#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddk n TRP 16 N 0.00 -0.52 0.00 0.54 -0.00 -1.26 -5.05 117.44 111.15 2ddk n TRP 16 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 2ddk n TRP 16 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 2ddk n TRP 16 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 2ddk n GLU 17 N 0.00 0.00 -0.28 5.87 2.13 -1.26 -0.22 120.64 126.88 2ddk n GLU 17 Ca 0.00 0.00 0.10 0.00 0.66 0.00 0.00 57.16 57.92 2ddk n GLU 17 Cb 0.00 0.00 0.24 0.00 0.27 0.00 0.00 31.44 31.95 2ddk n GLU 17 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2ddk h GLU 18 N 0.00 0.18 0.00 5.31 4.22 -2.00 0.32 114.58 122.61 2ddk h GLU 18 Ca 0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.43 2ddk h GLU 18 Cb 0.00 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2ddk h GLU 18 CO 0.00 0.12 -0.38 0.00 -2.18 0.00 0.00 179.01 176.57 2ddk h PHE 20 N 0.00 0.73 0.00 0.00 3.57 -0.19 -1.60 116.94 119.45 2ddk h PHE 20 Ca -0.00 -0.30 -0.05 0.00 3.53 0.00 0.00 57.97 61.15 2ddk h PHE 20 Cb 1.01 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 2ddk h PHE 20 CO 0.00 1.07 -0.23 1.96 -2.23 0.00 0.00 178.31 178.89 2ddk h GLN 21 N 0.40 0.00 -0.32 1.11 1.08 -0.99 -2.41 115.11 113.98 2ddk h GLN 21 Ca -0.02 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.03 2ddk h GLN 21 Cb 1.26 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.68 2ddk h GLN 21 CO 0.13 0.23 -0.38 0.00 -0.95 0.00 0.00 178.83 177.85 2ddk h ALA 22 N 1.77 0.72 -0.27 3.87 0.00 -1.38 -2.75 119.26 121.22 2ddk h ALA 22 Ca -0.00 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 2ddk h ALA 22 Cb 0.85 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ddk h ALA 22 CO 0.03 0.66 -0.18 0.00 0.00 0.00 0.00 179.25 179.76 2ddk h ALA 23 N 0.94 0.38 0.28 0.00 0.00 -0.93 -2.29 119.26 117.63 2ddk h ALA 23 Ca 0.05 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2ddk h ALA 23 Cb 0.93 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2ddk h ALA 23 CO 0.09 0.31 -0.24 0.28 0.00 0.00 0.00 179.25 179.68 2ddk h VAL 24 N 0.32 0.49 -0.36 0.00 2.07 -1.42 0.63 116.25 118.00 2ddk h VAL 24 Ca 0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 2ddk h VAL 24 Cb 0.72 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2ddk h VAL 24 CO 0.05 0.00 0.16 1.56 0.02 0.00 0.00 177.57 179.36 2ddk h GLN 25 N -0.53 0.52 -0.69 1.57 1.08 -1.56 0.27 115.11 115.76 2ddk h GLN 25 Ca -0.01 -0.08 0.02 0.00 -1.45 0.00 0.00 58.65 57.12 2ddk h GLN 25 Cb 0.48 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.78 2ddk h GLN 25 CO -0.03 0.49 0.45 -0.07 -0.95 0.00 0.00 178.83 178.71 2ddk h LEU 26 N 0.43 0.76 -0.59 1.46 -0.00 -1.27 1.46 115.31 117.55 2ddk h LEU 26 Ca 0.12 -0.01 0.03 0.00 -0.00 0.00 0.00 57.88 58.02 2ddk h LEU 26 Cb 0.15 -0.18 -0.04 0.00 -0.00 0.00 0.00 40.66 40.59 2ddk h LEU 26 CO -0.01 0.54 0.35 0.00 -0.00 0.00 0.00 178.44 179.32 2ddk h ALA 27 N 1.27 0.77 -0.41 1.53 0.00 0.81 0.25 119.26 123.48 2ddk h ALA 27 Ca 0.26 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2ddk h ALA 27 Cb -0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2ddk h ALA 27 CO -0.08 0.07 0.04 -0.07 0.00 0.00 0.00 179.25 179.22 2ddk h LEU 28 N 0.69 0.67 0.26 0.00 3.38 0.17 0.35 115.31 120.83 2ddk h LEU 28 Ca 0.24 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2ddk h LEU 28 Cb 0.05 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2ddk h LEU 28 CO -0.11 0.78 -0.12 -0.09 0.09 0.00 0.00 178.44 178.99 2ddk h ARG 29 N 0.54 -0.34 -1.01 1.13 2.43 0.24 0.22 114.38 117.59 2ddk h ARG 29 Ca 0.12 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 2ddk h ARG 29 Cb 0.41 0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 2ddk h ARG 29 CO 0.01 -0.13 0.67 0.00 -1.51 0.00 0.00 179.97 179.01 2ddk h ALA 30 N 0.23 1.28 -0.62 2.80 0.00 -0.97 0.10 119.26 122.08 2ddk h ALA 30 Ca -0.04 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.89 2ddk h ALA 30 Cb 0.36 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2ddk h ALA 30 CO 0.06 0.65 0.41 0.78 0.00 0.00 0.00 179.25 181.15 2ddk h GLY 31 N 1.35 0.70 1.81 0.00 0.00 0.31 -0.98 103.07 106.26 2ddk h GLY 31 Ca 0.37 -0.21 -0.23 0.00 0.00 0.00 0.00 47.33 47.26 2ddk h GLY 31 CO -0.09 0.14 -1.13 -1.61 0.00 0.00 0.00 176.54 173.85 2ddk h GLN 32 N 0.52 0.00 -0.27 4.80 4.15 0.11 -3.07 115.11 121.35 2ddk h GLN 32 Ca 0.28 -0.01 -0.19 0.00 0.77 0.00 0.00 58.65 59.50 2ddk h GLN 32 Cb 0.42 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.11 2ddk h GLN 32 CO -0.08 0.91 -0.58 0.82 -1.93 0.00 0.00 178.83 177.97 2ddk h ILE 33 N 0.00 1.27 0.00 2.39 2.04 0.38 -3.06 117.51 120.53 2ddk h ILE 33 Ca -0.06 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.04 2ddk h ILE 33 Cb 1.82 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 39.57 2ddk h ILE 33 CO 0.12 0.57 -0.59 2.30 0.00 0.00 0.00 178.15 180.55 2ddk n ILE 34 N -4.00 0.29 0.06 -0.67 -5.35 -0.57 -3.12 119.36 106.00 2ddk n ILE 34 Ca -0.05 -0.23 -0.13 0.00 -0.27 0.00 0.00 62.75 62.08 2ddk n ILE 34 Cb 0.65 -0.08 -0.09 0.00 -1.74 0.00 0.00 39.64 38.38 2ddk n ILE 34 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2ddk h ARG 35 N 0.00 -0.16 -0.07 6.28 2.43 -1.50 -0.78 114.38 120.58 2ddk h ARG 35 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2ddk h ARG 35 Cb 0.70 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 2ddk h ARG 35 CO 0.00 0.22 0.00 0.36 -1.51 0.00 0.00 179.97 179.04 2ddk n LYS 36 N -4.98 1.37 -0.02 0.20 -0.00 -1.16 -2.74 118.16 110.83 2ddk n LYS 36 Ca -0.09 -0.55 0.07 0.00 -0.00 0.00 0.00 58.31 57.75 2ddk n LYS 36 Cb 0.24 -1.38 -0.17 0.00 -0.00 0.00 0.00 35.03 33.72 2ddk n LYS 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ddk n ALA 37 N -0.26 2.57 -1.43 0.58 0.00 -1.14 -4.22 120.51 116.62 2ddk n ALA 37 Ca 0.17 -0.66 -0.25 0.00 0.00 0.00 0.00 53.44 52.69 2ddk n ALA 37 Cb 0.21 -0.66 -0.07 0.00 0.00 0.00 0.00 19.45 18.93 2ddk n ALA 37 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2ddk n LEU 38 N -2.36 6.40 -0.54 0.00 7.94 -0.31 -5.05 117.00 123.08 2ddk n LEU 38 Ca -0.09 -3.97 0.00 0.00 -1.11 0.00 0.00 56.01 50.84 2ddk n LEU 38 Cb 0.67 -1.29 0.00 0.00 0.53 0.00 0.00 43.42 43.34 2ddk n LEU 38 CO 0.45 1.76 0.24 0.41 -1.11 0.00 0.00 177.39 179.15 2ddk n THR 39 N 1.31 0.00 0.64 1.96 -1.04 -1.26 -5.01 114.28 110.88 2ddk n THR 39 Ca 0.49 -0.04 0.07 0.00 -2.04 0.00 0.00 64.05 62.53 2ddk n THR 39 Cb 0.59 0.46 0.19 0.00 -1.82 0.00 0.00 70.33 69.75 2ddk n THR 39 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2ddk n ASP 52 N 0.02 2.29 -2.96 8.00 5.75 -1.26 -5.15 116.55 123.25 2ddk n ASP 52 Ca 0.00 -2.00 -0.24 0.00 -0.01 0.00 0.00 54.79 52.54 2ddk n ASP 52 Cb 0.69 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.46 2ddk n ASP 52 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2ddk n LEU 53 N 0.75 3.47 -0.28 -2.12 4.32 -1.26 -4.70 117.00 117.19 2ddk n LEU 53 Ca 0.14 -5.42 0.00 0.00 -0.02 0.00 0.00 56.01 50.72 2ddk n LEU 53 Cb 0.36 -0.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.97 2ddk n LEU 53 CO 0.10 2.31 0.37 0.55 -1.22 0.00 0.00 177.39 179.49 2ddk n VAL 54 N -0.12 0.01 0.21 4.08 3.14 -1.26 -3.58 118.33 120.81 2ddk n VAL 54 Ca 0.29 -0.00 0.02 0.00 -2.96 0.00 0.00 64.34 61.69 2ddk n VAL 54 Cb 0.49 -0.27 0.10 0.00 -1.06 0.00 0.00 33.84 33.11 2ddk n VAL 54 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2ddk n THR 55 N -0.22 0.14 0.43 1.55 -2.24 -1.26 -0.45 114.28 112.23 2ddk n THR 55 Ca 0.00 0.04 0.13 0.00 -2.27 0.00 0.00 64.05 61.95 2ddk n THR 55 Cb 0.14 -0.98 0.40 0.00 -2.10 0.00 0.00 70.33 67.79 2ddk n THR 55 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2ddk h GLU 56 N 0.00 0.00 -0.05 -0.78 4.11 -2.00 -1.99 114.58 113.87 2ddk h GLU 56 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.26 2ddk h GLU 56 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2ddk h GLU 56 CO 0.00 0.00 -0.72 1.15 0.07 0.00 0.00 179.01 179.51 2ddk h THR 57 N 0.00 1.42 -0.45 -1.06 2.02 -1.09 0.15 112.91 113.90 2ddk h THR 57 Ca 0.00 -2.22 -0.04 0.00 0.77 0.00 0.00 66.41 64.92 2ddk h THR 57 Cb 0.70 2.18 -0.02 0.00 -1.74 0.00 0.00 68.15 69.27 2ddk h THR 57 CO 0.00 0.66 0.13 -0.78 0.37 0.00 0.00 175.52 175.90 2ddk h ASP 58 N 0.18 0.66 -0.32 4.18 -0.00 -1.53 -0.99 116.42 118.60 2ddk h ASP 58 Ca -0.02 -0.21 -0.12 0.00 -0.00 0.00 0.00 57.03 56.67 2ddk h ASP 58 Cb 1.28 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 40.42 2ddk h ASP 58 CO 0.11 0.70 -0.23 0.45 -0.00 0.00 0.00 179.24 180.27 2ddk h HIS 59 N 0.59 0.92 -0.37 0.28 3.86 -1.25 -1.22 115.15 117.96 2ddk h HIS 59 Ca 0.14 -0.22 -0.15 0.00 -1.16 0.00 0.00 60.37 58.99 2ddk h HIS 59 Cb 0.28 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 2ddk h HIS 59 CO 0.01 0.96 -0.36 -0.07 0.86 0.00 0.00 177.93 179.33 2ddk h LEU 60 N 0.70 0.96 -0.00 2.43 3.38 -0.74 -1.92 115.31 120.13 2ddk h LEU 60 Ca 0.09 -0.46 -0.25 0.00 0.09 0.00 0.00 57.88 57.35 2ddk h LEU 60 Cb 0.76 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2ddk h LEU 60 CO 0.06 1.23 -1.11 -0.37 0.09 0.00 0.00 178.44 178.34 2ddk h VAL 61 N 0.71 1.48 0.00 1.22 -1.51 -1.17 -2.25 116.25 114.74 2ddk h VAL 61 Ca 0.06 -2.87 0.00 0.00 -1.23 0.00 0.00 66.70 62.66 2ddk h VAL 61 Cb 0.95 2.75 0.00 0.00 -2.13 0.00 0.00 31.29 32.87 2ddk h VAL 61 CO 0.09 0.84 0.00 1.21 -1.23 0.00 0.00 177.57 178.48 2ddk n GLU 62 N -3.59 0.00 -0.19 5.19 2.13 -0.46 -2.12 120.64 121.60 2ddk n GLU 62 Ca -0.07 0.46 -0.05 0.00 0.66 0.00 0.00 57.16 58.16 2ddk n GLU 62 Cb 0.95 -1.22 -0.04 0.00 0.27 0.00 0.00 31.44 31.40 2ddk n GLU 62 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2ddk n ASP 63 N -1.88 -0.47 -0.24 4.31 10.43 -0.72 0.24 116.55 128.21 2ddk n ASP 63 Ca 0.00 0.82 0.20 0.00 2.57 0.00 0.00 54.79 58.39 2ddk n ASP 63 Cb 0.00 -0.12 0.54 0.00 1.84 0.00 0.00 41.12 43.38 2ddk n ASP 63 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 2ddk h LEU 64 N 0.00 0.35 0.05 0.64 7.12 -1.46 0.22 115.31 122.24 2ddk h LEU 64 Ca 0.07 0.04 -0.22 0.00 0.13 0.00 0.00 57.88 57.90 2ddk h LEU 64 Cb 0.18 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.27 2ddk h LEU 64 CO -0.42 0.14 -1.14 -0.29 -0.13 0.00 0.00 178.44 176.60 2ddk h ILE 65 N 0.35 1.10 0.00 4.05 -0.00 0.36 -3.15 117.51 120.22 2ddk h ILE 65 Ca 0.47 -2.31 -0.06 0.00 -0.00 0.00 0.00 64.86 62.96 2ddk h ILE 65 Cb 1.25 2.64 -0.01 0.00 -0.00 0.00 0.00 36.82 40.71 2ddk h ILE 65 CO -0.16 0.55 -0.31 -0.29 -0.00 0.00 0.00 178.15 177.94 2ddk h ILE 66 N -0.66 0.99 -0.09 2.19 -0.00 -0.86 -2.29 117.51 116.78 2ddk h ILE 66 Ca -0.27 -1.14 -0.08 0.00 -0.00 0.00 0.00 64.86 63.36 2ddk h ILE 66 Cb 1.47 1.66 0.00 0.00 -0.00 0.00 0.00 36.82 39.96 2ddk h ILE 66 CO -0.05 0.30 -0.26 0.77 -0.00 0.00 0.00 178.15 178.91 2ddk h SER 67 N 0.00 0.40 1.30 2.19 4.64 -0.70 -1.36 113.55 120.01 2ddk h SER 67 Ca -0.00 -0.60 -0.02 0.00 -0.47 0.00 0.00 61.79 60.70 2ddk h SER 67 Cb 0.64 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2ddk h SER 67 CO 0.04 0.92 -0.11 -0.08 -0.87 0.00 0.00 176.83 176.73 2ddk h GLU 68 N -0.11 0.00 0.00 4.77 4.81 -1.48 -2.70 114.58 119.86 2ddk h GLU 68 Ca -0.01 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.97 2ddk h GLU 68 Cb 0.88 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.22 2ddk h GLU 68 CO 0.06 0.11 -1.46 -0.07 -0.73 0.00 0.00 179.01 176.92 2ddk h LEU 69 N 0.00 0.00 -0.66 1.64 4.07 -1.42 -2.91 115.31 116.02 2ddk h LEU 69 Ca -0.00 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.81 2ddk h LEU 69 Cb 0.79 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.52 2ddk h LEU 69 CO 0.01 0.95 -0.60 -0.09 -1.08 0.00 0.00 178.44 177.64 2ddk h ARG 70 N 0.00 0.24 0.10 1.13 2.43 -1.18 -0.90 114.38 116.20 2ddk h ARG 70 Ca -0.19 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2ddk h ARG 70 Cb 1.89 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.47 2ddk h ARG 70 CO 0.09 0.76 -0.05 1.49 -1.51 0.00 0.00 179.97 180.75 2ddk h GLU 71 N 0.18 -0.13 0.00 0.20 4.81 -1.58 -2.89 114.58 115.17 2ddk h GLU 71 Ca -0.00 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2ddk h GLU 71 Cb 1.10 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.50 2ddk h GLU 71 CO 0.09 0.36 -0.13 0.00 -0.73 0.00 0.00 179.01 178.60 2ddk h ARG 72 N -0.74 0.00 -2.20 1.92 3.08 -1.55 -3.37 114.38 111.52 2ddk h ARG 72 Ca -0.01 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.54 2ddk h ARG 72 Cb 0.56 0.00 -0.35 0.00 0.08 0.00 0.00 29.97 30.26 2ddk h ARG 72 CO 0.02 0.13 -0.83 -0.06 -1.07 0.00 0.00 179.97 178.16 2ddk s PHE 73 N -3.68 0.42 0.22 3.04 0.40 -0.34 -5.01 117.98 113.02 2ddk s PHE 73 Ca 0.01 -1.64 -0.05 0.00 -0.60 0.00 0.00 56.93 54.65 2ddk s PHE 73 Cb 0.10 -0.68 0.19 0.00 0.51 0.00 0.00 43.02 43.14 2ddk s PHE 73 CO 0.60 -0.90 1.65 -1.00 0.70 0.00 0.00 175.22 176.27 2ddk h PRO 74 N 6.27 0.82 -0.04 0.24 0.13 -1.68 -3.14 132.00 134.60 2ddk h PRO 74 Ca 0.14 -0.30 -0.07 0.00 -0.87 0.00 0.00 66.00 64.90 2ddk h PRO 74 Cb 0.98 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 2ddk h PRO 74 CO 0.27 0.93 -0.31 0.66 -0.23 0.00 0.00 178.00 179.32 2ddk h SER 75 N 0.73 0.08 -4.02 1.44 4.64 -1.95 -3.45 113.55 111.01 2ddk h SER 75 Ca 0.11 -0.02 -0.55 0.00 -0.47 0.00 0.00 61.79 60.86 2ddk h SER 75 Cb 0.67 -0.02 0.13 0.00 -0.31 0.00 0.00 62.40 62.87 2ddk h SER 75 CO 0.05 0.38 0.64 -1.00 -0.87 0.00 0.00 176.83 176.03 2ddk s HIS 76 N -4.35 2.37 0.39 4.77 3.76 -1.19 -4.91 115.29 116.14 2ddk s HIS 76 Ca -0.04 1.34 0.02 0.00 -0.15 0.00 0.00 55.06 56.23 2ddk s HIS 76 Cb 0.15 -3.83 -0.01 0.00 1.11 0.00 0.00 32.58 29.99 2ddk s HIS 76 CO 0.73 -2.87 0.57 1.03 -0.85 0.00 0.00 174.74 173.36 2ddk s ARG 77 N -2.72 3.18 -0.04 1.40 1.81 0.06 -4.98 118.95 117.66 2ddk s ARG 77 Ca 0.67 -0.62 0.00 0.00 -1.72 0.00 0.00 55.73 54.07 2ddk s ARG 77 Cb -0.41 -2.67 0.02 0.00 -0.45 0.00 0.00 34.95 31.44 2ddk s ARG 77 CO 0.51 -0.06 -0.02 -0.06 -0.68 0.00 0.00 175.30 174.98 2ddk s PHE 78 N -2.37 0.62 -0.08 -0.53 0.40 -1.26 -0.78 117.98 113.98 2ddk s PHE 78 Ca 0.45 -0.14 0.04 0.00 -0.60 0.00 0.00 56.93 56.67 2ddk s PHE 78 Cb -0.10 -0.62 0.00 0.00 0.51 0.00 0.00 43.02 42.82 2ddk s PHE 78 CO 0.35 -0.20 -0.20 0.42 0.70 0.00 0.00 175.22 176.29 2ddk s ILE 79 N 1.11 1.73 -0.24 0.64 1.01 0.27 -4.94 121.20 120.79 2ddk s ILE 79 Ca -0.08 -0.84 -0.37 0.00 0.00 0.00 0.00 60.65 59.36 2ddk s ILE 79 Cb -0.14 -1.50 0.15 0.00 0.01 0.00 0.00 42.46 40.98 2ddk s ILE 79 CO -0.01 0.49 1.30 0.00 0.00 0.00 0.00 174.94 176.71 2ddk s ALA 80 N 0.32 -2.14 -0.83 9.38 0.00 -1.26 -1.68 121.76 125.55 2ddk s ALA 80 Ca -0.14 1.76 -0.15 0.00 0.00 0.00 0.00 51.96 53.43 2ddk s ALA 80 Cb -0.16 -0.28 -0.23 0.00 0.00 0.00 0.00 23.12 22.45 2ddk s ALA 80 CO 0.06 -0.56 2.11 0.39 0.00 0.00 0.00 175.76 177.76 2ddk n GLU 81 N -0.04 0.19 0.00 0.00 1.02 -1.23 -5.00 120.64 115.59 2ddk n GLU 81 Ca 0.03 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.76 2ddk n GLU 81 Cb 0.57 -2.10 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 2ddk n GLU 81 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2ddk n GLU 82 N 6.67 0.00 0.00 3.49 4.71 -1.26 -4.98 120.64 129.28 2ddk n GLU 82 Ca 0.52 0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.73 2ddk n GLU 82 Cb 0.30 -0.59 0.00 0.00 -1.01 0.00 0.00 31.44 30.14 2ddk n GLU 82 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ddk n ALA 88 N -2.60 0.00 -1.51 0.62 0.00 -1.26 -5.26 120.51 110.50 2ddk n ALA 88 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ddk n ALA 88 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2ddk n ALA 88 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2ddk n LYS 89 N 0.17 0.00 -0.71 0.00 2.85 -1.26 -4.86 118.16 114.35 2ddk n LYS 89 Ca 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.21 2ddk n LYS 89 Cb 0.00 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.33 2ddk n LYS 89 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ddk s VAL 91 N 0.09 4.15 -0.26 0.00 -7.23 -1.26 -4.30 120.40 111.60 2ddk s VAL 91 Ca 0.24 1.11 -0.14 0.00 -1.81 0.00 0.00 61.98 61.37 2ddk s VAL 91 Cb 0.12 -4.64 -0.04 0.00 0.56 0.00 0.00 36.38 32.38 2ddk s VAL 91 CO -0.01 -1.11 0.34 -0.22 -0.31 0.00 0.00 175.10 173.79 2ddk s LEU 92 N 4.60 4.06 0.00 1.32 2.96 -1.26 -5.07 118.68 125.28 2ddk s LEU 92 Ca 0.46 0.28 0.00 0.00 -0.22 0.00 0.00 54.13 54.65 2ddk s LEU 92 Cb -0.07 -2.38 0.00 0.00 0.50 0.00 0.00 46.19 44.24 2ddk s LEU 92 CO 0.30 -0.13 0.00 0.35 -1.32 0.00 0.00 176.35 175.54 2ddk n THR 93 N 4.93 0.00 0.84 3.68 -2.24 -1.26 -4.92 114.28 115.30 2ddk n THR 93 Ca -0.10 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.78 2ddk n THR 93 Cb 0.51 -1.50 -0.02 0.00 -2.10 0.00 0.00 70.33 67.22 2ddk n THR 93 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2ddk n HIS 94 N -0.44 0.00 -3.03 4.78 -0.00 -1.26 -2.91 115.22 112.36 2ddk n HIS 94 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.72 57.38 2ddk n HIS 94 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 29.93 2ddk n HIS 94 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2ddk s SER 95 N -2.23 6.95 -0.28 0.41 1.04 -1.26 -0.27 113.70 118.06 2ddk s SER 95 Ca 0.14 1.46 -0.35 0.00 0.48 0.00 0.00 55.95 57.67 2ddk s SER 95 Cb 0.15 -2.44 -0.12 0.00 0.10 0.00 0.00 66.02 63.71 2ddk s SER 95 CO 0.52 -0.15 2.06 -0.81 0.98 0.00 0.00 173.24 175.83 2ddk n PRO 96 N -0.01 1.35 -4.31 4.02 -0.04 -1.26 -4.61 135.00 130.14 2ddk n PRO 96 Ca 0.02 0.42 -0.22 0.00 -0.04 0.00 0.00 63.50 63.69 2ddk n PRO 96 Cb 0.52 -2.48 -0.11 0.00 -0.04 0.00 0.00 33.50 31.39 2ddk n PRO 96 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2ddk s THR 97 N 6.11 1.73 -0.14 0.52 -1.32 -0.98 -0.76 115.64 120.80 2ddk s THR 97 Ca 1.04 -1.81 -0.01 0.00 -1.21 0.00 0.00 61.69 59.70 2ddk s THR 97 Cb -0.83 -1.74 -0.02 0.00 -1.51 0.00 0.00 72.50 68.40 2ddk s THR 97 CO 0.52 -0.27 -0.10 0.26 -2.21 0.00 0.00 174.62 172.81 2ddk s TRP 98 N -1.87 2.88 -0.32 9.09 0.52 0.04 -0.73 118.94 128.55 2ddk s TRP 98 Ca 0.13 -0.56 -0.04 0.00 0.02 0.00 0.00 56.10 55.64 2ddk s TRP 98 Cb -0.07 -1.89 0.04 0.00 -1.15 0.00 0.00 33.47 30.41 2ddk s TRP 98 CO 0.06 -0.18 0.06 0.42 0.02 0.00 0.00 176.95 177.32 2ddk s ILE 99 N 0.41 3.45 0.15 2.03 1.09 0.11 -0.57 121.20 127.88 2ddk s ILE 99 Ca -0.08 -1.23 0.08 0.00 -1.10 0.00 0.00 60.65 58.32 2ddk s ILE 99 Cb -0.15 -2.96 -0.04 0.00 -1.06 0.00 0.00 42.46 38.25 2ddk s ILE 99 CO 0.04 -0.14 -0.17 0.27 -0.10 0.00 0.00 174.94 174.84 2ddk s ILE 100 N 1.34 1.68 -0.25 2.92 -5.25 -0.68 -0.31 121.20 120.66 2ddk s ILE 100 Ca -0.03 -1.86 0.00 0.00 -0.99 0.00 0.00 60.65 57.77 2ddk s ILE 100 Cb -0.20 -1.76 0.07 0.00 2.95 0.00 0.00 42.46 43.52 2ddk s ILE 100 CO 0.01 -0.34 -0.01 -0.62 -1.79 0.00 0.00 174.94 172.18 2ddk s ASP 101 N -2.61 3.83 0.13 4.36 -1.08 -0.25 -3.54 116.67 117.51 2ddk s ASP 101 Ca 0.14 -1.27 -0.30 0.00 -0.52 0.00 0.00 52.55 50.60 2ddk s ASP 101 Cb -0.05 -1.10 -0.08 0.00 -1.46 0.00 0.00 42.92 40.23 2ddk s ASP 101 CO 0.06 -0.28 1.58 1.55 0.52 0.00 0.00 175.17 178.59 2ddk h PRO 102 N 7.98 -0.52 -2.34 4.34 0.13 -1.90 -2.65 132.00 137.05 2ddk h PRO 102 Ca -0.16 0.04 -0.43 0.00 -0.87 0.00 0.00 66.00 64.58 2ddk h PRO 102 Cb 1.07 0.12 -0.35 0.00 0.13 0.00 0.00 31.00 31.96 2ddk h PRO 102 CO 0.42 -0.34 -0.72 0.96 -0.23 0.00 0.00 178.00 178.08 2ddk s ILE 103 N -5.85 -0.21 0.25 -3.56 -4.36 -1.26 -4.45 121.20 101.75 2ddk s ILE 103 Ca -0.16 -0.87 -0.30 0.00 -0.26 0.00 0.00 60.65 59.07 2ddk s ILE 103 Cb 0.09 -0.94 -0.09 0.00 1.25 0.00 0.00 42.46 42.77 2ddk s ILE 103 CO 0.63 -0.65 1.05 -0.62 0.24 0.00 0.00 174.94 175.60 2ddk s ASP 104 N 1.88 7.38 0.00 4.36 3.68 -0.55 -3.83 116.67 129.59 2ddk s ASP 104 Ca 0.12 2.14 0.00 0.00 2.13 0.00 0.00 52.55 56.95 2ddk s ASP 104 Cb -0.16 -2.62 0.00 0.00 -1.45 0.00 0.00 42.92 38.69 2ddk s ASP 104 CO -0.22 -0.06 0.00 0.61 0.13 0.00 0.00 175.17 175.63 2ddk n GLY 105 N 1.42 0.83 0.21 2.66 0.00 -1.26 -1.05 105.19 107.99 2ddk n GLY 105 Ca -0.01 -0.33 -0.07 0.00 0.00 0.00 0.00 46.02 45.61 2ddk n GLY 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ddk h THR 106 N 0.00 1.32 -0.27 2.61 1.35 -1.83 -0.65 112.91 115.43 2ddk h THR 106 Ca 0.00 -1.67 -0.08 0.00 -0.55 0.00 0.00 66.41 64.10 2ddk h THR 106 Cb 0.54 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.64 2ddk h THR 106 CO 0.00 0.52 -0.18 0.00 -0.25 0.00 0.00 175.52 175.61 2ddk h ASN 108 N 0.44 -0.69 -0.80 0.00 2.35 -1.76 -3.02 115.58 112.10 2ddk h ASN 108 Ca 0.08 0.02 0.18 0.00 -0.55 0.00 0.00 56.30 56.03 2ddk h ASN 108 Cb 0.56 0.18 -0.15 0.00 0.05 0.00 0.00 38.32 38.96 2ddk h ASN 108 CO 0.04 -0.35 -0.13 0.33 -1.65 0.00 0.00 177.43 175.67 2ddk n PHE 109 N -5.04 0.36 0.01 1.19 -0.00 -0.28 -0.28 117.46 113.43 2ddk n PHE 109 Ca -0.10 0.97 -0.02 0.00 -0.00 0.00 0.00 57.45 58.30 2ddk n PHE 109 Cb 0.32 -1.01 -0.01 0.00 -0.00 0.00 0.00 39.48 38.78 2ddk n PHE 109 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2ddk h VAL 110 N 0.00 0.00 0.00 -2.13 2.07 -1.14 -2.27 116.25 112.78 2ddk h VAL 110 Ca 0.42 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.94 2ddk h VAL 110 Cb 0.72 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2ddk h VAL 110 CO -0.80 0.00 0.00 1.41 0.02 0.00 0.00 177.57 178.20 2ddk n HIS 111 N -2.86 0.00 -0.99 1.57 8.25 0.62 -4.84 115.22 116.97 2ddk n HIS 111 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2ddk n HIS 111 Cb 0.05 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.00 2ddk n HIS 111 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ddk n ARG 112 N -1.16 -0.40 -2.17 -0.41 1.74 0.30 -4.95 116.66 109.61 2ddk n ARG 112 Ca 0.06 0.10 -0.40 0.00 -0.77 0.00 0.00 57.85 56.84 2ddk n ARG 112 Cb 0.06 -3.40 -0.03 0.00 -1.02 0.00 0.00 32.46 28.07 2ddk n ARG 112 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2ddk s PHE 113 N -1.86 1.90 -0.05 -1.55 2.19 -1.10 -4.87 117.98 112.64 2ddk s PHE 113 Ca 0.00 0.61 -0.07 0.00 0.33 0.00 0.00 56.93 57.80 2ddk s PHE 113 Cb 0.00 -4.22 -0.09 0.00 -1.31 0.00 0.00 43.02 37.41 2ddk s PHE 113 CO 0.00 -2.30 0.85 -0.35 1.83 0.00 0.00 175.22 175.25 2ddk n PRO 114 N 8.95 0.00 -3.04 10.12 -0.04 -1.26 -4.39 135.00 145.34 2ddk n PRO 114 Ca 0.17 -0.27 0.03 0.00 -0.04 0.00 0.00 63.50 63.39 2ddk n PRO 114 Cb 0.50 -1.42 -0.00 0.00 -0.04 0.00 0.00 33.50 32.54 2ddk n PRO 114 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2ddk s THR 115 N 4.01 -0.58 -0.15 0.52 2.01 -1.26 -4.94 115.64 115.25 2ddk s THR 115 Ca 0.17 0.00 -0.15 0.00 0.31 0.00 0.00 61.69 62.02 2ddk s THR 115 Cb 0.03 -0.22 0.04 0.00 0.01 0.00 0.00 72.50 72.35 2ddk s THR 115 CO 0.08 0.00 0.42 0.68 -0.69 0.00 0.00 174.62 175.11 2ddk s VAL 116 N 2.30 0.00 0.39 3.82 -7.23 -1.26 -4.60 120.40 113.81 2ddk s VAL 116 Ca 0.17 -0.01 0.06 0.00 -1.81 0.00 0.00 61.98 60.38 2ddk s VAL 116 Cb -0.02 -0.59 -0.02 0.00 0.56 0.00 0.00 36.38 36.30 2ddk s VAL 116 CO -0.16 -0.01 0.20 0.00 -0.31 0.00 0.00 175.10 174.82 2ddk s ALA 117 N 0.17 2.53 -0.09 1.32 0.00 -0.21 -2.23 121.76 123.24 2ddk s ALA 117 Ca -0.00 -1.55 0.01 0.00 0.00 0.00 0.00 51.96 50.42 2ddk s ALA 117 Cb -0.03 1.08 0.02 0.00 0.00 0.00 0.00 23.12 24.19 2ddk s ALA 117 CO 0.01 -0.48 -0.10 0.08 0.00 0.00 0.00 175.76 175.27 2ddk s VAL 118 N -3.29 1.05 -0.12 0.00 1.01 -0.97 -1.49 120.40 116.60 2ddk s VAL 118 Ca 0.30 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.92 2ddk s VAL 118 Cb 0.02 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 2ddk s VAL 118 CO 0.21 0.35 -0.14 -0.55 0.00 0.00 0.00 175.10 174.97 2ddk s SER 119 N 1.18 3.96 -0.26 3.32 0.15 -1.00 -1.15 113.70 119.90 2ddk s SER 119 Ca -0.05 -0.33 -0.02 0.00 0.70 0.00 0.00 55.95 56.25 2ddk s SER 119 Cb -0.14 -1.52 0.08 0.00 -1.71 0.00 0.00 66.02 62.73 2ddk s SER 119 CO -0.02 0.18 0.08 -0.63 1.20 0.00 0.00 173.24 174.05 2ddk s ILE 120 N 0.24 0.55 0.05 6.45 1.01 -0.99 -1.09 121.20 127.42 2ddk s ILE 120 Ca -0.09 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 59.67 2ddk s ILE 120 Cb -0.15 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 2ddk s ILE 120 CO 0.05 -0.49 -0.04 -0.83 0.00 0.00 0.00 174.94 173.63 2ddk s GLY 121 N 1.81 1.83 -0.08 6.18 0.00 0.58 -1.40 107.32 116.23 2ddk s GLY 121 Ca 0.05 -1.08 0.02 0.00 0.00 0.00 0.00 44.72 43.72 2ddk s GLY 121 CO -0.20 -1.00 -0.14 -0.12 0.00 0.00 0.00 173.10 171.64 2ddk s PHE 122 N -1.14 1.70 0.39 1.90 2.19 -0.75 0.08 117.98 122.35 2ddk s PHE 122 Ca 0.21 -0.68 0.08 0.00 0.33 0.00 0.00 56.93 56.86 2ddk s PHE 122 Cb -0.11 -1.23 -0.06 0.00 -1.31 0.00 0.00 43.02 40.31 2ddk s PHE 122 CO 0.12 -0.34 0.05 0.00 1.83 0.00 0.00 175.22 176.89 2ddk s ALA 123 N 0.72 3.29 -0.29 11.12 0.00 0.09 0.54 121.76 137.22 2ddk s ALA 123 Ca -0.13 -2.13 -0.24 0.00 0.00 0.00 0.00 51.96 49.46 2ddk s ALA 123 Cb -0.16 -0.17 0.17 0.00 0.00 0.00 0.00 23.12 22.96 2ddk s ALA 123 CO 0.03 -0.07 1.29 0.54 0.00 0.00 0.00 175.76 177.55 2ddk s VAL 124 N -2.61 0.00 -1.29 0.00 0.11 -0.27 -2.33 120.40 114.01 2ddk s VAL 124 Ca 0.37 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.42 2ddk s VAL 124 Cb 0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.90 2ddk s VAL 124 CO 0.20 0.00 0.00 0.54 -3.33 0.00 0.00 175.10 172.51 2ddk n ARG 125 N 2.02 -1.03 -1.98 1.54 1.74 0.63 -2.23 116.66 117.36 2ddk n ARG 125 Ca -0.12 0.91 -0.09 0.00 -0.77 0.00 0.00 57.85 57.78 2ddk n ARG 125 Cb 0.57 -4.99 -0.01 0.00 -1.02 0.00 0.00 32.46 27.00 2ddk n ARG 125 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2ddk n GLN 126 N -2.29 -0.70 -4.07 5.56 7.27 -1.15 -4.81 117.38 117.20 2ddk n GLN 126 Ca -0.12 0.52 -0.12 0.00 0.07 0.00 0.00 57.00 57.35 2ddk n GLN 126 Cb 0.44 -4.49 -0.11 0.00 2.41 0.00 0.00 30.24 28.49 2ddk n GLN 126 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 2ddk s GLU 127 N -4.09 0.55 -0.07 3.69 2.02 -0.95 -5.03 118.70 114.83 2ddk s GLU 127 Ca 0.00 -0.86 -0.30 0.00 0.02 0.00 0.00 54.97 53.83 2ddk s GLU 127 Cb 0.00 -0.19 -0.03 0.00 0.10 0.00 0.00 34.13 34.02 2ddk s GLU 127 CO 0.00 0.01 1.14 -0.51 0.02 0.00 0.00 175.26 175.92 2ddk s LEU 128 N -1.89 4.27 -0.24 1.80 1.43 -1.26 -1.11 118.68 121.68 2ddk s LEU 128 Ca -0.06 1.73 -0.15 0.00 -1.03 0.00 0.00 54.13 54.62 2ddk s LEU 128 Cb -0.06 -3.56 -0.16 0.00 0.03 0.00 0.00 46.19 42.44 2ddk s LEU 128 CO -0.01 -0.53 -0.08 1.21 0.23 0.00 0.00 176.35 177.16 2ddk n GLU 129 N 5.09 0.60 -4.00 1.70 4.07 0.19 -4.77 120.64 123.52 2ddk n GLU 129 Ca 0.10 0.36 -0.09 0.00 -0.06 0.00 0.00 57.16 57.47 2ddk n GLU 129 Cb 0.47 -1.60 -0.06 0.00 -0.06 0.00 0.00 31.44 30.19 2ddk n GLU 129 CO 0.00 0.00 0.00 -0.59 -0.06 0.00 0.00 177.13 176.48 2ddk s PHE 130 N -2.46 0.39 -0.08 4.31 -0.71 -1.08 0.15 117.98 118.50 2ddk s PHE 130 Ca -0.34 -0.75 -0.08 0.00 -1.04 0.00 0.00 56.93 54.73 2ddk s PHE 130 Cb 0.10 0.15 0.02 0.00 -1.21 0.00 0.00 43.02 42.08 2ddk s PHE 130 CO 0.56 -0.97 0.22 0.20 -1.34 0.00 0.00 175.22 173.90 2ddk s GLY 131 N -3.02 -0.16 -0.35 1.99 0.00 0.85 -1.80 107.32 104.83 2ddk s GLY 131 Ca 0.23 0.58 -0.01 0.00 0.00 0.00 0.00 44.72 45.52 2ddk s GLY 131 CO 0.09 0.49 0.17 0.14 0.00 0.00 0.00 173.10 173.99 2ddk s VAL 132 N -0.01 0.55 0.05 1.40 1.01 -0.49 -0.44 120.40 122.46 2ddk s VAL 132 Ca -0.01 -1.61 -0.04 0.00 0.00 0.00 0.00 61.98 60.32 2ddk s VAL 132 Cb -0.02 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 2ddk s VAL 132 CO 0.01 -0.84 0.26 -0.63 0.00 0.00 0.00 175.10 173.90 2ddk s ILE 133 N 1.27 5.32 -0.10 2.22 1.09 0.46 -2.35 121.20 129.11 2ddk s ILE 133 Ca 0.14 -0.06 -0.02 0.00 -1.10 0.00 0.00 60.65 59.61 2ddk s ILE 133 Cb -0.20 -3.59 0.04 0.00 -1.06 0.00 0.00 42.46 37.64 2ddk s ILE 133 CO -0.14 0.23 0.01 -0.47 -0.10 0.00 0.00 174.94 174.48 2ddk s TYR 134 N -1.43 0.71 -0.47 3.97 6.14 -0.30 -1.14 117.35 124.82 2ddk s TYR 134 Ca 0.32 -0.31 -0.28 0.00 0.64 0.00 0.00 57.07 57.44 2ddk s TYR 134 Cb -0.13 -0.84 0.03 0.00 0.42 0.00 0.00 41.96 41.44 2ddk s TYR 134 CO 0.21 -0.39 1.07 -1.58 0.64 0.00 0.00 175.55 175.50 2ddk s HIS 135 N 1.96 2.85 0.08 4.97 5.65 0.04 -2.29 115.29 128.55 2ddk s HIS 135 Ca 0.04 0.61 -0.29 0.00 0.25 0.00 0.00 55.06 55.67 2ddk s HIS 135 Cb -0.13 -4.30 -0.16 0.00 -1.18 0.00 0.00 32.58 26.81 2ddk s HIS 135 CO -0.06 -1.22 1.66 0.00 -0.65 0.00 0.00 174.74 174.47 2ddk n THR 137 N -5.35 0.00 0.10 0.00 -1.04 -1.26 -3.35 114.28 103.38 2ddk n THR 137 Ca -0.11 1.10 0.01 0.00 -2.04 0.00 0.00 64.05 63.01 2ddk n THR 137 Cb 0.26 -2.03 0.05 0.00 -1.82 0.00 0.00 70.33 66.79 2ddk n THR 137 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2ddk n GLU 138 N -1.62 0.03 -3.42 -2.82 1.02 -1.26 -4.87 120.64 107.70 2ddk n GLU 138 Ca 0.00 0.26 -0.18 0.00 -0.02 0.00 0.00 57.16 57.23 2ddk n GLU 138 Cb 0.00 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 29.99 2ddk n GLU 138 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2ddk n GLU 139 N -1.28 -4.61 -4.88 3.49 1.02 -0.27 -5.03 120.64 109.08 2ddk n GLU 139 Ca 0.01 0.80 -0.33 0.00 -0.02 0.00 0.00 57.16 57.62 2ddk n GLU 139 Cb 0.02 -5.66 -0.15 0.00 -0.02 0.00 0.00 31.44 25.63 2ddk n GLU 139 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2ddk s ARG 140 N -5.16 3.16 -0.80 3.49 0.52 -0.98 -4.94 118.95 114.24 2ddk s ARG 140 Ca 0.18 -0.72 -0.10 0.00 -0.52 0.00 0.00 55.73 54.57 2ddk s ARG 140 Cb -0.03 -2.53 0.21 0.00 0.52 0.00 0.00 34.95 33.12 2ddk s ARG 140 CO 0.75 0.28 0.71 -1.17 0.02 0.00 0.00 175.30 175.90 2ddk s LEU 141 N 0.15 6.21 0.03 2.53 2.96 -1.26 -0.78 118.68 128.52 2ddk s LEU 141 Ca -0.08 -2.91 -0.30 0.00 -0.22 0.00 0.00 54.13 50.62 2ddk s LEU 141 Cb -0.15 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 2ddk s LEU 141 CO 0.05 -0.46 1.04 -0.31 -1.32 0.00 0.00 176.35 175.36 2ddk s TYR 142 N -0.16 3.61 -0.04 5.38 2.02 -0.29 -3.00 117.35 124.87 2ddk s TYR 142 Ca 0.20 1.59 -0.13 0.00 -0.37 0.00 0.00 57.07 58.35 2ddk s TYR 142 Cb -0.13 -3.20 0.02 0.00 -0.40 0.00 0.00 41.96 38.25 2ddk s TYR 142 CO -0.08 -0.37 0.30 0.95 -1.57 0.00 0.00 175.55 174.79 2ddk s THR 143 N 0.93 0.04 0.03 -0.71 -4.23 0.72 -0.40 115.64 112.02 2ddk s THR 143 Ca 0.53 -0.36 -0.10 0.00 -1.18 0.00 0.00 61.69 60.59 2ddk s THR 143 Cb -0.24 -0.56 0.01 0.00 1.34 0.00 0.00 72.50 73.05 2ddk s THR 143 CO 0.29 -0.20 0.20 -0.83 -0.54 0.00 0.00 174.62 173.54 2ddk s GLY 144 N -0.93 0.01 -0.05 3.99 0.00 0.41 0.20 107.32 110.96 2ddk s GLY 144 Ca -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 44.72 44.37 2ddk s GLY 144 CO 0.03 -0.39 0.13 0.50 0.00 0.00 0.00 173.10 173.38 2ddk s ARG 145 N -2.35 0.14 -0.15 2.90 0.52 -1.17 -0.11 118.95 118.74 2ddk s ARG 145 Ca -0.07 0.21 -0.37 0.00 -0.52 0.00 0.00 55.73 54.98 2ddk s ARG 145 Cb -0.02 0.03 -0.14 0.00 0.52 0.00 0.00 34.95 35.34 2ddk s ARG 145 CO -0.03 -0.04 1.74 -2.13 0.02 0.00 0.00 175.30 174.86 2ddk n ARG 146 N 3.20 1.57 0.00 3.54 0.63 0.40 -1.50 116.66 124.51 2ddk n ARG 146 Ca -0.15 0.57 0.00 0.00 -0.92 0.00 0.00 57.85 57.36 2ddk n ARG 146 Cb 0.58 -2.32 0.00 0.00 0.45 0.00 0.00 32.46 31.17 2ddk n ARG 146 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ddk n GLY 147 N 4.06 2.52 2.19 5.14 0.00 -1.26 -4.85 105.19 112.99 2ddk n GLY 147 Ca 0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.98 2ddk n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ddk n ARG 148 N -0.02 2.36 -1.47 1.61 1.74 -0.56 -5.07 116.66 115.25 2ddk n ARG 148 Ca 0.00 -2.84 0.19 0.00 -0.77 0.00 0.00 57.85 54.43 2ddk n ARG 148 Cb 0.00 -2.11 -0.06 0.00 -1.02 0.00 0.00 32.46 29.26 2ddk n ARG 148 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ddk n GLY 149 N -0.77 -2.44 3.52 -0.13 0.00 -1.24 -4.63 105.19 99.50 2ddk n GLY 149 Ca 0.55 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.15 2ddk n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddk s ALA 150 N -2.97 2.77 0.02 4.61 0.00 0.08 -3.05 121.76 123.22 2ddk s ALA 150 Ca 0.00 -1.13 -0.05 0.00 0.00 0.00 0.00 51.96 50.78 2ddk s ALA 150 Cb 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 2ddk s ALA 150 CO 0.00 0.59 0.09 -0.06 0.00 0.00 0.00 175.76 176.39 2ddk s PHE 151 N -0.97 0.15 -0.08 0.00 0.08 0.13 -0.06 117.98 117.24 2ddk s PHE 151 Ca 0.16 -0.38 -0.01 0.00 0.12 0.00 0.00 56.93 56.82 2ddk s PHE 151 Cb -0.11 -0.12 0.03 0.00 -0.57 0.00 0.00 43.02 42.25 2ddk s PHE 151 CO 0.07 -0.31 -0.02 0.00 -0.10 0.00 0.00 175.22 174.85 2ddk n ASN 153 N 4.99 0.35 0.00 0.00 4.13 -1.16 -1.26 115.26 122.31 2ddk n ASN 153 Ca -0.10 -0.89 0.00 0.00 1.68 0.00 0.00 54.58 55.27 2ddk n ASN 153 Cb 0.50 -1.11 0.00 0.00 -1.54 0.00 0.00 39.78 37.63 2ddk n ASN 153 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ddk n GLY 154 N -1.91 2.70 3.74 7.41 0.00 -1.26 -5.03 105.19 110.84 2ddk n GLY 154 Ca -0.18 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2ddk n GLY 154 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ddk n GLN 155 N 0.00 2.63 -2.65 1.61 3.00 -0.39 -4.94 117.38 116.64 2ddk n GLN 155 Ca 0.00 0.93 -0.42 0.00 -0.01 0.00 0.00 57.00 57.51 2ddk n GLN 155 Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 30.24 27.50 2ddk n GLN 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 2ddk s ARG 156 N -0.54 4.59 0.36 -1.09 3.52 -1.26 -1.03 118.95 123.50 2ddk s ARG 156 Ca 0.64 1.51 -0.15 0.00 -0.13 0.00 0.00 55.73 57.60 2ddk s ARG 156 Cb -0.51 -3.40 -0.09 0.00 -1.56 0.00 0.00 34.95 29.39 2ddk s ARG 156 CO 0.49 0.02 0.79 -0.51 -0.81 0.00 0.00 175.30 175.27 2ddk s LEU 157 N 0.55 3.99 -0.30 -0.88 1.43 0.92 -4.92 118.68 119.47 2ddk s LEU 157 Ca 0.51 1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 2ddk s LEU 157 Cb -0.24 -4.17 0.12 0.00 0.03 0.00 0.00 46.19 41.94 2ddk s LEU 157 CO 0.29 -0.28 0.66 -0.60 0.23 0.00 0.00 176.35 176.65 2ddk s ARG 158 N -3.20 0.60 1.04 1.70 3.52 -1.18 -4.56 118.95 116.88 2ddk s ARG 158 Ca 0.55 1.42 -0.12 0.00 -0.13 0.00 0.00 55.73 57.45 2ddk s ARG 158 Cb -0.10 0.75 0.20 0.00 -1.56 0.00 0.00 34.95 34.24 2ddk s ARG 158 CO 0.19 -0.19 0.99 1.33 -0.81 0.00 0.00 175.30 176.81 2ddk n VAL 159 N 5.25 0.00 -0.26 7.11 0.24 -0.03 -4.28 118.33 126.36 2ddk n VAL 159 Ca -0.13 -0.22 -0.06 0.00 -2.04 0.00 0.00 64.34 61.89 2ddk n VAL 159 Cb 0.51 -0.95 0.05 0.00 -1.47 0.00 0.00 33.84 31.98 2ddk n VAL 159 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2ddk h SER 160 N -2.24 0.88 0.00 -1.34 4.64 -1.80 -3.47 113.55 110.24 2ddk h SER 160 Ca -0.52 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 2ddk h SER 160 Cb 1.30 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2ddk h SER 160 CO 0.44 0.72 0.00 0.61 -0.87 0.00 0.00 176.83 177.73 2ddk n GLY 161 N -1.09 0.56 3.80 -0.77 0.00 -1.26 -5.04 105.19 101.39 2ddk n GLY 161 Ca 0.06 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 2ddk n GLY 161 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ddk s GLU 162 N -1.07 3.87 0.00 1.61 2.56 -1.26 -4.87 118.70 119.54 2ddk s GLU 162 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 54.97 56.34 2ddk s GLU 162 Cb 0.00 -2.16 0.00 0.00 2.00 0.00 0.00 34.13 33.97 2ddk s GLU 162 CO 0.00 -0.37 0.00 0.25 -0.56 0.00 0.00 175.26 174.58 2ddk n THR 163 N -0.82 0.00 -3.01 -1.70 -2.24 -1.26 -3.85 114.28 101.40 2ddk n THR 163 Ca 0.09 -0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 2ddk n THR 163 Cb 0.52 0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 69.49 2ddk n THR 163 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ddk s ASP 164 N -0.28 6.27 0.53 3.42 -1.08 -1.26 -4.23 116.67 120.05 2ddk s ASP 164 Ca 0.00 -0.66 0.34 0.00 -0.52 0.00 0.00 52.55 51.71 2ddk s ASP 164 Cb 0.00 -2.36 1.51 0.00 -1.46 0.00 0.00 42.92 40.61 2ddk s ASP 164 CO 0.00 -1.05 1.83 0.25 0.52 0.00 0.00 175.17 176.72 2ddk h LEU 165 N 10.30 0.03 0.00 -1.34 6.46 -1.95 0.56 115.31 129.37 2ddk h LEU 165 Ca -0.27 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 2ddk h LEU 165 Cb 1.08 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.02 2ddk h LEU 165 CO 1.02 0.01 0.00 -1.54 -0.62 0.00 0.00 178.44 177.31 2ddk n SER 166 N -4.23 0.00 0.00 1.25 3.41 -1.26 -2.53 113.62 110.26 2ddk n SER 166 Ca 0.24 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.55 2ddk n SER 166 Cb 1.15 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.10 2ddk n SER 166 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ddk n LYS 167 N -0.70 0.22 -3.14 4.33 5.02 0.20 -3.94 118.16 120.14 2ddk n LYS 167 Ca 0.08 -0.48 -0.37 0.00 -2.02 0.00 0.00 58.31 55.51 2ddk n LYS 167 Cb 0.04 -0.71 -0.06 0.00 -0.02 0.00 0.00 35.03 34.27 2ddk n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ddk s ALA 168 N -0.16 3.48 -0.34 7.82 0.00 -1.05 -4.68 121.76 126.83 2ddk s ALA 168 Ca 0.00 0.14 -0.09 0.00 0.00 0.00 0.00 51.96 52.01 2ddk s ALA 168 Cb 0.00 -2.77 0.02 0.00 0.00 0.00 0.00 23.12 20.36 2ddk s ALA 168 CO 0.00 0.35 0.16 -1.17 0.00 0.00 0.00 175.76 175.10 2ddk s LEU 169 N -1.58 4.36 -0.20 0.00 2.96 -1.26 -1.69 118.68 121.26 2ddk s LEU 169 Ca 0.37 -0.85 -0.08 0.00 -0.22 0.00 0.00 54.13 53.35 2ddk s LEU 169 Cb -0.19 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.49 2ddk s LEU 169 CO 0.21 -0.30 0.08 -0.69 -1.32 0.00 0.00 176.35 174.34 2ddk s VAL 170 N 1.54 4.83 0.14 1.68 1.01 -0.91 -0.70 120.40 127.98 2ddk s VAL 170 Ca 0.02 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.02 2ddk s VAL 170 Cb -0.18 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2ddk s VAL 170 CO 0.05 0.43 0.22 -0.76 0.00 0.00 0.00 175.10 175.04 2ddk s LEU 171 N 0.63 4.15 0.03 3.92 1.43 -0.42 -1.14 118.68 127.28 2ddk s LEU 171 Ca 0.04 0.08 -0.27 0.00 -1.03 0.00 0.00 54.13 52.95 2ddk s LEU 171 Cb -0.13 -2.74 0.09 0.00 0.03 0.00 0.00 46.19 43.44 2ddk s LEU 171 CO 0.01 0.08 0.78 0.28 0.23 0.00 0.00 176.35 177.74 2ddk s THR 172 N -1.69 0.00 0.43 5.49 -1.32 -0.71 -2.82 115.64 115.02 2ddk s THR 172 Ca 0.33 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.86 2ddk s THR 172 Cb -0.11 -1.00 -0.06 0.00 -1.51 0.00 0.00 72.50 69.82 2ddk s THR 172 CO 0.26 0.00 0.01 -1.61 -2.21 0.00 0.00 174.62 171.08 2ddk s GLU 173 N -2.95 1.99 -0.07 7.08 8.01 -1.26 -4.09 118.70 127.42 2ddk s GLU 173 Ca 0.01 -2.17 0.06 0.00 0.01 0.00 0.00 54.97 52.88 2ddk s GLU 173 Cb -0.01 -1.54 -0.01 0.00 -4.31 0.00 0.00 34.13 28.26 2ddk s GLU 173 CO -0.07 -0.14 -0.24 0.42 0.01 0.00 0.00 175.26 175.23 2ddk s ILE 174 N -2.80 2.09 0.11 -1.63 1.09 -1.26 -4.82 121.20 113.98 2ddk s ILE 174 Ca 0.28 -1.04 -0.36 0.00 -1.10 0.00 0.00 60.65 58.43 2ddk s ILE 174 Cb 0.08 -1.76 -0.16 0.00 -1.06 0.00 0.00 42.46 39.55 2ddk s ILE 174 CO 0.14 0.57 1.32 0.61 -0.10 0.00 0.00 174.94 177.48 2ddk n GLY 175 N 3.06 0.42 0.23 6.18 0.00 -1.26 -4.77 105.19 109.06 2ddk n GLY 175 Ca -0.18 0.66 0.16 0.00 0.00 0.00 0.00 46.02 46.66 2ddk n GLY 175 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ddk h PRO 176 N 4.39 0.00 -5.80 1.61 0.13 -1.94 -3.39 132.00 127.00 2ddk h PRO 176 Ca -0.47 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.08 2ddk h PRO 176 Cb 1.33 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.38 2ddk h PRO 176 CO 0.77 0.00 0.21 -1.59 -0.23 0.00 0.00 178.00 177.15 2ddk s LYS 177 N -3.76 4.27 -0.43 0.86 -2.85 -1.26 -5.03 119.74 111.54 2ddk s LYS 177 Ca -0.03 0.78 -0.03 0.00 -1.00 0.00 0.00 55.97 55.69 2ddk s LYS 177 Cb 0.09 -3.56 0.11 0.00 -2.06 0.00 0.00 37.83 32.41 2ddk s LYS 177 CO 0.30 -0.23 0.23 1.03 0.10 0.00 0.00 175.35 176.78 2ddk s ARG 178 N 1.85 2.08 -0.01 1.78 1.81 -1.26 -5.03 118.95 120.17 2ddk s ARG 178 Ca 0.33 -1.87 0.01 0.00 -1.72 0.00 0.00 55.73 52.47 2ddk s ARG 178 Cb -0.16 -3.62 0.01 0.00 -0.45 0.00 0.00 34.95 30.73 2ddk s ARG 178 CO 0.12 -1.09 -0.01 0.16 -0.68 0.00 0.00 175.30 173.80 2ddk s ASP 179 N 1.81 0.30 0.00 0.23 1.47 -1.26 -5.09 116.67 114.13 2ddk s ASP 179 Ca 0.09 -0.03 0.00 0.00 1.18 0.00 0.00 52.55 53.79 2ddk s ASP 179 Cb -0.23 -0.11 0.00 0.00 -0.34 0.00 0.00 42.92 42.24 2ddk s ASP 179 CO -0.04 -0.04 0.00 -2.65 0.68 0.00 0.00 175.17 173.12 2ddk n PRO 180 N 3.58 0.00 0.00 2.11 -0.02 -1.26 -1.46 135.00 137.96 2ddk n PRO 180 Ca -0.20 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.39 2ddk n PRO 180 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.05 2ddk n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ddk n ALA 181 N 0.00 3.71 0.72 3.55 0.00 -1.26 -3.96 120.51 123.28 2ddk n ALA 181 Ca 0.00 -0.61 0.02 0.00 0.00 0.00 0.00 53.44 52.86 2ddk n ALA 181 Cb 0.00 -0.83 0.15 0.00 0.00 0.00 0.00 19.45 18.77 2ddk n ALA 181 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ddk n THR 182 N -0.35 0.00 -0.06 0.00 -2.24 -0.53 -2.48 114.28 108.62 2ddk n THR 182 Ca 0.09 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.81 2ddk n THR 182 Cb 0.43 -0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 68.08 2ddk n THR 182 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2ddk h LEU 183 N 0.00 0.00 -0.52 3.22 5.85 -1.70 -3.34 115.31 118.82 2ddk h LEU 183 Ca 0.00 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.39 2ddk h LEU 183 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 2ddk h LEU 183 CO 0.00 0.72 0.42 0.29 -0.34 0.00 0.00 178.44 179.54 2ddk n LYS 184 N -4.70 0.06 0.16 1.25 4.76 -1.03 0.30 118.16 118.96 2ddk n LYS 184 Ca -0.05 0.49 0.12 0.00 -2.87 0.00 0.00 58.31 56.00 2ddk n LYS 184 Cb 0.20 -2.11 0.13 0.00 -1.84 0.00 0.00 35.03 31.42 2ddk n LYS 184 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2ddk h LEU 185 N 0.00 0.00 0.01 -0.35 5.85 -1.74 -1.96 115.31 117.12 2ddk h LEU 185 Ca 0.00 -0.02 -0.32 0.00 0.84 0.00 0.00 57.88 58.39 2ddk h LEU 185 Cb 0.85 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.83 2ddk h LEU 185 CO 0.00 0.01 -1.74 0.33 -0.34 0.00 0.00 178.44 176.70 2ddk n PHE 186 N -2.82 0.69 0.15 1.25 7.35 0.89 -3.05 117.46 121.91 2ddk n PHE 186 Ca 0.03 0.28 -0.00 0.00 -0.76 0.00 0.00 57.45 57.00 2ddk n PHE 186 Cb 0.52 -1.07 0.22 0.00 0.35 0.00 0.00 39.48 39.51 2ddk n PHE 186 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2ddk h LEU 187 N -0.91 0.00 0.00 -2.13 -0.00 -1.44 -1.69 115.31 109.14 2ddk h LEU 187 Ca -0.47 -0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.35 2ddk h LEU 187 Cb 1.46 -0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 42.11 2ddk h LEU 187 CO -0.26 0.55 -0.31 0.77 -0.00 0.00 0.00 178.44 179.19 2ddk h SER 188 N 0.00 0.00 -0.26 -0.43 4.64 -1.55 -2.16 113.55 113.80 2ddk h SER 188 Ca -0.01 -0.87 0.06 0.00 -0.47 0.00 0.00 61.79 60.51 2ddk h SER 188 Cb 0.97 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.98 2ddk h SER 188 CO 0.07 1.11 -0.24 0.78 -0.87 0.00 0.00 176.83 177.68 2ddk h ASN 189 N -1.00 -0.78 -0.62 4.97 -0.26 -1.60 0.26 115.58 116.55 2ddk h ASN 189 Ca -0.08 0.14 0.08 0.00 -0.56 0.00 0.00 56.30 55.88 2ddk h ASN 189 Cb 1.06 0.37 -0.04 0.00 -1.06 0.00 0.00 38.32 38.65 2ddk h ASN 189 CO -0.05 -0.28 0.41 -0.03 -1.06 0.00 0.00 177.43 176.43 2ddk h MET 190 N -0.24 0.52 0.69 0.81 4.05 -1.43 -2.03 114.93 117.30 2ddk h MET 190 Ca 0.14 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.50 2ddk h MET 190 Cb 0.46 -0.12 0.01 0.00 -0.80 0.00 0.00 31.60 31.15 2ddk h MET 190 CO -0.40 0.34 -0.33 1.49 0.23 0.00 0.00 176.91 178.25 2ddk h GLU 191 N 0.53 -0.89 0.14 0.39 4.22 0.14 -0.17 114.58 118.95 2ddk h GLU 191 Ca 0.28 0.06 0.02 0.00 0.08 0.00 0.00 59.36 59.80 2ddk h GLU 191 Cb 0.40 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 2ddk h GLU 191 CO -0.08 -0.59 -0.35 0.00 -2.18 0.00 0.00 179.01 175.80 2ddk h ARG 192 N -1.02 -0.57 -0.96 1.92 -0.00 -1.03 -1.86 114.38 110.86 2ddk h ARG 192 Ca -0.09 0.04 0.17 0.00 -0.50 0.00 0.00 59.98 59.60 2ddk h ARG 192 Cb 0.71 0.13 -0.09 0.00 0.00 0.00 0.00 29.97 30.72 2ddk h ARG 192 CO 0.16 -0.38 0.61 1.25 0.00 0.00 0.00 179.97 181.60 2ddk h LEU 193 N -0.59 0.70 -1.29 3.04 5.85 -1.45 -1.43 115.31 120.14 2ddk h LEU 193 Ca 0.02 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 2ddk h LEU 193 Cb 0.61 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2ddk h LEU 193 CO -0.19 0.30 -0.34 0.25 -0.34 0.00 0.00 178.44 178.11 2ddk h LEU 194 N 0.71 0.00 0.00 2.25 6.46 -0.22 -3.18 115.31 121.34 2ddk h LEU 194 Ca 0.52 0.00 -0.13 0.00 -0.12 0.00 0.00 57.88 58.15 2ddk h LEU 194 Cb 0.86 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 2ddk h LEU 194 CO -0.28 0.34 -1.03 -0.74 -0.62 0.00 0.00 178.44 176.11 2ddk h HIS 195 N 0.00 0.00 0.00 1.25 2.76 -0.74 -3.26 115.15 115.16 2ddk h HIS 195 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2ddk h HIS 195 Cb 0.66 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.62 2ddk h HIS 195 CO 0.00 0.48 0.07 0.00 -1.30 0.00 0.00 177.93 177.18 2ddk n ALA 196 N -2.31 0.86 -1.17 5.26 0.00 -1.10 -4.65 120.51 117.40 2ddk n ALA 196 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2ddk n ALA 196 Cb 0.77 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2ddk n ALA 196 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ddk n LYS 197 N -1.05 0.00 -1.53 0.00 5.02 -1.23 -4.09 118.16 115.28 2ddk n LYS 197 Ca 0.00 0.10 -0.49 0.00 -2.02 0.00 0.00 58.31 55.90 2ddk n LYS 197 Cb 0.07 -2.50 -0.04 0.00 -0.02 0.00 0.00 35.03 32.54 2ddk n LYS 197 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ddk n ALA 198 N -0.69 -1.58 0.27 7.82 0.00 -1.23 -4.12 120.51 120.98 2ddk n ALA 198 Ca 0.00 0.46 0.12 0.00 0.00 0.00 0.00 53.44 54.02 2ddk n ALA 198 Cb 0.24 -1.89 0.74 0.00 0.00 0.00 0.00 19.45 18.54 2ddk n ALA 198 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2ddk h HIS 199 N 2.52 0.00 0.00 0.00 2.76 -1.45 -3.47 115.15 115.52 2ddk h HIS 199 Ca -0.40 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.77 2ddk h HIS 199 Cb 1.38 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.34 2ddk h HIS 199 CO 0.50 0.09 0.00 0.41 -1.30 0.00 0.00 177.93 177.63 2ddk n GLY 200 N -1.01 0.26 2.85 5.26 0.00 -1.13 -5.00 105.19 106.42 2ddk n GLY 200 Ca -0.02 -0.83 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 2ddk n GLY 200 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ddk s VAL 201 N -2.00 0.15 0.28 1.61 1.01 -1.26 -2.14 120.40 118.06 2ddk s VAL 201 Ca 0.00 0.02 0.11 0.00 0.00 0.00 0.00 61.98 62.11 2ddk s VAL 201 Cb 0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 36.38 36.13 2ddk s VAL 201 CO 0.00 0.10 -0.12 -0.13 0.00 0.00 0.00 175.10 174.94 2ddk s ARG 202 N 0.53 1.90 -0.28 2.72 1.81 -0.29 -4.98 118.95 120.35 2ddk s ARG 202 Ca -0.05 -1.68 0.01 0.00 -1.72 0.00 0.00 55.73 52.29 2ddk s ARG 202 Cb -0.08 -1.89 0.17 0.00 -0.45 0.00 0.00 34.95 32.70 2ddk s ARG 202 CO -0.01 0.31 0.51 0.08 -0.68 0.00 0.00 175.30 175.51 2ddk s VAL 203 N -2.46 -0.83 -1.22 3.52 1.01 -1.26 -1.73 120.40 117.43 2ddk s VAL 203 Ca 0.31 -0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.31 2ddk s VAL 203 Cb -0.05 -0.96 0.14 0.00 0.00 0.00 0.00 36.38 35.52 2ddk s VAL 203 CO 0.17 -0.09 0.95 2.30 0.00 0.00 0.00 175.10 178.43 2ddk n ILE 204 N 5.40 0.27 -1.14 2.22 -5.35 -1.26 -5.01 119.36 114.49 2ddk n ILE 204 Ca 0.00 -0.64 -0.01 0.00 -0.27 0.00 0.00 62.75 61.84 2ddk n ILE 204 Cb 0.51 1.03 -0.00 0.00 -1.74 0.00 0.00 39.64 39.43 2ddk n ILE 204 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ddk n GLY 205 N 0.57 0.44 3.15 3.28 0.00 -1.26 -4.92 105.19 106.45 2ddk n GLY 205 Ca 0.08 -1.02 0.04 0.00 0.00 0.00 0.00 46.02 45.12 2ddk n GLY 205 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ddk s SER 206 N -2.99 -1.23 0.20 1.61 0.15 -1.26 -4.13 113.70 106.05 2ddk s SER 206 Ca 0.00 0.36 -0.11 0.00 0.70 0.00 0.00 55.95 56.89 2ddk s SER 206 Cb 0.00 1.86 0.14 0.00 -1.71 0.00 0.00 66.02 66.31 2ddk s SER 206 CO 0.00 -0.23 1.87 0.77 1.20 0.00 0.00 173.24 176.85 2ddk h SER 207 N 7.87 0.79 -0.04 5.45 4.64 -1.95 0.92 113.55 131.22 2ddk h SER 207 Ca -0.10 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2ddk h SER 207 Cb 1.18 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2ddk h SER 207 CO 0.11 0.57 0.02 0.71 -0.87 0.00 0.00 176.83 177.37 2ddk h THR 208 N 0.93 1.06 -0.53 2.95 1.35 -1.97 0.41 112.91 117.11 2ddk h THR 208 Ca 0.26 -0.16 -0.03 0.00 -0.55 0.00 0.00 66.41 65.93 2ddk h THR 208 Cb -0.10 1.09 -0.02 0.00 -1.73 0.00 0.00 68.15 67.39 2ddk h THR 208 CO -0.06 0.05 0.22 -0.07 -0.25 0.00 0.00 175.52 175.41 2ddk h LEU 209 N 0.00 0.72 -0.24 3.87 4.07 -1.91 0.17 115.31 121.99 2ddk h LEU 209 Ca 0.01 -0.16 0.04 0.00 0.08 0.00 0.00 57.88 57.86 2ddk h LEU 209 Cb 0.06 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 41.57 2ddk h LEU 209 CO -0.00 0.68 -0.01 0.00 -1.08 0.00 0.00 178.44 178.03 2ddk h ALA 210 N 1.07 0.20 -0.74 1.53 0.00 -0.57 -0.10 119.26 120.65 2ddk h ALA 210 Ca 0.18 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.23 2ddk h ALA 210 Cb 0.18 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2ddk h ALA 210 CO -0.02 -0.43 0.42 -0.07 0.00 0.00 0.00 179.25 179.15 2ddk h LEU 211 N 0.06 0.60 -1.51 0.00 -0.00 0.60 -0.94 115.31 114.12 2ddk h LEU 211 Ca 0.11 0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 58.01 2ddk h LEU 211 Cb 0.15 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 40.72 2ddk h LEU 211 CO -0.20 0.37 0.08 0.00 -0.00 0.00 0.00 178.44 178.69 2ddk h HIS 213 N 0.40 0.00 0.14 0.00 3.86 0.33 0.45 115.15 120.33 2ddk h HIS 213 Ca 0.10 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 2ddk h HIS 213 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 2ddk h HIS 213 CO 0.00 0.15 -0.06 1.25 0.86 0.00 0.00 177.93 180.13 2ddk h LEU 214 N 0.00 -0.15 -0.51 2.43 5.85 -0.40 -0.17 115.31 122.36 2ddk h LEU 214 Ca -0.00 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.49 2ddk h LEU 214 Cb 0.27 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2ddk h LEU 214 CO 0.02 0.19 0.28 0.00 -0.34 0.00 0.00 178.44 178.59 2ddk h ALA 215 N 0.29 0.66 -0.62 1.25 0.00 -0.63 -2.62 119.26 117.60 2ddk h ALA 215 Ca -0.02 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2ddk h ALA 215 Cb 0.41 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2ddk h ALA 215 CO 0.03 -0.04 0.12 0.66 0.00 0.00 0.00 179.25 180.02 2ddk h SER 216 N 0.56 0.93 0.00 0.00 4.64 -0.93 -2.89 113.55 115.85 2ddk h SER 216 Ca 0.22 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2ddk h SER 216 Cb 0.08 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 2ddk h SER 216 CO -0.12 0.92 0.00 0.61 -0.87 0.00 0.00 176.83 177.36 2ddk n GLY 217 N -0.71 1.68 0.33 -0.77 0.00 -0.21 -4.32 105.19 101.19 2ddk n GLY 217 Ca 0.04 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.25 2ddk n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddk h ALA 218 N 0.00 1.46 -1.86 4.61 0.00 -1.44 -3.40 119.26 118.62 2ddk h ALA 218 Ca 0.00 -0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 2ddk h ALA 218 Cb 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 17.66 2ddk h ALA 218 CO 0.00 -0.20 -0.62 0.00 0.00 0.00 0.00 179.25 178.44 2ddk s ALA 219 N -4.39 2.77 -0.08 0.00 0.00 -0.92 -4.90 121.76 114.24 2ddk s ALA 219 Ca -0.05 -2.16 0.02 0.00 0.00 0.00 0.00 51.96 49.77 2ddk s ALA 219 Cb 0.13 0.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 2ddk s ALA 219 CO 0.45 -0.16 0.11 -0.25 0.00 0.00 0.00 175.76 175.91 2ddk n ASP 220 N -0.81 0.16 -3.57 0.00 10.43 0.12 -4.55 116.55 118.33 2ddk n ASP 220 Ca -0.04 -0.58 -0.06 0.00 2.57 0.00 0.00 54.79 56.68 2ddk n ASP 220 Cb 0.66 0.91 -0.02 0.00 1.84 0.00 0.00 41.12 44.52 2ddk n ASP 220 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2ddk s ALA 221 N -1.06 -1.86 0.00 2.24 0.00 -1.17 -0.48 121.76 119.44 2ddk s ALA 221 Ca 0.01 0.91 -0.15 0.00 0.00 0.00 0.00 51.96 52.73 2ddk s ALA 221 Cb 0.01 0.37 0.02 0.00 0.00 0.00 0.00 23.12 23.53 2ddk s ALA 221 CO 0.06 -0.77 0.33 -0.47 0.00 0.00 0.00 175.76 174.91 2ddk s TYR 222 N -2.99 -0.18 0.02 0.00 5.04 0.18 -1.31 117.35 118.11 2ddk s TYR 222 Ca 0.08 0.22 -0.23 0.00 -2.44 0.00 0.00 57.07 54.70 2ddk s TYR 222 Cb -0.01 0.12 0.05 0.00 0.35 0.00 0.00 41.96 42.47 2ddk s TYR 222 CO -0.06 -0.44 0.51 1.52 -1.34 0.00 0.00 175.55 175.75 2ddk s TYR 223 N -1.70 -0.42 -0.25 4.97 -0.85 -1.13 -1.76 117.35 116.22 2ddk s TYR 223 Ca -0.11 0.53 -0.29 0.00 -0.52 0.00 0.00 57.07 56.68 2ddk s TYR 223 Cb -0.04 0.31 0.17 0.00 0.38 0.00 0.00 41.96 42.79 2ddk s TYR 223 CO 0.02 -0.60 1.25 -1.14 -1.52 0.00 0.00 175.55 173.56 2ddk s GLN 224 N -2.11 0.23 -0.16 -3.49 0.74 -0.86 -4.03 119.66 109.99 2ddk s GLN 224 Ca -0.07 0.07 0.01 0.00 0.05 0.00 0.00 55.36 55.42 2ddk s GLN 224 Cb -0.01 0.11 0.01 0.00 1.10 0.00 0.00 33.01 34.22 2ddk s GLN 224 CO 0.01 -0.07 -0.18 -0.06 -0.55 0.00 0.00 175.29 174.44 2ddk s PHE 225 N -0.97 2.75 0.00 1.67 0.40 -1.26 -2.10 117.98 118.47 2ddk s PHE 225 Ca 0.05 -1.30 0.00 0.00 -0.60 0.00 0.00 56.93 55.08 2ddk s PHE 225 Cb -0.01 -1.89 0.00 0.00 0.51 0.00 0.00 43.02 41.63 2ddk s PHE 225 CO -0.05 -0.62 0.00 0.41 0.70 0.00 0.00 175.22 175.66 2ddk n GLY 226 N 4.26 1.26 3.68 4.36 0.00 0.37 -4.50 105.19 114.63 2ddk n GLY 226 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2ddk n GLY 226 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ddk s LEU 227 N 0.00 4.16 0.70 0.99 2.34 -0.64 -4.90 118.68 121.33 2ddk s LEU 227 Ca 0.00 0.33 -0.14 0.00 0.06 0.00 0.00 54.13 54.38 2ddk s LEU 227 Cb 0.00 -2.29 0.02 0.00 -0.56 0.00 0.00 46.19 43.36 2ddk s LEU 227 CO 0.00 0.03 1.11 -1.00 -1.06 0.00 0.00 176.35 175.43 2ddk s HIS 228 N 1.01 2.53 0.41 3.48 3.76 -1.26 -4.11 115.29 121.11 2ddk s HIS 228 Ca 0.13 1.56 0.13 0.00 -0.15 0.00 0.00 55.06 56.74 2ddk s HIS 228 Cb -0.14 -3.17 0.98 0.00 1.11 0.00 0.00 32.58 31.37 2ddk s HIS 228 CO 0.05 -1.83 1.92 0.00 -0.85 0.00 0.00 174.74 174.03 2ddk n TRP 230 N -4.49 0.00 -0.09 0.00 2.14 -1.26 -0.34 117.44 113.40 2ddk n TRP 230 Ca 0.14 0.00 -0.08 0.00 2.07 0.00 0.00 57.50 59.63 2ddk n TRP 230 Cb 0.47 -0.08 -0.16 0.00 -0.81 0.00 0.00 31.31 30.74 2ddk n TRP 230 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 2ddk n ASP 231 N -1.08 0.03 -0.34 -0.67 8.00 -0.58 -4.00 116.55 117.92 2ddk n ASP 231 Ca 0.03 0.02 0.07 0.00 0.71 0.00 0.00 54.79 55.61 2ddk n ASP 231 Cb 0.02 1.05 0.01 0.00 -0.02 0.00 0.00 41.12 42.18 2ddk n ASP 231 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ddk n LEU 232 N -2.71 1.56 0.42 0.64 -0.00 0.53 -4.37 117.00 113.07 2ddk n LEU 232 Ca -0.30 -0.81 -0.17 0.00 -0.00 0.00 0.00 56.01 54.74 2ddk n LEU 232 Cb 1.10 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 44.44 2ddk n LEU 232 CO 0.43 0.30 0.48 0.00 -0.00 0.00 0.00 177.39 178.60 2ddk h ALA 233 N 2.37 -1.19 0.61 1.47 0.00 -1.10 -0.15 119.26 121.27 2ddk h ALA 233 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2ddk h ALA 233 Cb 0.47 0.42 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2ddk h ALA 233 CO 0.00 -1.11 -0.36 0.00 0.00 0.00 0.00 179.25 177.78 2ddk h ALA 234 N -1.41 -0.93 -0.32 0.00 0.00 -1.83 -2.69 119.26 112.07 2ddk h ALA 234 Ca -0.11 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.71 2ddk h ALA 234 Cb 0.83 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 2ddk h ALA 234 CO 0.18 -1.03 0.43 0.00 0.00 0.00 0.00 179.25 178.83 2ddk h ALA 235 N -0.58 1.95 -0.06 0.00 0.00 -1.76 -2.46 119.26 116.36 2ddk h ALA 235 Ca -0.08 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2ddk h ALA 235 Cb 0.73 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2ddk h ALA 235 CO 0.08 -0.60 -0.20 1.15 0.00 0.00 0.00 179.25 179.69 2ddk h THR 236 N 0.00 1.44 -0.54 0.00 2.02 -0.67 -1.13 112.91 114.03 2ddk h THR 236 Ca 0.15 -1.60 -0.01 0.00 0.77 0.00 0.00 66.41 65.73 2ddk h THR 236 Cb 1.01 2.33 -0.03 0.00 -1.74 0.00 0.00 68.15 69.73 2ddk h THR 236 CO -0.00 0.45 0.31 1.62 0.37 0.00 0.00 175.52 178.26 2ddk h VAL 237 N -0.29 1.17 0.05 3.16 3.04 -1.44 -2.21 116.25 119.74 2ddk h VAL 237 Ca -0.01 -0.42 0.02 0.00 -1.01 0.00 0.00 66.70 65.29 2ddk h VAL 237 Cb 0.82 0.47 -0.03 0.00 -2.01 0.00 0.00 31.29 30.54 2ddk h VAL 237 CO 0.04 0.18 -0.20 0.40 -1.01 0.00 0.00 177.57 176.98 2ddk h ILE 238 N 0.72 0.54 -0.90 3.17 2.04 -1.51 -0.74 117.51 120.83 2ddk h ILE 238 Ca 0.19 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 2ddk h ILE 238 Cb 0.02 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.59 2ddk h ILE 238 CO -0.03 0.00 0.50 0.40 0.00 0.00 0.00 178.15 179.02 2ddk h ILE 239 N -0.35 1.26 -0.12 -0.67 2.04 -1.05 -2.80 117.51 115.82 2ddk h ILE 239 Ca 0.04 -0.63 -0.15 0.00 1.00 0.00 0.00 64.86 65.13 2ddk h ILE 239 Cb 0.40 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2ddk h ILE 239 CO -0.15 0.29 -0.57 0.03 0.00 0.00 0.00 178.15 177.75 2ddk h ARG 240 N 1.25 0.38 -0.50 2.37 3.08 -1.19 -0.49 114.38 119.29 2ddk h ARG 240 Ca 0.32 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2ddk h ARG 240 Cb 0.02 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2ddk h ARG 240 CO -0.05 0.85 0.00 0.39 -1.07 0.00 0.00 179.97 180.08 2ddk n GLU 241 N -3.92 0.87 0.00 0.04 -0.58 -0.30 -1.99 120.64 114.76 2ddk n GLU 241 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 2ddk n GLU 241 Cb 0.60 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 2ddk n GLU 241 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ddk n ALA 242 N -0.18 1.27 -0.05 0.62 0.00 -0.89 -0.74 120.51 120.55 2ddk n ALA 242 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2ddk n ALA 242 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 2ddk n ALA 242 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ddk n GLY 243 N -0.13 0.43 3.93 0.00 0.00 -0.84 -0.85 105.19 107.73 2ddk n GLY 243 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2ddk n GLY 243 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ddk s GLY 244 N -1.60 1.67 0.14 -0.02 0.00 -0.24 -4.84 107.32 102.43 2ddk s GLY 244 Ca 0.00 -0.89 0.10 0.00 0.00 0.00 0.00 44.72 43.94 2ddk s GLY 244 CO 0.00 -0.55 -0.25 -0.26 0.00 0.00 0.00 173.10 172.04 2ddk s ILE 245 N -3.06 2.17 -0.21 0.90 -4.36 -0.78 -3.88 121.20 111.98 2ddk s ILE 245 Ca 0.57 -1.80 -0.02 0.00 -0.26 0.00 0.00 60.65 59.13 2ddk s ILE 245 Cb -0.11 -1.95 0.06 0.00 1.25 0.00 0.00 42.46 41.72 2ddk s ILE 245 CO 0.44 -0.01 0.03 -0.69 0.24 0.00 0.00 174.94 174.94 2ddk s VAL 246 N -1.29 0.72 0.18 8.37 1.01 -1.26 -1.45 120.40 126.67 2ddk s VAL 246 Ca 0.15 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2ddk s VAL 246 Cb -0.09 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.07 2ddk s VAL 246 CO 0.07 -0.25 0.01 2.30 0.00 0.00 0.00 175.10 177.23 2ddk n ILE 247 N 4.97 0.00 -3.22 2.22 -5.35 -0.83 -4.02 119.36 113.12 2ddk n ILE 247 Ca -0.09 -0.84 -0.29 0.00 -0.27 0.00 0.00 62.75 61.27 2ddk n ILE 247 Cb 0.46 0.14 -0.03 0.00 -1.74 0.00 0.00 39.64 38.47 2ddk n ILE 247 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2ddk s ASP 248 N -1.98 6.47 0.32 7.28 -1.08 0.10 -1.81 116.67 125.96 2ddk s ASP 248 Ca 0.00 0.83 0.09 0.00 -0.52 0.00 0.00 52.55 52.95 2ddk s ASP 248 Cb -0.00 -2.19 0.91 0.00 -1.46 0.00 0.00 42.92 40.18 2ddk s ASP 248 CO 0.00 -0.24 1.66 0.71 0.52 0.00 0.00 175.17 177.82 2ddk h THR 249 N 1.31 0.31 -3.16 1.71 1.35 -1.81 -3.30 112.91 109.32 2ddk h THR 249 Ca -0.48 -0.10 -0.58 0.00 -0.55 0.00 0.00 66.41 64.71 2ddk h THR 249 Cb 1.19 0.01 -0.06 0.00 -1.73 0.00 0.00 68.15 67.55 2ddk h THR 249 CO 0.66 0.05 0.67 -0.94 -0.25 0.00 0.00 175.52 175.71 2ddk s SER 250 N -5.00 7.05 0.00 5.36 1.04 -1.26 -4.42 113.70 116.48 2ddk s SER 250 Ca -0.11 1.31 0.00 0.00 0.48 0.00 0.00 55.95 57.63 2ddk s SER 250 Cb 0.28 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.89 2ddk s SER 250 CO 0.78 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 175.02 2ddk n GLY 251 N 3.39 0.00 0.00 7.32 0.00 -1.24 -4.52 105.19 110.14 2ddk n GLY 251 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2ddk n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddk n GLY 252 N -0.27 -1.96 3.81 -0.02 0.00 -1.26 -4.75 105.19 100.75 2ddk n GLY 252 Ca 0.00 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 2ddk n GLY 252 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ddk s PRO 253 N -1.81 3.63 0.26 1.61 0.04 -1.26 -0.73 135.00 136.74 2ddk s PRO 253 Ca 0.00 1.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 2ddk s PRO 253 Cb 0.00 -2.08 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 2ddk s PRO 253 CO 0.00 -0.55 1.52 -1.17 0.04 0.00 0.00 177.00 176.85 2ddk s LEU 254 N -4.14 4.37 -0.21 -3.56 2.96 -1.26 -3.39 118.68 113.45 2ddk s LEU 254 Ca 0.63 2.78 -0.02 0.00 -0.22 0.00 0.00 54.13 57.30 2ddk s LEU 254 Cb -0.14 -3.62 0.06 0.00 0.50 0.00 0.00 46.19 42.99 2ddk s LEU 254 CO 0.31 -0.81 0.02 -0.62 -1.32 0.00 0.00 176.35 173.93 2ddk s ASP 255 N 0.52 3.16 0.18 3.68 3.68 -1.26 -4.91 116.67 121.72 2ddk s ASP 255 Ca 0.62 -0.94 -0.13 0.00 2.13 0.00 0.00 52.55 54.23 2ddk s ASP 255 Cb -0.45 -0.73 0.09 0.00 -1.45 0.00 0.00 42.92 40.39 2ddk s ASP 255 CO 0.43 -0.30 1.84 -0.07 0.13 0.00 0.00 175.17 177.20 2ddk h LEU 256 N 8.18 0.60 0.00 -1.34 4.07 -1.91 -1.63 115.31 123.27 2ddk h LEU 256 Ca -0.16 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.79 2ddk h LEU 256 Cb 1.10 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.70 2ddk h LEU 256 CO 0.36 0.43 0.04 0.80 -1.08 0.00 0.00 178.44 178.99 2ddk n MET 257 N -4.73 0.00 0.09 1.13 1.56 -1.26 -2.28 117.12 111.63 2ddk n MET 257 Ca 0.04 0.46 -0.04 0.00 -0.27 0.00 0.00 57.70 57.88 2ddk n MET 257 Cb 0.04 -1.54 -0.03 0.00 2.15 0.00 0.00 33.22 33.84 2ddk n MET 257 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2ddk h ALA 258 N 1.83 0.54 -1.91 -5.12 0.00 -1.69 -3.48 119.26 109.43 2ddk h ALA 258 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 54.91 53.84 2ddk h ALA 258 Cb 0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2ddk h ALA 258 CO 0.00 1.06 -0.37 0.00 0.00 0.00 0.00 179.25 179.94 2ddk s ARG 260 N -4.51 0.39 0.12 0.00 1.70 -1.26 0.14 118.95 115.54 2ddk s ARG 260 Ca 0.00 0.49 -0.13 0.00 -0.47 0.00 0.00 55.73 55.62 2ddk s ARG 260 Cb 0.00 0.17 0.02 0.00 -0.57 0.00 0.00 34.95 34.57 2ddk s ARG 260 CO 0.00 -0.06 0.33 0.54 -1.08 0.00 0.00 175.30 175.03 2ddk s VAL 261 N 0.29 0.09 -0.30 4.99 0.11 -0.89 -4.47 120.40 120.22 2ddk s VAL 261 Ca -0.01 -0.87 -0.01 0.00 -2.93 0.00 0.00 61.98 58.16 2ddk s VAL 261 Cb -0.03 -1.32 0.13 0.00 -1.53 0.00 0.00 36.38 33.63 2ddk s VAL 261 CO -0.01 -0.41 0.27 -0.69 -3.33 0.00 0.00 175.10 170.93 2ddk s VAL 262 N -3.84 -0.31 0.04 2.04 1.01 -0.75 -2.02 120.40 116.57 2ddk s VAL 262 Ca 0.06 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.42 2ddk s VAL 262 Cb 0.03 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2ddk s VAL 262 CO -0.10 -0.55 -0.00 0.00 0.00 0.00 0.00 175.10 174.45 2ddk s ALA 263 N 2.16 3.28 0.28 5.51 0.00 -0.72 -1.97 121.76 130.29 2ddk s ALA 263 Ca 0.10 -1.04 -0.13 0.00 0.00 0.00 0.00 51.96 50.90 2ddk s ALA 263 Cb -0.15 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2ddk s ALA 263 CO -0.29 0.67 0.53 0.00 0.00 0.00 0.00 175.76 176.67 2ddk s ALA 264 N -1.19 -0.26 0.05 0.00 0.00 -0.53 0.47 121.76 120.30 2ddk s ALA 264 Ca 0.23 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 51.04 2ddk s ALA 264 Cb -0.12 1.02 -0.17 0.00 0.00 0.00 0.00 23.12 23.86 2ddk s ALA 264 CO 0.14 -0.88 1.55 0.66 0.00 0.00 0.00 175.76 177.23 2ddk h SER 265 N 2.19 -0.16 -2.94 0.00 4.64 -1.07 -2.06 113.55 114.14 2ddk h SER 265 Ca -0.26 -0.12 -0.51 0.00 -0.47 0.00 0.00 61.79 60.43 2ddk h SER 265 Cb 1.25 0.04 -0.14 0.00 -0.31 0.00 0.00 62.40 63.24 2ddk h SER 265 CO 0.35 0.03 -0.59 0.42 -0.87 0.00 0.00 176.83 176.17 2ddk s THR 266 N -5.53 1.17 0.09 2.95 -4.23 -1.25 -4.28 115.64 104.55 2ddk s THR 266 Ca -0.14 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.18 2ddk s THR 266 Cb 0.04 -2.71 -0.08 0.00 1.34 0.00 0.00 72.50 71.09 2ddk s THR 266 CO 0.64 0.00 1.53 -0.09 -0.54 0.00 0.00 174.62 176.16 2ddk h ARG 267 N 1.99 0.46 -0.40 3.99 9.65 -1.90 0.16 114.38 128.32 2ddk h ARG 267 Ca -0.40 -0.14 0.06 0.00 -1.10 0.00 0.00 59.98 58.40 2ddk h ARG 267 Cb 1.25 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 29.73 2ddk h ARG 267 CO 0.69 0.62 0.07 1.49 2.80 0.00 0.00 179.97 185.64 2ddk h GLU 268 N 0.24 0.19 0.51 0.20 4.81 -1.91 0.19 114.58 118.81 2ddk h GLU 268 Ca 0.07 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 2ddk h GLU 268 Cb 0.41 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2ddk h GLU 268 CO 0.01 0.13 -0.26 0.52 -0.73 0.00 0.00 179.01 178.68 2ddk h MET 269 N 0.20 -0.69 -0.43 1.92 2.86 -1.69 -0.88 114.93 116.22 2ddk h MET 269 Ca 0.19 0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.97 2ddk h MET 269 Cb 0.24 0.16 -0.08 0.00 0.06 0.00 0.00 31.60 31.98 2ddk h MET 269 CO -0.26 -0.46 -0.08 0.00 1.06 0.00 0.00 176.91 177.17 2ddk h ALA 270 N -0.23 0.31 -0.59 6.32 0.00 -0.24 0.07 119.26 124.91 2ddk h ALA 270 Ca -0.07 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2ddk h ALA 270 Cb 0.56 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2ddk h ALA 270 CO 0.10 -0.44 0.24 0.52 0.00 0.00 0.00 179.25 179.67 2ddk h MET 271 N 0.02 0.88 -0.61 0.00 2.07 -0.55 -1.02 114.93 115.73 2ddk h MET 271 Ca 0.21 -0.16 0.04 0.00 -2.07 0.00 0.00 59.70 57.72 2ddk h MET 271 Cb 0.32 -0.14 -0.03 0.00 -1.87 0.00 0.00 31.60 29.87 2ddk h MET 271 CO -0.42 0.75 0.40 -0.07 1.07 0.00 0.00 176.91 178.64 2ddk h LEU 272 N 0.81 0.59 0.23 1.22 3.38 -0.24 -0.30 115.31 121.00 2ddk h LEU 272 Ca 0.20 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2ddk h LEU 272 Cb 0.20 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2ddk h LEU 272 CO -0.02 0.40 -0.11 0.40 0.09 0.00 0.00 178.44 179.20 2ddk h ILE 273 N 0.68 0.83 0.00 1.22 1.08 -0.02 -2.45 117.51 118.86 2ddk h ILE 273 Ca 0.25 -0.69 0.00 0.00 -0.39 0.00 0.00 64.86 64.03 2ddk h ILE 273 Cb 0.14 1.22 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 2ddk h ILE 273 CO -0.07 0.15 0.06 0.00 -0.69 0.00 0.00 178.15 177.59 2ddk h ALA 274 N -0.04 1.06 -1.72 1.87 0.00 -0.80 -0.82 119.26 118.82 2ddk h ALA 274 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2ddk h ALA 274 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2ddk h ALA 274 CO 0.05 -0.06 0.00 1.04 0.00 0.00 0.00 179.25 180.29 2ddk n GLN 275 N -2.99 0.00 -0.35 0.00 6.02 -0.16 -3.56 117.38 116.34 2ddk n GLN 275 Ca -0.03 0.21 0.27 0.00 -0.01 0.00 0.00 57.00 57.44 2ddk n GLN 275 Cb 0.12 -0.99 0.55 0.00 1.02 0.00 0.00 30.24 30.95 2ddk n GLN 275 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ddk h ALA 276 N -2.00 2.38 -2.30 -1.58 0.00 -1.34 -3.41 119.26 111.01 2ddk h ALA 276 Ca 0.00 0.07 -0.59 0.00 0.00 0.00 0.00 54.91 54.39 2ddk h ALA 276 Cb 0.00 0.08 0.12 0.00 0.00 0.00 0.00 17.79 17.99 2ddk h ALA 276 CO 0.00 -0.84 0.17 -0.11 0.00 0.00 0.00 179.25 178.46 2ddk n LEU 277 N -4.63 2.40 -4.22 0.00 -0.00 -0.33 -4.72 117.00 105.50 2ddk n LEU 277 Ca 0.28 1.08 -0.36 0.00 -0.00 0.00 0.00 56.01 57.01 2ddk n LEU 277 Cb 1.03 -1.34 -0.13 0.00 -0.00 0.00 0.00 43.42 42.97 2ddk n LEU 277 CO 0.25 -1.42 -0.31 -1.58 -0.00 0.00 0.00 177.39 174.33 2ddk s GLN 278 N -1.87 2.55 0.37 1.96 0.74 -1.26 -4.94 119.66 117.20 2ddk s GLN 278 Ca 0.61 -1.20 0.06 0.00 0.05 0.00 0.00 55.36 54.88 2ddk s GLN 278 Cb -0.59 -3.31 0.35 0.00 1.10 0.00 0.00 33.01 30.56 2ddk s GLN 278 CO 0.58 -0.63 1.03 1.79 -0.55 0.00 0.00 175.29 177.52 2ddk h THR 279 N 6.31 0.00 -0.00 -0.34 1.35 -1.92 -3.49 112.91 114.82 2ddk h THR 279 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2ddk h THR 279 Cb 1.07 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 2ddk h THR 279 CO 0.57 0.00 0.00 -0.38 -0.25 0.00 0.00 175.52 175.46