#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkj s ARG 7 N 0.00 4.72 -1.32 -1.58 3.52 -1.26 -4.94 118.95 118.10 2dkj s ARG 7 Ca 0.00 1.63 -0.17 0.00 -0.13 0.00 0.00 55.73 57.06 2dkj s ARG 7 Cb 0.00 -3.19 0.05 0.00 -1.56 0.00 0.00 34.95 30.25 2dkj s ARG 7 CO 0.00 0.35 1.86 -3.47 -0.81 0.00 0.00 175.30 173.22 2dkj n ASP 8 N 1.26 4.58 0.09 -2.12 -0.08 -1.26 -4.79 116.55 114.23 2dkj n ASP 8 Ca -0.01 -2.89 0.04 0.00 -1.51 0.00 0.00 54.79 50.42 2dkj n ASP 8 Cb 0.46 -1.72 0.47 0.00 2.34 0.00 0.00 41.12 42.67 2dkj n ASP 8 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2dkj h GLU 9 N 7.34 0.34 -0.53 -0.67 4.39 -1.98 -1.88 114.58 121.58 2dkj h GLU 9 Ca 0.46 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 60.09 2dkj h GLU 9 Cb 0.82 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 2dkj h GLU 9 CO 1.55 0.28 0.15 0.00 -1.16 0.00 0.00 179.01 179.83 2dkj h ALA 10 N 1.77 0.70 -0.21 3.43 0.00 -2.00 -1.27 119.26 121.68 2dkj h ALA 10 Ca 0.09 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2dkj h ALA 10 Cb 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2dkj h ALA 10 CO -0.01 0.37 -0.21 1.25 0.00 0.00 0.00 179.25 180.65 2dkj h LEU 11 N 0.73 0.54 -1.51 0.00 7.12 -1.88 -3.11 115.31 117.21 2dkj h LEU 11 Ca 0.17 -0.48 -0.03 0.00 0.13 0.00 0.00 57.88 57.67 2dkj h LEU 11 Cb 0.30 -0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 40.27 2dkj h LEU 11 CO -0.00 0.91 -0.16 -0.26 -0.13 0.00 0.00 178.44 178.79 2dkj h PHE 12 N 0.18 0.00 -0.42 1.25 -1.00 -1.28 -1.48 116.94 114.19 2dkj h PHE 12 Ca 0.03 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.72 2dkj h PHE 12 Cb 0.76 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.30 2dkj h PHE 12 CO 0.08 0.16 -0.13 1.49 -1.61 0.00 0.00 178.31 178.31 2dkj h GLU 13 N 0.00 0.75 -0.46 1.51 4.22 -1.18 -1.61 114.58 117.81 2dkj h GLU 13 Ca -0.00 -0.25 -0.13 0.00 0.08 0.00 0.00 59.36 59.05 2dkj h GLU 13 Cb 0.55 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2dkj h GLU 13 CO 0.02 0.85 -0.23 -0.07 -2.18 0.00 0.00 179.01 177.40 2dkj h LEU 14 N 0.68 1.00 -0.91 1.64 3.38 -1.23 -2.03 115.31 117.84 2dkj h LEU 14 Ca 0.11 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2dkj h LEU 14 Cb 0.60 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2dkj h LEU 14 CO 0.04 1.19 0.37 0.40 0.09 0.00 0.00 178.44 180.52 2dkj h ILE 15 N 0.82 1.25 -0.78 1.22 2.04 -1.06 -0.50 117.51 120.50 2dkj h ILE 15 Ca 0.10 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 2dkj h ILE 15 Cb 0.81 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 2dkj h ILE 15 CO 0.07 0.31 0.34 0.00 0.00 0.00 0.00 178.15 178.87 2dkj h ALA 16 N 1.26 1.14 -0.64 1.87 0.00 -1.11 -0.60 119.26 121.19 2dkj h ALA 16 Ca 0.27 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2dkj h ALA 16 Cb 0.14 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2dkj h ALA 16 CO -0.03 0.64 0.12 -0.07 0.00 0.00 0.00 179.25 179.90 2dkj h LEU 17 N 1.12 0.97 -0.65 0.00 3.38 -0.62 -1.80 115.31 117.71 2dkj h LEU 17 Ca 0.26 -0.21 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 2dkj h LEU 17 Cb 0.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2dkj h LEU 17 CO -0.03 0.96 -0.30 -0.08 0.09 0.00 0.00 178.44 179.08 2dkj h GLU 18 N 0.97 0.72 -0.63 1.13 4.57 -0.53 -0.33 114.58 120.48 2dkj h GLU 18 Ca 0.20 -0.32 -0.02 0.00 -1.18 0.00 0.00 59.36 58.03 2dkj h GLU 18 Cb 0.39 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.94 2dkj h GLU 18 CO 0.01 0.93 0.30 0.93 -1.18 0.00 0.00 179.01 180.00 2dkj h GLU 19 N 0.62 0.91 -0.52 1.92 5.08 -0.86 -0.66 114.58 121.06 2dkj h GLU 19 Ca 0.07 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2dkj h GLU 19 Cb 0.82 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 2dkj h GLU 19 CO 0.07 0.73 0.14 -0.22 -1.00 0.00 0.00 179.01 178.74 2dkj h LYS 20 N 0.86 0.82 -0.46 2.33 3.64 -1.08 -1.75 116.57 120.94 2dkj h LYS 20 Ca 0.21 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2dkj h LYS 20 Cb 0.13 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2dkj h LYS 20 CO -0.03 0.77 0.30 -0.09 -2.27 0.00 0.00 179.45 178.14 2dkj h ARG 21 N 0.72 0.60 -0.35 1.90 2.43 -0.68 -1.51 114.38 117.49 2dkj h ARG 21 Ca 0.16 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2dkj h ARG 21 Cb 0.31 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2dkj h ARG 21 CO -0.00 0.40 0.05 1.96 -1.51 0.00 0.00 179.97 180.87 2dkj h GLN 22 N 0.62 0.52 -0.02 0.20 4.20 -0.90 -2.80 115.11 116.93 2dkj h GLN 22 Ca 0.17 -0.09 -0.15 0.00 0.06 0.00 0.00 58.65 58.64 2dkj h GLN 22 Cb -0.07 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 2dkj h GLN 22 CO -0.04 0.51 -0.67 0.00 -0.67 0.00 0.00 178.83 177.96 2dkj h ARG 23 N 0.51 0.08 -0.64 1.46 3.08 -0.75 -3.35 114.38 114.76 2dkj h ARG 23 Ca 0.12 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2dkj h ARG 23 Cb 0.25 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2dkj h ARG 23 CO 0.00 0.71 0.00 0.39 -1.07 0.00 0.00 179.97 180.01 2dkj n GLU 24 N -3.77 3.66 -4.27 0.04 1.02 -0.62 -3.63 120.64 113.06 2dkj n GLU 24 Ca -0.02 -2.86 -0.16 0.00 -0.02 0.00 0.00 57.16 54.11 2dkj n GLU 24 Cb 0.66 -1.86 -0.10 0.00 -0.02 0.00 0.00 31.44 30.12 2dkj n GLU 24 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2dkj s GLY 25 N -0.95 1.78 -0.33 0.62 0.00 -1.20 -4.24 107.32 102.99 2dkj s GLY 25 Ca 0.50 -1.79 -0.08 0.00 0.00 0.00 0.00 44.72 43.35 2dkj s GLY 25 CO 0.25 -1.49 0.12 1.08 0.00 0.00 0.00 173.10 173.06 2dkj s LEU 26 N -3.27 4.24 -0.50 0.66 1.43 0.09 -4.82 118.68 116.50 2dkj s LEU 26 Ca 0.38 -0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 52.33 2dkj s LEU 26 Cb 0.06 -1.92 0.04 0.00 0.03 0.00 0.00 46.19 44.40 2dkj s LEU 26 CO 0.16 -0.29 0.87 -0.70 0.23 0.00 0.00 176.35 176.62 2dkj s GLU 27 N 1.49 3.37 -0.03 1.70 2.56 -1.26 -1.33 118.70 125.19 2dkj s GLU 27 Ca 0.01 -0.19 0.11 0.00 0.00 0.00 0.00 54.97 54.90 2dkj s GLU 27 Cb -0.18 -4.00 0.33 0.00 2.00 0.00 0.00 34.13 32.27 2dkj s GLU 27 CO 0.04 -1.32 1.27 1.28 -0.56 0.00 0.00 175.26 175.97 2dkj n LEU 28 N 7.10 3.03 -4.68 2.70 4.77 0.41 -4.12 117.00 126.21 2dkj n LEU 28 Ca 0.02 -2.17 -0.42 0.00 -0.03 0.00 0.00 56.01 53.40 2dkj n LEU 28 Cb 0.48 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2dkj n LEU 28 CO 0.62 0.71 1.09 -0.63 -1.33 0.00 0.00 177.39 177.85 2dkj s ILE 29 N -1.31 3.98 0.58 -0.08 1.01 -1.07 -0.70 121.20 123.61 2dkj s ILE 29 Ca 0.25 1.29 0.28 0.00 0.00 0.00 0.00 60.65 62.47 2dkj s ILE 29 Cb 0.15 -3.83 0.36 0.00 0.01 0.00 0.00 42.46 39.15 2dkj s ILE 29 CO 0.14 -0.04 2.09 0.00 0.00 0.00 0.00 174.94 177.13 2dkj h ALA 30 N 8.01 1.88 -0.06 9.38 0.00 -1.84 -1.99 119.26 134.64 2dkj h ALA 30 Ca -0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2dkj h ALA 30 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2dkj h ALA 30 CO 0.92 -0.32 0.00 -1.13 0.00 0.00 0.00 179.25 178.72 2dkj n SER 31 N -3.89 1.68 -4.96 0.00 3.41 -1.26 -4.76 113.62 103.85 2dkj n SER 31 Ca 0.02 -1.59 -0.22 0.00 -0.26 0.00 0.00 58.87 56.82 2dkj n SER 31 Cb 0.34 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 2dkj n SER 31 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2dkj s GLU 32 N -1.94 3.33 0.30 4.33 0.41 -0.75 -4.13 118.70 120.25 2dkj s GLU 32 Ca 0.36 -0.59 -0.18 0.00 -0.41 0.00 0.00 54.97 54.14 2dkj s GLU 32 Cb 0.20 -2.73 0.07 0.00 -1.78 0.00 0.00 34.13 29.89 2dkj s GLU 32 CO 0.32 0.13 0.92 -1.71 -0.49 0.00 0.00 175.26 174.43 2dkj n ASN 33 N -1.71 -2.05 -3.96 -0.19 2.85 -1.26 -3.53 115.26 105.40 2dkj n ASN 33 Ca -0.04 -2.28 -0.29 0.00 -0.11 0.00 0.00 54.58 51.86 2dkj n ASN 33 Cb 0.57 3.39 -0.16 0.00 1.24 0.00 0.00 39.78 44.81 2dkj n ASN 33 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2dkj s PHE 34 N -2.08 2.00 0.60 1.20 0.40 -1.26 -4.95 117.98 113.88 2dkj s PHE 34 Ca 0.19 -1.19 -0.14 0.00 -0.60 0.00 0.00 56.93 55.19 2dkj s PHE 34 Cb -0.04 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 41.98 2dkj s PHE 34 CO 0.09 -0.65 1.04 0.14 0.70 0.00 0.00 175.22 176.54 2dkj s VAL 35 N 1.54 4.15 0.79 -0.44 -7.23 -1.26 -4.89 120.40 113.06 2dkj s VAL 35 Ca 0.02 0.90 -0.11 0.00 -1.81 0.00 0.00 61.98 60.98 2dkj s VAL 35 Cb -0.14 -3.53 0.07 0.00 0.56 0.00 0.00 36.38 33.34 2dkj s VAL 35 CO -0.09 -0.72 1.09 -0.94 -0.31 0.00 0.00 175.10 174.13 2dkj s SER 36 N -3.28 4.50 0.31 4.85 1.04 -1.26 -4.76 113.70 115.10 2dkj s SER 36 Ca 0.60 1.38 -0.00 0.00 0.48 0.00 0.00 55.95 58.41 2dkj s SER 36 Cb -0.13 -2.12 0.48 0.00 0.10 0.00 0.00 66.02 64.35 2dkj s SER 36 CO 0.42 -1.97 1.91 0.11 0.98 0.00 0.00 173.24 174.68 2dkj h LYS 37 N -1.09 0.86 -0.01 4.02 1.57 -1.96 -2.33 116.57 117.64 2dkj h LYS 37 Ca -0.47 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.08 2dkj h LYS 37 Cb 1.26 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 2dkj h LYS 37 CO 0.58 0.68 -0.57 -0.56 -0.57 0.00 0.00 179.45 179.00 2dkj h GLN 38 N 0.86 0.02 -0.62 3.15 3.07 -1.99 0.37 115.11 119.96 2dkj h GLN 38 Ca 0.21 -0.01 -0.08 0.00 0.09 0.00 0.00 58.65 58.86 2dkj h GLN 38 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.65 2dkj h GLN 38 CO -0.03 0.59 0.09 0.28 0.09 0.00 0.00 178.83 179.85 2dkj h VAL 39 N 0.01 1.26 -0.51 1.86 2.07 -1.80 -1.73 116.25 117.41 2dkj h VAL 39 Ca -0.01 -1.03 -0.10 0.00 0.82 0.00 0.00 66.70 66.38 2dkj h VAL 39 Cb 1.02 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2dkj h VAL 39 CO 0.08 0.38 -0.07 0.03 0.02 0.00 0.00 177.57 178.01 2dkj h ARG 40 N 0.95 0.91 -0.67 1.57 3.08 -1.02 -1.90 114.38 117.30 2dkj h ARG 40 Ca 0.19 -0.30 0.01 0.00 0.07 0.00 0.00 59.98 59.95 2dkj h ARG 40 Cb 0.45 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 2dkj h ARG 40 CO 0.02 0.95 0.44 1.49 -1.07 0.00 0.00 179.97 181.79 2dkj h GLU 41 N 0.82 0.88 -0.33 0.04 4.81 -0.61 0.38 114.58 120.58 2dkj h GLU 41 Ca 0.14 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 2dkj h GLU 41 Cb 0.59 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2dkj h GLU 41 CO 0.04 0.58 -0.00 0.00 -0.73 0.00 0.00 179.01 178.89 2dkj h ALA 42 N 1.25 0.44 -0.13 2.92 0.00 -1.13 -2.85 119.26 119.76 2dkj h ALA 42 Ca 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2dkj h ALA 42 Cb -0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2dkj h ALA 42 CO -0.06 0.20 -0.15 0.28 0.00 0.00 0.00 179.25 179.52 2dkj h VAL 43 N 0.38 1.18 -0.32 0.00 2.07 -1.00 -2.12 116.25 116.43 2dkj h VAL 43 Ca 0.09 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2dkj h VAL 43 Cb 0.45 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2dkj h VAL 43 CO 0.02 0.25 0.00 0.61 0.02 0.00 0.00 177.57 178.46 2dkj n GLY 44 N -0.86 2.00 3.92 2.17 0.00 0.09 -4.68 105.19 107.84 2dkj n GLY 44 Ca -0.01 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 2dkj n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dkj s SER 45 N -0.53 4.51 0.00 1.61 1.04 -0.80 -4.96 113.70 114.58 2dkj s SER 45 Ca 0.28 0.51 0.19 0.00 0.48 0.00 0.00 55.95 57.41 2dkj s SER 45 Cb 0.20 -1.03 1.08 0.00 0.10 0.00 0.00 66.02 66.37 2dkj s SER 45 CO 0.10 -1.83 1.54 1.33 0.98 0.00 0.00 173.24 175.36 2dkj n VAL 46 N -3.14 0.14 0.29 5.02 0.24 -1.26 -3.28 118.33 116.34 2dkj n VAL 46 Ca 0.09 0.04 0.17 0.00 -2.04 0.00 0.00 64.34 62.60 2dkj n VAL 46 Cb 0.61 -0.73 0.84 0.00 -1.47 0.00 0.00 33.84 33.08 2dkj n VAL 46 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2dkj h LEU 47 N 0.00 0.00 -2.20 1.34 4.07 -1.93 -1.15 115.31 115.45 2dkj h LEU 47 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 2dkj h LEU 47 Cb 0.05 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.79 2dkj h LEU 47 CO 0.00 0.00 -0.05 0.00 -1.08 0.00 0.00 178.44 177.31 2dkj h THR 48 N 0.00 0.28 0.00 0.22 1.03 -1.90 -2.66 112.91 109.88 2dkj h THR 48 Ca 0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 66.41 66.08 2dkj h THR 48 Cb 0.16 1.24 0.00 0.00 -1.07 0.00 0.00 68.15 68.49 2dkj h THR 48 CO 0.00 0.05 0.00 0.78 -0.01 0.00 0.00 175.52 176.34 2dkj h ASN 49 N 0.00 0.00 -3.39 0.00 2.35 -1.50 -3.45 115.58 109.59 2dkj h ASN 49 Ca -0.00 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.16 2dkj h ASN 49 Cb 0.24 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.52 2dkj h ASN 49 CO 0.01 0.00 -0.09 -0.75 -1.65 0.00 0.00 177.43 174.95 2dkj s LYS 50 N -3.31 4.27 -0.19 0.81 2.47 -1.00 -5.04 119.74 117.74 2dkj s LYS 50 Ca 0.06 0.44 -0.22 0.00 -1.56 0.00 0.00 55.97 54.69 2dkj s LYS 50 Cb 0.10 -3.50 -0.02 0.00 -1.46 0.00 0.00 37.83 32.95 2dkj s LYS 50 CO 0.48 0.01 0.68 -0.47 0.16 0.00 0.00 175.35 176.21 2dkj s TYR 51 N 1.12 3.38 -0.32 4.03 6.14 -1.26 -4.80 117.35 125.64 2dkj s TYR 51 Ca 0.25 1.01 0.17 0.00 0.64 0.00 0.00 57.07 59.15 2dkj s TYR 51 Cb -0.15 -2.86 0.47 0.00 0.42 0.00 0.00 41.96 39.84 2dkj s TYR 51 CO 0.10 -0.20 1.02 0.00 0.64 0.00 0.00 175.55 177.11 2dkj n ALA 52 N 5.13 3.46 -1.74 3.97 0.00 -1.26 -4.76 120.51 125.31 2dkj n ALA 52 Ca 0.00 -3.20 -0.40 0.00 0.00 0.00 0.00 53.44 49.84 2dkj n ALA 52 Cb 0.49 -0.85 0.02 0.00 0.00 0.00 0.00 19.45 19.11 2dkj n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dkj n GLU 53 N -0.27 2.17 0.00 0.00 1.02 -1.26 -4.62 120.64 117.68 2dkj n GLU 53 Ca 0.13 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 58.05 2dkj n GLU 53 Cb 0.80 -2.56 0.00 0.00 -0.02 0.00 0.00 31.44 29.66 2dkj n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dkj n GLY 54 N 0.64 -0.32 3.28 0.62 0.00 -1.26 -1.43 105.19 106.71 2dkj n GLY 54 Ca 0.05 -1.98 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 2dkj n GLY 54 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dkj s TYR 55 N 0.00 1.38 -0.01 1.61 1.51 -0.88 -4.94 117.35 116.03 2dkj s TYR 55 Ca 0.00 -1.15 -0.38 0.00 -1.01 0.00 0.00 57.07 54.53 2dkj s TYR 55 Cb 0.00 -0.79 -0.16 0.00 -0.11 0.00 0.00 41.96 40.89 2dkj s TYR 55 CO 0.00 -0.33 1.45 -2.30 -1.11 0.00 0.00 175.55 173.26 2dkj n PRO 56 N -0.37 1.16 -0.77 -1.71 -0.02 -1.26 -0.06 135.00 131.97 2dkj n PRO 56 Ca -0.02 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2dkj n PRO 56 Cb 0.65 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2dkj n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dkj n GLY 57 N 2.96 1.25 2.32 -1.23 0.00 -1.26 -4.85 105.19 104.37 2dkj n GLY 57 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.06 2dkj n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkj n ALA 58 N 0.83 1.37 -2.51 4.61 0.00 0.92 -5.13 120.51 120.59 2dkj n ALA 58 Ca 0.00 -2.94 -0.20 0.00 0.00 0.00 0.00 53.44 50.30 2dkj n ALA 58 Cb 0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 19.45 18.47 2dkj n ALA 58 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dkj s ARG 59 N -1.63 3.16 -0.06 0.00 1.81 -1.20 -2.07 118.95 118.96 2dkj s ARG 59 Ca 0.36 -0.84 0.19 0.00 -1.72 0.00 0.00 55.73 53.71 2dkj s ARG 59 Cb 0.31 -2.77 0.64 0.00 -0.45 0.00 0.00 34.95 32.69 2dkj s ARG 59 CO -0.08 0.04 1.55 0.66 -0.68 0.00 0.00 175.30 176.79 2dkj n TYR 60 N -1.71 1.15 -3.92 -0.53 4.02 -0.52 -4.94 117.16 110.72 2dkj n TYR 60 Ca -0.01 -0.56 -0.10 0.00 -0.01 0.00 0.00 57.90 57.22 2dkj n TYR 60 Cb 0.58 -0.12 -0.09 0.00 -0.02 0.00 0.00 39.34 39.68 2dkj n TYR 60 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2dkj s TYR 61 N -1.45 0.18 0.81 -0.72 1.51 -1.26 -4.98 117.35 111.44 2dkj s TYR 61 Ca 0.47 -0.46 -0.10 0.00 -1.01 0.00 0.00 57.07 55.97 2dkj s TYR 61 Cb 0.28 -0.13 0.11 0.00 -0.11 0.00 0.00 41.96 42.11 2dkj s TYR 61 CO 0.27 -0.36 1.15 0.20 -1.11 0.00 0.00 175.55 175.70 2dkj s GLY 62 N -2.03 1.69 -0.17 0.71 0.00 -1.26 -4.40 107.32 101.86 2dkj s GLY 62 Ca -0.06 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2dkj s GLY 62 CO -0.04 -0.44 0.00 0.61 0.00 0.00 0.00 173.10 173.23 2dkj n GLY 63 N -3.28 0.51 0.97 0.20 0.00 -1.26 -4.93 105.19 97.39 2dkj n GLY 63 Ca 0.11 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.89 2dkj n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkj h GLU 65 N 2.52 0.43 0.22 0.00 9.09 -1.95 0.15 114.58 125.04 2dkj h GLU 65 Ca 0.00 -0.03 -0.31 0.00 0.05 0.00 0.00 59.36 59.07 2dkj h GLU 65 Cb 0.82 -0.10 0.04 0.00 -1.65 0.00 0.00 28.75 27.86 2dkj h GLU 65 CO 0.09 0.28 -1.35 0.28 0.05 0.00 0.00 179.01 178.36 2dkj h VAL 66 N 0.44 1.32 -0.67 -1.06 2.07 -2.01 -3.19 116.25 113.15 2dkj h VAL 66 Ca 0.37 -2.63 0.07 0.00 0.82 0.00 0.00 66.70 65.33 2dkj h VAL 66 Cb 0.52 3.01 -0.04 0.00 -1.52 0.00 0.00 31.29 33.26 2dkj h VAL 66 CO -0.36 0.78 0.44 0.40 0.02 0.00 0.00 177.57 178.86 2dkj h ILE 67 N 0.09 0.99 -0.64 4.57 5.03 -1.77 -0.71 117.51 125.09 2dkj h ILE 67 Ca -0.23 -0.23 -0.06 0.00 -0.12 0.00 0.00 64.86 64.23 2dkj h ILE 67 Cb 2.05 0.28 -0.03 0.00 -3.03 0.00 0.00 36.82 36.10 2dkj h ILE 67 CO 0.25 0.12 0.17 0.44 -0.68 0.00 0.00 178.15 178.45 2dkj h ASP 68 N 0.66 0.93 -0.30 1.72 3.32 -0.74 0.16 116.42 122.17 2dkj h ASP 68 Ca 0.29 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 2dkj h ASP 68 Cb 0.31 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2dkj h ASP 68 CO -0.09 0.89 -0.17 0.03 -1.72 0.00 0.00 179.24 178.18 2dkj h ARG 69 N 0.95 0.76 -0.01 3.56 3.08 -1.15 -0.62 114.38 120.94 2dkj h ARG 69 Ca 0.20 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2dkj h ARG 69 Cb 0.32 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 2dkj h ARG 69 CO -0.00 0.87 -0.00 0.28 -1.07 0.00 0.00 179.97 180.05 2dkj h VAL 70 N 0.67 1.31 -0.63 2.04 2.07 -0.77 -1.33 116.25 119.61 2dkj h VAL 70 Ca 0.10 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 2dkj h VAL 70 Cb 0.65 1.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 2dkj h VAL 70 CO 0.05 0.24 0.10 -0.08 0.02 0.00 0.00 177.57 177.90 2dkj h GLU 71 N -0.35 1.05 -0.66 1.57 4.81 -0.95 -1.62 114.58 118.43 2dkj h GLU 71 Ca 0.00 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 58.91 2dkj h GLU 71 Cb 0.39 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 2dkj h GLU 71 CO 0.00 0.98 0.26 0.77 -0.73 0.00 0.00 179.01 180.29 2dkj h SER 72 N 0.96 0.89 -0.56 1.04 0.02 -1.12 -0.35 113.55 114.44 2dkj h SER 72 Ca 0.19 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2dkj h SER 72 Cb 0.43 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2dkj h SER 72 CO 0.01 0.80 0.24 0.25 -1.14 0.00 0.00 176.83 176.99 2dkj h LEU 73 N 0.95 0.76 -0.51 5.07 5.85 -0.81 0.86 115.31 127.49 2dkj h LEU 73 Ca 0.22 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2dkj h LEU 73 Cb 0.19 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 2dkj h LEU 73 CO -0.02 0.71 0.22 0.00 -0.34 0.00 0.00 178.44 179.01 2dkj h ALA 74 N 1.08 0.66 0.00 1.25 0.00 -0.77 -0.83 119.26 120.65 2dkj h ALA 74 Ca 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dkj h ALA 74 Cb 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2dkj h ALA 74 CO -0.02 0.25 -0.00 0.82 0.00 0.00 0.00 179.25 180.30 2dkj h ILE 75 N 0.68 1.09 -0.78 0.00 2.04 -0.72 -0.92 117.51 118.89 2dkj h ILE 75 Ca 0.17 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 2dkj h ILE 75 Cb 0.17 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 2dkj h ILE 75 CO -0.02 0.07 0.29 -0.33 0.00 0.00 0.00 178.15 178.16 2dkj h GLU 76 N -0.12 1.19 -0.44 2.37 4.39 -0.75 -1.55 114.58 119.67 2dkj h GLU 76 Ca -0.00 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.36 2dkj h GLU 76 Cb 0.12 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 2dkj h GLU 76 CO 0.00 0.97 -0.17 0.00 -1.16 0.00 0.00 179.01 178.65 2dkj h ARG 77 N 1.15 0.84 -0.68 2.33 3.08 -1.07 -1.44 114.38 118.59 2dkj h ARG 77 Ca 0.26 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2dkj h ARG 77 Cb 0.25 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2dkj h ARG 77 CO -0.02 0.95 0.30 0.00 -1.07 0.00 0.00 179.97 180.14 2dkj h ALA 78 N 1.06 0.88 -0.64 0.04 0.00 -0.79 0.92 119.26 120.73 2dkj h ALA 78 Ca 0.11 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2dkj h ALA 78 Cb 0.69 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2dkj h ALA 78 CO 0.05 0.47 0.09 0.87 0.00 0.00 0.00 179.25 180.73 2dkj h LYS 79 N 0.95 1.06 -0.31 0.00 1.57 -1.05 -1.35 116.57 117.44 2dkj h LYS 79 Ca 0.23 -0.28 -0.18 0.00 -1.87 0.00 0.00 60.65 58.55 2dkj h LYS 79 Cb 0.16 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 2dkj h LYS 79 CO -0.03 0.98 -0.50 0.00 -0.57 0.00 0.00 179.45 179.33 2dkj h ALA 80 N 1.10 0.48 -0.43 3.86 0.00 -0.94 0.93 119.26 124.26 2dkj h ALA 80 Ca 0.20 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 2dkj h ALA 80 Cb 0.44 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2dkj h ALA 80 CO 0.01 0.66 0.04 1.25 0.00 0.00 0.00 179.25 181.21 2dkj h LEU 81 N 0.68 0.72 -1.95 0.00 5.85 -0.68 -3.27 115.31 116.66 2dkj h LEU 81 Ca 0.02 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2dkj h LEU 81 Cb 1.11 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.95 2dkj h LEU 81 CO 0.11 0.83 0.00 0.49 -0.34 0.00 0.00 178.44 179.53 2dkj n PHE 82 N -4.44 0.11 -3.22 1.25 3.01 -0.52 -4.79 117.46 108.86 2dkj n PHE 82 Ca -0.00 -0.06 -0.15 0.00 1.01 0.00 0.00 57.45 58.25 2dkj n PHE 82 Cb 0.27 -0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.81 2dkj n PHE 82 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dkj n GLY 83 N 1.24 -0.33 3.66 1.37 0.00 0.19 -4.89 105.19 106.43 2dkj n GLY 83 Ca 0.14 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 2dkj n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkj s ALA 84 N -3.32 3.25 -0.46 4.61 0.00 -0.41 -4.93 121.76 120.52 2dkj s ALA 84 Ca 0.05 -1.74 0.19 0.00 0.00 0.00 0.00 51.96 50.46 2dkj s ALA 84 Cb -0.01 -0.70 -0.26 0.00 0.00 0.00 0.00 23.12 22.15 2dkj s ALA 84 CO 0.64 0.18 0.62 0.00 0.00 0.00 0.00 175.76 177.19 2dkj n ALA 85 N -0.97 3.61 -3.28 0.00 0.00 -0.55 -4.71 120.51 114.61 2dkj n ALA 85 Ca -0.05 -0.51 -0.14 0.00 0.00 0.00 0.00 53.44 52.74 2dkj n ALA 85 Cb 0.60 -0.69 -0.08 0.00 0.00 0.00 0.00 19.45 19.28 2dkj n ALA 85 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2dkj s TRP 86 N -3.10 -0.25 -0.06 0.00 -0.00 -0.79 -4.81 118.94 109.93 2dkj s TRP 86 Ca -0.00 0.40 -0.18 0.00 -0.00 0.00 0.00 56.10 56.32 2dkj s TRP 86 Cb 0.14 0.14 0.04 0.00 -0.00 0.00 0.00 33.47 33.78 2dkj s TRP 86 CO 0.81 -0.41 0.42 0.00 -0.00 0.00 0.00 176.95 177.77 2dkj s ALA 87 N -1.25 -1.07 -0.15 5.86 0.00 -1.26 -2.18 121.76 121.70 2dkj s ALA 87 Ca -0.13 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2dkj s ALA 87 Cb -0.04 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2dkj s ALA 87 CO 0.05 -0.27 -0.13 1.21 0.00 0.00 0.00 175.76 176.62 2dkj s ASN 88 N -0.88 2.71 0.00 0.00 3.84 -0.01 -4.96 114.94 115.64 2dkj s ASN 88 Ca -0.09 -0.51 0.18 0.00 0.21 0.00 0.00 52.86 52.64 2dkj s ASN 88 Cb -0.04 -1.16 0.48 0.00 -0.55 0.00 0.00 41.25 39.98 2dkj s ASN 88 CO 0.04 -0.07 1.40 1.33 -2.79 0.00 0.00 177.10 177.01 2dkj n VAL 89 N 4.78 0.91 0.47 -5.21 0.24 -1.26 -1.58 118.33 116.67 2dkj n VAL 89 Ca -0.16 -0.95 0.12 0.00 -2.04 0.00 0.00 64.34 61.30 2dkj n VAL 89 Cb 0.50 0.58 0.20 0.00 -1.47 0.00 0.00 33.84 33.65 2dkj n VAL 89 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2dkj h GLN 90 N 3.42 0.00 -6.54 7.34 4.20 -1.95 -3.45 115.11 118.13 2dkj h GLN 90 Ca 0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 2dkj h GLN 90 Cb 0.88 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.72 2dkj h GLN 90 CO 0.00 0.00 0.75 -2.30 -0.67 0.00 0.00 178.83 176.61 2dkj n PRO 91 N -2.37 2.13 0.28 1.46 -0.02 -1.26 -4.71 135.00 130.51 2dkj n PRO 91 Ca 0.03 0.77 0.18 0.00 -2.02 0.00 0.00 63.50 62.46 2dkj n PRO 91 Cb 0.47 -2.50 0.81 0.00 -0.02 0.00 0.00 33.50 32.25 2dkj n PRO 91 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dkj h HIS 92 N 5.38 0.00 -2.64 6.00 3.86 -1.92 -0.51 115.15 125.32 2dkj h HIS 92 Ca -0.45 0.00 0.11 0.00 -1.16 0.00 0.00 60.37 58.87 2dkj h HIS 92 Cb 1.26 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.68 2dkj h HIS 92 CO 0.61 0.00 0.42 -1.54 0.86 0.00 0.00 177.93 178.27 2dkj s SER 93 N -5.47 -0.12 0.31 2.45 1.04 -1.26 -4.13 113.70 106.52 2dkj s SER 93 Ca -0.00 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 55.81 2dkj s SER 93 Cb 0.10 0.61 0.53 0.00 0.10 0.00 0.00 66.02 67.36 2dkj s SER 93 CO 0.50 -1.17 1.81 1.23 0.98 0.00 0.00 173.24 176.60 2dkj h GLY 94 N 2.00 0.55 1.01 7.32 0.00 -1.80 -2.01 103.07 110.14 2dkj h GLY 94 Ca -0.25 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 2dkj h GLY 94 CO 0.30 0.34 0.26 1.76 0.00 0.00 0.00 176.54 179.21 2dkj h SER 95 N 0.47 0.92 0.29 0.19 0.02 -1.94 -1.64 113.55 111.86 2dkj h SER 95 Ca 0.09 -0.17 -0.11 0.00 -0.84 0.00 0.00 61.79 60.75 2dkj h SER 95 Cb 0.46 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 2dkj h SER 95 CO 0.03 0.84 -0.46 1.56 -1.14 0.00 0.00 176.83 177.65 2dkj h GLN 96 N 0.94 0.21 -0.18 3.45 7.50 -1.87 -0.18 115.11 124.97 2dkj h GLN 96 Ca 0.22 -0.11 -0.01 0.00 0.50 0.00 0.00 58.65 59.26 2dkj h GLN 96 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.73 2dkj h GLN 96 CO -0.02 0.63 0.08 0.00 -1.50 0.00 0.00 178.83 178.02 2dkj h ALA 97 N 1.35 0.23 -0.61 3.87 0.00 -0.96 -1.15 119.26 122.00 2dkj h ALA 97 Ca 0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2dkj h ALA 97 Cb 0.88 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2dkj h ALA 97 CO 0.07 -0.19 0.12 -0.91 0.00 0.00 0.00 179.25 178.33 2dkj h ASN 98 N 0.15 0.96 -0.36 0.00 2.35 -1.12 -2.43 115.58 115.14 2dkj h ASN 98 Ca 0.06 -0.25 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2dkj h ASN 98 Cb 0.14 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 2dkj h ASN 98 CO -0.01 0.97 0.21 -0.03 -1.65 0.00 0.00 177.43 176.92 2dkj h MET 99 N 0.91 0.42 -0.61 0.81 4.05 -0.84 0.04 114.93 119.71 2dkj h MET 99 Ca 0.19 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 2dkj h MET 99 Cb 0.40 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.08 2dkj h MET 99 CO 0.01 0.28 0.27 0.00 0.23 0.00 0.00 176.91 177.69 2dkj h ALA 100 N 1.15 0.79 -0.30 0.39 0.00 -1.12 -1.45 119.26 118.73 2dkj h ALA 100 Ca 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2dkj h ALA 100 Cb -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2dkj h ALA 100 CO -0.06 0.39 0.07 0.28 0.00 0.00 0.00 179.25 179.92 2dkj h VAL 101 N 0.85 1.22 -0.65 0.00 2.07 -1.11 -1.02 116.25 117.60 2dkj h VAL 101 Ca 0.21 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.99 2dkj h VAL 101 Cb 0.17 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2dkj h VAL 101 CO -0.02 0.24 0.43 1.88 0.02 0.00 0.00 177.57 180.13 2dkj h TYR 102 N 0.31 0.82 0.00 1.57 0.05 -0.84 -1.09 116.97 117.80 2dkj h TYR 102 Ca 0.09 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.88 2dkj h TYR 102 Cb 0.30 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 37.76 2dkj h TYR 102 CO 0.02 0.51 -0.07 0.52 -1.05 0.00 0.00 178.16 178.09 2dkj h MET 103 N 0.88 0.00 0.00 4.88 2.86 -1.11 0.39 114.93 122.84 2dkj h MET 103 Ca 0.24 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.71 2dkj h MET 103 Cb -0.10 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.54 2dkj h MET 103 CO -0.05 0.07 -0.98 0.00 1.06 0.00 0.00 176.91 177.01 2dkj h ALA 104 N 1.93 0.59 0.00 6.32 0.00 -0.41 -3.37 119.26 124.33 2dkj h ALA 104 Ca -0.00 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2dkj h ALA 104 Cb 0.58 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2dkj h ALA 104 CO 0.01 0.96 -1.78 1.28 0.00 0.00 0.00 179.25 179.72 2dkj n LEU 105 N -3.16 0.05 -4.27 0.00 4.77 -0.48 -4.98 117.00 108.93 2dkj n LEU 105 Ca -0.03 -0.03 -0.14 0.00 -0.03 0.00 0.00 56.01 55.77 2dkj n LEU 105 Cb 0.85 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.83 2dkj n LEU 105 CO 0.43 0.01 -0.28 -0.04 -1.33 0.00 0.00 177.39 176.18 2dkj s MET 106 N -3.25 1.25 0.17 3.23 -1.94 0.13 -4.96 119.30 113.94 2dkj s MET 106 Ca -0.06 -1.64 0.11 0.00 -1.71 0.00 0.00 55.69 52.39 2dkj s MET 106 Cb 0.12 -0.17 -0.04 0.00 2.01 0.00 0.00 34.83 36.75 2dkj s MET 106 CO 0.77 -0.24 -0.24 -1.21 -0.01 0.00 0.00 175.02 174.08 2dkj s GLU 107 N -4.01 1.45 0.27 2.03 0.41 -1.26 -4.43 118.70 113.16 2dkj s GLU 107 Ca 0.32 -1.46 -0.29 0.00 -0.41 0.00 0.00 54.97 53.13 2dkj s GLU 107 Cb 0.07 -1.78 -0.14 0.00 -1.78 0.00 0.00 34.13 30.50 2dkj s GLU 107 CO 0.09 0.39 1.17 -2.30 -0.49 0.00 0.00 175.26 174.12 2dkj n PRO 108 N 0.44 1.60 0.00 0.39 -0.02 -1.26 -1.64 135.00 134.50 2dkj n PRO 108 Ca -0.14 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2dkj n PRO 108 Cb 0.55 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2dkj n PRO 108 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dkj n GLY 109 N 1.46 3.22 3.71 -1.23 0.00 0.17 -5.01 105.19 107.51 2dkj n GLY 109 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2dkj n GLY 109 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dkj s ASP 110 N -0.75 3.47 -0.18 1.61 1.01 -0.65 -4.27 116.67 116.90 2dkj s ASP 110 Ca 0.00 1.61 -0.14 0.00 0.71 0.00 0.00 52.55 54.73 2dkj s ASP 110 Cb 0.00 -2.28 -0.05 0.00 1.01 0.00 0.00 42.92 41.61 2dkj s ASP 110 CO 0.00 -2.66 0.29 -0.89 0.21 0.00 0.00 175.17 172.12 2dkj s THR 111 N -2.88 5.30 -0.10 -1.27 2.01 -1.26 -0.92 115.64 116.53 2dkj s THR 111 Ca 0.64 0.51 0.00 0.00 0.31 0.00 0.00 61.69 63.15 2dkj s THR 111 Cb -0.19 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.67 2dkj s THR 111 CO 0.57 0.36 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.55 2dkj s LEU 112 N 0.70 2.98 -0.13 4.42 2.96 0.67 -0.48 118.68 129.80 2dkj s LEU 112 Ca 0.15 -0.15 0.01 0.00 -0.22 0.00 0.00 54.13 53.92 2dkj s LEU 112 Cb -0.13 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.90 2dkj s LEU 112 CO 0.04 0.27 -0.18 -0.32 -1.32 0.00 0.00 176.35 174.85 2dkj s MET 113 N -0.29 3.20 0.28 1.98 -2.45 -0.19 -1.22 119.30 120.61 2dkj s MET 113 Ca 0.03 -0.78 -0.12 0.00 -1.25 0.00 0.00 55.69 53.57 2dkj s MET 113 Cb -0.13 -2.53 0.00 0.00 1.25 0.00 0.00 34.83 33.43 2dkj s MET 113 CO 0.03 0.10 0.53 0.20 1.05 0.00 0.00 175.02 176.93 2dkj s GLY 114 N 0.59 0.60 0.15 2.11 0.00 -0.90 -0.12 107.32 109.75 2dkj s GLY 114 Ca -0.10 -0.90 -0.30 0.00 0.00 0.00 0.00 44.72 43.42 2dkj s GLY 114 CO 0.03 -0.60 1.18 -0.29 0.00 0.00 0.00 173.10 173.43 2dkj s MET 115 N -3.70 4.50 0.32 2.90 1.75 -1.26 -1.93 119.30 121.88 2dkj s MET 115 Ca 0.22 1.82 -0.29 0.00 -1.25 0.00 0.00 55.69 56.18 2dkj s MET 115 Cb -0.02 -3.27 -0.12 0.00 2.84 0.00 0.00 34.83 34.26 2dkj s MET 115 CO 0.11 -0.10 1.43 -3.47 -0.65 0.00 0.00 175.02 172.34 2dkj n ASP 116 N 2.85 3.27 -0.25 1.11 -0.08 0.69 -4.00 116.55 120.14 2dkj n ASP 116 Ca 0.05 1.18 0.03 0.00 -1.51 0.00 0.00 54.79 54.55 2dkj n ASP 116 Cb 0.45 -1.53 0.16 0.00 2.34 0.00 0.00 41.12 42.54 2dkj n ASP 116 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 2dkj h LEU 117 N 3.52 0.36 -1.91 -2.67 5.85 -1.87 -0.30 115.31 118.29 2dkj h LEU 117 Ca -0.47 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.31 2dkj h LEU 117 Cb 1.26 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2dkj h LEU 117 CO 0.70 0.18 -0.11 0.00 -0.34 0.00 0.00 178.44 178.86 2dkj h ALA 118 N 1.48 1.58 -0.00 1.25 0.00 -1.90 -2.04 119.26 119.62 2dkj h ALA 118 Ca 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2dkj h ALA 118 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2dkj h ALA 118 CO -0.33 0.14 -0.24 0.00 0.00 0.00 0.00 179.25 178.82 2dkj n ALA 119 N -2.41 3.03 0.00 0.00 0.00 -0.28 -4.81 120.51 116.04 2dkj n ALA 119 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2dkj n ALA 119 Cb 0.20 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2dkj n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dkj n GLY 120 N 1.36 0.64 3.75 0.00 0.00 -0.77 -4.77 105.19 105.40 2dkj n GLY 120 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2dkj n GLY 120 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dkj s GLY 121 N -0.25 1.63 0.33 -0.02 0.00 -0.31 -0.58 107.32 108.12 2dkj s GLY 121 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 44.72 44.69 2dkj s GLY 121 CO 0.00 0.42 0.55 -1.58 0.00 0.00 0.00 173.10 172.48 2dkj s HIS 122 N -2.98 3.50 0.36 1.90 2.46 -1.26 -4.40 115.29 114.86 2dkj s HIS 122 Ca 0.62 0.43 0.11 0.00 0.47 0.00 0.00 55.06 56.69 2dkj s HIS 122 Cb -0.17 -1.95 0.90 0.00 -0.13 0.00 0.00 32.58 31.23 2dkj s HIS 122 CO 0.56 0.13 1.83 -0.07 -2.47 0.00 0.00 174.74 174.72 2dkj h LEU 123 N 1.01 0.61 0.00 8.88 3.38 -1.96 0.46 115.31 127.69 2dkj h LEU 123 Ca -0.49 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2dkj h LEU 123 Cb 1.21 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dkj h LEU 123 CO 0.63 0.24 0.00 0.35 0.09 0.00 0.00 178.44 179.75 2dkj n THR 124 N -4.61 0.00 -0.62 0.22 -2.24 -1.26 -2.05 114.28 103.72 2dkj n THR 124 Ca 0.21 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.06 2dkj n THR 124 Cb 0.61 -0.23 0.36 0.00 -2.10 0.00 0.00 70.33 68.97 2dkj n THR 124 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2dkj n HIS 125 N -0.70 1.69 0.00 4.78 8.25 0.15 -4.77 115.22 124.62 2dkj n HIS 125 Ca 0.09 -0.62 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 2dkj n HIS 125 Cb 0.04 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 30.78 2dkj n HIS 125 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dkj n GLY 126 N 0.82 0.00 3.74 -1.41 0.00 -1.21 -3.99 105.19 103.15 2dkj n GLY 126 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 2dkj n GLY 126 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dkj n SER 127 N 0.00 3.68 0.29 1.61 2.88 -0.87 -4.02 113.62 117.19 2dkj n SER 127 Ca 0.00 1.17 0.15 0.00 -1.33 0.00 0.00 58.87 58.86 2dkj n SER 127 Cb 0.00 -1.58 0.86 0.00 -0.75 0.00 0.00 64.21 62.74 2dkj n SER 127 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2dkj h ARG 128 N 4.15 0.00 -0.09 -1.46 -0.00 -1.89 -1.18 114.38 113.91 2dkj h ARG 128 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.50 2dkj h ARG 128 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.21 2dkj h ARG 128 CO 0.74 0.06 0.00 1.33 -0.00 0.00 0.00 179.97 182.10 2dkj n VAL 129 N -3.60 0.10 -4.20 0.08 0.24 -1.26 -4.23 118.33 105.45 2dkj n VAL 129 Ca -0.02 -0.37 -0.23 0.00 -2.04 0.00 0.00 64.34 61.68 2dkj n VAL 129 Cb 0.16 0.71 -0.06 0.00 -1.47 0.00 0.00 33.84 33.19 2dkj n VAL 129 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2dkj s ASN 130 N -1.85 5.03 0.49 -1.34 3.84 -0.50 -5.00 114.94 115.62 2dkj s ASN 130 Ca 0.35 -0.43 0.20 0.00 0.21 0.00 0.00 52.86 53.19 2dkj s ASN 130 Cb 0.20 -1.13 1.23 0.00 -0.55 0.00 0.00 41.25 41.00 2dkj s ASN 130 CO 0.31 -0.00 1.99 2.19 -2.79 0.00 0.00 177.10 178.79 2dkj h PHE 131 N 1.83 0.20 -0.54 0.43 -5.15 -1.90 -0.73 116.94 111.08 2dkj h PHE 131 Ca -0.47 0.01 0.01 0.00 -0.20 0.00 0.00 57.97 57.32 2dkj h PHE 131 Cb 1.24 -0.06 -0.03 0.00 0.22 0.00 0.00 35.95 37.31 2dkj h PHE 131 CO 0.62 0.09 0.36 0.66 -2.00 0.00 0.00 178.31 178.03 2dkj h SER 132 N 0.18 0.62 1.49 -0.68 4.64 -1.86 0.26 113.55 118.20 2dkj h SER 132 Ca 0.26 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.52 2dkj h SER 132 Cb 0.80 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.73 2dkj h SER 132 CO -0.04 0.45 -0.52 1.23 -0.87 0.00 0.00 176.83 177.07 2dkj h GLY 133 N 0.73 0.00 1.44 -0.77 0.00 -0.70 -2.80 103.07 100.97 2dkj h GLY 133 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.25 2dkj h GLY 133 CO -0.05 0.00 -1.22 0.50 0.00 0.00 0.00 176.54 175.78 2dkj h LYS 134 N 0.00 0.45 0.00 4.80 1.57 -0.81 -3.36 116.57 119.22 2dkj h LYS 134 Ca -0.02 -0.65 -0.22 0.00 -1.87 0.00 0.00 60.65 57.89 2dkj h LYS 134 Cb 1.16 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.66 2dkj h LYS 134 CO 0.02 1.28 -1.61 1.28 -0.57 0.00 0.00 179.45 179.85 2dkj n LEU 135 N -3.69 0.77 -4.38 2.94 4.77 0.05 -4.97 117.00 112.49 2dkj n LEU 135 Ca -0.11 0.35 -0.23 0.00 -0.03 0.00 0.00 56.01 55.99 2dkj n LEU 135 Cb 0.98 0.14 -0.11 0.00 -2.33 0.00 0.00 43.42 42.11 2dkj n LEU 135 CO 0.56 0.25 -0.49 -0.31 -1.33 0.00 0.00 177.39 176.07 2dkj s TYR 136 N -2.79 2.01 0.37 -1.77 1.51 -1.05 -0.66 117.35 114.97 2dkj s TYR 136 Ca -0.04 -0.43 -0.24 0.00 -1.01 0.00 0.00 57.07 55.34 2dkj s TYR 136 Cb 0.08 -0.96 -0.10 0.00 -0.11 0.00 0.00 41.96 40.88 2dkj s TYR 136 CO 0.82 0.45 0.98 0.15 -1.11 0.00 0.00 175.55 176.85 2dkj s LYS 137 N -3.04 4.37 -0.01 -0.62 1.02 -0.09 -4.51 119.74 116.85 2dkj s LYS 137 Ca 0.21 1.36 0.06 0.00 0.02 0.00 0.00 55.97 57.61 2dkj s LYS 137 Cb -0.05 -2.59 -0.02 0.00 -0.52 0.00 0.00 37.83 34.65 2dkj s LYS 137 CO 0.09 0.07 -0.19 0.08 -0.92 0.00 0.00 175.35 174.48 2dkj s VAL 138 N -1.74 1.51 -0.09 3.17 1.01 -1.26 -0.24 120.40 122.77 2dkj s VAL 138 Ca 0.55 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.68 2dkj s VAL 138 Cb -0.18 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 34.95 2dkj s VAL 138 CO 0.23 0.39 -0.11 0.68 0.00 0.00 0.00 175.10 176.29 2dkj s VAL 139 N -0.50 1.14 0.14 2.92 -7.23 -0.36 -4.96 120.40 111.57 2dkj s VAL 139 Ca 0.07 -0.44 0.09 0.00 -1.81 0.00 0.00 61.98 59.89 2dkj s VAL 139 Cb -0.08 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.74 2dkj s VAL 139 CO -0.00 0.37 -0.13 -0.44 -0.31 0.00 0.00 175.10 174.59 2dkj s SER 140 N 1.05 4.15 0.17 4.85 0.01 -1.26 -2.12 113.70 120.56 2dkj s SER 140 Ca -0.07 -0.53 0.10 0.00 1.31 0.00 0.00 55.95 56.76 2dkj s SER 140 Cb -0.15 -0.68 -0.04 0.00 0.21 0.00 0.00 66.02 65.36 2dkj s SER 140 CO -0.01 0.15 -0.22 -0.72 0.41 0.00 0.00 173.24 172.85 2dkj s TYR 141 N -1.41 2.09 0.00 2.43 -0.85 -0.81 -4.85 117.35 113.95 2dkj s TYR 141 Ca 0.22 -0.40 0.00 0.00 -0.52 0.00 0.00 57.07 56.36 2dkj s TYR 141 Cb -0.10 -1.05 0.00 0.00 0.38 0.00 0.00 41.96 41.19 2dkj s TYR 141 CO 0.13 0.40 0.00 0.41 -1.52 0.00 0.00 175.55 174.98 2dkj n GLY 142 N 0.39 4.89 3.36 5.49 0.00 -1.26 -0.22 105.19 117.83 2dkj n GLY 142 Ca -0.14 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 44.76 2dkj n GLY 142 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dkj s VAL 143 N 3.25 1.94 0.35 1.61 -7.23 -1.26 -4.35 120.40 114.70 2dkj s VAL 143 Ca 0.00 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 57.90 2dkj s VAL 143 Cb 0.00 -1.94 -0.09 0.00 0.56 0.00 0.00 36.38 34.91 2dkj s VAL 143 CO 0.00 -0.32 1.17 -0.13 -0.31 0.00 0.00 175.10 175.52 2dkj s ARG 144 N -2.90 4.32 0.42 4.82 0.52 0.04 -4.86 118.95 121.31 2dkj s ARG 144 Ca 0.18 1.90 0.13 0.00 -0.52 0.00 0.00 55.73 57.42 2dkj s ARG 144 Cb -0.06 -2.93 0.89 0.00 0.52 0.00 0.00 34.95 33.38 2dkj s ARG 144 CO 0.08 -0.11 1.94 -1.00 0.02 0.00 0.00 175.30 176.22 2dkj h PRO 145 N 3.18 0.05 0.00 3.54 0.13 -1.98 0.78 132.00 137.69 2dkj h PRO 145 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dkj h PRO 145 Cb 1.22 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dkj h PRO 145 CO 0.65 0.26 -0.59 0.38 -0.23 0.00 0.00 178.00 178.47 2dkj h ASP 146 N 0.04 0.00 0.00 1.44 2.03 -1.97 -3.39 116.42 114.57 2dkj h ASP 146 Ca 0.01 -0.15 -0.02 0.00 -0.73 0.00 0.00 57.03 56.14 2dkj h ASP 146 Cb 0.41 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.91 2dkj h ASP 146 CO 0.03 0.07 -1.12 0.35 -1.03 0.00 0.00 179.24 177.55 2dkj n THR 147 N -2.27 0.07 -1.27 1.15 -2.24 -1.14 -5.00 114.28 103.59 2dkj n THR 147 Ca 0.03 -0.07 -0.09 0.00 -2.27 0.00 0.00 64.05 61.65 2dkj n THR 147 Cb 0.46 -0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.36 2dkj n THR 147 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dkj n GLU 148 N -1.84 -0.89 -4.46 -0.78 1.02 0.25 -4.69 120.64 109.26 2dkj n GLU 148 Ca -0.02 0.78 -0.23 0.00 -0.02 0.00 0.00 57.16 57.67 2dkj n GLU 148 Cb 0.33 -4.74 -0.10 0.00 -0.02 0.00 0.00 31.44 26.90 2dkj n GLU 148 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2dkj s LEU 149 N -2.10 2.58 0.55 -4.62 1.43 -1.26 -4.77 118.68 110.49 2dkj s LEU 149 Ca 0.00 -1.15 -0.21 0.00 -1.03 0.00 0.00 54.13 51.74 2dkj s LEU 149 Cb 0.00 -0.80 -0.05 0.00 0.03 0.00 0.00 46.19 45.37 2dkj s LEU 149 CO 0.00 -0.23 1.30 -0.63 0.23 0.00 0.00 176.35 177.01 2dkj s ILE 150 N -2.83 2.32 -0.40 -0.59 1.01 -1.26 -0.78 121.20 118.67 2dkj s ILE 150 Ca 0.30 0.23 -0.01 0.00 0.00 0.00 0.00 60.65 61.16 2dkj s ILE 150 Cb 0.02 -3.11 0.11 0.00 0.01 0.00 0.00 42.46 39.49 2dkj s ILE 150 CO 0.13 -0.01 0.18 -0.62 0.00 0.00 0.00 174.94 174.61 2dkj s ASP 151 N -1.17 5.14 0.52 3.58 3.68 -1.26 -4.82 116.67 122.35 2dkj s ASP 151 Ca 0.72 -2.09 0.19 0.00 2.13 0.00 0.00 52.55 53.50 2dkj s ASP 151 Cb -0.37 -1.78 1.31 0.00 -1.45 0.00 0.00 42.92 40.63 2dkj s ASP 151 CO 0.42 -0.50 2.10 -0.07 0.13 0.00 0.00 175.17 177.25 2dkj h LEU 152 N 7.92 0.00 -0.60 -1.34 3.38 -1.97 -0.61 115.31 122.08 2dkj h LEU 152 Ca -0.11 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 2dkj h LEU 152 Cb 1.04 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 2dkj h LEU 152 CO 0.66 0.00 -0.14 -0.33 0.09 0.00 0.00 178.44 178.73 2dkj h GLU 153 N 0.00 0.97 -0.21 1.13 5.08 -1.99 -1.17 114.58 118.39 2dkj h GLU 153 Ca 0.08 -0.36 -0.19 0.00 -1.00 0.00 0.00 59.36 57.88 2dkj h GLU 153 Cb 0.31 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2dkj h GLU 153 CO -0.00 1.03 -0.63 1.49 -1.00 0.00 0.00 179.01 179.91 2dkj h GLU 154 N 0.86 0.73 -0.58 2.33 4.57 -1.63 -1.18 114.58 119.68 2dkj h GLU 154 Ca 0.13 -0.51 0.01 0.00 -1.18 0.00 0.00 59.36 57.81 2dkj h GLU 154 Cb 0.69 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 2dkj h GLU 154 CO 0.05 1.13 0.38 0.28 -1.18 0.00 0.00 179.01 179.68 2dkj h VAL 155 N 0.54 1.15 -0.37 0.32 2.07 -1.00 -0.19 116.25 118.77 2dkj h VAL 155 Ca -0.01 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 2dkj h VAL 155 Cb 1.22 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2dkj h VAL 155 CO 0.13 0.14 0.15 -0.09 0.02 0.00 0.00 177.57 177.92 2dkj h ARG 156 N 0.78 0.56 -0.39 1.57 2.43 -1.09 -0.83 114.38 117.42 2dkj h ARG 156 Ca 0.21 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2dkj h ARG 156 Cb -0.09 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.34 2dkj h ARG 156 CO -0.05 0.53 0.20 -0.09 -1.51 0.00 0.00 179.97 179.06 2dkj h ARG 157 N 0.45 0.40 -0.75 0.20 2.43 -0.79 -0.66 114.38 115.67 2dkj h ARG 157 Ca 0.12 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 2dkj h ARG 157 Cb 0.19 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 2dkj h ARG 157 CO -0.01 0.27 0.33 -0.07 -1.51 0.00 0.00 179.97 178.97 2dkj h LEU 158 N 0.41 1.01 -0.46 3.80 3.38 -0.87 -1.77 115.31 120.80 2dkj h LEU 158 Ca 0.16 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2dkj h LEU 158 Cb 0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2dkj h LEU 158 CO -0.10 0.88 0.19 0.00 0.09 0.00 0.00 178.44 179.50 2dkj h ALA 159 N 1.16 0.60 -0.59 1.53 0.00 -0.67 0.24 119.26 121.54 2dkj h ALA 159 Ca 0.25 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2dkj h ALA 159 Cb 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2dkj h ALA 159 CO -0.03 0.21 0.08 -0.07 0.00 0.00 0.00 179.25 179.44 2dkj h LEU 160 N 0.61 0.92 0.03 0.00 3.38 -0.95 0.16 115.31 119.46 2dkj h LEU 160 Ca 0.16 -0.21 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 2dkj h LEU 160 Cb 0.18 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 40.71 2dkj h LEU 160 CO -0.01 0.93 -0.91 -0.33 0.09 0.00 0.00 178.44 178.21 2dkj h GLU 161 N 0.91 0.57 0.00 1.13 5.08 -1.13 -3.36 114.58 117.77 2dkj h GLU 161 Ca 0.18 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2dkj h GLU 161 Cb 0.42 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2dkj h GLU 161 CO 0.01 1.25 -1.07 0.72 -1.00 0.00 0.00 179.01 178.93 2dkj n HIS 162 N -3.99 0.22 -3.76 4.33 8.25 0.06 -5.02 115.22 115.30 2dkj n HIS 162 Ca -0.11 0.06 -0.32 0.00 -0.26 0.00 0.00 57.72 57.09 2dkj n HIS 162 Cb 0.82 -0.40 0.03 0.00 1.12 0.00 0.00 29.99 31.56 2dkj n HIS 162 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2dkj n ARG 163 N -1.93 -1.00 -2.10 -0.41 5.12 0.56 -4.92 116.66 111.98 2dkj n ARG 163 Ca 0.02 0.48 -0.35 0.00 -1.93 0.00 0.00 57.85 56.07 2dkj n ARG 163 Cb 0.43 -3.47 0.02 0.00 -1.16 0.00 0.00 32.46 28.28 2dkj n ARG 163 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2dkj s PRO 164 N -5.98 3.15 0.07 5.56 0.04 -1.26 -4.82 135.00 131.77 2dkj s PRO 164 Ca 0.36 1.60 0.09 0.00 0.04 0.00 0.00 61.00 63.09 2dkj s PRO 164 Cb -0.16 -1.98 -0.21 0.00 0.04 0.00 0.00 34.50 32.20 2dkj s PRO 164 CO 0.89 -1.01 1.09 -0.22 0.04 0.00 0.00 177.00 177.80 2dkj h LYS 165 N 0.87 0.00 -4.04 4.56 1.63 -1.13 -3.39 116.57 115.07 2dkj h LYS 165 Ca -0.49 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 58.97 2dkj h LYS 165 Cb 1.26 0.00 -0.31 0.00 -0.60 0.00 0.00 32.23 32.59 2dkj h LYS 165 CO 0.56 0.83 -0.75 0.08 -3.45 0.00 0.00 179.45 176.71 2dkj s VAL 166 N -2.69 0.33 -0.13 2.00 1.01 -1.21 -0.98 120.40 118.73 2dkj s VAL 166 Ca -0.01 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 61.90 2dkj s VAL 166 Cb 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 36.14 2dkj s VAL 166 CO 0.82 0.13 -0.20 -0.63 0.00 0.00 0.00 175.10 175.22 2dkj s ILE 167 N 0.39 2.30 -0.17 2.22 1.01 0.16 -1.02 121.20 126.10 2dkj s ILE 167 Ca -0.04 -0.91 -0.06 0.00 0.00 0.00 0.00 60.65 59.63 2dkj s ILE 167 Cb -0.07 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.43 2dkj s ILE 167 CO -0.01 0.54 0.04 -0.69 0.00 0.00 0.00 174.94 174.83 2dkj s VAL 168 N 0.63 4.59 0.05 2.92 1.01 0.83 -0.84 120.40 129.59 2dkj s VAL 168 Ca -0.10 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 61.83 2dkj s VAL 168 Cb -0.16 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 2dkj s VAL 168 CO 0.02 0.47 -0.14 0.00 0.00 0.00 0.00 175.10 175.46 2dkj s ALA 169 N 0.32 2.77 0.00 5.51 0.00 -0.22 -4.33 121.76 125.81 2dkj s ALA 169 Ca 0.02 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.80 2dkj s ALA 169 Cb -0.13 -0.85 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2dkj s ALA 169 CO 0.01 0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.77 2dkj n GLY 170 N 1.34 3.18 3.83 0.00 0.00 -1.26 -0.83 105.19 111.44 2dkj n GLY 170 Ca -0.15 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 43.87 2dkj n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkj s ALA 171 N -2.83 -1.19 -0.28 4.61 0.00 -1.26 -4.74 121.76 116.07 2dkj s ALA 171 Ca 0.00 -0.44 0.19 0.00 0.00 0.00 0.00 51.96 51.71 2dkj s ALA 171 Cb 0.00 0.72 -0.26 0.00 0.00 0.00 0.00 23.12 23.58 2dkj s ALA 171 CO 0.00 -1.03 0.52 0.43 0.00 0.00 0.00 175.76 175.69 2dkj n SER 172 N -1.06 0.76 -2.75 0.00 7.64 0.25 -4.52 113.62 113.94 2dkj n SER 172 Ca -0.06 -0.29 -0.10 0.00 1.01 0.00 0.00 58.87 59.43 2dkj n SER 172 Cb 0.60 1.59 0.04 0.00 -1.01 0.00 0.00 64.21 65.43 2dkj n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dkj n ALA 173 N -1.93 2.75 -4.06 -0.43 0.00 -0.43 -4.98 120.51 111.43 2dkj n ALA 173 Ca -0.01 -2.85 -0.33 0.00 0.00 0.00 0.00 53.44 50.25 2dkj n ALA 173 Cb 0.43 -0.95 -0.15 0.00 0.00 0.00 0.00 19.45 18.77 2dkj n ALA 173 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2dkj s TYR 174 N -2.43 3.00 -2.00 0.00 5.04 -1.26 -4.52 117.35 115.18 2dkj s TYR 174 Ca 0.28 -1.91 0.12 0.00 -2.44 0.00 0.00 57.07 53.12 2dkj s TYR 174 Cb 0.43 -1.94 0.74 0.00 0.35 0.00 0.00 41.96 41.54 2dkj s TYR 174 CO 0.00 -0.83 1.41 -0.35 -1.34 0.00 0.00 175.55 174.45 2dkj n PRO 175 N 4.55 0.92 -4.41 4.97 -0.04 -1.26 -4.90 135.00 134.83 2dkj n PRO 175 Ca -0.18 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.08 2dkj n PRO 175 Cb 0.46 -1.21 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 2dkj n PRO 175 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dkj s ARG 176 N -2.00 1.53 0.87 0.54 1.81 -1.26 -0.51 118.95 119.93 2dkj s ARG 176 Ca 0.19 -1.81 -0.11 0.00 -1.72 0.00 0.00 55.73 52.28 2dkj s ARG 176 Cb 0.09 -0.88 0.12 0.00 -0.45 0.00 0.00 34.95 33.82 2dkj s ARG 176 CO 0.14 -0.09 1.15 -0.06 -0.68 0.00 0.00 175.30 175.76 2dkj s PHE 177 N -3.25 1.82 -0.00 -0.53 2.99 -1.26 -4.93 117.98 112.82 2dkj s PHE 177 Ca 0.32 1.74 0.02 0.00 0.00 0.00 0.00 56.93 59.01 2dkj s PHE 177 Cb 0.06 -3.32 -0.03 0.00 0.00 0.00 0.00 43.02 39.73 2dkj s PHE 177 CO 0.12 -2.63 -0.04 -1.58 -0.00 0.00 0.00 175.22 171.09 2dkj s TRP 178 N -2.61 2.96 -1.07 0.36 0.52 -1.26 -5.05 118.94 112.80 2dkj s TRP 178 Ca 0.67 0.01 -0.12 0.00 0.02 0.00 0.00 56.10 56.68 2dkj s TRP 178 Cb -0.23 -1.64 0.24 0.00 -1.15 0.00 0.00 33.47 30.69 2dkj s TRP 178 CO 0.56 0.41 1.12 0.34 0.02 0.00 0.00 176.95 179.40 2dkj s ASP 179 N -1.43 7.13 0.33 2.95 3.68 -1.26 -4.85 116.67 123.21 2dkj s ASP 179 Ca 0.18 -3.21 0.03 0.00 2.13 0.00 0.00 52.55 51.67 2dkj s ASP 179 Cb -0.11 -2.26 0.59 0.00 -1.45 0.00 0.00 42.92 39.68 2dkj s ASP 179 CO 0.08 -0.48 1.91 -0.26 0.13 0.00 0.00 175.17 176.55 2dkj h PHE 180 N 7.11 0.68 -0.50 -5.34 0.05 -1.96 -1.95 116.94 115.03 2dkj h PHE 180 Ca 0.19 -0.04 -0.01 0.00 3.82 0.00 0.00 57.97 61.94 2dkj h PHE 180 Cb 0.91 -0.21 -0.02 0.00 2.00 0.00 0.00 35.95 38.63 2dkj h PHE 180 CO 0.91 0.55 0.27 -0.22 -0.18 0.00 0.00 178.31 179.64 2dkj h LYS 181 N 0.67 0.70 -0.55 1.51 3.64 -1.94 -0.60 116.57 119.99 2dkj h LYS 181 Ca 0.16 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 2dkj h LYS 181 Cb 0.18 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2dkj h LYS 181 CO -0.01 0.54 0.16 0.00 -2.27 0.00 0.00 179.45 177.87 2dkj h ALA 182 N 1.12 0.72 -0.74 5.00 0.00 -1.88 -1.22 119.26 122.25 2dkj h ALA 182 Ca 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2dkj h ALA 182 Cb 0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2dkj h ALA 182 CO -0.03 0.39 0.37 0.74 0.00 0.00 0.00 179.25 180.72 2dkj h PHE 183 N 0.76 1.03 -0.32 0.00 -1.00 -1.02 -1.22 116.94 115.17 2dkj h PHE 183 Ca 0.17 -0.04 -0.12 0.00 2.81 0.00 0.00 57.97 60.80 2dkj h PHE 183 Cb 0.30 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.52 2dkj h PHE 183 CO 0.02 0.74 -0.30 -0.09 -1.61 0.00 0.00 178.31 177.07 2dkj h ARG 184 N 1.04 0.68 -0.61 1.51 9.65 -0.76 -0.33 114.38 125.56 2dkj h ARG 184 Ca 0.26 -0.30 -0.04 0.00 -1.10 0.00 0.00 59.98 58.80 2dkj h ARG 184 Cb 0.09 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 2dkj h ARG 184 CO -0.04 0.89 0.22 0.93 2.80 0.00 0.00 179.97 184.78 2dkj h GLU 185 N 0.58 0.92 -0.27 0.20 5.08 -0.69 0.10 114.58 120.51 2dkj h GLU 185 Ca 0.07 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 2dkj h GLU 185 Cb 0.80 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 2dkj h GLU 185 CO 0.07 0.80 0.04 0.82 -1.00 0.00 0.00 179.01 179.73 2dkj h ILE 186 N 0.85 1.24 -0.51 3.13 2.04 -1.02 -1.38 117.51 121.86 2dkj h ILE 186 Ca 0.20 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.29 2dkj h ILE 186 Cb 0.24 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 2dkj h ILE 186 CO -0.01 0.26 0.28 0.00 0.00 0.00 0.00 178.15 178.68 2dkj h ALA 187 N 0.86 0.66 -0.47 1.87 0.00 -0.81 -2.17 119.26 119.19 2dkj h ALA 187 Ca 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2dkj h ALA 187 Cb 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2dkj h ALA 187 CO 0.01 -0.05 0.08 -0.44 0.00 0.00 0.00 179.25 178.85 2dkj h ASP 188 N 0.55 0.68 -0.19 0.00 3.32 -0.82 0.16 116.42 120.12 2dkj h ASP 188 Ca 0.22 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 2dkj h ASP 188 Cb 0.09 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2dkj h ASP 188 CO -0.13 0.70 0.03 -0.08 -1.72 0.00 0.00 179.24 178.03 2dkj h GLU 189 N 0.70 0.42 -0.24 3.56 4.81 -0.61 -2.82 114.58 120.39 2dkj h GLU 189 Ca 0.15 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2dkj h GLU 189 Cb 0.31 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2dkj h GLU 189 CO 0.00 0.43 0.00 1.33 -0.73 0.00 0.00 179.01 180.04 2dkj n VAL 190 N -4.34 0.44 -2.46 0.32 0.24 -1.03 -4.98 118.33 106.51 2dkj n VAL 190 Ca 0.01 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.34 61.48 2dkj n VAL 190 Cb 0.20 0.98 0.01 0.00 -1.47 0.00 0.00 33.84 33.56 2dkj n VAL 190 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dkj n GLY 191 N 0.99 0.00 3.85 7.63 0.00 0.04 -4.89 105.19 112.82 2dkj n GLY 191 Ca 0.13 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 2dkj n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkj s ALA 192 N -2.73 3.68 0.19 4.61 0.00 0.34 -4.93 121.76 122.92 2dkj s ALA 192 Ca 0.09 -1.42 -0.19 0.00 0.00 0.00 0.00 51.96 50.45 2dkj s ALA 192 Cb -0.04 -1.36 -0.08 0.00 0.00 0.00 0.00 23.12 21.64 2dkj s ALA 192 CO 0.11 0.22 0.68 0.71 0.00 0.00 0.00 175.76 177.47 2dkj s TYR 193 N -2.13 3.67 -0.25 0.00 1.51 -0.15 -4.37 117.35 115.62 2dkj s TYR 193 Ca 0.34 1.32 -0.08 0.00 -1.01 0.00 0.00 57.07 57.64 2dkj s TYR 193 Cb -0.08 -2.56 -0.04 0.00 -0.11 0.00 0.00 41.96 39.17 2dkj s TYR 193 CO 0.26 0.39 0.10 -1.17 -1.11 0.00 0.00 175.55 174.02 2dkj s LEU 194 N -1.85 3.64 -0.15 -1.29 2.96 -1.26 -0.66 118.68 120.06 2dkj s LEU 194 Ca 0.40 -0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.18 2dkj s LEU 194 Cb -0.17 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.52 2dkj s LEU 194 CO 0.21 -0.02 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.41 2dkj s VAL 195 N 1.56 3.14 -0.22 1.68 1.01 -0.02 -0.52 120.40 127.01 2dkj s VAL 195 Ca 0.06 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 2dkj s VAL 195 Cb -0.15 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 2dkj s VAL 195 CO 0.06 0.51 -0.01 -0.69 0.00 0.00 0.00 175.10 174.96 2dkj s VAL 196 N 0.57 3.69 -0.58 2.92 1.01 -0.55 -1.06 120.40 126.41 2dkj s VAL 196 Ca -0.07 -0.39 -0.17 0.00 0.00 0.00 0.00 61.98 61.35 2dkj s VAL 196 Cb -0.15 -2.69 0.13 0.00 0.00 0.00 0.00 36.38 33.66 2dkj s VAL 196 CO 0.03 0.41 0.59 -0.62 0.00 0.00 0.00 175.10 175.51 2dkj s ASP 197 N 1.38 6.23 -0.09 3.32 -1.08 -0.01 -0.73 116.67 125.68 2dkj s ASP 197 Ca 0.05 -1.72 0.15 0.00 -0.52 0.00 0.00 52.55 50.50 2dkj s ASP 197 Cb -0.15 -2.24 0.58 0.00 -1.46 0.00 0.00 42.92 39.65 2dkj s ASP 197 CO -0.00 -0.93 1.46 1.15 0.52 0.00 0.00 175.17 177.36 2dkj n MET 198 N 5.56 3.21 -0.38 4.34 0.00 -0.23 -4.06 117.12 125.56 2dkj n MET 198 Ca -0.10 -2.30 -0.02 0.00 0.00 0.00 0.00 57.70 55.28 2dkj n MET 198 Cb 0.41 -1.78 0.02 0.00 0.00 0.00 0.00 33.22 31.88 2dkj n MET 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2dkj n ALA 199 N 0.86 -0.19 -0.22 3.17 0.00 -1.25 -0.39 120.51 122.49 2dkj n ALA 199 Ca 0.21 0.95 -0.07 0.00 0.00 0.00 0.00 53.44 54.53 2dkj n ALA 199 Cb 0.74 -0.39 0.03 0.00 0.00 0.00 0.00 19.45 19.83 2dkj n ALA 199 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dkj h HIS 200 N 0.00 0.97 -0.46 0.00 3.86 -1.84 -3.25 115.15 114.43 2dkj h HIS 200 Ca 0.31 -0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 2dkj h HIS 200 Cb 0.56 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.74 2dkj h HIS 200 CO -0.88 0.78 0.00 1.97 0.86 0.00 0.00 177.93 180.67 2dkj n PHE 201 N -4.41 1.32 -0.36 2.45 -1.74 -0.62 -3.73 117.46 110.37 2dkj n PHE 201 Ca 0.04 -0.72 0.05 0.00 -0.56 0.00 0.00 57.45 56.26 2dkj n PHE 201 Cb 0.19 -0.31 0.21 0.00 1.52 0.00 0.00 39.48 41.09 2dkj n PHE 201 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2dkj h ALA 202 N 3.04 1.47 -0.46 1.98 0.00 -0.75 -1.00 119.26 123.53 2dkj h ALA 202 Ca 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2dkj h ALA 202 Cb 1.49 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2dkj h ALA 202 CO 0.26 0.34 -0.01 0.78 0.00 0.00 0.00 179.25 180.62 2dkj h GLY 203 N 1.08 0.83 1.41 0.00 0.00 -1.83 -0.75 103.07 103.82 2dkj h GLY 203 Ca 0.46 -0.56 -0.12 0.00 0.00 0.00 0.00 47.33 47.11 2dkj h GLY 203 CO -0.21 0.52 -0.31 1.41 0.00 0.00 0.00 176.54 177.95 2dkj h LEU 204 N 0.72 0.69 -0.29 3.11 3.38 -1.52 -1.34 115.31 120.06 2dkj h LEU 204 Ca 0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2dkj h LEU 204 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2dkj h LEU 204 CO 0.02 0.95 0.06 0.58 0.09 0.00 0.00 178.44 180.15 2dkj h VAL 205 N 0.57 1.22 -0.39 1.22 2.07 -0.88 0.11 116.25 120.18 2dkj h VAL 205 Ca 0.07 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 66.88 2dkj h VAL 205 Cb 0.81 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2dkj h VAL 205 CO 0.07 0.24 0.26 0.00 0.02 0.00 0.00 177.57 178.16 2dkj h ALA 206 N 0.89 1.85 -0.01 1.67 0.00 -0.89 -0.95 119.26 121.83 2dkj h ALA 206 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2dkj h ALA 206 Cb 0.30 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2dkj h ALA 206 CO 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 179.25 179.25 2dkj n ALA 207 N -2.50 2.78 -1.56 0.00 0.00 -0.53 -4.92 120.51 113.78 2dkj n ALA 207 Ca 0.04 -0.33 -0.06 0.00 0.00 0.00 0.00 53.44 53.09 2dkj n ALA 207 Cb 0.15 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.32 2dkj n ALA 207 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dkj n GLY 208 N 1.24 0.53 0.78 0.00 0.00 -0.36 -4.90 105.19 102.48 2dkj n GLY 208 Ca 0.16 -0.73 0.07 0.00 0.00 0.00 0.00 46.02 45.51 2dkj n GLY 208 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dkj n LEU 209 N -0.73 3.16 -3.77 0.99 4.77 0.31 -4.95 117.00 116.78 2dkj n LEU 209 Ca -0.06 -2.05 -0.13 0.00 -0.03 0.00 0.00 56.01 53.74 2dkj n LEU 209 Cb 0.34 -0.29 -0.10 0.00 -2.33 0.00 0.00 43.42 41.04 2dkj n LEU 209 CO 0.08 0.77 -0.01 -2.28 -1.33 0.00 0.00 177.39 174.63 2dkj s HIS 210 N -1.09 -0.30 0.23 -1.77 2.46 -1.16 -4.89 115.29 108.76 2dkj s HIS 210 Ca 0.28 0.69 -0.31 0.00 0.47 0.00 0.00 55.06 56.20 2dkj s HIS 210 Cb 0.15 0.11 -0.15 0.00 -0.13 0.00 0.00 32.58 32.56 2dkj s HIS 210 CO 0.18 -0.22 1.10 -2.30 -2.47 0.00 0.00 174.74 171.03 2dkj n PRO 211 N 2.48 1.28 -2.90 2.88 -0.02 -1.26 -4.54 135.00 132.91 2dkj n PRO 211 Ca -0.15 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.36 2dkj n PRO 211 Cb 0.57 -1.89 -0.04 0.00 -0.02 0.00 0.00 33.50 32.11 2dkj n PRO 211 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2dkj s ASN 212 N -0.24 6.79 0.31 2.55 2.47 -1.26 -4.89 114.94 120.67 2dkj s ASN 212 Ca 0.67 0.95 0.24 0.00 0.42 0.00 0.00 52.86 55.14 2dkj s ASN 212 Cb -0.78 -2.43 0.51 0.00 -1.45 0.00 0.00 41.25 37.11 2dkj s ASN 212 CO 0.55 -0.54 1.62 1.55 -3.72 0.00 0.00 177.10 176.57 2dkj h PRO 213 N 7.78 0.00 -0.69 0.43 0.13 -1.97 -3.39 132.00 134.29 2dkj h PRO 213 Ca -0.23 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.04 2dkj h PRO 213 Cb 1.09 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.09 2dkj h PRO 213 CO 0.88 0.00 -0.14 -0.07 -0.23 0.00 0.00 178.00 178.43 2dkj h LEU 214 N 0.00 -0.59 -1.65 1.56 -0.00 -1.90 0.25 115.31 112.99 2dkj h LEU 214 Ca 0.00 0.20 -0.04 0.00 -0.00 0.00 0.00 57.88 58.05 2dkj h LEU 214 Cb 0.87 0.41 -0.01 0.00 -0.00 0.00 0.00 40.66 41.94 2dkj h LEU 214 CO 0.00 -0.22 -0.18 -0.65 -0.00 0.00 0.00 178.44 177.40 2dkj h PRO 215 N 0.02 0.00 0.01 1.13 0.11 -1.92 -3.31 132.00 128.04 2dkj h PRO 215 Ca 0.34 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 66.09 2dkj h PRO 215 Cb 0.53 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.58 2dkj h PRO 215 CO -0.69 0.18 -2.28 0.66 -0.21 0.00 0.00 178.00 175.65 2dkj n TYR 216 N -3.64 0.22 -2.58 0.65 4.02 -0.55 -4.97 117.16 110.32 2dkj n TYR 216 Ca -0.01 0.07 -0.32 0.00 -0.01 0.00 0.00 57.90 57.63 2dkj n TYR 216 Cb 0.30 -1.04 -0.04 0.00 -0.02 0.00 0.00 39.34 38.54 2dkj n TYR 216 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dkj s ALA 217 N -2.52 3.12 0.10 -0.72 0.00 -0.03 -4.72 121.76 116.99 2dkj s ALA 217 Ca -0.15 0.15 -0.03 0.00 0.00 0.00 0.00 51.96 51.93 2dkj s ALA 217 Cb 0.07 -3.04 -0.21 0.00 0.00 0.00 0.00 23.12 19.94 2dkj s ALA 217 CO 0.78 -0.11 1.21 0.45 0.00 0.00 0.00 175.76 178.09 2dkj h HIS 218 N 1.21 0.47 -3.21 0.00 3.86 -1.13 -3.45 115.15 112.91 2dkj h HIS 218 Ca -0.47 -0.32 -0.15 0.00 -1.16 0.00 0.00 60.37 58.28 2dkj h HIS 218 Cb 1.18 -0.03 -0.23 0.00 1.06 0.00 0.00 27.41 29.40 2dkj h HIS 218 CO 0.63 1.21 -0.41 0.08 0.86 0.00 0.00 177.93 180.30 2dkj s VAL 219 N -2.85 0.04 -0.09 2.45 1.01 -1.15 -4.50 120.40 115.31 2dkj s VAL 219 Ca -0.04 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2dkj s VAL 219 Cb 0.08 -0.44 0.00 0.00 0.00 0.00 0.00 36.38 36.02 2dkj s VAL 219 CO 0.87 -0.17 -0.21 -0.69 0.00 0.00 0.00 175.10 174.90 2dkj s VAL 220 N -0.66 1.81 0.27 2.92 1.01 0.05 -1.48 120.40 124.33 2dkj s VAL 220 Ca -0.07 -0.87 0.10 0.00 0.00 0.00 0.00 61.98 61.13 2dkj s VAL 220 Cb -0.04 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2dkj s VAL 220 CO 0.02 0.50 -0.03 0.42 0.00 0.00 0.00 175.10 176.01 2dkj s THR 221 N 0.41 3.29 0.04 3.92 -4.23 0.09 -0.28 115.64 118.89 2dkj s THR 221 Ca -0.17 -1.98 -0.28 0.00 -1.18 0.00 0.00 61.69 58.07 2dkj s THR 221 Cb -0.17 -2.77 0.09 0.00 1.34 0.00 0.00 72.50 70.99 2dkj s THR 221 CO 0.07 -0.37 1.06 -0.55 -0.54 0.00 0.00 174.62 174.29 2dkj s SER 222 N -3.65 -0.17 0.27 3.99 0.15 -0.44 -1.07 113.70 112.77 2dkj s SER 222 Ca 0.31 -0.22 0.05 0.00 0.70 0.00 0.00 55.95 56.80 2dkj s SER 222 Cb -0.06 0.35 -0.02 0.00 -1.71 0.00 0.00 66.02 64.57 2dkj s SER 222 CO 0.19 -0.62 0.39 0.42 1.20 0.00 0.00 173.24 174.82 2dkj s THR 223 N -2.94 4.93 -0.80 6.45 -4.23 -1.26 -0.67 115.64 117.11 2dkj s THR 223 Ca 0.11 -0.99 0.22 0.00 -1.18 0.00 0.00 61.69 59.85 2dkj s THR 223 Cb 0.00 -3.73 -0.19 0.00 1.34 0.00 0.00 72.50 69.92 2dkj s THR 223 CO -0.02 -0.28 0.95 0.35 -0.54 0.00 0.00 174.62 175.07 2dkj n THR 224 N -1.48 0.04 -2.83 3.99 -2.24 -0.21 -4.77 114.28 106.77 2dkj n THR 224 Ca -0.06 -0.11 -0.18 0.00 -2.27 0.00 0.00 64.05 61.43 2dkj n THR 224 Cb 0.57 0.61 0.08 0.00 -2.10 0.00 0.00 70.33 69.49 2dkj n THR 224 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dkj n HIS 225 N -1.69 -2.65 -0.95 4.78 -0.00 -1.15 -0.44 115.22 113.11 2dkj n HIS 225 Ca 0.03 -1.67 0.00 0.00 -0.00 0.00 0.00 57.72 56.08 2dkj n HIS 225 Cb 0.38 -0.53 0.00 0.00 -0.00 0.00 0.00 29.99 29.84 2dkj n HIS 225 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2dkj n LYS 226 N -2.28 0.00 0.27 -1.40 5.02 -1.26 -4.19 118.16 114.33 2dkj n LYS 226 Ca 0.14 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.56 2dkj n LYS 226 Cb 0.50 0.00 0.78 0.00 -0.02 0.00 0.00 35.03 36.30 2dkj n LYS 226 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2dkj h THR 227 N 0.00 0.58 0.00 -0.18 1.35 -1.78 -0.94 112.91 111.94 2dkj h THR 227 Ca 0.00 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2dkj h THR 227 Cb 0.00 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 2dkj h THR 227 CO 0.00 0.08 0.00 0.25 -0.25 0.00 0.00 175.52 175.60 2dkj h LEU 228 N 0.00 0.00 1.86 3.87 5.85 -1.80 -3.38 115.31 121.71 2dkj h LEU 228 Ca -0.00 0.00 -0.40 0.00 0.84 0.00 0.00 57.88 58.32 2dkj h LEU 228 Cb 0.22 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.26 2dkj h LEU 228 CO 0.01 0.00 -0.56 -1.14 -0.34 0.00 0.00 178.44 176.41 2dkj n ARG 229 N -2.47 -3.40 -1.21 1.25 0.63 -0.36 -4.91 116.66 106.19 2dkj n ARG 229 Ca 0.02 0.91 0.00 0.00 -0.92 0.00 0.00 57.85 57.86 2dkj n ARG 229 Cb 0.26 -5.68 0.00 0.00 0.45 0.00 0.00 32.46 27.50 2dkj n ARG 229 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2dkj n GLY 230 N -1.26 2.45 3.76 5.14 0.00 0.42 -4.66 105.19 111.03 2dkj n GLY 230 Ca -0.16 -2.15 -0.31 0.00 0.00 0.00 0.00 46.02 43.40 2dkj n GLY 230 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkj s PRO 231 N -1.94 2.18 -0.15 1.61 0.04 -1.26 -4.04 135.00 131.44 2dkj s PRO 231 Ca 0.00 1.20 -0.29 0.00 0.04 0.00 0.00 61.00 61.95 2dkj s PRO 231 Cb 0.00 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2dkj s PRO 231 CO 0.00 -1.70 1.55 0.50 0.04 0.00 0.00 177.00 177.39 2dkj s ARG 232 N -4.86 4.03 0.00 4.56 3.52 -1.26 -2.94 118.95 122.00 2dkj s ARG 232 Ca 0.62 1.85 0.00 0.00 -0.13 0.00 0.00 55.73 58.07 2dkj s ARG 232 Cb -0.18 -3.96 0.00 0.00 -1.56 0.00 0.00 34.95 29.25 2dkj s ARG 232 CO 0.56 -1.00 0.00 0.41 -0.81 0.00 0.00 175.30 174.45 2dkj n GLY 233 N 4.24 -1.43 3.72 8.12 0.00 -1.26 -4.89 105.19 113.69 2dkj n GLY 233 Ca 0.17 -1.00 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 2dkj n GLY 233 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dkj s GLY 234 N 0.00 2.65 -0.11 -0.02 0.00 -0.20 -1.04 107.32 108.60 2dkj s GLY 234 Ca 0.00 -1.50 -0.26 0.00 0.00 0.00 0.00 44.72 42.96 2dkj s GLY 234 CO 0.00 -2.08 0.61 -2.27 0.00 0.00 0.00 173.10 169.36 2dkj s LEU 235 N -3.86 -0.37 -0.01 0.66 2.96 0.15 -4.19 118.68 114.02 2dkj s LEU 235 Ca 0.26 0.81 0.02 0.00 -0.22 0.00 0.00 54.13 55.00 2dkj s LEU 235 Cb 0.05 2.24 -0.00 0.00 0.50 0.00 0.00 46.19 48.98 2dkj s LEU 235 CO 0.14 -0.46 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.00 2dkj s ILE 236 N -0.71 0.62 0.08 6.68 1.01 -0.61 -1.33 121.20 126.94 2dkj s ILE 236 Ca -0.08 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2dkj s ILE 236 Cb -0.02 -0.54 -0.04 0.00 0.01 0.00 0.00 42.46 41.87 2dkj s ILE 236 CO 0.06 0.19 -0.05 -0.76 0.00 0.00 0.00 174.94 174.38 2dkj s LEU 237 N -0.02 2.49 -0.01 2.97 1.43 0.62 -0.83 118.68 125.33 2dkj s LEU 237 Ca 0.01 -0.99 -0.29 0.00 -1.03 0.00 0.00 54.13 51.83 2dkj s LEU 237 Cb -0.05 0.03 0.10 0.00 0.03 0.00 0.00 46.19 46.30 2dkj s LEU 237 CO -0.00 -0.51 0.94 -0.55 0.23 0.00 0.00 176.35 176.46 2dkj s SER 238 N -2.95 -0.31 0.00 2.29 0.15 -0.93 -0.77 113.70 111.19 2dkj s SER 238 Ca 0.09 -0.04 0.21 0.00 0.70 0.00 0.00 55.95 56.91 2dkj s SER 238 Cb 0.06 0.36 0.53 0.00 -1.71 0.00 0.00 66.02 65.25 2dkj s SER 238 CO -0.07 -0.59 1.45 -0.46 1.20 0.00 0.00 173.24 174.77 2dkj n ASN 239 N -0.25 3.64 -3.96 5.45 0.23 -1.26 -1.49 115.26 117.62 2dkj n ASN 239 Ca -0.07 -1.98 -0.30 0.00 -0.53 0.00 0.00 54.58 51.69 2dkj n ASN 239 Cb 0.61 -0.38 -0.14 0.00 -2.08 0.00 0.00 39.78 37.79 2dkj n ASN 239 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2dkj s ASP 240 N -1.12 4.41 0.53 0.53 -1.08 -1.26 -4.80 116.67 113.89 2dkj s ASP 240 Ca 0.42 -2.74 0.19 0.00 -0.52 0.00 0.00 52.55 49.90 2dkj s ASP 240 Cb 0.22 -1.60 1.36 0.00 -1.46 0.00 0.00 42.92 41.44 2dkj s ASP 240 CO 0.30 -0.28 2.15 -0.65 0.52 0.00 0.00 175.17 177.21 2dkj h PRO 241 N 6.85 0.00 -0.28 4.34 0.11 -1.87 -0.34 132.00 140.80 2dkj h PRO 241 Ca -0.07 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.97 2dkj h PRO 241 Cb 0.93 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 2dkj h PRO 241 CO 0.63 0.00 -0.10 0.93 -0.21 0.00 0.00 178.00 179.25 2dkj h GLU 242 N 0.00 0.57 -0.36 1.05 4.39 -2.00 -0.80 114.58 117.43 2dkj h GLU 242 Ca 0.02 -0.23 -0.09 0.00 0.34 0.00 0.00 59.36 59.40 2dkj h GLU 242 Cb 0.09 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2dkj h GLU 242 CO -0.00 0.79 -0.16 1.25 -1.16 0.00 0.00 179.01 179.73 2dkj h LEU 243 N 0.32 0.64 -0.96 1.33 5.85 -1.85 -2.53 115.31 118.12 2dkj h LEU 243 Ca 0.07 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.64 2dkj h LEU 243 Cb 0.60 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 2dkj h LEU 243 CO 0.03 0.82 0.62 1.23 -0.34 0.00 0.00 178.44 180.80 2dkj h GLY 244 N 0.98 1.43 0.87 3.75 0.00 -0.69 -1.23 103.07 108.17 2dkj h GLY 244 Ca 0.10 -0.46 0.04 0.00 0.00 0.00 0.00 47.33 47.01 2dkj h GLY 244 CO 0.04 0.35 0.65 0.50 0.00 0.00 0.00 176.54 178.09 2dkj h LYS 245 N 1.15 1.22 -0.37 4.80 1.57 -0.71 0.11 116.57 124.35 2dkj h LYS 245 Ca 0.40 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 59.00 2dkj h LYS 245 Cb 0.10 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2dkj h LYS 245 CO -0.15 0.81 -0.20 -0.09 -0.57 0.00 0.00 179.45 179.25 2dkj h ARG 246 N 1.26 0.78 -0.47 3.15 2.43 -1.22 -2.88 114.38 117.44 2dkj h ARG 246 Ca 0.40 -0.35 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 2dkj h ARG 246 Cb 0.01 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2dkj h ARG 246 CO -0.13 0.97 0.05 0.82 -1.51 0.00 0.00 179.97 180.18 2dkj h ILE 247 N 0.57 1.22 -0.96 1.20 2.04 -0.61 -1.93 117.51 119.04 2dkj h ILE 247 Ca 0.08 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.12 2dkj h ILE 247 Cb 0.75 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 37.59 2dkj h ILE 247 CO 0.06 0.31 0.63 0.44 0.00 0.00 0.00 178.15 179.59 2dkj h ASP 248 N 0.70 1.02 0.40 1.72 3.32 -0.66 -0.90 116.42 122.03 2dkj h ASP 248 Ca 0.15 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.12 2dkj h ASP 248 Cb 0.35 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2dkj h ASP 248 CO 0.01 0.68 -0.37 0.11 -1.72 0.00 0.00 179.24 177.95 2dkj h LYS 249 N 1.18 0.00 0.00 3.56 1.57 -1.15 -1.73 116.57 120.00 2dkj h LYS 249 Ca 0.40 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.99 2dkj h LYS 249 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2dkj h LYS 249 CO -0.13 0.37 -0.86 -0.07 -0.57 0.00 0.00 179.45 178.19 2dkj h LEU 250 N 0.00 0.17 -0.19 2.94 -0.00 -0.79 -1.21 115.31 116.22 2dkj h LEU 250 Ca -0.00 -0.13 -0.06 0.00 -0.00 0.00 0.00 57.88 57.68 2dkj h LEU 250 Cb 0.67 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 41.28 2dkj h LEU 250 CO 0.05 0.94 -0.13 0.40 -0.00 0.00 0.00 178.44 179.70 2dkj h ILE 251 N 0.07 1.32 -2.83 1.22 1.08 -0.99 0.22 117.51 117.60 2dkj h ILE 251 Ca -0.03 -1.22 -0.15 0.00 -0.39 0.00 0.00 64.86 63.06 2dkj h ILE 251 Cb 1.48 1.70 -0.28 0.00 -3.07 0.00 0.00 36.82 36.66 2dkj h ILE 251 CO 0.12 0.37 -0.39 0.12 -0.69 0.00 0.00 178.15 177.68 2dkj s PHE 252 N -4.48 -0.47 -1.82 1.37 5.36 -0.68 -0.82 117.98 116.44 2dkj s PHE 252 Ca -0.14 1.05 0.02 0.00 -0.96 0.00 0.00 56.93 56.90 2dkj s PHE 252 Cb 0.06 0.16 0.07 0.00 -0.34 0.00 0.00 43.02 42.97 2dkj s PHE 252 CO 0.76 -0.29 0.99 -0.35 -1.46 0.00 0.00 175.22 174.87 2dkj n PRO 253 N 4.27 1.22 0.37 10.12 -0.04 -1.06 -3.98 135.00 145.90 2dkj n PRO 253 Ca -0.24 -0.29 -0.16 0.00 -0.04 0.00 0.00 63.50 62.77 2dkj n PRO 253 Cb 0.54 -1.15 -0.08 0.00 -0.04 0.00 0.00 33.50 32.77 2dkj n PRO 253 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2dkj h GLY 254 N 5.67 -1.12 0.00 0.55 0.00 -1.12 -3.42 103.07 103.64 2dkj h GLY 254 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2dkj h GLY 254 CO 0.01 -0.39 -0.05 0.29 0.00 0.00 0.00 176.54 176.40 2dkj n ILE 255 N -4.86 0.00 -4.53 2.60 -5.35 0.77 -4.97 119.36 103.02 2dkj n ILE 255 Ca -0.12 -0.35 -0.25 0.00 -0.27 0.00 0.00 62.75 61.76 2dkj n ILE 255 Cb 0.41 0.96 -0.10 0.00 -1.74 0.00 0.00 39.64 39.16 2dkj n ILE 255 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2dkj s GLN 256 N -0.80 1.81 0.00 6.28 -0.21 -0.00 -5.04 119.66 121.69 2dkj s GLN 256 Ca 0.00 -2.02 0.00 0.00 0.02 0.00 0.00 55.36 53.36 2dkj s GLN 256 Cb 0.00 -1.17 0.00 0.00 1.00 0.00 0.00 33.01 32.84 2dkj s GLN 256 CO 0.00 -0.16 0.00 0.41 -2.12 0.00 0.00 175.29 173.42 2dkj n GLY 257 N -0.83 1.50 3.72 3.09 0.00 -1.26 -4.64 105.19 106.77 2dkj n GLY 257 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2dkj n GLY 257 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dkj s GLY 258 N 0.00 2.20 0.65 -0.02 0.00 -1.26 -4.71 107.32 104.18 2dkj s GLY 258 Ca 0.00 1.08 -0.12 0.00 0.00 0.00 0.00 44.72 45.68 2dkj s GLY 258 CO 0.00 2.20 1.04 2.56 0.00 0.00 0.00 173.10 178.91 2dkj s PRO 259 N 0.64 3.27 -0.99 2.90 0.04 -1.26 -4.97 135.00 134.64 2dkj s PRO 259 Ca 0.61 0.92 -0.18 0.00 0.04 0.00 0.00 61.00 62.39 2dkj s PRO 259 Cb -0.36 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.29 2dkj s PRO 259 CO 0.33 -0.83 1.19 -0.51 0.04 0.00 0.00 177.00 177.22 2dkj s LEU 260 N -5.20 5.05 0.49 -3.56 1.43 -1.26 -4.77 118.68 110.86 2dkj s LEU 260 Ca 0.58 -2.24 0.23 0.00 -1.03 0.00 0.00 54.13 51.66 2dkj s LEU 260 Cb -0.13 -2.40 1.27 0.00 0.03 0.00 0.00 46.19 44.96 2dkj s LEU 260 CO 0.51 -1.00 2.03 -0.33 0.23 0.00 0.00 176.35 177.79 2dkj h GLU 261 N 8.48 0.00 -0.48 1.70 4.39 -1.87 -0.45 114.58 126.35 2dkj h GLU 261 Ca 0.19 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.78 2dkj h GLU 261 Cb 0.99 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 2dkj h GLU 261 CO 1.14 0.15 -0.14 1.12 -1.16 0.00 0.00 179.01 180.12 2dkj h HIS 262 N 0.00 1.00 -0.20 4.33 2.07 -1.86 -0.12 115.15 120.37 2dkj h HIS 262 Ca -0.00 -0.21 -0.16 0.00 -2.85 0.00 0.00 60.37 57.15 2dkj h HIS 262 Cb 0.35 -0.25 -0.01 0.00 2.57 0.00 0.00 27.41 30.08 2dkj h HIS 262 CO 0.00 0.97 -0.55 0.28 -3.07 0.00 0.00 177.93 175.56 2dkj h VAL 263 N 0.80 1.32 -0.69 6.12 2.07 -1.54 -1.87 116.25 122.45 2dkj h VAL 263 Ca 0.12 -1.79 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 2dkj h VAL 263 Cb 0.67 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 2dkj h VAL 263 CO 0.05 0.56 0.34 0.40 0.02 0.00 0.00 177.57 178.94 2dkj h ILE 264 N 0.46 1.22 -0.79 4.57 2.04 -0.83 0.23 117.51 124.40 2dkj h ILE 264 Ca 0.01 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 2dkj h ILE 264 Cb 1.11 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2dkj h ILE 264 CO 0.11 0.26 0.36 0.00 0.00 0.00 0.00 178.15 178.87 2dkj h ALA 265 N 1.40 1.03 -0.41 1.87 0.00 -0.74 -0.47 119.26 121.93 2dkj h ALA 265 Ca 0.24 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2dkj h ALA 265 Cb 0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2dkj h ALA 265 CO -0.03 0.61 0.08 0.78 0.00 0.00 0.00 179.25 180.69 2dkj h GLY 266 N 1.13 0.66 1.01 0.00 0.00 -0.27 -1.42 103.07 104.18 2dkj h GLY 266 Ca 0.27 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 47.16 2dkj h GLY 266 CO -0.03 0.34 0.02 0.50 0.00 0.00 0.00 176.54 177.37 2dkj h LYS 267 N 0.59 0.88 -0.65 4.80 1.57 0.32 -0.58 116.57 123.50 2dkj h LYS 267 Ca 0.13 -0.27 0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2dkj h LYS 267 Cb 0.26 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 2dkj h LYS 267 CO -0.00 0.90 0.41 0.00 -0.57 0.00 0.00 179.45 180.19 2dkj h ALA 268 N 0.94 0.85 -0.51 3.86 0.00 -0.53 0.36 119.26 124.23 2dkj h ALA 268 Ca 0.15 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2dkj h ALA 268 Cb 0.49 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2dkj h ALA 268 CO 0.02 0.17 0.21 0.28 0.00 0.00 0.00 179.25 179.93 2dkj h VAL 269 N 0.80 1.21 -0.82 0.00 2.07 -0.97 -0.48 116.25 118.05 2dkj h VAL 269 Ca 0.26 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2dkj h VAL 269 Cb 0.01 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 2dkj h VAL 269 CO -0.10 0.24 0.45 0.00 0.02 0.00 0.00 177.57 178.18 2dkj h ALA 270 N 1.06 1.25 -0.44 1.67 0.00 -0.51 -0.19 119.26 122.10 2dkj h ALA 270 Ca 0.17 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2dkj h ALA 270 Cb 0.17 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2dkj h ALA 270 CO -0.02 0.61 -0.23 0.74 0.00 0.00 0.00 179.25 180.35 2dkj h PHE 271 N 1.15 1.02 -0.38 0.00 0.05 -0.59 -0.74 116.94 117.45 2dkj h PHE 271 Ca 0.29 -0.25 0.02 0.00 3.82 0.00 0.00 57.97 61.86 2dkj h PHE 271 Cb 0.02 -0.24 -0.03 0.00 2.00 0.00 0.00 35.95 37.70 2dkj h PHE 271 CO 0.01 1.03 0.20 0.35 -0.18 0.00 0.00 178.31 179.71 2dkj h PHE 272 N 0.77 0.36 -0.73 -0.55 3.57 -0.41 -0.42 116.94 119.53 2dkj h PHE 272 Ca 0.10 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 2dkj h PHE 272 Cb 0.78 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 2dkj h PHE 272 CO 0.05 0.20 0.32 0.93 -2.23 0.00 0.00 178.31 177.58 2dkj h GLU 273 N 0.40 1.08 0.00 1.11 5.08 -0.73 -2.57 114.58 118.95 2dkj h GLU 273 Ca 0.16 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2dkj h GLU 273 Cb 0.05 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2dkj h GLU 273 CO -0.10 0.86 -0.02 0.00 -1.00 0.00 0.00 179.01 178.75 2dkj h ALA 274 N 1.16 1.00 0.00 3.43 0.00 -0.69 -2.63 119.26 121.52 2dkj h ALA 274 Ca 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2dkj h ALA 274 Cb 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2dkj h ALA 274 CO -0.03 0.03 -0.07 1.28 0.00 0.00 0.00 179.25 180.46 2dkj n LEU 275 N -3.12 0.36 -4.80 0.00 4.77 -0.21 -4.74 117.00 109.26 2dkj n LEU 275 Ca 0.01 0.47 -0.35 0.00 -0.03 0.00 0.00 56.01 56.11 2dkj n LEU 275 Cb 0.35 -0.40 -0.07 0.00 -2.33 0.00 0.00 43.42 40.97 2dkj n LEU 275 CO 0.29 -0.06 0.62 -1.10 -1.33 0.00 0.00 177.39 175.82 2dkj s GLN 276 N -3.04 4.42 0.51 3.23 -1.52 -0.99 -4.94 119.66 117.33 2dkj s GLN 276 Ca 0.12 1.20 0.21 0.00 -1.95 0.00 0.00 55.36 54.94 2dkj s GLN 276 Cb 0.16 -2.59 1.30 0.00 -0.22 0.00 0.00 33.01 31.67 2dkj s GLN 276 CO 0.58 0.18 2.03 -1.00 -0.25 0.00 0.00 175.29 176.83 2dkj h PRO 277 N 2.74 0.06 -0.21 2.91 0.13 -1.88 -1.33 132.00 134.42 2dkj h PRO 277 Ca -0.48 -0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.71 2dkj h PRO 277 Cb 1.19 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2dkj h PRO 277 CO 0.64 0.04 0.15 0.93 -0.23 0.00 0.00 178.00 179.53 2dkj h GLU 278 N 0.07 0.03 -0.12 0.86 3.07 -1.92 -1.70 114.58 114.87 2dkj h GLU 278 Ca 0.19 -0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.96 2dkj h GLU 278 Cb 0.67 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.56 2dkj h GLU 278 CO -0.01 0.02 -0.30 0.35 -1.40 0.00 0.00 179.01 177.67 2dkj h PHE 279 N 0.04 0.25 -0.25 4.33 3.57 -1.43 -1.42 116.94 122.02 2dkj h PHE 279 Ca 0.10 -0.05 -0.13 0.00 3.53 0.00 0.00 57.97 61.42 2dkj h PHE 279 Cb 0.36 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2dkj h PHE 279 CO -0.00 0.51 -0.37 -0.22 -2.23 0.00 0.00 178.31 176.00 2dkj h LYS 280 N 0.20 0.57 -0.40 1.11 3.64 -1.44 -0.43 116.57 119.81 2dkj h LYS 280 Ca 0.03 -0.27 -0.11 0.00 -1.27 0.00 0.00 60.65 59.03 2dkj h LYS 280 Cb 0.64 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 2dkj h LYS 280 CO 0.05 0.85 -0.16 1.49 -2.27 0.00 0.00 179.45 179.41 2dkj h GLU 281 N 0.48 0.82 -0.04 1.90 4.57 -1.38 -0.62 114.58 120.31 2dkj h GLU 281 Ca 0.05 -0.34 0.01 0.00 -1.18 0.00 0.00 59.36 57.89 2dkj h GLU 281 Cb 0.86 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 2dkj h GLU 281 CO 0.07 0.97 -0.01 -0.92 -1.18 0.00 0.00 179.01 177.94 2dkj h TYR 282 N 0.63 -0.03 -0.48 0.92 3.20 -1.07 -1.96 116.97 118.18 2dkj h TYR 282 Ca 0.09 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 2dkj h TYR 282 Cb 0.71 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 2dkj h TYR 282 CO 0.05 -0.02 0.22 0.77 -1.64 0.00 0.00 178.16 177.55 2dkj h SER 283 N -0.00 0.61 -0.63 -2.11 0.02 -0.95 -0.58 113.55 109.90 2dkj h SER 283 Ca 0.02 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.86 2dkj h SER 283 Cb 0.03 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 2dkj h SER 283 CO -0.04 0.53 0.18 -0.09 -1.14 0.00 0.00 176.83 176.27 2dkj h ARG 284 N 0.68 1.00 -0.29 3.45 2.43 -0.77 -2.16 114.38 118.72 2dkj h ARG 284 Ca 0.17 -0.22 -0.09 0.00 -0.81 0.00 0.00 59.98 59.02 2dkj h ARG 284 Cb 0.09 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2dkj h ARG 284 CO -0.02 0.89 -0.21 -0.07 -1.51 0.00 0.00 179.97 179.04 2dkj h LEU 285 N 0.92 0.53 -0.01 3.80 3.38 -0.57 -0.34 115.31 123.02 2dkj h LEU 285 Ca 0.20 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2dkj h LEU 285 Cb 0.32 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2dkj h LEU 285 CO -0.00 0.75 -0.01 0.58 0.09 0.00 0.00 178.44 179.85 2dkj h VAL 286 N 0.48 0.97 -0.46 1.22 2.07 -0.69 0.22 116.25 120.06 2dkj h VAL 286 Ca 0.07 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.50 2dkj h VAL 286 Cb 0.63 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2dkj h VAL 286 CO 0.04 0.00 -0.08 0.58 0.02 0.00 0.00 177.57 178.13 2dkj h VAL 287 N -0.01 1.27 -0.68 2.57 2.07 -1.22 -1.52 116.25 118.73 2dkj h VAL 287 Ca 0.01 -1.19 -0.05 0.00 0.82 0.00 0.00 66.70 66.29 2dkj h VAL 287 Cb 0.02 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2dkj h VAL 287 CO -0.02 0.41 0.21 -0.33 0.02 0.00 0.00 177.57 177.86 2dkj h GLU 288 N 0.71 1.05 -0.66 1.57 3.07 -0.91 -1.20 114.58 118.21 2dkj h GLU 288 Ca 0.12 -0.23 -0.04 0.00 -0.50 0.00 0.00 59.36 58.72 2dkj h GLU 288 Cb 0.62 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 2dkj h GLU 288 CO 0.04 0.91 0.27 -0.91 -1.40 0.00 0.00 179.01 177.92 2dkj h ASN 289 N 0.99 0.91 -0.21 1.42 2.35 -0.40 -0.23 115.58 120.40 2dkj h ASN 289 Ca 0.22 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 2dkj h ASN 289 Cb 0.30 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 2dkj h ASN 289 CO -0.01 0.83 0.05 0.00 -1.65 0.00 0.00 177.43 176.65 2dkj h ALA 290 N 1.12 0.28 -0.41 -0.83 0.00 -1.00 0.10 119.26 118.51 2dkj h ALA 290 Ca 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2dkj h ALA 290 Cb 0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2dkj h ALA 290 CO -0.02 -0.07 0.25 -0.22 0.00 0.00 0.00 179.25 179.19 2dkj h LYS 291 N 0.16 0.55 -0.34 0.00 3.64 -1.10 -1.58 116.57 117.90 2dkj h LYS 291 Ca 0.07 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 2dkj h LYS 291 Cb 0.28 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2dkj h LYS 291 CO 0.00 0.41 -0.12 -0.09 -2.27 0.00 0.00 179.45 177.38 2dkj h ARG 292 N 0.54 0.68 -0.73 1.90 9.65 -0.93 -1.82 114.38 123.67 2dkj h ARG 292 Ca 0.15 -0.28 -0.05 0.00 -1.10 0.00 0.00 59.98 58.70 2dkj h ARG 292 Cb -0.01 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 2dkj h ARG 292 CO -0.03 0.86 0.27 1.25 2.80 0.00 0.00 179.97 185.12 2dkj h LEU 293 N 0.46 1.02 -0.46 3.80 5.85 -0.70 0.75 115.31 126.03 2dkj h LEU 293 Ca 0.08 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2dkj h LEU 293 Cb 0.63 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2dkj h LEU 293 CO 0.04 0.93 0.26 0.00 -0.34 0.00 0.00 178.44 179.34 2dkj h ALA 294 N 1.13 0.58 -0.74 1.25 0.00 -1.22 -0.84 119.26 119.42 2dkj h ALA 294 Ca 0.24 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2dkj h ALA 294 Cb 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2dkj h ALA 294 CO -0.02 0.09 0.39 0.93 0.00 0.00 0.00 179.25 180.64 2dkj h GLU 295 N 0.60 1.05 -0.21 0.00 5.08 -0.84 -0.56 114.58 119.70 2dkj h GLU 295 Ca 0.16 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 2dkj h GLU 295 Cb 0.02 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 2dkj h GLU 295 CO -0.03 0.80 -0.28 0.93 -1.00 0.00 0.00 179.01 179.43 2dkj h GLU 296 N 1.03 0.40 -0.09 2.33 4.39 -0.51 -0.67 114.58 121.46 2dkj h GLU 296 Ca 0.26 -0.15 -0.20 0.00 0.34 0.00 0.00 59.36 59.60 2dkj h GLU 296 Cb 0.07 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2dkj h GLU 296 CO -0.04 0.65 -0.78 -0.07 -1.16 0.00 0.00 179.01 177.61 2dkj h LEU 297 N 0.35 0.63 -0.76 1.33 3.38 -0.84 -2.75 115.31 116.65 2dkj h LEU 297 Ca 0.05 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 2dkj h LEU 297 Cb 0.68 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2dkj h LEU 297 CO 0.05 1.19 0.32 0.00 0.09 0.00 0.00 178.44 180.10 2dkj h ALA 298 N 0.79 0.99 0.00 1.53 0.00 -0.77 -1.59 119.26 120.21 2dkj h ALA 298 Ca -0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2dkj h ALA 298 Cb 1.38 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 2dkj h ALA 298 CO 0.14 0.60 -0.09 0.00 0.00 0.00 0.00 179.25 179.90 2dkj h ARG 299 N 1.09 0.00 -0.35 0.00 3.08 -1.04 -2.20 114.38 114.96 2dkj h ARG 299 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 2dkj h ARG 299 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2dkj h ARG 299 CO -0.02 0.09 0.00 0.54 -1.07 0.00 0.00 179.97 179.50 2dkj n ARG 300 N -3.60 2.05 0.00 0.04 1.74 -0.64 -4.93 116.66 111.33 2dkj n ARG 300 Ca -0.02 -1.61 0.00 0.00 -0.77 0.00 0.00 57.85 55.45 2dkj n ARG 300 Cb 0.21 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 2dkj n ARG 300 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dkj n GLY 301 N 1.26 1.00 3.96 -0.13 0.00 -0.83 -5.07 105.19 105.38 2dkj n GLY 301 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 2dkj n GLY 301 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dkj s TYR 302 N -2.00 2.93 -0.01 1.61 1.51 -0.96 -4.58 117.35 115.84 2dkj s TYR 302 Ca 0.00 -0.33 0.05 0.00 -1.01 0.00 0.00 57.07 55.79 2dkj s TYR 302 Cb 0.00 -2.11 -0.03 0.00 -0.11 0.00 0.00 41.96 39.72 2dkj s TYR 302 CO 0.00 -0.12 -0.17 0.50 -1.11 0.00 0.00 175.55 174.64 2dkj s ARG 303 N -4.19 2.30 -0.20 -0.62 3.52 -1.11 -4.23 118.95 114.40 2dkj s ARG 303 Ca 0.48 -0.83 -0.07 0.00 -0.13 0.00 0.00 55.73 55.18 2dkj s ARG 303 Cb -0.08 -2.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 2dkj s ARG 303 CO 0.30 0.59 0.06 0.42 -0.81 0.00 0.00 175.30 175.86 2dkj s ILE 304 N -0.78 4.60 0.25 4.11 -1.09 -1.26 0.05 121.20 127.09 2dkj s ILE 304 Ca 0.12 -0.09 -0.31 0.00 -2.23 0.00 0.00 60.65 58.14 2dkj s ILE 304 Cb -0.10 -3.10 -0.12 0.00 -1.58 0.00 0.00 42.46 37.56 2dkj s ILE 304 CO 0.02 0.42 1.65 0.52 -1.23 0.00 0.00 174.94 176.32 2dkj n VAL 305 N 4.02 0.52 -0.85 2.92 0.31 -0.24 -0.19 118.33 124.82 2dkj n VAL 305 Ca -0.16 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2dkj n VAL 305 Cb 0.52 -1.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 2dkj n VAL 305 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dkj n THR 306 N 3.02 0.00 -0.72 2.52 -2.24 -1.26 -3.42 114.28 112.18 2dkj n THR 306 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2dkj n THR 306 Cb 0.35 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2dkj n THR 306 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dkj n GLY 307 N -1.86 1.13 0.00 3.38 0.00 0.73 -4.86 105.19 103.70 2dkj n GLY 307 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2dkj n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dkj n GLY 308 N -2.00 -0.59 3.39 -0.02 0.00 -1.22 -4.89 105.19 99.87 2dkj n GLY 308 Ca 0.00 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 2dkj n GLY 308 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dkj s THR 309 N -4.00 0.03 -0.87 2.61 -1.32 -1.26 -4.79 115.64 106.04 2dkj s THR 309 Ca 0.00 -0.24 0.14 0.00 -1.21 0.00 0.00 61.69 60.38 2dkj s THR 309 Cb 0.00 -0.94 -0.11 0.00 -1.51 0.00 0.00 72.50 69.93 2dkj s THR 309 CO 0.00 -0.13 0.66 0.47 -2.21 0.00 0.00 174.62 173.41 2dkj n ASP 310 N 0.58 0.91 0.00 8.08 10.43 0.33 -4.85 116.55 132.03 2dkj n ASP 310 Ca -0.19 -0.96 0.00 0.00 2.57 0.00 0.00 54.79 56.22 2dkj n ASP 310 Cb 0.59 0.86 0.00 0.00 1.84 0.00 0.00 41.12 44.41 2dkj n ASP 310 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2dkj n ASN 311 N -1.01 0.00 -0.13 -2.24 0.23 -1.25 -4.88 115.26 105.98 2dkj n ASN 311 Ca 0.04 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.22 2dkj n ASN 311 Cb 0.25 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.40 2dkj n ASN 311 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dkj n HIS 312 N 0.00 0.00 -4.26 -2.53 1.44 -1.26 -4.59 115.22 104.01 2dkj n HIS 312 Ca 0.00 0.00 -0.15 0.00 -2.01 0.00 0.00 57.72 55.56 2dkj n HIS 312 Cb 0.00 -0.20 -0.10 0.00 0.12 0.00 0.00 29.99 29.81 2dkj n HIS 312 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 2dkj s LEU 313 N -2.64 2.32 0.12 2.39 0.05 -1.26 -1.59 118.68 118.07 2dkj s LEU 313 Ca 0.22 -1.11 -0.16 0.00 0.05 0.00 0.00 54.13 53.13 2dkj s LEU 313 Cb 0.19 -0.23 0.04 0.00 -2.05 0.00 0.00 46.19 44.14 2dkj s LEU 313 CO 0.54 -0.46 0.40 0.72 -0.55 0.00 0.00 176.35 177.01 2dkj s PHE 314 N -3.46 -0.21 -0.16 3.48 -0.12 -0.23 -4.68 117.98 112.60 2dkj s PHE 314 Ca 0.22 -0.08 -0.01 0.00 -0.05 0.00 0.00 56.93 57.00 2dkj s PHE 314 Cb 0.05 0.26 -0.01 0.00 -0.63 0.00 0.00 43.02 42.68 2dkj s PHE 314 CO 0.03 -0.69 -0.11 -0.51 -0.05 0.00 0.00 175.22 173.90 2dkj s LEU 315 N -2.74 2.77 -0.26 -1.99 1.43 -1.26 -1.48 118.68 115.16 2dkj s LEU 315 Ca 0.02 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.66 2dkj s LEU 315 Cb 0.02 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.54 2dkj s LEU 315 CO -0.11 0.11 0.21 -0.69 0.23 0.00 0.00 176.35 176.10 2dkj s VAL 316 N 0.68 5.31 -0.39 -1.59 1.01 0.30 -1.08 120.40 124.64 2dkj s VAL 316 Ca -0.05 0.25 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 2dkj s VAL 316 Cb -0.15 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.69 2dkj s VAL 316 CO 0.02 0.28 0.82 -0.62 0.00 0.00 0.00 175.10 175.61 2dkj s ASP 317 N 1.42 6.54 0.00 3.32 -1.08 0.11 -1.89 116.67 125.09 2dkj s ASP 317 Ca 0.09 0.29 0.28 0.00 -0.52 0.00 0.00 52.55 52.69 2dkj s ASP 317 Cb -0.15 -2.41 1.12 0.00 -1.46 0.00 0.00 42.92 40.02 2dkj s ASP 317 CO 0.08 -0.82 1.79 0.18 0.52 0.00 0.00 175.17 176.92 2dkj n LEU 318 N 6.62 0.76 -0.24 -1.34 4.77 -0.01 -2.77 117.00 124.79 2dkj n LEU 318 Ca 0.04 -0.15 0.14 0.00 -0.03 0.00 0.00 56.01 56.00 2dkj n LEU 318 Cb 0.48 -0.12 0.43 0.00 -2.33 0.00 0.00 43.42 41.88 2dkj n LEU 318 CO 0.57 0.14 1.22 0.03 -1.33 0.00 0.00 177.39 178.01 2dkj h ARG 319 N 1.01 0.56 -0.14 3.23 3.08 -1.75 -1.71 114.38 118.66 2dkj h ARG 319 Ca 0.00 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.06 2dkj h ARG 319 Cb 0.39 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2dkj h ARG 319 CO 0.00 0.37 0.14 -1.35 -1.07 0.00 0.00 179.97 178.06 2dkj h PRO 320 N 0.58 0.00 -0.39 0.04 0.11 -1.84 -1.65 132.00 128.85 2dkj h PRO 320 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 2dkj h PRO 320 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2dkj h PRO 320 CO -0.18 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.24 2dkj n LYS 321 N -3.97 3.02 -3.25 1.05 5.02 -0.66 -4.99 118.16 114.39 2dkj n LYS 321 Ca 0.01 -2.43 -0.23 0.00 -2.02 0.00 0.00 58.31 53.64 2dkj n LYS 321 Cb 0.26 -1.54 0.05 0.00 -0.02 0.00 0.00 35.03 33.78 2dkj n LYS 321 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dkj n GLY 322 N 0.41 -0.53 3.50 0.72 0.00 -0.62 -5.01 105.19 103.65 2dkj n GLY 322 Ca 0.17 0.18 -0.27 0.00 0.00 0.00 0.00 46.02 46.10 2dkj n GLY 322 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dkj s LEU 323 N -6.93 2.71 0.29 0.99 1.43 -1.18 -5.04 118.68 110.94 2dkj s LEU 323 Ca 0.41 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 52.89 2dkj s LEU 323 Cb -0.18 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 2dkj s LEU 323 CO 0.51 0.13 0.43 0.42 0.23 0.00 0.00 176.35 178.07 2dkj s THR 324 N -1.54 4.78 0.25 5.49 -4.23 -1.26 -4.32 115.64 114.81 2dkj s THR 324 Ca 0.22 -0.92 -0.04 0.00 -1.18 0.00 0.00 61.69 59.76 2dkj s THR 324 Cb -0.09 -3.69 0.16 0.00 1.34 0.00 0.00 72.50 70.22 2dkj s THR 324 CO 0.12 -0.29 1.81 1.23 -0.54 0.00 0.00 174.62 176.94 2dkj h GLY 325 N 1.00 1.07 0.98 3.99 0.00 -0.91 -1.30 103.07 107.90 2dkj h GLY 325 Ca -0.49 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 46.23 2dkj h GLY 325 CO 0.58 0.56 0.26 1.70 0.00 0.00 0.00 176.54 179.65 2dkj h LYS 326 N 0.96 0.61 -0.40 4.80 3.64 -1.52 -0.10 116.57 124.57 2dkj h LYS 326 Ca 0.22 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2dkj h LYS 326 Cb 0.26 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2dkj h LYS 326 CO -0.01 0.46 0.13 1.49 -2.27 0.00 0.00 179.45 179.25 2dkj h GLU 327 N 0.59 0.62 -0.37 1.90 4.57 -1.79 -2.10 114.58 118.00 2dkj h GLU 327 Ca 0.16 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2dkj h GLU 327 Cb 0.01 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2dkj h GLU 327 CO -0.03 0.62 0.20 0.00 -1.18 0.00 0.00 179.01 178.62 2dkj h ALA 328 N 0.97 0.48 -0.79 2.92 0.00 -1.01 -1.09 119.26 120.75 2dkj h ALA 328 Ca 0.13 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2dkj h ALA 328 Cb 0.25 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 2dkj h ALA 328 CO -0.00 0.00 0.50 1.49 0.00 0.00 0.00 179.25 181.23 2dkj h GLU 329 N 0.47 0.93 -0.19 0.00 4.81 -0.90 -1.19 114.58 118.51 2dkj h GLU 329 Ca 0.13 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2dkj h GLU 329 Cb 0.06 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 2dkj h GLU 329 CO -0.02 0.61 -0.04 0.93 -0.73 0.00 0.00 179.01 179.76 2dkj h GLU 330 N 0.95 0.37 -0.84 1.92 5.08 -1.08 -0.95 114.58 120.04 2dkj h GLU 330 Ca 0.32 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2dkj h GLU 330 Cb 0.05 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2dkj h GLU 330 CO -0.13 0.62 0.41 0.00 -1.00 0.00 0.00 179.01 178.91 2dkj h ARG 331 N 0.09 1.20 -0.34 2.33 3.08 -0.98 -1.60 114.38 118.16 2dkj h ARG 331 Ca 0.05 -0.18 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 2dkj h ARG 331 Cb 0.48 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2dkj h ARG 331 CO 0.02 0.92 -0.30 -0.07 -1.07 0.00 0.00 179.97 179.47 2dkj h LEU 332 N 1.19 0.86 -0.98 3.04 3.38 -1.20 -2.97 115.31 118.64 2dkj h LEU 332 Ca 0.29 -0.46 0.06 0.00 0.09 0.00 0.00 57.88 57.86 2dkj h LEU 332 Cb 0.11 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 2dkj h LEU 332 CO -0.04 1.14 0.63 -0.78 0.09 0.00 0.00 178.44 179.48 2dkj h ASP 333 N 0.60 1.01 0.09 -0.43 3.58 -0.77 -0.47 116.42 120.03 2dkj h ASP 333 Ca 0.06 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 2dkj h ASP 333 Cb 0.88 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.73 2dkj h ASP 333 CO 0.08 0.65 -0.01 0.00 -2.88 0.00 0.00 179.24 177.07 2dkj h ALA 334 N 1.44 1.21 -0.27 -0.78 0.00 -1.13 -1.77 119.26 117.96 2dkj h ALA 334 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2dkj h ALA 334 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2dkj h ALA 334 CO -0.17 0.02 0.00 1.33 0.00 0.00 0.00 179.25 180.43 2dkj n VAL 335 N -3.40 2.02 -0.77 0.00 0.24 -0.53 -4.81 118.33 111.07 2dkj n VAL 335 Ca -0.03 -1.71 0.00 0.00 -2.04 0.00 0.00 64.34 60.56 2dkj n VAL 335 Cb 0.10 -0.10 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2dkj n VAL 335 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dkj n GLY 336 N -0.33 0.56 3.28 7.63 0.00 -0.67 -4.44 105.19 111.22 2dkj n GLY 336 Ca 0.19 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 2dkj n GLY 336 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dkj s ILE 337 N -2.00 3.15 -0.26 -0.61 1.01 -0.30 -0.73 121.20 121.46 2dkj s ILE 337 Ca 0.00 -0.57 -0.09 0.00 0.00 0.00 0.00 60.65 59.99 2dkj s ILE 337 Cb 0.00 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 2dkj s ILE 337 CO 0.00 0.45 0.13 -0.89 0.00 0.00 0.00 174.94 174.62 2dkj s THR 338 N 1.40 4.81 0.36 2.92 2.01 -0.44 -2.34 115.64 124.36 2dkj s THR 338 Ca 0.05 -0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.10 2dkj s THR 338 Cb -0.14 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2dkj s THR 338 CO -0.05 0.30 0.21 0.68 -0.69 0.00 0.00 174.62 175.08 2dkj s VAL 339 N 1.64 0.24 0.01 3.82 -7.23 -1.26 -0.44 120.40 117.18 2dkj s VAL 339 Ca 0.07 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.25 2dkj s VAL 339 Cb -0.15 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.36 2dkj s VAL 339 CO 0.07 0.00 -0.06 0.54 -0.31 0.00 0.00 175.10 175.34 2dkj s ASN 340 N -3.48 0.69 0.64 4.85 4.22 -1.23 -4.91 114.94 115.72 2dkj s ASN 340 Ca 0.33 -0.20 -0.18 0.00 -2.14 0.00 0.00 52.86 50.67 2dkj s ASN 340 Cb 0.02 -0.05 -0.01 0.00 1.28 0.00 0.00 41.25 42.49 2dkj s ASN 340 CO 0.22 0.01 1.25 -1.59 -2.04 0.00 0.00 177.10 174.94 2dkj s LYS 341 N -0.46 2.65 -0.20 3.55 -2.85 -1.26 -0.94 119.74 120.24 2dkj s LYS 341 Ca -0.01 1.94 -0.13 0.00 -1.00 0.00 0.00 55.97 56.78 2dkj s LYS 341 Cb -0.04 -1.87 0.06 0.00 -2.06 0.00 0.00 37.83 33.92 2dkj s LYS 341 CO -0.00 -1.49 0.50 1.21 0.10 0.00 0.00 175.35 175.67 2dkj s ASN 342 N -1.54 -0.61 0.38 0.03 2.47 -0.05 -4.68 114.94 110.94 2dkj s ASN 342 Ca 0.80 1.06 -0.26 0.00 0.42 0.00 0.00 52.86 54.87 2dkj s ASN 342 Cb -0.34 0.98 -0.09 0.00 -1.45 0.00 0.00 41.25 40.35 2dkj s ASN 342 CO 0.38 -0.20 1.23 0.00 -3.72 0.00 0.00 177.10 174.80 2dkj s ALA 343 N 1.08 3.27 0.54 1.71 0.00 -1.26 -2.72 121.76 124.37 2dkj s ALA 343 Ca -0.07 1.11 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 2dkj s ALA 343 Cb -0.06 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.64 2dkj s ALA 343 CO -0.10 -0.62 0.80 0.96 0.00 0.00 0.00 175.76 176.80 2dkj s ILE 344 N -1.29 3.52 0.22 0.00 -4.36 -1.26 -4.91 121.20 113.11 2dkj s ILE 344 Ca 0.54 -0.31 -0.32 0.00 -0.26 0.00 0.00 60.65 60.30 2dkj s ILE 344 Cb -0.35 -3.36 -0.14 0.00 1.25 0.00 0.00 42.46 39.87 2dkj s ILE 344 CO 0.45 -0.30 1.44 -2.65 0.24 0.00 0.00 174.94 174.11 2dkj n PRO 345 N -2.38 2.01 -4.01 0.37 -0.02 -1.26 -1.72 135.00 127.99 2dkj n PRO 345 Ca 0.04 0.72 -0.27 0.00 -2.02 0.00 0.00 63.50 61.97 2dkj n PRO 345 Cb 0.58 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 2dkj n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2dkj n PHE 346 N 2.26 -1.64 -1.69 6.00 3.01 -1.26 -4.83 117.46 119.31 2dkj n PHE 346 Ca 0.13 0.75 -0.44 0.00 1.01 0.00 0.00 57.45 58.90 2dkj n PHE 346 Cb 0.30 -3.58 -0.04 0.00 -0.01 0.00 0.00 39.48 36.16 2dkj n PHE 346 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2dkj n ASP 347 N -2.93 3.51 0.02 4.37 4.64 -0.70 -4.88 116.55 120.58 2dkj n ASP 347 Ca -0.25 1.07 0.10 0.00 -1.38 0.00 0.00 54.79 54.33 2dkj n ASP 347 Cb 0.66 -1.49 0.44 0.00 -1.04 0.00 0.00 41.12 39.68 2dkj n ASP 347 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2dkj n PRO 348 N 3.71 0.04 -4.06 -0.67 -0.04 -1.26 -4.75 135.00 127.97 2dkj n PRO 348 Ca 0.17 0.19 -0.30 0.00 -0.04 0.00 0.00 63.50 63.51 2dkj n PRO 348 Cb 0.32 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.14 2dkj n PRO 348 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2dkj s LYS 349 N -3.05 2.85 0.81 0.54 -0.14 -1.26 -5.09 119.74 114.40 2dkj s LYS 349 Ca 0.09 -0.72 -0.11 0.00 -1.36 0.00 0.00 55.97 53.87 2dkj s LYS 349 Cb 0.13 -2.70 0.08 0.00 -1.68 0.00 0.00 37.83 33.66 2dkj s LYS 349 CO 0.39 0.56 1.12 -1.25 -0.76 0.00 0.00 175.35 175.41 2dkj s PRO 350 N -2.45 1.85 0.51 -1.68 0.04 -1.26 -4.37 135.00 127.64 2dkj s PRO 350 Ca 0.29 1.36 0.28 0.00 0.04 0.00 0.00 61.00 62.97 2dkj s PRO 350 Cb -0.12 -1.84 1.39 0.00 0.04 0.00 0.00 34.50 33.97 2dkj s PRO 350 CO 0.22 -1.98 1.90 -1.00 0.04 0.00 0.00 177.00 176.18 2dkj h PRO 351 N -1.25 0.08 0.00 0.56 0.13 -1.98 0.20 132.00 129.74 2dkj h PRO 351 Ca -0.44 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dkj h PRO 351 Cb 1.25 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dkj h PRO 351 CO 0.48 0.05 0.00 0.54 -0.23 0.00 0.00 178.00 178.84 2dkj n ARG 352 N -4.34 0.00 0.01 0.86 3.00 -1.26 -4.29 116.66 110.64 2dkj n ARG 352 Ca 0.17 0.06 -0.02 0.00 -0.01 0.00 0.00 57.85 58.06 2dkj n ARG 352 Cb 0.85 -1.50 -0.01 0.00 0.00 0.00 0.00 32.46 31.80 2dkj n ARG 352 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2dkj n VAL 353 N -1.51 0.97 -1.08 1.55 0.31 0.25 -4.79 118.33 114.02 2dkj n VAL 353 Ca 0.06 0.29 0.14 0.00 -0.01 0.00 0.00 64.34 64.82 2dkj n VAL 353 Cb 0.30 -1.61 -0.06 0.00 -0.91 0.00 0.00 33.84 31.57 2dkj n VAL 353 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2dkj n THR 354 N -3.42 -0.18 -0.61 2.52 -2.24 0.44 -1.61 114.28 109.19 2dkj n THR 354 Ca -0.03 0.45 0.06 0.00 -2.27 0.00 0.00 64.05 62.27 2dkj n THR 354 Cb 0.09 -0.82 0.12 0.00 -2.10 0.00 0.00 70.33 67.62 2dkj n THR 354 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dkj n SER 355 N -3.83 2.57 -3.05 3.42 7.64 -1.26 -0.96 113.62 118.14 2dkj n SER 355 Ca -0.04 -2.60 -0.12 0.00 1.01 0.00 0.00 58.87 57.12 2dkj n SER 355 Cb 0.51 -0.29 -0.01 0.00 -1.01 0.00 0.00 64.21 63.41 2dkj n SER 355 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dkj s GLY 356 N -1.90 0.93 0.03 0.23 0.00 -1.10 -0.83 107.32 104.69 2dkj s GLY 356 Ca 0.23 -1.13 0.01 0.00 0.00 0.00 0.00 44.72 43.82 2dkj s GLY 356 CO 0.05 -0.65 -0.04 -0.26 0.00 0.00 0.00 173.10 172.19 2dkj s ILE 357 N -2.63 0.27 -0.11 0.90 -4.36 -0.79 -0.88 121.20 113.61 2dkj s ILE 357 Ca 0.23 -1.13 -0.03 0.00 -0.26 0.00 0.00 60.65 59.45 2dkj s ILE 357 Cb -0.03 -0.60 -0.03 0.00 1.25 0.00 0.00 42.46 43.05 2dkj s ILE 357 CO 0.16 -0.55 0.02 -0.60 0.24 0.00 0.00 174.94 174.20 2dkj s ARG 358 N -1.95 3.26 -0.01 0.37 3.52 -0.11 -0.54 118.95 123.50 2dkj s ARG 358 Ca -0.10 -0.39 0.04 0.00 -0.13 0.00 0.00 55.73 55.15 2dkj s ARG 358 Cb -0.07 -2.90 -0.01 0.00 -1.56 0.00 0.00 34.95 30.41 2dkj s ARG 358 CO -0.02 0.58 -0.13 0.42 -0.81 0.00 0.00 175.30 175.34 2dkj s ILE 359 N -0.53 1.01 0.03 4.11 1.01 -0.55 -3.48 121.20 122.80 2dkj s ILE 359 Ca 0.09 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.23 2dkj s ILE 359 Cb -0.12 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.48 2dkj s ILE 359 CO 0.02 0.29 -0.09 -0.83 0.00 0.00 0.00 174.94 174.33 2dkj s GLY 360 N -0.28 0.53 0.00 6.18 0.00 0.12 -1.06 107.32 112.81 2dkj s GLY 360 Ca 0.05 -0.66 0.23 0.00 0.00 0.00 0.00 44.72 44.33 2dkj s GLY 360 CO -0.00 -0.67 1.17 -1.30 0.00 0.00 0.00 173.10 172.29 2dkj n THR 361 N 1.91 0.00 -0.20 0.90 -2.24 -0.62 -4.46 114.28 109.57 2dkj n THR 361 Ca -0.19 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2dkj n THR 361 Cb 0.55 1.40 0.11 0.00 -2.10 0.00 0.00 70.33 70.29 2dkj n THR 361 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2dkj h PRO 362 N 3.73 0.30 -0.01 -0.78 0.11 -1.83 -1.51 132.00 132.02 2dkj h PRO 362 Ca 0.00 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 2dkj h PRO 362 Cb 0.88 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.92 2dkj h PRO 362 CO 0.00 0.20 0.00 0.00 -0.21 0.00 0.00 178.00 177.99 2dkj h ALA 363 N 1.45 0.02 0.00 -0.75 0.00 -1.82 -2.00 119.26 116.16 2dkj h ALA 363 Ca 0.31 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2dkj h ALA 363 Cb 0.43 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2dkj h ALA 363 CO -0.36 -0.34 -0.37 -0.84 0.00 0.00 0.00 179.25 177.34 2dkj h ILE 364 N -0.25 1.13 -0.44 0.00 3.07 -1.69 -2.40 117.51 116.93 2dkj h ILE 364 Ca 0.00 -1.32 -0.11 0.00 1.55 0.00 0.00 64.86 64.99 2dkj h ILE 364 Cb 0.27 1.74 -0.02 0.00 -0.27 0.00 0.00 36.82 38.54 2dkj h ILE 364 CO 0.00 0.36 -0.16 0.74 -1.05 0.00 0.00 178.15 178.04 2dkj h THR 365 N 0.00 1.27 -0.22 0.16 2.02 -1.16 -1.83 112.91 113.14 2dkj h THR 365 Ca -0.00 -1.27 -0.03 0.00 0.77 0.00 0.00 66.41 65.88 2dkj h THR 365 Cb 0.71 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 2dkj h THR 365 CO 0.05 0.43 -0.01 0.74 0.37 0.00 0.00 175.52 177.10 2dkj h THR 366 N 0.75 1.15 -0.08 3.16 2.02 -0.88 -1.24 112.91 117.79 2dkj h THR 366 Ca 0.11 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.73 2dkj h THR 366 Cb 0.67 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 2dkj h THR 366 CO 0.05 0.19 0.00 0.54 0.37 0.00 0.00 175.52 176.67 2dkj n ARG 367 N -4.35 1.19 -0.14 6.66 1.74 -0.86 -4.77 116.66 116.14 2dkj n ARG 367 Ca 0.00 -0.30 0.00 0.00 -0.77 0.00 0.00 57.85 56.78 2dkj n ARG 367 Cb 0.20 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.51 2dkj n ARG 367 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dkj n GLY 368 N 0.69 0.71 3.75 -0.13 0.00 -0.47 -4.12 105.19 105.63 2dkj n GLY 368 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2dkj n GLY 368 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dkj s PHE 369 N -2.17 3.31 0.33 1.61 0.08 -0.75 -5.01 117.98 115.38 2dkj s PHE 369 Ca 0.00 1.45 0.10 0.00 0.12 0.00 0.00 56.93 58.60 2dkj s PHE 369 Cb 0.00 -3.51 -0.06 0.00 -0.57 0.00 0.00 43.02 38.88 2dkj s PHE 369 CO 0.00 -1.38 -0.11 0.95 -0.10 0.00 0.00 175.22 174.58 2dkj s THR 370 N -0.69 2.23 0.29 0.64 -4.23 -1.26 -4.55 115.64 108.07 2dkj s THR 370 Ca 0.50 -2.23 0.04 0.00 -1.18 0.00 0.00 61.69 58.82 2dkj s THR 370 Cb -0.36 -2.57 0.29 0.00 1.34 0.00 0.00 72.50 71.20 2dkj s THR 370 CO 0.43 -0.24 1.70 -0.65 -0.54 0.00 0.00 174.62 175.32 2dkj h PRO 371 N 2.08 0.39 0.00 3.99 0.11 -1.90 0.15 132.00 136.82 2dkj h PRO 371 Ca -0.41 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2dkj h PRO 371 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2dkj h PRO 371 CO 0.69 0.26 0.00 0.39 -0.21 0.00 0.00 178.00 179.12 2dkj n GLU 372 N -5.04 0.11 0.00 1.05 -0.58 -1.26 -1.45 120.64 113.47 2dkj n GLU 372 Ca 0.22 0.22 0.11 0.00 -0.42 0.00 0.00 57.16 57.29 2dkj n GLU 372 Cb 0.66 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 30.03 2dkj n GLU 372 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2dkj n GLU 373 N -1.35 0.34 0.12 3.49 1.02 0.04 -4.34 120.64 119.95 2dkj n GLU 373 Ca 0.05 -0.26 0.02 0.00 -0.02 0.00 0.00 57.16 56.94 2dkj n GLU 373 Cb 0.10 -1.49 0.37 0.00 -0.02 0.00 0.00 31.44 30.40 2dkj n GLU 373 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2dkj h MET 374 N 0.64 0.22 -0.85 3.49 2.86 -1.28 -2.50 114.93 117.50 2dkj h MET 374 Ca 0.00 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2dkj h MET 374 Cb 0.56 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 2dkj h MET 374 CO 0.00 0.40 0.56 -1.35 1.06 0.00 0.00 176.91 177.59 2dkj h PRO 375 N 0.20 1.13 -0.38 -0.22 0.11 -1.76 0.44 132.00 131.52 2dkj h PRO 375 Ca 0.04 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 2dkj h PRO 375 Cb 0.45 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.29 2dkj h PRO 375 CO 0.03 0.75 0.12 1.25 -0.21 0.00 0.00 178.00 179.94 2dkj h LEU 376 N 1.16 0.55 -0.78 2.35 5.85 -1.76 -0.82 115.31 121.86 2dkj h LEU 376 Ca 0.31 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2dkj h LEU 376 Cb -0.13 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.72 2dkj h LEU 376 CO -0.07 0.61 0.49 0.58 -0.34 0.00 0.00 178.44 179.71 2dkj h VAL 377 N 0.47 1.21 -0.85 1.05 2.07 -1.03 -0.73 116.25 118.45 2dkj h VAL 377 Ca 0.12 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 2dkj h VAL 377 Cb 0.25 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 2dkj h VAL 377 CO -0.00 0.22 0.40 0.00 0.02 0.00 0.00 177.57 178.20 2dkj h ALA 378 N 1.26 1.09 -0.59 1.67 0.00 -0.65 -1.36 119.26 120.68 2dkj h ALA 378 Ca 0.28 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2dkj h ALA 378 Cb -0.06 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.37 2dkj h ALA 378 CO -0.06 0.67 0.17 1.49 0.00 0.00 0.00 179.25 181.52 2dkj h GLU 379 N 1.21 0.93 -0.63 0.00 4.81 -0.44 -0.49 114.58 119.97 2dkj h GLU 379 Ca 0.29 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 2dkj h GLU 379 Cb 0.13 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2dkj h GLU 379 CO -0.04 0.85 0.07 -0.07 -0.73 0.00 0.00 179.01 179.10 2dkj h LEU 380 N 0.85 1.03 -0.12 1.64 3.38 -0.82 -0.05 115.31 121.22 2dkj h LEU 380 Ca 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2dkj h LEU 380 Cb 0.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2dkj h LEU 380 CO -0.00 1.05 0.05 0.40 0.09 0.00 0.00 178.44 180.03 2dkj h ILE 381 N 0.98 1.13 -0.56 1.22 2.04 -1.04 -1.71 117.51 119.58 2dkj h ILE 381 Ca 0.19 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.66 2dkj h ILE 381 Cb 0.47 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2dkj h ILE 381 CO 0.02 0.12 0.37 -0.78 0.00 0.00 0.00 178.15 177.88 2dkj h ASP 382 N 0.05 0.65 -0.75 1.72 3.58 -0.90 -1.84 116.42 118.93 2dkj h ASP 382 Ca 0.04 -0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 2dkj h ASP 382 Cb 0.14 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.00 2dkj h ASP 382 CO -0.00 0.47 0.46 0.03 -2.88 0.00 0.00 179.24 177.32 2dkj h ARG 383 N 0.76 1.02 -0.84 0.28 3.08 -0.89 0.11 114.38 117.90 2dkj h ARG 383 Ca 0.21 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2dkj h ARG 383 Cb -0.09 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 29.71 2dkj h ARG 383 CO -0.04 0.71 0.44 0.00 -1.07 0.00 0.00 179.97 180.01 2dkj h ALA 384 N 1.25 1.08 -0.02 0.04 0.00 -0.89 0.20 119.26 120.92 2dkj h ALA 384 Ca 0.27 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 2dkj h ALA 384 Cb -0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 2dkj h ALA 384 CO -0.05 0.61 -0.81 -0.07 0.00 0.00 0.00 179.25 178.93 2dkj h LEU 385 N 1.18 0.30 0.05 0.00 3.38 -0.84 -1.21 115.31 118.17 2dkj h LEU 385 Ca 0.29 -0.22 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 2dkj h LEU 385 Cb 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2dkj h LEU 385 CO -0.04 0.99 -0.91 -0.07 0.09 0.00 0.00 178.44 178.50 2dkj h LEU 386 N 0.14 0.17 0.00 1.67 3.38 -0.58 -3.39 115.31 116.71 2dkj h LEU 386 Ca -0.04 -0.81 -0.13 0.00 0.09 0.00 0.00 57.88 56.99 2dkj h LEU 386 Cb 1.41 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 2dkj h LEU 386 CO 0.13 1.38 -1.18 -0.33 0.09 0.00 0.00 178.44 178.53 2dkj h GLU 387 N -0.71 0.00 0.00 1.13 5.08 -0.75 -3.51 114.58 115.82 2dkj h GLU 387 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2dkj h GLU 387 Cb 1.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.65 2dkj h GLU 387 CO -0.03 0.28 0.00 0.41 -1.00 0.00 0.00 179.01 178.67 2dkj n GLY 388 N 1.33 -0.32 3.77 -3.84 0.00 -0.46 -4.96 105.19 100.72 2dkj n GLY 388 Ca -0.06 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.82 2dkj n GLY 388 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkj s PRO 389 N -1.52 2.96 0.03 1.61 0.04 -1.26 -4.66 135.00 132.21 2dkj s PRO 389 Ca 0.00 1.52 -0.25 0.00 0.04 0.00 0.00 61.00 62.31 2dkj s PRO 389 Cb 0.00 -1.96 0.06 0.00 0.04 0.00 0.00 34.50 32.64 2dkj s PRO 389 CO 0.00 -1.14 0.58 -1.54 0.04 0.00 0.00 177.00 174.94 2dkj s SER 390 N -2.19 -0.53 0.20 6.66 1.04 -1.26 -5.05 113.70 112.57 2dkj s SER 390 Ca 0.70 0.32 -0.11 0.00 0.48 0.00 0.00 55.95 57.34 2dkj s SER 390 Cb -0.23 0.52 0.13 0.00 0.10 0.00 0.00 66.02 66.54 2dkj s SER 390 CO 0.36 -0.72 1.86 1.05 0.98 0.00 0.00 173.24 176.77 2dkj h GLU 391 N 2.75 0.92 -0.53 4.02 9.09 -1.97 -1.46 114.58 127.40 2dkj h GLU 391 Ca -0.30 -0.07 0.04 0.00 0.05 0.00 0.00 59.36 59.08 2dkj h GLU 391 Cb 1.20 -0.20 -0.04 0.00 -1.65 0.00 0.00 28.75 28.06 2dkj h GLU 391 CO 0.40 0.63 0.29 0.00 0.05 0.00 0.00 179.01 180.38 2dkj h ALA 392 N 1.24 0.69 -0.38 1.06 0.00 -1.99 -0.91 119.26 118.98 2dkj h ALA 392 Ca 0.25 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 2dkj h ALA 392 Cb -0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2dkj h ALA 392 CO -0.05 -0.03 -0.17 1.25 0.00 0.00 0.00 179.25 180.26 2dkj h LEU 393 N 0.57 0.80 -0.99 0.00 5.85 -1.90 -1.40 115.31 118.24 2dkj h LEU 393 Ca 0.23 -0.40 0.03 0.00 0.84 0.00 0.00 57.88 58.57 2dkj h LEU 393 Cb 0.09 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 2dkj h LEU 393 CO -0.13 1.02 0.65 -0.09 -0.34 0.00 0.00 178.44 179.55 2dkj h ARG 394 N 0.58 1.25 -0.03 1.25 9.65 -0.93 -1.09 114.38 125.05 2dkj h ARG 394 Ca 0.09 -0.08 -0.16 0.00 -1.10 0.00 0.00 59.98 58.73 2dkj h ARG 394 Cb 0.71 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 2dkj h ARG 394 CO 0.05 0.83 -0.69 0.93 2.80 0.00 0.00 179.97 183.89 2dkj h GLU 395 N 1.29 0.17 -0.54 0.20 4.39 -1.04 -0.28 114.58 118.77 2dkj h GLU 395 Ca 0.38 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.83 2dkj h GLU 395 Cb -0.07 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2dkj h GLU 395 CO -0.10 0.79 -0.10 1.49 -1.16 0.00 0.00 179.01 179.92 2dkj h GLU 396 N 0.11 1.02 -0.51 2.33 4.81 -0.69 -0.29 114.58 121.36 2dkj h GLU 396 Ca -0.02 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 58.77 2dkj h GLU 396 Cb 1.23 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 2dkj h GLU 396 CO 0.10 1.07 0.07 0.28 -0.73 0.00 0.00 179.01 179.80 2dkj h VAL 397 N 0.90 1.25 -0.40 0.32 2.07 -1.07 -1.21 116.25 118.11 2dkj h VAL 397 Ca 0.14 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.70 2dkj h VAL 397 Cb 0.67 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 2dkj h VAL 397 CO 0.05 0.34 0.26 -0.09 0.02 0.00 0.00 177.57 178.15 2dkj h ARG 398 N 0.73 0.51 -0.66 1.57 2.43 -0.73 0.16 114.38 118.39 2dkj h ARG 398 Ca 0.15 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 2dkj h ARG 398 Cb 0.42 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 2dkj h ARG 398 CO 0.01 0.34 0.29 0.00 -1.51 0.00 0.00 179.97 179.11 2dkj h ARG 399 N 0.53 0.97 -0.52 0.20 3.08 -0.89 -0.88 114.38 116.87 2dkj h ARG 399 Ca 0.15 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2dkj h ARG 399 Cb -0.04 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2dkj h ARG 399 CO -0.04 0.79 0.17 1.25 -1.07 0.00 0.00 179.97 181.06 2dkj h LEU 400 N 0.92 0.75 -0.21 3.04 5.85 -0.81 -1.58 115.31 123.27 2dkj h LEU 400 Ca 0.22 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2dkj h LEU 400 Cb 0.16 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 2dkj h LEU 400 CO -0.02 0.75 0.12 0.00 -0.34 0.00 0.00 178.44 178.94 2dkj h ALA 401 N 1.03 0.27 0.00 1.25 0.00 -0.73 -2.51 119.26 118.56 2dkj h ALA 401 Ca 0.17 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2dkj h ALA 401 Cb 0.26 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2dkj h ALA 401 CO -0.01 -0.20 -0.07 -0.07 0.00 0.00 0.00 179.25 178.91 2dkj h LEU 402 N 0.24 0.00 0.00 0.00 3.38 -0.97 -0.74 115.31 117.22 2dkj h LEU 402 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2dkj h LEU 402 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2dkj h LEU 402 CO -0.01 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.58 2dkj n ALA 403 N -2.43 2.21 -3.75 1.53 0.00 -0.61 -3.93 120.51 113.53 2dkj n ALA 403 Ca -0.03 -0.11 -0.28 0.00 0.00 0.00 0.00 53.44 53.02 2dkj n ALA 403 Cb 0.15 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.10 2dkj n ALA 403 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2dkj n HIS 404 N -1.29 2.35 -1.62 0.00 8.25 -0.28 -5.09 115.22 117.54 2dkj n HIS 404 Ca 0.11 -4.08 -0.41 0.00 -0.26 0.00 0.00 57.72 53.07 2dkj n HIS 404 Cb 0.19 -0.43 0.01 0.00 1.12 0.00 0.00 29.99 30.88 2dkj n HIS 404 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2dkj n PRO 405 N 2.05 1.40 -1.51 -0.41 -0.04 -1.25 -4.84 135.00 130.39 2dkj n PRO 405 Ca 0.23 0.50 -0.30 0.00 -0.04 0.00 0.00 63.50 63.89 2dkj n PRO 405 Cb 0.38 -2.07 0.09 0.00 -0.04 0.00 0.00 33.50 31.86 2dkj n PRO 405 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2dkj s MET 406 N -2.03 2.20 0.00 0.54 -1.94 -1.26 -4.61 119.30 112.20 2dkj s MET 406 Ca 0.63 0.74 0.00 0.00 -1.71 0.00 0.00 55.69 55.35 2dkj s MET 406 Cb -0.56 -1.92 0.00 0.00 2.01 0.00 0.00 34.83 34.36 2dkj s MET 406 CO 0.57 -1.57 0.31 -2.30 -0.01 0.00 0.00 175.02 172.02