#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 2.38 -0.45 3.44 2.02 -1.26 -4.58 118.70 120.26 1ofr s GLU 21 Ca 0.00 -1.63 0.00 0.00 0.02 0.00 0.00 54.97 53.36 1ofr s GLU 21 Cb 0.00 -2.58 0.00 0.00 0.10 0.00 0.00 34.13 31.65 1ofr s GLU 21 CO 0.00 -0.72 0.00 -0.25 0.02 0.00 0.00 175.26 174.31 1ofr n ASP 22 N -2.10 -4.34 0.11 -0.19 9.92 -1.26 -4.78 116.55 113.91 1ofr n ASP 22 Ca 0.12 0.11 0.20 0.00 -0.53 0.00 0.00 54.79 54.68 1ofr n ASP 22 Cb 0.62 -3.00 0.73 0.00 -0.64 0.00 0.00 41.12 38.83 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 0.29 -0.44 2.53 -1.51 -2.05 1.11 116.25 116.19 1ofr h VAL 23 Ca -0.09 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.38 1ofr h VAL 23 Cb 0.81 0.61 0.00 0.00 -2.13 0.00 0.00 31.29 30.58 1ofr h VAL 23 CO 0.13 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 177.01 1ofr n ARG 24 N -3.55 2.95 -3.59 5.19 1.74 -1.26 -4.87 116.66 113.26 1ofr n ARG 24 Ca 0.07 -2.35 -0.41 0.00 -0.77 0.00 0.00 57.85 54.39 1ofr n ARG 24 Cb 0.64 -1.46 -0.11 0.00 -1.02 0.00 0.00 32.46 30.51 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 -1.31 4.47 -0.24 0.55 -1.09 0.38 -4.97 121.20 119.00 1ofr s ILE 25 Ca 0.33 -1.07 0.28 0.00 -2.23 0.00 0.00 60.65 57.96 1ofr s ILE 25 Cb 0.19 -3.59 0.32 0.00 -1.58 0.00 0.00 42.46 37.81 1ofr s ILE 25 CO 0.19 -0.35 1.83 -0.07 -1.23 0.00 0.00 174.94 175.31 1ofr h LEU 26 N 8.44 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 0.22 3.63 3.41 0.83 0.00 -1.26 -5.12 105.19 106.90 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 2.85 0.05 1.61 1.51 -1.26 -5.12 117.35 114.98 1ofr s TYR 28 Ca 0.00 -0.53 0.02 0.00 -1.01 0.00 0.00 57.07 55.55 1ofr s TYR 28 Cb 0.00 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1ofr s TYR 28 CO 0.00 -0.14 0.06 -0.51 -1.11 0.00 0.00 175.55 173.86 1ofr s ASP 29 N 0.25 5.49 0.37 2.29 1.01 -1.26 -5.07 116.67 119.75 1ofr s ASP 29 Ca -0.08 0.03 -0.28 0.00 0.71 0.00 0.00 52.55 52.93 1ofr s ASP 29 Cb -0.15 -1.49 -0.10 0.00 1.01 0.00 0.00 42.92 42.19 1ofr s ASP 29 CO 0.05 0.22 1.41 -2.16 0.21 0.00 0.00 175.17 174.89 1ofr s PRO 30 N -2.09 4.13 -0.19 8.23 0.04 -1.26 -5.01 135.00 138.86 1ofr s PRO 30 Ca 0.26 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.71 1ofr s PRO 30 Cb -0.12 -2.95 0.04 0.00 0.04 0.00 0.00 34.50 31.51 1ofr s PRO 30 CO 0.18 -0.45 -0.08 -1.17 0.04 0.00 0.00 177.00 175.52 1ofr s LEU 31 N -2.10 1.99 0.23 -3.56 2.96 -1.26 -4.94 118.68 112.01 1ofr s LEU 31 Ca 0.53 -0.80 -0.31 0.00 -0.22 0.00 0.00 54.13 53.32 1ofr s LEU 31 Cb -0.43 -1.08 -0.14 0.00 0.50 0.00 0.00 46.19 45.04 1ofr s LEU 31 CO 0.58 -0.17 1.31 0.00 -1.32 0.00 0.00 176.35 176.75 1ofr n ALA 32 N 4.77 0.57 -1.56 5.97 0.00 -1.26 -4.94 120.51 124.06 1ofr n ALA 32 Ca -0.13 0.42 -0.29 0.00 0.00 0.00 0.00 53.44 53.43 1ofr n ALA 32 Cb 0.47 -2.20 0.11 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 0.12 4.02 0.08 0.00 1.04 -1.26 -4.84 113.70 112.86 1ofr s SER 33 Ca 0.68 1.12 -0.31 0.00 0.48 0.00 0.00 55.95 57.92 1ofr s SER 33 Cb -0.70 -1.77 -0.18 0.00 0.10 0.00 0.00 66.02 63.48 1ofr s SER 33 CO 0.52 -2.25 1.64 -0.65 0.98 0.00 0.00 173.24 173.48 1ofr h PRO 34 N -1.28 -0.72 -0.97 4.02 0.11 -1.82 -0.86 132.00 130.48 1ofr h PRO 34 Ca -0.49 0.05 0.22 0.00 0.11 0.00 0.00 66.00 65.89 1ofr h PRO 34 Cb 1.30 0.16 -0.12 0.00 0.11 0.00 0.00 31.00 32.46 1ofr h PRO 34 CO 0.61 -0.48 0.54 0.00 -0.21 0.00 0.00 178.00 178.46 1ofr h ALA 35 N -0.28 1.64 -0.13 -0.75 0.00 -0.64 0.41 119.26 119.52 1ofr h ALA 35 Ca -0.07 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ofr h ALA 35 Cb 0.58 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1ofr h ALA 35 CO 0.11 -0.21 0.01 1.25 0.00 0.00 0.00 179.25 180.40 1ofr h LEU 36 N 0.59 0.21 -0.74 0.00 5.85 -1.68 -2.83 115.31 116.72 1ofr h LEU 36 Ca 0.59 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.99 1ofr h LEU 36 Cb 1.06 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1ofr h LEU 36 CO -0.45 0.45 0.34 0.25 -0.34 0.00 0.00 178.44 178.69 1ofr h LEU 37 N -0.04 0.98 -1.72 2.25 7.12 0.50 -1.53 115.31 122.87 1ofr h LEU 37 Ca 0.04 -0.14 0.00 0.00 0.13 0.00 0.00 57.88 57.90 1ofr h LEU 37 Cb 0.34 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 40.22 1ofr h LEU 37 CO 0.01 0.84 0.00 1.56 -0.13 0.00 0.00 178.44 180.72 1ofr h GLN 38 N 1.04 0.00 0.06 1.25 4.20 -0.19 -0.10 115.11 121.37 1ofr h GLN 38 Ca 0.25 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.60 1ofr h GLN 38 Cb 0.14 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 1ofr h GLN 38 CO -0.03 0.00 -2.07 0.28 -0.67 0.00 0.00 178.83 176.34 1ofr n VAL 39 N -2.58 1.63 0.02 -0.54 0.31 -0.75 -3.47 118.33 112.97 1ofr n VAL 39 Ca -0.01 -0.49 0.01 0.00 -0.01 0.00 0.00 64.34 63.84 1ofr n VAL 39 Cb 0.11 -1.72 0.35 0.00 -0.91 0.00 0.00 33.84 31.67 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 -0.26 0.47 -2.64 5.55 4.20 -0.80 -3.27 115.11 118.36 1ofr h GLN 40 Ca -0.49 -0.08 -0.60 0.00 0.06 0.00 0.00 58.65 57.54 1ofr h GLN 40 Cb 1.82 -0.08 -0.40 0.00 0.30 0.00 0.00 27.48 29.12 1ofr h GLN 40 CO -0.07 0.46 -0.78 -0.89 -0.67 0.00 0.00 178.83 176.88 1ofr n ILE 41 N -4.34 0.30 -1.90 2.54 5.41 -0.09 -5.10 119.36 116.19 1ofr n ILE 41 Ca 0.01 -4.21 -0.34 0.00 1.00 0.00 0.00 62.75 59.21 1ofr n ILE 41 Cb 0.20 -1.94 0.04 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 -0.86 2.94 -0.17 0.38 0.04 -1.23 -4.60 135.00 131.50 1ofr s PRO 42 Ca 0.30 1.49 -0.18 0.00 0.04 0.00 0.00 61.00 62.65 1ofr s PRO 42 Cb 0.02 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1ofr s PRO 42 CO -0.17 -1.16 0.51 0.00 0.04 0.00 0.00 177.00 176.22 1ofr s ALA 43 N -2.12 3.51 0.77 8.56 0.00 -1.26 -5.03 121.76 126.19 1ofr s ALA 43 Ca 0.69 -0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.23 1ofr s ALA 43 Cb -0.22 -2.76 0.06 0.00 0.00 0.00 0.00 23.12 20.19 1ofr s ALA 43 CO 0.37 -0.28 1.11 0.95 0.00 0.00 0.00 175.76 177.91 1ofr s THR 44 N 1.26 3.08 0.46 0.00 -4.23 -1.26 -4.81 115.64 110.15 1ofr s THR 44 Ca 0.25 0.39 0.12 0.00 -1.18 0.00 0.00 61.69 61.27 1ofr s THR 44 Cb -0.15 -2.82 0.28 0.00 1.34 0.00 0.00 72.50 71.15 1ofr s THR 44 CO 0.10 -0.42 2.08 -0.65 -0.54 0.00 0.00 174.62 175.18 1ofr h PRO 45 N -0.98 0.30 -0.14 3.99 0.11 -1.99 -1.53 132.00 131.76 1ofr h PRO 45 Ca -0.44 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1ofr h PRO 45 Cb 1.24 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ofr h PRO 45 CO 0.50 0.20 -0.04 1.15 -0.21 0.00 0.00 178.00 179.60 1ofr h THR 46 N 0.31 1.30 -0.18 -1.15 2.02 -1.92 -1.96 112.91 111.34 1ofr h THR 46 Ca 0.12 -1.02 0.04 0.00 0.77 0.00 0.00 66.41 66.32 1ofr h THR 46 Cb 0.11 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 1ofr h THR 46 CO -0.03 0.30 -0.07 0.28 0.37 0.00 0.00 175.52 176.37 1ofr h SER 47 N -0.04 -0.24 0.20 4.18 0.02 -1.42 0.61 113.55 116.86 1ofr h SER 47 Ca 0.03 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 1ofr h SER 47 Cb 0.48 0.14 -0.00 0.00 0.14 0.00 0.00 62.40 63.16 1ofr h SER 47 CO 0.02 -0.09 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.39 1ofr h LEU 48 N -0.04 0.00 -0.05 5.07 3.38 -1.31 -2.06 115.31 120.31 1ofr h LEU 48 Ca 0.09 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1ofr h LEU 48 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ofr h LEU 48 CO -0.21 0.16 -0.25 -0.08 0.09 0.00 0.00 178.44 178.15 1ofr h GLU 49 N 0.00 0.25 -0.79 1.13 4.57 -0.45 -2.78 114.58 116.50 1ofr h GLU 49 Ca -0.00 -0.21 0.09 0.00 -1.18 0.00 0.00 59.36 58.06 1ofr h GLU 49 Cb 0.30 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.86 1ofr h GLU 49 CO 0.02 0.87 0.44 1.15 -1.18 0.00 0.00 179.01 180.30 1ofr h THR 50 N -0.30 0.89 -0.69 0.32 2.02 -0.64 -0.25 112.91 114.27 1ofr h THR 50 Ca -0.02 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 1ofr h THR 50 Cb 0.92 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1ofr h THR 50 CO 0.05 0.13 0.27 0.00 0.37 0.00 0.00 175.52 176.35 1ofr h ALA 51 N 1.44 0.90 -0.26 6.16 0.00 -1.40 -1.49 119.26 124.62 1ofr h ALA 51 Ca 0.38 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.96 1ofr h ALA 51 Cb 0.36 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ofr h ALA 51 CO -0.25 0.52 -0.43 0.87 0.00 0.00 0.00 179.25 179.96 1ofr h LYS 52 N 0.99 0.64 0.29 0.00 1.57 -1.04 -2.62 116.57 116.40 1ofr h LYS 52 Ca 0.23 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1ofr h LYS 52 Cb 0.22 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ofr h LYS 52 CO -0.02 0.95 -0.14 -0.09 -0.57 0.00 0.00 179.45 179.58 1ofr h ARG 53 N 0.52 -0.38 -0.90 3.15 2.43 -0.88 -2.40 114.38 115.93 1ofr h ARG 53 Ca 0.04 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.41 1ofr h ARG 53 Cb 0.96 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 30.50 1ofr h ARG 53 CO 0.09 -0.15 0.47 0.78 -1.51 0.00 0.00 179.97 179.65 1ofr h GLY 54 N -0.55 1.52 1.49 2.80 0.00 -1.25 0.16 103.07 107.24 1ofr h GLY 54 Ca -0.04 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 1ofr h GLY 54 CO 0.07 -0.10 -0.07 3.21 0.00 0.00 0.00 176.54 179.64 1ofr h ARG 55 N 0.60 0.62 0.20 4.80 3.08 -1.33 -0.00 114.38 122.34 1ofr h ARG 55 Ca 0.51 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 1ofr h ARG 55 Cb 0.81 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1ofr h ARG 55 CO -0.41 0.69 -0.09 0.00 -1.07 0.00 0.00 179.97 179.09 1ofr h ARG 56 N 0.57 -0.25 -0.28 0.04 3.08 -0.25 -1.46 114.38 115.82 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 0.47 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1ofr h ARG 56 CO 0.03 0.10 0.09 0.93 -1.07 0.00 0.00 179.97 180.04 1ofr h GLU 57 N -0.65 0.20 -0.80 0.04 5.08 -1.00 -1.01 114.58 116.44 1ofr h GLU 57 Ca -0.03 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1ofr h GLU 57 Cb 0.47 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.61 1ofr h GLU 57 CO 0.04 0.13 0.48 0.00 -1.00 0.00 0.00 179.01 178.67 1ofr h ALA 58 N 1.18 1.08 -0.39 3.43 0.00 -1.02 -1.41 119.26 122.15 1ofr h ALA 58 Ca 0.13 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ofr h ALA 58 Cb 0.10 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1ofr h ALA 58 CO -0.14 0.22 0.09 0.82 0.00 0.00 0.00 179.25 180.24 1ofr h ILE 59 N 0.89 1.23 -0.65 0.00 2.04 -0.65 -1.92 117.51 118.45 1ofr h ILE 59 Ca 0.35 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1ofr h ILE 59 Cb 0.16 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1ofr h ILE 59 CO -0.17 0.27 0.34 0.44 0.00 0.00 0.00 178.15 179.04 1ofr h ASP 60 N 0.48 0.83 -0.18 1.72 3.32 -0.75 -1.67 116.42 120.18 1ofr h ASP 60 Ca 0.12 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1ofr h ASP 60 Cb 0.32 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1ofr h ASP 60 CO 0.00 0.70 0.02 0.40 -1.72 0.00 0.00 179.24 178.64 1ofr h ILE 61 N 0.90 1.23 0.00 0.35 2.04 -1.16 0.40 117.51 121.26 1ofr h ILE 61 Ca 0.23 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1ofr h ILE 61 Cb 0.07 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1ofr h ILE 61 CO -0.03 0.23 0.00 0.16 0.00 0.00 0.00 178.15 178.51 1ofr h ILE 62 N 0.07 0.00 -0.02 -0.67 3.07 -1.27 -2.97 117.51 115.72 1ofr h ILE 62 Ca 0.05 -0.60 0.00 0.00 1.55 0.00 0.00 64.86 65.86 1ofr h ILE 62 Cb 0.33 1.55 0.00 0.00 -0.27 0.00 0.00 36.82 38.44 1ofr h ILE 62 CO 0.01 0.00 -0.14 0.35 -1.05 0.00 0.00 178.15 177.31 1ofr n THR 63 N -2.82 0.00 -0.39 0.16 -2.24 -0.63 -1.01 114.28 107.34 1ofr n THR 63 Ca 0.03 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 1ofr n THR 63 Cb 0.38 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 0.71 0.19 3.38 0.00 -0.96 -4.94 105.19 104.87 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 4.09 0.00 -5.25 1.61 1.57 -1.19 -3.44 116.57 113.95 1ofr h LYS 65 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 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 -5.61 1.77 0.00 0.86 2.15 -0.90 -4.95 116.67 109.99 1ofr s ASP 66 Ca 0.07 -0.28 0.26 0.00 0.43 0.00 0.00 52.55 53.04 1ofr s ASP 66 Cb 0.08 -0.31 1.38 0.00 -0.30 0.00 0.00 42.92 43.76 1ofr s ASP 66 CO 0.63 0.16 1.91 -0.90 -0.17 0.00 0.00 175.17 176.79 1ofr n ASP 67 N 2.90 0.50 -4.43 -0.34 5.68 -1.26 -4.53 116.55 115.07 1ofr n ASP 67 Ca -0.16 -1.30 -0.29 0.00 -0.50 0.00 0.00 54.79 52.54 1ofr n ASP 67 Cb 0.54 -0.01 0.15 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 -1.97 0.96 -0.12 0.11 0.52 -1.26 -4.99 118.95 112.20 1ofr s ARG 68 Ca 0.39 -0.13 0.01 0.00 -0.52 0.00 0.00 55.73 55.47 1ofr s ARG 68 Cb 0.19 -1.86 -0.01 0.00 0.52 0.00 0.00 34.95 33.79 1ofr s ARG 68 CO 0.31 -2.24 -0.15 0.08 0.02 0.00 0.00 175.30 173.32 1ofr s VAL 69 N -3.64 2.90 -0.11 3.52 1.01 -0.82 -4.91 120.40 118.35 1ofr s VAL 69 Ca 0.69 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1ofr s VAL 69 Cb -0.08 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 1ofr s VAL 69 CO 0.52 0.53 1.07 -0.22 0.00 0.00 0.00 175.10 177.01 1ofr s LEU 70 N 0.27 4.24 -0.26 3.92 2.96 0.22 -1.98 118.68 128.05 1ofr s LEU 70 Ca -0.10 1.60 0.02 0.00 -0.22 0.00 0.00 54.13 55.43 1ofr s LEU 70 Cb -0.16 -3.55 0.06 0.00 0.50 0.00 0.00 46.19 43.04 1ofr s LEU 70 CO 0.06 -0.52 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.79 1ofr s VAL 71 N 2.26 2.00 -0.63 1.68 1.01 -0.13 0.33 120.40 126.93 1ofr s VAL 71 Ca 0.50 -1.57 -0.18 0.00 0.00 0.00 0.00 61.98 60.73 1ofr s VAL 71 Cb -0.20 -2.18 0.12 0.00 0.00 0.00 0.00 36.38 34.13 1ofr s VAL 71 CO 0.17 -0.09 0.70 -0.63 0.00 0.00 0.00 175.10 175.26 1ofr s ILE 72 N 1.17 4.95 0.00 2.22 -1.09 -0.46 0.13 121.20 128.12 1ofr s ILE 72 Ca -0.07 -1.24 0.06 0.00 -2.23 0.00 0.00 60.65 57.17 1ofr s ILE 72 Cb -0.20 -4.48 -0.02 0.00 -1.58 0.00 0.00 42.46 36.18 1ofr s ILE 72 CO -0.06 -1.10 -0.18 0.54 -1.23 0.00 0.00 174.94 172.91 1ofr s VAL 73 N 2.29 1.47 0.00 2.92 0.11 0.02 -1.06 120.40 126.15 1ofr s VAL 73 Ca 0.12 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.28 1ofr s VAL 73 Cb -0.23 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.38 1ofr s VAL 73 CO 0.03 0.33 0.00 0.61 -3.33 0.00 0.00 175.10 172.74 1ofr n GLY 74 N 2.40 0.15 3.22 6.54 0.00 -1.03 -1.38 105.19 115.08 1ofr n GLY 74 Ca -0.16 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.01 -0.13 0.04 1.61 -0.02 0.17 -1.89 135.00 133.77 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 -1.43 0.19 0.00 -0.02 0.00 0.00 33.50 32.23 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 -6.85 -0.39 -0.02 0.00 1.04 -1.26 -4.65 113.70 101.57 1ofr s SER 77 Ca -0.06 0.74 -0.19 0.00 0.48 0.00 0.00 55.95 56.93 1ofr s SER 77 Cb 0.13 0.75 -0.05 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 4.97 0.00 -1.02 -1.09 -0.61 -4.78 121.20 118.82 1ofr s ILE 78 Ca 0.04 1.11 0.00 0.00 -2.23 0.00 0.00 60.65 59.56 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 0.45 0.01 0.00 -1.23 0.00 0.00 174.94 174.09 1ofr n HIS 79 N 2.63 0.00 -3.84 3.97 1.44 -1.26 -4.49 115.22 113.67 1ofr n HIS 79 Ca -0.09 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 -0.14 3.82 0.54 4.39 -1.08 -1.26 -4.92 116.67 118.02 1ofr s ASP 80 Ca 0.00 -1.37 0.30 0.00 -0.52 0.00 0.00 52.55 50.96 1ofr s ASP 80 Cb 0.00 -1.01 1.55 0.00 -1.46 0.00 0.00 42.92 42.00 1ofr s ASP 80 CO 0.00 -0.33 2.10 -0.07 0.52 0.00 0.00 175.17 177.39 1ofr h LEU 81 N 8.02 0.00 0.04 -1.34 4.07 -1.97 -1.44 115.31 122.69 1ofr h LEU 81 Ca -0.15 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.81 1ofr h LEU 81 Cb 1.06 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.80 1ofr h LEU 81 CO 0.43 0.09 -0.02 -0.33 -1.08 0.00 0.00 178.44 177.53 1ofr h GLU 82 N 0.00 -0.05 -0.88 1.13 3.07 -1.99 -2.71 114.58 113.15 1ofr h GLU 82 Ca -0.00 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.92 1ofr h GLU 82 Cb 0.31 0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.18 1ofr h GLU 82 CO 0.01 0.55 0.57 0.00 -1.40 0.00 0.00 179.01 178.75 1ofr h ALA 83 N -0.28 1.52 -0.10 3.43 0.00 -1.98 0.76 119.26 122.61 1ofr h ALA 83 Ca -0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ofr h ALA 83 Cb 0.63 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ofr h ALA 83 CO 0.01 0.36 -0.20 0.00 0.00 0.00 0.00 179.25 179.42 1ofr h ALA 84 N 1.51 1.50 -0.05 0.00 0.00 -1.35 -1.84 119.26 119.03 1ofr h ALA 84 Ca 0.37 -0.23 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 1ofr h ALA 84 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ofr h ALA 84 CO -0.13 0.36 -0.87 0.37 0.00 0.00 0.00 179.25 178.98 1ofr h GLN 85 N 0.15 0.51 0.02 0.00 5.75 -0.55 -2.09 115.11 118.89 1ofr h GLN 85 Ca 0.03 -0.48 -0.00 0.00 -0.15 0.00 0.00 58.65 58.04 1ofr h GLN 85 Cb 0.44 0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.11 1ofr h GLN 85 CO 0.03 1.12 -0.01 1.49 -2.65 0.00 0.00 178.83 178.81 1ofr h GLU 86 N 0.32 -0.03 -0.51 1.69 4.81 -0.89 -2.41 114.58 117.55 1ofr h GLU 86 Ca -0.07 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.24 1ofr h GLU 86 Cb 1.49 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.82 1ofr h GLU 86 CO 0.16 0.16 0.18 -0.92 -0.73 0.00 0.00 179.01 177.86 1ofr h TYR 87 N -0.22 0.31 -0.99 0.92 5.03 -1.37 -1.63 116.97 119.03 1ofr h TYR 87 Ca -0.00 0.03 0.10 0.00 2.58 0.00 0.00 58.73 61.43 1ofr h TYR 87 Cb 0.21 -0.06 -0.07 0.00 1.55 0.00 0.00 36.73 38.35 1ofr h TYR 87 CO -0.01 0.09 0.63 0.00 -1.32 0.00 0.00 178.16 177.55 1ofr h ALA 88 N 1.35 1.50 -0.01 1.82 0.00 -1.19 -0.13 119.26 122.60 1ofr h ALA 88 Ca 0.25 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ofr h ALA 88 Cb 0.28 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ofr h ALA 88 CO -0.26 0.30 0.00 -0.07 0.00 0.00 0.00 179.25 179.23 1ofr h LEU 89 N 1.05 0.01 0.60 0.00 -0.00 -0.80 0.22 115.31 116.38 1ofr h LEU 89 Ca 0.46 -0.07 -0.02 0.00 -0.00 0.00 0.00 57.88 58.25 1ofr h LEU 89 Cb 0.35 -0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.00 1ofr h LEU 89 CO -0.21 0.08 -0.44 0.03 -0.00 0.00 0.00 178.44 177.90 1ofr h ARG 90 N -0.06 -0.97 -0.49 1.13 3.08 -1.03 -1.59 114.38 114.46 1ofr h ARG 90 Ca 0.00 0.07 0.14 0.00 0.07 0.00 0.00 59.98 60.26 1ofr h ARG 90 Cb 0.07 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1ofr h ARG 90 CO -0.00 -0.64 0.39 1.25 -1.07 0.00 0.00 179.97 179.89 1ofr h LEU 91 N -1.00 0.00 -0.07 3.04 5.85 -0.95 0.24 115.31 122.42 1ofr h LEU 91 Ca -0.07 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1ofr h LEU 91 Cb 0.83 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 1ofr h LEU 91 CO 0.03 0.00 -0.04 0.50 -0.34 0.00 0.00 178.44 178.60 1ofr h LYS 92 N 0.00 0.15 0.36 1.25 1.63 0.18 0.24 116.57 120.38 1ofr h LYS 92 Ca 0.23 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.97 1ofr h LYS 92 Cb 1.01 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.61 1ofr h LYS 92 CO -0.00 0.53 -0.37 -0.22 -3.45 0.00 0.00 179.45 175.94 1ofr h LYS 93 N -0.24 -0.73 -0.91 1.90 3.64 -0.16 0.57 116.57 120.64 1ofr h LYS 93 Ca 0.01 0.05 0.21 0.00 -1.27 0.00 0.00 60.65 59.65 1ofr h LYS 93 Cb 0.49 0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 32.41 1ofr h LYS 93 CO 0.01 -0.49 0.60 1.25 -2.27 0.00 0.00 179.45 178.56 1ofr h LEU 94 N -0.76 0.39 -0.16 5.20 5.85 -0.99 0.54 115.31 125.38 1ofr h LEU 94 Ca -0.02 0.04 -0.22 0.00 0.84 0.00 0.00 57.88 58.52 1ofr h LEU 94 Cb 0.68 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 1ofr h LEU 94 CO -0.07 0.15 -0.97 -1.28 -0.34 0.00 0.00 178.44 175.94 1ofr h SER 95 N 0.39 0.31 0.62 1.25 0.87 0.05 -2.08 113.55 114.96 1ofr h SER 95 Ca 0.47 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 1ofr h SER 95 Cb 1.21 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1ofr h SER 95 CO -0.18 1.11 -0.07 0.44 -0.53 0.00 0.00 176.83 177.60 1ofr h ASP 96 N 0.11 0.00 0.00 6.23 3.45 0.13 0.11 116.42 126.45 1ofr h ASP 96 Ca -0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.40 1ofr h ASP 96 Cb 1.63 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.40 1ofr h ASP 96 CO 0.15 0.07 -0.26 -0.08 -1.57 0.00 0.00 179.24 177.55 1ofr h GLU 97 N 0.00 0.00 0.00 3.56 4.81 -1.27 -3.35 114.58 118.33 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 0.40 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.78 1ofr h GLU 97 CO 0.01 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.57 1ofr n LEU 98 N -4.34 0.00 -0.28 1.64 4.77 -0.79 -4.04 117.00 113.96 1ofr n LEU 98 Ca -0.04 0.00 0.27 0.00 -0.03 0.00 0.00 56.01 56.21 1ofr n LEU 98 Cb 0.13 0.00 0.61 0.00 -2.33 0.00 0.00 43.42 41.84 1ofr n LEU 98 CO 0.05 0.00 1.25 0.50 -1.33 0.00 0.00 177.39 177.87 1ofr h LYS 99 N 0.00 0.21 0.00 3.23 3.64 -0.91 0.20 116.57 122.94 1ofr h LYS 99 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1ofr h LYS 99 Cb 0.00 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1ofr h LYS 99 CO 0.00 0.14 0.00 0.41 -2.27 0.00 0.00 179.45 177.73 1ofr n GLY 100 N -1.60 -1.37 0.00 5.01 0.00 -1.26 -4.17 105.19 101.81 1ofr n GLY 100 Ca 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1ofr n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ofr n ASP 101 N -1.66 3.17 -4.13 1.61 8.00 -0.28 -4.94 116.55 118.31 1ofr n ASP 101 Ca 0.05 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.23 1ofr n ASP 101 Cb 0.29 0.26 -0.16 0.00 -0.02 0.00 0.00 41.12 41.49 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 -3.25 2.06 -0.54 0.64 1.43 0.54 -1.95 118.68 117.61 1ofr s LEU 102 Ca 0.00 -0.60 -0.21 0.00 -1.03 0.00 0.00 54.13 52.29 1ofr s LEU 102 Cb 0.00 -1.41 0.06 0.00 0.03 0.00 0.00 46.19 44.86 1ofr s LEU 102 CO 0.00 0.04 0.76 -0.55 0.23 0.00 0.00 176.35 176.83 1ofr s SER 103 N 1.03 6.26 -0.19 2.29 0.15 -0.84 -4.24 113.70 118.16 1ofr s SER 103 Ca -0.02 -0.76 -0.12 0.00 0.70 0.00 0.00 55.95 55.75 1ofr s SER 103 Cb -0.14 -2.35 -0.05 0.00 -1.71 0.00 0.00 66.02 61.77 1ofr s SER 103 CO -0.06 -1.06 0.20 -0.63 1.20 0.00 0.00 173.24 172.88 1ofr s ILE 104 N 3.19 5.36 0.04 6.45 1.01 -1.26 -0.95 121.20 135.04 1ofr s ILE 104 Ca 0.21 0.33 0.08 0.00 0.00 0.00 0.00 60.65 61.27 1ofr s ILE 104 Cb -0.17 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 1ofr s ILE 104 CO 0.14 0.40 -0.23 -0.63 0.00 0.00 0.00 174.94 174.61 1ofr s ILE 105 N 0.56 2.38 0.19 2.92 1.01 0.12 -4.56 121.20 123.82 1ofr s ILE 105 Ca 0.11 -1.31 -0.05 0.00 0.00 0.00 0.00 60.65 59.40 1ofr s ILE 105 Cb -0.12 -1.96 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 1ofr s ILE 105 CO 0.01 0.36 0.44 -0.32 0.00 0.00 0.00 174.94 175.43 1ofr s MET 106 N -1.31 3.64 -0.56 2.79 -2.45 -0.72 -0.80 119.30 119.89 1ofr s MET 106 Ca 0.13 -0.05 -0.23 0.00 -1.25 0.00 0.00 55.69 54.28 1ofr s MET 106 Cb -0.10 -2.78 0.05 0.00 1.25 0.00 0.00 34.83 33.25 1ofr s MET 106 CO 0.03 0.39 0.91 1.03 1.05 0.00 0.00 175.02 178.43 1ofr s ARG 107 N -2.94 3.29 -0.64 4.11 0.52 -0.48 -0.93 118.95 121.88 1ofr s ARG 107 Ca 0.42 -0.38 0.01 0.00 -0.52 0.00 0.00 55.73 55.26 1ofr s ARG 107 Cb -0.12 -4.07 0.40 0.00 0.52 0.00 0.00 34.95 31.69 1ofr s ARG 107 CO 0.26 -1.49 1.71 0.00 0.02 0.00 0.00 175.30 175.79 1ofr n ALA 108 N 7.36 5.95 -1.77 2.13 0.00 -0.46 -4.04 120.51 129.68 1ofr n ALA 108 Ca 0.00 -3.97 -0.39 0.00 0.00 0.00 0.00 53.44 49.08 1ofr n ALA 108 Cb 0.47 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 -3.83 2.96 -1.90 0.00 1.51 -1.26 -4.71 117.35 110.12 1ofr s TYR 109 Ca 0.54 1.49 0.18 0.00 -1.01 0.00 0.00 57.07 58.27 1ofr s TYR 109 Cb 0.44 -3.52 0.30 0.00 -0.11 0.00 0.00 41.96 39.08 1ofr s TYR 109 CO -0.21 -1.66 1.22 1.28 -1.11 0.00 0.00 175.55 175.07 1ofr n LEU 110 N 0.10 2.94 -3.63 -1.29 4.77 -1.26 -1.58 117.00 117.05 1ofr n LEU 110 Ca 0.04 -1.45 0.01 0.00 -0.03 0.00 0.00 56.01 54.58 1ofr n LEU 110 Cb 0.45 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 1ofr n LEU 110 CO 0.53 0.63 1.03 -1.83 -1.33 0.00 0.00 177.39 176.42 1ofr s GLU 111 N -1.27 0.47 -0.01 3.23 1.03 -1.26 0.19 118.70 121.08 1ofr s GLU 111 Ca 0.28 -0.26 -0.01 0.00 0.03 0.00 0.00 54.97 55.01 1ofr s GLU 111 Cb 0.17 0.16 0.00 0.00 -0.80 0.00 0.00 34.13 33.66 1ofr s GLU 111 CO 0.24 -0.21 0.04 0.21 -1.33 0.00 0.00 175.26 174.20 1ofr s LYS 112 N -2.51 0.08 0.00 -4.83 2.36 -1.26 -4.85 119.74 108.73 1ofr s LYS 112 Ca 0.14 -0.00 0.00 0.00 -2.55 0.00 0.00 55.97 53.56 1ofr s LYS 112 Cb 0.04 0.03 0.00 0.00 -1.05 0.00 0.00 37.83 36.86 1ofr s LYS 112 CO -0.03 -0.01 0.15 -2.30 1.55 0.00 0.00 175.35 174.70 1ofr n PRO 113 N 2.91 0.00 -0.16 4.03 -0.02 -1.26 -4.87 135.00 135.63 1ofr n PRO 113 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1ofr n PRO 113 Cb 0.59 -0.82 0.00 0.00 -0.02 0.00 0.00 33.50 33.25 1ofr n PRO 113 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1ofr n TRP 119 N 1.93 0.00 -0.82 6.00 -0.00 -1.26 -5.21 117.44 118.08 1ofr n TRP 119 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.58 1ofr n TRP 119 Cb 0.00 -0.06 0.34 0.00 -0.00 0.00 0.00 31.31 31.59 1ofr n TRP 119 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1ofr n LYS 120 N 0.01 3.98 0.00 5.87 5.02 -1.26 -5.06 118.16 126.72 1ofr n LYS 120 Ca 0.00 -2.96 0.00 0.00 -2.02 0.00 0.00 58.31 53.33 1ofr n LYS 120 Cb 0.00 -2.01 0.00 0.00 -0.02 0.00 0.00 35.03 33.00 1ofr n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ofr n GLY 121 N 0.43 2.59 0.27 0.72 0.00 -1.26 -4.44 105.19 103.50 1ofr n GLY 121 Ca 0.25 -1.95 0.18 0.00 0.00 0.00 0.00 46.02 44.50 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 0.06 0.99 5.85 -0.48 -1.38 115.31 120.34 1ofr h LEU 122 Ca 0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.41 1ofr h LEU 122 Cb 0.00 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1ofr h LEU 122 CO 0.00 0.00 -1.74 0.40 -0.34 0.00 0.00 178.44 176.76 1ofr h ILE 123 N 0.00 0.86 0.02 4.05 5.03 -1.79 -3.21 117.51 122.48 1ofr h ILE 123 Ca 0.00 -2.63 -0.27 0.00 -0.12 0.00 0.00 64.86 61.84 1ofr h ILE 123 Cb 0.33 2.52 -0.04 0.00 -3.03 0.00 0.00 36.82 36.61 1ofr h ILE 123 CO 0.00 0.69 -1.48 0.78 -0.68 0.00 0.00 178.15 177.46 1ofr h ASN 124 N 0.04 0.07 -2.62 1.72 2.35 -1.74 -3.27 115.58 112.12 1ofr h ASN 124 Ca -0.31 -0.12 -0.60 0.00 -0.55 0.00 0.00 56.30 54.72 1ofr h ASN 124 Cb 2.01 -0.02 -0.39 0.00 0.05 0.00 0.00 38.32 39.96 1ofr h ASN 124 CO 0.10 1.10 -0.83 0.47 -1.65 0.00 0.00 177.43 176.62 1ofr n ASP 125 N -3.21 0.81 -0.26 5.81 9.92 -0.53 -2.53 116.55 126.55 1ofr n ASP 125 Ca -0.12 -2.68 0.30 0.00 -0.53 0.00 0.00 54.79 51.75 1ofr n ASP 125 Cb 1.02 -0.63 0.69 0.00 -0.64 0.00 0.00 41.12 41.56 1ofr n ASP 125 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 1ofr h PRO 126 N 5.53 0.07 -0.00 -0.24 0.13 -1.76 -2.06 132.00 133.67 1ofr h PRO 126 Ca 0.23 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 1ofr h PRO 126 Cb 0.85 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1ofr h PRO 126 CO 0.50 0.05 -0.01 -0.40 -0.23 0.00 0.00 178.00 177.91 1ofr n ASP 127 N -4.29 1.07 -2.19 1.44 5.68 -1.26 -4.99 116.55 112.01 1ofr n ASP 127 Ca 0.23 -1.04 -0.03 0.00 -0.50 0.00 0.00 54.79 53.45 1ofr n ASP 127 Cb 1.06 0.13 -0.03 0.00 -1.14 0.00 0.00 41.12 41.14 1ofr n ASP 127 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 1ofr n VAL 128 N -0.01 -9.12 0.00 2.12 0.31 -0.78 -5.05 118.33 105.81 1ofr n VAL 128 Ca 0.01 1.69 0.00 0.00 -0.01 0.00 0.00 64.34 66.03 1ofr n VAL 128 Cb 0.06 -5.47 0.00 0.00 -0.91 0.00 0.00 33.84 27.52 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 0.99 0.00 -4.01 4.52 2.04 -1.26 -4.96 115.26 112.58 1ofr n ASN 129 Ca -0.24 0.00 -0.34 0.00 -0.44 0.00 0.00 54.58 53.56 1ofr n ASN 129 Cb 0.37 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.56 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 0.00 -1.57 -4.03 0.53 4.13 -1.26 -4.84 115.26 108.22 1ofr n ASN 130 Ca 0.00 -0.91 -0.33 0.00 1.68 0.00 0.00 54.58 55.02 1ofr n ASN 130 Cb 0.00 -1.39 -0.08 0.00 -1.54 0.00 0.00 39.78 36.77 1ofr n ASN 130 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 1ofr n THR 131 N -3.56 2.57 -1.63 3.41 -1.04 -1.26 -5.07 114.28 107.69 1ofr n THR 131 Ca 0.09 -5.04 -0.46 0.00 -2.04 0.00 0.00 64.05 56.60 1ofr n THR 131 Cb 0.42 -2.31 -0.03 0.00 -1.82 0.00 0.00 70.33 66.59 1ofr n THR 131 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1ofr n PHE 132 N 2.14 1.81 -2.67 -1.42 -1.74 -1.25 -4.62 117.46 109.71 1ofr n PHE 132 Ca 0.21 0.54 -0.04 0.00 -0.56 0.00 0.00 57.45 57.60 1ofr n PHE 132 Cb 0.36 -2.38 0.06 0.00 1.52 0.00 0.00 39.48 39.04 1ofr n PHE 132 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1ofr n ASN 133 N 2.05 -1.40 -0.32 5.98 5.15 -1.05 -5.03 115.26 120.64 1ofr n ASN 133 Ca 0.13 -1.61 0.13 0.00 -0.60 0.00 0.00 54.58 52.63 1ofr n ASN 133 Cb 0.29 0.76 0.36 0.00 -0.53 0.00 0.00 39.78 40.65 1ofr n ASN 133 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 1ofr h ILE 134 N 1.72 0.76 -0.04 -1.44 5.03 -1.79 -0.35 117.51 121.40 1ofr h ILE 134 Ca -0.17 -0.25 0.01 0.00 -0.12 0.00 0.00 64.86 64.33 1ofr h ILE 134 Cb 1.19 -0.02 -0.01 0.00 -3.03 0.00 0.00 36.82 34.95 1ofr h ILE 134 CO -0.15 0.13 -0.01 0.78 -0.68 0.00 0.00 178.15 178.22 1ofr h ASN 135 N 0.72 -0.04 0.48 1.72 2.35 -1.92 0.52 115.58 119.41 1ofr h ASN 135 Ca 0.52 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 56.18 1ofr h ASN 135 Cb 0.85 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.24 1ofr h ASN 135 CO -0.28 -0.01 -0.46 0.50 -1.65 0.00 0.00 177.43 175.52 1ofr h LYS 136 N 0.00 0.00 -0.07 0.81 3.64 -1.80 -2.15 116.57 117.01 1ofr h LYS 136 Ca 0.02 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1ofr h LYS 136 Cb 0.03 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1ofr h LYS 136 CO -0.04 0.46 0.03 0.78 -2.27 0.00 0.00 179.45 178.41 1ofr h GLY 137 N 1.41 0.10 1.76 5.01 0.00 0.07 -0.57 103.07 110.87 1ofr h GLY 137 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 1ofr h GLY 137 CO 0.06 0.05 -0.06 1.41 0.00 0.00 0.00 176.54 178.00 1ofr h LEU 138 N -0.00 0.28 -0.35 3.11 3.38 0.21 0.18 115.31 122.12 1ofr h LEU 138 Ca 0.02 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1ofr h LEU 138 Cb 0.11 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1ofr h LEU 138 CO -0.00 0.38 -0.16 1.56 0.09 0.00 0.00 178.44 180.30 1ofr h GLN 139 N 0.29 0.72 0.08 1.13 4.20 -0.97 0.35 115.11 120.91 1ofr h GLN 139 Ca 0.06 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 1ofr h GLN 139 Cb 0.30 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1ofr h GLN 139 CO 0.01 0.92 -0.04 0.77 -0.67 0.00 0.00 178.83 179.83 1ofr h SER 140 N 0.51 -0.09 -0.07 1.46 0.02 -0.60 0.19 113.55 114.96 1ofr h SER 140 Ca 0.08 -0.21 0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1ofr h SER 140 Cb 0.70 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 1ofr h SER 140 CO 0.05 0.16 -0.22 0.00 -1.14 0.00 0.00 176.83 175.68 1ofr h ALA 141 N 0.56 -0.59 -0.77 3.77 0.00 -0.58 0.36 119.26 122.01 1ofr h ALA 141 Ca -0.01 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1ofr h ALA 141 Cb 0.29 0.77 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 1ofr h ALA 141 CO 0.02 -0.68 0.42 -0.09 0.00 0.00 0.00 179.25 178.92 1ofr h ARG 142 N -0.22 0.69 -0.09 0.00 2.43 -0.88 -1.09 114.38 115.21 1ofr h ARG 142 Ca 0.02 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1ofr h ARG 142 Cb 0.27 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1ofr h ARG 142 CO -0.19 0.45 -0.03 0.37 -1.51 0.00 0.00 179.97 179.07 1ofr h GLN 143 N 0.71 -0.01 0.06 0.20 5.75 -0.06 -1.20 115.11 120.56 1ofr h GLN 143 Ca 0.38 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.89 1ofr h GLN 143 Cb 0.36 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.88 1ofr h GLN 143 CO -0.26 -0.01 -0.43 1.25 -2.65 0.00 0.00 178.83 176.74 1ofr h LEU 144 N -0.01 -1.31 -0.98 -2.39 5.85 0.66 0.16 115.31 117.30 1ofr h LEU 144 Ca 0.05 0.14 0.25 0.00 0.84 0.00 0.00 57.88 59.16 1ofr h LEU 144 Cb 0.08 0.49 -0.13 0.00 0.37 0.00 0.00 40.66 41.47 1ofr h LEU 144 CO -0.10 -0.44 0.54 -0.26 -0.34 0.00 0.00 178.44 177.84 1ofr h PHE 145 N -0.58 0.92 -0.22 1.25 -1.00 -1.07 0.39 116.94 116.62 1ofr h PHE 145 Ca 0.00 0.04 -0.04 0.00 2.81 0.00 0.00 57.97 60.78 1ofr h PHE 145 Cb 0.60 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 1ofr h PHE 145 CO -0.45 0.00 -0.01 0.28 -1.61 0.00 0.00 178.31 176.52 1ofr h VAL 146 N 0.50 1.26 -0.50 -0.55 2.07 -0.08 -1.69 116.25 117.26 1ofr h VAL 146 Ca 0.64 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 67.31 1ofr h VAL 146 Cb 1.26 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 1ofr h VAL 146 CO -0.51 0.28 0.17 0.78 0.02 0.00 0.00 177.57 178.32 1ofr h ASN 147 N 0.16 0.17 0.57 0.57 2.35 0.13 0.68 115.58 120.21 1ofr h ASN 147 Ca 0.06 0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1ofr h ASN 147 Cb 0.42 0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.85 1ofr h ASN 147 CO 0.01 0.12 -0.27 -0.07 -1.65 0.00 0.00 177.43 175.57 1ofr h LEU 148 N 0.34 -0.64 -2.33 1.61 3.38 -1.14 -2.94 115.31 113.58 1ofr h LEU 148 Ca 0.24 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1ofr h LEU 148 Cb 0.26 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1ofr h LEU 148 CO -0.25 -0.27 0.00 0.71 0.09 0.00 0.00 178.44 178.72 1ofr h THR 149 N -1.08 0.00 0.00 0.22 1.35 -1.26 -1.67 112.91 110.47 1ofr h THR 149 Ca -0.08 -0.03 -0.07 0.00 -0.55 0.00 0.00 66.41 65.68 1ofr h THR 149 Cb 0.64 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.90 1ofr h THR 149 CO 0.13 0.00 -0.32 -1.13 -0.25 0.00 0.00 175.52 173.94 1ofr h ASN 150 N 0.00 0.00 -0.51 5.36 -1.24 -0.67 -2.67 115.58 115.85 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 0.04 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1ofr h ASN 150 CO 0.00 0.32 0.00 2.30 -1.29 0.00 0.00 177.43 178.76 1ofr n ILE 151 N -3.50 2.45 -1.04 2.57 -5.35 -0.63 -4.70 119.36 109.16 1ofr n ILE 151 Ca -0.00 -1.24 -0.01 0.00 -0.27 0.00 0.00 62.75 61.23 1ofr n ILE 151 Cb 0.48 -0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 38.07 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 0.55 0.51 3.34 3.28 0.00 -1.01 -5.03 105.19 106.84 1ofr n GLY 152 Ca 0.25 -0.68 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.31 4.16 0.82 0.99 2.96 -1.22 -4.97 118.68 121.11 1ofr s LEU 153 Ca 0.00 -0.85 -0.12 0.00 -0.22 0.00 0.00 54.13 52.94 1ofr s LEU 153 Cb 0.00 -1.92 0.09 0.00 0.50 0.00 0.00 46.19 44.86 1ofr s LEU 153 CO 0.00 -0.26 1.16 -2.84 -1.32 0.00 0.00 176.35 173.09 1ofr s PRO 154 N 1.50 1.68 0.11 0.98 0.02 -1.26 -3.61 135.00 134.41 1ofr s PRO 154 Ca 0.02 1.56 0.05 0.00 0.02 0.00 0.00 61.00 62.64 1ofr s PRO 154 Cb -0.18 -1.80 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 1ofr s PRO 154 CO 0.04 -2.14 -0.12 0.96 -0.33 0.00 0.00 177.00 175.41 1ofr s ILE 155 N -2.44 1.11 0.07 2.83 -4.36 -1.26 -1.75 121.20 115.39 1ofr s ILE 155 Ca 0.69 -1.70 0.06 0.00 -0.26 0.00 0.00 60.65 59.43 1ofr s ILE 155 Cb -0.24 -1.46 -0.03 0.00 1.25 0.00 0.00 42.46 41.98 1ofr s ILE 155 CO 0.52 -0.52 -0.16 -0.83 0.24 0.00 0.00 174.94 174.20 1ofr s GLY 156 N -2.50 0.92 0.15 6.27 0.00 -0.10 -1.58 107.32 110.47 1ofr s GLY 156 Ca 0.08 -1.00 -0.06 0.00 0.00 0.00 0.00 44.72 43.74 1ofr s GLY 156 CO 0.01 -1.00 0.19 -0.45 0.00 0.00 0.00 173.10 171.85 1ofr s SER 157 N -1.58 0.16 -0.09 1.64 0.15 -0.25 -1.35 113.70 112.37 1ofr s SER 157 Ca 0.01 -1.00 -0.18 0.00 0.70 0.00 0.00 55.95 55.47 1ofr s SER 157 Cb -0.09 0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 64.55 1ofr s SER 157 CO 0.02 -0.82 0.50 -0.70 1.20 0.00 0.00 173.24 173.44 1ofr s GLU 158 N -4.00 4.31 -1.02 5.44 2.12 -1.26 -1.61 118.70 122.69 1ofr s GLU 158 Ca 0.20 0.50 -0.22 0.00 0.36 0.00 0.00 54.97 55.81 1ofr s GLU 158 Cb 0.05 -3.41 0.07 0.00 0.26 0.00 0.00 34.13 31.10 1ofr s GLU 158 CO 0.00 0.22 1.39 -1.64 -0.54 0.00 0.00 175.26 174.70 1ofr s MET 159 N 0.40 3.62 0.01 4.30 -1.94 -1.00 -4.88 119.30 119.81 1ofr s MET 159 Ca 0.27 -1.33 -0.09 0.00 -1.71 0.00 0.00 55.69 52.83 1ofr s MET 159 Cb -0.16 -5.27 -0.05 0.00 2.01 0.00 0.00 34.83 31.37 1ofr s MET 159 CO 0.12 -2.11 1.04 -0.07 -0.01 0.00 0.00 175.02 173.99 1ofr h LEU 160 N 12.21 -0.26 0.00 -0.03 -0.00 -1.95 -3.45 115.31 121.83 1ofr h LEU 160 Ca 0.21 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 1ofr h LEU 160 Cb 1.00 0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 1ofr h LEU 160 CO 1.36 -0.18 0.00 -0.90 -0.00 0.00 0.00 178.44 178.72 1ofr n ASP 161 N -2.90 1.87 -1.55 -0.43 5.68 -1.26 -5.04 116.55 112.92 1ofr n ASP 161 Ca -0.04 -0.55 0.08 0.00 -0.50 0.00 0.00 54.79 53.78 1ofr n ASP 161 Cb 0.12 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.45 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 -0.04 2.15 0.01 2.12 -2.24 -1.26 -4.52 114.28 110.50 1ofr n THR 162 Ca 0.00 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.43 1ofr n THR 162 Cb 0.00 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 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 0.73 0.12 -0.33 2.28 5.41 -1.26 -4.53 119.36 121.77 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 0.97 -1.37 0.43 0.00 -0.71 0.00 0.00 39.64 38.96 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 0.46 -0.84 4.38 0.02 -1.99 0.58 113.55 116.16 1ofr h SER 164 Ca 0.00 0.18 0.12 0.00 -0.84 0.00 0.00 61.79 61.25 1ofr h SER 164 Cb 0.77 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.39 1ofr h SER 164 CO 0.00 -0.10 0.54 -0.65 -1.14 0.00 0.00 176.83 175.48 1ofr h PRO 165 N 0.34 0.68 0.00 3.45 0.11 -1.87 -1.11 132.00 133.61 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 1.51 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.47 1ofr h PRO 165 CO -0.60 0.45 -0.03 1.96 -0.21 0.00 0.00 178.00 179.57 1ofr h GLN 166 N 0.70 0.00 0.00 1.05 1.08 -1.19 1.25 115.11 118.00 1ofr h GLN 166 Ca 0.40 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 1ofr h GLN 166 Cb 0.59 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 1ofr h GLN 166 CO -0.17 0.03 -0.31 0.66 -0.95 0.00 0.00 178.83 178.10 1ofr n TYR 167 N -4.32 0.56 0.00 2.96 4.02 -0.43 -4.46 117.16 115.49 1ofr n TYR 167 Ca -0.03 0.16 0.00 0.00 -0.01 0.00 0.00 57.90 58.02 1ofr n TYR 167 Cb 0.12 -0.69 0.00 0.00 -0.02 0.00 0.00 39.34 38.74 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 -2.02 0.00 -0.32 7.72 4.77 -0.63 -4.84 117.00 121.68 1ofr n LEU 168 Ca 0.05 -0.06 0.18 0.00 -0.03 0.00 0.00 56.01 56.15 1ofr n LEU 168 Cb 0.41 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.86 1ofr n LEU 168 CO 0.33 0.00 0.90 0.00 -1.33 0.00 0.00 177.39 177.29 1ofr h ALA 169 N 0.00 1.42 0.00 -1.18 0.00 0.13 -0.60 119.26 119.03 1ofr h ALA 169 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1ofr h ALA 169 Cb 0.00 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ofr h ALA 169 CO 0.00 -0.62 0.13 0.38 0.00 0.00 0.00 179.25 179.14 1ofr h ASP 170 N 0.08 0.00 0.00 0.00 2.03 -1.89 -2.33 116.42 114.31 1ofr h ASP 170 Ca 0.64 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.94 1ofr h ASP 170 Cb 1.41 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.91 1ofr h ASP 170 CO -0.80 0.00 -0.56 0.18 -1.03 0.00 0.00 179.24 177.03 1ofr n LEU 171 N -2.54 0.46 -4.75 0.15 4.77 -0.24 -4.85 117.00 110.00 1ofr n LEU 171 Ca -0.02 -0.47 -0.39 0.00 -0.03 0.00 0.00 56.01 55.10 1ofr n LEU 171 Cb 0.17 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 1ofr n LEU 171 CO 0.12 0.12 0.39 -0.69 -1.33 0.00 0.00 177.39 176.00 1ofr s VAL 172 N -2.04 4.79 -0.07 4.08 1.01 -0.88 -4.58 120.40 122.72 1ofr s VAL 172 Ca 0.03 1.47 0.17 0.00 0.00 0.00 0.00 61.98 63.65 1ofr s VAL 172 Cb 0.08 -4.04 -0.26 0.00 0.00 0.00 0.00 36.38 32.16 1ofr s VAL 172 CO 0.43 0.39 0.28 -1.20 0.00 0.00 0.00 175.10 175.00 1ofr n SER 173 N 2.73 0.85 -3.85 3.32 7.64 -0.62 -4.87 113.62 118.82 1ofr n SER 173 Ca -0.04 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.71 1ofr n SER 173 Cb 0.50 1.51 -0.13 0.00 -1.01 0.00 0.00 64.21 65.08 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 -2.97 -0.07 -0.01 1.43 5.36 -1.15 -4.12 117.98 116.45 1ofr s PHE 174 Ca -0.07 0.17 0.03 0.00 -0.96 0.00 0.00 56.93 56.10 1ofr s PHE 174 Cb 0.09 0.02 -0.01 0.00 -0.34 0.00 0.00 43.02 42.79 1ofr s PHE 174 CO 0.73 -0.04 -0.11 0.20 -1.46 0.00 0.00 175.22 174.55 1ofr s GLY 175 N 0.02 0.54 -0.07 13.12 0.00 -0.64 -1.09 107.32 119.21 1ofr s GLY 175 Ca -0.00 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.29 1ofr s GLY 175 CO 0.00 -0.35 -0.14 0.00 0.00 0.00 0.00 173.10 172.62 1ofr s ALA 176 N -0.18 1.37 -0.12 3.20 0.00 -0.63 -0.02 121.76 125.36 1ofr s ALA 176 Ca 0.03 -0.48 -0.22 0.00 0.00 0.00 0.00 51.96 51.29 1ofr s ALA 176 Cb -0.05 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 1ofr s ALA 176 CO -0.00 0.14 0.65 0.42 0.00 0.00 0.00 175.76 176.97 1ofr s ILE 177 N 0.61 5.05 1.20 0.00 -1.09 -0.11 -2.38 121.20 124.48 1ofr s ILE 177 Ca -0.15 1.29 -0.15 0.00 -2.23 0.00 0.00 60.65 59.42 1ofr s ILE 177 Cb -0.16 -3.98 0.26 0.00 -1.58 0.00 0.00 42.46 37.00 1ofr s ILE 177 CO 0.04 0.20 0.74 0.61 -1.23 0.00 0.00 174.94 175.31 1ofr n GLY 178 N 3.38 -2.33 0.17 6.18 0.00 -1.26 -3.23 105.19 108.09 1ofr n GLY 178 Ca -0.02 -1.13 0.02 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.65 1.12 -0.04 4.61 0.00 -1.86 -2.74 119.26 117.70 1ofr h ALA 179 Ca -0.60 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 53.89 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 0.46 0.57 0.00 0.54 0.00 0.00 0.00 179.25 180.82 1ofr n ARG 180 N -3.82 1.20 0.00 0.00 1.74 -1.26 -3.82 116.66 110.70 1ofr n ARG 180 Ca -0.01 -0.30 0.00 0.00 -0.77 0.00 0.00 57.85 56.77 1ofr n ARG 180 Cb 0.51 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 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 -0.50 0.00 -0.18 0.55 -2.24 -1.10 -4.83 114.28 105.98 1ofr n THR 181 Ca 0.15 -0.20 0.21 0.00 -2.27 0.00 0.00 64.05 61.94 1ofr n THR 181 Cb 0.14 1.17 0.59 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 0.17 0.68 0.00 4.28 2.02 -1.59 0.93 112.91 119.39 1ofr h THR 182 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1ofr h THR 182 Cb 0.09 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1ofr h THR 182 CO 0.00 0.05 -0.15 -0.33 0.37 0.00 0.00 175.52 175.46 1ofr h GLU 183 N 0.25 0.00 -6.25 6.66 5.08 -1.86 -3.43 114.58 115.03 1ofr h GLU 183 Ca 0.41 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 58.21 1ofr h GLU 183 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1ofr h GLU 183 CO -0.10 0.00 1.21 0.45 -1.00 0.00 0.00 179.01 179.57 1ofr s SER 184 N -6.00 6.31 0.20 1.42 0.15 0.32 -4.89 113.70 111.20 1ofr s SER 184 Ca 0.06 2.10 -0.12 0.00 0.70 0.00 0.00 55.95 58.70 1ofr s SER 184 Cb 0.06 -2.53 0.23 0.00 -1.71 0.00 0.00 66.02 62.08 1ofr s SER 184 CO 0.68 -1.25 1.71 -0.61 1.20 0.00 0.00 173.24 174.98 1ofr h GLN 185 N 11.16 0.25 -0.99 5.44 5.75 -1.88 -1.17 115.11 133.66 1ofr h GLN 185 Ca -0.41 -0.02 0.20 0.00 -0.15 0.00 0.00 58.65 58.27 1ofr h GLN 185 Cb 1.20 -0.06 -0.10 0.00 1.07 0.00 0.00 27.48 29.59 1ofr h GLN 185 CO 0.97 0.17 0.61 1.25 -2.65 0.00 0.00 178.83 179.18 1ofr h LEU 186 N 0.26 0.71 0.00 -2.39 5.85 -1.93 0.48 115.31 118.28 1ofr h LEU 186 Ca 0.28 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1ofr h LEU 186 Cb 0.38 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1ofr h LEU 186 CO -0.35 0.25 -0.23 0.45 -0.34 0.00 0.00 178.44 178.22 1ofr h HIS 187 N 0.69 0.00 -0.00 1.25 3.86 -1.51 -2.37 115.15 117.07 1ofr h HIS 187 Ca 0.56 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.67 1ofr h HIS 187 Cb 0.97 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.45 1ofr h HIS 187 CO -0.00 0.00 -0.40 0.00 0.86 0.00 0.00 177.93 178.38 1ofr h ARG 188 N 0.00 0.28 -0.76 2.45 3.08 -0.48 -2.34 114.38 116.61 1ofr h ARG 188 Ca 0.00 -0.29 -0.05 0.00 0.07 0.00 0.00 59.98 59.70 1ofr h ARG 188 Cb 0.88 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.98 1ofr h ARG 188 CO 0.00 1.00 0.27 0.93 -1.07 0.00 0.00 179.97 181.10 1ofr h GLU 189 N -0.33 1.16 -0.99 0.04 5.08 -1.32 -0.85 114.58 117.37 1ofr h GLU 189 Ca -0.05 -0.23 0.03 0.00 -1.00 0.00 0.00 59.36 58.11 1ofr h GLU 189 Cb 1.14 -0.18 -0.06 0.00 0.50 0.00 0.00 28.75 30.16 1ofr h GLU 189 CO 0.08 0.96 0.65 1.25 -1.00 0.00 0.00 179.01 180.96 1ofr h LEU 190 N 1.12 1.10 -0.68 1.33 5.85 -1.44 -2.09 115.31 120.50 1ofr h LEU 190 Ca 0.25 -0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.82 1ofr h LEU 190 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1ofr h LEU 190 CO -0.01 0.76 -0.47 0.00 -0.34 0.00 0.00 178.44 178.38 1ofr h ALA 191 N 1.41 0.85 0.00 1.25 0.00 -0.81 -2.76 119.26 119.21 1ofr h ALA 191 Ca 0.39 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ofr h ALA 191 Cb -0.04 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ofr h ALA 191 CO -0.11 0.66 0.00 -1.13 0.00 0.00 0.00 179.25 178.67 1ofr n SER 192 N -3.99 0.00 0.00 0.00 3.41 -0.39 -2.27 113.62 110.39 1ofr n SER 192 Ca -0.02 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 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 -0.41 -0.52 3.83 5.00 0.00 -1.05 -1.08 105.19 110.96 1ofr n GLY 193 Ca 0.07 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 -0.18 3.92 -0.07 0.99 1.43 -0.96 -4.96 118.68 118.85 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 0.20 0.00 0.03 0.00 0.00 46.19 41.93 1ofr s LEU 194 CO 0.00 -0.37 0.88 -1.20 0.23 0.00 0.00 176.35 175.89 1ofr n SER 195 N -0.71 2.35 -3.22 2.29 7.64 -1.26 -4.90 113.62 115.81 1ofr n SER 195 Ca 0.07 -2.26 -0.13 0.00 1.01 0.00 0.00 58.87 57.55 1ofr n SER 195 Cb 0.54 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 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 0.80 0.26 1.43 -0.12 -1.26 -5.06 117.98 112.65 1ofr s PHE 196 Ca 0.14 -1.14 -0.29 0.00 -0.05 0.00 0.00 56.93 55.59 1ofr s PHE 196 Cb 0.11 0.15 -0.09 0.00 -0.63 0.00 0.00 43.02 42.56 1ofr s PHE 196 CO 0.04 -1.23 1.18 -2.14 -0.05 0.00 0.00 175.22 173.02 1ofr s PRO 197 N -2.95 4.53 -0.14 1.99 0.02 -1.26 -4.88 135.00 132.31 1ofr s PRO 197 Ca 0.26 1.92 0.02 0.00 0.02 0.00 0.00 61.00 63.22 1ofr s PRO 197 Cb -0.02 -3.18 0.01 0.00 0.02 0.00 0.00 34.50 31.33 1ofr s PRO 197 CO 0.17 0.02 -0.20 0.08 -0.33 0.00 0.00 177.00 176.75 1ofr s VAL 198 N -0.76 2.23 -0.22 3.83 1.01 -0.83 -1.61 120.40 124.06 1ofr s VAL 198 Ca 0.48 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 1ofr s VAL 198 Cb -0.34 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 1ofr s VAL 198 CO 0.42 0.54 0.18 -0.83 0.00 0.00 0.00 175.10 175.41 1ofr s GLY 199 N 0.80 2.03 -0.23 4.51 0.00 0.97 -2.22 107.32 113.16 1ofr s GLY 199 Ca -0.07 -0.76 -0.10 0.00 0.00 0.00 0.00 44.72 43.79 1ofr s GLY 199 CO -0.01 0.34 0.15 -1.36 0.00 0.00 0.00 173.10 172.23 1ofr s PHE 200 N 0.80 3.32 0.33 1.90 0.08 -0.10 -0.93 117.98 123.37 1ofr s PHE 200 Ca 0.09 0.22 -0.20 0.00 0.12 0.00 0.00 56.93 57.16 1ofr s PHE 200 Cb -0.13 -2.25 -0.10 0.00 -0.57 0.00 0.00 43.02 39.98 1ofr s PHE 200 CO 0.02 0.08 0.83 0.15 -0.10 0.00 0.00 175.22 176.21 1ofr s LYS 201 N 0.97 4.24 0.72 0.44 1.02 -1.20 -0.27 119.74 125.66 1ofr s LYS 201 Ca 0.07 0.97 -0.13 0.00 0.02 0.00 0.00 55.97 56.90 1ofr s LYS 201 Cb -0.13 -2.54 0.03 0.00 -0.52 0.00 0.00 37.83 34.67 1ofr s LYS 201 CO 0.04 0.19 1.11 0.54 -0.92 0.00 0.00 175.35 176.31 1ofr s ASN 202 N -1.97 4.66 0.49 2.83 4.22 -0.77 -4.59 114.94 119.81 1ofr s ASN 202 Ca 0.53 1.98 -0.20 0.00 -2.14 0.00 0.00 52.86 53.03 1ofr s ASN 202 Cb -0.13 -2.54 -0.11 0.00 1.28 0.00 0.00 41.25 39.74 1ofr s ASN 202 CO 0.18 -1.93 0.45 0.61 -2.04 0.00 0.00 177.10 174.37 1ofr n GLY 203 N -0.64 -1.71 0.00 0.45 0.00 -0.36 -4.79 105.19 98.14 1ofr n GLY 203 Ca 0.10 -0.07 0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.26 0.93 -1.34 2.61 -2.24 -1.26 -1.72 114.28 109.99 1ofr n THR 204 Ca 0.11 0.23 -0.19 0.00 -2.27 0.00 0.00 64.05 61.93 1ofr n THR 204 Cb 0.44 -1.09 0.17 0.00 -2.10 0.00 0.00 70.33 67.74 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 3.86 0.00 3.42 5.75 -1.26 -3.71 116.55 123.29 1ofr n ASP 205 Ca 0.04 -3.69 0.00 0.00 -0.01 0.00 0.00 54.79 51.12 1ofr n ASP 205 Cb 0.07 -0.78 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 1.23 3.80 6.12 0.00 -0.70 -4.10 105.19 110.44 1ofr n GLY 206 Ca 0.52 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.50 3.93 -1.94 2.61 -4.23 -1.26 -4.81 115.64 108.45 1ofr s THR 207 Ca 0.00 1.27 0.16 0.00 -1.18 0.00 0.00 61.69 61.95 1ofr s THR 207 Cb 0.00 -3.56 0.10 0.00 1.34 0.00 0.00 72.50 70.39 1ofr s THR 207 CO 0.00 -0.19 0.99 -0.11 -0.54 0.00 0.00 174.62 174.77 1ofr n LEU 208 N -0.64 2.22 -0.01 4.79 7.94 -1.26 -1.22 117.00 128.82 1ofr n LEU 208 Ca 0.08 -0.95 -0.12 0.00 -1.11 0.00 0.00 56.01 53.90 1ofr n LEU 208 Cb 0.52 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.39 1ofr n LEU 208 CO 0.40 0.40 0.72 0.78 -1.11 0.00 0.00 177.39 178.59 1ofr h ASN 209 N 2.94 0.08 -0.68 1.96 4.21 -2.00 -2.97 115.58 119.11 1ofr h ASN 209 Ca 0.00 -0.32 0.07 0.00 1.21 0.00 0.00 56.30 57.27 1ofr h ASN 209 Cb 0.66 -0.02 -0.04 0.00 -1.12 0.00 0.00 38.32 37.79 1ofr h ASN 209 CO 0.00 0.37 0.45 -0.37 -1.29 0.00 0.00 177.43 176.59 1ofr h VAL 210 N -0.23 0.98 -0.01 2.81 -1.51 -1.97 -1.41 116.25 114.92 1ofr h VAL 210 Ca 0.01 -0.22 -0.16 0.00 -1.23 0.00 0.00 66.70 65.10 1ofr h VAL 210 Cb 0.34 0.28 -0.02 0.00 -2.13 0.00 0.00 31.29 29.76 1ofr h VAL 210 CO 0.00 0.12 -0.73 0.00 -1.23 0.00 0.00 177.57 175.72 1ofr h ALA 211 N 1.64 0.75 -0.21 5.19 0.00 -1.80 -1.20 119.26 123.63 1ofr h ALA 211 Ca 0.30 -0.65 -0.14 0.00 0.00 0.00 0.00 54.91 54.42 1ofr h ALA 211 Cb 0.33 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ofr h ALA 211 CO -0.10 0.87 -0.45 0.28 0.00 0.00 0.00 179.25 179.85 1ofr h VAL 212 N 0.06 1.31 -0.00 0.00 2.07 -1.19 -2.35 116.25 116.15 1ofr h VAL 212 Ca -0.02 -1.64 -0.14 0.00 0.82 0.00 0.00 66.70 65.72 1ofr h VAL 212 Cb 1.30 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 1ofr h VAL 212 CO 0.10 0.51 -0.68 0.44 0.02 0.00 0.00 177.57 177.96 1ofr h ASP 213 N 0.42 0.01 0.09 0.57 3.32 -1.11 -2.01 116.42 117.72 1ofr h ASP 213 Ca 0.03 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ofr h ASP 213 Cb 0.96 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1ofr h ASP 213 CO 0.08 0.69 -0.04 0.00 -1.72 0.00 0.00 179.24 178.26 1ofr h ALA 214 N 1.31 -0.12 -0.95 3.45 0.00 -0.97 -0.73 119.26 121.24 1ofr h ALA 214 Ca -0.01 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1ofr h ALA 214 Cb 1.21 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 1ofr h ALA 214 CO 0.09 -0.47 0.61 0.00 0.00 0.00 0.00 179.25 179.48 1ofr h GLN 216 N 1.12 -0.36 0.17 0.00 1.08 -1.09 -2.71 115.11 113.33 1ofr h GLN 216 Ca 0.40 0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.62 1ofr h GLN 216 Cb 0.13 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 1ofr h GLN 216 CO -0.16 -0.24 -0.08 0.00 -0.95 0.00 0.00 178.83 177.39 1ofr h ALA 217 N 0.38 -0.23 0.00 3.87 0.00 -0.51 -2.49 119.26 120.28 1ofr h ALA 217 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ofr h ALA 217 Cb 0.32 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1ofr h ALA 217 CO 0.01 -0.63 0.17 0.00 0.00 0.00 0.00 179.25 178.81 1ofr h ALA 218 N 0.58 1.14 0.00 0.00 0.00 -0.84 0.36 119.26 120.51 1ofr h ALA 218 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1ofr h ALA 218 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1ofr h ALA 218 CO 0.04 -0.14 -0.44 0.00 0.00 0.00 0.00 179.25 178.70 1ofr h ALA 219 N 1.62 0.82 -2.33 0.00 0.00 -1.10 0.65 119.26 118.92 1ofr h ALA 219 Ca 0.00 -0.40 -0.46 0.00 0.00 0.00 0.00 54.91 54.05 1ofr h ALA 219 Cb 0.33 -0.07 0.09 0.00 0.00 0.00 0.00 17.79 18.15 1ofr h ALA 219 CO 0.00 0.55 0.30 -1.01 0.00 0.00 0.00 179.25 179.10 1ofr s HIS 220 N -3.28 2.73 0.02 0.00 3.76 0.12 -3.99 115.29 114.66 1ofr s HIS 220 Ca 0.02 0.50 -0.19 0.00 -0.15 0.00 0.00 55.06 55.23 1ofr s HIS 220 Cb 0.09 -3.38 -0.06 0.00 1.11 0.00 0.00 32.58 30.34 1ofr s HIS 220 CO 0.71 -1.67 0.56 0.45 -0.85 0.00 0.00 174.74 173.95 1ofr s SER 221 N -4.58 6.99 0.20 1.40 0.15 -1.26 -3.59 113.70 113.00 1ofr s SER 221 Ca 0.62 1.17 0.08 0.00 0.70 0.00 0.00 55.95 58.52 1ofr s SER 221 Cb -0.10 -2.35 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 1ofr s SER 221 CO 0.47 0.19 -0.15 -1.00 1.20 0.00 0.00 173.24 173.95 1ofr s HIS 222 N -0.63 1.71 -0.33 3.44 3.76 -1.23 -4.93 115.29 117.08 1ofr s HIS 222 Ca 0.29 -0.56 0.03 0.00 -0.15 0.00 0.00 55.06 54.67 1ofr s HIS 222 Cb -0.18 -0.81 0.10 0.00 1.11 0.00 0.00 32.58 32.80 1ofr s HIS 222 CO 0.17 0.35 0.06 -1.01 -0.85 0.00 0.00 174.74 173.46 1ofr s HIS 223 N -2.80 3.15 0.31 1.40 3.76 -1.26 -0.57 115.29 119.28 1ofr s HIS 223 Ca 0.21 -2.61 0.03 0.00 -0.15 0.00 0.00 55.06 52.54 1ofr s HIS 223 Cb -0.02 -2.54 -0.06 0.00 1.11 0.00 0.00 32.58 31.07 1ofr s HIS 223 CO 0.07 -0.92 0.07 -0.59 -0.85 0.00 0.00 174.74 172.51 1ofr s PHE 224 N 1.12 1.84 -0.31 1.40 -0.12 -0.33 -4.95 117.98 116.62 1ofr s PHE 224 Ca 0.10 -1.04 -0.15 0.00 -0.05 0.00 0.00 56.93 55.79 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 -0.13 -0.10 0.39 -1.64 -0.05 0.00 0.00 175.22 173.69 1ofr s MET 225 N -3.92 3.80 0.00 1.99 -1.94 -1.26 0.95 119.30 118.91 1ofr s MET 225 Ca 0.36 -0.15 0.00 0.00 -1.71 0.00 0.00 55.69 54.19 1ofr s MET 225 Cb 0.08 -3.73 0.00 0.00 2.01 0.00 0.00 34.83 33.19 1ofr s MET 225 CO 0.15 -0.42 0.00 0.41 -0.01 0.00 0.00 175.02 175.15 1ofr n GLY 226 N 4.80 4.61 3.39 -0.03 0.00 -0.29 -4.92 105.19 112.76 1ofr n GLY 226 Ca -0.08 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.86 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 -1.33 2.47 0.93 1.61 -7.23 -1.26 -0.23 120.40 115.36 1ofr s VAL 227 Ca 0.00 -1.18 -0.15 0.00 -1.81 0.00 0.00 61.98 58.84 1ofr s VAL 227 Cb 0.00 -1.97 0.17 0.00 0.56 0.00 0.00 36.38 35.14 1ofr s VAL 227 CO 0.00 0.42 1.28 0.42 -0.31 0.00 0.00 175.10 176.91 1ofr s THR 228 N -0.80 1.99 -0.01 5.32 -4.23 0.11 -4.86 115.64 113.16 1ofr s THR 228 Ca 0.12 0.00 0.27 0.00 -1.18 0.00 0.00 61.69 60.91 1ofr s THR 228 Cb -0.10 -2.98 0.28 0.00 1.34 0.00 0.00 72.50 71.03 1ofr s THR 228 CO 0.02 0.00 1.84 0.11 -0.54 0.00 0.00 174.62 176.05 1ofr h LYS 229 N -1.51 0.00 -0.86 3.99 1.79 -1.96 -2.03 116.57 115.99 1ofr h LYS 229 Ca -0.45 0.00 -0.43 0.00 -2.18 0.00 0.00 60.65 57.59 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 0.46 0.00 0.49 0.72 -1.08 0.00 0.00 179.45 180.04 1ofr n HIS 230 N -2.47 2.68 -1.74 -1.35 8.25 -1.26 0.15 115.22 119.48 1ofr n HIS 230 Ca -0.01 -1.73 -0.20 0.00 -0.26 0.00 0.00 57.72 55.51 1ofr n HIS 230 Cb 0.07 -0.84 -0.07 0.00 1.12 0.00 0.00 29.99 30.26 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 -1.03 1.49 3.53 -1.41 0.00 -0.76 -4.97 105.19 102.05 1ofr n GLY 231 Ca 0.53 0.00 -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 -2.78 3.40 0.15 1.61 1.01 -1.26 -4.85 120.40 117.68 1ofr s VAL 232 Ca 0.00 -0.60 -0.31 0.00 0.00 0.00 0.00 61.98 61.08 1ofr s VAL 232 Cb 0.00 -2.36 -0.08 0.00 0.00 0.00 0.00 36.38 33.94 1ofr s VAL 232 CO 0.00 0.60 1.37 0.00 0.00 0.00 0.00 175.10 177.06 1ofr s ALA 233 N -0.77 3.57 0.06 5.51 0.00 -1.26 0.09 121.76 128.97 1ofr s ALA 233 Ca 0.12 1.13 -0.15 0.00 0.00 0.00 0.00 51.96 53.06 1ofr s ALA 233 Cb -0.11 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.52 1ofr s ALA 233 CO 0.01 -0.60 0.34 0.00 0.00 0.00 0.00 175.76 175.51 1ofr s ALA 234 N 0.76 -0.77 -0.62 0.00 0.00 0.68 -4.91 121.76 116.90 1ofr s ALA 234 Ca 0.62 0.02 -0.27 0.00 0.00 0.00 0.00 51.96 52.32 1ofr s ALA 234 Cb -0.37 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.18 1ofr s ALA 234 CO 0.33 -0.48 1.45 0.42 0.00 0.00 0.00 175.76 177.49 1ofr s ILE 235 N -2.90 3.69 0.25 0.00 1.01 -1.26 -1.14 121.20 120.84 1ofr s ILE 235 Ca -0.03 0.51 -0.19 0.00 0.00 0.00 0.00 60.65 60.94 1ofr s ILE 235 Cb 0.00 -4.49 -0.08 0.00 0.01 0.00 0.00 42.46 37.90 1ofr s ILE 235 CO -0.06 -1.33 0.74 -0.89 0.00 0.00 0.00 174.94 173.41 1ofr s THR 236 N 6.49 4.57 -0.10 2.92 2.01 0.27 -4.92 115.64 126.88 1ofr s THR 236 Ca 0.50 1.26 -0.00 0.00 0.31 0.00 0.00 61.69 63.75 1ofr s THR 236 Cb -0.10 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.61 1ofr s THR 236 CO 0.21 0.13 -0.06 -0.89 -0.69 0.00 0.00 174.62 173.32 1ofr s THR 237 N -1.61 0.90 0.25 -0.82 2.01 -1.26 -1.19 115.64 113.92 1ofr s THR 237 Ca 0.45 -0.22 0.02 0.00 0.31 0.00 0.00 61.69 62.25 1ofr s THR 237 Cb -0.16 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 1ofr s THR 237 CO 0.20 0.34 0.40 0.42 -0.69 0.00 0.00 174.62 175.30 1ofr s THR 238 N 1.64 5.22 0.01 -0.82 -4.23 0.27 -4.95 115.64 112.78 1ofr s THR 238 Ca 0.03 -0.70 0.02 0.00 -1.18 0.00 0.00 61.69 59.87 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 0.88 0.50 -0.54 0.00 0.00 174.62 175.07 1ofr h LYS 239 N 1.35 0.14 0.00 3.99 3.64 -1.87 -3.25 116.57 120.57 1ofr h LYS 239 Ca -0.50 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 58.63 1ofr h LYS 239 Cb 1.22 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1ofr h LYS 239 CO 0.63 0.96 0.00 0.41 -2.27 0.00 0.00 179.45 179.18 1ofr n GLY 240 N 1.59 3.08 3.40 5.01 0.00 -0.24 -4.12 105.19 113.92 1ofr n GLY 240 Ca -0.14 -1.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 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 4.78 0.00 1.61 3.84 0.23 -4.86 114.94 120.54 1ofr s ASN 241 Ca 0.00 -0.26 0.23 0.00 0.21 0.00 0.00 52.86 53.04 1ofr s ASN 241 Cb 0.00 -1.84 0.53 0.00 -0.55 0.00 0.00 41.25 39.39 1ofr s ASN 241 CO 0.00 -0.00 1.47 -1.84 -2.79 0.00 0.00 177.10 173.94 1ofr n GLU 242 N 4.68 2.61 -2.02 0.43 0.00 -1.26 -3.36 120.64 121.71 1ofr n GLU 242 Ca -0.17 -2.46 -0.31 0.00 0.00 0.00 0.00 57.16 54.22 1ofr n GLU 242 Cb 0.51 -1.54 0.03 0.00 0.00 0.00 0.00 31.44 30.44 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 1.58 3.12 -3.92 -1.84 8.25 -1.26 -4.94 115.22 116.20 1ofr n HIS 243 Ca 0.22 -2.69 -0.36 0.00 -0.26 0.00 0.00 57.72 54.63 1ofr n HIS 243 Cb 0.62 -0.66 -0.12 0.00 1.12 0.00 0.00 29.99 30.95 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 1.13 2.14 -0.09 0.00 -0.71 -0.94 -4.57 117.98 114.94 1ofr s PHE 245 Ca 0.04 -0.88 -0.08 0.00 -1.04 0.00 0.00 56.93 54.96 1ofr s PHE 245 Cb -0.14 -1.53 -0.04 0.00 -1.21 0.00 0.00 43.02 40.09 1ofr s PHE 245 CO 0.03 0.19 0.20 0.08 -1.34 0.00 0.00 175.22 174.37 1ofr s VAL 246 N -2.97 5.41 -0.11 -2.49 1.01 -1.26 -0.92 120.40 119.06 1ofr s VAL 246 Ca 0.28 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.59 1ofr s VAL 246 Cb 0.07 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 1ofr s VAL 246 CO 0.14 0.59 -0.16 -0.63 0.00 0.00 0.00 175.10 175.04 1ofr s ILE 247 N -1.06 2.83 -0.27 2.22 1.01 0.63 -0.86 121.20 125.70 1ofr s ILE 247 Ca 0.18 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 1ofr s ILE 247 Cb -0.13 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 1ofr s ILE 247 CO 0.07 0.54 0.27 -0.76 0.00 0.00 0.00 174.94 175.06 1ofr s LEU 248 N 0.18 4.04 -0.06 2.97 1.43 0.28 -1.85 118.68 125.67 1ofr s LEU 248 Ca -0.09 0.14 0.11 0.00 -1.03 0.00 0.00 54.13 53.26 1ofr s LEU 248 Cb -0.15 -2.26 0.21 0.00 0.03 0.00 0.00 46.19 44.02 1ofr s LEU 248 CO 0.05 -0.10 1.10 -2.11 0.23 0.00 0.00 176.35 175.52 1ofr n ARG 249 N 5.12 0.52 0.00 1.70 -4.01 -1.26 0.12 116.66 118.84 1ofr n ARG 249 Ca -0.12 -1.88 0.00 0.00 -1.04 0.00 0.00 57.85 54.82 1ofr n ARG 249 Cb 0.51 -0.79 0.00 0.00 -3.04 0.00 0.00 32.46 29.15 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 -0.40 -1.28 0.00 2.89 0.00 -1.26 -1.59 105.19 103.55 1ofr n GLY 250 Ca 0.08 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.59 0.13 -0.02 0.00 -1.25 -4.17 105.19 99.29 1ofr n GLY 251 Ca 0.00 -0.50 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 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 0.40 0.00 1.61 1.79 -1.73 -3.28 116.57 115.36 1ofr h LYS 252 Ca 0.00 -0.68 0.00 0.00 -2.18 0.00 0.00 60.65 57.79 1ofr h LYS 252 Cb 0.00 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1ofr h LYS 252 CO 0.00 1.31 0.00 1.17 -1.08 0.00 0.00 179.45 180.85 1ofr n LYS 253 N -3.60 0.14 0.00 3.15 4.81 -1.26 -4.92 118.16 116.49 1ofr n LYS 253 Ca -0.18 0.15 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 1ofr n LYS 253 Cb 1.07 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.62 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 -0.65 2.44 3.69 3.14 0.00 -1.24 -5.02 105.19 107.55 1ofr n GLY 254 Ca 0.04 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.71 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 0.47 3.75 -2.20 2.61 -2.24 -1.26 -3.96 114.28 111.45 1ofr n THR 255 Ca 0.00 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1ofr n THR 255 Cb 0.00 -1.33 0.09 0.00 -2.10 0.00 0.00 70.33 66.99 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 -2.17 1.87 0.02 3.42 0.23 -1.26 -4.78 115.26 112.58 1ofr n ASN 256 Ca 0.15 -2.86 0.11 0.00 -0.53 0.00 0.00 54.58 51.45 1ofr n ASN 256 Cb 0.49 -0.41 -0.12 0.00 -2.08 0.00 0.00 39.78 37.66 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 -0.37 0.23 -1.35 -2.53 0.18 -1.26 -4.44 117.16 107.62 1ofr n TYR 257 Ca 0.16 0.07 -0.32 0.00 1.88 0.00 0.00 57.90 59.68 1ofr n TYR 257 Cb 0.92 -0.58 0.09 0.00 -0.38 0.00 0.00 39.34 39.39 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 -4.62 4.37 0.14 9.48 1.47 -1.26 -4.76 116.67 121.49 1ofr s ASP 258 Ca -0.05 2.03 -0.28 0.00 1.18 0.00 0.00 52.55 55.43 1ofr s ASP 258 Cb 0.13 -2.55 -0.04 0.00 -0.34 0.00 0.00 42.92 40.12 1ofr s ASP 258 CO 0.88 -2.13 1.59 0.00 0.68 0.00 0.00 175.17 176.18 1ofr h ALA 259 N -0.75 -0.51 -0.92 2.11 0.00 -1.93 0.03 119.26 117.28 1ofr h ALA 259 Ca -0.45 0.01 0.27 0.00 0.00 0.00 0.00 54.91 54.74 1ofr h ALA 259 Cb 1.25 0.77 -0.04 0.00 0.00 0.00 0.00 17.79 19.78 1ofr h ALA 259 CO 0.50 -0.89 0.73 -0.22 0.00 0.00 0.00 179.25 179.38 1ofr h LYS 260 N -0.44 0.00 0.04 0.00 3.64 -1.98 0.03 116.57 117.85 1ofr h LYS 260 Ca 0.09 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.28 1ofr h LYS 260 Cb 0.60 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.44 1ofr h LYS 260 CO -0.42 0.00 -0.79 0.77 -2.27 0.00 0.00 179.45 176.74 1ofr h SER 261 N 0.00 0.63 0.25 4.20 0.02 -1.32 -3.17 113.55 114.16 1ofr h SER 261 Ca 0.44 -0.79 -0.02 0.00 -0.84 0.00 0.00 61.79 60.58 1ofr h SER 261 Cb 1.89 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 64.24 1ofr h SER 261 CO -0.00 1.35 -0.07 0.58 -1.14 0.00 0.00 176.83 177.54 1ofr h VAL 262 N -0.01 0.50 -0.01 2.27 2.07 -0.40 -2.11 116.25 118.56 1ofr h VAL 262 Ca -0.11 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 1ofr h VAL 262 Cb 1.50 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1ofr h VAL 262 CO 0.15 0.07 -0.02 0.00 0.02 0.00 0.00 177.57 177.80 1ofr h ALA 263 N 1.93 0.01 -0.65 1.67 0.00 -1.35 -0.69 119.26 120.17 1ofr h ALA 263 Ca -0.00 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.64 1ofr h ALA 263 Cb 0.22 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1ofr h ALA 263 CO 0.01 -0.17 0.43 0.93 0.00 0.00 0.00 179.25 180.45 1ofr h GLU 264 N -0.59 0.69 0.22 0.00 5.08 -1.47 -2.61 114.58 115.91 1ofr h GLU 264 Ca -0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ofr h GLU 264 Cb 0.64 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1ofr h GLU 264 CO 0.00 0.46 -0.11 0.00 -1.00 0.00 0.00 179.01 178.37 1ofr h ALA 265 N 1.63 -1.00 -0.18 3.43 0.00 -1.29 -3.08 119.26 118.77 1ofr h ALA 265 Ca 0.27 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1ofr h ALA 265 Cb 0.17 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ofr h ALA 265 CO -0.08 -0.98 0.61 0.87 0.00 0.00 0.00 179.25 179.67 1ofr h LYS 266 N -0.32 0.00 -0.09 0.00 1.57 -0.95 0.49 116.57 117.28 1ofr h LYS 266 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ofr h LYS 266 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ofr h LYS 266 CO 0.05 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.93 1ofr n ALA 267 N -1.91 2.55 -0.01 3.86 0.00 -1.00 -3.81 120.51 120.20 1ofr n ALA 267 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 53.44 53.01 1ofr n ALA 267 Cb 0.70 -1.15 -0.04 0.00 0.00 0.00 0.00 19.45 18.96 1ofr n ALA 267 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ofr n GLN 268 N 0.15 1.40 -1.88 0.00 6.02 0.17 -4.98 117.38 118.27 1ofr n GLN 268 Ca 0.17 -0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.71 1ofr n GLN 268 Cb 0.32 -1.13 -0.03 0.00 1.02 0.00 0.00 30.24 30.42 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 -3.77 4.37 0.87 1.08 1.43 -1.09 -4.96 118.68 116.59 1ofr s LEU 269 Ca -0.02 2.51 -0.11 0.00 -1.03 0.00 0.00 54.13 55.48 1ofr s LEU 269 Cb 0.03 -3.55 0.11 0.00 0.03 0.00 0.00 46.19 42.81 1ofr s LEU 269 CO 0.21 -0.93 1.10 -2.84 0.23 0.00 0.00 176.35 174.12 1ofr s PRO 270 N 3.16 1.48 -0.56 1.29 0.02 -1.26 -4.83 135.00 134.29 1ofr s PRO 270 Ca 0.77 1.12 -0.35 0.00 0.02 0.00 0.00 61.00 62.56 1ofr s PRO 270 Cb -0.40 -1.81 -0.15 0.00 0.02 0.00 0.00 34.50 32.16 1ofr s PRO 270 CO 0.34 -2.17 2.34 0.00 -0.33 0.00 0.00 177.00 177.17 1ofr n ALA 271 N -3.88 0.64 0.00 -1.55 0.00 -1.26 -1.03 120.51 113.44 1ofr n ALA 271 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ofr n ALA 271 Cb 0.54 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.53 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 6.69 1.09 3.78 0.00 0.00 -1.26 -5.10 105.19 110.40 1ofr n GLY 272 Ca 0.50 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 5.10 0.45 1.61 0.01 -0.20 -5.06 113.70 113.61 1ofr s SER 273 Ca 0.00 1.84 0.00 0.00 1.31 0.00 0.00 55.95 59.10 1ofr s SER 273 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1ofr s SER 273 CO 0.00 -1.63 0.00 0.59 0.41 0.00 0.00 173.24 172.61 1ofr n ASN 274 N -2.81 0.00 -4.78 2.44 3.02 -1.26 -5.05 115.26 106.82 1ofr n ASN 274 Ca 0.09 -0.71 -0.37 0.00 -0.03 0.00 0.00 54.58 53.56 1ofr n ASN 274 Cb 0.53 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.63 1ofr n ASN 274 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1ofr s GLY 275 N -2.16 2.22 0.33 7.41 0.00 -0.18 -4.92 107.32 110.02 1ofr s GLY 275 Ca 0.00 -0.48 -0.24 0.00 0.00 0.00 0.00 44.72 43.99 1ofr s GLY 275 CO 0.00 0.18 0.40 1.04 0.00 0.00 0.00 173.10 174.72 1ofr n LEU 276 N 2.94 -1.35 -4.35 0.66 4.77 -0.81 -4.45 117.00 114.41 1ofr n LEU 276 Ca -0.14 0.97 -0.28 0.00 -0.03 0.00 0.00 56.01 56.52 1ofr n LEU 276 Cb 0.53 -0.99 -0.13 0.00 -2.33 0.00 0.00 43.42 40.50 1ofr n LEU 276 CO 0.37 -3.29 -0.56 -0.32 -1.33 0.00 0.00 177.39 172.26 1ofr s MET 277 N -1.17 1.47 -0.08 3.23 -2.45 -0.04 -1.65 119.30 118.61 1ofr s MET 277 Ca 0.62 -1.23 0.04 0.00 -1.25 0.00 0.00 55.69 53.87 1ofr s MET 277 Cb -0.74 -1.82 0.00 0.00 1.25 0.00 0.00 34.83 33.53 1ofr s MET 277 CO 0.59 0.44 -0.21 0.42 1.05 0.00 0.00 175.02 177.32 1ofr s ILE 278 N -0.98 1.77 -0.23 10.11 1.01 0.20 -0.56 121.20 132.52 1ofr s ILE 278 Ca 0.12 -0.86 -0.19 0.00 0.00 0.00 0.00 60.65 59.72 1ofr s ILE 278 Cb -0.10 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 1ofr s ILE 278 CO 0.04 0.50 0.54 -0.62 0.00 0.00 0.00 174.94 175.40 1ofr s ASP 279 N 0.33 6.54 0.00 3.58 -1.08 0.32 0.19 116.67 126.54 1ofr s ASP 279 Ca -0.14 0.65 0.18 0.00 -0.52 0.00 0.00 52.55 52.71 1ofr s ASP 279 Cb -0.16 -2.30 0.92 0.00 -1.46 0.00 0.00 42.92 39.92 1ofr s ASP 279 CO 0.06 -0.25 1.61 -1.22 0.52 0.00 0.00 175.17 175.90 1ofr n TYR 280 N 5.17 0.06 -3.64 -5.34 4.02 0.00 -4.64 117.16 112.79 1ofr n TYR 280 Ca -0.04 -0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.82 1ofr n TYR 280 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1ofr n TYR 280 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1ofr n SER 281 N -0.47 0.08 0.00 7.72 3.41 -1.26 -4.20 113.62 118.91 1ofr n SER 281 Ca 0.13 -0.64 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 1ofr n SER 281 Cb 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 1ofr n SER 281 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ofr n HIS 282 N 0.00 0.00 0.33 7.33 8.25 -1.26 -2.12 115.22 127.76 1ofr n HIS 282 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 1ofr n HIS 282 Cb 0.00 0.01 0.74 0.00 1.12 0.00 0.00 29.99 31.85 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 0.23 -1.41 0.00 -1.61 0.22 103.07 100.51 1ofr h GLY 283 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 1ofr h GLY 283 CO 0.00 0.00 -1.96 0.70 0.00 0.00 0.00 176.54 175.28 1ofr n ASN 284 N -2.86 0.20 0.17 0.19 3.02 -0.90 -4.08 115.26 111.00 1ofr n ASN 284 Ca -0.02 0.09 0.02 0.00 -0.03 0.00 0.00 54.58 54.64 1ofr n ASN 284 Cb 0.45 1.27 0.33 0.00 -0.61 0.00 0.00 39.78 41.21 1ofr n ASN 284 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 1ofr h SER 285 N 0.00 0.05 -4.72 6.41 0.87 -0.45 -3.45 113.55 112.26 1ofr h SER 285 Ca -0.20 -0.02 -0.25 0.00 -1.23 0.00 0.00 61.79 60.09 1ofr h SER 285 Cb 1.50 -0.01 0.12 0.00 -0.44 0.00 0.00 62.40 63.57 1ofr h SER 285 CO 0.02 0.42 -0.57 0.59 -0.53 0.00 0.00 176.83 176.76 1ofr n ASN 286 N -4.08 -2.41 -1.04 6.23 5.03 -0.84 -2.32 115.26 115.83 1ofr n ASN 286 Ca -0.02 -0.46 -0.09 0.00 0.87 0.00 0.00 54.58 54.89 1ofr n ASN 286 Cb 0.42 -3.95 -0.04 0.00 -1.02 0.00 0.00 39.78 35.19 1ofr n ASN 286 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1ofr n LYS 287 N -3.40 -1.42 -3.63 3.52 4.01 -1.26 -4.86 118.16 111.12 1ofr n LYS 287 Ca -0.19 0.59 -0.29 0.00 -0.51 0.00 0.00 58.31 57.91 1ofr n LYS 287 Cb 0.62 -4.67 -0.13 0.00 -0.51 0.00 0.00 35.03 30.34 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 -1.79 3.43 0.00 4.39 3.68 -0.98 -4.97 116.67 120.43 1ofr s ASP 288 Ca 0.00 -2.48 0.00 0.00 2.13 0.00 0.00 52.55 52.20 1ofr s ASP 288 Cb 0.00 -0.83 0.00 0.00 -1.45 0.00 0.00 42.92 40.64 1ofr s ASP 288 CO 0.00 -0.28 0.76 2.22 0.13 0.00 0.00 175.17 178.00 1ofr n PHE 289 N 3.71 0.00 0.31 -5.34 1.16 -1.26 0.14 117.46 116.18 1ofr n PHE 289 Ca 0.10 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.79 1ofr n PHE 289 Cb 0.35 -0.27 0.07 0.00 -1.61 0.00 0.00 39.48 38.02 1ofr n PHE 289 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1ofr h ARG 290 N 0.00 0.00 0.00 3.97 3.08 -1.88 -3.31 114.38 116.24 1ofr h ARG 290 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ofr h ARG 290 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1ofr h ARG 290 CO 0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1ofr n ASN 291 N -2.44 0.00 0.41 7.04 5.03 0.38 -3.83 115.26 121.84 1ofr n ASN 291 Ca 0.01 0.32 -0.18 0.00 0.87 0.00 0.00 54.58 55.61 1ofr n ASN 291 Cb 0.50 -0.42 -0.09 0.00 -1.02 0.00 0.00 39.78 38.76 1ofr n ASN 291 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 1ofr h GLN 292 N 0.00 -1.06 0.00 3.52 4.20 -1.71 -2.27 115.11 117.79 1ofr h GLN 292 Ca 0.00 0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1ofr h GLN 292 Cb 0.23 0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1ofr h GLN 292 CO 0.00 -0.71 0.29 -1.35 -0.67 0.00 0.00 178.83 176.39 1ofr h PRO 293 N -1.10 0.00 0.39 1.46 0.11 -1.87 -0.49 132.00 130.50 1ofr h PRO 293 Ca -0.10 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 1ofr h PRO 293 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1ofr h PRO 293 CO 0.12 0.00 -0.19 0.87 -0.21 0.00 0.00 178.00 178.60 1ofr h LYS 294 N 0.00 -0.51 -0.95 1.05 1.57 -1.63 -2.76 116.57 113.35 1ofr h LYS 294 Ca 0.00 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 58.94 1ofr h LYS 294 Cb 0.57 0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.92 1ofr h LYS 294 CO 0.00 -0.23 0.60 0.28 -0.57 0.00 0.00 179.45 179.53 1ofr h VAL 295 N -1.04 0.89 -0.74 0.50 2.07 -0.70 0.52 116.25 117.74 1ofr h VAL 295 Ca -0.05 -0.30 0.09 0.00 0.82 0.00 0.00 66.70 67.26 1ofr h VAL 295 Cb 0.51 -0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.16 1ofr h VAL 295 CO 0.09 0.16 0.40 -1.13 0.02 0.00 0.00 177.57 177.10 1ofr h ASN 296 N 0.86 0.55 -0.93 0.57 -1.24 -1.25 -0.76 115.58 113.38 1ofr h ASN 296 Ca 0.47 0.05 0.05 0.00 0.71 0.00 0.00 56.30 57.58 1ofr h ASN 296 Cb 0.58 -0.05 -0.06 0.00 0.73 0.00 0.00 38.32 39.53 1ofr h ASN 296 CO -0.24 0.32 0.61 0.44 -1.29 0.00 0.00 177.43 177.27 1ofr h ASP 297 N 0.68 0.98 1.48 1.15 3.45 -0.59 1.10 116.42 124.67 1ofr h ASP 297 Ca 0.36 -0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.79 1ofr h ASP 297 Cb 0.34 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.88 1ofr h ASP 297 CO -0.25 0.66 -0.13 0.58 -1.57 0.00 0.00 179.24 178.53 1ofr h VAL 298 N 1.13 0.26 0.00 -1.35 2.07 -1.02 -2.83 116.25 114.51 1ofr h VAL 298 Ca 0.38 -1.13 -0.14 0.00 0.82 0.00 0.00 66.70 66.63 1ofr h VAL 298 Cb 0.07 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 1ofr h VAL 298 CO -0.13 0.13 -0.88 0.58 0.02 0.00 0.00 177.57 177.30 1ofr h VAL 299 N 0.00 0.77 -0.90 2.57 2.07 0.19 -3.23 116.25 117.72 1ofr h VAL 299 Ca -0.00 -1.87 0.26 0.00 0.82 0.00 0.00 66.70 65.91 1ofr h VAL 299 Cb 0.91 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 1ofr h VAL 299 CO 0.02 0.26 0.68 0.00 0.02 0.00 0.00 177.57 178.54 1ofr h GLU 301 N 0.00 -0.05 -0.79 0.00 4.81 -1.63 -2.53 114.58 114.39 1ofr h GLU 301 Ca 0.43 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.69 1ofr h GLU 301 Cb 1.78 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 31.12 1ofr h GLU 301 CO -0.00 0.46 0.51 1.96 -0.73 0.00 0.00 179.01 181.21 1ofr h GLN 302 N -0.60 0.97 -0.30 1.92 4.20 -0.64 -2.30 115.11 118.37 1ofr h GLN 302 Ca -0.01 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 1ofr h GLN 302 Cb 0.54 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1ofr h GLN 302 CO 0.01 0.64 -0.31 0.82 -0.67 0.00 0.00 178.83 179.32 1ofr h ILE 303 N 1.00 1.28 -0.11 2.54 2.04 -1.44 -2.17 117.51 120.65 1ofr h ILE 303 Ca 0.31 -1.42 -0.05 0.00 1.00 0.00 0.00 64.86 64.69 1ofr h ILE 303 Cb -0.02 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1ofr h ILE 303 CO -0.10 0.46 -0.18 0.00 0.00 0.00 0.00 178.15 178.33 1ofr h ALA 304 N 1.13 1.50 -0.39 1.87 0.00 -1.00 -1.99 119.26 120.38 1ofr h ALA 304 Ca 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ofr h ALA 304 Cb 0.80 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1ofr h ALA 304 CO 0.07 0.36 0.00 0.09 0.00 0.00 0.00 179.25 179.76 1ofr n ASN 305 N -4.25 2.86 -0.42 0.00 3.02 -0.90 -3.77 115.26 111.79 1ofr n ASN 305 Ca -0.01 -2.22 0.00 0.00 -0.03 0.00 0.00 54.58 52.32 1ofr n ASN 305 Cb 0.29 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 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 0.85 0.75 3.49 7.41 0.00 -0.75 -5.06 105.19 111.87 1ofr n GLY 306 Ca 0.15 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.48 3.14 -0.09 1.61 2.56 -0.84 -4.92 118.70 117.68 1ofr s GLU 307 Ca 0.00 -0.69 0.15 0.00 0.00 0.00 0.00 54.97 54.43 1ofr s GLU 307 Cb 0.00 -3.98 0.60 0.00 2.00 0.00 0.00 34.13 32.74 1ofr s GLU 307 CO 0.00 -0.93 1.48 0.09 -0.56 0.00 0.00 175.26 175.33 1ofr n ASN 308 N 5.81 3.99 -0.06 -1.70 3.02 -1.26 -3.95 115.26 121.11 1ofr n ASN 308 Ca -0.06 -2.36 -0.20 0.00 -0.03 0.00 0.00 54.58 51.93 1ofr n ASN 308 Cb 0.47 -0.52 -0.13 0.00 -0.61 0.00 0.00 39.78 38.99 1ofr n ASN 308 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ofr n ALA 309 N 0.90 1.13 -2.35 5.41 0.00 -1.26 -4.78 120.51 119.56 1ofr n ALA 309 Ca 0.21 -0.83 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 1ofr n ALA 309 Cb 0.75 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 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 -2.54 3.67 -0.11 0.00 1.01 -1.25 -1.92 121.20 120.06 1ofr s ILE 310 Ca -0.28 0.50 0.17 0.00 0.00 0.00 0.00 60.65 61.03 1ofr s ILE 310 Cb 0.08 -4.44 -0.25 0.00 0.01 0.00 0.00 42.46 37.85 1ofr s ILE 310 CO 0.69 -1.28 0.22 0.35 0.00 0.00 0.00 174.94 174.92 1ofr n THR 311 N 6.82 0.66 -3.96 2.92 -2.24 -0.66 -4.98 114.28 112.85 1ofr n THR 311 Ca 0.12 -0.61 -0.09 0.00 -2.27 0.00 0.00 64.05 61.20 1ofr n THR 311 Cb 0.50 -0.26 -0.09 0.00 -2.10 0.00 0.00 70.33 68.37 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 -4.72 0.23 0.03 3.38 0.00 -1.16 0.70 107.32 105.78 1ofr s GLY 312 Ca -0.08 -0.69 0.06 0.00 0.00 0.00 0.00 44.72 44.02 1ofr s GLY 312 CO 0.75 -0.82 -0.17 -1.34 0.00 0.00 0.00 173.10 171.52 1ofr s VAL 313 N -2.89 1.39 -0.20 1.40 -7.23 0.15 -0.62 120.40 112.39 1ofr s VAL 313 Ca -0.03 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.06 1ofr s VAL 313 Cb 0.01 -1.22 -0.01 0.00 0.56 0.00 0.00 36.38 35.72 1ofr s VAL 313 CO -0.06 0.14 -0.06 -0.32 -0.31 0.00 0.00 175.10 174.49 1ofr s MET 314 N -1.06 3.37 0.02 4.82 0.00 0.13 -1.35 119.30 125.24 1ofr s MET 314 Ca 0.05 -0.64 0.08 0.00 0.00 0.00 0.00 55.69 55.18 1ofr s MET 314 Cb -0.08 -2.93 -0.02 0.00 0.00 0.00 0.00 34.83 31.79 1ofr s MET 314 CO 0.01 -0.13 -0.23 0.42 0.00 0.00 0.00 175.02 175.09 1ofr s ILE 315 N 1.28 1.88 -0.32 10.11 1.01 -0.22 -0.82 121.20 134.13 1ofr s ILE 315 Ca 0.03 -1.20 -0.06 0.00 0.00 0.00 0.00 60.65 59.42 1ofr s ILE 315 Cb -0.14 -1.60 0.03 0.00 0.01 0.00 0.00 42.46 40.75 1ofr s ILE 315 CO -0.03 0.36 0.09 -1.61 0.00 0.00 0.00 174.94 173.76 1ofr s GLU 316 N -1.00 2.80 0.07 2.79 2.02 -1.26 -2.47 118.70 121.64 1ofr s GLU 316 Ca 0.09 -1.06 -0.13 0.00 0.02 0.00 0.00 54.97 53.90 1ofr s GLU 316 Cb -0.09 -3.42 0.02 0.00 0.10 0.00 0.00 34.13 30.74 1ofr s GLU 316 CO 0.01 -0.58 0.29 -1.54 0.02 0.00 0.00 175.26 173.46 1ofr s SER 317 N 1.44 -0.07 0.30 -0.19 1.04 -0.79 -3.22 113.70 112.20 1ofr s SER 317 Ca -0.00 -0.33 0.04 0.00 0.48 0.00 0.00 55.95 56.14 1ofr s SER 317 Cb -0.19 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 1ofr s SER 317 CO 0.02 -0.68 0.22 0.21 0.98 0.00 0.00 173.24 173.99 1ofr s ASN 318 N -2.38 1.31 0.43 7.02 3.84 -0.77 -0.66 114.94 123.74 1ofr s ASN 318 Ca -0.01 -1.63 0.09 0.00 0.21 0.00 0.00 52.86 51.52 1ofr s ASN 318 Cb 0.01 0.49 0.94 0.00 -0.55 0.00 0.00 41.25 42.14 1ofr s ASN 318 CO -0.07 -0.98 2.05 0.40 -2.79 0.00 0.00 177.10 175.72 1ofr h ILE 319 N 2.26 1.05 0.00 -5.21 2.04 -1.80 -2.75 117.51 113.10 1ofr h ILE 319 Ca -0.29 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1ofr h ILE 319 Cb 1.24 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1ofr h ILE 319 CO 0.44 0.08 0.00 0.59 0.00 0.00 0.00 178.15 179.26 1ofr n ASN 320 N -4.48 0.00 -3.58 1.72 3.02 -1.11 -2.78 115.26 108.05 1ofr n ASN 320 Ca 0.04 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.57 1ofr n ASN 320 Cb 0.12 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 1ofr n ASN 320 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1ofr s GLU 321 N 3.78 0.95 1.99 3.52 -1.05 -1.25 -2.13 118.70 124.51 1ofr s GLU 321 Ca 0.00 -0.58 0.00 0.00 -0.15 0.00 0.00 54.97 54.24 1ofr s GLU 321 Cb 0.00 0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.98 1ofr s GLU 321 CO 0.00 -0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.18 1ofr n GLY 322 N -0.63 -1.41 2.94 -3.83 0.00 -1.26 -4.80 105.19 96.20 1ofr n GLY 322 Ca -0.04 -1.29 -0.11 0.00 0.00 0.00 0.00 46.02 44.58 1ofr n GLY 322 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ofr s ASN 323 N -4.00 0.17 0.05 1.61 2.20 -1.26 -3.33 114.94 110.38 1ofr s ASN 323 Ca 0.00 -0.29 0.00 0.00 -0.94 0.00 0.00 52.86 51.63 1ofr s ASN 323 Cb 0.00 0.05 0.00 0.00 -2.00 0.00 0.00 41.25 39.30 1ofr s ASN 323 CO 0.00 -0.16 0.00 0.00 -2.94 0.00 0.00 177.10 174.00 1ofr n GLN 324 N 2.24 1.85 -4.32 3.55 10.64 -1.19 -5.00 117.38 125.15 1ofr n GLN 324 Ca -0.19 -0.38 -0.29 0.00 -1.83 0.00 0.00 57.00 54.31 1ofr n GLN 324 Cb 0.57 0.10 -0.05 0.00 -0.86 0.00 0.00 30.24 30.00 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 -1.31 2.66 -0.42 2.61 0.00 -1.26 -4.63 107.32 104.97 1ofr s GLY 325 Ca 0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 1ofr s GLY 325 CO 0.00 -2.06 0.19 -0.42 0.00 0.00 0.00 173.10 170.82 1ofr s ILE 326 N -2.79 3.09 -0.02 0.90 1.09 -1.26 -4.79 121.20 117.42 1ofr s ILE 326 Ca 0.22 -2.23 -0.07 0.00 -1.10 0.00 0.00 60.65 57.47 1ofr s ILE 326 Cb 0.01 -3.14 -0.04 0.00 -1.06 0.00 0.00 42.46 38.23 1ofr s ILE 326 CO 0.13 -0.69 0.52 1.55 -0.10 0.00 0.00 174.94 176.35 1ofr h PRO 327 N 7.83 -0.25 0.00 2.79 0.13 -2.00 -3.53 132.00 136.96 1ofr h PRO 327 Ca -0.10 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1ofr h PRO 327 Cb 1.03 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1ofr h PRO 327 CO 0.66 -0.17 0.00 1.63 -0.23 0.00 0.00 178.00 179.89 1ofr n LYS 335 N -3.47 0.00 0.00 0.86 5.02 -1.26 -5.27 118.16 114.05 1ofr n LYS 335 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1ofr n LYS 335 Cb 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.11 1ofr n LYS 335 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1ofr n TYR 336 N 0.00 0.00 -0.81 2.13 4.19 -1.26 -5.01 117.16 116.40 1ofr n TYR 336 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1ofr n TYR 336 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1ofr n TYR 336 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1ofr n GLY 337 N -0.97 0.27 3.17 2.98 0.00 -1.26 -4.89 105.19 104.49 1ofr n GLY 337 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.74 1.99 -0.02 1.61 1.01 -1.26 -2.74 120.40 119.25 1ofr s VAL 338 Ca 0.00 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 1ofr s VAL 338 Cb 0.00 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1ofr s VAL 338 CO 0.00 0.54 1.39 -0.55 0.00 0.00 0.00 175.10 176.48 1ofr s SER 339 N 0.70 6.86 0.00 3.32 0.15 -1.25 -4.65 113.70 118.84 1ofr s SER 339 Ca -0.10 2.06 0.01 0.00 0.70 0.00 0.00 55.95 58.62 1ofr s SER 339 Cb -0.16 -2.56 0.05 0.00 -1.71 0.00 0.00 66.02 61.65 1ofr s SER 339 CO 0.01 -0.72 0.39 2.30 1.20 0.00 0.00 173.24 176.42 1ofr n ILE 340 N 4.77 0.00 0.00 6.45 -5.35 -1.26 -3.14 119.36 120.83 1ofr n ILE 340 Ca 0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 1ofr n ILE 340 Cb 0.44 -0.38 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 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 -0.54 0.00 -1.40 7.28 -2.24 -1.26 -4.75 114.28 111.37 1ofr n THR 341 Ca 0.01 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1ofr n THR 341 Cb 0.00 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.33 1ofr n THR 341 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ofr s ASP 342 N 1.00 4.47 -0.02 3.42 1.01 -1.26 -4.70 116.67 120.59 1ofr s ASP 342 Ca 0.00 1.56 -0.25 0.00 0.71 0.00 0.00 52.55 54.57 1ofr s ASP 342 Cb 0.00 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1ofr s ASP 342 CO 0.00 -2.02 0.77 0.00 0.21 0.00 0.00 175.17 174.13 1ofr s ALA 343 N -3.01 3.32 0.00 5.23 0.00 -1.26 -4.53 121.76 121.50 1ofr s ALA 343 Ca 0.61 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.82 1ofr s ALA 343 Cb -0.16 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1ofr s ALA 343 CO 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 175.76 176.24 1ofr s ILE 345 N 3.82 0.13 0.58 0.00 -4.36 -1.20 -4.10 121.20 116.07 1ofr s ILE 345 Ca 0.00 -1.39 -0.19 0.00 -0.26 0.00 0.00 60.65 58.81 1ofr s ILE 345 Cb 0.00 -1.58 -0.04 0.00 1.25 0.00 0.00 42.46 42.09 1ofr s ILE 345 CO 0.00 -0.58 1.16 -0.83 0.24 0.00 0.00 174.94 174.93 1ofr s GLY 346 N -2.92 2.62 0.41 6.27 0.00 -0.90 -1.85 107.32 110.95 1ofr s GLY 346 Ca 0.11 0.87 0.17 0.00 0.00 0.00 0.00 44.72 45.86 1ofr s GLY 346 CO -0.06 1.24 1.85 -0.25 0.00 0.00 0.00 173.10 175.87 1ofr h TRP 347 N 0.95 0.59 0.54 1.90 -0.00 -1.30 0.55 115.95 119.17 1ofr h TRP 347 Ca -0.50 0.02 -0.03 0.00 -0.00 0.00 0.00 58.89 58.38 1ofr h TRP 347 Cb 1.27 -0.18 0.01 0.00 -0.00 0.00 0.00 29.16 30.26 1ofr h TRP 347 CO 0.50 0.15 -0.26 1.49 -0.00 0.00 0.00 178.44 180.32 1ofr h GLU 348 N 0.44 -0.70 -0.67 2.65 4.81 -1.89 -1.13 114.58 118.08 1ofr h GLU 348 Ca 0.48 0.05 0.14 0.00 -0.13 0.00 0.00 59.36 59.90 1ofr h GLU 348 Cb 1.15 0.16 -0.12 0.00 0.63 0.00 0.00 28.75 30.57 1ofr h GLU 348 CO -0.19 -0.46 -0.03 1.79 -0.73 0.00 0.00 179.01 179.38 1ofr h THR 349 N -1.07 0.41 0.00 0.32 1.35 -1.75 -2.43 112.91 109.73 1ofr h THR 349 Ca -0.07 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 1ofr h THR 349 Cb 0.55 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 1ofr h THR 349 CO 0.12 0.02 0.00 0.41 -0.25 0.00 0.00 175.52 175.82 1ofr n THR 350 N -5.34 0.00 -0.16 6.82 -1.04 0.12 -2.53 114.28 112.15 1ofr n THR 350 Ca 0.10 1.38 0.07 0.00 -2.04 0.00 0.00 64.05 63.56 1ofr n THR 350 Cb 0.39 -2.21 0.14 0.00 -1.82 0.00 0.00 70.33 66.83 1ofr n THR 350 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1ofr n GLU 351 N -1.92 -0.04 0.15 -2.82 2.13 -0.43 0.17 120.64 117.89 1ofr n GLU 351 Ca 0.00 0.71 0.12 0.00 0.66 0.00 0.00 57.16 58.65 1ofr n GLU 351 Cb 0.00 -1.13 0.18 0.00 0.27 0.00 0.00 31.44 30.76 1ofr n GLU 351 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1ofr h ASP 352 N 0.00 0.00 -0.53 4.31 5.19 -1.44 -1.98 116.42 121.96 1ofr h ASP 352 Ca 0.29 -0.03 -0.10 0.00 -0.62 0.00 0.00 57.03 56.57 1ofr h ASP 352 Cb 0.59 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.09 1ofr h ASP 352 CO -0.45 0.01 -0.07 0.58 -3.12 0.00 0.00 179.24 176.20 1ofr h VAL 353 N 0.00 1.27 -0.30 -1.35 2.07 0.20 -0.82 116.25 117.33 1ofr h VAL 353 Ca 0.00 -1.21 -0.16 0.00 0.82 0.00 0.00 66.70 66.15 1ofr h VAL 353 Cb 0.91 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1ofr h VAL 353 CO 0.00 0.43 -0.45 -0.07 0.02 0.00 0.00 177.57 177.49 1ofr h LEU 354 N 0.86 0.91 -1.00 2.57 3.38 -1.37 0.09 115.31 120.75 1ofr h LEU 354 Ca 0.14 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1ofr h LEU 354 Cb 0.62 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1ofr h LEU 354 CO 0.04 1.25 0.34 0.03 0.09 0.00 0.00 178.44 180.19 1ofr h ARG 355 N 0.60 1.05 -0.19 1.13 3.08 -1.24 0.66 114.38 119.49 1ofr h ARG 355 Ca 0.03 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 1ofr h ARG 355 Cb 1.05 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1ofr h ARG 355 CO 0.10 0.82 -0.03 -0.22 -1.07 0.00 0.00 179.97 179.57 1ofr h LYS 356 N 1.04 0.35 -0.98 0.04 3.64 -1.06 -1.15 116.57 118.47 1ofr h LYS 356 Ca 0.25 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1ofr h LYS 356 Cb 0.13 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1ofr h LYS 356 CO -0.03 0.60 0.65 1.25 -2.27 0.00 0.00 179.45 179.65 1ofr h LEU 357 N 0.08 1.12 0.01 5.20 5.85 -0.29 -0.07 115.31 127.21 1ofr h LEU 357 Ca 0.05 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ofr h LEU 357 Cb 0.47 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1ofr h LEU 357 CO 0.02 0.81 -0.01 0.00 -0.34 0.00 0.00 178.44 178.92 1ofr h ALA 358 N 1.36 -0.02 -0.29 1.25 0.00 0.44 -1.99 119.26 120.01 1ofr h ALA 358 Ca 0.36 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.25 1ofr h ALA 358 Cb -0.15 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.57 1ofr h ALA 358 CO -0.08 -0.43 -0.35 0.00 0.00 0.00 0.00 179.25 178.39 1ofr h ALA 359 N 0.80 -0.32 -0.73 0.00 0.00 -0.53 0.47 119.26 118.94 1ofr h ALA 359 Ca -0.00 0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.14 1ofr h ALA 359 Cb 0.17 0.71 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1ofr h ALA 359 CO 0.00 -0.79 0.50 0.00 0.00 0.00 0.00 179.25 178.97 1ofr h ALA 360 N 0.54 2.33 -0.03 0.00 0.00 -0.80 0.35 119.26 121.65 1ofr h ALA 360 Ca 0.13 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1ofr h ALA 360 Cb 0.56 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ofr h ALA 360 CO -0.47 -0.53 -0.52 0.28 0.00 0.00 0.00 179.25 178.00 1ofr h VAL 361 N 0.25 1.37 -0.12 0.00 2.07 -0.17 -1.87 116.25 117.79 1ofr h VAL 361 Ca 0.36 -1.79 -0.12 0.00 0.82 0.00 0.00 66.70 65.98 1ofr h VAL 361 Cb 1.05 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.74 1ofr h VAL 361 CO -0.08 0.52 -0.44 0.03 0.02 0.00 0.00 177.57 177.61 1ofr h ARG 362 N 0.06 0.29 0.03 1.57 3.08 0.43 -3.16 114.38 116.67 1ofr h ARG 362 Ca -0.00 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1ofr h ARG 362 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 1ofr h ARG 362 CO 0.07 0.68 -0.01 0.37 -1.07 0.00 0.00 179.97 180.01 1ofr h GLN 363 N 0.24 -0.04 0.00 0.04 5.75 -0.73 -2.96 115.11 117.41 1ofr h GLN 363 Ca 0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1ofr h GLN 363 Cb 0.88 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.43 1ofr h GLN 363 CO 0.07 0.35 0.30 -0.09 -2.65 0.00 0.00 178.83 176.81 1ofr h ARG 364 N -0.43 0.00 0.12 1.69 2.43 -1.33 -2.35 114.38 114.51 1ofr h ARG 364 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1ofr h ARG 364 Cb 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1ofr h ARG 364 CO 0.01 0.00 -0.06 0.00 -1.51 0.00 0.00 179.97 178.41 1ofr h ARG 365 N 0.00 -0.16 -0.28 0.20 3.08 -1.52 -2.91 114.38 112.80 1ofr h ARG 365 Ca 0.00 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1ofr h ARG 365 Cb 0.61 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1ofr h ARG 365 CO 0.00 0.28 -0.04 0.93 -1.07 0.00 0.00 179.97 180.07 1ofr h GLU 366 N -0.67 0.53 -1.35 0.04 3.07 -1.56 -2.12 114.58 112.52 1ofr h GLU 366 Ca -0.02 -0.19 0.39 0.00 -0.50 0.00 0.00 59.36 59.04 1ofr h GLU 366 Cb 0.51 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 28.33 1ofr h GLU 366 CO 0.03 0.72 1.04 0.28 -1.40 0.00 0.00 179.01 179.68 1ofr h VAL 367 N 0.30 0.23 -1.76 3.13 2.07 -1.50 -1.77 116.25 116.95 1ofr h VAL 367 Ca 0.08 0.00 -0.77 0.00 0.82 0.00 0.00 66.70 66.82 1ofr h VAL 367 Cb 0.51 0.26 -0.19 0.00 -1.52 0.00 0.00 31.29 30.34 1ofr h VAL 367 CO 0.02 0.00 1.74 0.59 0.02 0.00 0.00 177.57 179.94 1ofr n ASN 368 N -3.95 6.89 -3.52 0.57 3.02 -0.80 -4.85 115.26 112.62 1ofr n ASN 368 Ca 0.30 -3.30 -0.12 0.00 -0.03 0.00 0.00 54.58 51.42 1ofr n ASN 368 Cb 1.47 -1.33 -0.04 0.00 -0.61 0.00 0.00 39.78 39.27 1ofr n ASN 368 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ofr s LYS 369 N -1.76 0.88 0.00 3.52 1.02 -0.67 -5.01 119.74 117.72 1ofr s LYS 369 Ca 0.43 -0.03 0.00 0.00 0.02 0.00 0.00 55.97 56.39 1ofr s LYS 369 Cb 0.14 0.41 0.00 0.00 -0.52 0.00 0.00 37.83 37.86 1ofr s LYS 369 CO -0.04 -0.32 0.00 1.17 -0.92 0.00 0.00 175.35 175.24