr h PHE 289 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.02 1ofr h PHE 289 CO 0.28 0.00 0.00 0.54 -0.00 0.00 0.00 178.31 179.13 1ofr n ARG 290 N -3.06 0.62 0.01 6.09 1.74 -1.26 -2.48 116.66 118.31 1ofr n ARG 290 Ca -0.02 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.18 1ofr n ARG 290 Cb 0.13 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.26 1ofr n ARG 290 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ofr n ASN 291 N -1.01 0.57 -0.10 0.55 3.02 -0.60 -4.17 115.26 113.52 1ofr n ASN 291 Ca 0.15 -0.29 -0.09 0.00 -0.03 0.00 0.00 54.58 54.32 1ofr n ASN 291 Cb 0.07 0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 39.57 1ofr n ASN 291 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1ofr h GLN 292 N 0.00 0.44 -0.03 3.52 4.20 -1.69 0.36 115.11 121.91 1ofr h GLN 292 Ca 0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1ofr h GLN 292 Cb 0.53 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 1ofr h GLN 292 CO 0.00 0.38 0.01 -1.35 -0.67 0.00 0.00 178.83 177.20 1ofr h PRO 293 N 0.39 0.04 0.29 1.46 0.11 -1.81 0.15 132.00 132.63 1ofr h PRO 293 Ca 0.11 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 1ofr h PRO 293 Cb 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1ofr h PRO 293 CO -0.02 0.03 -0.14 0.87 -0.21 0.00 0.00 178.00 178.54 1ofr h LYS 294 N 0.04 -0.37 -0.52 1.05 6.56 -1.47 -2.53 116.57 119.32 1ofr h LYS 294 Ca 0.01 0.03 0.07 0.00 -1.06 0.00 0.00 60.65 59.70 1ofr h LYS 294 Cb 0.01 0.08 -0.06 0.00 -0.57 0.00 0.00 32.23 31.69 1ofr h LYS 294 CO -0.00 -0.07 0.20 0.28 -2.06 0.00 0.00 179.45 177.80 1ofr h VAL 295 N -0.69 0.83 -0.78 0.50 2.07 -0.23 -0.78 116.25 117.17 1ofr h VAL 295 Ca -0.04 -0.13 0.17 0.00 0.82 0.00 0.00 66.70 67.52 1ofr h VAL 295 Cb 0.48 0.42 -0.11 0.00 -1.52 0.00 0.00 31.29 30.55 1ofr h VAL 295 CO 0.07 0.07 0.24 -1.13 0.02 0.00 0.00 177.57 176.84 1ofr h ASN 296 N 0.38 0.11 -0.15 0.57 -1.24 -0.62 0.12 115.58 114.76 1ofr h ASN 296 Ca 0.25 0.15 0.02 0.00 0.71 0.00 0.00 56.30 57.42 1ofr h ASN 296 Cb 0.26 0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.47 1ofr h ASN 296 CO -0.25 -0.01 0.04 0.44 -1.29 0.00 0.00 177.43 176.36 1ofr h ASP 297 N 0.32 0.04 -0.26 1.15 3.32 -0.72 1.01 116.42 121.28 1ofr h ASP 297 Ca 0.45 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.52 1ofr h ASP 297 Cb 0.79 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 1ofr h ASP 297 CO -0.51 0.04 0.14 0.58 -1.72 0.00 0.00 179.24 177.78 1ofr h VAL 298 N 0.11 1.12 -0.22 -1.35 2.07 -0.67 -1.89 116.25 115.41 1ofr h VAL 298 Ca 0.07 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 1ofr h VAL 298 Cb 0.05 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1ofr h VAL 298 CO -0.08 0.12 -0.34 0.58 0.02 0.00 0.00 177.57 177.87 1ofr h VAL 299 N 0.30 1.29 0.00 2.57 2.07 -0.56 -2.63 116.25 119.30 1ofr h VAL 299 Ca 0.09 -1.44 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1ofr h VAL 299 Cb 0.06 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1ofr h VAL 299 CO -0.01 0.45 -0.06 0.00 0.02 0.00 0.00 177.57 177.97 1ofr h GLU 301 N 0.00 -0.12 -0.94 0.00 4.81 -0.99 -0.77 114.58 116.57 1ofr h GLU 301 Ca -0.00 0.01 0.26 0.00 -0.13 0.00 0.00 59.36 59.50 1ofr h GLU 301 Cb 0.44 0.03 -0.14 0.00 0.63 0.00 0.00 28.75 29.71 1ofr h GLU 301 CO 0.01 0.27 0.44 1.96 -0.73 0.00 0.00 179.01 180.95 1ofr h GLN 302 N -0.97 0.34 -0.06 1.92 4.20 -1.35 0.19 115.11 119.37 1ofr h GLN 302 Ca -0.01 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 1ofr h GLN 302 Cb 0.44 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.14 1ofr h GLN 302 CO 0.02 0.23 -0.06 0.82 -0.67 0.00 0.00 178.83 179.16 1ofr h ILE 303 N 0.35 1.38 -0.01 2.54 2.04 -1.40 -1.35 117.51 121.06 1ofr h ILE 303 Ca 0.63 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1ofr h ILE 303 Cb 1.30 2.07 -0.00 0.00 -0.74 0.00 0.00 36.82 39.45 1ofr h ILE 303 CO -0.58 0.34 0.11 0.00 0.00 0.00 0.00 178.15 178.01 1ofr h ALA 304 N 0.54 1.14 -0.76 1.87 0.00 0.85 -2.07 119.26 120.83 1ofr h ALA 304 Ca 0.01 -0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.41 1ofr h ALA 304 Cb 0.58 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.06 1ofr h ALA 304 CO 0.02 -0.11 -0.03 0.09 0.00 0.00 0.00 179.25 179.22 1ofr n ASN 305 N -3.07 5.25 -0.46 0.00 3.02 -0.19 -4.21 115.26 115.60 1ofr n ASN 305 Ca -0.03 -3.77 -0.04 0.00 -0.03 0.00 0.00 54.58 50.71 1ofr n ASN 305 Cb 0.17 -0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 38.69 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 -0.89 0.30 3.55 7.41 0.00 -0.78 -5.01 105.19 109.77 1ofr n GLY 306 Ca 0.49 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.84 3.48 0.00 1.61 2.56 -0.52 -4.87 118.70 117.12 1ofr s GLU 307 Ca 0.00 0.05 0.18 0.00 0.00 0.00 0.00 54.97 55.21 1ofr s GLU 307 Cb 0.00 -3.94 0.42 0.00 2.00 0.00 0.00 34.13 32.60 1ofr s GLU 307 CO 0.00 -1.23 1.34 0.09 -0.56 0.00 0.00 175.26 174.90 1ofr n ASN 308 N 7.09 3.30 0.12 -1.70 3.02 -1.26 -4.04 115.26 121.79 1ofr n ASN 308 Ca 0.05 -1.94 0.09 0.00 -0.03 0.00 0.00 54.58 52.74 1ofr n ASN 308 Cb 0.48 -0.28 0.02 0.00 -0.61 0.00 0.00 39.78 39.39 1ofr n ASN 308 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ofr h ALA 309 N 3.54 0.65 -1.71 5.41 0.00 -1.95 -3.41 119.26 121.77 1ofr h ALA 309 Ca 0.00 -0.21 -0.63 0.00 0.00 0.00 0.00 54.91 54.07 1ofr h ALA 309 Cb 0.87 0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.56 1ofr h ALA 309 CO 0.00 0.24 0.49 0.42 0.00 0.00 0.00 179.25 180.40 1ofr s ILE 310 N -3.21 4.39 -0.05 0.00 1.01 -1.26 -1.34 121.20 120.75 1ofr s ILE 310 Ca 0.01 -0.32 0.19 0.00 0.00 0.00 0.00 60.65 60.53 1ofr s ILE 310 Cb 0.08 -4.63 -0.29 0.00 0.01 0.00 0.00 42.46 37.63 1ofr s ILE 310 CO 0.77 -1.36 0.38 0.35 0.00 0.00 0.00 174.94 175.07 1ofr n THR 311 N 5.92 0.16 -3.69 2.92 -2.24 -0.26 -4.96 114.28 112.13 1ofr n THR 311 Ca -0.04 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.14 1ofr n THR 311 Cb 0.45 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.60 1ofr n THR 311 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ofr s GLY 312 N -4.35 -0.22 0.00 3.38 0.00 -1.08 -0.50 107.32 104.56 1ofr s GLY 312 Ca -0.07 0.11 0.05 0.00 0.00 0.00 0.00 44.72 44.81 1ofr s GLY 312 CO 0.79 -0.13 -0.15 -1.34 0.00 0.00 0.00 173.10 172.27 1ofr s VAL 313 N -2.85 1.21 -0.22 1.40 -7.23 0.21 -0.19 120.40 112.73 1ofr s VAL 313 Ca -0.03 -0.75 -0.05 0.00 -1.81 0.00 0.00 61.98 59.35 1ofr s VAL 313 Cb 0.00 -1.03 -0.02 0.00 0.56 0.00 0.00 36.38 35.90 1ofr s VAL 313 CO -0.05 0.27 -0.01 -0.32 -0.31 0.00 0.00 175.10 174.68 1ofr s MET 314 N -0.55 3.49 -0.10 4.82 0.00 -0.34 -1.79 119.30 124.83 1ofr s MET 314 Ca 0.05 -0.57 0.04 0.00 0.00 0.00 0.00 55.69 55.21 1ofr s MET 314 Cb -0.06 -3.09 0.00 0.00 0.00 0.00 0.00 34.83 31.68 1ofr s MET 314 CO -0.00 -0.14 -0.23 0.42 0.00 0.00 0.00 175.02 175.07 1ofr s ILE 315 N 1.39 1.99 -0.51 10.11 1.01 -0.35 -0.51 121.20 134.33 1ofr s ILE 315 Ca 0.05 -0.97 -0.18 0.00 0.00 0.00 0.00 60.65 59.54 1ofr s ILE 315 Cb -0.15 -1.73 0.06 0.00 0.01 0.00 0.00 42.46 40.65 1ofr s ILE 315 CO -0.00 0.54 0.59 -1.61 0.00 0.00 0.00 174.94 174.46 1ofr s GLU 316 N 0.44 3.09 0.44 2.79 2.02 -1.26 -2.06 118.70 124.16 1ofr s GLU 316 Ca -0.17 -1.01 0.03 0.00 0.02 0.00 0.00 54.97 53.85 1ofr s GLU 316 Cb -0.17 -4.12 -0.03 0.00 0.10 0.00 0.00 34.13 29.91 1ofr s GLU 316 CO 0.07 -1.21 0.06 0.45 0.02 0.00 0.00 175.26 174.65 1ofr s SER 317 N 2.74 3.38 0.02 -0.19 0.15 -0.68 -3.23 113.70 115.89 1ofr s SER 317 Ca 0.13 -1.62 -0.02 0.00 0.70 0.00 0.00 55.95 55.14 1ofr s SER 317 Cb -0.20 0.39 0.01 0.00 -1.71 0.00 0.00 66.02 64.50 1ofr s SER 317 CO 0.11 -0.83 0.11 -3.20 1.20 0.00 0.00 173.24 170.62 1ofr n ASN 318 N -1.21 -0.20 0.11 5.45 2.85 -0.50 -1.35 115.26 120.40 1ofr n ASN 318 Ca -0.11 -1.11 -0.20 0.00 -0.11 0.00 0.00 54.58 53.05 1ofr n ASN 318 Cb 0.66 0.32 -0.13 0.00 1.24 0.00 0.00 39.78 41.88 1ofr n ASN 318 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1ofr h ILE 319 N 1.11 1.35 -4.01 -1.44 2.04 -1.81 -0.70 117.51 114.05 1ofr h ILE 319 Ca -0.03 -2.66 -0.49 0.00 1.00 0.00 0.00 64.86 62.68 1ofr h ILE 319 Cb 0.13 2.80 -0.23 0.00 -0.74 0.00 0.00 36.82 38.78 1ofr h ILE 319 CO 0.04 0.80 -0.81 0.20 0.00 0.00 0.00 178.15 178.38 1ofr s ASN 320 N -7.36 2.06 1.27 1.72 0.01 -0.76 -2.02 114.94 109.86 1ofr s ASN 320 Ca -0.08 -0.57 -0.21 0.00 -0.71 0.00 0.00 52.86 51.30 1ofr s ASN 320 Cb 0.06 -0.12 0.31 0.00 0.41 0.00 0.00 41.25 41.91 1ofr s ASN 320 CO 0.92 0.04 1.07 -1.83 -1.51 0.00 0.00 177.10 175.79 1ofr s GLU 321 N -1.50 -1.72 1.67 -0.60 -1.05 -1.26 -4.47 118.70 109.77 1ofr s GLU 321 Ca 0.03 -0.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.78 1ofr s GLU 321 Cb -0.09 -1.54 0.00 0.00 -0.44 0.00 0.00 34.13 32.06 1ofr s GLU 321 CO 0.02 -4.04 0.00 0.41 0.95 0.00 0.00 175.26 172.60 1ofr n GLY 322 N -0.46 -1.26 0.00 -3.83 0.00 -0.35 -4.77 105.19 94.52 1ofr n GLY 322 Ca 0.14 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.09 1.14 -0.35 1.61 6.94 -1.26 -3.37 115.26 117.88 1ofr n ASN 323 Ca 0.00 -0.49 0.00 0.00 -0.02 0.00 0.00 54.58 54.07 1ofr n ASN 323 Cb 0.03 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.45 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 0.00 -4.01 -3.83 10.64 -1.15 -4.87 117.38 114.16 1ofr n GLN 324 Ca 0.00 0.00 -0.21 0.00 -1.83 0.00 0.00 57.00 54.96 1ofr n GLN 324 Cb 0.00 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.32 1ofr n GLN 324 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ofr n GLY 325 N 0.00 3.32 3.33 2.61 0.00 -1.26 -4.59 105.19 108.60 1ofr n GLY 325 Ca 0.00 -2.05 -0.47 0.00 0.00 0.00 0.00 46.02 43.51 1ofr n GLY 325 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ofr s ILE 326 N -2.90 5.47 1.02 -0.61 1.01 -1.26 -4.96 121.20 118.97 1ofr s ILE 326 Ca 0.20 -2.18 -0.17 0.00 0.00 0.00 0.00 60.65 58.50 1ofr s ILE 326 Cb 0.01 -4.45 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 1ofr s ILE 326 CO 0.14 -1.01 -0.21 -0.81 0.00 0.00 0.00 174.94 173.06 1ofr n PRO 327 N 4.41 -0.58 0.20 2.79 -0.04 -1.26 -4.85 135.00 135.67 1ofr n PRO 327 Ca 0.07 -0.15 0.14 0.00 -0.04 0.00 0.00 63.50 63.53 1ofr n PRO 327 Cb 0.45 -1.53 0.65 0.00 -0.04 0.00 0.00 33.50 33.03 1ofr n PRO 327 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ofr h ALA 328 N -1.53 1.00 -0.42 0.55 0.00 -1.97 -3.18 119.26 113.71 1ofr h ALA 328 Ca -0.46 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.06 1ofr h ALA 328 Cb 1.32 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.97 1ofr h ALA 328 CO 0.31 0.00 0.26 -0.85 0.00 0.00 0.00 179.25 178.98 1ofr n GLU 329 N -2.56 2.15 0.00 0.00 0.00 -1.26 -5.02 120.64 113.96 1ofr n GLU 329 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 57.16 55.29 1ofr n GLU 329 Cb 0.19 -1.96 0.00 0.00 0.00 0.00 0.00 31.44 29.67 1ofr n GLU 329 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1ofr n GLY 330 N 1.02 0.15 0.25 -1.84 0.00 -1.20 -2.63 105.19 100.95 1ofr n GLY 330 Ca 0.42 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 1ofr n GLY 330 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ofr h LYS 331 N 0.00 0.85 -0.50 1.61 3.64 -1.83 -3.09 116.57 117.25 1ofr h LYS 331 Ca 0.00 -0.21 0.15 0.00 -1.27 0.00 0.00 60.65 59.32 1ofr h LYS 331 Cb 0.00 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1ofr h LYS 331 CO 0.00 0.81 1.04 0.00 -2.27 0.00 0.00 179.45 179.04 1ofr h ALA 332 N 1.00 2.43 -2.21 5.00 0.00 -1.95 -2.66 119.26 120.87 1ofr h ALA 332 Ca 0.17 -0.02 -0.60 0.00 0.00 0.00 0.00 54.91 54.46 1ofr h ALA 332 Cb 0.35 0.04 -0.42 0.00 0.00 0.00 0.00 17.79 17.75 1ofr h ALA 332 CO 0.00 -1.30 -0.59 0.41 0.00 0.00 0.00 179.25 177.77 1ofr n GLY 333 N -1.59 5.03 3.03 0.00 0.00 -1.08 -5.03 105.19 105.55 1ofr n GLY 333 Ca 0.11 -2.78 -0.26 0.00 0.00 0.00 0.00 46.02 43.09 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 -2.74 1.63 0.08 0.99 1.43 -1.01 -4.66 118.68 114.40 1ofr s LEU 334 Ca 0.42 -0.35 -0.37 0.00 -1.03 0.00 0.00 54.13 52.81 1ofr s LEU 334 Cb 0.18 -0.93 -0.17 0.00 0.03 0.00 0.00 46.19 45.31 1ofr s LEU 334 CO -0.04 0.01 1.36 0.29 0.23 0.00 0.00 176.35 178.20 1ofr n LYS 335 N 4.05 1.18 -2.48 1.70 5.02 -1.26 -4.90 118.16 121.47 1ofr n LYS 335 Ca -0.20 0.42 -0.36 0.00 -2.02 0.00 0.00 58.31 56.15 1ofr n LYS 335 Cb 0.51 -2.07 -0.03 0.00 -0.02 0.00 0.00 35.03 33.42 1ofr n LYS 335 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1ofr s TYR 336 N 0.60 3.11 0.00 2.13 5.04 -1.26 -3.52 117.35 123.45 1ofr s TYR 336 Ca 0.85 1.60 0.00 0.00 -2.44 0.00 0.00 57.07 57.08 1ofr s TYR 336 Cb -0.95 -3.17 0.00 0.00 0.35 0.00 0.00 41.96 38.19 1ofr s TYR 336 CO 0.47 -0.87 0.00 0.41 -1.34 0.00 0.00 175.55 174.22 1ofr n GLY 337 N 0.21 0.35 3.62 8.97 0.00 -1.26 -4.77 105.19 112.31 1ofr n GLY 337 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.98 4.58 0.71 1.61 1.01 -1.23 -1.83 120.40 123.27 1ofr s VAL 338 Ca 0.00 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 1ofr s VAL 338 Cb 0.00 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.37 1ofr s VAL 338 CO 0.00 0.49 1.23 -0.24 0.00 0.00 0.00 175.10 176.58 1ofr n SER 339 N 3.34 1.54 -0.57 3.32 2.88 -1.25 -4.92 113.62 117.96 1ofr n SER 339 Ca -0.17 0.73 0.06 0.00 -1.33 0.00 0.00 58.87 58.16 1ofr n SER 339 Cb 0.52 -1.53 0.20 0.00 -0.75 0.00 0.00 64.21 62.66 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 -2.48 2.19 0.00 2.46 -5.35 -1.26 -2.93 119.36 111.99 1ofr n ILE 340 Ca 0.15 -3.16 0.00 0.00 -0.27 0.00 0.00 62.75 59.47 1ofr n ILE 340 Cb 0.49 -0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.15 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 -1.14 0.00 -1.27 7.28 -2.24 -1.26 -4.83 114.28 110.81 1ofr n THR 341 Ca 0.19 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.60 1ofr n THR 341 Cb 0.69 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.97 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 -2.45 -4.89 3.42 8.00 -1.26 -4.63 116.55 114.74 1ofr n ASP 342 Ca 0.00 0.60 -0.31 0.00 0.71 0.00 0.00 54.79 55.79 1ofr n ASP 342 Cb 0.00 -1.04 -0.04 0.00 -0.02 0.00 0.00 41.12 40.01 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 -1.91 3.62 0.09 2.24 0.00 -1.26 -4.75 121.76 119.79 1ofr s ALA 343 Ca 0.61 -0.42 -0.02 0.00 0.00 0.00 0.00 51.96 52.13 1ofr s ALA 343 Cb -0.40 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 1ofr s ALA 343 CO 0.62 0.43 0.03 0.00 0.00 0.00 0.00 175.76 176.84 1ofr s ILE 345 N -3.97 2.96 0.66 0.00 -4.36 -1.20 -1.21 121.20 114.08 1ofr s ILE 345 Ca 0.14 0.31 -0.00 0.00 -0.26 0.00 0.00 60.65 60.83 1ofr s ILE 345 Cb 0.07 -2.73 0.09 0.00 1.25 0.00 0.00 42.46 41.15 1ofr s ILE 345 CO -0.05 -0.41 0.92 -0.83 0.24 0.00 0.00 174.94 174.81 1ofr s GLY 346 N -3.29 1.78 0.03 6.27 0.00 -1.26 -1.42 107.32 109.43 1ofr s GLY 346 Ca 0.63 -1.56 -0.09 0.00 0.00 0.00 0.00 44.72 43.69 1ofr s GLY 346 CO 0.57 -1.10 1.15 -0.25 0.00 0.00 0.00 173.10 173.47 1ofr h TRP 347 N -0.33 -0.42 -0.56 1.90 2.91 -0.49 -1.78 115.95 117.17 1ofr h TRP 347 Ca -0.38 0.01 0.05 0.00 1.13 0.00 0.00 58.89 59.70 1ofr h TRP 347 Cb 1.28 0.18 -0.07 0.00 -0.51 0.00 0.00 29.16 30.04 1ofr h TRP 347 CO 0.02 -0.16 -0.33 0.39 -1.03 0.00 0.00 178.44 177.34 1ofr n GLU 348 N -3.28 -0.25 0.20 2.65 -0.58 -1.26 0.94 120.64 119.06 1ofr n GLU 348 Ca -0.02 0.85 0.05 0.00 -0.42 0.00 0.00 57.16 57.62 1ofr n GLU 348 Cb 0.11 -1.25 0.44 0.00 -0.57 0.00 0.00 31.44 30.17 1ofr n GLU 348 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ofr h THR 349 N 0.00 1.11 -0.35 2.62 1.03 -1.93 -2.87 112.91 112.52 1ofr h THR 349 Ca 0.09 -1.05 -0.04 0.00 -0.01 0.00 0.00 66.41 65.40 1ofr h THR 349 Cb 0.23 1.58 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1ofr h THR 349 CO -0.53 0.29 0.05 0.74 -0.01 0.00 0.00 175.52 176.06 1ofr h THR 350 N 0.00 1.24 0.00 0.00 2.02 0.15 -2.13 112.91 114.18 1ofr h THR 350 Ca -0.00 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.31 1ofr h THR 350 Cb 0.56 1.12 -0.00 0.00 -1.74 0.00 0.00 68.15 68.08 1ofr h THR 350 CO 0.04 0.28 -0.11 -0.08 0.37 0.00 0.00 175.52 176.02 1ofr h GLU 351 N 0.41 0.00 0.54 6.66 4.81 -1.07 -1.20 114.58 124.74 1ofr h GLU 351 Ca 0.11 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1ofr h GLU 351 Cb 0.36 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.75 1ofr h GLU 351 CO 0.01 0.11 -0.26 -0.44 -0.73 0.00 0.00 179.01 177.70 1ofr h ASP 352 N 0.00 -0.62 -0.95 1.04 3.32 -1.31 -2.44 116.42 115.46 1ofr h ASP 352 Ca -0.00 0.02 0.29 0.00 0.02 0.00 0.00 57.03 57.36 1ofr h ASP 352 Cb 0.23 0.16 -0.16 0.00 0.22 0.00 0.00 39.33 39.79 1ofr h ASP 352 CO 0.01 -0.31 0.31 0.58 -1.72 0.00 0.00 179.24 178.12 1ofr h VAL 353 N -1.01 0.19 0.00 -1.35 2.07 -1.05 0.82 116.25 115.93 1ofr h VAL 353 Ca -0.07 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1ofr h VAL 353 Cb 0.56 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1ofr h VAL 353 CO 0.12 0.03 0.00 0.18 0.02 0.00 0.00 177.57 177.92 1ofr n LEU 354 N -5.26 0.18 -0.07 2.57 4.77 -0.48 -1.90 117.00 116.81 1ofr n LEU 354 Ca 0.27 0.53 -0.09 0.00 -0.03 0.00 0.00 56.01 56.68 1ofr n LEU 354 Cb 0.87 -0.48 -0.15 0.00 -2.33 0.00 0.00 43.42 41.33 1ofr n LEU 354 CO 0.03 -0.14 -0.90 0.54 -1.33 0.00 0.00 177.39 175.58 1ofr n ARG 355 N -1.68 0.67 0.09 3.23 1.74 0.28 -2.07 116.66 118.91 1ofr n ARG 355 Ca 0.05 0.11 -0.08 0.00 -0.77 0.00 0.00 57.85 57.16 1ofr n ARG 355 Cb 0.30 -1.63 -0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1ofr n ARG 355 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1ofr h LYS 356 N 0.00 0.16 -0.09 5.56 1.57 -1.28 -2.27 116.57 120.23 1ofr h LYS 356 Ca -0.44 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.07 1ofr h LYS 356 Cb 2.14 0.05 0.00 0.00 0.08 0.00 0.00 32.23 34.51 1ofr h LYS 356 CO 0.05 0.93 -0.31 1.25 -0.57 0.00 0.00 179.45 180.80 1ofr h LEU 357 N 0.09 0.42 -1.71 2.94 7.12 -1.52 0.11 115.31 122.75 1ofr h LEU 357 Ca -0.04 -0.62 0.08 0.00 0.13 0.00 0.00 57.88 57.43 1ofr h LEU 357 Cb 1.50 -0.12 -0.03 0.00 -0.53 0.00 0.00 40.66 41.48 1ofr h LEU 357 CO 0.13 0.97 0.34 0.00 -0.13 0.00 0.00 178.44 179.75 1ofr h ALA 358 N 0.46 2.03 0.00 1.25 0.00 -1.38 -1.89 119.26 119.73 1ofr h ALA 358 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ofr h ALA 358 Cb 0.95 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ofr h ALA 358 CO 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 179.25 179.18 1ofr h ALA 359 N 1.74 -0.00 -1.32 0.00 0.00 -1.19 -2.37 119.26 116.11 1ofr h ALA 359 Ca 0.23 -0.41 0.38 0.00 0.00 0.00 0.00 54.91 55.11 1ofr h ALA 359 Cb 0.46 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1ofr h ALA 359 CO -0.05 -0.09 0.94 0.00 0.00 0.00 0.00 179.25 180.05 1ofr h ALA 360 N 0.18 3.17 0.00 0.00 0.00 -0.02 0.27 119.26 122.86 1ofr h ALA 360 Ca -0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1ofr h ALA 360 Cb 0.82 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1ofr h ALA 360 CO 0.00 -1.57 -0.26 0.28 0.00 0.00 0.00 179.25 177.70 1ofr h VAL 361 N 0.04 1.43 -0.99 0.00 2.07 -1.41 -2.44 116.25 114.94 1ofr h VAL 361 Ca 0.64 -2.17 0.16 0.00 0.82 0.00 0.00 66.70 66.16 1ofr h VAL 361 Cb 2.49 2.79 -0.10 0.00 -1.52 0.00 0.00 31.29 34.95 1ofr h VAL 361 CO -0.05 0.48 0.60 -0.09 0.02 0.00 0.00 177.57 178.54 1ofr h ARG 362 N -1.00 0.80 0.00 1.57 2.43 -0.56 -2.16 114.38 115.47 1ofr h ARG 362 Ca -0.07 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1ofr h ARG 362 Cb 0.96 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1ofr h ARG 362 CO -0.04 0.53 0.00 0.94 -1.51 0.00 0.00 179.97 179.89 1ofr n GLN 363 N -4.73 0.00 -0.13 0.20 -0.06 0.80 -3.07 117.38 110.39 1ofr n GLN 363 Ca 0.21 0.32 0.12 0.00 -2.00 0.00 0.00 57.00 55.65 1ofr n GLN 363 Cb 0.49 -1.28 0.21 0.00 -4.06 0.00 0.00 30.24 25.61 1ofr n GLN 363 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 1ofr n ARG 364 N -1.45 -0.02 -0.11 3.69 0.63 -0.92 0.18 116.66 118.66 1ofr n ARG 364 Ca 0.00 0.45 0.17 0.00 -0.92 0.00 0.00 57.85 57.55 1ofr n ARG 364 Cb 0.00 -0.84 0.57 0.00 0.45 0.00 0.00 32.46 32.64 1ofr n ARG 364 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ofr h ARG 365 N 0.00 0.27 0.00 -0.14 3.08 -1.33 -2.46 114.38 113.80 1ofr h ARG 365 Ca 0.29 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.33 1ofr h ARG 365 Cb 0.86 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1ofr h ARG 365 CO -0.21 0.18 -0.00 0.93 -1.07 0.00 0.00 179.97 179.80 1ofr h GLU 366 N 0.28 -0.00 -1.39 0.04 4.39 0.18 -0.47 114.58 117.61 1ofr h GLU 366 Ca 0.34 0.00 0.41 0.00 0.34 0.00 0.00 59.36 60.45 1ofr h GLU 366 Cb 0.93 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.49 1ofr h GLU 366 CO -0.08 0.87 0.96 0.28 -1.16 0.00 0.00 179.01 179.87 1ofr h VAL 367 N -0.98 0.24 0.00 3.13 2.07 -1.51 0.94 116.25 120.14 1ofr h VAL 367 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1ofr h VAL 367 Cb 0.87 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1ofr h VAL 367 CO 0.00 0.02 -1.20 0.59 0.02 0.00 0.00 177.57 177.00 1ofr n ASN 368 N -4.35 0.79 0.31 0.57 3.02 -0.97 -4.51 115.26 110.12 1ofr n ASN 368 Ca 0.33 -0.79 -0.14 0.00 -0.03 0.00 0.00 54.58 53.95 1ofr n ASN 368 Cb 1.42 1.20 -0.07 0.00 -0.61 0.00 0.00 39.78 41.72 1ofr n ASN 368 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ofr h LYS 369 N 0.00 -0.78 0.00 3.52 3.64 0.27 -3.51 116.57 119.71 1ofr h LYS 369 Ca 0.00 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1ofr h LYS 369 Cb 0.60 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1ofr h LYS 369 CO 0.00 -0.47 0.00 1.17 -2.27 0.00 0.00 179.45 177.88