#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ofr s ALA 19 N 0.00 -0.48 -0.03 4.61 0.00 -1.26 -5.13 121.76 119.47 1ofr s ALA 19 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.79 1ofr s ALA 19 Cb 0.00 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.51 1ofr s ALA 19 CO 0.00 -1.42 1.33 -1.21 0.00 0.00 0.00 175.76 174.47 1ofr s GLU 20 N 2.37 4.30 0.09 0.00 2.02 -1.26 -5.00 118.70 121.23 1ofr s GLU 20 Ca 0.09 1.86 -0.24 0.00 0.02 0.00 0.00 54.97 56.70 1ofr s GLU 20 Cb -0.15 -3.59 0.06 0.00 0.10 0.00 0.00 34.13 30.55 1ofr s GLU 20 CO -0.21 -0.55 0.58 -1.21 0.02 0.00 0.00 175.26 173.89 1ofr s GLU 21 N 2.45 1.16 -1.08 1.61 0.41 -1.26 -4.96 118.70 117.03 1ofr s GLU 21 Ca 0.61 -0.28 -0.11 0.00 -0.41 0.00 0.00 54.97 54.78 1ofr s GLU 21 Cb -0.29 0.53 0.10 0.00 -1.78 0.00 0.00 34.13 32.70 1ofr s GLU 21 CO 0.24 -0.46 0.36 -0.25 -0.49 0.00 0.00 175.26 174.67 1ofr n ASP 22 N 0.09 -2.34 0.20 -0.19 8.00 -1.26 -4.81 116.55 116.25 1ofr n ASP 22 Ca -0.18 -0.37 0.08 0.00 0.71 0.00 0.00 54.79 55.03 1ofr n ASP 22 Cb 0.62 -2.01 0.32 0.00 -0.02 0.00 0.00 41.12 40.02 1ofr n ASP 22 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1ofr h VAL 23 N -0.62 0.63 -0.44 2.53 -1.51 -2.00 -2.96 116.25 111.88 1ofr h VAL 23 Ca -0.35 -1.43 0.00 0.00 -1.23 0.00 0.00 66.70 63.69 1ofr h VAL 23 Cb 1.23 1.97 0.00 0.00 -2.13 0.00 0.00 31.29 32.36 1ofr h VAL 23 CO 0.48 0.29 0.00 0.54 -1.23 0.00 0.00 177.57 177.65 1ofr n ARG 24 N -3.34 2.97 -3.59 5.19 1.74 -1.26 -4.87 116.66 113.51 1ofr n ARG 24 Ca 0.01 -2.37 -0.41 0.00 -0.77 0.00 0.00 57.85 54.31 1ofr n ARG 24 Cb 0.52 -1.48 -0.10 0.00 -1.02 0.00 0.00 32.46 30.38 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 -1.37 4.39 -0.34 0.55 -1.09 -1.12 -4.97 121.20 117.25 1ofr s ILE 25 Ca 0.34 -1.19 0.27 0.00 -2.23 0.00 0.00 60.65 57.84 1ofr s ILE 25 Cb 0.20 -3.60 0.29 0.00 -1.58 0.00 0.00 42.46 37.78 1ofr s ILE 25 CO 0.19 -0.41 1.79 -0.07 -1.23 0.00 0.00 174.94 175.21 1ofr h LEU 26 N 8.43 0.00 0.00 2.97 3.38 -1.89 -3.48 115.31 124.72 1ofr h LEU 26 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1ofr h LEU 26 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1ofr h LEU 26 CO 0.73 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.87 1ofr n GLY 27 N 0.15 3.69 3.43 0.83 0.00 -1.26 -5.12 105.19 106.92 1ofr n GLY 27 Ca 0.02 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.47 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 2.91 0.09 1.61 1.51 -1.26 -5.12 117.35 115.09 1ofr s TYR 28 Ca 0.00 -0.48 0.03 0.00 -1.01 0.00 0.00 57.07 55.61 1ofr s TYR 28 Cb 0.00 -1.90 -0.04 0.00 -0.11 0.00 0.00 41.96 39.91 1ofr s TYR 28 CO 0.00 -0.13 0.12 -0.51 -1.11 0.00 0.00 175.55 173.92 1ofr s ASP 29 N 0.35 5.71 0.42 2.29 1.01 -1.26 -5.07 116.67 120.12 1ofr s ASP 29 Ca -0.08 0.04 -0.25 0.00 0.71 0.00 0.00 52.55 52.96 1ofr s ASP 29 Cb -0.15 -1.58 -0.08 0.00 1.01 0.00 0.00 42.92 42.11 1ofr s ASP 29 CO 0.04 0.16 1.29 -2.16 0.21 0.00 0.00 175.17 174.71 1ofr s PRO 30 N -2.52 3.90 -0.18 8.23 0.04 -1.26 -5.02 135.00 138.20 1ofr s PRO 30 Ca 0.31 2.12 -0.00 0.00 0.04 0.00 0.00 61.00 63.46 1ofr s PRO 30 Cb -0.12 -2.69 0.04 0.00 0.04 0.00 0.00 34.50 31.77 1ofr s PRO 30 CO 0.23 -0.53 -0.05 -1.17 0.04 0.00 0.00 177.00 175.52 1ofr s LEU 31 N -2.55 1.76 0.19 -3.56 2.96 -1.26 -4.94 118.68 111.29 1ofr s LEU 31 Ca 0.58 -0.75 -0.32 0.00 -0.22 0.00 0.00 54.13 53.41 1ofr s LEU 31 Cb -0.37 -0.95 -0.15 0.00 0.50 0.00 0.00 46.19 45.22 1ofr s LEU 31 CO 0.47 -0.19 1.31 0.00 -1.32 0.00 0.00 176.35 176.62 1ofr n ALA 32 N 4.84 0.19 -1.51 5.97 0.00 -1.26 -4.94 120.51 123.80 1ofr n ALA 32 Ca -0.12 0.44 -0.29 0.00 0.00 0.00 0.00 53.44 53.47 1ofr n ALA 32 Cb 0.47 -2.16 0.12 0.00 0.00 0.00 0.00 19.45 17.88 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 0.23 3.86 0.07 0.00 1.04 -1.26 -4.83 113.70 112.81 1ofr s SER 33 Ca 0.72 1.13 -0.35 0.00 0.48 0.00 0.00 55.95 57.94 1ofr s SER 33 Cb -0.76 -1.78 -0.19 0.00 0.10 0.00 0.00 66.02 63.39 1ofr s SER 33 CO 0.50 -2.35 1.60 -0.65 0.98 0.00 0.00 173.24 173.32 1ofr h PRO 34 N -1.35 -1.02 -1.00 4.02 0.11 -1.82 -0.79 132.00 130.14 1ofr h PRO 34 Ca -0.49 0.07 0.27 0.00 0.11 0.00 0.00 66.00 65.96 1ofr h PRO 34 Cb 1.30 0.23 -0.13 0.00 0.11 0.00 0.00 31.00 32.51 1ofr h PRO 34 CO 0.60 -0.68 0.57 0.00 -0.21 0.00 0.00 178.00 178.28 1ofr h ALA 35 N -0.85 1.82 -0.09 -0.75 0.00 -0.88 0.39 119.26 118.90 1ofr h ALA 35 Ca -0.10 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1ofr h ALA 35 Cb 0.84 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ofr h ALA 35 CO 0.12 -0.38 -0.00 1.25 0.00 0.00 0.00 179.25 180.24 1ofr h LEU 36 N 0.48 0.17 -0.71 0.00 5.85 -1.69 -2.94 115.31 116.48 1ofr h LEU 36 Ca 0.67 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 59.05 1ofr h LEU 36 Cb 1.37 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 1ofr h LEU 36 CO -0.53 0.45 0.37 0.25 -0.34 0.00 0.00 178.44 178.64 1ofr h LEU 37 N -0.12 0.90 -1.99 2.25 7.12 0.73 -1.79 115.31 122.41 1ofr h LEU 37 Ca 0.03 -0.11 0.00 0.00 0.13 0.00 0.00 57.88 57.92 1ofr h LEU 37 Cb 0.37 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.27 1ofr h LEU 37 CO 0.01 0.76 0.00 1.56 -0.13 0.00 0.00 178.44 180.63 1ofr h GLN 38 N 0.98 0.00 0.05 1.25 4.20 -0.33 -0.48 115.11 120.78 1ofr h GLN 38 Ca 0.25 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.60 1ofr h GLN 38 Cb 0.07 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 1ofr h GLN 38 CO -0.04 0.00 -2.01 0.28 -0.67 0.00 0.00 178.83 176.40 1ofr n VAL 39 N -2.69 1.61 0.09 -0.54 0.31 -0.85 -3.48 118.33 112.78 1ofr n VAL 39 Ca -0.01 -0.43 0.03 0.00 -0.01 0.00 0.00 64.34 63.92 1ofr n VAL 39 Cb 0.10 -1.77 0.42 0.00 -0.91 0.00 0.00 33.84 31.68 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 0.33 -2.54 5.55 4.20 -0.83 -3.25 115.11 118.16 1ofr h GLN 40 Ca -0.49 -0.05 -0.60 0.00 0.06 0.00 0.00 58.65 57.57 1ofr h GLN 40 Cb 1.75 -0.06 -0.40 0.00 0.30 0.00 0.00 27.48 29.07 1ofr h GLN 40 CO -0.12 0.35 -0.80 -0.89 -0.67 0.00 0.00 178.83 176.71 1ofr n ILE 41 N -4.37 0.38 -1.86 2.54 5.41 -0.23 -5.10 119.36 116.13 1ofr n ILE 41 Ca 0.00 -4.28 -0.34 0.00 1.00 0.00 0.00 62.75 59.13 1ofr n ILE 41 Cb 0.18 -1.95 0.04 0.00 -0.71 0.00 0.00 39.64 37.21 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 -1.03 2.84 -0.17 0.38 0.04 -1.23 -4.61 135.00 131.22 1ofr s PRO 42 Ca 0.31 1.58 -0.19 0.00 0.04 0.00 0.00 61.00 62.74 1ofr s PRO 42 Cb 0.05 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.61 1ofr s PRO 42 CO -0.15 -1.25 0.52 0.00 0.04 0.00 0.00 177.00 176.16 1ofr s ALA 43 N -2.02 3.52 0.81 8.56 0.00 -1.26 -5.03 121.76 126.33 1ofr s ALA 43 Ca 0.71 -0.32 -0.10 0.00 0.00 0.00 0.00 51.96 52.25 1ofr s ALA 43 Cb -0.24 -2.78 0.08 0.00 0.00 0.00 0.00 23.12 20.17 1ofr s ALA 43 CO 0.37 -0.32 1.10 0.95 0.00 0.00 0.00 175.76 177.87 1ofr s THR 44 N 1.35 3.00 0.48 0.00 -4.23 -1.26 -4.80 115.64 110.19 1ofr s THR 44 Ca 0.25 0.33 0.14 0.00 -1.18 0.00 0.00 61.69 61.23 1ofr s THR 44 Cb -0.15 -2.70 0.25 0.00 1.34 0.00 0.00 72.50 71.24 1ofr s THR 44 CO 0.10 -0.43 2.09 -0.65 -0.54 0.00 0.00 174.62 175.20 1ofr h PRO 45 N -1.32 0.09 -0.11 3.99 0.11 -1.99 -1.59 132.00 131.17 1ofr h PRO 45 Ca -0.43 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1ofr h PRO 45 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ofr h PRO 45 CO 0.49 0.11 -0.07 1.15 -0.21 0.00 0.00 178.00 179.47 1ofr h THR 46 N 0.09 1.33 -0.26 -1.15 2.02 -1.92 -2.11 112.91 110.92 1ofr h THR 46 Ca 0.02 -1.15 0.05 0.00 0.77 0.00 0.00 66.41 66.11 1ofr h THR 46 Cb 0.08 1.85 -0.05 0.00 -1.74 0.00 0.00 68.15 68.29 1ofr h THR 46 CO 0.00 0.33 -0.03 0.28 0.37 0.00 0.00 175.52 176.47 1ofr h SER 47 N -0.12 -0.18 0.25 4.18 0.02 -1.47 0.35 113.55 116.59 1ofr h SER 47 Ca 0.02 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1ofr h SER 47 Cb 0.55 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 1ofr h SER 47 CO 0.02 -0.06 -0.17 -0.07 -1.14 0.00 0.00 176.83 175.41 1ofr h LEU 48 N 0.04 0.00 -0.03 5.07 3.38 -1.32 -2.15 115.31 120.30 1ofr h LEU 48 Ca 0.12 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 1ofr h LEU 48 Cb 0.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.93 1ofr h LEU 48 CO -0.24 0.17 -0.31 -0.08 0.09 0.00 0.00 178.44 178.07 1ofr h GLU 49 N 0.00 0.26 -0.83 1.13 4.57 -0.53 -2.84 114.58 116.34 1ofr h GLU 49 Ca -0.00 -0.24 0.09 0.00 -1.18 0.00 0.00 59.36 58.03 1ofr h GLU 49 Cb 0.35 0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.92 1ofr h GLU 49 CO 0.02 0.93 0.48 1.15 -1.18 0.00 0.00 179.01 180.41 1ofr h THR 50 N -0.32 0.92 -0.62 0.32 2.02 -0.74 -0.50 112.91 113.99 1ofr h THR 50 Ca -0.03 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 1ofr h THR 50 Cb 1.02 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.44 1ofr h THR 50 CO 0.06 0.15 0.17 0.00 0.37 0.00 0.00 175.52 176.27 1ofr h ALA 51 N 1.46 0.82 -0.20 6.16 0.00 -1.42 -1.67 119.26 124.40 1ofr h ALA 51 Ca 0.40 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1ofr h ALA 51 Cb 0.36 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ofr h ALA 51 CO -0.24 0.52 -0.44 0.87 0.00 0.00 0.00 179.25 179.96 1ofr h LYS 52 N 0.91 0.49 0.22 0.00 1.57 -1.12 -2.54 116.57 116.10 1ofr h LYS 52 Ca 0.20 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1ofr h LYS 52 Cb 0.34 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1ofr h LYS 52 CO -0.00 0.84 -0.11 -0.09 -0.57 0.00 0.00 179.45 179.52 1ofr h ARG 53 N 0.40 -0.28 -0.87 3.15 2.43 -0.93 -2.47 114.38 115.81 1ofr h ARG 53 Ca 0.03 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.38 1ofr h ARG 53 Cb 0.93 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 30.45 1ofr h ARG 53 CO 0.08 -0.01 0.43 0.78 -1.51 0.00 0.00 179.97 179.75 1ofr h GLY 54 N -0.55 1.43 1.48 2.80 0.00 -1.28 0.11 103.07 107.06 1ofr h GLY 54 Ca -0.03 -0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.00 1ofr h GLY 54 CO 0.05 -0.09 -0.02 3.21 0.00 0.00 0.00 176.54 179.69 1ofr h ARG 55 N 0.58 0.64 0.18 4.80 3.08 -1.34 -0.02 114.38 122.30 1ofr h ARG 55 Ca 0.49 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.37 1ofr h ARG 55 Cb 0.76 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1ofr h ARG 55 CO -0.40 0.68 -0.09 0.00 -1.07 0.00 0.00 179.97 179.09 1ofr h ARG 56 N 0.60 -0.24 -0.11 0.04 3.08 -0.37 -1.58 114.38 115.80 1ofr h ARG 56 Ca 0.12 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.22 1ofr h ARG 56 Cb 0.41 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 1ofr h ARG 56 CO 0.02 0.11 -0.07 0.93 -1.07 0.00 0.00 179.97 179.89 1ofr h GLU 57 N -0.63 -0.07 -0.79 0.04 5.08 -1.06 -0.62 114.58 116.53 1ofr h GLU 57 Ca -0.03 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.42 1ofr h GLU 57 Cb 0.46 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 1ofr h GLU 57 CO 0.04 -0.04 0.45 0.00 -1.00 0.00 0.00 179.01 178.46 1ofr h ALA 58 N 1.03 1.11 -0.47 3.43 0.00 -1.04 -1.32 119.26 121.99 1ofr h ALA 58 Ca 0.07 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ofr h ALA 58 Cb 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ofr h ALA 58 CO -0.15 0.10 0.11 0.82 0.00 0.00 0.00 179.25 180.12 1ofr h ILE 59 N 0.78 1.24 -0.50 0.00 2.04 -0.64 -1.98 117.51 118.46 1ofr h ILE 59 Ca 0.37 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 1ofr h ILE 59 Cb 0.31 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1ofr h ILE 59 CO -0.23 0.30 0.19 0.44 0.00 0.00 0.00 178.15 178.86 1ofr h ASP 60 N 0.65 0.69 -0.10 1.72 3.32 -0.58 -1.98 116.42 120.14 1ofr h ASP 60 Ca 0.15 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1ofr h ASP 60 Cb 0.34 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 1ofr h ASP 60 CO 0.00 0.68 0.03 0.40 -1.72 0.00 0.00 179.24 178.63 1ofr h ILE 61 N 0.66 1.17 0.00 0.35 2.04 -1.18 0.32 117.51 120.87 1ofr h ILE 61 Ca 0.17 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.52 1ofr h ILE 61 Cb 0.20 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1ofr h ILE 61 CO -0.01 0.15 0.00 0.16 0.00 0.00 0.00 178.15 178.44 1ofr h ILE 62 N -0.02 0.00 -0.02 -0.67 3.07 -1.34 -3.00 117.51 115.53 1ofr h ILE 62 Ca 0.03 -0.55 0.00 0.00 1.55 0.00 0.00 64.86 65.89 1ofr h ILE 62 Cb 0.20 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.24 1ofr h ILE 62 CO -0.00 0.00 -0.13 0.35 -1.05 0.00 0.00 178.15 177.32 1ofr n THR 63 N -2.81 0.00 -0.44 0.16 -2.24 -0.75 -1.30 114.28 106.90 1ofr n THR 63 Ca 0.02 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1ofr n THR 63 Cb 0.35 0.97 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 0.72 0.16 3.38 0.00 -0.97 -4.94 105.19 104.85 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 -4.95 1.61 1.57 -1.20 -3.44 116.57 114.24 1ofr h LYS 65 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 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 -0.80 0.34 -0.57 0.00 0.00 179.45 178.42 1ofr s ASP 66 N -5.12 1.53 0.00 0.86 2.15 -0.93 -4.95 116.67 110.21 1ofr s ASP 66 Ca 0.08 -0.24 0.28 0.00 0.43 0.00 0.00 52.55 53.10 1ofr s ASP 66 Cb 0.09 -0.33 1.51 0.00 -0.30 0.00 0.00 42.92 43.89 1ofr s ASP 66 CO 0.59 0.12 1.99 -0.90 -0.17 0.00 0.00 175.17 176.80 1ofr n ASP 67 N 3.07 0.40 -4.31 -0.34 5.68 -1.26 -4.51 116.55 115.28 1ofr n ASP 67 Ca -0.17 -1.23 -0.30 0.00 -0.50 0.00 0.00 54.79 52.60 1ofr n ASP 67 Cb 0.54 -0.01 0.17 0.00 -1.14 0.00 0.00 41.12 40.68 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 -1.99 0.75 -0.12 0.11 0.52 -1.26 -4.95 118.95 112.01 1ofr s ARG 68 Ca 0.41 -0.21 0.01 0.00 -0.52 0.00 0.00 55.73 55.42 1ofr s ARG 68 Cb 0.20 -1.84 -0.01 0.00 0.52 0.00 0.00 34.95 33.82 1ofr s ARG 68 CO 0.33 -2.37 -0.15 0.08 0.02 0.00 0.00 175.30 173.20 1ofr s VAL 69 N -3.68 2.83 -0.07 3.52 1.01 -0.38 -4.91 120.40 118.72 1ofr s VAL 69 Ca 0.70 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 1ofr s VAL 69 Cb -0.07 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 1ofr s VAL 69 CO 0.53 0.53 1.12 -0.22 0.00 0.00 0.00 175.10 177.06 1ofr s LEU 70 N 0.35 4.27 -0.25 3.92 2.96 -0.40 -1.15 118.68 128.37 1ofr s LEU 70 Ca -0.13 1.71 0.01 0.00 -0.22 0.00 0.00 54.13 55.50 1ofr s LEU 70 Cb -0.16 -3.56 0.07 0.00 0.50 0.00 0.00 46.19 43.03 1ofr s LEU 70 CO 0.06 -0.53 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.83 1ofr s VAL 71 N 2.11 1.67 -0.61 1.68 1.01 -0.70 -1.20 120.40 124.37 1ofr s VAL 71 Ca 0.53 -1.41 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 1ofr s VAL 71 Cb -0.22 -1.96 0.10 0.00 0.00 0.00 0.00 36.38 34.30 1ofr s VAL 71 CO 0.20 -0.17 0.73 -0.63 0.00 0.00 0.00 175.10 175.24 1ofr s ILE 72 N 1.31 4.78 0.02 2.22 -1.09 -0.81 -0.90 121.20 126.73 1ofr s ILE 72 Ca -0.04 -0.97 0.06 0.00 -2.23 0.00 0.00 60.65 57.47 1ofr s ILE 72 Cb -0.19 -4.51 -0.02 0.00 -1.58 0.00 0.00 42.46 36.16 1ofr s ILE 72 CO -0.07 -1.16 -0.17 0.54 -1.23 0.00 0.00 174.94 172.84 1ofr s VAL 73 N 2.78 1.37 0.00 2.92 0.11 -0.31 -1.97 120.40 125.31 1ofr s VAL 73 Ca 0.13 -0.94 0.00 0.00 -2.93 0.00 0.00 61.98 58.24 1ofr s VAL 73 Cb -0.23 -1.18 0.00 0.00 -1.53 0.00 0.00 36.38 33.43 1ofr s VAL 73 CO 0.06 0.23 0.00 0.61 -3.33 0.00 0.00 175.10 172.67 1ofr n GLY 74 N 2.21 0.45 3.18 6.54 0.00 -1.07 -1.89 105.19 114.62 1ofr n GLY 74 Ca -0.16 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.09 -0.12 0.01 1.61 -0.02 0.20 -2.38 135.00 133.21 1ofr n PRO 75 Ca 0.00 -0.02 -0.05 0.00 -2.02 0.00 0.00 63.50 61.41 1ofr n PRO 75 Cb 0.00 -1.37 0.14 0.00 -0.02 0.00 0.00 33.50 32.25 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 -0.44 -0.01 0.00 1.04 -1.26 -4.70 113.70 101.48 1ofr s SER 77 Ca -0.07 0.84 -0.19 0.00 0.48 0.00 0.00 55.95 57.01 1ofr s SER 77 Cb 0.13 0.85 -0.05 0.00 0.10 0.00 0.00 66.02 67.04 1ofr s SER 77 CO 0.81 -0.16 0.55 -0.63 0.98 0.00 0.00 173.24 174.79 1ofr s ILE 78 N 0.17 4.93 0.00 -1.02 -1.09 0.30 -4.79 121.20 119.70 1ofr s ILE 78 Ca 0.03 1.15 0.00 0.00 -2.23 0.00 0.00 60.65 59.60 1ofr s ILE 78 Cb -0.05 -3.88 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 1ofr s ILE 78 CO -0.06 0.45 0.01 0.00 -1.23 0.00 0.00 174.94 174.11 1ofr n HIS 79 N 2.56 0.00 -3.83 3.97 1.44 -1.26 -4.43 115.22 113.67 1ofr n HIS 79 Ca -0.08 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.33 1ofr n HIS 79 Cb 0.51 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.46 1ofr n HIS 79 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1ofr s ASP 80 N -0.13 3.65 0.50 4.39 -1.08 -1.26 -4.97 116.67 117.77 1ofr s ASP 80 Ca 0.00 -1.23 0.27 0.00 -0.52 0.00 0.00 52.55 51.06 1ofr s ASP 80 Cb 0.00 -0.93 1.34 0.00 -1.46 0.00 0.00 42.92 41.86 1ofr s ASP 80 CO 0.00 -0.31 2.02 -0.07 0.52 0.00 0.00 175.17 177.33 1ofr h LEU 81 N 8.06 0.00 0.20 -1.34 4.07 -1.98 -1.53 115.31 122.79 1ofr h LEU 81 Ca -0.15 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.80 1ofr h LEU 81 Cb 1.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.81 1ofr h LEU 81 CO 0.41 0.14 -0.09 -0.33 -1.08 0.00 0.00 178.44 177.49 1ofr h GLU 82 N 0.00 -0.26 -0.81 1.13 3.07 -1.99 -2.73 114.58 112.99 1ofr h GLU 82 Ca -0.00 0.02 0.06 0.00 -0.50 0.00 0.00 59.36 58.94 1ofr h GLU 82 Cb 0.43 0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.34 1ofr h GLU 82 CO 0.02 0.07 0.53 0.00 -1.40 0.00 0.00 179.01 178.23 1ofr h ALA 83 N -0.62 1.61 0.00 3.43 0.00 -1.99 0.47 119.26 122.16 1ofr h ALA 83 Ca -0.03 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1ofr h ALA 83 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ofr h ALA 83 CO 0.04 0.27 -0.29 0.00 0.00 0.00 0.00 179.25 179.28 1ofr h ALA 84 N 1.56 1.40 0.05 0.00 0.00 -1.36 -1.88 119.26 119.03 1ofr h ALA 84 Ca 0.35 -0.26 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 1ofr h ALA 84 Cb 0.22 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1ofr h ALA 84 CO -0.12 0.36 -1.08 0.37 0.00 0.00 0.00 179.25 178.78 1ofr h GLN 85 N 0.00 0.46 0.09 0.00 5.75 -0.61 -2.32 115.11 118.48 1ofr h GLN 85 Ca -0.00 -0.57 -0.00 0.00 -0.15 0.00 0.00 58.65 57.93 1ofr h GLN 85 Cb 0.55 0.18 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1ofr h GLN 85 CO 0.04 1.21 -0.04 1.49 -2.65 0.00 0.00 178.83 178.87 1ofr h GLU 86 N 0.23 -0.12 -0.59 1.69 4.81 -0.97 -2.30 114.58 117.32 1ofr h GLU 86 Ca -0.12 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.19 1ofr h GLU 86 Cb 1.74 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 31.08 1ofr h GLU 86 CO 0.19 0.04 0.26 -0.92 -0.73 0.00 0.00 179.01 177.85 1ofr h TYR 87 N -0.25 0.46 -0.81 0.92 5.03 -1.41 -1.74 116.97 119.18 1ofr h TYR 87 Ca -0.01 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.37 1ofr h TYR 87 Cb 0.21 -0.12 -0.05 0.00 1.55 0.00 0.00 36.73 38.32 1ofr h TYR 87 CO -0.03 0.17 0.53 0.00 -1.32 0.00 0.00 178.16 177.51 1ofr h ALA 88 N 1.37 1.55 0.14 1.82 0.00 -1.19 -0.51 119.26 122.44 1ofr h ALA 88 Ca 0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1ofr h ALA 88 Cb 0.29 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ofr h ALA 88 CO -0.25 0.36 -0.07 -0.07 0.00 0.00 0.00 179.25 179.22 1ofr h LEU 89 N 0.96 -0.16 0.34 0.00 -0.00 -0.75 0.67 115.31 116.36 1ofr h LEU 89 Ca 0.33 -0.08 -0.00 0.00 -0.00 0.00 0.00 57.88 58.14 1ofr h LEU 89 Cb 0.11 0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 1ofr h LEU 89 CO -0.11 -0.03 -0.42 0.03 -0.00 0.00 0.00 178.44 177.92 1ofr h ARG 90 N -0.29 -0.77 -0.24 1.13 3.08 -1.10 -1.36 114.38 114.83 1ofr h ARG 90 Ca -0.02 0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.15 1ofr h ARG 90 Cb 0.23 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1ofr h ARG 90 CO 0.03 -0.51 0.25 1.25 -1.07 0.00 0.00 179.97 179.92 1ofr h LEU 91 N -0.80 0.00 0.15 3.04 5.85 -1.04 -2.02 115.31 120.50 1ofr h LEU 91 Ca -0.02 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1ofr h LEU 91 Cb 0.73 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.76 1ofr h LEU 91 CO -0.11 0.00 -0.07 0.50 -0.34 0.00 0.00 178.44 178.42 1ofr h LYS 92 N 0.00 -0.19 -0.13 1.25 1.63 0.18 -1.87 116.57 117.44 1ofr h LYS 92 Ca 0.12 0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.96 1ofr h LYS 92 Cb 0.62 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 32.23 1ofr h LYS 92 CO -0.00 0.25 -0.54 -0.22 -3.45 0.00 0.00 179.45 175.50 1ofr h LYS 93 N -0.82 -0.56 -0.32 1.90 3.64 -0.59 -2.21 116.57 117.60 1ofr h LYS 93 Ca -0.02 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1ofr h LYS 93 Cb 0.54 0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 32.41 1ofr h LYS 93 CO 0.03 -0.38 -0.23 1.25 -2.27 0.00 0.00 179.45 177.86 1ofr h LEU 94 N -0.59 -0.74 -1.99 5.20 6.46 -1.56 -0.74 115.31 121.35 1ofr h LEU 94 Ca 0.03 0.15 0.22 0.00 -0.12 0.00 0.00 57.88 58.16 1ofr h LEU 94 Cb 0.68 0.37 -0.03 0.00 -0.73 0.00 0.00 40.66 40.95 1ofr h LEU 94 CO -0.43 -0.26 0.56 -1.28 -0.62 0.00 0.00 178.44 176.41 1ofr h SER 95 N -0.19 0.00 -0.02 1.25 0.87 -0.75 0.13 113.55 114.84 1ofr h SER 95 Ca 0.16 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1ofr h SER 95 Cb 0.45 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1ofr h SER 95 CO -0.43 0.00 0.00 0.44 -0.53 0.00 0.00 176.83 176.31 1ofr h ASP 96 N 0.00 0.03 0.18 6.23 3.32 -0.61 0.14 116.42 125.71 1ofr h ASP 96 Ca 0.35 -0.25 0.01 0.00 0.02 0.00 0.00 57.03 57.16 1ofr h ASP 96 Cb 1.46 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.96 1ofr h ASP 96 CO -0.00 0.27 -0.48 -0.08 -1.72 0.00 0.00 179.24 177.23 1ofr h GLU 97 N -0.22 -0.73 -0.08 3.56 4.81 -0.60 -2.71 114.58 118.62 1ofr h GLU 97 Ca 0.01 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1ofr h GLU 97 Cb 0.25 0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1ofr h GLU 97 CO 0.00 -0.48 0.00 1.28 -0.73 0.00 0.00 179.01 179.08 1ofr n LEU 98 N -5.49 0.46 0.00 1.64 4.77 -0.69 -4.40 117.00 113.29 1ofr n LEU 98 Ca -0.08 -0.22 0.02 0.00 -0.03 0.00 0.00 56.01 55.69 1ofr n LEU 98 Cb 0.41 -0.05 0.12 0.00 -2.33 0.00 0.00 43.42 41.56 1ofr n LEU 98 CO 0.19 0.11 0.31 2.29 -1.33 0.00 0.00 177.39 178.96 1ofr n LYS 99 N -0.30 0.17 0.00 3.23 2.85 0.03 -1.03 118.16 123.11 1ofr n LYS 99 Ca 0.05 0.00 0.10 0.00 -1.05 0.00 0.00 58.31 57.41 1ofr n LYS 99 Cb 0.09 -1.36 -0.09 0.00 -0.65 0.00 0.00 35.03 33.01 1ofr n LYS 99 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ofr n GLY 100 N -0.57 -0.73 1.33 2.58 0.00 -1.26 -4.69 105.19 101.84 1ofr n GLY 100 Ca 0.03 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.19 0.04 -4.94 1.61 8.00 -0.19 -4.89 116.55 114.98 1ofr n ASP 101 Ca 0.05 0.02 -0.26 0.00 0.71 0.00 0.00 54.79 55.31 1ofr n ASP 101 Cb 0.34 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 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 -5.75 4.27 -0.41 0.64 1.43 -0.31 -1.24 118.68 117.31 1ofr s LEU 102 Ca 0.00 0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 1ofr s LEU 102 Cb 0.00 -3.04 0.12 0.00 0.03 0.00 0.00 46.19 43.30 1ofr s LEU 102 CO 0.00 -0.03 0.19 -0.55 0.23 0.00 0.00 176.35 176.18 1ofr s SER 103 N -3.37 3.94 0.25 2.29 0.15 -0.30 -4.14 113.70 112.52 1ofr s SER 103 Ca 0.36 -2.38 -0.29 0.00 0.70 0.00 0.00 55.95 54.35 1ofr s SER 103 Cb -0.11 -1.13 -0.09 0.00 -1.71 0.00 0.00 66.02 62.98 1ofr s SER 103 CO 0.29 -0.31 0.93 -0.63 1.20 0.00 0.00 173.24 174.72 1ofr s ILE 104 N 0.65 4.12 -0.03 6.45 1.01 -1.26 -1.72 121.20 130.41 1ofr s ILE 104 Ca 0.15 2.02 0.00 0.00 0.00 0.00 0.00 60.65 62.82 1ofr s ILE 104 Cb -0.22 -4.26 0.03 0.00 0.01 0.00 0.00 42.46 38.01 1ofr s ILE 104 CO -0.07 0.44 -0.00 -0.63 0.00 0.00 0.00 174.94 174.68 1ofr s ILE 105 N -1.25 0.21 0.22 2.92 1.01 -0.08 -4.53 121.20 119.69 1ofr s ILE 105 Ca 0.42 0.08 -0.23 0.00 0.00 0.00 0.00 60.65 60.92 1ofr s ILE 105 Cb -0.24 -0.31 -0.08 0.00 0.01 0.00 0.00 42.46 41.84 1ofr s ILE 105 CO 0.30 0.16 0.78 -0.32 0.00 0.00 0.00 174.94 175.86 1ofr s MET 106 N 1.09 4.41 -0.43 2.79 -2.45 -0.04 -1.16 119.30 123.51 1ofr s MET 106 Ca -0.09 1.04 -0.27 0.00 -1.25 0.00 0.00 55.69 55.12 1ofr s MET 106 Cb -0.14 -3.00 0.02 0.00 1.25 0.00 0.00 34.83 32.97 1ofr s MET 106 CO -0.02 0.44 1.03 1.03 1.05 0.00 0.00 175.02 178.55 1ofr s ARG 107 N -1.70 3.73 -0.78 4.11 0.52 -0.79 -0.26 118.95 123.78 1ofr s ARG 107 Ca 0.42 0.51 -0.00 0.00 -0.52 0.00 0.00 55.73 56.13 1ofr s ARG 107 Cb -0.19 -3.87 0.19 0.00 0.52 0.00 0.00 34.95 31.60 1ofr s ARG 107 CO 0.23 -1.20 0.62 0.00 0.02 0.00 0.00 175.30 174.98 1ofr s ALA 108 N 3.97 3.97 -0.20 2.13 0.00 -0.35 -4.23 121.76 127.05 1ofr s ALA 108 Ca 0.43 -3.68 -0.07 0.00 0.00 0.00 0.00 51.96 48.63 1ofr s ALA 108 Cb -0.09 -2.64 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 1ofr s ALA 108 CO 0.26 -2.13 0.05 0.71 0.00 0.00 0.00 175.76 174.65 1ofr s TYR 109 N -1.03 3.15 -0.12 0.00 1.51 -1.26 -4.45 117.35 115.15 1ofr s TYR 109 Ca 0.24 -0.16 0.17 0.00 -1.01 0.00 0.00 57.07 56.32 1ofr s TYR 109 Cb -0.11 -2.12 -0.21 0.00 -0.11 0.00 0.00 41.96 39.41 1ofr s TYR 109 CO -0.11 -0.06 0.52 1.28 -1.11 0.00 0.00 175.55 176.08 1ofr n LEU 110 N 4.03 0.47 0.00 -1.29 7.99 -1.26 0.11 117.00 127.05 1ofr n LEU 110 Ca -0.16 0.21 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 1ofr n LEU 110 Cb 0.52 0.21 0.00 0.00 -0.11 0.00 0.00 43.42 44.04 1ofr n LEU 110 CO 0.33 0.27 0.00 -0.62 -1.51 0.00 0.00 177.39 175.86 1ofr n GLU 111 N -2.78 3.84 0.00 3.23 1.02 -1.26 -0.39 120.64 124.30 1ofr n GLU 111 Ca -0.17 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.97 1ofr n GLU 111 Cb 0.93 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.35 1ofr n GLU 111 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1ofr n LYS 112 N 0.00 0.00 -1.06 3.49 0.00 -1.26 -4.69 118.16 114.65 1ofr n LYS 112 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 58.31 57.81 1ofr n LYS 112 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 34.93 1ofr n LYS 112 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 1ofr n PRO 113 N 0.00 0.00 -3.18 1.64 -0.02 -1.26 -4.97 135.00 127.20 1ofr n PRO 113 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.28 1ofr n PRO 113 Cb 0.00 -1.22 0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1ofr n PRO 113 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ofr s ARG 114 N 4.65 3.02 0.01 -0.52 0.52 -1.26 -5.03 118.95 120.35 1ofr s ARG 114 Ca 0.97 -0.84 -0.29 0.00 -0.52 0.00 0.00 55.73 55.05 1ofr s ARG 114 Cb -1.22 -2.70 0.10 0.00 0.52 0.00 0.00 34.95 31.65 1ofr s ARG 114 CO 0.55 -0.16 0.98 0.14 0.02 0.00 0.00 175.30 176.84 1ofr s VAL 117 N -2.38 0.00 0.00 3.52 -7.23 -1.26 -5.19 120.40 107.86 1ofr s VAL 117 Ca 0.48 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.45 1ofr s VAL 117 Cb -0.10 -1.37 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1ofr s VAL 117 CO 0.34 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.74 1ofr n GLY 118 N -0.31 5.55 2.98 2.32 0.00 -1.26 -5.10 105.19 109.37 1ofr n GLY 118 Ca -0.07 -1.42 -0.55 0.00 0.00 0.00 0.00 46.02 43.98 1ofr n GLY 118 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1ofr n TRP 119 N 0.00 1.12 0.29 1.61 -0.00 -1.26 -4.81 117.44 114.38 1ofr n TRP 119 Ca 0.00 0.74 0.02 0.00 -0.00 0.00 0.00 57.50 58.26 1ofr n TRP 119 Cb 0.00 -2.05 0.13 0.00 -0.00 0.00 0.00 31.31 29.39 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 6.28 0.14 0.00 5.87 4.76 -1.26 -4.86 118.16 129.09 1ofr n LYS 120 Ca 0.46 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.90 1ofr n LYS 120 Cb -0.04 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 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 -0.69 -1.15 0.32 0.72 0.00 -1.26 -4.25 105.19 98.88 1ofr n GLY 121 Ca 0.03 -1.45 0.02 0.00 0.00 0.00 0.00 46.02 44.63 1ofr n GLY 121 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ofr n LEU 122 N -1.02 -0.42 0.32 0.99 7.94 0.47 0.21 117.00 125.50 1ofr n LEU 122 Ca 0.00 1.48 -0.16 0.00 -1.11 0.00 0.00 56.01 56.21 1ofr n LEU 122 Cb 0.00 -0.40 -0.08 0.00 0.53 0.00 0.00 43.42 43.47 1ofr n LEU 122 CO 0.00 -1.37 0.58 0.40 -1.11 0.00 0.00 177.39 175.89 1ofr h ILE 123 N 0.00 0.36 0.00 1.96 2.04 -1.77 -1.92 117.51 118.17 1ofr h ILE 123 Ca 0.36 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.97 1ofr h ILE 123 Cb 0.57 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1ofr h ILE 123 CO -0.86 0.02 -0.33 0.78 0.00 0.00 0.00 178.15 177.77 1ofr h ASN 124 N -0.93 0.00 -1.28 1.72 -0.26 -1.39 -3.33 115.58 110.11 1ofr h ASN 124 Ca -0.08 0.00 -0.41 0.00 -0.56 0.00 0.00 56.30 55.25 1ofr h ASN 124 Cb 0.66 0.00 -0.31 0.00 -1.06 0.00 0.00 38.32 37.62 1ofr h ASN 124 CO 0.14 0.33 -0.91 -0.67 -1.06 0.00 0.00 177.43 175.25 1ofr n ASP 125 N -4.10 -0.55 0.00 5.81 4.64 0.13 -2.87 116.55 119.61 1ofr n ASP 125 Ca -0.02 -3.13 0.00 0.00 -1.38 0.00 0.00 54.79 50.26 1ofr n ASP 125 Cb 0.37 0.29 0.00 0.00 -1.04 0.00 0.00 41.12 40.74 1ofr n ASP 125 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1ofr n PRO 126 N 0.75 0.00 -0.00 -0.67 -0.04 -0.73 -1.83 135.00 132.48 1ofr n PRO 126 Ca 0.18 0.29 0.06 0.00 -0.04 0.00 0.00 63.50 63.98 1ofr n PRO 126 Cb 0.63 -1.68 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 1ofr n PRO 126 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ofr n ASP 127 N -1.28 0.78 -3.31 3.54 8.00 -1.26 -5.00 116.55 118.02 1ofr n ASP 127 Ca 0.00 -0.68 -0.19 0.00 0.71 0.00 0.00 54.79 54.63 1ofr n ASP 127 Cb 0.18 1.07 0.08 0.00 -0.02 0.00 0.00 41.12 42.43 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 -1.37 -4.14 -0.25 2.53 0.31 -0.76 -4.67 118.33 109.98 1ofr n VAL 128 Ca 0.02 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1ofr n VAL 128 Cb 0.20 -4.30 0.00 0.00 -0.91 0.00 0.00 33.84 28.83 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 -2.83 1.60 -2.25 4.52 0.23 -1.26 -3.28 115.26 111.99 1ofr n ASN 129 Ca -0.13 -1.84 -0.16 0.00 -0.53 0.00 0.00 54.58 51.93 1ofr n ASN 129 Cb 0.61 -0.02 0.03 0.00 -2.08 0.00 0.00 39.78 38.32 1ofr n ASN 129 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1ofr n ASN 130 N -0.43 -4.82 -3.02 0.53 2.85 -1.26 -5.04 115.26 104.07 1ofr n ASN 130 Ca 0.01 -0.22 -0.13 0.00 -0.11 0.00 0.00 54.58 54.12 1ofr n ASN 130 Cb 0.32 -3.65 -0.03 0.00 1.24 0.00 0.00 39.78 37.65 1ofr n ASN 130 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1ofr n THR 131 N -4.16 0.00 -4.34 -0.44 -2.24 -1.26 -5.15 114.28 96.69 1ofr n THR 131 Ca -0.07 -1.01 -0.22 0.00 -2.27 0.00 0.00 64.05 60.48 1ofr n THR 131 Cb 0.58 0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.93 1ofr n THR 131 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1ofr s PHE 132 N -1.84 1.83 -0.35 4.78 2.99 -1.26 -4.38 117.98 119.76 1ofr s PHE 132 Ca 0.01 -0.47 0.04 0.00 0.00 0.00 0.00 56.93 56.52 1ofr s PHE 132 Cb 0.00 -0.91 0.18 0.00 0.00 0.00 0.00 43.02 42.29 1ofr s PHE 132 CO 0.01 0.34 1.17 -1.71 -0.00 0.00 0.00 175.22 175.02 1ofr n ASN 133 N 0.27 -1.42 -0.24 1.36 2.85 -1.14 -5.00 115.26 111.94 1ofr n ASN 133 Ca -0.13 -1.95 0.18 0.00 -0.11 0.00 0.00 54.58 52.58 1ofr n ASN 133 Cb 0.57 1.02 0.34 0.00 1.24 0.00 0.00 39.78 42.95 1ofr n ASN 133 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1ofr n ILE 134 N -0.52 -0.30 -0.12 -1.44 -0.00 -1.25 0.07 119.36 115.80 1ofr n ILE 134 Ca -0.18 1.52 -0.09 0.00 -0.00 0.00 0.00 62.75 64.00 1ofr n ILE 134 Cb 0.72 -2.37 -0.01 0.00 -0.00 0.00 0.00 39.64 37.99 1ofr n ILE 134 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.55 177.33 1ofr h ASN 135 N 0.00 0.44 0.68 4.38 2.35 -1.92 0.39 115.58 121.90 1ofr h ASN 135 Ca 0.55 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 56.13 1ofr h ASN 135 Cb 1.35 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 1ofr h ASN 135 CO -0.61 0.37 -0.51 0.50 -1.65 0.00 0.00 177.43 175.53 1ofr h LYS 136 N 0.48 0.00 -0.06 0.81 3.64 -0.70 -2.22 116.57 118.52 1ofr h LYS 136 Ca 0.13 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1ofr h LYS 136 Cb 0.01 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1ofr h LYS 136 CO -0.02 0.51 0.02 0.78 -2.27 0.00 0.00 179.45 178.46 1ofr h GLY 137 N 1.87 0.10 1.99 5.01 0.00 0.15 -0.71 103.07 111.48 1ofr h GLY 137 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 1ofr h GLY 137 CO 0.07 0.05 -0.18 1.41 0.00 0.00 0.00 176.54 177.89 1ofr h LEU 138 N -0.09 0.01 -0.22 3.11 3.38 -0.08 0.10 115.31 121.52 1ofr h LEU 138 Ca 0.02 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1ofr h LEU 138 Cb 0.20 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ofr h LEU 138 CO -0.00 0.19 -0.29 1.56 0.09 0.00 0.00 178.44 179.99 1ofr h GLN 139 N 0.01 0.59 -0.10 1.13 4.20 -1.01 -0.52 115.11 119.41 1ofr h GLN 139 Ca 0.00 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 1ofr h GLN 139 Cb 0.32 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 1ofr h GLN 139 CO 0.02 0.94 0.03 0.77 -0.67 0.00 0.00 178.83 179.92 1ofr h SER 140 N 0.28 0.14 0.03 1.46 0.02 -0.73 0.16 113.55 114.91 1ofr h SER 140 Ca 0.03 -0.20 0.01 0.00 -0.84 0.00 0.00 61.79 60.78 1ofr h SER 140 Cb 0.86 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 1ofr h SER 140 CO 0.07 0.30 -0.21 0.00 -1.14 0.00 0.00 176.83 175.85 1ofr h ALA 141 N 0.85 -0.71 -0.77 3.77 0.00 -0.75 0.23 119.26 121.87 1ofr h ALA 141 Ca 0.03 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1ofr h ALA 141 Cb 0.21 0.64 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 1ofr h ALA 141 CO -0.00 -0.77 0.41 -0.09 0.00 0.00 0.00 179.25 178.80 1ofr h ARG 142 N -0.28 0.65 -0.03 0.00 2.43 -1.06 -1.23 114.38 114.85 1ofr h ARG 142 Ca -0.00 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1ofr h ARG 142 Cb 0.29 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1ofr h ARG 142 CO -0.12 0.43 -0.08 0.37 -1.51 0.00 0.00 179.97 179.06 1ofr h GLN 143 N 0.67 -0.13 0.02 0.20 5.75 -0.28 -1.25 115.11 120.09 1ofr h GLN 143 Ca 0.38 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.91 1ofr h GLN 143 Cb 0.41 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.94 1ofr h GLN 143 CO -0.27 -0.08 -0.44 1.25 -2.65 0.00 0.00 178.83 176.64 1ofr h LEU 144 N -0.13 -1.34 -1.14 -2.39 5.85 0.31 0.17 115.31 116.64 1ofr h LEU 144 Ca 0.04 0.15 0.26 0.00 0.84 0.00 0.00 57.88 59.17 1ofr h LEU 144 Cb 0.19 0.51 -0.11 0.00 0.37 0.00 0.00 40.66 41.61 1ofr h LEU 144 CO -0.11 -0.43 0.63 -0.26 -0.34 0.00 0.00 178.44 177.92 1ofr h PHE 145 N -0.56 0.88 -0.17 1.25 -1.00 -1.09 0.52 116.94 116.77 1ofr h PHE 145 Ca 0.01 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.77 1ofr h PHE 145 Cb 0.59 -0.25 -0.00 0.00 3.61 0.00 0.00 35.95 39.90 1ofr h PHE 145 CO -0.48 0.06 -0.08 0.28 -1.61 0.00 0.00 178.31 176.48 1ofr h VAL 146 N 0.50 1.31 -0.54 -0.55 2.07 0.11 -1.73 116.25 117.42 1ofr h VAL 146 Ca 0.63 -1.11 0.08 0.00 0.82 0.00 0.00 66.70 67.12 1ofr h VAL 146 Cb 1.36 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 32.74 1ofr h VAL 146 CO -0.41 0.33 0.19 0.78 0.02 0.00 0.00 177.57 178.48 1ofr h ASN 147 N 0.04 0.18 0.52 0.57 2.35 0.14 0.47 115.58 119.85 1ofr h ASN 147 Ca 0.04 0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1ofr h ASN 147 Cb 0.55 0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.98 1ofr h ASN 147 CO 0.02 0.12 -0.25 -0.07 -1.65 0.00 0.00 177.43 175.61 1ofr h LEU 148 N 0.37 -0.59 -2.27 1.61 3.38 -1.13 -2.96 115.31 113.71 1ofr h LEU 148 Ca 0.26 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1ofr h LEU 148 Cb 0.30 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1ofr h LEU 148 CO -0.27 -0.22 0.00 0.71 0.09 0.00 0.00 178.44 178.75 1ofr h THR 149 N -1.03 0.00 0.00 0.22 1.35 -1.25 -1.70 112.91 110.50 1ofr h THR 149 Ca -0.07 -0.04 -0.07 0.00 -0.55 0.00 0.00 66.41 65.68 1ofr h THR 149 Cb 0.61 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 1ofr h THR 149 CO 0.12 0.00 -0.34 -1.13 -0.25 0.00 0.00 175.52 173.92 1ofr h ASN 150 N 0.00 0.00 -0.50 5.36 -1.24 -0.73 -2.66 115.58 115.81 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 0.34 0.00 2.30 -1.29 0.00 0.00 177.43 178.78 1ofr n ILE 151 N -3.46 2.21 -0.96 2.57 -5.35 -0.64 -4.70 119.36 109.03 1ofr n ILE 151 Ca 0.00 -1.16 0.00 0.00 -0.27 0.00 0.00 62.75 61.32 1ofr n ILE 151 Cb 0.50 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 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 0.62 0.48 3.39 3.28 0.00 -1.00 -5.03 105.19 106.94 1ofr n GLY 152 Ca 0.23 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1ofr n GLY 152 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ofr s LEU 153 N 0.00 4.19 0.80 0.99 2.96 -1.22 -4.96 118.68 121.44 1ofr s LEU 153 Ca 0.00 -0.70 -0.13 0.00 -0.22 0.00 0.00 54.13 53.08 1ofr s LEU 153 Cb 0.00 -1.97 0.08 0.00 0.50 0.00 0.00 46.19 44.80 1ofr s LEU 153 CO 0.00 -0.24 1.17 -2.84 -1.32 0.00 0.00 176.35 173.12 1ofr s PRO 154 N 1.56 1.78 0.12 0.98 0.02 -1.26 -3.64 135.00 134.56 1ofr s PRO 154 Ca 0.03 1.60 0.05 0.00 0.02 0.00 0.00 61.00 62.71 1ofr s PRO 154 Cb -0.18 -1.81 -0.04 0.00 0.02 0.00 0.00 34.50 32.50 1ofr s PRO 154 CO 0.05 -2.08 -0.12 0.96 -0.33 0.00 0.00 177.00 175.49 1ofr s ILE 155 N -2.34 1.18 0.07 2.83 -4.36 -1.26 -0.86 121.20 116.47 1ofr s ILE 155 Ca 0.70 -1.74 0.06 0.00 -0.26 0.00 0.00 60.65 59.40 1ofr s ILE 155 Cb -0.25 -1.52 -0.03 0.00 1.25 0.00 0.00 42.46 41.91 1ofr s ILE 155 CO 0.51 -0.51 -0.15 -0.83 0.24 0.00 0.00 174.94 174.19 1ofr s GLY 156 N -2.56 0.92 0.15 6.27 0.00 0.64 -1.51 107.32 111.24 1ofr s GLY 156 Ca 0.09 -1.03 -0.07 0.00 0.00 0.00 0.00 44.72 43.71 1ofr s GLY 156 CO 0.02 -1.04 0.23 -0.45 0.00 0.00 0.00 173.10 171.86 1ofr s SER 157 N -1.70 0.10 -0.09 1.64 0.15 -0.16 -1.22 113.70 112.43 1ofr s SER 157 Ca -0.00 -0.93 -0.19 0.00 0.70 0.00 0.00 55.95 55.53 1ofr s SER 157 Cb -0.10 0.40 -0.04 0.00 -1.71 0.00 0.00 66.02 64.57 1ofr s SER 157 CO 0.02 -0.85 0.53 -0.70 1.20 0.00 0.00 173.24 173.45 1ofr s GLU 158 N -3.98 4.34 -1.04 5.44 2.12 -1.26 -1.62 118.70 122.70 1ofr s GLU 158 Ca 0.18 0.57 -0.21 0.00 0.36 0.00 0.00 54.97 55.87 1ofr s GLU 158 Cb 0.04 -3.41 0.07 0.00 0.26 0.00 0.00 34.13 31.09 1ofr s GLU 158 CO -0.00 0.19 1.41 -1.64 -0.54 0.00 0.00 175.26 174.69 1ofr s MET 159 N 0.46 3.65 0.01 4.30 -1.94 -1.03 -4.89 119.30 119.86 1ofr s MET 159 Ca 0.29 -1.38 -0.06 0.00 -1.71 0.00 0.00 55.69 52.83 1ofr s MET 159 Cb -0.16 -5.28 -0.03 0.00 2.01 0.00 0.00 34.83 31.37 1ofr s MET 159 CO 0.13 -2.11 1.05 -0.07 -0.01 0.00 0.00 175.02 174.00 1ofr h LEU 160 N 12.20 -0.18 0.00 -0.03 -0.00 -1.95 -3.46 115.31 121.90 1ofr h LEU 160 Ca 0.22 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1ofr h LEU 160 Cb 0.99 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.70 1ofr h LEU 160 CO 1.36 -0.12 0.00 -0.90 -0.00 0.00 0.00 178.44 178.78 1ofr n ASP 161 N -2.58 1.76 -1.54 -0.43 5.68 -1.26 -5.04 116.55 113.13 1ofr n ASP 161 Ca -0.03 -0.53 0.09 0.00 -0.50 0.00 0.00 54.79 53.82 1ofr n ASP 161 Cb 0.08 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.41 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 -0.06 2.08 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 0.80 0.23 -0.33 2.28 5.41 -1.26 -4.53 119.36 121.96 1ofr n ILE 163 Ca 0.25 0.08 0.22 0.00 1.00 0.00 0.00 62.75 64.30 1ofr n ILE 163 Cb 0.95 -1.42 0.45 0.00 -0.71 0.00 0.00 39.64 38.91 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 -0.86 4.38 0.02 -1.99 0.20 113.55 115.79 1ofr h SER 164 Ca 0.00 0.19 0.13 0.00 -0.84 0.00 0.00 61.79 61.26 1ofr h SER 164 Cb 0.71 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.32 1ofr h SER 164 CO 0.00 -0.11 0.56 -0.65 -1.14 0.00 0.00 176.83 175.48 1ofr h PRO 165 N 0.34 0.68 -0.03 3.45 0.11 -1.87 -1.41 132.00 133.27 1ofr h PRO 165 Ca 0.71 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.77 1ofr h PRO 165 Cb 1.59 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.54 1ofr h PRO 165 CO -0.60 0.45 -0.02 1.96 -0.21 0.00 0.00 178.00 179.58 1ofr h GLN 166 N 0.70 0.04 0.00 1.05 1.08 -1.26 1.39 115.11 118.10 1ofr h GLN 166 Ca 0.42 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.62 1ofr h GLN 166 Cb 0.63 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 1ofr h GLN 166 CO -0.18 0.06 -0.22 0.66 -0.95 0.00 0.00 178.83 178.20 1ofr n TYR 167 N -4.49 0.34 0.00 2.96 4.02 -0.54 -4.45 117.16 115.00 1ofr n TYR 167 Ca -0.03 0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1ofr n TYR 167 Cb 0.12 -0.59 0.00 0.00 -0.02 0.00 0.00 39.34 38.85 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 -1.81 0.00 -0.33 7.72 4.77 -0.67 -4.82 117.00 121.87 1ofr n LEU 168 Ca 0.06 -0.03 0.19 0.00 -0.03 0.00 0.00 56.01 56.20 1ofr n LEU 168 Cb 0.38 0.00 0.37 0.00 -2.33 0.00 0.00 43.42 41.84 1ofr n LEU 168 CO 0.31 0.00 0.91 0.00 -1.33 0.00 0.00 177.39 177.28 1ofr h ALA 169 N 0.00 1.46 0.00 -1.18 0.00 0.16 -1.12 119.26 118.59 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 -0.64 0.11 0.38 0.00 0.00 0.00 179.25 179.10 1ofr h ASP 170 N 0.07 0.00 -0.00 0.00 2.03 -1.89 -2.41 116.42 114.22 1ofr h ASP 170 Ca 0.65 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.95 1ofr h ASP 170 Cb 1.46 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.96 1ofr h ASP 170 CO -0.81 0.00 -0.50 0.18 -1.03 0.00 0.00 179.24 177.08 1ofr n LEU 171 N -2.65 0.61 -4.77 0.15 4.77 -0.43 -4.85 117.00 109.84 1ofr n LEU 171 Ca -0.02 -0.53 -0.39 0.00 -0.03 0.00 0.00 56.01 55.04 1ofr n LEU 171 Cb 0.16 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 1ofr n LEU 171 CO 0.14 0.15 0.35 -0.69 -1.33 0.00 0.00 177.39 176.00 1ofr s VAL 172 N -2.01 4.79 -0.09 4.08 1.01 -0.91 -4.56 120.40 122.72 1ofr s VAL 172 Ca 0.05 1.38 0.15 0.00 0.00 0.00 0.00 61.98 63.57 1ofr s VAL 172 Cb 0.09 -3.99 -0.23 0.00 0.00 0.00 0.00 36.38 32.24 1ofr s VAL 172 CO 0.44 0.43 0.22 -1.20 0.00 0.00 0.00 175.10 175.00 1ofr n SER 173 N 2.51 1.17 -3.86 3.32 7.64 -0.57 -4.87 113.62 118.96 1ofr n SER 173 Ca -0.06 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.70 1ofr n SER 173 Cb 0.51 1.35 -0.14 0.00 -1.01 0.00 0.00 64.21 64.91 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 -2.79 -0.02 -0.01 1.43 5.36 -1.12 -4.12 117.98 116.70 1ofr s PHE 174 Ca -0.07 0.06 0.03 0.00 -0.96 0.00 0.00 56.93 55.99 1ofr s PHE 174 Cb 0.08 0.01 -0.00 0.00 -0.34 0.00 0.00 43.02 42.76 1ofr s PHE 174 CO 0.67 -0.01 -0.10 0.20 -1.46 0.00 0.00 175.22 174.51 1ofr s GLY 175 N 0.02 0.54 -0.09 13.12 0.00 -0.49 -0.98 107.32 119.43 1ofr s GLY 175 Ca -0.00 -0.43 0.02 0.00 0.00 0.00 0.00 44.72 44.31 1ofr s GLY 175 CO 0.00 -0.29 -0.15 0.00 0.00 0.00 0.00 173.10 172.66 1ofr s ALA 176 N -0.11 1.54 -0.14 3.20 0.00 -0.64 0.24 121.76 125.84 1ofr s ALA 176 Ca 0.02 -0.60 -0.22 0.00 0.00 0.00 0.00 51.96 51.15 1ofr s ALA 176 Cb -0.06 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 1ofr s ALA 176 CO -0.00 0.07 0.67 0.42 0.00 0.00 0.00 175.76 176.92 1ofr s ILE 177 N 0.74 5.02 1.22 0.00 -1.09 0.00 -2.47 121.20 124.63 1ofr s ILE 177 Ca -0.12 1.33 -0.15 0.00 -2.23 0.00 0.00 60.65 59.47 1ofr s ILE 177 Cb -0.16 -4.00 0.28 0.00 -1.58 0.00 0.00 42.46 37.01 1ofr s ILE 177 CO 0.03 0.16 0.82 0.61 -1.23 0.00 0.00 174.94 175.33 1ofr n GLY 178 N 3.45 -2.44 0.15 6.18 0.00 -1.26 -3.11 105.19 108.17 1ofr n GLY 178 Ca -0.01 -1.20 -0.00 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 -2.78 1.11 -0.00 4.61 0.00 -1.86 -2.78 119.26 117.56 1ofr h ALA 179 Ca -0.59 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1ofr h ALA 179 Cb 1.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ofr h ALA 179 CO 0.45 0.67 -0.01 0.54 0.00 0.00 0.00 179.25 180.90 1ofr n ARG 180 N -3.90 0.99 0.00 0.00 1.74 -1.26 -3.86 116.66 110.36 1ofr n ARG 180 Ca -0.01 -0.15 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1ofr n ARG 180 Cb 0.55 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.49 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 -0.88 0.00 -0.09 0.55 -2.24 -1.10 -4.75 114.28 105.77 1ofr n THR 181 Ca 0.21 -0.39 0.20 0.00 -2.27 0.00 0.00 64.05 61.80 1ofr n THR 181 Cb 0.17 1.07 0.64 0.00 -2.10 0.00 0.00 70.33 70.10 1ofr n THR 181 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1ofr h THR 182 N 0.07 0.72 0.00 4.28 2.02 -1.60 0.84 112.91 119.23 1ofr h THR 182 Ca 0.00 -0.05 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 1ofr h THR 182 Cb 0.03 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1ofr h THR 182 CO 0.00 0.02 -0.42 -0.33 0.37 0.00 0.00 175.52 175.16 1ofr h GLU 183 N 0.13 0.00 -6.25 6.66 5.08 -1.85 -3.43 114.58 114.93 1ofr h GLU 183 Ca 0.32 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 58.14 1ofr h GLU 183 Cb 1.09 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.35 1ofr h GLU 183 CO -0.04 0.24 1.30 0.45 -1.00 0.00 0.00 179.01 179.96 1ofr s SER 184 N -6.21 6.18 0.19 1.42 0.15 0.29 -4.89 113.70 110.83 1ofr s SER 184 Ca 0.04 2.40 -0.11 0.00 0.70 0.00 0.00 55.95 58.98 1ofr s SER 184 Cb 0.07 -2.52 0.22 0.00 -1.71 0.00 0.00 66.02 62.07 1ofr s SER 184 CO 0.73 -1.31 1.75 -0.61 1.20 0.00 0.00 173.24 174.99 1ofr h GLN 185 N 11.80 0.37 -0.97 5.44 5.75 -1.89 -1.57 115.11 134.05 1ofr h GLN 185 Ca -0.46 -0.02 0.18 0.00 -0.15 0.00 0.00 58.65 58.19 1ofr h GLN 185 Cb 1.23 -0.08 -0.10 0.00 1.07 0.00 0.00 27.48 29.60 1ofr h GLN 185 CO 0.95 0.25 0.57 1.25 -2.65 0.00 0.00 178.83 179.19 1ofr h LEU 186 N 0.38 0.73 0.00 -2.39 5.85 -1.93 0.22 115.31 118.16 1ofr h LEU 186 Ca 0.27 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1ofr h LEU 186 Cb 0.30 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1ofr h LEU 186 CO -0.27 0.27 -0.05 0.45 -0.34 0.00 0.00 178.44 178.50 1ofr h HIS 187 N 0.74 0.00 0.02 1.25 3.86 -1.58 -2.27 115.15 117.18 1ofr h HIS 187 Ca 0.55 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.62 1ofr h HIS 187 Cb 0.82 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.30 1ofr h HIS 187 CO -0.03 0.00 -0.56 0.00 0.86 0.00 0.00 177.93 178.20 1ofr h ARG 188 N 0.00 0.34 -0.76 2.45 3.08 -0.51 -2.32 114.38 116.66 1ofr h ARG 188 Ca 0.00 -0.39 -0.04 0.00 0.07 0.00 0.00 59.98 59.61 1ofr h ARG 188 Cb 0.91 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.04 1ofr h ARG 188 CO 0.00 1.09 0.31 0.93 -1.07 0.00 0.00 179.97 181.23 1ofr h GLU 189 N -0.24 1.13 -0.78 0.04 5.08 -1.28 -1.09 114.58 117.44 1ofr h GLU 189 Ca -0.08 -0.20 0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1ofr h GLU 189 Cb 1.30 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.32 1ofr h GLU 189 CO 0.11 0.92 0.48 1.25 -1.00 0.00 0.00 179.01 180.77 1ofr h LEU 190 N 1.09 0.76 -0.82 1.33 5.85 -1.41 -1.98 115.31 120.14 1ofr h LEU 190 Ca 0.25 0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.87 1ofr h LEU 190 Cb 0.21 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1ofr h LEU 190 CO -0.02 0.50 -0.34 0.00 -0.34 0.00 0.00 178.44 178.24 1ofr h ALA 191 N 1.36 0.99 0.00 1.25 0.00 -0.84 -2.60 119.26 119.41 1ofr h ALA 191 Ca 0.33 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ofr h ALA 191 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ofr h ALA 191 CO -0.15 0.60 0.00 -1.13 0.00 0.00 0.00 179.25 178.57 1ofr n SER 192 N -4.07 0.00 0.00 0.00 3.41 -0.47 -2.24 113.62 110.26 1ofr n SER 192 Ca -0.01 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 1ofr n SER 192 Cb 0.46 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 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 -0.43 -0.52 3.82 5.00 0.00 -0.99 -0.88 105.19 111.19 1ofr n GLY 193 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.14 3.83 -0.09 0.99 1.43 -0.95 -4.96 118.68 118.80 1ofr s LEU 194 Ca 0.00 1.72 0.04 0.00 -1.03 0.00 0.00 54.13 54.87 1ofr s LEU 194 Cb 0.00 -4.54 0.27 0.00 0.03 0.00 0.00 46.19 41.96 1ofr s LEU 194 CO 0.00 -0.54 0.97 -1.20 0.23 0.00 0.00 176.35 175.81 1ofr n SER 195 N -0.97 2.69 -3.15 2.29 7.64 -1.26 -4.91 113.62 115.95 1ofr n SER 195 Ca 0.07 -2.34 -0.13 0.00 1.01 0.00 0.00 58.87 57.48 1ofr n SER 195 Cb 0.54 -0.57 -0.02 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 -1.54 0.84 0.29 1.43 -0.12 -1.26 -5.06 117.98 112.56 1ofr s PHE 196 Ca 0.19 -1.18 -0.29 0.00 -0.05 0.00 0.00 56.93 55.59 1ofr s PHE 196 Cb 0.14 0.14 -0.10 0.00 -0.63 0.00 0.00 43.02 42.58 1ofr s PHE 196 CO 0.05 -1.25 1.15 -2.14 -0.05 0.00 0.00 175.22 172.98 1ofr s PRO 197 N -2.85 4.57 -0.12 1.99 0.02 -1.26 -4.88 135.00 132.47 1ofr s PRO 197 Ca 0.27 1.90 0.03 0.00 0.02 0.00 0.00 61.00 63.22 1ofr s PRO 197 Cb -0.02 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1ofr s PRO 197 CO 0.18 0.11 -0.22 0.08 -0.33 0.00 0.00 177.00 176.82 1ofr s VAL 198 N -1.12 2.18 -0.21 3.83 1.01 -0.89 -1.40 120.40 123.81 1ofr s VAL 198 Ca 0.46 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1ofr s VAL 198 Cb -0.34 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1ofr s VAL 198 CO 0.44 0.55 0.09 -0.83 0.00 0.00 0.00 175.10 175.35 1ofr s GLY 199 N 0.50 1.92 -0.23 4.51 0.00 0.14 -2.21 107.32 111.94 1ofr s GLY 199 Ca -0.14 -0.83 -0.11 0.00 0.00 0.00 0.00 44.72 43.64 1ofr s GLY 199 CO 0.05 0.21 0.20 -1.36 0.00 0.00 0.00 173.10 172.20 1ofr s PHE 200 N 0.70 3.33 0.37 1.90 0.08 -0.21 -0.82 117.98 123.34 1ofr s PHE 200 Ca 0.05 0.29 -0.20 0.00 0.12 0.00 0.00 56.93 57.19 1ofr s PHE 200 Cb -0.13 -2.31 -0.10 0.00 -0.57 0.00 0.00 43.02 39.91 1ofr s PHE 200 CO 0.02 0.05 0.88 0.15 -0.10 0.00 0.00 175.22 176.22 1ofr s LYS 201 N 1.10 4.22 0.69 0.44 1.02 -1.18 -0.62 119.74 125.42 1ofr s LYS 201 Ca 0.09 1.02 -0.13 0.00 0.02 0.00 0.00 55.97 56.97 1ofr s LYS 201 Cb -0.14 -2.38 0.02 0.00 -0.52 0.00 0.00 37.83 34.81 1ofr s LYS 201 CO 0.05 0.09 1.10 0.54 -0.92 0.00 0.00 175.35 176.21 1ofr s ASN 202 N -2.09 4.99 0.55 2.83 4.22 -0.89 -4.56 114.94 120.00 1ofr s ASN 202 Ca 0.57 1.90 -0.18 0.00 -2.14 0.00 0.00 52.86 53.01 1ofr s ASN 202 Cb -0.11 -2.54 -0.10 0.00 1.28 0.00 0.00 41.25 39.78 1ofr s ASN 202 CO 0.16 -1.71 0.39 0.61 -2.04 0.00 0.00 177.10 174.52 1ofr n GLY 203 N -0.89 -1.85 0.00 0.45 0.00 -0.41 -4.78 105.19 97.71 1ofr n GLY 203 Ca 0.10 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.65 0.81 -1.35 2.61 -2.24 -1.26 -1.87 114.28 109.33 1ofr n THR 204 Ca 0.11 0.20 -0.20 0.00 -2.27 0.00 0.00 64.05 61.89 1ofr n THR 204 Cb 0.47 -1.04 0.16 0.00 -2.10 0.00 0.00 70.33 67.83 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 -1.30 3.96 0.00 3.42 5.75 -1.26 -1.82 116.55 125.30 1ofr n ASP 205 Ca 0.05 -3.70 0.00 0.00 -0.01 0.00 0.00 54.79 51.13 1ofr n ASP 205 Cb 0.08 -0.78 0.00 0.00 -1.03 0.00 0.00 41.12 39.39 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 -1.09 1.20 3.80 6.12 0.00 -0.78 -3.90 105.19 110.54 1ofr n GLY 206 Ca 0.52 0.00 -0.34 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 -1.45 3.96 -1.78 2.61 -4.23 -1.26 -4.86 115.64 108.64 1ofr s THR 207 Ca 0.00 1.24 0.16 0.00 -1.18 0.00 0.00 61.69 61.91 1ofr s THR 207 Cb 0.00 -3.51 0.07 0.00 1.34 0.00 0.00 72.50 70.40 1ofr s THR 207 CO 0.00 -0.25 0.94 -0.11 -0.54 0.00 0.00 174.62 174.66 1ofr n LEU 208 N -0.81 2.03 -0.02 4.79 7.94 -1.26 -1.29 117.00 128.37 1ofr n LEU 208 Ca 0.08 -0.90 -0.12 0.00 -1.11 0.00 0.00 56.01 53.96 1ofr n LEU 208 Cb 0.53 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.41 1ofr n LEU 208 CO 0.39 0.37 0.74 0.78 -1.11 0.00 0.00 177.39 178.56 1ofr h ASN 209 N 2.58 0.14 -0.89 1.96 4.21 -1.98 -2.92 115.58 118.68 1ofr h ASN 209 Ca 0.00 -0.30 0.06 0.00 1.21 0.00 0.00 56.30 57.27 1ofr h ASN 209 Cb 0.61 -0.04 -0.06 0.00 -1.12 0.00 0.00 38.32 37.72 1ofr h ASN 209 CO 0.00 0.41 0.58 -0.37 -1.29 0.00 0.00 177.43 176.76 1ofr h VAL 210 N -0.12 1.08 -0.05 2.81 -1.51 -1.97 -1.16 116.25 115.34 1ofr h VAL 210 Ca 0.02 -0.35 -0.13 0.00 -1.23 0.00 0.00 66.70 65.01 1ofr h VAL 210 Cb 0.33 -0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 29.45 1ofr h VAL 210 CO 0.00 0.19 -0.56 0.00 -1.23 0.00 0.00 177.57 175.97 1ofr h ALA 211 N 1.51 0.97 -0.11 5.19 0.00 -1.79 -0.71 119.26 124.33 1ofr h ALA 211 Ca 0.37 -0.51 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 1ofr h ALA 211 Cb 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ofr h ALA 211 CO -0.13 0.70 -0.55 0.28 0.00 0.00 0.00 179.25 179.55 1ofr h VAL 212 N 0.11 1.35 -0.01 0.00 2.07 -1.17 -2.31 116.25 116.29 1ofr h VAL 212 Ca -0.00 -1.83 -0.17 0.00 0.82 0.00 0.00 66.70 65.51 1ofr h VAL 212 Cb 1.02 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 1ofr h VAL 212 CO 0.08 0.55 -0.79 0.44 0.02 0.00 0.00 177.57 177.87 1ofr h ASP 213 N 0.25 0.12 -0.04 0.57 3.32 -0.96 -2.27 116.42 117.41 1ofr h ASP 213 Ca 0.00 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1ofr h ASP 213 Cb 1.04 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.55 1ofr h ASP 213 CO 0.09 0.86 0.02 0.00 -1.72 0.00 0.00 179.24 178.49 1ofr h ALA 214 N 1.13 0.05 -0.84 3.45 0.00 -0.93 -0.73 119.26 121.39 1ofr h ALA 214 Ca -0.02 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ofr h ALA 214 Cb 1.39 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1ofr h ALA 214 CO 0.11 -0.37 0.54 0.00 0.00 0.00 0.00 179.25 179.53 1ofr h GLN 216 N 1.04 -0.11 0.18 0.00 1.08 -1.04 -2.69 115.11 113.56 1ofr h GLN 216 Ca 0.34 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.54 1ofr h GLN 216 Cb 0.03 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1ofr h GLN 216 CO -0.12 -0.08 -0.09 0.00 -0.95 0.00 0.00 178.83 177.60 1ofr h ALA 217 N 0.87 -0.24 0.00 3.87 0.00 -0.63 -2.71 119.26 120.43 1ofr h ALA 217 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ofr h ALA 217 Cb 0.15 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ofr h ALA 217 CO -0.07 -0.59 0.18 0.00 0.00 0.00 0.00 179.25 178.77 1ofr h ALA 218 N 0.48 1.17 0.00 0.00 0.00 -0.80 0.78 119.26 120.89 1ofr h ALA 218 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1ofr h ALA 218 Cb 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1ofr h ALA 218 CO 0.04 -0.17 -0.59 0.00 0.00 0.00 0.00 179.25 178.53 1ofr h ALA 219 N 1.60 0.85 -2.46 0.00 0.00 -1.13 0.60 119.26 118.72 1ofr h ALA 219 Ca 0.00 -0.54 -0.46 0.00 0.00 0.00 0.00 54.91 53.91 1ofr h ALA 219 Cb 0.36 -0.09 0.09 0.00 0.00 0.00 0.00 17.79 18.15 1ofr h ALA 219 CO 0.00 0.74 0.33 -1.01 0.00 0.00 0.00 179.25 179.32 1ofr s HIS 220 N -3.40 2.88 0.05 0.00 3.76 0.27 -3.91 115.29 114.94 1ofr s HIS 220 Ca 0.00 0.60 -0.21 0.00 -0.15 0.00 0.00 55.06 55.30 1ofr s HIS 220 Cb 0.11 -3.39 -0.06 0.00 1.11 0.00 0.00 32.58 30.35 1ofr s HIS 220 CO 0.75 -1.66 0.61 0.45 -0.85 0.00 0.00 174.74 174.04 1ofr s SER 221 N -4.57 7.07 0.19 1.40 0.15 -1.26 -3.63 113.70 113.05 1ofr s SER 221 Ca 0.62 1.27 0.08 0.00 0.70 0.00 0.00 55.95 58.61 1ofr s SER 221 Cb -0.11 -2.38 -0.05 0.00 -1.71 0.00 0.00 66.02 61.78 1ofr s SER 221 CO 0.47 0.19 -0.15 -1.00 1.20 0.00 0.00 173.24 173.96 1ofr s HIS 222 N -0.71 1.68 -0.35 3.44 3.76 -1.22 -4.93 115.29 116.96 1ofr s HIS 222 Ca 0.31 -0.57 0.03 0.00 -0.15 0.00 0.00 55.06 54.68 1ofr s HIS 222 Cb -0.19 -0.80 0.10 0.00 1.11 0.00 0.00 32.58 32.80 1ofr s HIS 222 CO 0.19 0.33 0.08 -1.01 -0.85 0.00 0.00 174.74 173.48 1ofr s HIS 223 N -2.81 3.14 0.31 1.40 3.76 -1.26 -0.50 115.29 119.33 1ofr s HIS 223 Ca 0.20 -2.67 0.04 0.00 -0.15 0.00 0.00 55.06 52.48 1ofr s HIS 223 Cb -0.02 -2.57 -0.06 0.00 1.11 0.00 0.00 32.58 31.04 1ofr s HIS 223 CO 0.06 -0.91 0.06 -0.59 -0.85 0.00 0.00 174.74 172.51 1ofr s PHE 224 N 0.99 1.92 -0.29 1.40 -0.12 -0.38 -4.95 117.98 116.55 1ofr s PHE 224 Ca 0.11 -0.97 -0.16 0.00 -0.05 0.00 0.00 56.93 55.86 1ofr s PHE 224 Cb -0.19 -1.23 -0.03 0.00 -0.63 0.00 0.00 43.02 40.93 1ofr s PHE 224 CO -0.12 -0.02 0.41 -1.64 -0.05 0.00 0.00 175.22 173.80 1ofr s MET 225 N -3.90 3.93 0.00 1.99 -1.94 -1.26 0.96 119.30 119.07 1ofr s MET 225 Ca 0.36 0.00 0.00 0.00 -1.71 0.00 0.00 55.69 54.35 1ofr s MET 225 Cb 0.08 -3.69 0.00 0.00 2.01 0.00 0.00 34.83 33.24 1ofr s MET 225 CO 0.15 -0.36 0.00 0.41 -0.01 0.00 0.00 175.02 175.21 1ofr n GLY 226 N 4.69 4.57 3.39 -0.03 0.00 -0.24 -4.92 105.19 112.65 1ofr n GLY 226 Ca -0.07 -1.76 -0.31 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 -1.38 2.42 0.93 1.61 -7.23 -1.26 -0.29 120.40 115.20 1ofr s VAL 227 Ca 0.00 -1.21 -0.15 0.00 -1.81 0.00 0.00 61.98 58.81 1ofr s VAL 227 Cb 0.00 -1.95 0.17 0.00 0.56 0.00 0.00 36.38 35.16 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 2.00 -0.04 5.32 -4.23 0.75 -4.86 115.64 113.77 1ofr s THR 228 Ca 0.12 0.00 0.28 0.00 -1.18 0.00 0.00 61.69 60.91 1ofr s THR 228 Cb -0.10 -2.99 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 -1.50 0.00 -0.82 3.99 1.79 -1.96 -1.79 116.57 116.27 1ofr h LYS 229 Ca -0.45 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.69 1ofr h LYS 229 Cb 1.26 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.71 1ofr h LYS 229 CO 0.45 0.00 0.41 0.72 -1.08 0.00 0.00 179.45 179.95 1ofr n HIS 230 N -2.48 2.64 -1.61 -1.35 8.25 -1.26 -0.14 115.22 119.27 1ofr n HIS 230 Ca -0.01 -1.48 -0.18 0.00 -0.26 0.00 0.00 57.72 55.79 1ofr n HIS 230 Cb 0.09 -0.78 -0.07 0.00 1.12 0.00 0.00 29.99 30.34 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 -0.60 1.59 3.54 -1.41 0.00 -0.67 -4.96 105.19 102.67 1ofr n GLY 231 Ca 0.48 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.71 3.47 0.17 1.61 1.01 -1.26 -4.85 120.40 117.85 1ofr s VAL 232 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 1ofr s VAL 232 Cb 0.00 -2.40 -0.08 0.00 0.00 0.00 0.00 36.38 33.90 1ofr s VAL 232 CO 0.00 0.59 1.26 0.00 0.00 0.00 0.00 175.10 176.95 1ofr s ALA 233 N -0.79 3.48 0.08 5.51 0.00 -1.26 -0.18 121.76 128.61 1ofr s ALA 233 Ca 0.12 1.02 -0.17 0.00 0.00 0.00 0.00 51.96 52.93 1ofr s ALA 233 Cb -0.11 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.59 1ofr s ALA 233 CO 0.01 -0.47 0.41 0.00 0.00 0.00 0.00 175.76 175.71 1ofr s ALA 234 N 0.23 -0.98 -0.62 0.00 0.00 0.60 -4.91 121.76 116.08 1ofr s ALA 234 Ca 0.56 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.39 1ofr s ALA 234 Cb -0.34 0.52 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1ofr s ALA 234 CO 0.36 -0.55 1.39 0.42 0.00 0.00 0.00 175.76 177.38 1ofr s ILE 235 N -3.13 3.75 0.23 0.00 1.01 -1.26 -1.07 121.20 120.72 1ofr s ILE 235 Ca -0.01 0.58 -0.21 0.00 0.00 0.00 0.00 60.65 61.01 1ofr s ILE 235 Cb 0.01 -4.57 -0.08 0.00 0.01 0.00 0.00 42.46 37.82 1ofr s ILE 235 CO -0.07 -1.38 0.75 -0.89 0.00 0.00 0.00 174.94 173.35 1ofr s THR 236 N 6.12 4.52 -0.10 2.92 2.01 0.27 -4.93 115.64 126.46 1ofr s THR 236 Ca 0.47 1.36 0.00 0.00 0.31 0.00 0.00 61.69 63.84 1ofr s THR 236 Cb -0.10 -3.89 0.02 0.00 0.01 0.00 0.00 72.50 68.55 1ofr s THR 236 CO 0.22 0.22 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.39 1ofr s THR 237 N -1.51 1.03 0.25 -0.82 2.01 -1.26 -1.25 115.64 114.09 1ofr s THR 237 Ca 0.43 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 62.15 1ofr s THR 237 Cb -0.17 -1.03 -0.03 0.00 0.01 0.00 0.00 72.50 71.28 1ofr s THR 237 CO 0.22 0.36 0.39 0.42 -0.69 0.00 0.00 174.62 175.31 1ofr s THR 238 N 1.51 5.24 0.00 -0.82 -4.23 0.34 -4.95 115.64 112.73 1ofr s THR 238 Ca 0.01 -0.85 0.04 0.00 -1.18 0.00 0.00 61.69 59.71 1ofr s THR 238 Cb -0.13 -3.84 -0.25 0.00 1.34 0.00 0.00 72.50 69.62 1ofr s THR 238 CO -0.06 -0.34 0.85 0.50 -0.54 0.00 0.00 174.62 175.03 1ofr h LYS 239 N 1.22 0.11 0.00 3.99 3.64 -1.87 -3.24 116.57 120.42 1ofr h LYS 239 Ca -0.51 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 58.68 1ofr h LYS 239 Cb 1.22 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 1ofr h LYS 239 CO 0.62 0.89 0.00 0.41 -2.27 0.00 0.00 179.45 179.10 1ofr n GLY 240 N 1.58 3.03 3.38 5.01 0.00 -0.06 -4.09 105.19 114.05 1ofr n GLY 240 Ca -0.14 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 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 4.62 0.00 1.61 3.84 0.21 -4.85 114.94 120.37 1ofr s ASN 241 Ca 0.00 -0.29 0.23 0.00 0.21 0.00 0.00 52.86 53.01 1ofr s ASN 241 Cb 0.00 -1.80 0.59 0.00 -0.55 0.00 0.00 41.25 39.49 1ofr s ASN 241 CO 0.00 0.01 1.50 -1.84 -2.79 0.00 0.00 177.10 173.99 1ofr n GLU 242 N 4.58 2.67 -2.03 0.43 0.00 -1.26 -3.34 120.64 121.69 1ofr n GLU 242 Ca -0.17 -2.57 -0.30 0.00 0.00 0.00 0.00 57.16 54.12 1ofr n GLU 242 Cb 0.51 -1.56 0.03 0.00 0.00 0.00 0.00 31.44 30.42 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 1.62 3.11 -4.02 -1.84 8.25 -1.26 -4.97 115.22 116.10 1ofr n HIS 243 Ca 0.23 -2.68 -0.35 0.00 -0.26 0.00 0.00 57.72 54.66 1ofr n HIS 243 Cb 0.62 -0.62 -0.12 0.00 1.12 0.00 0.00 29.99 31.00 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 0.86 2.07 -0.01 0.00 -0.71 -0.94 -4.66 117.98 114.58 1ofr s PHE 245 Ca 0.02 -0.93 -0.08 0.00 -1.04 0.00 0.00 56.93 54.90 1ofr s PHE 245 Cb -0.14 -1.41 -0.05 0.00 -1.21 0.00 0.00 43.02 40.21 1ofr s PHE 245 CO 0.02 0.09 0.28 0.08 -1.34 0.00 0.00 175.22 174.35 1ofr s VAL 246 N -3.12 5.28 -0.09 -2.49 1.01 -1.26 -1.04 120.40 118.69 1ofr s VAL 246 Ca 0.32 0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.63 1ofr s VAL 246 Cb 0.08 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1ofr s VAL 246 CO 0.15 0.44 -0.21 -0.63 0.00 0.00 0.00 175.10 174.85 1ofr s ILE 247 N -1.22 2.41 -0.26 2.22 1.01 0.21 -0.52 121.20 125.04 1ofr s ILE 247 Ca 0.25 -0.91 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 1ofr s ILE 247 Cb -0.14 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.35 1ofr s ILE 247 CO 0.14 0.56 0.25 -0.76 0.00 0.00 0.00 174.94 175.12 1ofr s LEU 248 N 0.13 4.05 -0.05 2.97 1.43 0.15 -2.09 118.68 125.29 1ofr s LEU 248 Ca -0.11 0.13 0.11 0.00 -1.03 0.00 0.00 54.13 53.24 1ofr s LEU 248 Cb -0.16 -2.23 0.20 0.00 0.03 0.00 0.00 46.19 44.03 1ofr s LEU 248 CO 0.06 -0.07 1.09 -2.11 0.23 0.00 0.00 176.35 175.56 1ofr n ARG 249 N 4.94 0.43 0.00 1.70 -4.01 -1.26 0.74 116.66 119.19 1ofr n ARG 249 Ca -0.12 -1.78 0.00 0.00 -1.04 0.00 0.00 57.85 54.91 1ofr n ARG 249 Cb 0.52 -0.71 0.00 0.00 -3.04 0.00 0.00 32.46 29.22 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 -0.31 0.34 0.00 2.89 0.00 -1.26 -2.41 105.19 104.44 1ofr n GLY 250 Ca 0.07 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 0.07 0.16 -0.02 0.00 -1.15 -4.14 105.19 100.11 1ofr n GLY 251 Ca 0.00 -1.37 0.03 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 -0.27 1.61 1.57 -1.60 -2.26 116.57 115.62 1ofr h LYS 252 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ofr h LYS 252 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ofr h LYS 252 CO 0.00 0.48 0.00 1.63 -0.57 0.00 0.00 179.45 180.99 1ofr n LYS 253 N -3.49 0.74 0.00 3.15 4.76 -1.25 -4.92 118.16 117.14 1ofr n LYS 253 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1ofr n LYS 253 Cb 0.60 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.65 1ofr n LYS 253 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ofr n GLY 254 N 0.20 0.01 3.75 0.72 0.00 -0.85 -4.96 105.19 104.06 1ofr n GLY 254 Ca 0.00 -1.78 -0.38 0.00 0.00 0.00 0.00 46.02 43.86 1ofr n GLY 254 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ofr s THR 255 N -2.18 2.08 -0.38 2.61 -4.23 -1.26 -2.91 115.64 109.38 1ofr s THR 255 Ca 0.00 0.06 0.13 0.00 -1.18 0.00 0.00 61.69 60.70 1ofr s THR 255 Cb 0.00 -3.03 0.42 0.00 1.34 0.00 0.00 72.50 71.23 1ofr s THR 255 CO 0.00 -0.00 0.93 -0.46 -0.54 0.00 0.00 174.62 174.55 1ofr n ASN 256 N -0.99 2.20 -0.00 3.99 6.94 -1.26 -4.86 115.26 121.28 1ofr n ASN 256 Ca 0.10 -3.06 0.03 0.00 -0.02 0.00 0.00 54.58 51.63 1ofr n ASN 256 Cb 0.45 -0.54 -0.05 0.00 -2.36 0.00 0.00 39.78 37.28 1ofr n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ofr n TYR 257 N -0.08 0.00 -1.04 -2.53 0.18 -1.26 -4.55 117.16 107.88 1ofr n TYR 257 Ca 0.20 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.69 1ofr n TYR 257 Cb 0.71 -0.09 0.22 0.00 -0.38 0.00 0.00 39.34 39.80 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 -2.32 1.36 0.33 9.48 1.47 -1.26 -4.68 116.67 121.04 1ofr s ASP 258 Ca -0.00 0.88 0.02 0.00 1.18 0.00 0.00 52.55 54.62 1ofr s ASP 258 Cb 0.05 -1.31 0.56 0.00 -0.34 0.00 0.00 42.92 41.88 1ofr s ASP 258 CO 0.28 -3.88 1.93 0.00 0.68 0.00 0.00 175.17 174.18 1ofr h ALA 259 N -2.41 1.42 -0.31 2.11 0.00 -1.96 -0.35 119.26 117.76 1ofr h ALA 259 Ca -0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1ofr h ALA 259 Cb 1.31 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1ofr h ALA 259 CO 0.43 0.46 0.14 -0.22 0.00 0.00 0.00 179.25 180.06 1ofr h LYS 260 N 0.77 0.45 0.11 0.00 3.64 -1.99 -1.20 116.57 118.36 1ofr h LYS 260 Ca 0.19 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1ofr h LYS 260 Cb 0.10 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1ofr h LYS 260 CO -0.02 0.45 -0.09 0.77 -2.27 0.00 0.00 179.45 178.28 1ofr h SER 261 N 0.36 -0.24 -0.01 4.20 0.02 -1.79 -2.10 113.55 113.99 1ofr h SER 261 Ca 0.10 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1ofr h SER 261 Cb 0.15 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1ofr h SER 261 CO -0.01 -0.15 0.03 0.58 -1.14 0.00 0.00 176.83 176.14 1ofr h VAL 262 N -0.22 0.25 0.10 2.27 2.07 -0.86 -1.92 116.25 117.95 1ofr h VAL 262 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1ofr h VAL 262 Cb 0.20 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1ofr h VAL 262 CO -0.02 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.53 1ofr h ALA 263 N 1.95 -0.13 -0.44 1.67 0.00 -0.51 -2.26 119.26 119.54 1ofr h ALA 263 Ca 0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ofr h ALA 263 Cb 0.07 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ofr h ALA 263 CO -0.00 -0.31 0.15 0.93 0.00 0.00 0.00 179.25 180.02 1ofr h GLU 264 N -0.66 0.64 0.83 0.00 5.08 -1.32 -0.44 114.58 118.71 1ofr h GLU 264 Ca -0.01 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1ofr h GLU 264 Cb 0.52 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1ofr h GLU 264 CO 0.02 0.56 -0.48 0.00 -1.00 0.00 0.00 179.01 178.11 1ofr h ALA 265 N 1.53 -1.29 0.00 3.43 0.00 -1.36 -0.01 119.26 121.56 1ofr h ALA 265 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ofr h ALA 265 Cb 0.18 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ofr h ALA 265 CO -0.01 -1.23 0.00 0.87 0.00 0.00 0.00 179.25 178.88 1ofr h LYS 266 N -1.22 0.00 -0.06 0.00 1.57 -1.11 -1.96 116.57 113.79 1ofr h LYS 266 Ca -0.11 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.53 1ofr h LYS 266 Cb 0.96 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.28 1ofr h LYS 266 CO 0.13 0.00 -0.51 0.00 -0.57 0.00 0.00 179.45 178.50 1ofr h ALA 267 N 2.01 0.15 0.00 3.86 0.00 -0.33 -3.30 119.26 121.65 1ofr h ALA 267 Ca 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 1ofr h ALA 267 Cb 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ofr h ALA 267 CO 0.00 0.34 -0.11 1.96 0.00 0.00 0.00 179.25 181.44 1ofr h GLN 268 N -0.00 0.00 -6.95 0.00 4.20 -0.33 -3.46 115.11 108.57 1ofr h GLN 268 Ca -0.05 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.14 1ofr h GLN 268 Cb 1.18 0.00 0.09 0.00 0.30 0.00 0.00 27.48 29.04 1ofr h GLN 268 CO 0.10 0.11 0.63 -0.51 -0.67 0.00 0.00 178.83 178.49 1ofr s LEU 269 N -6.27 4.22 0.95 1.46 1.43 -0.80 -5.02 118.68 114.65 1ofr s LEU 269 Ca 0.06 2.69 -0.15 0.00 -1.03 0.00 0.00 54.13 55.71 1ofr s LEU 269 Cb 0.06 -3.89 0.17 0.00 0.03 0.00 0.00 46.19 42.56 1ofr s LEU 269 CO 0.68 -0.87 1.21 -2.84 0.23 0.00 0.00 176.35 174.77 1ofr s PRO 270 N -2.23 0.78 0.14 1.29 0.02 -1.26 -5.00 135.00 128.74 1ofr s PRO 270 Ca 0.57 -0.07 -0.30 0.00 0.02 0.00 0.00 61.00 61.21 1ofr s PRO 270 Cb -0.39 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.22 1ofr s PRO 270 CO 0.50 -2.37 1.27 0.00 -0.33 0.00 0.00 177.00 176.07 1ofr s ALA 271 N -3.54 3.48 0.00 -1.55 0.00 -1.26 -2.83 121.76 116.07 1ofr s ALA 271 Ca 0.68 1.00 0.00 0.00 0.00 0.00 0.00 51.96 53.65 1ofr s ALA 271 Cb -0.09 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1ofr s ALA 271 CO 0.53 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.22 1ofr n GLY 272 N 2.77 0.51 3.36 0.00 0.00 -1.26 -5.02 105.19 105.54 1ofr n GLY 272 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.11 -0.55 0.00 1.61 0.01 -1.13 -5.06 113.70 106.48 1ofr s SER 273 Ca 0.00 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.21 1ofr s SER 273 Cb 0.00 -1.38 0.00 0.00 0.21 0.00 0.00 66.02 64.85 1ofr s SER 273 CO 0.00 -5.06 0.00 0.59 0.41 0.00 0.00 173.24 169.18 1ofr n ASN 274 N -5.44 0.17 -3.94 2.44 3.02 -1.26 -5.01 115.26 105.24 1ofr n ASN 274 Ca 0.11 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 1ofr n ASN 274 Cb 0.59 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1ofr n ASN 274 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ofr n GLY 275 N 5.00 -3.31 2.93 7.41 0.00 -0.42 -4.91 105.19 111.89 1ofr n GLY 275 Ca 0.00 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 1ofr n GLY 275 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofr s LEU 276 N 0.00 1.00 0.08 0.99 1.43 -0.75 -4.16 118.68 117.26 1ofr s LEU 276 Ca 0.00 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 1ofr s LEU 276 Cb 0.00 0.33 -0.04 0.00 0.03 0.00 0.00 46.19 46.51 1ofr s LEU 276 CO 0.00 -0.12 0.09 -0.32 0.23 0.00 0.00 176.35 176.23 1ofr s MET 277 N 0.84 2.93 -0.12 1.70 -2.45 0.32 -2.13 119.30 120.40 1ofr s MET 277 Ca -0.06 -0.67 -0.00 0.00 -1.25 0.00 0.00 55.69 53.71 1ofr s MET 277 Cb -0.09 -2.76 0.02 0.00 1.25 0.00 0.00 34.83 33.26 1ofr s MET 277 CO -0.04 0.57 -0.09 0.42 1.05 0.00 0.00 175.02 176.93 1ofr s ILE 278 N -1.40 1.14 -0.18 10.11 1.01 0.16 0.34 121.20 132.38 1ofr s ILE 278 Ca 0.30 -0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.38 1ofr s ILE 278 Cb -0.12 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 1ofr s ILE 278 CO 0.22 0.39 0.56 -0.62 0.00 0.00 0.00 174.94 175.49 1ofr s ASP 279 N 1.58 6.64 0.04 3.58 2.15 0.23 -1.60 116.67 129.29 1ofr s ASP 279 Ca 0.03 0.78 0.25 0.00 0.43 0.00 0.00 52.55 54.04 1ofr s ASP 279 Cb -0.13 -2.32 1.01 0.00 -0.30 0.00 0.00 42.92 41.19 1ofr s ASP 279 CO -0.08 -0.18 1.78 -1.22 -0.17 0.00 0.00 175.17 175.31 1ofr n TYR 280 N 4.64 0.18 -4.13 -5.34 4.02 -0.73 -4.55 117.16 111.24 1ofr n TYR 280 Ca -0.04 0.06 -0.09 0.00 -0.01 0.00 0.00 57.90 57.81 1ofr n TYR 280 Cb 0.50 -0.59 -0.02 0.00 -0.02 0.00 0.00 39.34 39.21 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 -1.65 2.28 0.00 7.72 3.41 -1.26 -3.32 113.62 120.80 1ofr n SER 281 Ca 0.06 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 1ofr n SER 281 Cb 0.30 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 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 -0.46 0.00 -0.21 7.33 8.25 -1.26 -2.70 115.22 126.18 1ofr n HIS 282 Ca -0.05 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.32 1ofr n HIS 282 Cb 0.19 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.32 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 1.02 2.00 -1.41 0.00 -1.81 -3.17 103.07 99.70 1ofr h GLY 283 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1ofr h GLY 283 CO 0.00 0.61 0.00 3.43 0.00 0.00 0.00 176.54 180.58 1ofr h ASN 284 N 0.85 0.00 0.72 0.19 2.35 -1.45 -3.16 115.58 115.07 1ofr h ASN 284 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1ofr h ASN 284 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1ofr h ASN 284 CO 0.01 0.00 -0.81 -1.54 -1.65 0.00 0.00 177.43 173.44 1ofr n SER 285 N -2.36 0.68 -3.03 5.81 3.41 -1.21 -4.83 113.62 112.09 1ofr n SER 285 Ca 0.05 0.03 -0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1ofr n SER 285 Cb 0.41 0.42 -0.00 0.00 -0.26 0.00 0.00 64.21 64.77 1ofr n SER 285 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ofr n ASN 286 N -2.11 -7.00 0.00 4.04 5.15 -1.19 -3.13 115.26 111.01 1ofr n ASN 286 Ca 0.02 0.77 0.00 0.00 -0.60 0.00 0.00 54.58 54.77 1ofr n ASN 286 Cb 0.45 -2.86 0.00 0.00 -0.53 0.00 0.00 39.78 36.84 1ofr n ASN 286 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 1ofr n LYS 287 N 1.14 0.00 -3.97 1.20 0.00 -1.26 -4.82 118.16 110.44 1ofr n LYS 287 Ca -0.01 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.94 1ofr n LYS 287 Cb 0.33 -0.11 -0.07 0.00 -0.00 0.00 0.00 35.03 35.18 1ofr n LYS 287 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1ofr s ASP 288 N 0.00 6.18 0.12 -5.58 -1.08 -1.18 -4.99 116.67 110.14 1ofr s ASP 288 Ca 0.00 0.40 0.26 0.00 -0.52 0.00 0.00 52.55 52.69 1ofr s ASP 288 Cb 0.00 -1.96 0.75 0.00 -1.46 0.00 0.00 42.92 40.26 1ofr s ASP 288 CO 0.00 0.39 1.66 2.22 0.52 0.00 0.00 175.17 179.96 1ofr n PHE 289 N 1.94 0.54 0.91 -5.34 -1.74 -1.26 -3.23 117.46 109.27 1ofr n PHE 289 Ca -0.19 0.16 0.12 0.00 -0.56 0.00 0.00 57.45 56.97 1ofr n PHE 289 Cb 0.55 -0.70 0.55 0.00 1.52 0.00 0.00 39.48 41.39 1ofr n PHE 289 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1ofr n ARG 290 N -1.98 0.06 -0.45 3.97 1.74 -1.26 -2.50 116.66 116.25 1ofr n ARG 290 Ca 0.05 0.07 0.06 0.00 -0.77 0.00 0.00 57.85 57.26 1ofr n ARG 290 Cb 0.40 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.59 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 -1.46 3.49 0.01 0.55 3.02 -1.20 -4.04 115.26 115.63 1ofr n ASN 291 Ca 0.07 -2.35 -0.21 0.00 -0.03 0.00 0.00 54.58 52.06 1ofr n ASN 291 Cb 0.27 -0.50 -0.14 0.00 -0.61 0.00 0.00 39.78 38.81 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 2.75 0.25 -0.06 3.52 4.20 -1.71 -2.87 115.11 121.19 1ofr h GLN 292 Ca 0.00 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.23 1ofr h GLN 292 Cb 1.13 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 29.06 1ofr h GLN 292 CO 0.19 1.21 -0.19 -1.35 -0.67 0.00 0.00 178.83 178.01 1ofr h PRO 293 N -0.29 0.10 -0.55 1.46 0.11 -1.80 -1.31 132.00 129.71 1ofr h PRO 293 Ca -0.29 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.68 1ofr h PRO 293 Cb 1.77 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.85 1ofr h PRO 293 CO 0.07 0.29 -0.09 0.87 -0.21 0.00 0.00 178.00 178.93 1ofr h LYS 294 N 0.09 1.03 -0.51 1.05 1.57 -1.76 -2.33 116.57 115.71 1ofr h LYS 294 Ca 0.02 -0.37 -0.12 0.00 -1.87 0.00 0.00 60.65 58.31 1ofr h LYS 294 Cb 0.39 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1ofr h LYS 294 CO 0.03 1.06 -0.15 0.28 -0.57 0.00 0.00 179.45 180.10 1ofr h VAL 295 N 0.92 1.27 -0.79 0.50 2.07 -1.15 -2.86 116.25 116.20 1ofr h VAL 295 Ca 0.15 -1.31 0.12 0.00 0.82 0.00 0.00 66.70 66.48 1ofr h VAL 295 Cb 0.65 1.04 -0.08 0.00 -1.52 0.00 0.00 31.29 31.38 1ofr h VAL 295 CO 0.05 0.46 0.41 -1.13 0.02 0.00 0.00 177.57 177.37 1ofr h ASN 296 N 0.87 0.52 0.68 0.57 -1.24 -1.00 -1.41 115.58 114.56 1ofr h ASN 296 Ca 0.13 0.07 -0.03 0.00 0.71 0.00 0.00 56.30 57.18 1ofr h ASN 296 Cb 0.72 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.75 1ofr h ASN 296 CO 0.06 0.26 -0.49 0.44 -1.29 0.00 0.00 177.43 176.41 1ofr h ASP 297 N 0.64 -1.27 -1.02 1.15 3.32 -1.20 0.59 116.42 118.62 1ofr h ASP 297 Ca 0.41 0.08 0.25 0.00 0.02 0.00 0.00 57.03 57.79 1ofr h ASP 297 Cb 0.50 0.39 -0.10 0.00 0.22 0.00 0.00 39.33 40.34 1ofr h ASP 297 CO -0.31 -0.71 0.64 0.58 -1.72 0.00 0.00 179.24 177.72 1ofr h VAL 298 N -1.11 0.55 0.13 -1.35 2.07 -1.29 0.18 116.25 115.43 1ofr h VAL 298 Ca -0.09 -0.17 -0.26 0.00 0.82 0.00 0.00 66.70 67.00 1ofr h VAL 298 Cb 0.91 0.01 0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1ofr h VAL 298 CO 0.04 0.09 -1.09 0.58 0.02 0.00 0.00 177.57 177.22 1ofr h VAL 299 N 0.49 1.36 -0.90 2.57 2.07 -0.94 -3.07 116.25 117.83 1ofr h VAL 299 Ca 0.61 -2.46 0.09 0.00 0.82 0.00 0.00 66.70 65.76 1ofr h VAL 299 Cb 1.35 2.87 -0.07 0.00 -1.52 0.00 0.00 31.29 33.91 1ofr h VAL 299 CO -0.36 0.73 0.55 0.00 0.02 0.00 0.00 177.57 178.51 1ofr h GLU 301 N 0.93 -0.65 -1.01 0.00 4.81 -1.17 0.23 114.58 117.71 1ofr h GLU 301 Ca 0.43 0.04 0.38 0.00 -0.13 0.00 0.00 59.36 60.08 1ofr h GLU 301 Cb 0.35 0.15 -0.16 0.00 0.63 0.00 0.00 28.75 29.71 1ofr h GLU 301 CO -0.23 -0.43 0.56 1.96 -0.73 0.00 0.00 179.01 180.14 1ofr h GLN 302 N -0.72 0.15 -0.00 1.92 4.20 -1.38 0.59 115.11 119.86 1ofr h GLN 302 Ca -0.07 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1ofr h GLN 302 Cb 0.52 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.27 1ofr h GLN 302 CO 0.11 0.10 -0.00 0.82 -0.67 0.00 0.00 178.83 179.19 1ofr h ILE 303 N 0.15 1.35 -0.02 2.54 2.04 -0.72 -0.96 117.51 121.89 1ofr h ILE 303 Ca 0.80 -1.03 0.03 0.00 1.00 0.00 0.00 64.86 65.66 1ofr h ILE 303 Cb 2.00 2.04 -0.05 0.00 -0.74 0.00 0.00 36.82 40.08 1ofr h ILE 303 CO -0.69 0.27 -0.25 0.00 0.00 0.00 0.00 178.15 177.48 1ofr h ALA 304 N 0.56 -0.32 0.00 1.87 0.00 0.34 -0.24 119.26 121.47 1ofr h ALA 304 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ofr h ALA 304 Cb 0.44 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1ofr h ALA 304 CO 0.00 -0.75 0.00 0.09 0.00 0.00 0.00 179.25 178.59 1ofr n ASN 305 N -5.37 0.00 -0.20 0.00 4.13 0.73 -3.93 115.26 110.62 1ofr n ASN 305 Ca -0.04 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.22 1ofr n ASN 305 Cb 0.28 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.52 1ofr n ASN 305 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ofr n GLY 306 N -0.57 0.95 3.59 7.41 0.00 -0.11 -5.04 105.19 111.42 1ofr n GLY 306 Ca 0.00 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.19 3.76 0.01 1.61 2.56 -0.37 -4.91 118.70 118.18 1ofr s GLU 307 Ca 0.00 0.38 0.23 0.00 0.00 0.00 0.00 54.97 55.58 1ofr s GLU 307 Cb 0.00 -3.82 0.12 0.00 2.00 0.00 0.00 34.13 32.44 1ofr s GLU 307 CO 0.00 -0.90 1.13 0.09 -0.56 0.00 0.00 175.26 175.01 1ofr n ASN 308 N 6.57 0.70 0.16 -1.70 3.02 -1.26 -4.01 115.26 118.73 1ofr n ASN 308 Ca 0.04 -0.51 0.03 0.00 -0.03 0.00 0.00 54.58 54.12 1ofr n ASN 308 Cb 0.48 0.67 0.21 0.00 -0.61 0.00 0.00 39.78 40.53 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 2.88 0.87 -1.04 5.41 0.00 -1.97 -3.39 119.26 122.02 1ofr h ALA 309 Ca 0.00 -0.44 -0.64 0.00 0.00 0.00 0.00 54.91 53.83 1ofr h ALA 309 Cb 0.56 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.18 1ofr h ALA 309 CO 0.00 0.61 1.77 0.42 0.00 0.00 0.00 179.25 182.05 1ofr s ILE 310 N -3.40 4.05 -0.59 0.00 1.01 -1.26 -1.82 121.20 119.20 1ofr s ILE 310 Ca 0.01 -1.31 0.24 0.00 0.00 0.00 0.00 60.65 59.59 1ofr s ILE 310 Cb 0.10 -5.11 0.19 0.00 0.01 0.00 0.00 42.46 37.65 1ofr s ILE 310 CO 0.72 -1.96 1.51 0.71 0.00 0.00 0.00 174.94 175.92 1ofr h THR 311 N 6.21 0.00 -2.99 2.92 1.35 -1.63 -3.47 112.91 115.30 1ofr h THR 311 Ca 0.31 -0.64 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 1ofr h THR 311 Cb 0.95 1.45 -0.12 0.00 -1.73 0.00 0.00 68.15 68.70 1ofr h THR 311 CO 1.43 0.00 0.21 -0.83 -0.25 0.00 0.00 175.52 176.08 1ofr s GLY 312 N -3.82 -0.59 0.10 5.82 0.00 -0.91 -1.28 107.32 106.65 1ofr s GLY 312 Ca 0.07 0.45 0.01 0.00 0.00 0.00 0.00 44.72 45.24 1ofr s GLY 312 CO 0.67 0.15 -0.03 -1.34 0.00 0.00 0.00 173.10 172.55 1ofr s VAL 313 N -3.76 0.50 -0.10 1.40 -7.23 -0.34 -0.66 120.40 110.22 1ofr s VAL 313 Ca 0.02 -1.91 0.00 0.00 -1.81 0.00 0.00 61.98 58.28 1ofr s VAL 313 Cb -0.01 -1.75 0.02 0.00 0.56 0.00 0.00 36.38 35.20 1ofr s VAL 313 CO -0.12 -0.80 -0.08 -0.32 -0.31 0.00 0.00 175.10 173.48 1ofr s MET 314 N -3.89 1.45 0.10 4.82 1.75 -0.63 -1.92 119.30 120.97 1ofr s MET 314 Ca 0.14 -0.25 0.09 0.00 -1.25 0.00 0.00 55.69 54.43 1ofr s MET 314 Cb 0.06 -1.46 -0.04 0.00 2.84 0.00 0.00 34.83 36.24 1ofr s MET 314 CO -0.04 -0.20 -0.22 0.42 -0.65 0.00 0.00 175.02 174.33 1ofr s ILE 315 N 1.47 2.54 -0.38 10.11 1.09 -0.83 -1.78 121.20 133.43 1ofr s ILE 315 Ca 0.00 -1.54 -0.01 0.00 -1.10 0.00 0.00 60.65 58.00 1ofr s ILE 315 Cb -0.13 -2.12 0.10 0.00 -1.06 0.00 0.00 42.46 39.24 1ofr s ILE 315 CO -0.05 0.16 0.14 -1.61 -0.10 0.00 0.00 174.94 173.48 1ofr s GLU 316 N -1.91 1.93 0.26 2.79 2.02 -1.26 -2.60 118.70 119.93 1ofr s GLU 316 Ca 0.15 -1.76 0.03 0.00 0.02 0.00 0.00 54.97 53.42 1ofr s GLU 316 Cb -0.10 -3.44 -0.05 0.00 0.10 0.00 0.00 34.13 30.64 1ofr s GLU 316 CO 0.07 -0.98 0.03 -1.54 0.02 0.00 0.00 175.26 172.86 1ofr s SER 317 N 1.52 1.83 0.35 -0.19 1.04 -1.00 -2.14 113.70 115.12 1ofr s SER 317 Ca 0.07 -1.29 -0.03 0.00 0.48 0.00 0.00 55.95 55.18 1ofr s SER 317 Cb -0.21 0.02 0.00 0.00 0.10 0.00 0.00 66.02 65.93 1ofr s SER 317 CO -0.05 -0.58 0.48 0.21 0.98 0.00 0.00 173.24 174.29 1ofr s ASN 318 N -3.35 0.92 0.33 7.02 3.84 -0.85 -0.63 114.94 122.22 1ofr s ASN 318 Ca 0.32 -1.49 0.03 0.00 0.21 0.00 0.00 52.86 51.93 1ofr s ASN 318 Cb 0.07 0.67 0.61 0.00 -0.55 0.00 0.00 41.25 42.05 1ofr s ASN 318 CO 0.11 -1.31 1.94 0.40 -2.79 0.00 0.00 177.10 175.45 1ofr h ILE 319 N 2.10 1.06 -3.58 -5.21 2.04 -1.85 -2.57 117.51 109.51 1ofr h ILE 319 Ca -0.28 -0.32 -0.39 0.00 1.00 0.00 0.00 64.86 64.87 1ofr h ILE 319 Cb 1.24 0.05 -0.18 0.00 -0.74 0.00 0.00 36.82 37.20 1ofr h ILE 319 CO 0.39 0.17 -0.75 0.20 0.00 0.00 0.00 178.15 178.15 1ofr s ASN 320 N -6.12 1.90 0.91 1.72 -0.87 -0.49 -2.70 114.94 109.28 1ofr s ASN 320 Ca -0.11 -0.83 -0.12 0.00 -1.57 0.00 0.00 52.86 50.23 1ofr s ASN 320 Cb 0.19 -0.05 0.18 0.00 -0.02 0.00 0.00 41.25 41.56 1ofr s ASN 320 CO 0.79 -0.18 1.25 -1.83 -2.57 0.00 0.00 177.10 174.55 1ofr s GLU 321 N -2.78 0.88 3.02 -0.60 -1.05 -1.26 -4.52 118.70 112.39 1ofr s GLU 321 Ca 0.09 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.32 1ofr s GLU 321 Cb -0.04 -1.96 0.00 0.00 -0.44 0.00 0.00 34.13 31.69 1ofr s GLU 321 CO 0.02 -2.19 0.00 0.41 0.95 0.00 0.00 175.26 174.45 1ofr n GLY 322 N -3.55 -0.27 0.42 -3.83 0.00 -0.75 -4.84 105.19 92.39 1ofr n GLY 322 Ca 0.15 -1.12 -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 1.45 -0.17 -3.55 1.61 6.94 -1.26 -2.35 115.26 117.93 1ofr n ASN 323 Ca 0.00 -1.07 -0.07 0.00 -0.02 0.00 0.00 54.58 53.42 1ofr n ASN 323 Cb 0.00 0.27 -0.02 0.00 -2.36 0.00 0.00 39.78 37.66 1ofr n ASN 323 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ofr s GLN 324 N -2.00 0.57 0.65 -3.83 -2.07 -1.13 -4.96 119.66 106.89 1ofr s GLN 324 Ca 0.03 -0.16 0.02 0.00 -1.82 0.00 0.00 55.36 53.43 1ofr s GLN 324 Cb -0.00 0.26 0.10 0.00 -1.09 0.00 0.00 33.01 32.28 1ofr s GLN 324 CO 0.00 -0.24 0.90 0.20 -1.32 0.00 0.00 175.29 174.83 1ofr s GLY 325 N -2.13 1.77 -0.14 2.60 0.00 -1.26 -4.37 107.32 103.79 1ofr s GLY 325 Ca 0.06 -1.73 -0.29 0.00 0.00 0.00 0.00 44.72 42.76 1ofr s GLY 325 CO -0.06 -1.25 1.04 -0.42 0.00 0.00 0.00 173.10 172.41 1ofr s ILE 326 N -2.95 4.69 0.88 0.90 1.01 -1.26 -5.01 121.20 119.45 1ofr s ILE 326 Ca 0.63 1.98 -0.10 0.00 0.00 0.00 0.00 60.65 63.16 1ofr s ILE 326 Cb -0.07 -4.27 0.12 0.00 0.01 0.00 0.00 42.46 38.25 1ofr s ILE 326 CO 0.42 -0.05 1.13 -2.84 0.00 0.00 0.00 174.94 173.59 1ofr s PRO 327 N 2.39 1.36 0.22 2.79 0.02 -1.26 -4.85 135.00 135.68 1ofr s PRO 327 Ca 0.48 1.40 -0.09 0.00 0.02 0.00 0.00 61.00 62.81 1ofr s PRO 327 Cb -0.18 -1.78 0.33 0.00 0.02 0.00 0.00 34.50 32.89 1ofr s PRO 327 CO 0.15 -2.34 1.69 0.00 -0.33 0.00 0.00 177.00 176.17 1ofr h ALA 328 N -1.65 0.73 0.00 -1.55 0.00 -1.95 0.29 119.26 115.13 1ofr h ALA 328 Ca -0.44 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ofr h ALA 328 Cb 1.26 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1ofr h ALA 328 CO 0.45 -0.33 0.00 0.39 0.00 0.00 0.00 179.25 179.76 1ofr n GLU 329 N -5.17 0.50 0.00 0.00 4.71 -1.26 -4.96 120.64 114.46 1ofr n GLU 329 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.25 1ofr n GLU 329 Cb 0.36 -1.07 0.00 0.00 -1.01 0.00 0.00 31.44 29.71 1ofr n GLU 329 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ofr n GLY 330 N 0.07 0.36 0.00 0.62 0.00 0.10 -3.01 105.19 103.33 1ofr n GLY 330 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.11 1ofr n GLY 330 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ofr n LYS 331 N -0.37 0.00 0.11 1.61 4.81 -1.21 -1.21 118.16 121.90 1ofr n LYS 331 Ca 0.00 0.06 -0.24 0.00 -0.87 0.00 0.00 58.31 57.26 1ofr n LYS 331 Cb 0.00 -1.62 -0.15 0.00 0.02 0.00 0.00 35.03 33.27 1ofr n LYS 331 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ofr h ALA 332 N 0.67 -0.01 -0.99 3.14 0.00 -1.89 -3.36 119.26 116.83 1ofr h ALA 332 Ca 0.00 -0.99 -0.66 0.00 0.00 0.00 0.00 54.91 53.26 1ofr h ALA 332 Cb 0.25 0.31 -0.30 0.00 0.00 0.00 0.00 17.79 18.06 1ofr h ALA 332 CO 0.00 0.84 0.79 0.41 0.00 0.00 0.00 179.25 181.29 1ofr n GLY 333 N 1.79 5.82 3.88 0.00 0.00 -0.35 -4.99 105.19 111.34 1ofr n GLY 333 Ca -0.21 -2.25 -0.33 0.00 0.00 0.00 0.00 46.02 43.23 1ofr n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ofr s LEU 334 N -3.79 4.32 -0.04 0.99 1.43 -1.26 -4.68 118.68 115.65 1ofr s LEU 334 Ca 0.64 0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 54.11 1ofr s LEU 334 Cb 0.50 -3.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.66 1ofr s LEU 334 CO -0.00 0.14 0.97 -0.54 0.23 0.00 0.00 176.35 177.15 1ofr s LYS 335 N -2.16 4.50 0.40 1.70 1.02 -1.26 -5.01 119.74 118.94 1ofr s LYS 335 Ca 0.35 1.37 -0.27 0.00 0.02 0.00 0.00 55.97 57.45 1ofr s LYS 335 Cb -0.13 -3.49 -0.10 0.00 -0.52 0.00 0.00 37.83 33.59 1ofr s LYS 335 CO 0.20 -0.14 1.38 0.98 -0.92 0.00 0.00 175.35 176.86 1ofr n TYR 336 N 4.28 2.56 -2.59 3.18 9.36 -1.26 -2.99 117.16 129.70 1ofr n TYR 336 Ca 0.06 0.48 -0.12 0.00 3.32 0.00 0.00 57.90 61.64 1ofr n TYR 336 Cb 0.50 -2.45 -0.00 0.00 -0.63 0.00 0.00 39.34 36.76 1ofr n TYR 336 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ofr n GLY 337 N 0.64 -0.50 3.02 2.98 0.00 -1.26 -4.67 105.19 105.39 1ofr n GLY 337 Ca 0.04 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.58 2.20 0.14 1.61 1.01 -1.16 -1.40 120.40 120.21 1ofr s VAL 338 Ca 0.06 -2.16 -0.34 0.00 0.00 0.00 0.00 61.98 59.54 1ofr s VAL 338 Cb -0.03 -2.56 -0.17 0.00 0.00 0.00 0.00 36.38 33.62 1ofr s VAL 338 CO 0.08 -0.49 1.04 -0.24 0.00 0.00 0.00 175.10 175.49 1ofr n SER 339 N 4.31 0.63 -1.76 3.32 2.88 -1.26 -4.62 113.62 117.12 1ofr n SER 339 Ca 0.00 1.14 0.05 0.00 -1.33 0.00 0.00 58.87 58.73 1ofr n SER 339 Cb 0.42 -1.11 0.35 0.00 -0.75 0.00 0.00 64.21 63.13 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 1.29 2.49 0.00 2.46 -5.35 -1.26 -2.85 119.36 116.14 1ofr n ILE 340 Ca 0.17 -1.27 0.00 0.00 -0.27 0.00 0.00 62.75 61.38 1ofr n ILE 340 Cb 0.21 -0.32 0.00 0.00 -1.74 0.00 0.00 39.64 37.79 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 0.48 0.00 -1.97 7.28 -2.24 -1.26 -4.79 114.28 111.79 1ofr n THR 341 Ca 0.26 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.74 1ofr n THR 341 Cb 1.12 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 69.36 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 6.20 0.45 3.42 1.01 -1.26 -4.78 116.67 122.71 1ofr s ASP 342 Ca 0.00 1.35 -0.21 0.00 0.71 0.00 0.00 52.55 54.39 1ofr s ASP 342 Cb 0.00 -2.42 -0.09 0.00 1.01 0.00 0.00 42.92 41.42 1ofr s ASP 342 CO 0.00 -0.85 1.03 0.00 0.21 0.00 0.00 175.17 175.55 1ofr s ALA 343 N -3.13 2.96 0.20 5.23 0.00 -1.26 -4.74 121.76 121.02 1ofr s ALA 343 Ca 0.54 0.60 0.05 0.00 0.00 0.00 0.00 51.96 53.16 1ofr s ALA 343 Cb -0.11 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 1ofr s ALA 343 CO 0.53 -0.21 -0.07 0.00 0.00 0.00 0.00 175.76 176.00 1ofr s ILE 345 N -3.25 4.65 1.32 0.00 -4.36 -0.91 -1.80 121.20 116.85 1ofr s ILE 345 Ca 0.23 1.06 -0.20 0.00 -0.26 0.00 0.00 60.65 61.48 1ofr s ILE 345 Cb 0.03 -3.70 0.31 0.00 1.25 0.00 0.00 42.46 40.35 1ofr s ILE 345 CO 0.06 -0.04 0.73 0.61 0.24 0.00 0.00 174.94 176.54 1ofr n GLY 346 N 0.04 -3.28 0.21 6.27 0.00 -1.26 -2.00 105.19 105.16 1ofr n GLY 346 Ca 0.01 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.50 1ofr n GLY 346 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1ofr h TRP 347 N -3.25 0.85 0.64 1.61 2.91 -1.24 -2.55 115.95 114.92 1ofr h TRP 347 Ca -0.40 -0.28 -0.03 0.00 1.13 0.00 0.00 58.89 59.31 1ofr h TRP 347 Cb 1.20 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 29.69 1ofr h TRP 347 CO -2.96 1.04 -0.36 0.93 -1.03 0.00 0.00 178.44 176.06 1ofr h GLU 348 N 0.41 -0.90 -0.99 2.65 3.07 -1.89 0.15 114.58 117.08 1ofr h GLU 348 Ca 0.03 0.06 0.29 0.00 -0.50 0.00 0.00 59.36 59.23 1ofr h GLU 348 Cb 0.95 0.20 -0.04 0.00 -0.84 0.00 0.00 28.75 29.02 1ofr h GLU 348 CO 0.08 -0.60 0.80 1.15 -1.40 0.00 0.00 179.01 179.04 1ofr h THR 349 N -0.93 0.36 0.15 1.13 2.02 -1.90 0.32 112.91 114.05 1ofr h THR 349 Ca -0.08 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.85 1ofr h THR 349 Cb 0.74 0.42 0.02 0.00 -1.74 0.00 0.00 68.15 67.59 1ofr h THR 349 CO 0.10 0.00 -1.18 0.74 0.37 0.00 0.00 175.52 175.56 1ofr h THR 350 N 0.00 1.28 -0.24 3.16 2.02 -0.64 -2.53 112.91 115.97 1ofr h THR 350 Ca 0.47 -2.52 0.01 0.00 0.77 0.00 0.00 66.41 65.15 1ofr h THR 350 Cb 2.06 2.99 -0.01 0.00 -1.74 0.00 0.00 68.15 71.45 1ofr h THR 350 CO -0.00 0.74 0.16 -0.08 0.37 0.00 0.00 175.52 176.70 1ofr h GLU 351 N -0.24 0.26 0.00 6.66 4.81 0.12 -1.47 114.58 124.72 1ofr h GLU 351 Ca -0.23 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1ofr h GLU 351 Cb 1.79 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 31.11 1ofr h GLU 351 CO 0.14 0.17 0.00 -0.25 -0.73 0.00 0.00 179.01 178.34 1ofr n ASP 352 N -4.50 0.00 -0.31 1.04 8.00 -0.44 -1.92 116.55 118.42 1ofr n ASP 352 Ca 0.01 0.49 0.26 0.00 0.71 0.00 0.00 54.79 56.26 1ofr n ASP 352 Cb 0.12 -0.08 0.43 0.00 -0.02 0.00 0.00 41.12 41.57 1ofr n ASP 352 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1ofr n VAL 353 N -0.73 -0.14 -0.02 2.53 0.31 -0.95 -0.15 118.33 119.19 1ofr n VAL 353 Ca 0.00 1.08 -0.16 0.00 -0.01 0.00 0.00 64.34 65.25 1ofr n VAL 353 Cb 0.00 -1.78 -0.12 0.00 -0.91 0.00 0.00 33.84 31.03 1ofr n VAL 353 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ofr h LEU 354 N 0.00 0.26 -0.65 7.52 3.38 -1.22 -2.62 115.31 121.98 1ofr h LEU 354 Ca 0.55 -0.85 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 1ofr h LEU 354 Cb 1.82 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.46 1ofr h LEU 354 CO -0.25 1.08 0.35 0.03 0.09 0.00 0.00 178.44 179.73 1ofr h ARG 355 N -0.53 0.92 0.00 1.13 3.08 0.16 0.39 114.38 119.52 1ofr h ARG 355 Ca -0.05 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 1ofr h ARG 355 Cb 1.15 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 31.03 1ofr h ARG 355 CO 0.07 0.70 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.44 1ofr h LYS 356 N 0.89 0.00 0.00 0.04 1.63 -1.44 0.39 116.57 118.08 1ofr h LYS 356 Ca 0.23 0.00 -0.19 0.00 -0.85 0.00 0.00 60.65 59.84 1ofr h LYS 356 Cb 0.06 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 1ofr h LYS 356 CO -0.03 0.01 -1.73 -0.11 -3.45 0.00 0.00 179.45 174.14 1ofr n LEU 357 N -3.31 0.54 0.05 5.20 0.00 -0.17 -2.88 117.00 116.43 1ofr n LEU 357 Ca -0.03 0.24 -0.20 0.00 0.00 0.00 0.00 56.01 56.02 1ofr n LEU 357 Cb 0.11 0.16 -0.10 0.00 0.00 0.00 0.00 43.42 43.58 1ofr n LEU 357 CO 0.23 0.21 0.07 0.00 0.00 0.00 0.00 177.39 177.90 1ofr h ALA 358 N 1.41 0.13 -0.65 1.96 0.00 0.12 -2.09 119.26 120.14 1ofr h ALA 358 Ca -0.23 -0.71 0.07 0.00 0.00 0.00 0.00 54.91 54.05 1ofr h ALA 358 Cb 1.65 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 1ofr h ALA 358 CO 0.04 0.70 0.33 0.00 0.00 0.00 0.00 179.25 180.32 1ofr h ALA 359 N 0.42 0.88 0.00 0.00 0.00 -0.41 0.36 119.26 120.51 1ofr h ALA 359 Ca -0.13 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1ofr h ALA 359 Cb 1.72 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1ofr h ALA 359 CO 0.21 -0.04 -0.37 0.00 0.00 0.00 0.00 179.25 179.05 1ofr h ALA 360 N 1.38 1.33 -0.15 0.00 0.00 -1.45 -1.87 119.26 118.49 1ofr h ALA 360 Ca 0.31 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1ofr h ALA 360 Cb 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ofr h ALA 360 CO -0.22 0.47 -0.44 0.28 0.00 0.00 0.00 179.25 179.34 1ofr h VAL 361 N 0.00 1.35 0.13 0.00 2.07 -0.27 -1.84 116.25 117.68 1ofr h VAL 361 Ca -0.00 -1.71 0.01 0.00 0.82 0.00 0.00 66.70 65.82 1ofr h VAL 361 Cb 0.68 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1ofr h VAL 361 CO 0.05 0.52 -0.18 0.03 0.02 0.00 0.00 177.57 178.01 1ofr h ARG 362 N 0.21 -0.35 -0.48 1.57 3.08 -0.98 -0.94 114.38 116.48 1ofr h ARG 362 Ca -0.01 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.13 1ofr h ARG 362 Cb 1.05 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 1ofr h ARG 362 CO 0.09 -0.23 0.33 0.37 -1.07 0.00 0.00 179.97 179.46 1ofr h GLN 363 N -0.36 0.35 0.00 0.04 5.75 -1.34 0.11 115.11 119.65 1ofr h GLN 363 Ca 0.02 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.37 1ofr h GLN 363 Cb 0.37 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 1ofr h GLN 363 CO -0.08 0.23 -0.59 -0.09 -2.65 0.00 0.00 178.83 175.65 1ofr h ARG 364 N 0.36 0.00 0.00 1.69 2.43 -0.76 -2.51 114.38 115.59 1ofr h ARG 364 Ca 0.21 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.33 1ofr h ARG 364 Cb 0.39 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1ofr h ARG 364 CO -0.05 0.59 -0.28 -0.09 -1.51 0.00 0.00 179.97 178.63 1ofr h ARG 365 N 0.00 0.00 0.35 0.20 2.43 0.55 -2.99 114.38 114.93 1ofr h ARG 365 Ca -0.01 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1ofr h ARG 365 Cb 1.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1ofr h ARG 365 CO 0.08 0.28 -0.17 1.49 -1.51 0.00 0.00 179.97 180.14 1ofr h GLU 366 N 0.00 -0.45 0.00 0.20 4.57 -0.99 -3.06 114.58 114.85 1ofr h GLU 366 Ca -0.00 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1ofr h GLU 366 Cb 0.52 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1ofr h GLU 366 CO 0.04 -0.30 0.06 0.28 -1.18 0.00 0.00 179.01 177.91 1ofr n VAL 367 N -4.71 0.44 0.29 0.32 0.31 -0.98 0.29 118.33 114.29 1ofr n VAL 367 Ca -0.06 0.17 0.03 0.00 -0.01 0.00 0.00 64.34 64.48 1ofr n VAL 367 Cb 0.19 -1.17 -0.00 0.00 -0.91 0.00 0.00 33.84 31.94 1ofr n VAL 367 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1ofr n ASN 368 N -0.99 0.90 -4.73 4.52 5.03 -1.13 -4.96 115.26 113.89 1ofr n ASN 368 Ca 0.00 -0.95 -0.33 0.00 0.87 0.00 0.00 54.58 54.17 1ofr n ASN 368 Cb 0.06 0.53 0.09 0.00 -1.02 0.00 0.00 39.78 39.45 1ofr n ASN 368 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1ofr s LYS 369 N -1.12 2.17 0.00 3.52 -0.14 0.14 -5.09 119.74 119.23 1ofr s LYS 369 Ca 0.05 1.57 0.00 0.00 -1.36 0.00 0.00 55.97 56.23 1ofr s LYS 369 Cb 0.05 -1.86 0.00 0.00 -1.68 0.00 0.00 37.83 34.35 1ofr s LYS 369 CO 0.18 -1.77 0.00 1.63 -0.76 0.00 0.00 175.35 174.63