#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajd s PRO 2 N 0.00 4.20 0.05 -0.78 0.02 -1.26 -4.97 135.00 132.26 1ajd s PRO 2 Ca 0.00 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.34 1ajd s PRO 2 Cb 0.00 -3.60 -0.03 0.00 0.02 0.00 0.00 34.50 30.89 1ajd s PRO 2 CO 0.00 -0.72 -0.07 -1.21 -0.33 0.00 0.00 177.00 174.66 1ajd s GLU 3 N 2.65 0.56 -0.34 5.54 0.41 -1.26 -5.13 118.70 121.12 1ajd s GLU 3 Ca 0.73 -0.82 -0.11 0.00 -0.41 0.00 0.00 54.97 54.35 1ajd s GLU 3 Cb -0.39 -0.26 -0.00 0.00 -1.78 0.00 0.00 34.13 31.70 1ajd s GLU 3 CO 0.32 0.04 0.20 -1.64 -0.49 0.00 0.00 175.26 173.68 1ajd s MET 4 N -1.86 3.26 0.67 1.61 -1.94 -1.26 -4.94 119.30 114.84 1ajd s MET 4 Ca -0.08 -0.78 -0.17 0.00 -1.71 0.00 0.00 55.69 52.95 1ajd s MET 4 Cb -0.08 -3.70 -0.00 0.00 2.01 0.00 0.00 34.83 33.06 1ajd s MET 4 CO -0.00 -0.50 1.18 -0.35 -0.01 0.00 0.00 175.02 175.34 1ajd n PRO 5 N 5.03 0.88 -4.32 2.03 -0.04 -1.26 -5.01 135.00 132.32 1ajd n PRO 5 Ca -0.13 0.36 -0.23 0.00 -0.04 0.00 0.00 63.50 63.45 1ajd n PRO 5 Cb 0.49 -2.41 -0.12 0.00 -0.04 0.00 0.00 33.50 31.41 1ajd n PRO 5 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ajd s VAL 6 N -1.55 1.81 -0.64 0.52 -7.23 -1.26 -4.82 120.40 107.23 1ajd s VAL 6 Ca 0.79 -1.73 -0.26 0.00 -1.81 0.00 0.00 61.98 58.98 1ajd s VAL 6 Cb -0.37 -1.72 -0.06 0.00 0.56 0.00 0.00 36.38 34.79 1ajd s VAL 6 CO 0.44 -0.16 2.14 -0.76 -0.31 0.00 0.00 175.10 176.45 1ajd s LEU 7 N -2.26 3.25 0.31 1.32 1.02 0.08 -4.76 118.68 117.65 1ajd s LEU 7 Ca 0.11 0.41 0.26 0.00 0.02 0.00 0.00 54.13 54.93 1ajd s LEU 7 Cb -0.08 -2.53 1.01 0.00 0.02 0.00 0.00 46.19 44.61 1ajd s LEU 7 CO 0.06 -2.82 1.77 -0.33 0.02 0.00 0.00 176.35 175.04 1ajd h GLU 8 N 15.77 0.00 -0.02 1.70 4.39 -1.97 -3.43 114.58 131.02 1ajd h GLU 8 Ca -0.17 0.00 0.29 0.00 0.34 0.00 0.00 59.36 59.83 1ajd h GLU 8 Cb 1.15 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.61 1ajd h GLU 8 CO 1.17 0.00 0.24 1.21 -1.16 0.00 0.00 179.01 180.47 1ajd s ASN 9 N -4.62 -0.03 -0.27 1.42 3.84 -1.26 -5.02 114.94 109.00 1ajd s ASN 9 Ca 0.05 0.01 0.12 0.00 0.21 0.00 0.00 52.86 53.25 1ajd s ASN 9 Cb 0.09 1.02 0.47 0.00 -0.55 0.00 0.00 41.25 42.29 1ajd s ASN 9 CO 0.46 -0.00 1.17 0.54 -2.79 0.00 0.00 177.10 176.47 1ajd n ARG 10 N 5.32 2.88 -2.96 0.43 1.74 -1.26 -4.94 116.66 117.87 1ajd n ARG 10 Ca -0.02 -3.88 -0.31 0.00 -0.77 0.00 0.00 57.85 52.87 1ajd n ARG 10 Cb 0.56 -2.00 -0.04 0.00 -1.02 0.00 0.00 32.46 29.97 1ajd n ARG 10 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ajd s ALA 11 N -3.55 3.34 -0.17 7.54 0.00 -1.26 -4.75 121.76 122.90 1ajd s ALA 11 Ca 0.43 -0.12 -0.34 0.00 0.00 0.00 0.00 51.96 51.93 1ajd s ALA 11 Cb 0.38 -2.72 -0.11 0.00 0.00 0.00 0.00 23.12 20.67 1ajd s ALA 11 CO 0.01 0.11 1.98 0.00 0.00 0.00 0.00 175.76 177.85 1ajd n ALA 12 N -0.97 0.94 -0.32 0.00 0.00 0.82 -4.53 120.51 116.44 1ajd n ALA 12 Ca 0.03 0.16 0.30 0.00 0.00 0.00 0.00 53.44 53.93 1ajd n ALA 12 Cb 0.54 -2.54 0.65 0.00 0.00 0.00 0.00 19.45 18.10 1ajd n ALA 12 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1ajd h GLN 13 N 10.39 0.15 0.00 0.00 1.08 -0.74 -3.46 115.11 122.53 1ajd h GLN 13 Ca -0.43 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 1ajd h GLN 13 Cb 1.28 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.68 1ajd h GLN 13 CO 0.97 0.10 0.00 0.41 -0.95 0.00 0.00 178.83 179.35 1ajd n GLY 14 N -1.64 4.35 3.58 3.46 0.00 0.12 -5.02 105.19 110.03 1ajd n GLY 14 Ca 0.26 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1ajd n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ajd s ASP 15 N 1.43 6.55 0.58 1.61 2.15 -1.24 -4.76 116.67 122.98 1ajd s ASP 15 Ca 0.00 0.25 0.34 0.00 0.43 0.00 0.00 52.55 53.57 1ajd s ASP 15 Cb 0.00 -2.51 1.39 0.00 -0.30 0.00 0.00 42.92 41.50 1ajd s ASP 15 CO 0.00 -1.22 1.66 0.40 -0.17 0.00 0.00 175.17 175.85 1ajd h ILE 16 N 6.17 0.23 0.00 4.11 5.03 -1.95 0.60 117.51 131.69 1ajd h ILE 16 Ca -0.24 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.50 1ajd h ILE 16 Cb 1.07 0.30 0.00 0.00 -3.03 0.00 0.00 36.82 35.16 1ajd h ILE 16 CO 1.10 0.00 -1.00 0.35 -0.68 0.00 0.00 178.15 177.92 1ajd n THR 17 N -3.76 0.42 -2.76 -0.27 -2.24 -1.26 -4.59 114.28 99.82 1ajd n THR 17 Ca 0.23 -0.42 -0.32 0.00 -2.27 0.00 0.00 64.05 61.27 1ajd n THR 17 Cb 1.27 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 69.31 1ajd n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajd s ALA 18 N -3.30 3.20 0.11 6.98 0.00 0.21 -5.00 121.76 123.96 1ajd s ALA 18 Ca 0.01 0.07 -0.31 0.00 0.00 0.00 0.00 51.96 51.74 1ajd s ALA 18 Cb 0.12 -2.93 -0.09 0.00 0.00 0.00 0.00 23.12 20.22 1ajd s ALA 18 CO 0.79 0.01 1.64 -2.14 0.00 0.00 0.00 175.76 176.06 1ajd s PRO 19 N -3.63 4.20 0.00 0.00 0.02 -1.26 -1.87 135.00 132.46 1ajd s PRO 19 Ca 0.56 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.95 1ajd s PRO 19 Cb -0.10 -3.45 0.00 0.00 0.02 0.00 0.00 34.50 30.97 1ajd s PRO 19 CO 0.25 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 1ajd n GLY 20 N 3.93 1.75 0.18 0.52 0.00 -1.26 -4.91 105.19 105.41 1ajd n GLY 20 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 1ajd n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ajd h GLY 21 N 0.00 0.00 0.15 -0.02 0.00 -1.49 -2.83 103.07 98.88 1ajd h GLY 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ajd h GLY 21 CO 0.00 0.00 -1.25 0.00 0.00 0.00 0.00 176.54 175.29 1ajd n ALA 22 N -1.89 3.96 -1.66 3.60 0.00 -1.26 0.14 120.51 123.40 1ajd n ALA 22 Ca 0.02 -0.53 -0.48 0.00 0.00 0.00 0.00 53.44 52.44 1ajd n ALA 22 Cb 0.28 -0.82 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 1ajd n ALA 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ajd n ARG 23 N -1.78 1.91 0.07 0.00 1.74 -1.07 -4.47 116.66 113.05 1ajd n ARG 23 Ca 0.02 0.69 0.01 0.00 -0.77 0.00 0.00 57.85 57.80 1ajd n ARG 23 Cb 0.41 -2.45 -0.05 0.00 -1.02 0.00 0.00 32.46 29.35 1ajd n ARG 23 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ajd h ARG 24 N 6.49 0.00 -6.06 5.56 3.08 -1.88 0.16 114.38 121.73 1ajd h ARG 24 Ca -0.46 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 58.99 1ajd h ARG 24 Cb 1.28 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.28 1ajd h ARG 24 CO 0.89 0.35 -0.26 -0.51 -1.07 0.00 0.00 179.97 179.37 1ajd s LEU 25 N -5.98 4.37 0.00 3.04 1.43 -1.26 -4.56 118.68 115.72 1ajd s LEU 25 Ca -0.01 0.79 0.11 0.00 -1.03 0.00 0.00 54.13 53.99 1ajd s LEU 25 Cb 0.08 -2.87 0.12 0.00 0.03 0.00 0.00 46.19 43.55 1ajd s LEU 25 CO 0.79 0.21 0.91 0.35 0.23 0.00 0.00 176.35 178.84 1ajd n THR 26 N 1.08 0.12 -3.17 5.49 -2.24 -1.26 -4.97 114.28 109.34 1ajd n THR 26 Ca -0.09 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1ajd n THR 26 Cb 0.52 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 1ajd n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajd n GLY 27 N 0.62 -0.93 3.71 3.38 0.00 -1.26 -5.14 105.19 105.57 1ajd n GLY 27 Ca 0.07 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 1ajd n GLY 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ajd s ASP 28 N -4.00 7.05 0.00 1.61 2.15 -1.26 -4.96 116.67 117.26 1ajd s ASP 28 Ca 0.00 1.99 0.23 0.00 0.43 0.00 0.00 52.55 55.20 1ajd s ASP 28 Cb 0.00 -2.57 0.13 0.00 -0.30 0.00 0.00 42.92 40.17 1ajd s ASP 28 CO 0.00 -0.52 1.17 0.00 -0.17 0.00 0.00 175.17 175.65 1ajd n GLN 29 N 4.31 0.97 -0.22 4.34 1.13 -1.26 -4.58 117.38 122.07 1ajd n GLN 29 Ca 0.10 -0.77 -0.01 0.00 -1.94 0.00 0.00 57.00 54.38 1ajd n GLN 29 Cb 0.46 -1.48 0.06 0.00 0.11 0.00 0.00 30.24 29.39 1ajd n GLN 29 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1ajd h THR 30 N 1.87 0.32 -0.40 5.09 2.02 -1.99 -0.91 112.91 118.90 1ajd h THR 30 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1ajd h THR 30 Cb 0.67 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 1ajd h THR 30 CO 0.00 0.00 0.14 0.00 0.37 0.00 0.00 175.52 176.03 1ajd h ALA 31 N 1.58 0.52 -0.19 6.16 0.00 -2.00 -1.56 119.26 123.77 1ajd h ALA 31 Ca 0.31 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1ajd h ALA 31 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ajd h ALA 31 CO -0.68 0.14 -0.23 0.00 0.00 0.00 0.00 179.25 178.48 1ajd h ALA 32 N 0.99 1.25 -0.23 0.00 0.00 -1.70 -1.38 119.26 118.20 1ajd h ALA 32 Ca 0.13 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1ajd h ALA 32 Cb 0.22 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ajd h ALA 32 CO -0.01 0.49 -0.52 1.25 0.00 0.00 0.00 179.25 180.47 1ajd h LEU 33 N 0.31 0.73 -0.92 0.00 5.85 -0.97 -2.76 115.31 117.55 1ajd h LEU 33 Ca 0.05 -0.38 -0.05 0.00 0.84 0.00 0.00 57.88 58.34 1ajd h LEU 33 Cb 0.59 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1ajd h LEU 33 CO 0.04 1.12 0.24 0.03 -0.34 0.00 0.00 178.44 179.53 1ajd h ARG 34 N 0.52 1.03 0.00 1.25 3.08 -0.77 0.44 114.38 119.93 1ajd h ARG 34 Ca 0.02 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1ajd h ARG 34 Cb 1.08 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.96 1ajd h ARG 34 CO 0.10 0.86 0.00 -0.25 -1.07 0.00 0.00 179.97 179.62 1ajd n ASP 35 N -4.28 0.00 0.01 7.04 8.00 -0.57 -2.52 116.55 124.24 1ajd n ASP 35 Ca 0.06 -0.20 0.07 0.00 0.71 0.00 0.00 54.79 55.43 1ajd n ASP 35 Cb 0.20 -0.17 -0.12 0.00 -0.02 0.00 0.00 41.12 41.02 1ajd n ASP 35 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1ajd n SER 36 N -1.17 0.31 -4.60 -2.24 7.64 0.13 -4.53 113.62 109.16 1ajd n SER 36 Ca 0.10 0.12 -0.43 0.00 1.01 0.00 0.00 58.87 59.67 1ajd n SER 36 Cb 0.10 1.29 -0.03 0.00 -1.01 0.00 0.00 64.21 64.56 1ajd n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ajd s LEU 37 N -4.99 3.82 -0.16 -3.43 1.43 -1.05 -4.74 118.68 109.56 1ajd s LEU 37 Ca -0.06 0.45 -0.04 0.00 -1.03 0.00 0.00 54.13 53.45 1ajd s LEU 37 Cb 0.11 -3.41 0.08 0.00 0.03 0.00 0.00 46.19 43.00 1ajd s LEU 37 CO 0.86 -1.10 0.24 -0.55 0.23 0.00 0.00 176.35 176.03 1ajd s SER 38 N 2.24 0.84 -0.14 2.29 0.15 -1.26 -5.02 113.70 112.79 1ajd s SER 38 Ca 0.43 0.18 0.13 0.00 0.70 0.00 0.00 55.95 57.40 1ajd s SER 38 Cb -0.09 0.53 0.63 0.00 -1.71 0.00 0.00 66.02 65.38 1ajd s SER 38 CO 0.27 -0.28 1.49 -0.90 1.20 0.00 0.00 173.24 175.01 1ajd n ASP 39 N 5.33 4.38 -4.70 5.45 5.68 -1.26 -0.39 116.55 131.04 1ajd n ASP 39 Ca -0.05 -2.55 -0.33 0.00 -0.50 0.00 0.00 54.79 51.35 1ajd n ASP 39 Cb 0.50 -0.58 0.12 0.00 -1.14 0.00 0.00 41.12 40.01 1ajd n ASP 39 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1ajd s LYS 40 N -2.09 1.74 0.44 0.11 -2.85 -1.26 -4.81 119.74 111.01 1ajd s LYS 40 Ca 0.43 1.75 -0.25 0.00 -1.00 0.00 0.00 55.97 56.90 1ajd s LYS 40 Cb 0.30 -1.79 -0.08 0.00 -2.06 0.00 0.00 37.83 34.20 1ajd s LYS 40 CO 0.17 -2.14 1.28 -2.14 0.10 0.00 0.00 175.35 172.62 1ajd s PRO 41 N -4.11 3.79 -0.16 1.78 0.02 -1.26 -4.48 135.00 130.58 1ajd s PRO 41 Ca 0.73 2.09 -0.18 0.00 0.02 0.00 0.00 61.00 63.65 1ajd s PRO 41 Cb -0.28 -2.60 -0.04 0.00 0.02 0.00 0.00 34.50 31.59 1ajd s PRO 41 CO 0.50 -0.61 0.50 0.00 -0.33 0.00 0.00 177.00 177.05 1ajd s ALA 42 N -1.33 3.51 -0.09 -1.55 0.00 -0.94 -4.92 121.76 116.44 1ajd s ALA 42 Ca 0.61 -0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.15 1ajd s ALA 42 Cb -0.36 -2.73 -0.09 0.00 0.00 0.00 0.00 23.12 19.93 1ajd s ALA 42 CO 0.46 -0.23 0.39 -0.22 0.00 0.00 0.00 175.76 176.16 1ajd h LYS 43 N 7.10 -0.11 -6.13 0.00 3.64 -1.55 -3.38 116.57 116.14 1ajd h LYS 43 Ca -0.37 0.01 -0.52 0.00 -1.27 0.00 0.00 60.65 58.50 1ajd h LYS 43 Cb 1.17 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 1ajd h LYS 43 CO 0.75 0.19 -0.47 -0.80 -2.27 0.00 0.00 179.45 176.85 1ajd s ASN 44 N -5.58 4.96 -0.12 4.20 0.01 -0.99 -3.81 114.94 113.60 1ajd s ASN 44 Ca -0.07 -0.68 -0.14 0.00 -0.71 0.00 0.00 52.86 51.25 1ajd s ASN 44 Cb -0.00 -0.78 0.04 0.00 0.41 0.00 0.00 41.25 40.92 1ajd s ASN 44 CO 0.25 -0.40 0.39 -0.63 -1.51 0.00 0.00 177.10 175.20 1ajd s ILE 45 N -2.40 0.01 -0.09 0.60 1.01 -0.46 -2.11 121.20 117.77 1ajd s ILE 45 Ca 0.41 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.98 1ajd s ILE 45 Cb -0.03 -0.57 0.03 0.00 0.01 0.00 0.00 42.46 41.89 1ajd s ILE 45 CO 0.25 -0.04 -0.04 -0.63 0.00 0.00 0.00 174.94 174.48 1ajd s ILE 46 N -0.07 0.70 -0.22 2.92 1.01 0.14 -1.84 121.20 123.84 1ajd s ILE 46 Ca -0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 60.65 60.48 1ajd s ILE 46 Cb -0.03 -0.78 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 1ajd s ILE 46 CO 0.01 0.31 -0.01 -0.22 0.00 0.00 0.00 174.94 175.04 1ajd s LEU 47 N 1.78 3.11 -0.38 2.97 2.96 0.09 -0.70 118.68 128.49 1ajd s LEU 47 Ca 0.04 -0.30 -0.10 0.00 -0.22 0.00 0.00 54.13 53.54 1ajd s LEU 47 Cb -0.13 -1.80 0.04 0.00 0.50 0.00 0.00 46.19 44.80 1ajd s LEU 47 CO -0.06 -0.00 0.21 -0.76 -1.32 0.00 0.00 176.35 174.41 1ajd s LEU 48 N 1.39 4.77 -0.36 -0.68 2.01 0.15 -0.58 118.68 125.38 1ajd s LEU 48 Ca 0.05 -1.11 -0.12 0.00 0.01 0.00 0.00 54.13 52.95 1ajd s LEU 48 Cb -0.15 -2.00 0.01 0.00 0.01 0.00 0.00 46.19 44.06 1ajd s LEU 48 CO -0.00 -0.41 0.22 -0.63 1.01 0.00 0.00 176.35 176.54 1ajd s ILE 49 N 1.51 4.87 -0.44 -0.59 -1.09 0.79 -1.23 121.20 125.02 1ajd s ILE 49 Ca 0.02 -0.61 -0.23 0.00 -2.23 0.00 0.00 60.65 57.60 1ajd s ILE 49 Cb -0.20 -3.63 0.02 0.00 -1.58 0.00 0.00 42.46 37.08 1ajd s ILE 49 CO 0.05 -0.15 0.76 -0.83 -1.23 0.00 0.00 174.94 173.54 1ajd s GLY 50 N 1.63 1.62 -0.19 6.18 0.00 0.59 -1.03 107.32 116.12 1ajd s GLY 50 Ca 0.04 -1.01 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 1ajd s GLY 50 CO 0.08 1.74 1.51 -0.35 0.00 0.00 0.00 173.10 176.08 1ajd s ASP 51 N 2.09 6.59 0.00 1.64 -1.08 -0.84 -2.75 116.67 122.32 1ajd s ASP 51 Ca 0.29 1.69 0.00 0.00 -0.52 0.00 0.00 52.55 54.01 1ajd s ASP 51 Cb -0.12 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.80 1ajd s ASP 51 CO 0.22 -1.07 0.00 0.61 0.52 0.00 0.00 175.17 175.45 1ajd n GLY 52 N 4.30 1.39 3.47 2.66 0.00 -1.25 -1.01 105.19 114.75 1ajd n GLY 52 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1ajd n GLY 52 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ajd n MET 53 N -2.00 2.23 -0.22 1.61 0.00 -1.11 -4.10 117.12 113.53 1ajd n MET 53 Ca 0.00 -2.69 -0.01 0.00 0.00 0.00 0.00 57.70 54.99 1ajd n MET 53 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 33.22 29.70 1ajd n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ajd n GLY 54 N 5.39 -0.76 0.24 -5.12 0.00 -1.26 -4.40 105.19 99.29 1ajd n GLY 54 Ca 0.47 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.74 1ajd n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ajd h ASP 55 N -0.07 0.42 -0.43 1.61 3.32 -1.92 -0.94 116.42 118.41 1ajd h ASP 55 Ca -0.02 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1ajd h ASP 55 Cb 0.06 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1ajd h ASP 55 CO 0.02 0.64 0.05 -1.28 -1.72 0.00 0.00 179.24 176.94 1ajd h SER 56 N 0.38 0.70 -0.03 6.45 0.87 -1.93 -1.84 113.55 118.14 1ajd h SER 56 Ca 0.06 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1ajd h SER 56 Cb 0.58 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1ajd h SER 56 CO 0.04 0.80 0.02 -0.33 -0.53 0.00 0.00 176.83 176.83 1ajd h GLU 57 N 0.58 0.04 -0.60 2.24 3.07 -1.77 -1.51 114.58 116.62 1ajd h GLU 57 Ca 0.13 -0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.01 1ajd h GLU 57 Cb 0.41 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.27 1ajd h GLU 57 CO 0.01 0.03 0.38 0.82 -1.40 0.00 0.00 179.01 178.85 1ajd h ILE 58 N 0.04 1.09 -0.47 3.13 2.04 -1.08 -2.32 117.51 119.93 1ajd h ILE 58 Ca 0.01 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.57 1ajd h ILE 58 Cb -0.00 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 1ajd h ILE 58 CO -0.00 0.14 0.12 0.74 0.00 0.00 0.00 178.15 179.14 1ajd h THR 59 N 0.75 1.24 -0.89 -0.27 2.02 -1.23 -2.25 112.91 112.28 1ajd h THR 59 Ca 0.24 -0.82 0.02 0.00 0.77 0.00 0.00 66.41 66.61 1ajd h THR 59 Cb -0.01 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 67.22 1ajd h THR 59 CO -0.09 0.29 0.59 0.00 0.37 0.00 0.00 175.52 176.68 1ajd h ALA 60 N 0.98 1.14 -0.06 6.16 0.00 -0.92 -0.96 119.26 125.60 1ajd h ALA 60 Ca 0.15 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 1ajd h ALA 60 Cb 0.32 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ajd h ALA 60 CO 0.00 0.50 -0.83 0.00 0.00 0.00 0.00 179.25 178.93 1ajd h ALA 61 N 1.34 0.44 -0.32 0.00 0.00 -1.34 -2.72 119.26 116.65 1ajd h ALA 61 Ca 0.33 -0.64 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 1ajd h ALA 61 Cb -0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ajd h ALA 61 CO -0.08 0.76 -0.03 -0.09 0.00 0.00 0.00 179.25 179.80 1ajd h ARG 62 N 0.32 0.58 -0.70 0.00 2.43 -1.04 0.40 114.38 116.38 1ajd h ARG 62 Ca -0.06 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 58.98 1ajd h ARG 62 Cb 1.44 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.88 1ajd h ARG 62 CO 0.15 0.74 0.38 -0.91 -1.51 0.00 0.00 179.97 178.82 1ajd h ASN 63 N 0.37 0.54 0.13 -3.80 2.35 -1.22 0.68 115.58 114.63 1ajd h ASN 63 Ca 0.09 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1ajd h ASN 63 Cb 0.50 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1ajd h ASN 63 CO 0.02 0.34 -0.06 0.22 -1.65 0.00 0.00 177.43 176.30 1ajd h TYR 64 N 0.68 -0.16 -0.00 1.19 3.20 -1.36 -2.38 116.97 118.14 1ajd h TYR 64 Ca 0.32 -0.00 -0.26 0.00 3.14 0.00 0.00 58.73 61.93 1ajd h TYR 64 Cb 0.25 0.05 0.02 0.00 1.54 0.00 0.00 36.73 38.59 1ajd h TYR 64 CO -0.08 0.17 -1.03 0.00 -1.64 0.00 0.00 178.16 175.57 1ajd h ALA 65 N -0.66 0.16 0.00 1.82 0.00 -0.94 0.13 119.26 119.77 1ajd h ALA 65 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1ajd h ALA 65 Cb 0.40 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ajd h ALA 65 CO 0.03 0.70 -0.93 0.39 0.00 0.00 0.00 179.25 179.44 1ajd n GLU 66 N -3.84 2.04 0.00 0.00 -0.58 0.74 -4.83 120.64 114.17 1ajd n GLU 66 Ca -0.10 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1ajd n GLU 66 Cb 0.88 -1.16 0.00 0.00 -0.57 0.00 0.00 31.44 30.59 1ajd n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ajd n GLY 67 N 1.47 -2.11 0.37 0.62 0.00 0.20 -3.43 105.19 102.31 1ajd n GLY 67 Ca 0.01 -1.40 0.19 0.00 0.00 0.00 0.00 46.02 44.82 1ajd n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajd h ALA 68 N 0.00 1.98 -0.00 4.61 0.00 -1.75 0.23 119.26 124.33 1ajd h ALA 68 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ajd h ALA 68 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ajd h ALA 68 CO 0.00 -0.42 -0.09 0.41 0.00 0.00 0.00 179.25 179.16 1ajd n GLY 69 N -1.39 -0.88 0.00 0.00 0.00 -1.26 -4.89 105.19 96.77 1ajd n GLY 69 Ca 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1ajd n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajd n GLY 70 N 1.24 -2.02 3.59 -0.02 0.00 0.79 -0.13 105.19 108.64 1ajd n GLY 70 Ca 0.16 -1.48 -0.02 0.00 0.00 0.00 0.00 46.02 44.67 1ajd n GLY 70 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ajd s PHE 71 N -0.63 -0.75 -0.06 1.61 5.36 -1.26 -4.50 117.98 117.76 1ajd s PHE 71 Ca 0.00 1.42 -0.30 0.00 -0.96 0.00 0.00 56.93 57.09 1ajd s PHE 71 Cb 0.00 0.45 -0.03 0.00 -0.34 0.00 0.00 43.02 43.10 1ajd s PHE 71 CO 0.00 -0.37 1.10 -0.06 -1.46 0.00 0.00 175.22 174.43 1ajd s PHE 72 N 1.77 3.39 0.40 10.12 0.08 -1.26 -4.93 117.98 127.55 1ajd s PHE 72 Ca -0.08 1.42 0.27 0.00 0.12 0.00 0.00 56.93 58.66 1ajd s PHE 72 Cb -0.05 -3.30 1.40 0.00 -0.57 0.00 0.00 43.02 40.50 1ajd s PHE 72 CO -0.17 -0.75 2.05 0.87 -0.10 0.00 0.00 175.22 177.12 1ajd h LYS 73 N 7.18 0.00 0.00 0.44 6.56 -1.95 -2.92 116.57 125.87 1ajd h LYS 73 Ca -0.35 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.24 1ajd h LYS 73 Cb 1.17 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 1ajd h LYS 73 CO 0.85 0.13 0.00 0.41 -2.06 0.00 0.00 179.45 178.78 1ajd n GLY 74 N -0.65 0.37 0.63 3.86 0.00 -1.26 -4.01 105.19 104.13 1ajd n GLY 74 Ca -0.02 0.00 0.48 0.00 0.00 0.00 0.00 46.02 46.49 1ajd n GLY 74 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ajd h ILE 75 N 0.00 0.04 0.00 -0.61 2.04 -1.78 0.11 117.51 117.31 1ajd h ILE 75 Ca 0.00 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1ajd h ILE 75 Cb 0.00 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.11 1ajd h ILE 75 CO 0.00 0.00 -1.58 0.47 0.00 0.00 0.00 178.15 177.04 1ajd n ASP 76 N -4.18 0.46 0.00 1.72 8.00 -1.11 -4.43 116.55 117.01 1ajd n ASP 76 Ca 0.42 -0.39 0.10 0.00 0.71 0.00 0.00 54.79 55.63 1ajd n ASP 76 Cb 1.83 1.59 0.60 0.00 -0.02 0.00 0.00 41.12 45.12 1ajd n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ajd n ALA 77 N -1.94 2.34 -2.59 2.24 0.00 0.37 -4.78 120.51 116.14 1ajd n ALA 77 Ca -0.01 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 1ajd n ALA 77 Cb 0.46 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 1ajd n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ajd s LEU 78 N -1.88 4.09 0.14 0.00 1.02 -1.26 -0.74 118.68 120.05 1ajd s LEU 78 Ca 0.30 0.39 -0.25 0.00 0.02 0.00 0.00 54.13 54.59 1ajd s LEU 78 Cb 0.14 -3.10 -0.01 0.00 0.02 0.00 0.00 46.19 43.24 1ajd s LEU 78 CO 0.23 -0.79 1.61 1.55 0.02 0.00 0.00 176.35 178.97 1ajd h PRO 79 N 8.53 -0.36 -6.17 1.29 0.13 -1.87 -3.43 132.00 130.12 1ajd h PRO 79 Ca -0.24 0.02 -0.55 0.00 -0.87 0.00 0.00 66.00 64.36 1ajd h PRO 79 Cb 1.09 0.08 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 1ajd h PRO 79 CO 0.94 -0.24 0.20 -0.51 -0.23 0.00 0.00 178.00 178.16 1ajd s LEU 80 N -10.45 4.33 0.04 1.56 2.01 -1.00 -4.97 118.68 110.21 1ajd s LEU 80 Ca -0.15 1.36 -0.06 0.00 0.01 0.00 0.00 54.13 55.29 1ajd s LEU 80 Cb 0.11 -3.26 -0.01 0.00 0.01 0.00 0.00 46.19 43.03 1ajd s LEU 80 CO 0.66 -0.17 0.11 0.42 1.01 0.00 0.00 176.35 178.38 1ajd s THR 81 N 0.91 0.13 0.00 5.49 -4.23 -1.26 -0.67 115.64 116.00 1ajd s THR 81 Ca 0.43 -1.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 1ajd s THR 81 Cb -0.19 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 72.74 1ajd s THR 81 CO 0.22 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 1ajd n GLY 82 N 0.74 1.81 2.87 3.99 0.00 -0.64 -3.44 105.19 110.53 1ajd n GLY 82 Ca -0.19 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.79 1ajd n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ajd s GLN 83 N -0.63 0.84 -0.04 1.61 1.11 0.41 -2.42 119.66 120.54 1ajd s GLN 83 Ca 0.00 -0.08 0.06 0.00 0.01 0.00 0.00 55.36 55.35 1ajd s GLN 83 Cb 0.00 -0.91 -0.02 0.00 -1.01 0.00 0.00 33.01 31.07 1ajd s GLN 83 CO 0.00 -0.13 -0.21 1.52 0.01 0.00 0.00 175.29 176.49 1ajd s TYR 84 N 1.13 2.51 0.38 0.91 1.13 -0.91 -1.41 117.35 121.08 1ajd s TYR 84 Ca -0.08 -0.35 -0.24 0.00 -1.41 0.00 0.00 57.07 54.99 1ajd s TYR 84 Cb -0.14 -1.57 -0.10 0.00 -1.10 0.00 0.00 41.96 39.05 1ajd s TYR 84 CO -0.01 0.04 0.98 0.95 -2.51 0.00 0.00 175.55 175.00 1ajd s THR 85 N -0.60 4.09 -0.12 -3.49 -4.23 -0.02 -3.60 115.64 107.67 1ajd s THR 85 Ca 0.09 1.58 0.22 0.00 -1.18 0.00 0.00 61.69 62.39 1ajd s THR 85 Cb -0.11 -3.80 0.45 0.00 1.34 0.00 0.00 72.50 70.39 1ajd s THR 85 CO 0.00 -0.02 1.16 0.00 -0.54 0.00 0.00 174.62 175.23 1ajd n HIS 86 N 0.05 0.53 -0.99 3.99 1.44 -1.26 -0.10 115.22 118.88 1ajd n HIS 86 Ca 0.04 -1.19 -0.30 0.00 -2.01 0.00 0.00 57.72 54.25 1ajd n HIS 86 Cb 0.51 -0.20 0.14 0.00 0.12 0.00 0.00 29.99 30.56 1ajd n HIS 86 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1ajd s TYR 87 N -1.71 2.08 0.00 -1.40 1.13 -1.26 -4.46 117.35 111.73 1ajd s TYR 87 Ca 0.34 1.54 0.00 0.00 -1.41 0.00 0.00 57.07 57.54 1ajd s TYR 87 Cb 0.37 -3.18 0.00 0.00 -1.10 0.00 0.00 41.96 38.05 1ajd s TYR 87 CO -0.11 -2.47 0.00 0.00 -2.51 0.00 0.00 175.55 170.47 1ajd n ALA 88 N -3.98 0.00 -2.45 9.51 0.00 0.37 -4.92 120.51 119.04 1ajd n ALA 88 Ca 0.09 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.35 1ajd n ALA 88 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1ajd n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ajd s LEU 89 N 0.00 2.44 -0.18 0.00 1.43 -0.74 0.45 118.68 122.07 1ajd s LEU 89 Ca 0.00 -0.86 -0.22 0.00 -1.03 0.00 0.00 54.13 52.02 1ajd s LEU 89 Cb 0.00 -0.55 -0.02 0.00 0.03 0.00 0.00 46.19 45.64 1ajd s LEU 89 CO 0.00 -0.16 0.70 0.21 0.23 0.00 0.00 176.35 177.33 1ajd s ASN 90 N -2.63 6.79 0.21 2.29 3.84 0.37 -4.04 114.94 121.76 1ajd s ASN 90 Ca 0.11 0.96 -0.10 0.00 0.21 0.00 0.00 52.86 54.05 1ajd s ASN 90 Cb -0.04 -2.39 0.25 0.00 -0.55 0.00 0.00 41.25 38.53 1ajd s ASN 90 CO 0.03 -0.31 1.78 0.50 -2.79 0.00 0.00 177.10 176.31 1ajd h LYS 91 N 7.40 0.52 0.23 0.43 3.64 -1.92 0.53 116.57 127.42 1ajd h LYS 91 Ca -0.31 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 1ajd h LYS 91 Cb 1.14 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1ajd h LYS 91 CO 0.80 0.35 -0.11 0.87 -2.27 0.00 0.00 179.45 179.08 1ajd h LYS 92 N 0.54 -0.30 0.00 1.90 1.79 -1.93 -3.36 116.57 115.20 1ajd h LYS 92 Ca 0.30 0.02 -0.13 0.00 -2.18 0.00 0.00 60.65 58.65 1ajd h LYS 92 Cb 0.27 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.97 1ajd h LYS 92 CO -0.23 -0.20 -0.64 1.79 -1.08 0.00 0.00 179.45 179.09 1ajd h THR 93 N -0.42 1.18 0.00 -0.16 1.35 -1.99 -3.47 112.91 109.40 1ajd h THR 93 Ca -0.03 -2.45 0.00 0.00 -0.55 0.00 0.00 66.41 63.38 1ajd h THR 93 Cb 0.24 2.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.09 1ajd h THR 93 CO 0.05 0.63 0.00 0.61 -0.25 0.00 0.00 175.52 176.56 1ajd n GLY 94 N 0.99 0.54 3.90 5.82 0.00 0.19 -4.99 105.19 111.62 1ajd n GLY 94 Ca 0.01 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 1ajd n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajd s LYS 95 N -0.26 3.66 0.42 1.61 1.02 -1.25 -4.64 119.74 120.31 1ajd s LYS 95 Ca 0.00 0.16 -0.26 0.00 0.02 0.00 0.00 55.97 55.89 1ajd s LYS 95 Cb 0.00 -2.53 -0.09 0.00 -0.52 0.00 0.00 37.83 34.68 1ajd s LYS 95 CO 0.00 0.09 1.40 -2.30 -0.92 0.00 0.00 175.35 173.62 1ajd n PRO 96 N -1.23 2.27 -3.94 -1.68 -0.02 -1.26 0.14 135.00 129.28 1ajd n PRO 96 Ca -0.00 0.80 -0.32 0.00 -2.02 0.00 0.00 63.50 61.96 1ajd n PRO 96 Cb 0.54 -2.57 -0.14 0.00 -0.02 0.00 0.00 33.50 31.31 1ajd n PRO 96 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1ajd s ASP 97 N -0.40 4.76 0.45 2.55 -1.08 0.17 -4.64 116.67 118.49 1ajd s ASP 97 Ca 0.59 -2.42 0.31 0.00 -0.52 0.00 0.00 52.55 50.52 1ajd s ASP 97 Cb -0.47 -1.68 1.42 0.00 -1.46 0.00 0.00 42.92 40.73 1ajd s ASP 97 CO 0.59 -0.37 1.66 1.88 0.52 0.00 0.00 175.17 179.45 1ajd h TYR 98 N 7.34 0.44 -3.45 -5.34 0.05 -1.94 0.11 116.97 114.18 1ajd h TYR 98 Ca -0.06 0.02 -0.67 0.00 0.05 0.00 0.00 58.73 58.07 1ajd h TYR 98 Cb 0.99 -0.11 -0.33 0.00 1.01 0.00 0.00 36.73 38.28 1ajd h TYR 98 CO 0.51 -0.13 -0.77 0.08 -1.05 0.00 0.00 178.16 176.80 1ajd s VAL 99 N -5.25 2.66 0.76 -2.88 1.01 -1.26 -4.43 120.40 111.00 1ajd s VAL 99 Ca -0.07 -1.04 -0.07 0.00 0.00 0.00 0.00 61.98 60.80 1ajd s VAL 99 Cb 0.28 -2.32 0.11 0.00 0.00 0.00 0.00 36.38 34.45 1ajd s VAL 99 CO 0.82 0.26 1.07 0.28 0.00 0.00 0.00 175.10 177.53 1ajd s THR 100 N 1.30 2.19 0.00 3.92 -1.32 -1.26 -4.81 115.64 115.66 1ajd s THR 100 Ca 0.00 -0.31 0.00 0.00 -1.21 0.00 0.00 61.69 60.17 1ajd s THR 100 Cb -0.16 -2.88 0.00 0.00 -1.51 0.00 0.00 72.50 67.95 1ajd s THR 100 CO -0.06 0.00 0.00 -0.90 -2.21 0.00 0.00 174.62 171.45 1ajd n ASP 101 N -3.07 0.53 0.05 8.08 5.75 -1.26 -4.88 116.55 121.75 1ajd n ASP 101 Ca 0.11 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.67 1ajd n ASP 101 Cb 0.60 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.55 1ajd n ASP 101 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1ajd h SER 102 N 0.00 0.53 -0.07 -1.12 0.02 -2.00 -3.37 113.55 107.54 1ajd h SER 102 Ca 0.00 -0.91 0.01 0.00 -0.84 0.00 0.00 61.79 60.04 1ajd h SER 102 Cb 0.00 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 1ajd h SER 102 CO 0.00 1.73 0.03 0.00 -1.14 0.00 0.00 176.83 177.45 1ajd h ALA 103 N 0.05 0.08 0.65 3.77 0.00 -1.87 -3.03 119.26 118.90 1ajd h ALA 103 Ca -0.33 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 1ajd h ALA 103 Cb 1.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1ajd h ALA 103 CO 0.13 -0.44 -0.35 0.00 0.00 0.00 0.00 179.25 178.59 1ajd h ALA 104 N 1.04 -0.93 -0.56 0.00 0.00 -1.77 -1.55 119.26 115.50 1ajd h ALA 104 Ca 0.03 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.84 1ajd h ALA 104 Cb 0.01 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 1ajd h ALA 104 CO -0.03 -1.03 0.14 0.77 0.00 0.00 0.00 179.25 179.09 1ajd h SER 105 N -0.92 0.05 -0.48 0.00 0.02 -1.72 -0.49 113.55 110.00 1ajd h SER 105 Ca -0.08 0.09 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 1ajd h SER 105 Cb 0.73 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.33 1ajd h SER 105 CO 0.12 0.04 0.15 0.00 -1.14 0.00 0.00 176.83 176.00 1ajd h ALA 106 N 1.43 0.58 -0.04 3.77 0.00 -1.47 -2.60 119.26 120.93 1ajd h ALA 106 Ca 0.28 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1ajd h ALA 106 Cb 0.39 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1ajd h ALA 106 CO -0.35 -0.25 -0.04 1.15 0.00 0.00 0.00 179.25 179.76 1ajd h THR 107 N 0.31 0.88 0.00 0.00 2.02 -0.08 -0.83 112.91 115.21 1ajd h THR 107 Ca 0.24 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 1ajd h THR 107 Cb 0.27 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1ajd h THR 107 CO -0.26 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 175.57 1ajd h ALA 108 N 0.98 1.33 0.00 6.16 0.00 -0.84 0.22 119.26 127.12 1ajd h ALA 108 Ca 0.03 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1ajd h ALA 108 Cb 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1ajd h ALA 108 CO -0.08 0.08 -1.87 -2.67 0.00 0.00 0.00 179.25 174.71 1ajd n TRP 109 N -3.65 0.36 0.25 0.00 2.14 -1.04 -1.54 117.44 113.97 1ajd n TRP 109 Ca -0.02 0.12 0.12 0.00 2.07 0.00 0.00 57.50 59.78 1ajd n TRP 109 Cb 0.17 -0.86 0.07 0.00 -0.81 0.00 0.00 31.31 29.88 1ajd n TRP 109 CO 0.00 0.00 0.00 0.66 2.07 0.00 0.00 177.69 180.42 1ajd h SER 110 N 0.00 0.00 0.00 -0.67 4.64 -0.83 -3.28 113.55 113.41 1ajd h SER 110 Ca -0.22 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1ajd h SER 110 Cb 1.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 1ajd h SER 110 CO 0.02 0.03 -0.87 0.41 -0.87 0.00 0.00 176.83 175.56 1ajd n THR 111 N -2.56 0.00 -0.21 2.95 -1.04 0.76 0.49 114.28 114.67 1ajd n THR 111 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1ajd n THR 111 Cb 0.52 -0.64 0.00 0.00 -1.82 0.00 0.00 70.33 68.38 1ajd n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ajd n GLY 112 N 2.96 0.87 3.01 3.41 0.00 -0.59 -4.91 105.19 109.94 1ajd n GLY 112 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1ajd n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajd s VAL 113 N -2.04 0.96 0.43 1.61 0.11 -1.25 -4.95 120.40 115.28 1ajd s VAL 113 Ca 0.00 -0.41 -0.26 0.00 -2.93 0.00 0.00 61.98 58.39 1ajd s VAL 113 Cb 0.00 -0.88 -0.09 0.00 -1.53 0.00 0.00 36.38 33.89 1ajd s VAL 113 CO 0.00 0.31 1.42 -0.54 -3.33 0.00 0.00 175.10 172.96 1ajd s LYS 114 N 0.50 3.78 0.07 1.54 -0.14 -1.26 -3.53 119.74 120.71 1ajd s LYS 114 Ca -0.10 2.41 0.01 0.00 -1.36 0.00 0.00 55.97 56.94 1ajd s LYS 114 Cb -0.13 -2.71 -0.00 0.00 -1.68 0.00 0.00 37.83 33.30 1ajd s LYS 114 CO 0.02 -0.74 0.07 -2.37 -0.76 0.00 0.00 175.35 171.57 1ajd n THR 115 N -0.06 0.00 -3.90 2.17 5.66 -1.26 -4.42 114.28 112.46 1ajd n THR 115 Ca 0.04 -0.51 -0.29 0.00 -3.05 0.00 0.00 64.05 60.25 1ajd n THR 115 Cb 0.42 0.26 -0.04 0.00 -1.55 0.00 0.00 70.33 69.43 1ajd n THR 115 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1ajd s TYR 116 N -2.78 3.50 -0.04 1.09 1.13 -1.26 -1.80 117.35 117.20 1ajd s TYR 116 Ca 0.08 0.21 -0.33 0.00 -1.41 0.00 0.00 57.07 55.63 1ajd s TYR 116 Cb 0.00 -1.74 -0.11 0.00 -1.10 0.00 0.00 41.96 39.02 1ajd s TYR 116 CO 0.06 0.54 1.89 0.09 -2.51 0.00 0.00 175.55 175.62 1ajd n ASN 117 N -0.15 3.66 0.00 -0.18 3.02 -1.26 -1.69 115.26 118.66 1ajd n ASN 117 Ca -0.06 0.96 0.00 0.00 -0.03 0.00 0.00 54.58 55.45 1ajd n ASN 117 Cb 0.53 -1.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.27 1ajd n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ajd n GLY 118 N 4.40 1.97 3.76 7.41 0.00 -1.26 -4.98 105.19 116.48 1ajd n GLY 118 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1ajd n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajd s ALA 119 N -2.20 3.38 -0.26 4.61 0.00 -0.68 0.02 121.76 126.63 1ajd s ALA 119 Ca 0.00 0.39 0.01 0.00 0.00 0.00 0.00 51.96 52.36 1ajd s ALA 119 Cb 0.00 -3.04 0.07 0.00 0.00 0.00 0.00 23.12 20.15 1ajd s ALA 119 CO 0.00 0.16 -0.02 -0.51 0.00 0.00 0.00 175.76 175.39 1ajd s LEU 120 N -0.60 2.87 -0.13 0.00 1.43 -0.86 -3.73 118.68 117.67 1ajd s LEU 120 Ca 0.39 -1.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 1ajd s LEU 120 Cb -0.22 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.79 1ajd s LEU 120 CO 0.26 -0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.17 1ajd n GLY 121 N 4.63 0.50 3.12 -3.19 0.00 -1.24 -0.85 105.19 108.16 1ajd n GLY 121 Ca -0.08 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 1ajd n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ajd s VAL 122 N -1.99 0.18 0.00 1.61 -7.23 -1.26 -1.58 120.40 110.13 1ajd s VAL 122 Ca 0.00 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.31 1ajd s VAL 122 Cb 0.00 -1.76 0.00 0.00 0.56 0.00 0.00 36.38 35.18 1ajd s VAL 122 CO 0.00 -0.76 0.00 -0.90 -0.31 0.00 0.00 175.10 173.13 1ajd n ASP 123 N 0.02 0.00 0.11 4.85 5.68 -1.05 -4.72 116.55 121.43 1ajd n ASP 123 Ca -0.10 -0.21 0.12 0.00 -0.50 0.00 0.00 54.79 54.10 1ajd n ASP 123 Cb 0.62 0.00 0.46 0.00 -1.14 0.00 0.00 41.12 41.06 1ajd n ASP 123 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 1ajd n ILE 124 N -0.25 0.74 0.06 2.12 -5.35 -1.26 -2.05 119.36 113.36 1ajd n ILE 124 Ca 0.00 0.07 0.10 0.00 -0.27 0.00 0.00 62.75 62.66 1ajd n ILE 124 Cb 0.00 -0.95 0.28 0.00 -1.74 0.00 0.00 39.64 37.23 1ajd n ILE 124 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1ajd n HIS 125 N -2.15 0.79 -1.70 4.28 8.25 -1.26 -4.92 115.22 118.51 1ajd n HIS 125 Ca 0.03 -0.39 -0.15 0.00 -0.26 0.00 0.00 57.72 56.95 1ajd n HIS 125 Cb 0.29 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.35 1ajd n HIS 125 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ajd n GLU 126 N 1.34 -1.08 -3.00 -0.41 1.02 -0.87 -4.99 120.64 112.64 1ajd n GLU 126 Ca 0.21 0.93 -0.40 0.00 -0.02 0.00 0.00 57.16 57.87 1ajd n GLU 126 Cb 0.54 -5.12 -0.05 0.00 -0.02 0.00 0.00 31.44 26.79 1ajd n GLU 126 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1ajd s LYS 127 N -3.72 4.35 0.42 3.49 2.36 -1.26 -4.75 119.74 120.62 1ajd s LYS 127 Ca 0.00 0.88 -0.27 0.00 -2.55 0.00 0.00 55.97 54.04 1ajd s LYS 127 Cb 0.00 -3.51 -0.09 0.00 -1.05 0.00 0.00 37.83 33.17 1ajd s LYS 127 CO 0.00 -0.12 1.45 -0.51 1.55 0.00 0.00 175.35 177.72 1ajd s ASP 128 N 0.99 6.09 -0.05 1.43 1.01 -1.26 -2.52 116.67 122.37 1ajd s ASP 128 Ca 0.36 2.97 0.01 0.00 0.71 0.00 0.00 52.55 56.61 1ajd s ASP 128 Cb -0.17 -2.66 0.02 0.00 1.01 0.00 0.00 42.92 41.12 1ajd s ASP 128 CO 0.15 -1.03 -0.07 -1.00 0.21 0.00 0.00 175.17 173.43 1ajd s HIS 129 N -1.17 0.92 0.27 4.23 3.76 -0.61 -4.96 115.29 117.73 1ajd s HIS 129 Ca 0.57 -0.28 -0.30 0.00 -0.15 0.00 0.00 55.06 54.90 1ajd s HIS 129 Cb -0.45 -0.75 -0.13 0.00 1.11 0.00 0.00 32.58 32.36 1ajd s HIS 129 CO 0.59 -0.20 1.40 -0.35 -0.85 0.00 0.00 174.74 175.33 1ajd n PRO 130 N 3.94 2.14 -3.58 8.40 -0.04 -1.26 -4.81 135.00 139.79 1ajd n PRO 130 Ca -0.25 0.76 -0.35 0.00 -0.04 0.00 0.00 63.50 63.62 1ajd n PRO 130 Cb 0.51 -2.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.50 1ajd n PRO 130 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ajd s THR 131 N -0.30 5.11 0.43 0.52 -4.23 -1.26 -4.51 115.64 111.39 1ajd s THR 131 Ca 0.65 0.49 0.26 0.00 -1.18 0.00 0.00 61.69 61.91 1ajd s THR 131 Cb -0.61 -3.65 0.46 0.00 1.34 0.00 0.00 72.50 70.04 1ajd s THR 131 CO 0.52 0.34 1.67 -0.29 -0.54 0.00 0.00 174.62 176.33 1ajd h ILE 132 N 3.02 0.26 -0.04 2.99 6.09 -0.30 0.30 117.51 129.83 1ajd h ILE 132 Ca -0.50 -0.06 -0.01 0.00 -1.37 0.00 0.00 64.86 62.92 1ajd h ILE 132 Cb 1.20 0.06 -0.00 0.00 0.47 0.00 0.00 36.82 38.54 1ajd h ILE 132 CO 0.65 0.03 -0.02 0.25 -3.07 0.00 0.00 178.15 176.00 1ajd h LEU 133 N 0.18 0.09 -1.40 2.19 6.46 -1.82 0.10 115.31 121.12 1ajd h LEU 133 Ca 0.74 -0.41 0.01 0.00 -0.12 0.00 0.00 57.88 58.10 1ajd h LEU 133 Cb 2.22 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 42.09 1ajd h LEU 133 CO -0.37 0.48 0.41 -0.33 -0.62 0.00 0.00 178.44 178.01 1ajd h GLU 134 N -0.30 0.81 -0.02 1.25 5.08 -0.73 -0.58 114.58 120.08 1ajd h GLU 134 Ca 0.01 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 1ajd h GLU 134 Cb 0.45 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1ajd h GLU 134 CO 0.01 0.53 -0.77 0.52 -1.00 0.00 0.00 179.01 178.30 1ajd h MET 135 N 0.83 0.20 -0.35 2.33 2.86 -0.64 -1.46 114.93 118.70 1ajd h MET 135 Ca 0.23 -0.19 -0.11 0.00 -2.06 0.00 0.00 59.70 57.57 1ajd h MET 135 Cb -0.09 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1ajd h MET 135 CO -0.05 0.87 -0.23 0.00 1.06 0.00 0.00 176.91 178.57 1ajd h ALA 136 N 1.07 0.50 -0.09 6.32 0.00 -0.02 -0.21 119.26 126.82 1ajd h ALA 136 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1ajd h ALA 136 Cb 1.35 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ajd h ALA 136 CO 0.12 0.47 0.06 -0.22 0.00 0.00 0.00 179.25 179.68 1ajd h LYS 137 N 0.55 0.12 -0.60 0.00 3.64 -1.11 -0.60 116.57 118.58 1ajd h LYS 137 Ca 0.07 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.54 1ajd h LYS 137 Cb 0.79 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.50 1ajd h LYS 137 CO 0.06 0.11 0.17 0.00 -2.27 0.00 0.00 179.45 177.52 1ajd h ALA 138 N 1.01 0.73 0.00 5.00 0.00 -1.07 0.36 119.26 125.29 1ajd h ALA 138 Ca 0.03 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ajd h ALA 138 Cb 0.01 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ajd h ALA 138 CO -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1ajd n ALA 139 N -2.54 2.10 -0.49 0.00 0.00 -0.11 -4.85 120.51 114.63 1ajd n ALA 139 Ca 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1ajd n ALA 139 Cb 0.30 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1ajd n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ajd n GLY 140 N 0.12 0.75 3.88 0.00 0.00 0.13 -5.06 105.19 105.00 1ajd n GLY 140 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1ajd n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajd s LEU 141 N 0.00 3.97 0.74 0.99 1.02 -0.30 -4.86 118.68 120.23 1ajd s LEU 141 Ca 0.00 1.04 -0.13 0.00 0.02 0.00 0.00 54.13 55.07 1ajd s LEU 141 Cb 0.00 -3.88 0.04 0.00 0.02 0.00 0.00 46.19 42.37 1ajd s LEU 141 CO 0.00 -0.28 1.11 0.00 0.02 0.00 0.00 176.35 177.21 1ajd s ALA 142 N -2.16 2.27 -0.02 4.21 0.00 0.08 -4.05 121.76 122.08 1ajd s ALA 142 Ca 0.50 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.88 1ajd s ALA 142 Cb -0.10 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.70 1ajd s ALA 142 CO 0.27 -1.66 0.06 0.95 0.00 0.00 0.00 175.76 175.38 1ajd s THR 143 N -2.60 0.00 0.02 0.00 -4.23 -1.26 -1.09 115.64 106.49 1ajd s THR 143 Ca 0.65 -0.01 0.03 0.00 -1.18 0.00 0.00 61.69 61.18 1ajd s THR 143 Cb -0.20 -0.10 -0.02 0.00 1.34 0.00 0.00 72.50 73.53 1ajd s THR 143 CO 0.50 -0.00 -0.09 -0.83 -0.54 0.00 0.00 174.62 173.65 1ajd s GLY 144 N 0.02 0.52 -0.18 3.99 0.00 0.78 -2.23 107.32 110.22 1ajd s GLY 144 Ca -0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 44.72 44.10 1ajd s GLY 144 CO 0.00 -0.57 0.06 0.21 0.00 0.00 0.00 173.10 172.80 1ajd s ASN 145 N -0.85 2.65 -0.03 1.64 2.47 0.67 -1.82 114.94 119.68 1ajd s ASN 145 Ca -0.01 -0.72 0.04 0.00 0.42 0.00 0.00 52.86 52.58 1ajd s ASN 145 Cb -0.06 -0.44 -0.00 0.00 -1.45 0.00 0.00 41.25 39.29 1ajd s ASN 145 CO 0.00 -0.32 -0.14 -0.69 -3.72 0.00 0.00 177.10 172.23 1ajd s VAL 146 N 1.98 1.13 0.22 -5.21 1.01 0.07 -0.62 120.40 118.97 1ajd s VAL 146 Ca 0.00 -0.57 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 1ajd s VAL 146 Cb -0.17 -0.96 0.04 0.00 0.00 0.00 0.00 36.38 35.29 1ajd s VAL 146 CO -0.08 0.33 0.62 -0.55 0.00 0.00 0.00 175.10 175.42 1ajd s SER 147 N -0.07 -0.35 -0.09 3.32 0.15 0.14 -0.63 113.70 116.16 1ajd s SER 147 Ca 0.00 -0.40 0.14 0.00 0.70 0.00 0.00 55.95 56.39 1ajd s SER 147 Cb -0.08 0.65 0.47 0.00 -1.71 0.00 0.00 66.02 65.34 1ajd s SER 147 CO 0.01 -1.15 1.39 0.35 1.20 0.00 0.00 173.24 175.04 1ajd n THR 148 N -0.40 1.69 -4.60 6.45 -2.24 -1.11 -3.75 114.28 110.31 1ajd n THR 148 Ca -0.09 -1.40 -0.27 0.00 -2.27 0.00 0.00 64.05 60.02 1ajd n THR 148 Cb 0.62 0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 1ajd n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajd n ALA 149 N 0.19 0.39 -1.77 6.98 0.00 -1.26 -1.56 120.51 123.48 1ajd n ALA 149 Ca 0.18 -1.92 -0.41 0.00 0.00 0.00 0.00 53.44 51.29 1ajd n ALA 149 Cb 0.70 1.09 -0.01 0.00 0.00 0.00 0.00 19.45 21.23 1ajd n ALA 149 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ajd s GLU 150 N -3.52 4.13 0.46 0.00 2.02 -1.26 -1.05 118.70 119.49 1ajd s GLU 150 Ca 0.03 2.55 0.32 0.00 0.02 0.00 0.00 54.97 57.90 1ajd s GLU 150 Cb 0.00 -3.02 1.57 0.00 0.10 0.00 0.00 34.13 32.78 1ajd s GLU 150 CO 0.02 -0.60 1.96 -0.07 0.02 0.00 0.00 175.26 176.60 1ajd h LEU 151 N 4.54 0.00 -0.13 1.80 -0.00 -1.65 0.15 115.31 120.03 1ajd h LEU 151 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.40 1ajd h LEU 151 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 1ajd h LEU 151 CO 0.77 0.00 -0.05 0.00 -0.00 0.00 0.00 178.44 179.15 1ajd n GLN 152 N -2.68 0.65 -2.37 1.13 3.00 -1.26 -3.48 117.38 112.36 1ajd n GLN 152 Ca -0.01 -0.13 -0.35 0.00 -0.01 0.00 0.00 57.00 56.51 1ajd n GLN 152 Cb 0.14 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 28.87 1ajd n GLN 152 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1ajd s GLY 153 N -2.44 2.60 0.08 1.08 0.00 0.54 -4.76 107.32 104.41 1ajd s GLY 153 Ca 0.31 0.75 -0.15 0.00 0.00 0.00 0.00 44.72 45.63 1ajd s GLY 153 CO 0.45 1.10 1.24 0.00 0.00 0.00 0.00 173.10 175.89 1ajd n ALA 154 N -1.12 -0.31 -0.17 3.20 0.00 -1.26 -1.61 120.51 119.24 1ajd n ALA 154 Ca 0.10 0.41 -0.08 0.00 0.00 0.00 0.00 53.44 53.87 1ajd n ALA 154 Cb 0.51 0.18 -0.03 0.00 0.00 0.00 0.00 19.45 20.12 1ajd n ALA 154 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1ajd h THR 155 N 0.00 0.12 0.04 0.00 2.02 -1.94 -1.92 112.91 111.23 1ajd h THR 155 Ca 0.08 0.00 -0.24 0.00 0.77 0.00 0.00 66.41 67.02 1ajd h THR 155 Cb 0.20 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 1ajd h THR 155 CO -0.45 0.00 -1.03 1.55 0.37 0.00 0.00 175.52 175.96 1ajd h PRO 156 N -0.25 0.38 -0.68 6.66 0.13 -1.83 -3.30 132.00 133.12 1ajd h PRO 156 Ca 0.17 -0.46 0.16 0.00 -0.87 0.00 0.00 66.00 65.00 1ajd h PRO 156 Cb 0.57 0.14 -0.04 0.00 0.13 0.00 0.00 31.00 31.80 1ajd h PRO 156 CO -0.64 1.14 0.47 0.00 -0.23 0.00 0.00 178.00 178.75 1ajd h ALA 157 N 0.68 2.33 0.00 -0.56 0.00 -0.91 -1.87 119.26 118.94 1ajd h ALA 157 Ca -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1ajd h ALA 157 Cb 1.68 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 1ajd h ALA 157 CO 0.18 -0.52 -0.06 0.00 0.00 0.00 0.00 179.25 178.85 1ajd h ALA 158 N 1.67 1.23 0.00 0.00 0.00 -1.43 0.22 119.26 120.95 1ajd h ALA 158 Ca 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ajd h ALA 158 Cb 0.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1ajd h ALA 158 CO -0.07 0.08 -0.01 1.28 0.00 0.00 0.00 179.25 180.53 1ajd n LEU 159 N -3.50 0.42 0.00 0.00 4.77 -0.70 -4.21 117.00 113.78 1ajd n LEU 159 Ca -0.02 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1ajd n LEU 159 Cb 0.18 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 1ajd n LEU 159 CO 0.27 -0.09 0.15 1.33 -1.33 0.00 0.00 177.39 177.73 1ajd n VAL 160 N -1.89 0.00 -4.28 4.08 0.24 -0.99 -4.32 118.33 111.18 1ajd n VAL 160 Ca 0.06 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.17 1ajd n VAL 160 Cb 0.39 1.16 -0.13 0.00 -1.47 0.00 0.00 33.84 33.79 1ajd n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ajd s ALA 161 N 0.00 1.09 -0.30 2.33 0.00 0.03 -4.15 121.76 120.76 1ajd s ALA 161 Ca 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1ajd s ALA 161 Cb 0.00 -0.14 0.10 0.00 0.00 0.00 0.00 23.12 23.08 1ajd s ALA 161 CO 0.00 0.18 0.09 -1.01 0.00 0.00 0.00 175.76 175.02 1ajd s HIS 162 N -0.97 1.80 0.01 0.00 3.76 -1.23 -3.61 115.29 115.05 1ajd s HIS 162 Ca -0.00 -1.75 -0.07 0.00 -0.15 0.00 0.00 55.06 53.09 1ajd s HIS 162 Cb -0.08 -1.73 -0.00 0.00 1.11 0.00 0.00 32.58 31.87 1ajd s HIS 162 CO 0.01 -0.86 0.13 0.14 -0.85 0.00 0.00 174.74 173.31 1ajd s VAL 163 N 1.59 0.09 -0.53 -0.90 -7.23 -0.03 -4.88 120.40 108.52 1ajd s VAL 163 Ca 0.09 -0.78 0.26 0.00 -1.81 0.00 0.00 61.98 59.73 1ajd s VAL 163 Cb -0.17 -0.54 0.29 0.00 0.56 0.00 0.00 36.38 36.51 1ajd s VAL 163 CO -0.23 -0.43 1.76 0.71 -0.31 0.00 0.00 175.10 176.60 1ajd h THR 164 N 4.10 0.00 -3.64 5.32 1.35 -1.89 -2.28 112.91 115.88 1ajd h THR 164 Ca -0.31 -0.42 -0.28 0.00 -0.55 0.00 0.00 66.41 64.85 1ajd h THR 164 Cb 1.19 1.31 -0.31 0.00 -1.73 0.00 0.00 68.15 68.61 1ajd h THR 164 CO 0.43 0.00 -0.73 -0.55 -0.25 0.00 0.00 175.52 174.42 1ajd s SER 165 N -4.66 0.15 0.47 5.36 0.15 -1.25 -4.19 113.70 109.73 1ajd s SER 165 Ca 0.07 0.00 0.18 0.00 0.70 0.00 0.00 55.95 56.90 1ajd s SER 165 Cb 0.10 -0.07 1.13 0.00 -1.71 0.00 0.00 66.02 65.47 1ajd s SER 165 CO 0.51 -0.05 2.02 0.08 1.20 0.00 0.00 173.24 176.99 1ajd h ARG 166 N 6.71 0.00 0.00 5.44 0.11 -0.69 -2.86 114.38 123.09 1ajd h ARG 166 Ca -0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.73 1ajd h ARG 166 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1ajd h ARG 166 CO 0.49 0.17 0.00 1.63 0.10 0.00 0.00 179.97 182.36 1ajd n LYS 167 N -4.15 0.03 -1.31 0.08 5.02 -1.26 -4.08 118.16 112.49 1ajd n LYS 167 Ca -0.02 0.45 -0.28 0.00 -2.02 0.00 0.00 58.31 56.44 1ajd n LYS 167 Cb 0.24 -1.58 -0.08 0.00 -0.02 0.00 0.00 35.03 33.59 1ajd n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ajd h TYR 169 N 4.00 -1.09 -3.92 0.00 -1.99 -1.89 -2.95 116.97 109.13 1ajd h TYR 169 Ca 0.55 0.07 -0.31 0.00 2.00 0.00 0.00 58.73 61.05 1ajd h TYR 169 Cb 0.78 0.55 -0.07 0.00 2.00 0.00 0.00 36.73 39.98 1ajd h TYR 169 CO 1.77 -0.22 -0.27 0.41 -0.00 0.00 0.00 178.16 179.85 1ajd n GLY 170 N -1.15 3.53 0.20 3.88 0.00 -1.26 -1.51 105.19 108.88 1ajd n GLY 170 Ca 0.01 -1.95 -0.05 0.00 0.00 0.00 0.00 46.02 44.03 1ajd n GLY 170 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ajd n PRO 171 N -0.47 -0.21 -0.31 1.61 -0.02 -1.26 -1.18 135.00 133.15 1ajd n PRO 171 Ca -0.01 0.93 0.13 0.00 -2.02 0.00 0.00 63.50 62.53 1ajd n PRO 171 Cb 0.35 -1.38 0.30 0.00 -0.02 0.00 0.00 33.50 32.75 1ajd n PRO 171 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ajd h SER 172 N 0.00 0.38 -0.00 2.55 0.87 -1.97 0.46 113.55 115.84 1ajd h SER 172 Ca 0.08 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1ajd h SER 172 Cb 0.20 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1ajd h SER 172 CO -0.46 0.04 -0.00 0.00 -0.53 0.00 0.00 176.83 175.88 1ajd h ALA 173 N 1.69 0.00 -0.08 6.23 0.00 -1.48 -3.29 119.26 122.32 1ajd h ALA 173 Ca 0.55 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1ajd h ALA 173 Cb 1.01 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1ajd h ALA 173 CO -0.50 -0.13 -0.26 1.15 0.00 0.00 0.00 179.25 179.51 1ajd h THR 174 N -0.74 0.39 -0.83 0.00 2.02 -0.64 0.04 112.91 113.16 1ajd h THR 174 Ca -0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 1ajd h THR 174 Cb 0.74 0.39 -0.16 0.00 -1.74 0.00 0.00 68.15 67.39 1ajd h THR 174 CO 0.00 0.00 -0.22 0.28 0.37 0.00 0.00 175.52 175.95 1ajd h SER 175 N -0.36 -0.81 0.06 4.18 0.02 -1.05 0.73 113.55 116.32 1ajd h SER 175 Ca 0.09 0.25 -0.20 0.00 -0.84 0.00 0.00 61.79 61.09 1ajd h SER 175 Cb 0.48 0.53 0.02 0.00 0.14 0.00 0.00 62.40 63.57 1ajd h SER 175 CO -0.28 -0.28 -0.80 -0.08 -1.14 0.00 0.00 176.83 174.25 1ajd h GLU 176 N -0.01 0.43 0.00 3.45 4.81 -1.53 -3.30 114.58 118.44 1ajd h GLU 176 Ca 0.39 -0.55 -0.06 0.00 -0.13 0.00 0.00 59.36 59.01 1ajd h GLU 176 Cb 0.60 0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 1ajd h GLU 176 CO -0.85 1.21 -1.97 1.63 -0.73 0.00 0.00 179.01 178.29 1ajd n LYS 177 N -4.10 0.67 -3.03 1.92 5.02 -0.04 -4.59 118.16 114.02 1ajd n LYS 177 Ca -0.12 -0.15 -0.22 0.00 -2.02 0.00 0.00 58.31 55.80 1ajd n LYS 177 Cb 0.78 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 34.29 1ajd n LYS 177 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ajd h PRO 179 N 2.97 0.00 0.00 0.00 0.13 -1.60 0.23 132.00 133.73 1ajd h PRO 179 Ca 0.11 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.16 1ajd h PRO 179 Cb 0.78 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 1ajd h PRO 179 CO 0.65 0.00 -0.39 0.78 -0.23 0.00 0.00 178.00 178.81 1ajd h GLY 180 N 0.04 0.00 0.15 1.56 0.00 -1.90 -2.97 103.07 99.95 1ajd h GLY 180 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ajd h GLY 180 CO 0.00 0.00 -0.97 0.70 0.00 0.00 0.00 176.54 176.27 1ajd n ASN 181 N -3.33 0.88 -4.67 0.19 4.13 0.66 -4.20 115.26 108.92 1ajd n ASN 181 Ca 0.01 -0.84 -0.51 0.00 1.68 0.00 0.00 54.58 54.93 1ajd n ASN 181 Cb 0.60 0.93 -0.05 0.00 -1.54 0.00 0.00 39.78 39.72 1ajd n ASN 181 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ajd n ALA 182 N -1.54 0.41 0.20 5.41 0.00 -0.40 0.32 120.51 124.90 1ajd n ALA 182 Ca 0.04 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.72 1ajd n ALA 182 Cb 0.34 -2.32 -0.07 0.00 0.00 0.00 0.00 19.45 17.40 1ajd n ALA 182 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ajd h LEU 183 N 7.11 -0.48 0.00 0.00 5.85 -1.89 0.37 115.31 126.27 1ajd h LEU 183 Ca -0.47 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1ajd h LEU 183 Cb 1.29 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.46 1ajd h LEU 183 CO 0.91 -0.31 0.00 -1.84 -0.34 0.00 0.00 178.44 176.86 1ajd n GLU 184 N -5.32 0.37 -0.12 1.25 0.00 -1.26 -1.23 120.64 114.33 1ajd n GLU 184 Ca -0.10 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.15 1ajd n GLU 184 Cb 0.23 -1.25 0.11 0.00 0.00 0.00 0.00 31.44 30.53 1ajd n GLU 184 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ajd n LYS 185 N -0.75 1.18 -0.99 3.44 4.01 -0.27 -4.98 118.16 119.80 1ajd n LYS 185 Ca 0.04 -2.31 0.00 0.00 -0.51 0.00 0.00 58.31 55.53 1ajd n LYS 185 Cb 0.02 -1.34 0.00 0.00 -0.51 0.00 0.00 35.03 33.20 1ajd n LYS 185 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ajd n GLY 186 N -1.20 0.62 3.95 0.72 0.00 -0.36 -4.85 105.19 104.06 1ajd n GLY 186 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1ajd n GLY 186 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ajd s GLY 187 N -2.00 1.58 0.22 -0.02 0.00 0.11 -4.98 107.32 102.23 1ajd s GLY 187 Ca 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 44.72 43.63 1ajd s GLY 187 CO 0.00 -0.82 1.71 0.50 0.00 0.00 0.00 173.10 174.49 1ajd h LYS 188 N 0.31 0.31 0.00 2.90 1.57 -1.77 -3.34 116.57 116.56 1ajd h LYS 188 Ca -0.46 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1ajd h LYS 188 Cb 1.25 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1ajd h LYS 188 CO 0.58 0.20 0.00 0.41 -0.57 0.00 0.00 179.45 180.07 1ajd n GLY 189 N -1.32 1.60 3.76 3.86 0.00 0.15 -4.77 105.19 108.47 1ajd n GLY 189 Ca 0.10 -1.97 -0.29 0.00 0.00 0.00 0.00 46.02 43.86 1ajd n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ajd s SER 190 N 0.00 3.50 0.14 1.61 1.04 -1.26 -4.73 113.70 114.00 1ajd s SER 190 Ca 0.00 1.11 -0.23 0.00 0.48 0.00 0.00 55.95 57.31 1ajd s SER 190 Cb 0.00 -1.74 -0.00 0.00 0.10 0.00 0.00 66.02 64.38 1ajd s SER 190 CO 0.00 -2.57 1.64 0.40 0.98 0.00 0.00 173.24 173.69 1ajd h ILE 191 N -1.51 0.45 -0.69 -1.02 2.04 -1.45 0.42 117.51 115.75 1ajd h ILE 191 Ca -0.51 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.36 1ajd h ILE 191 Cb 1.32 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1ajd h ILE 191 CO 0.60 0.00 0.45 0.74 0.00 0.00 0.00 178.15 179.95 1ajd h THR 192 N -0.26 1.18 -0.54 -0.27 2.02 -1.54 0.18 112.91 113.67 1ajd h THR 192 Ca 0.11 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.87 1ajd h THR 192 Cb 0.43 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1ajd h THR 192 CO -0.31 0.17 0.00 -0.33 0.37 0.00 0.00 175.52 175.42 1ajd h GLU 193 N 0.94 0.93 -0.12 6.66 5.08 -1.59 -1.96 114.58 124.50 1ajd h GLU 193 Ca 0.25 -0.27 -0.14 0.00 -1.00 0.00 0.00 59.36 58.21 1ajd h GLU 193 Cb -0.10 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1ajd h GLU 193 CO -0.05 0.92 -0.51 1.96 -1.00 0.00 0.00 179.01 180.32 1ajd h GLN 194 N 0.86 0.34 0.20 2.33 4.20 0.40 -2.57 115.11 120.86 1ajd h GLN 194 Ca 0.16 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1ajd h GLN 194 Cb 0.50 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1ajd h GLN 194 CO 0.02 0.77 -0.17 1.25 -0.67 0.00 0.00 178.83 180.04 1ajd h LEU 195 N 0.27 -0.44 -2.13 1.46 6.46 -0.12 -0.15 115.31 120.66 1ajd h LEU 195 Ca 0.01 0.04 0.08 0.00 -0.12 0.00 0.00 57.88 57.89 1ajd h LEU 195 Cb 0.99 0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 1ajd h LEU 195 CO 0.08 -0.26 0.26 -0.07 -0.62 0.00 0.00 178.44 177.84 1ajd h LEU 196 N -0.38 0.00 0.06 2.25 -0.00 -1.24 -2.23 115.31 113.77 1ajd h LEU 196 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 57.88 57.61 1ajd h LEU 196 Cb 0.35 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.99 1ajd h LEU 196 CO -0.02 0.00 -1.32 0.78 -0.00 0.00 0.00 178.44 177.88 1ajd h ASN 197 N 0.00 0.21 0.21 -0.43 2.35 -0.71 -3.34 115.58 113.87 1ajd h ASN 197 Ca 0.13 -0.26 -0.07 0.00 -0.55 0.00 0.00 56.30 55.55 1ajd h ASN 197 Cb 0.65 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.94 1ajd h ASN 197 CO -0.00 1.21 -0.26 0.00 -1.65 0.00 0.00 177.43 176.73 1ajd h ALA 198 N 0.76 1.45 -6.34 -0.83 0.00 -0.46 -3.48 119.26 110.36 1ajd h ALA 198 Ca -0.15 -0.27 -0.46 0.00 0.00 0.00 0.00 54.91 54.03 1ajd h ALA 198 Cb 1.92 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 19.72 1ajd h ALA 198 CO 0.15 0.40 -0.95 -2.13 0.00 0.00 0.00 179.25 176.72 1ajd n ARG 199 N -4.19 -1.12 -2.35 0.00 0.63 -1.19 -4.94 116.66 103.50 1ajd n ARG 199 Ca -0.02 0.40 -0.38 0.00 -0.92 0.00 0.00 57.85 56.93 1ajd n ARG 199 Cb 0.34 -3.89 -0.03 0.00 0.45 0.00 0.00 32.46 29.33 1ajd n ARG 199 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ajd s ALA 200 N -3.48 3.19 0.21 5.13 0.00 -1.26 -4.92 121.76 120.62 1ajd s ALA 200 Ca 0.47 0.93 -0.09 0.00 0.00 0.00 0.00 51.96 53.26 1ajd s ALA 200 Cb -0.18 -3.36 0.16 0.00 0.00 0.00 0.00 23.12 19.74 1ajd s ALA 200 CO 0.88 -0.44 1.83 -0.44 0.00 0.00 0.00 175.76 177.60 1ajd h ASP 201 N 2.79 0.96 -3.27 0.00 5.19 -1.81 -3.42 116.42 116.87 1ajd h ASP 201 Ca -0.48 -0.09 -0.57 0.00 -0.62 0.00 0.00 57.03 55.27 1ajd h ASP 201 Cb 1.23 -0.24 -0.35 0.00 0.18 0.00 0.00 39.33 40.15 1ajd h ASP 201 CO 0.63 0.77 -0.83 -0.69 -3.12 0.00 0.00 179.24 176.01 1ajd s VAL 202 N -5.88 1.40 -0.08 -1.35 1.01 -0.95 -1.07 120.40 113.49 1ajd s VAL 202 Ca -0.13 -0.58 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1ajd s VAL 202 Cb 0.15 -1.29 0.05 0.00 0.00 0.00 0.00 36.38 35.28 1ajd s VAL 202 CO 0.80 0.42 0.13 -0.89 0.00 0.00 0.00 175.10 175.57 1ajd s THR 203 N 1.05 -0.22 -0.03 3.92 2.01 -1.04 -0.24 115.64 121.10 1ajd s THR 203 Ca -0.06 0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.28 1ajd s THR 203 Cb -0.15 -0.29 0.01 0.00 0.01 0.00 0.00 72.50 72.09 1ajd s THR 203 CO -0.02 0.12 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.22 1ajd s LEU 204 N 2.26 1.55 0.00 4.42 1.43 0.20 -0.55 118.68 127.99 1ajd s LEU 204 Ca 0.04 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1ajd s LEU 204 Cb -0.12 -0.38 0.00 0.00 0.03 0.00 0.00 46.19 45.71 1ajd s LEU 204 CO -0.05 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.12 1ajd n GLY 205 N 3.67 -0.70 0.00 -3.19 0.00 -0.09 -0.68 105.19 104.20 1ajd n GLY 205 Ca -0.22 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1ajd n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajd n GLY 206 N 0.00 5.29 1.86 -0.02 0.00 -0.21 -1.04 105.19 111.07 1ajd n GLY 206 Ca 0.00 -1.60 -0.05 0.00 0.00 0.00 0.00 46.02 44.37 1ajd n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ajd n GLY 207 N 3.27 0.23 0.13 -0.02 0.00 0.26 -1.86 105.19 107.20 1ajd n GLY 207 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 1ajd n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajd h ALA 208 N 0.15 0.83 -0.74 4.61 0.00 -0.23 -3.35 119.26 120.53 1ajd h ALA 208 Ca -0.18 -0.60 0.12 0.00 0.00 0.00 0.00 54.91 54.26 1ajd h ALA 208 Cb 1.10 -0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.65 1ajd h ALA 208 CO 0.14 0.82 -0.34 -0.22 0.00 0.00 0.00 179.25 179.65 1ajd h LYS 209 N 0.00 -0.10 -0.94 0.00 3.64 -1.46 -0.98 116.57 116.73 1ajd h LYS 209 Ca -0.01 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1ajd h LYS 209 Cb 1.23 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.01 1ajd h LYS 209 CO 0.09 -0.06 0.62 1.15 -2.27 0.00 0.00 179.45 178.97 1ajd h THR 210 N -0.10 1.11 0.00 1.00 2.02 -1.84 -1.39 112.91 113.71 1ajd h THR 210 Ca 0.28 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1ajd h THR 210 Cb 0.57 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1ajd h THR 210 CO -0.79 0.21 0.00 0.49 0.37 0.00 0.00 175.52 175.80 1ajd n PHE 211 N -4.47 0.00 1.22 3.16 3.01 -0.37 -0.51 117.46 119.49 1ajd n PHE 211 Ca 0.14 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.73 1ajd n PHE 211 Cb 0.15 -0.16 0.41 0.00 -0.01 0.00 0.00 39.48 39.87 1ajd n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ajd n ALA 212 N -1.16 3.08 -2.01 4.37 0.00 -0.52 -1.79 120.51 122.48 1ajd n ALA 212 Ca 0.01 -0.35 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 1ajd n ALA 212 Cb 0.01 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.26 1ajd n ALA 212 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1ajd s GLU 213 N -2.62 3.78 0.03 0.00 2.02 0.33 -4.82 118.70 117.41 1ajd s GLU 213 Ca 0.22 0.67 0.05 0.00 0.02 0.00 0.00 54.97 55.93 1ajd s GLU 213 Cb 0.19 -2.23 -0.03 0.00 0.10 0.00 0.00 34.13 32.15 1ajd s GLU 213 CO 0.55 -0.25 -0.12 0.95 0.02 0.00 0.00 175.26 176.42 1ajd s THR 214 N -2.67 3.27 0.33 3.63 -4.23 -1.26 -0.34 115.64 114.38 1ajd s THR 214 Ca 0.54 -1.00 -0.29 0.00 -1.18 0.00 0.00 61.69 59.77 1ajd s THR 214 Cb -0.10 -2.42 -0.11 0.00 1.34 0.00 0.00 72.50 71.21 1ajd s THR 214 CO 0.37 0.34 1.40 0.00 -0.54 0.00 0.00 174.62 176.19 1ajd s ALA 215 N -1.00 3.55 -0.06 3.99 0.00 -0.99 -4.77 121.76 122.48 1ajd s ALA 215 Ca 0.17 1.39 0.12 0.00 0.00 0.00 0.00 51.96 53.64 1ajd s ALA 215 Cb -0.11 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1ajd s ALA 215 CO 0.07 -0.81 1.36 1.79 0.00 0.00 0.00 175.76 178.18 1ajd h THR 216 N 3.10 1.14 -0.95 0.00 1.35 -1.94 -2.23 112.91 113.39 1ajd h THR 216 Ca -0.49 -2.63 0.00 0.00 -0.55 0.00 0.00 66.41 62.74 1ajd h THR 216 Cb 1.23 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 70.21 1ajd h THR 216 CO 0.67 0.65 0.00 0.00 -0.25 0.00 0.00 175.52 176.59 1ajd n ALA 217 N -2.28 0.00 -0.99 6.62 0.00 -1.26 -4.81 120.51 117.79 1ajd n ALA 217 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1ajd n ALA 217 Cb 0.81 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.25 1ajd n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ajd n GLY 218 N 0.00 -1.37 0.34 0.00 0.00 -1.26 -3.11 105.19 99.79 1ajd n GLY 218 Ca 0.00 -1.10 -0.05 0.00 0.00 0.00 0.00 46.02 44.87 1ajd n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ajd h GLU 219 N 0.00 1.16 -0.94 1.61 4.81 -2.01 -2.99 114.58 116.22 1ajd h GLU 219 Ca 0.01 -0.19 -0.44 0.00 -0.13 0.00 0.00 59.36 58.60 1ajd h GLU 219 Cb 0.38 -0.20 -0.26 0.00 0.63 0.00 0.00 28.75 29.29 1ajd h GLU 219 CO 0.00 0.92 0.56 0.91 -0.73 0.00 0.00 179.01 180.67 1ajd n TRP 220 N -4.29 2.93 -1.68 0.92 8.01 -1.26 -4.99 117.44 117.07 1ajd n TRP 220 Ca 0.07 -1.68 -0.41 0.00 -1.31 0.00 0.00 57.50 54.17 1ajd n TRP 220 Cb 0.17 -0.88 0.01 0.00 -2.01 0.00 0.00 31.31 28.60 1ajd n TRP 220 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 1ajd n GLN 221 N -0.89 1.76 0.00 -0.99 7.27 -1.13 -1.48 117.38 121.92 1ajd n GLN 221 Ca 0.55 0.63 0.00 0.00 0.07 0.00 0.00 57.00 58.25 1ajd n GLN 221 Cb 1.61 -2.30 0.00 0.00 2.41 0.00 0.00 30.24 31.95 1ajd n GLN 221 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ajd n GLY 222 N 0.91 2.50 3.89 1.69 0.00 -0.84 -4.87 105.19 108.47 1ajd n GLY 222 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1ajd n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ajd s LYS 223 N 0.00 3.64 0.88 1.61 -0.14 -0.55 -4.81 119.74 120.37 1ajd s LYS 223 Ca 0.00 0.42 -0.13 0.00 -1.36 0.00 0.00 55.97 54.90 1ajd s LYS 223 Cb 0.00 -2.31 0.12 0.00 -1.68 0.00 0.00 37.83 33.96 1ajd s LYS 223 CO 0.00 -0.23 1.18 0.95 -0.76 0.00 0.00 175.35 176.49 1ajd s THR 224 N -2.72 1.99 0.16 2.17 -4.23 -1.26 -2.35 115.64 109.39 1ajd s THR 224 Ca 0.50 0.00 0.18 0.00 -1.18 0.00 0.00 61.69 61.19 1ajd s THR 224 Cb -0.10 -2.90 0.12 0.00 1.34 0.00 0.00 72.50 70.95 1ajd s THR 224 CO 0.42 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 176.14 1ajd h LEU 225 N -1.34 0.00 -0.04 4.79 3.38 -0.59 -1.06 115.31 120.44 1ajd h LEU 225 Ca -0.47 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 1ajd h LEU 225 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1ajd h LEU 225 CO 0.59 0.40 -0.17 -0.09 0.09 0.00 0.00 178.44 179.27 1ajd h ARG 226 N 0.00 0.19 -0.93 1.13 2.43 -1.62 -1.01 114.38 114.57 1ajd h ARG 226 Ca -0.00 -0.15 0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1ajd h ARG 226 Cb 0.94 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.45 1ajd h ARG 226 CO 0.05 0.79 0.58 0.93 -1.51 0.00 0.00 179.97 180.81 1ajd h GLU 227 N -0.36 0.98 0.26 0.20 5.08 -1.81 -2.48 114.58 116.45 1ajd h GLU 227 Ca -0.01 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1ajd h GLU 227 Cb 0.81 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1ajd h GLU 227 CO 0.04 0.65 -0.21 0.37 -1.00 0.00 0.00 179.01 178.85 1ajd h GLN 228 N 1.01 -0.44 -0.90 2.33 4.15 -1.03 -1.74 115.11 118.49 1ajd h GLN 228 Ca 0.42 0.03 0.24 0.00 0.77 0.00 0.00 58.65 60.12 1ajd h GLN 228 Cb 0.26 0.10 -0.17 0.00 0.21 0.00 0.00 27.48 27.89 1ajd h GLN 228 CO -0.20 -0.30 0.01 0.00 -1.93 0.00 0.00 178.83 176.41 1ajd n ALA 229 N -2.45 0.45 0.07 3.38 0.00 -0.40 0.13 120.51 121.69 1ajd n ALA 229 Ca -0.06 0.97 -0.13 0.00 0.00 0.00 0.00 53.44 54.22 1ajd n ALA 229 Cb 0.20 -0.70 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 1ajd n ALA 229 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ajd h GLU 230 N 0.00 -0.10 -0.08 0.00 5.08 -1.30 0.12 114.58 118.30 1ajd h GLU 230 Ca 0.54 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.93 1ajd h GLU 230 Cb 1.10 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1ajd h GLU 230 CO -0.85 0.03 0.07 0.00 -1.00 0.00 0.00 179.01 177.26 1ajd h ALA 231 N 0.69 1.92 -0.00 3.43 0.00 0.20 0.27 119.26 125.78 1ajd h ALA 231 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ajd h ALA 231 Cb 0.19 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ajd h ALA 231 CO 0.02 -0.11 -0.13 0.54 0.00 0.00 0.00 179.25 179.57 1ajd n ARG 232 N -4.26 0.05 -0.41 0.00 5.12 0.17 -4.94 116.66 112.40 1ajd n ARG 232 Ca -0.01 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1ajd n ARG 232 Cb 0.18 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 29.98 1ajd n ARG 232 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ajd n GLY 233 N 1.48 0.75 3.80 -0.13 0.00 0.96 -4.97 105.19 107.08 1ajd n GLY 233 Ca 0.07 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 1ajd n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ajd s TYR 234 N -2.00 3.63 -0.26 1.61 1.51 0.27 -3.51 117.35 118.61 1ajd s TYR 234 Ca 0.00 1.62 -0.15 0.00 -1.01 0.00 0.00 57.07 57.53 1ajd s TYR 234 Cb 0.00 -2.80 -0.04 0.00 -0.11 0.00 0.00 41.96 39.01 1ajd s TYR 234 CO 0.00 0.22 0.37 -0.65 -1.11 0.00 0.00 175.55 174.37 1ajd s GLN 235 N -2.17 4.04 -0.26 -0.62 -0.21 0.22 -4.45 119.66 116.22 1ajd s GLN 235 Ca 0.49 0.05 -0.11 0.00 0.02 0.00 0.00 55.36 55.82 1ajd s GLN 235 Cb -0.17 -3.63 -0.05 0.00 1.00 0.00 0.00 33.01 30.16 1ajd s GLN 235 CO 0.22 -0.22 0.17 -0.51 -2.12 0.00 0.00 175.29 172.83 1ajd s LEU 236 N 1.90 4.08 -0.06 2.90 1.02 -1.26 -0.75 118.68 126.50 1ajd s LEU 236 Ca 0.15 0.06 0.05 0.00 0.02 0.00 0.00 54.13 54.42 1ajd s LEU 236 Cb -0.15 -2.11 -0.01 0.00 0.02 0.00 0.00 46.19 43.93 1ajd s LEU 236 CO 0.09 0.02 -0.23 0.68 0.02 0.00 0.00 176.35 176.94 1ajd s VAL 237 N 1.34 1.86 -0.45 -1.59 -7.23 -0.99 -5.01 120.40 108.33 1ajd s VAL 237 Ca 0.07 -0.95 0.04 0.00 -1.81 0.00 0.00 61.98 59.33 1ajd s VAL 237 Cb -0.14 -1.58 0.06 0.00 0.56 0.00 0.00 36.38 35.28 1ajd s VAL 237 CO 0.07 0.52 0.81 -1.54 -0.31 0.00 0.00 175.10 174.65 1ajd n SER 238 N 3.04 1.72 -3.28 4.85 3.41 -1.26 -2.24 113.62 119.86 1ajd n SER 238 Ca -0.18 -1.49 -0.11 0.00 -0.26 0.00 0.00 58.87 56.84 1ajd n SER 238 Cb 0.52 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.43 1ajd n SER 238 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1ajd s ASP 239 N -0.59 0.27 0.20 4.04 1.47 -1.26 -4.47 116.67 116.34 1ajd s ASP 239 Ca 0.06 -1.17 -0.10 0.00 1.18 0.00 0.00 52.55 52.51 1ajd s ASP 239 Cb 0.04 0.74 0.14 0.00 -0.34 0.00 0.00 42.92 43.50 1ajd s ASP 239 CO 0.05 -1.45 1.85 0.00 0.68 0.00 0.00 175.17 176.31 1ajd h ALA 240 N 2.07 0.94 0.61 2.11 0.00 -1.27 0.80 119.26 124.53 1ajd h ALA 240 Ca -0.29 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1ajd h ALA 240 Cb 1.25 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1ajd h ALA 240 CO 0.37 0.40 -0.34 0.00 0.00 0.00 0.00 179.25 179.69 1ajd h ALA 241 N 1.24 -0.89 -0.58 0.00 0.00 -1.89 0.26 119.26 117.40 1ajd h ALA 241 Ca 0.26 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ajd h ALA 241 Cb -0.04 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1ajd h ALA 241 CO -0.05 -1.01 0.38 0.66 0.00 0.00 0.00 179.25 179.23 1ajd h SER 242 N -0.88 0.64 -0.47 0.00 4.64 -1.96 -0.37 113.55 115.15 1ajd h SER 242 Ca -0.08 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 1ajd h SER 242 Cb 0.70 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1ajd h SER 242 CO 0.11 0.46 0.30 0.25 -0.87 0.00 0.00 176.83 177.08 1ajd h LEU 243 N 0.75 0.55 -0.28 5.97 5.85 -0.33 -2.45 115.31 125.37 1ajd h LEU 243 Ca 0.22 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ajd h LEU 243 Cb -0.05 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1ajd h LEU 243 CO -0.05 0.41 -0.13 0.59 -0.34 0.00 0.00 178.44 178.92 1ajd n ASN 244 N -4.75 0.57 0.08 1.25 4.13 0.04 -3.15 115.26 113.42 1ajd n ASN 244 Ca 0.02 -0.63 0.13 0.00 1.68 0.00 0.00 54.58 55.78 1ajd n ASN 244 Cb 0.03 -0.04 0.33 0.00 -1.54 0.00 0.00 39.78 38.56 1ajd n ASN 244 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1ajd n SER 245 N -0.90 0.69 -4.63 6.41 7.64 -0.23 -4.82 113.62 117.79 1ajd n SER 245 Ca 0.14 0.37 -0.43 0.00 1.01 0.00 0.00 58.87 59.96 1ajd n SER 245 Cb 0.29 -0.38 -0.03 0.00 -1.01 0.00 0.00 64.21 63.08 1ajd n SER 245 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ajd s VAL 246 N -3.11 3.12 -0.11 0.44 1.01 -1.15 -4.88 120.40 115.71 1ajd s VAL 246 Ca 0.09 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 61.99 1ajd s VAL 246 Cb 0.13 -3.12 -0.27 0.00 0.00 0.00 0.00 36.38 33.13 1ajd s VAL 246 CO 0.64 -0.05 0.63 0.74 0.00 0.00 0.00 175.10 177.06 1ajd h THR 247 N 6.34 1.29 -4.25 3.92 2.02 -1.92 -3.48 112.91 116.83 1ajd h THR 247 Ca -0.44 -2.39 -0.17 0.00 0.77 0.00 0.00 66.41 64.19 1ajd h THR 247 Cb 1.23 2.90 -0.15 0.00 -1.74 0.00 0.00 68.15 70.39 1ajd h THR 247 CO 0.96 0.63 -0.67 -0.70 0.37 0.00 0.00 175.52 176.11 1ajd s GLU 248 N -2.39 0.79 -0.16 6.66 -6.30 -1.26 -4.97 118.70 111.07 1ajd s GLU 248 Ca -0.20 -1.34 -0.07 0.00 -2.50 0.00 0.00 54.97 50.87 1ajd s GLU 248 Cb 0.02 0.16 0.07 0.00 0.00 0.00 0.00 34.13 34.38 1ajd s GLU 248 CO 0.74 -0.17 0.34 0.00 0.02 0.00 0.00 175.26 176.19 1ajd s ALA 249 N -3.93 -0.86 0.00 6.30 0.00 -1.26 -4.91 121.76 117.09 1ajd s ALA 249 Ca 0.16 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1ajd s ALA 249 Cb 0.07 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1ajd s ALA 249 CO -0.04 -0.52 0.00 0.27 0.00 0.00 0.00 175.76 175.47 1ajd n ASN 250 N 4.94 0.00 0.23 0.00 0.23 -1.14 -4.88 115.26 114.64 1ajd n ASN 250 Ca -0.14 -0.41 0.15 0.00 -0.53 0.00 0.00 54.58 53.65 1ajd n ASN 250 Cb 0.51 0.00 0.59 0.00 -2.08 0.00 0.00 39.78 38.80 1ajd n ASN 250 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1ajd h GLN 251 N 0.00 0.00 0.00 -3.83 1.08 -1.92 -1.50 115.11 108.94 1ajd h GLN 251 Ca 0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1ajd h GLN 251 Cb 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1ajd h GLN 251 CO 0.00 0.00 -0.34 1.96 -0.95 0.00 0.00 178.83 179.50 1ajd h GLN 252 N 0.00 0.00 -2.70 1.46 7.50 -1.95 -3.41 115.11 116.01 1ajd h GLN 252 Ca 0.00 0.00 -0.61 0.00 0.50 0.00 0.00 58.65 58.54 1ajd h GLN 252 Cb 0.51 0.00 -0.41 0.00 0.05 0.00 0.00 27.48 27.63 1ajd h GLN 252 CO 0.00 0.63 -0.66 1.63 -1.50 0.00 0.00 178.83 178.94 1ajd n LYS 253 N -4.61 1.75 -2.06 1.46 5.02 -1.21 -4.82 118.16 113.68 1ajd n LYS 253 Ca -0.12 -4.31 -0.41 0.00 -2.02 0.00 0.00 58.31 51.46 1ajd n LYS 253 Cb 0.38 -2.14 -0.02 0.00 -0.02 0.00 0.00 35.03 33.23 1ajd n LYS 253 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ajd s PRO 254 N -1.53 4.31 -0.02 1.97 0.04 -0.57 -2.88 135.00 136.32 1ajd s PRO 254 Ca 0.30 2.28 -0.19 0.00 0.04 0.00 0.00 61.00 63.43 1ajd s PRO 254 Cb 0.03 -3.06 -0.05 0.00 0.04 0.00 0.00 34.50 31.46 1ajd s PRO 254 CO -0.13 -0.26 0.54 -1.17 0.04 0.00 0.00 177.00 176.03 1ajd s LEU 255 N -1.74 4.40 -0.30 -3.56 2.96 -0.23 0.70 118.68 120.91 1ajd s LEU 255 Ca 0.50 1.07 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 1ajd s LEU 255 Cb -0.41 -2.83 0.09 0.00 0.50 0.00 0.00 46.19 43.55 1ajd s LEU 255 CO 0.54 0.12 0.07 -0.22 -1.32 0.00 0.00 176.35 175.54 1ajd s LEU 256 N -0.19 2.66 -0.42 -0.68 2.96 0.07 -2.51 118.68 120.56 1ajd s LEU 256 Ca 0.29 -1.63 -0.16 0.00 -0.22 0.00 0.00 54.13 52.41 1ajd s LEU 256 Cb -0.17 -1.02 0.02 0.00 0.50 0.00 0.00 46.19 45.52 1ajd s LEU 256 CO 0.15 -0.38 0.35 -0.83 -1.32 0.00 0.00 176.35 174.33 1ajd s GLY 257 N 1.48 1.97 -0.54 7.98 0.00 0.29 -2.34 107.32 116.16 1ajd s GLY 257 Ca 0.08 -1.67 -0.02 0.00 0.00 0.00 0.00 44.72 43.10 1ajd s GLY 257 CO -0.19 1.02 0.34 1.08 0.00 0.00 0.00 173.10 175.34 1ajd s LEU 258 N 1.84 5.17 -0.46 0.66 1.43 -0.95 -0.91 118.68 125.47 1ajd s LEU 258 Ca 0.07 -2.57 0.03 0.00 -1.03 0.00 0.00 54.13 50.64 1ajd s LEU 258 Cb -0.19 -1.83 0.63 0.00 0.03 0.00 0.00 46.19 44.84 1ajd s LEU 258 CO 0.11 -0.42 1.91 0.49 0.23 0.00 0.00 176.35 178.67 1ajd n PHE 259 N 3.86 3.01 0.00 0.29 3.72 -0.21 -4.51 117.46 123.62 1ajd n PHE 259 Ca 0.04 -1.92 0.00 0.00 -0.05 0.00 0.00 57.45 55.52 1ajd n PHE 259 Cb 0.39 -0.98 0.00 0.00 -0.94 0.00 0.00 39.48 37.95 1ajd n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ajd n ALA 260 N -1.08 0.00 0.26 4.37 0.00 -1.26 -4.84 120.51 117.96 1ajd n ALA 260 Ca 0.59 0.00 0.13 0.00 0.00 0.00 0.00 53.44 54.16 1ajd n ALA 260 Cb 1.56 0.00 0.72 0.00 0.00 0.00 0.00 19.45 21.73 1ajd n ALA 260 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1ajd h ASP 261 N 0.00 0.00 0.00 0.00 3.58 -1.93 -0.30 116.42 117.77 1ajd h ASP 261 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1ajd h ASP 261 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1ajd h ASP 261 CO 0.00 0.12 0.00 0.61 -2.88 0.00 0.00 179.24 177.09 1ajd n GLY 262 N -0.61 4.43 3.77 -0.78 0.00 -1.26 -1.36 105.19 109.39 1ajd n GLY 262 Ca -0.02 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 1ajd n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ajd s ASN 263 N 1.12 7.38 0.54 1.61 0.01 -1.26 0.91 114.94 125.25 1ajd s ASN 263 Ca 0.00 1.94 -0.21 0.00 -0.71 0.00 0.00 52.86 53.87 1ajd s ASN 263 Cb 0.00 -2.60 -0.05 0.00 0.41 0.00 0.00 41.25 39.01 1ajd s ASN 263 CO 0.00 -0.04 1.30 -0.04 -1.51 0.00 0.00 177.10 176.81 1ajd s MET 264 N -1.74 3.23 0.40 -0.60 -1.94 -0.60 -4.93 119.30 113.11 1ajd s MET 264 Ca 0.47 2.09 -0.26 0.00 -1.71 0.00 0.00 55.69 56.28 1ajd s MET 264 Cb -0.23 -2.24 -0.10 0.00 2.01 0.00 0.00 34.83 34.27 1ajd s MET 264 CO 0.29 -1.07 1.25 -0.35 -0.01 0.00 0.00 175.02 175.12 1ajd n PRO 265 N -1.01 1.92 -2.22 2.03 -0.04 -1.26 -4.92 135.00 129.50 1ajd n PRO 265 Ca 0.10 0.68 -0.35 0.00 -0.04 0.00 0.00 63.50 63.89 1ajd n PRO 265 Cb 0.46 -2.34 0.01 0.00 -0.04 0.00 0.00 33.50 31.59 1ajd n PRO 265 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ajd s VAL 266 N -1.18 3.11 0.18 0.52 1.01 -1.26 -4.85 120.40 117.93 1ajd s VAL 266 Ca 0.60 0.69 0.04 0.00 0.00 0.00 0.00 61.98 63.30 1ajd s VAL 266 Cb -0.53 -3.27 -0.12 0.00 0.00 0.00 0.00 36.38 32.46 1ajd s VAL 266 CO 0.59 -0.16 1.43 -0.09 0.00 0.00 0.00 175.10 176.87 1ajd h ARG 267 N 1.13 0.17 -4.70 2.72 2.43 -1.89 -3.41 114.38 110.83 1ajd h ARG 267 Ca -0.50 -0.17 -0.52 0.00 -0.81 0.00 0.00 59.98 57.98 1ajd h ARG 267 Cb 1.27 0.05 -0.33 0.00 -0.42 0.00 0.00 29.97 30.53 1ajd h ARG 267 CO 0.57 0.89 -0.82 -1.58 -1.51 0.00 0.00 179.97 177.52 1ajd s TRP 268 N -3.31 1.47 0.32 2.20 0.51 -1.26 -0.40 118.94 118.46 1ajd s TRP 268 Ca -0.03 -0.51 -0.19 0.00 -2.12 0.00 0.00 56.10 53.26 1ajd s TRP 268 Cb 0.11 -1.06 -0.09 0.00 -0.81 0.00 0.00 33.47 31.62 1ajd s TRP 268 CO 0.82 -0.24 0.80 -0.51 -0.51 0.00 0.00 176.95 177.30 1ajd s LEU 269 N 0.50 4.14 -0.18 2.99 1.02 0.28 -3.98 118.68 123.44 1ajd s LEU 269 Ca -0.12 1.46 -0.34 0.00 0.02 0.00 0.00 54.13 55.15 1ajd s LEU 269 Cb -0.14 -4.04 0.14 0.00 0.02 0.00 0.00 46.19 42.17 1ajd s LEU 269 CO 0.03 -0.16 1.18 -0.83 0.02 0.00 0.00 176.35 176.59 1ajd s GLY 270 N -2.02 -0.28 0.74 -3.19 0.00 -1.26 -2.17 107.32 99.14 1ajd s GLY 270 Ca 0.52 1.66 -0.11 0.00 0.00 0.00 0.00 44.72 46.79 1ajd s GLY 270 CO 0.18 0.58 1.11 -4.14 0.00 0.00 0.00 173.10 170.84 1ajd s PRO 271 N -2.31 2.41 0.86 2.90 0.02 -1.26 -4.92 135.00 132.69 1ajd s PRO 271 Ca 0.08 0.22 -0.13 0.00 0.02 0.00 0.00 61.00 61.19 1ajd s PRO 271 Cb -0.01 -2.02 0.12 0.00 0.02 0.00 0.00 34.50 32.61 1ajd s PRO 271 CO -0.05 -1.28 1.22 0.21 -0.33 0.00 0.00 177.00 176.77 1ajd s LYS 272 N -5.43 1.51 0.41 5.54 2.20 -1.26 -4.45 119.74 118.26 1ajd s LYS 272 Ca 0.60 -0.11 -0.15 0.00 -0.36 0.00 0.00 55.97 55.95 1ajd s LYS 272 Cb -0.11 -1.93 -0.08 0.00 -1.51 0.00 0.00 37.83 34.20 1ajd s LYS 272 CO 0.50 -1.86 0.84 0.00 -0.36 0.00 0.00 175.35 174.46 1ajd s ALA 273 N -3.66 3.22 0.09 3.13 0.00 0.52 -4.93 121.76 120.13 1ajd s ALA 273 Ca 0.66 0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.72 1ajd s ALA 273 Cb -0.08 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 1ajd s ALA 273 CO 0.50 0.07 -0.10 0.99 0.00 0.00 0.00 175.76 177.22 1ajd s THR 274 N -2.28 0.89 -0.06 0.00 2.01 -1.10 -4.78 115.64 110.32 1ajd s THR 274 Ca 0.56 -1.65 -0.30 0.00 0.31 0.00 0.00 61.69 60.61 1ajd s THR 274 Cb -0.10 -1.36 -0.05 0.00 0.01 0.00 0.00 72.50 71.00 1ajd s THR 274 CO 0.24 -0.59 1.63 -0.47 -0.69 0.00 0.00 174.62 174.74 1ajd s TYR 275 N -2.53 2.04 -0.98 4.92 5.04 -1.26 -0.39 117.35 124.18 1ajd s TYR 275 Ca 0.05 0.25 -0.05 0.00 -2.44 0.00 0.00 57.07 54.89 1ajd s TYR 275 Cb -0.02 -3.89 0.01 0.00 0.35 0.00 0.00 41.96 38.40 1ajd s TYR 275 CO -0.01 -3.70 0.85 0.72 -1.34 0.00 0.00 175.55 172.07 1ajd n HIS 276 N 7.11 -2.01 0.03 4.97 8.25 -1.26 -4.94 115.22 127.37 1ajd n HIS 276 Ca 0.17 0.74 -0.20 0.00 -0.26 0.00 0.00 57.72 58.18 1ajd n HIS 276 Cb 0.43 -4.11 -0.10 0.00 1.12 0.00 0.00 29.99 27.33 1ajd n HIS 276 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ajd h GLY 277 N -1.85 0.77 1.71 -1.41 0.00 -1.50 -1.01 103.07 99.77 1ajd h GLY 277 Ca -0.43 -1.30 0.00 0.00 0.00 0.00 0.00 47.33 45.60 1ajd h GLY 277 CO 0.40 1.15 0.00 1.16 0.00 0.00 0.00 176.54 179.26 1ajd n ASN 278 N -3.91 0.00 -0.02 0.19 6.94 -1.25 -2.11 115.26 115.10 1ajd n ASN 278 Ca -0.10 0.25 -0.04 0.00 -0.02 0.00 0.00 54.58 54.66 1ajd n ASN 278 Cb 0.84 -0.36 -0.02 0.00 -2.36 0.00 0.00 39.78 37.88 1ajd n ASN 278 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 1ajd n ILE 279 N -1.36 0.26 1.13 1.53 -5.35 -1.22 -4.74 119.36 109.61 1ajd n ILE 279 Ca 0.05 -0.09 0.05 0.00 -0.27 0.00 0.00 62.75 62.49 1ajd n ILE 279 Cb 0.10 -0.98 0.14 0.00 -1.74 0.00 0.00 39.64 37.17 1ajd n ILE 279 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1ajd n ASP 280 N -2.84 1.49 -3.67 7.28 8.00 -0.39 -4.85 116.55 121.57 1ajd n ASP 280 Ca -0.08 -1.98 -0.12 0.00 0.71 0.00 0.00 54.79 53.32 1ajd n ASP 280 Cb 0.58 -0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.44 1ajd n ASP 280 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1ajd s LYS 281 N -1.64 0.93 0.73 -1.24 3.01 -0.90 -4.99 119.74 115.65 1ajd s LYS 281 Ca 0.20 -0.45 -0.11 0.00 -1.01 0.00 0.00 55.97 54.59 1ajd s LYS 281 Cb 0.10 0.41 0.03 0.00 -1.01 0.00 0.00 37.83 37.36 1ajd s LYS 281 CO 0.14 -0.33 1.08 -1.25 0.51 0.00 0.00 175.35 175.50 1ajd s PRO 282 N -2.74 2.64 0.56 -1.68 0.04 -1.26 -4.65 135.00 127.90 1ajd s PRO 282 Ca -0.04 0.66 -0.21 0.00 0.04 0.00 0.00 61.00 61.45 1ajd s PRO 282 Cb -0.00 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 1ajd s PRO 282 CO -0.04 -1.23 1.36 0.00 0.04 0.00 0.00 177.00 177.13 1ajd s ALA 283 N -3.20 2.78 0.04 8.56 0.00 -1.26 -4.76 121.76 123.92 1ajd s ALA 283 Ca 0.59 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1ajd s ALA 283 Cb -0.13 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.37 1ajd s ALA 283 CO 0.54 -1.43 0.14 0.08 0.00 0.00 0.00 175.76 175.08 1ajd s VAL 284 N -1.30 4.99 -0.29 0.00 1.01 -0.09 -4.84 120.40 119.88 1ajd s VAL 284 Ca 0.73 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.22 1ajd s VAL 284 Cb -0.41 -3.37 0.09 0.00 0.00 0.00 0.00 36.38 32.69 1ajd s VAL 284 CO 0.48 0.22 0.09 -0.89 0.00 0.00 0.00 175.10 175.00 1ajd s THR 285 N -1.37 0.65 0.60 3.92 2.01 -1.26 -0.81 115.64 119.37 1ajd s THR 285 Ca 0.29 -1.14 -0.18 0.00 0.31 0.00 0.00 61.69 60.97 1ajd s THR 285 Cb -0.12 -1.44 -0.08 0.00 0.01 0.00 0.00 72.50 70.87 1ajd s THR 285 CO 0.21 -0.61 0.50 0.00 -0.69 0.00 0.00 174.62 174.04 1ajd s THR 287 N -1.76 0.53 0.18 0.00 -1.32 -0.92 -4.99 115.64 107.35 1ajd s THR 287 Ca 0.68 -1.13 -0.33 0.00 -1.21 0.00 0.00 61.69 59.69 1ajd s THR 287 Cb -0.43 -0.67 -0.13 0.00 -1.51 0.00 0.00 72.50 69.77 1ajd s THR 287 CO 0.55 -0.42 1.65 -2.65 -2.21 0.00 0.00 174.62 171.54 1ajd n PRO 288 N 1.36 2.42 -2.35 7.08 -0.02 -1.26 0.99 135.00 143.22 1ajd n PRO 288 Ca -0.22 0.87 -0.43 0.00 -2.02 0.00 0.00 63.50 61.70 1ajd n PRO 288 Cb 0.55 -2.68 -0.02 0.00 -0.02 0.00 0.00 33.50 31.33 1ajd n PRO 288 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1ajd s ASN 289 N 1.08 6.66 0.00 2.55 2.47 0.46 -4.55 114.94 123.61 1ajd s ASN 289 Ca 0.77 1.39 0.00 0.00 0.42 0.00 0.00 52.86 55.45 1ajd s ASN 289 Cb -0.60 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 36.66 1ajd s ASN 289 CO 0.36 -1.06 0.94 -2.65 -3.72 0.00 0.00 177.10 170.96 1ajd n PRO 290 N 7.27 0.00 0.03 0.43 -0.02 -1.26 -1.23 135.00 140.21 1ajd n PRO 290 Ca 0.15 0.44 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 1ajd n PRO 290 Cb 0.46 -1.52 0.13 0.00 -0.02 0.00 0.00 33.50 32.56 1ajd n PRO 290 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1ajd n GLN 291 N -1.44 0.20 -0.30 -0.52 6.02 -1.26 -4.26 117.38 115.82 1ajd n GLN 291 Ca 0.00 0.03 0.12 0.00 -0.01 0.00 0.00 57.00 57.14 1ajd n GLN 291 Cb 0.02 -1.60 0.26 0.00 1.02 0.00 0.00 30.24 29.94 1ajd n GLN 291 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1ajd h ARG 292 N 0.00 0.12 -0.98 -1.09 0.11 -1.40 -3.47 114.38 107.67 1ajd h ARG 292 Ca 0.00 -0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.17 1ajd h ARG 292 Cb 0.66 -0.03 -0.05 0.00 1.11 0.00 0.00 29.97 31.67 1ajd h ARG 292 CO 0.00 0.08 -0.34 0.09 0.10 0.00 0.00 179.97 179.90 1ajd n ASN 293 N -5.33 -2.25 0.02 0.08 3.02 -1.26 -4.31 115.26 105.22 1ajd n ASN 293 Ca 0.20 0.39 0.11 0.00 -0.03 0.00 0.00 54.58 55.25 1ajd n ASN 293 Cb 0.66 -1.39 -0.08 0.00 -0.61 0.00 0.00 39.78 38.37 1ajd n ASN 293 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ajd n ASP 294 N -2.73 0.45 0.02 6.41 2.03 -1.26 -3.94 116.55 117.52 1ajd n ASP 294 Ca -0.02 -0.14 0.11 0.00 0.52 0.00 0.00 54.79 55.26 1ajd n ASP 294 Cb 0.19 1.26 -0.05 0.00 -0.72 0.00 0.00 41.12 41.80 1ajd n ASP 294 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1ajd n SER 295 N -2.14 0.54 -4.60 1.67 3.41 -1.26 -4.80 113.62 106.45 1ajd n SER 295 Ca -0.01 -0.28 -0.37 0.00 -0.26 0.00 0.00 58.87 57.96 1ajd n SER 295 Cb 0.50 1.12 -0.11 0.00 -0.26 0.00 0.00 64.21 65.45 1ajd n SER 295 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ajd s VAL 296 N -3.25 5.14 0.41 -3.33 1.01 -1.25 -0.77 120.40 118.35 1ajd s VAL 296 Ca 0.01 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.84 1ajd s VAL 296 Cb 0.14 -3.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.02 1ajd s VAL 296 CO 0.84 0.31 1.32 -2.16 0.00 0.00 0.00 175.10 175.41 1ajd s PRO 297 N 1.39 3.94 0.66 2.72 0.04 -1.26 -4.77 135.00 137.72 1ajd s PRO 297 Ca 0.07 2.20 -0.03 0.00 0.04 0.00 0.00 61.00 63.27 1ajd s PRO 297 Cb -0.15 -2.75 0.07 0.00 0.04 0.00 0.00 34.50 31.71 1ajd s PRO 297 CO 0.07 -0.53 0.93 0.95 0.04 0.00 0.00 177.00 178.46 1ajd s THR 298 N -1.25 2.39 0.12 1.26 -4.23 -1.26 -4.89 115.64 107.77 1ajd s THR 298 Ca 0.57 -0.46 -0.21 0.00 -1.18 0.00 0.00 61.69 60.42 1ajd s THR 298 Cb -0.39 -2.93 -0.06 0.00 1.34 0.00 0.00 72.50 70.46 1ajd s THR 298 CO 0.50 0.00 1.71 0.25 -0.54 0.00 0.00 174.62 176.54 1ajd h LEU 299 N -0.38 -0.16 -1.17 4.79 5.85 -1.95 -1.91 115.31 120.37 1ajd h LEU 299 Ca -0.42 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1ajd h LEU 299 Cb 1.30 0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.43 1ajd h LEU 299 CO 0.53 -0.06 0.00 0.00 -0.34 0.00 0.00 178.44 178.57 1ajd h ALA 300 N 1.13 1.00 0.00 1.25 0.00 -1.86 -1.27 119.26 119.51 1ajd h ALA 300 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1ajd h ALA 300 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ajd h ALA 300 CO -0.16 0.00 -0.23 1.96 0.00 0.00 0.00 179.25 180.82 1ajd h GLN 301 N 0.00 0.00 -0.44 0.00 4.20 -1.75 -2.03 115.11 115.10 1ajd h GLN 301 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ajd h GLN 301 Cb 0.30 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1ajd h GLN 301 CO 0.00 0.99 0.27 0.52 -0.67 0.00 0.00 178.83 179.94 1ajd h MET 302 N -1.00 0.60 -0.47 1.46 2.86 -1.25 -0.09 114.93 117.04 1ajd h MET 302 Ca -0.06 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1ajd h MET 302 Cb 1.05 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.53 1ajd h MET 302 CO -0.04 0.44 0.19 1.15 1.06 0.00 0.00 176.91 179.71 1ajd h THR 303 N 0.58 0.88 -0.18 2.22 2.02 -1.35 0.02 112.91 117.11 1ajd h THR 303 Ca 0.16 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1ajd h THR 303 Cb -0.00 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1ajd h THR 303 CO -0.03 0.07 0.08 -0.78 0.37 0.00 0.00 175.52 175.23 1ajd h ASP 304 N 0.38 0.23 0.25 4.18 1.82 -0.91 -2.60 116.42 119.77 1ajd h ASP 304 Ca 0.22 -0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.72 1ajd h ASP 304 Cb 0.19 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.13 1ajd h ASP 304 CO -0.20 0.30 -0.19 0.50 -1.61 0.00 0.00 179.24 178.04 1ajd h LYS 305 N 0.15 -0.43 -0.92 0.28 1.63 -0.71 -1.48 116.57 115.09 1ajd h LYS 305 Ca 0.06 0.03 0.18 0.00 -0.85 0.00 0.00 60.65 60.06 1ajd h LYS 305 Cb 0.13 0.10 -0.08 0.00 -0.60 0.00 0.00 32.23 31.78 1ajd h LYS 305 CO -0.01 -0.29 0.59 0.00 -3.45 0.00 0.00 179.45 176.30 1ajd h ALA 306 N 0.27 1.93 -0.15 5.00 0.00 -0.95 0.46 119.26 125.82 1ajd h ALA 306 Ca -0.02 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1ajd h ALA 306 Cb 0.39 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ajd h ALA 306 CO -0.00 -0.22 -0.64 0.82 0.00 0.00 0.00 179.25 179.21 1ajd h ILE 307 N 0.61 1.33 -0.67 0.00 2.04 -1.18 -0.08 117.51 119.56 1ajd h ILE 307 Ca 0.49 -1.93 -0.03 0.00 1.00 0.00 0.00 64.86 64.38 1ajd h ILE 307 Cb 0.92 1.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.88 1ajd h ILE 307 CO -0.23 0.59 0.29 -0.08 0.00 0.00 0.00 178.15 178.72 1ajd h GLU 308 N 0.40 0.99 0.12 2.37 4.81 0.83 -0.81 114.58 123.29 1ajd h GLU 308 Ca -0.01 -0.17 -0.28 0.00 -0.13 0.00 0.00 59.36 58.77 1ajd h GLU 308 Cb 1.20 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1ajd h GLU 308 CO 0.12 0.81 -1.27 -0.07 -0.73 0.00 0.00 179.01 177.88 1ajd h LEU 309 N 0.94 0.41 0.00 1.64 3.38 -0.64 -3.34 115.31 117.71 1ajd h LEU 309 Ca 0.23 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1ajd h LEU 309 Cb 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ajd h LEU 309 CO -0.02 1.36 -0.24 -0.07 0.09 0.00 0.00 178.44 179.55 1ajd h LEU 310 N 0.07 0.00 0.00 1.67 4.07 -0.93 -3.27 115.31 116.92 1ajd h LEU 310 Ca -0.14 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.82 1ajd h LEU 310 Cb 1.97 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.71 1ajd h LEU 310 CO 0.20 0.17 0.00 -1.54 -1.08 0.00 0.00 178.44 176.19 1ajd n SER 311 N -3.11 0.00 0.06 -0.43 3.41 -0.32 -2.30 113.62 110.94 1ajd n SER 311 Ca 0.03 -0.40 -0.18 0.00 -0.26 0.00 0.00 58.87 58.06 1ajd n SER 311 Cb 0.60 -0.10 -0.09 0.00 -0.26 0.00 0.00 64.21 64.36 1ajd n SER 311 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ajd h LYS 312 N 0.00 0.56 -5.83 4.33 1.79 -1.76 -3.42 116.57 112.23 1ajd h LYS 312 Ca 0.00 -0.63 -0.52 0.00 -2.18 0.00 0.00 60.65 57.31 1ajd h LYS 312 Cb 0.07 0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1ajd h LYS 312 CO 0.00 1.25 1.54 1.21 -1.08 0.00 0.00 179.45 182.36 1ajd s ASN 313 N -7.23 4.98 0.65 0.86 3.84 -0.97 -4.80 114.94 112.27 1ajd s ASN 313 Ca -0.08 1.36 0.41 0.00 0.21 0.00 0.00 52.86 54.76 1ajd s ASN 313 Cb 0.07 -2.51 2.29 0.00 -0.55 0.00 0.00 41.25 40.56 1ajd s ASN 313 CO 0.90 -2.42 2.34 1.05 -2.79 0.00 0.00 177.10 176.19 1ajd h GLU 314 N 17.08 0.00 0.00 0.43 4.11 -1.88 -2.10 114.58 132.22 1ajd h GLU 314 Ca -0.31 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 58.95 1ajd h GLU 314 Cb 1.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 1ajd h GLU 314 CO 1.08 0.00 -0.78 0.87 0.07 0.00 0.00 179.01 180.25 1ajd h LYS 315 N 0.00 0.00 0.00 1.06 1.79 -1.89 -3.50 116.57 114.03 1ajd h LYS 315 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ajd h LYS 315 Cb 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1ajd h LYS 315 CO -0.00 0.78 0.00 0.41 -1.08 0.00 0.00 179.45 179.56 1ajd n GLY 316 N 1.28 0.82 3.30 3.86 0.00 -0.79 -4.88 105.19 108.78 1ajd n GLY 316 Ca 0.01 -2.19 -0.12 0.00 0.00 0.00 0.00 46.02 43.72 1ajd n GLY 316 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ajd s PHE 317 N -0.92 -0.20 -0.14 1.61 -0.12 -1.25 -0.74 117.98 116.22 1ajd s PHE 317 Ca 0.00 0.06 0.02 0.00 -0.05 0.00 0.00 56.93 56.97 1ajd s PHE 317 Cb 0.00 0.19 0.01 0.00 -0.63 0.00 0.00 43.02 42.59 1ajd s PHE 317 CO 0.00 -0.58 -0.22 0.12 -0.05 0.00 0.00 175.22 174.49 1ajd s PHE 318 N -2.82 2.64 -0.02 3.49 5.36 -0.25 -1.35 117.98 125.03 1ajd s PHE 318 Ca -0.03 -1.34 0.03 0.00 -0.96 0.00 0.00 56.93 54.63 1ajd s PHE 318 Cb -0.00 -1.80 -0.00 0.00 -0.34 0.00 0.00 43.02 40.88 1ajd s PHE 318 CO -0.05 -0.61 -0.10 -1.17 -1.46 0.00 0.00 175.22 171.83 1ajd s LEU 319 N 0.83 1.86 -0.07 6.12 2.96 -0.77 -0.16 118.68 129.46 1ajd s LEU 319 Ca -0.07 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.69 1ajd s LEU 319 Cb -0.15 -0.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.94 1ajd s LEU 319 CO -0.02 0.09 -0.24 -1.58 -1.32 0.00 0.00 176.35 173.28 1ajd s GLN 320 N 0.06 2.65 -0.13 1.98 0.74 -0.76 -0.74 119.66 123.47 1ajd s GLN 320 Ca -0.01 -0.87 0.00 0.00 0.05 0.00 0.00 55.36 54.53 1ajd s GLN 320 Cb -0.08 -2.16 0.02 0.00 1.10 0.00 0.00 33.01 31.89 1ajd s GLN 320 CO 0.00 0.30 -0.13 0.08 -0.55 0.00 0.00 175.29 175.00 1ajd s VAL 321 N 0.02 1.40 -0.18 1.34 1.01 0.25 -0.76 120.40 123.49 1ajd s VAL 321 Ca -0.09 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1ajd s VAL 321 Cb -0.15 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.91 1ajd s VAL 321 CO 0.05 0.43 -0.16 -0.70 0.00 0.00 0.00 175.10 174.72 1ajd s GLU 322 N 1.43 3.11 -0.81 2.72 2.12 0.20 -0.15 118.70 127.31 1ajd s GLU 322 Ca 0.02 -0.78 -0.23 0.00 0.36 0.00 0.00 54.97 54.35 1ajd s GLU 322 Cb -0.13 -2.65 0.07 0.00 0.26 0.00 0.00 34.13 31.68 1ajd s GLU 322 CO -0.08 -0.14 1.17 0.20 -0.54 0.00 0.00 175.26 175.86 1ajd s GLY 323 N 1.18 1.38 0.11 -1.50 0.00 -0.19 -2.76 107.32 105.54 1ajd s GLY 323 Ca 0.02 -2.05 -0.13 0.00 0.00 0.00 0.00 44.72 42.56 1ajd s GLY 323 CO -0.07 2.30 1.36 0.00 0.00 0.00 0.00 173.10 176.68 1ajd h ALA 324 N 9.53 0.38 0.00 3.20 0.00 -1.86 -2.24 119.26 128.27 1ajd h ALA 324 Ca -0.08 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1ajd h ALA 324 Cb 1.04 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1ajd h ALA 324 CO 1.23 0.64 0.00 0.43 0.00 0.00 0.00 179.25 181.55 1ajd n SER 325 N -4.02 0.00 -0.20 0.00 7.64 -1.26 -3.64 113.62 112.13 1ajd n SER 325 Ca -0.06 -0.19 -0.00 0.00 1.01 0.00 0.00 58.87 59.63 1ajd n SER 325 Cb 0.65 -0.26 0.10 0.00 -1.01 0.00 0.00 64.21 63.70 1ajd n SER 325 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1ajd h ILE 326 N 0.00 0.76 -0.21 0.44 2.04 -1.74 0.28 117.51 119.08 1ajd h ILE 326 Ca 0.00 -0.13 -0.21 0.00 1.00 0.00 0.00 64.86 65.52 1ajd h ILE 326 Cb 0.24 0.34 0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1ajd h ILE 326 CO 0.00 0.07 -0.68 -0.78 0.00 0.00 0.00 178.15 176.76 1ajd h ASP 327 N 0.38 0.95 0.19 1.72 1.82 -1.14 -2.79 116.42 117.56 1ajd h ASP 327 Ca 0.30 -0.59 -0.03 0.00 -0.39 0.00 0.00 57.03 56.31 1ajd h ASP 327 Cb 0.37 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 40.10 1ajd h ASP 327 CO -0.31 1.38 -0.16 0.11 -1.61 0.00 0.00 179.24 178.65 1ajd h LYS 328 N 0.58 0.00 0.00 0.28 1.57 -1.35 -2.10 116.57 115.55 1ajd h LYS 328 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ajd h LYS 328 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1ajd h LYS 328 CO 0.14 0.16 -0.73 1.04 -0.57 0.00 0.00 179.45 179.49 1ajd n GLN 329 N -4.24 0.01 0.07 3.15 1.13 0.88 -2.59 117.38 115.80 1ajd n GLN 329 Ca -0.02 -0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.88 1ajd n GLN 329 Cb 0.23 -1.50 -0.14 0.00 0.11 0.00 0.00 30.24 28.94 1ajd n GLN 329 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1ajd h ASP 330 N 0.00 0.36 -0.17 1.08 1.82 -1.11 -2.32 116.42 116.08 1ajd h ASP 330 Ca 0.00 -0.47 -0.19 0.00 -0.39 0.00 0.00 57.03 55.98 1ajd h ASP 330 Cb 0.51 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.40 1ajd h ASP 330 CO 0.00 1.38 -0.61 0.45 -1.61 0.00 0.00 179.24 178.85 1ajd h HIS 331 N 0.06 1.00 0.00 0.28 3.86 -1.51 -3.09 115.15 115.76 1ajd h HIS 331 Ca -0.20 -0.38 0.00 0.00 -1.16 0.00 0.00 60.37 58.63 1ajd h HIS 331 Cb 1.99 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 30.28 1ajd h HIS 331 CO 0.06 1.19 0.00 0.00 0.86 0.00 0.00 177.93 180.04 1ajd n ALA 332 N -2.57 1.56 -4.02 2.45 0.00 -1.07 -2.28 120.51 114.59 1ajd n ALA 332 Ca -0.05 -0.04 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 1ajd n ALA 332 Cb 0.66 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1ajd n ALA 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ajd n ALA 333 N -1.44 -1.46 -3.81 0.00 0.00 -0.93 -4.68 120.51 108.19 1ajd n ALA 333 Ca 0.03 0.02 -0.30 0.00 0.00 0.00 0.00 53.44 53.19 1ajd n ALA 333 Cb 0.12 -3.42 -0.14 0.00 0.00 0.00 0.00 19.45 16.01 1ajd n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ajd s ASN 334 N -3.57 4.06 0.22 0.00 3.84 -0.92 0.19 114.94 118.77 1ajd s ASN 334 Ca 0.53 -2.36 -0.07 0.00 0.21 0.00 0.00 52.86 51.16 1ajd s ASN 334 Cb -0.28 -1.20 0.35 0.00 -0.55 0.00 0.00 41.25 39.57 1ajd s ASN 334 CO 0.87 -0.32 1.75 -0.65 -2.79 0.00 0.00 177.10 175.97 1ajd h PRO 335 N 7.19 0.47 -0.74 0.43 0.11 -1.80 -2.12 132.00 135.53 1ajd h PRO 335 Ca -0.06 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.05 1ajd h PRO 335 Cb 0.96 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.92 1ajd h PRO 335 CO 0.52 0.31 0.47 0.00 -0.21 0.00 0.00 178.00 179.09 1ajd h GLY 337 N 0.94 0.80 0.94 0.00 0.00 -1.63 -1.28 103.07 102.85 1ajd h GLY 337 Ca 0.29 -0.97 0.01 0.00 0.00 0.00 0.00 47.33 46.66 1ajd h GLY 337 CO -0.09 0.87 0.16 -1.61 0.00 0.00 0.00 176.54 175.87 1ajd h GLN 338 N 0.55 0.33 -0.16 4.80 4.15 -0.94 -2.72 115.11 121.12 1ajd h GLN 338 Ca 0.00 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.35 1ajd h GLN 338 Cb 1.17 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.78 1ajd h GLN 338 CO 0.12 0.22 -0.10 0.82 -1.93 0.00 0.00 178.83 177.95 1ajd h ILE 339 N 0.34 1.32 -0.69 2.39 2.04 -0.96 -3.05 117.51 118.89 1ajd h ILE 339 Ca 0.11 -1.19 0.13 0.00 1.00 0.00 0.00 64.86 64.91 1ajd h ILE 339 Cb -0.01 1.75 -0.09 0.00 -0.74 0.00 0.00 36.82 37.73 1ajd h ILE 339 CO -0.05 0.35 0.23 1.23 0.00 0.00 0.00 178.15 179.91 1ajd h GLY 340 N 0.03 0.98 1.15 5.37 0.00 -1.20 -0.04 103.07 109.35 1ajd h GLY 340 Ca 0.03 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.31 1ajd h GLY 340 CO 0.03 -0.10 0.48 0.83 0.00 0.00 0.00 176.54 177.77 1ajd h GLU 341 N 0.37 0.83 -0.23 4.80 4.39 -1.46 -1.42 114.58 121.86 1ajd h GLU 341 Ca 0.37 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.88 1ajd h GLU 341 Cb 0.56 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1ajd h GLU 341 CO -0.40 0.55 -0.44 1.15 -1.16 0.00 0.00 179.01 178.71 1ajd h THR 342 N 0.86 1.31 -0.23 1.13 2.02 -0.93 -0.91 112.91 116.14 1ajd h THR 342 Ca 0.29 -1.62 -0.03 0.00 0.77 0.00 0.00 66.41 65.82 1ajd h THR 342 Cb 0.09 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1ajd h THR 342 CO -0.09 0.51 0.02 0.58 0.37 0.00 0.00 175.52 176.91 1ajd h VAL 343 N 0.45 1.24 -0.50 3.16 2.07 -0.77 -1.67 116.25 120.23 1ajd h VAL 343 Ca 0.03 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.77 1ajd h VAL 343 Cb 0.94 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1ajd h VAL 343 CO 0.08 0.26 0.24 -0.78 0.02 0.00 0.00 177.57 177.40 1ajd h ASP 344 N 0.19 0.34 -0.23 0.57 3.58 -1.08 -2.09 116.42 117.70 1ajd h ASP 344 Ca 0.07 0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.56 1ajd h ASP 344 Cb 0.37 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 1ajd h ASP 344 CO 0.01 0.24 0.12 0.25 -2.88 0.00 0.00 179.24 176.97 1ajd h LEU 345 N 0.48 0.18 -0.72 2.28 5.85 -0.99 -2.56 115.31 119.82 1ajd h LEU 345 Ca 0.22 0.01 0.16 0.00 0.84 0.00 0.00 57.88 59.11 1ajd h LEU 345 Cb 0.14 -0.03 -0.13 0.00 0.37 0.00 0.00 40.66 41.01 1ajd h LEU 345 CO -0.16 0.14 -0.05 -0.78 -0.34 0.00 0.00 178.44 177.24 1ajd h ASP 346 N 0.25 -0.44 -0.74 1.25 3.58 -0.66 0.28 116.42 119.94 1ajd h ASP 346 Ca 0.09 0.20 -0.03 0.00 0.42 0.00 0.00 57.03 57.71 1ajd h ASP 346 Cb 0.02 0.37 -0.04 0.00 1.72 0.00 0.00 39.33 41.40 1ajd h ASP 346 CO -0.06 -0.19 0.36 -0.33 -2.88 0.00 0.00 179.24 176.14 1ajd h GLU 347 N 0.07 1.08 -0.50 0.28 5.08 -1.08 -1.36 114.58 118.15 1ajd h GLU 347 Ca 0.38 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.51 1ajd h GLU 347 Cb 0.64 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1ajd h GLU 347 CO -0.67 0.84 0.03 0.00 -1.00 0.00 0.00 179.01 178.21 1ajd h ALA 348 N 1.32 0.67 -0.25 3.43 0.00 -0.20 -2.40 119.26 121.83 1ajd h ALA 348 Ca 0.26 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ajd h ALA 348 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ajd h ALA 348 CO -0.03 0.45 0.02 0.28 0.00 0.00 0.00 179.25 179.97 1ajd h VAL 349 N 0.73 1.14 0.00 0.00 2.07 -0.45 -0.88 116.25 118.87 1ajd h VAL 349 Ca 0.15 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1ajd h VAL 349 Cb 0.47 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1ajd h VAL 349 CO 0.02 0.18 -0.00 1.56 0.02 0.00 0.00 177.57 179.35 1ajd h GLN 350 N 0.35 -0.01 -0.69 1.57 4.20 -0.99 -0.50 115.11 119.06 1ajd h GLN 350 Ca 0.08 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.91 1ajd h GLN 350 Cb 0.20 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.90 1ajd h GLN 350 CO 0.00 0.27 0.26 0.00 -0.67 0.00 0.00 178.83 178.70 1ajd h ARG 351 N -0.28 0.42 0.35 1.46 2.47 -0.89 0.47 114.38 118.37 1ajd h ARG 351 Ca -0.00 -0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1ajd h ARG 351 Cb 0.28 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.48 1ajd h ARG 351 CO 0.00 0.28 -0.34 0.00 0.56 0.00 0.00 179.97 180.47 1ajd h ALA 352 N 1.48 -0.73 -0.59 0.04 0.00 -0.88 -2.57 119.26 116.01 1ajd h ALA 352 Ca 0.36 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ajd h ALA 352 Cb 0.49 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1ajd h ALA 352 CO -0.35 -0.95 0.39 -0.07 0.00 0.00 0.00 179.25 178.27 1ajd h LEU 353 N -0.71 0.67 -0.26 0.00 -0.00 -0.09 0.78 115.31 115.69 1ajd h LEU 353 Ca -0.02 -0.02 -0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1ajd h LEU 353 Cb 0.64 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.12 1ajd h LEU 353 CO -0.06 0.48 0.16 -0.33 -0.00 0.00 0.00 178.44 178.69 1ajd h GLU 354 N 0.79 0.36 0.37 1.13 4.39 0.13 -1.39 114.58 120.35 1ajd h GLU 354 Ca 0.22 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 1ajd h GLU 354 Cb -0.07 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 1ajd h GLU 354 CO -0.05 0.28 -0.18 0.35 -1.16 0.00 0.00 179.01 178.25 1ajd h PHE 355 N 0.34 -0.45 -0.43 4.33 3.57 -1.03 -2.88 116.94 120.39 1ajd h PHE 355 Ca 0.10 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.67 1ajd h PHE 355 Cb 0.01 0.15 -0.09 0.00 2.79 0.00 0.00 35.95 38.82 1ajd h PHE 355 CO -0.05 -0.12 -0.16 0.00 -2.23 0.00 0.00 178.31 175.76 1ajd h ALA 356 N -0.46 0.20 -0.87 2.41 0.00 -0.88 0.19 119.26 119.85 1ajd h ALA 356 Ca -0.05 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.11 1ajd h ALA 356 Cb 0.54 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1ajd h ALA 356 CO 0.08 -0.50 0.56 -0.22 0.00 0.00 0.00 179.25 179.17 1ajd h LYS 357 N -0.06 0.84 0.05 0.00 3.64 -1.33 -1.00 116.57 118.70 1ajd h LYS 357 Ca 0.21 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.39 1ajd h LYS 357 Cb 0.38 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1ajd h LYS 357 CO -0.47 0.55 -0.62 -0.22 -2.27 0.00 0.00 179.45 176.42 1ajd h LYS 358 N 0.86 0.33 -0.29 1.90 3.64 -0.91 -3.32 116.57 118.78 1ajd h LYS 358 Ca 0.40 -0.42 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1ajd h LYS 358 Cb 0.39 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1ajd h LYS 358 CO -0.16 1.13 -0.15 1.49 -2.27 0.00 0.00 179.45 179.49 1ajd h GLU 359 N -0.26 0.51 0.00 1.90 4.22 -0.39 -3.47 114.58 117.08 1ajd h GLU 359 Ca -0.09 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 59.19 1ajd h GLU 359 Cb 1.38 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1ajd h GLU 359 CO 0.12 0.65 0.00 0.41 -2.18 0.00 0.00 179.01 178.01 1ajd n GLY 360 N -0.58 2.79 2.56 1.92 0.00 -0.41 -4.85 105.19 106.63 1ajd n GLY 360 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1ajd n GLY 360 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ajd n ASN 361 N 0.00 2.15 -4.31 1.61 3.02 -1.26 -4.94 115.26 111.53 1ajd n ASN 361 Ca 0.00 -3.01 -0.17 0.00 -0.03 0.00 0.00 54.58 51.37 1ajd n ASN 361 Cb 0.00 -0.53 -0.10 0.00 -0.61 0.00 0.00 39.78 38.54 1ajd n ASN 361 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1ajd s THR 362 N -3.55 1.54 -0.18 3.41 2.01 -1.26 -1.46 115.64 116.14 1ajd s THR 362 Ca 0.34 -2.10 0.00 0.00 0.31 0.00 0.00 61.69 60.25 1ajd s THR 362 Cb 0.42 -1.92 0.04 0.00 0.01 0.00 0.00 72.50 71.05 1ajd s THR 362 CO -0.03 -0.60 -0.08 -0.22 -0.69 0.00 0.00 174.62 172.99 1ajd s LEU 363 N -3.14 1.90 -0.16 4.42 2.96 -0.89 -3.56 118.68 120.21 1ajd s LEU 363 Ca 0.19 -0.75 -0.02 0.00 -0.22 0.00 0.00 54.13 53.33 1ajd s LEU 363 Cb -0.01 -1.06 -0.01 0.00 0.50 0.00 0.00 46.19 45.61 1ajd s LEU 363 CO 0.05 -0.16 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.13 1ajd s VAL 364 N 1.52 3.19 -0.04 1.68 1.01 -0.48 0.23 120.40 127.52 1ajd s VAL 364 Ca 0.00 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.45 1ajd s VAL 364 Cb -0.16 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 1ajd s VAL 364 CO -0.08 0.49 -0.21 -0.63 0.00 0.00 0.00 175.10 174.67 1ajd s ILE 365 N 0.77 1.73 -0.10 2.22 1.01 0.12 -1.23 121.20 125.72 1ajd s ILE 365 Ca -0.04 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.71 1ajd s ILE 365 Cb -0.15 -1.46 0.02 0.00 0.01 0.00 0.00 42.46 40.88 1ajd s ILE 365 CO 0.01 0.49 -0.11 -0.69 0.00 0.00 0.00 174.94 174.64 1ajd s VAL 366 N -0.24 1.18 0.17 2.92 1.01 -0.85 0.33 120.40 124.92 1ajd s VAL 366 Ca 0.01 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 1ajd s VAL 366 Cb -0.11 -1.13 0.04 0.00 0.00 0.00 0.00 36.38 35.18 1ajd s VAL 366 CO 0.01 0.38 0.50 1.07 0.00 0.00 0.00 175.10 177.07 1ajd n THR 367 N 4.42 0.00 -4.57 3.92 5.66 -0.37 -2.46 114.28 120.88 1ajd n THR 367 Ca -0.18 -0.45 -0.26 0.00 -3.05 0.00 0.00 64.05 60.12 1ajd n THR 367 Cb 0.51 0.50 -0.11 0.00 -1.55 0.00 0.00 70.33 69.68 1ajd n THR 367 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ajd s ALA 368 N -1.59 2.97 0.03 1.79 0.00 -1.26 -0.30 121.76 123.40 1ajd s ALA 368 Ca 0.11 -2.10 0.03 0.00 0.00 0.00 0.00 51.96 50.00 1ajd s ALA 368 Cb -0.02 0.33 -0.25 0.00 0.00 0.00 0.00 23.12 23.18 1ajd s ALA 368 CO 0.05 -0.18 0.94 0.38 0.00 0.00 0.00 175.76 176.95 1ajd h ASP 369 N 1.85 0.20 -4.88 0.00 2.03 -1.92 -3.48 116.42 110.23 1ajd h ASP 369 Ca -0.43 -0.28 0.17 0.00 -0.73 0.00 0.00 57.03 55.76 1ajd h ASP 369 Cb 1.25 -0.07 -0.13 0.00 -0.83 0.00 0.00 39.33 39.55 1ajd h ASP 369 CO 0.77 1.23 0.56 -1.38 -1.03 0.00 0.00 179.24 179.39 1ajd s HIS 370 N -2.64 -0.23 1.05 4.15 -3.43 -1.26 -4.87 115.29 108.06 1ajd s HIS 370 Ca -0.05 0.06 -0.17 0.00 -0.80 0.00 0.00 55.06 54.10 1ajd s HIS 370 Cb 0.08 0.56 0.23 0.00 -1.43 0.00 0.00 32.58 32.03 1ajd s HIS 370 CO 0.84 -0.55 1.25 0.00 -2.00 0.00 0.00 174.74 174.28 1ajd s ALA 371 N -3.01 1.65 0.00 -1.38 0.00 -1.13 -3.84 121.76 114.05 1ajd s ALA 371 Ca 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.92 1ajd s ALA 371 Cb -0.01 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1ajd s ALA 371 CO -0.05 -2.87 0.00 1.58 0.00 0.00 0.00 175.76 174.42 1ajd n HIS 372 N -4.13 0.00 -0.07 0.00 -0.00 -1.26 -1.68 115.22 108.08 1ajd n HIS 372 Ca 0.15 0.00 -0.06 0.00 0.46 0.00 0.00 57.72 58.26 1ajd n HIS 372 Cb 0.59 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.43 1ajd n HIS 372 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1ajd h ALA 373 N 1.03 0.04 -0.85 1.57 0.00 -1.84 -3.34 119.26 115.86 1ajd h ALA 373 Ca 0.00 -0.51 -0.65 0.00 0.00 0.00 0.00 54.91 53.76 1ajd h ALA 373 Cb 0.00 0.42 0.06 0.00 0.00 0.00 0.00 17.79 18.27 1ajd h ALA 373 CO 0.00 0.42 -0.08 -1.13 0.00 0.00 0.00 179.25 178.46 1ajd n SER 374 N -4.62 -0.28 -3.78 0.00 3.41 -1.24 -4.54 113.62 102.57 1ajd n SER 374 Ca -0.09 0.98 -0.17 0.00 -0.26 0.00 0.00 58.87 59.33 1ajd n SER 374 Cb 0.28 -0.79 -0.16 0.00 -0.26 0.00 0.00 64.21 63.28 1ajd n SER 374 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ajd s GLN 375 N -0.22 0.15 -0.21 4.33 -0.21 0.21 -4.77 119.66 118.94 1ajd s GLN 375 Ca 0.72 0.16 -0.29 0.00 0.02 0.00 0.00 55.36 55.96 1ajd s GLN 375 Cb -1.01 -0.43 0.00 0.00 1.00 0.00 0.00 33.01 32.58 1ajd s GLN 375 CO 0.48 -0.18 1.06 0.42 -2.12 0.00 0.00 175.29 174.96 1ajd s ILE 376 N 1.24 4.64 0.32 1.08 1.01 -1.26 0.15 121.20 128.38 1ajd s ILE 376 Ca -0.07 1.97 0.04 0.00 0.00 0.00 0.00 60.65 62.59 1ajd s ILE 376 Cb -0.13 -4.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.01 1ajd s ILE 376 CO -0.03 -0.15 0.06 0.68 0.00 0.00 0.00 174.94 175.50 1ajd s VAL 377 N 3.08 1.17 0.81 2.92 -7.23 -0.74 -4.99 120.40 115.42 1ajd s VAL 377 Ca 0.46 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.49 1ajd s VAL 377 Cb -0.16 -2.78 0.06 0.00 0.56 0.00 0.00 36.38 34.06 1ajd s VAL 377 CO 0.09 -0.01 1.01 0.00 -0.31 0.00 0.00 175.10 175.88 1ajd n ALA 378 N -0.67 -0.53 -0.26 1.32 0.00 -1.26 -3.94 120.51 115.17 1ajd n ALA 378 Ca -0.02 -0.35 -0.05 0.00 0.00 0.00 0.00 53.44 53.02 1ajd n ALA 378 Cb 0.66 -2.14 0.10 0.00 0.00 0.00 0.00 19.45 18.07 1ajd n ALA 378 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ajd h PRO 379 N -0.89 1.12 -0.87 0.00 0.11 -1.94 -2.73 132.00 126.80 1ajd h PRO 379 Ca -0.46 -0.21 -0.02 0.00 0.11 0.00 0.00 66.00 65.43 1ajd h PRO 379 Cb 1.31 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1ajd h PRO 379 CO 0.44 0.92 0.03 -0.40 -0.21 0.00 0.00 178.00 178.78 1ajd n ASP 380 N -4.28 2.76 -4.74 -2.05 5.75 -1.26 -4.81 116.55 107.93 1ajd n ASP 380 Ca 0.07 -2.36 -0.42 0.00 -0.01 0.00 0.00 54.79 52.07 1ajd n ASP 380 Cb 0.19 -0.57 -0.02 0.00 -1.03 0.00 0.00 41.12 39.69 1ajd n ASP 380 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ajd s THR 381 N -1.58 2.52 -0.43 2.12 2.01 -1.03 -4.98 115.64 114.27 1ajd s THR 381 Ca 0.20 0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.62 1ajd s THR 381 Cb 0.15 -3.27 0.12 0.00 0.01 0.00 0.00 72.50 69.51 1ajd s THR 381 CO 0.05 0.06 0.19 -0.54 -0.69 0.00 0.00 174.62 173.69 1ajd s LYS 382 N 0.06 1.88 0.26 4.92 1.02 -1.26 -4.87 119.74 121.75 1ajd s LYS 382 Ca 0.63 -2.04 0.10 0.00 0.02 0.00 0.00 55.97 54.68 1ajd s LYS 382 Cb -0.44 -3.44 -0.04 0.00 -0.52 0.00 0.00 37.83 33.39 1ajd s LYS 382 CO 0.41 -1.04 -0.05 0.00 -0.92 0.00 0.00 175.35 173.74 1ajd s ALA 383 N 0.71 3.07 -0.29 5.17 0.00 -1.26 -5.05 121.76 124.11 1ajd s ALA 383 Ca 0.12 -1.66 0.23 0.00 0.00 0.00 0.00 51.96 50.65 1ajd s ALA 383 Cb -0.22 -0.69 0.48 0.00 0.00 0.00 0.00 23.12 22.70 1ajd s ALA 383 CO -0.05 0.30 1.65 -1.00 0.00 0.00 0.00 175.76 176.66 1ajd h PRO 384 N 2.09 0.00 0.00 0.00 0.13 -1.99 -3.41 132.00 128.83 1ajd h PRO 384 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1ajd h PRO 384 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1ajd h PRO 384 CO 0.59 0.09 0.00 0.41 -0.23 0.00 0.00 178.00 178.86 1ajd n GLY 385 N 0.91 1.39 3.78 1.56 0.00 -1.26 -4.94 105.19 106.63 1ajd n GLY 385 Ca 0.03 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 43.99 1ajd n GLY 385 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajd s LEU 386 N 0.00 4.36 0.02 0.99 1.43 -0.15 -4.07 118.68 121.25 1ajd s LEU 386 Ca 0.00 0.76 0.00 0.00 -1.03 0.00 0.00 54.13 53.86 1ajd s LEU 386 Cb 0.00 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.70 1ajd s LEU 386 CO 0.00 0.20 -0.03 0.42 0.23 0.00 0.00 176.35 177.16 1ajd s THR 387 N -0.25 0.18 -0.11 5.49 -4.23 0.48 -0.36 115.64 116.84 1ajd s THR 387 Ca 0.21 -0.73 -0.10 0.00 -1.18 0.00 0.00 61.69 59.90 1ajd s THR 387 Cb -0.15 -0.28 0.03 0.00 1.34 0.00 0.00 72.50 73.44 1ajd s THR 387 CO 0.09 -0.35 0.29 -1.58 -0.54 0.00 0.00 174.62 172.53 1ajd s GLN 388 N -1.13 0.33 0.00 3.99 0.74 -0.26 -2.71 119.66 120.62 1ajd s GLN 388 Ca -0.11 0.41 -0.05 0.00 0.05 0.00 0.00 55.36 55.65 1ajd s GLN 388 Cb -0.08 0.15 -0.05 0.00 1.10 0.00 0.00 33.01 34.14 1ajd s GLN 388 CO -0.01 -0.05 0.24 0.00 -0.55 0.00 0.00 175.29 174.93 1ajd s ALA 389 N 0.21 3.88 0.02 1.58 0.00 -1.26 -0.59 121.76 125.60 1ajd s ALA 389 Ca -0.00 -0.64 -0.02 0.00 0.00 0.00 0.00 51.96 51.30 1ajd s ALA 389 Cb -0.02 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 1ajd s ALA 389 CO -0.00 0.68 0.01 -0.51 0.00 0.00 0.00 175.76 175.94 1ajd s LEU 390 N -1.83 2.09 -0.56 0.00 1.43 0.08 -0.92 118.68 118.97 1ajd s LEU 390 Ca 0.28 -0.45 -0.17 0.00 -1.03 0.00 0.00 54.13 52.75 1ajd s LEU 390 Cb -0.13 0.24 0.12 0.00 0.03 0.00 0.00 46.19 46.44 1ajd s LEU 390 CO 0.17 -0.33 0.59 0.20 0.23 0.00 0.00 176.35 177.21 1ajd s ASN 391 N -1.50 6.19 1.02 2.29 0.02 0.01 -1.09 114.94 121.87 1ajd s ASN 391 Ca -0.15 -1.62 -0.12 0.00 -1.02 0.00 0.00 52.86 49.95 1ajd s ASN 391 Cb -0.09 -2.25 0.20 0.00 0.02 0.00 0.00 41.25 39.13 1ajd s ASN 391 CO -0.01 -0.97 1.09 0.42 0.02 0.00 0.00 177.10 177.65 1ajd s THR 392 N 2.09 2.03 0.29 1.60 -4.23 0.63 -4.86 115.64 113.19 1ajd s THR 392 Ca 0.07 0.01 -0.02 0.00 -1.18 0.00 0.00 61.69 60.57 1ajd s THR 392 Cb -0.27 -2.47 0.27 0.00 1.34 0.00 0.00 72.50 71.37 1ajd s THR 392 CO 0.05 -0.01 1.94 0.50 -0.54 0.00 0.00 174.62 176.55 1ajd h LYS 393 N -1.98 1.11 0.00 3.99 3.64 -1.08 0.48 116.57 122.73 1ajd h LYS 393 Ca -0.55 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.76 1ajd h LYS 393 Cb 1.33 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1ajd h LYS 393 CO 0.57 0.74 0.00 -0.25 -2.27 0.00 0.00 179.45 178.24 1ajd n ASP 394 N -4.43 0.00 -1.40 4.20 8.00 -1.26 -4.71 116.55 116.95 1ajd n ASP 394 Ca 0.12 0.06 -0.15 0.00 0.71 0.00 0.00 54.79 55.52 1ajd n ASP 394 Cb 0.09 -0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.09 1ajd n ASP 394 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ajd n GLY 395 N -1.05 0.80 3.72 0.44 0.00 0.16 -4.98 105.19 104.28 1ajd n GLY 395 Ca 0.00 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 1ajd n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajd s ALA 396 N -2.64 3.72 -0.21 4.61 0.00 -1.25 -4.92 121.76 121.06 1ajd s ALA 396 Ca 0.00 -1.49 -0.02 0.00 0.00 0.00 0.00 51.96 50.45 1ajd s ALA 396 Cb 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1ajd s ALA 396 CO 0.00 -0.13 -0.10 0.08 0.00 0.00 0.00 175.76 175.60 1ajd s VAL 397 N -2.75 2.80 -0.06 0.00 1.01 -1.26 -0.27 120.40 119.88 1ajd s VAL 397 Ca 0.26 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 1ajd s VAL 397 Cb 0.04 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1ajd s VAL 397 CO 0.14 0.44 0.08 -0.32 0.00 0.00 0.00 175.10 175.44 1ajd s MET 398 N 1.39 3.16 -0.08 2.72 0.00 -0.25 -4.86 119.30 121.39 1ajd s MET 398 Ca 0.05 -0.35 0.03 0.00 0.00 0.00 0.00 55.69 55.41 1ajd s MET 398 Cb -0.14 -2.94 -0.02 0.00 0.00 0.00 0.00 34.83 31.73 1ajd s MET 398 CO -0.07 0.70 -0.17 0.08 0.00 0.00 0.00 175.02 175.56 1ajd s VAL 399 N -1.06 2.73 -0.04 10.11 1.01 -1.25 -0.74 120.40 131.14 1ajd s VAL 399 Ca 0.18 -0.82 0.06 0.00 0.00 0.00 0.00 61.98 61.41 1ajd s VAL 399 Cb -0.12 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1ajd s VAL 399 CO 0.08 0.56 -0.24 -0.04 0.00 0.00 0.00 175.10 175.46 1ajd s MET 400 N -0.19 2.39 0.27 2.72 -1.94 0.24 -1.80 119.30 120.99 1ajd s MET 400 Ca -0.01 -0.89 0.11 0.00 -1.71 0.00 0.00 55.69 53.19 1ajd s MET 400 Cb -0.13 -2.15 -0.05 0.00 2.01 0.00 0.00 34.83 34.51 1ajd s MET 400 CO 0.03 0.47 -0.18 0.45 -0.01 0.00 0.00 175.02 175.79 1ajd s SER 401 N -0.38 3.36 -0.15 3.03 0.15 0.12 -1.10 113.70 118.73 1ajd s SER 401 Ca 0.03 -1.04 -0.04 0.00 0.70 0.00 0.00 55.95 55.59 1ajd s SER 401 Cb -0.12 -0.26 0.06 0.00 -1.71 0.00 0.00 66.02 63.98 1ajd s SER 401 CO 0.02 -0.03 0.08 -0.31 1.20 0.00 0.00 173.24 174.20 1ajd s TYR 402 N -2.63 0.24 -0.24 3.44 2.02 0.51 0.63 117.35 121.33 1ajd s TYR 402 Ca 0.29 -0.28 0.19 0.00 -0.37 0.00 0.00 57.07 56.90 1ajd s TYR 402 Cb -0.03 -0.69 0.49 0.00 -0.40 0.00 0.00 41.96 41.32 1ajd s TYR 402 CO 0.13 -0.47 1.14 0.41 -1.57 0.00 0.00 175.55 175.19 1ajd n GLY 403 N 5.26 2.88 0.35 0.71 0.00 -1.26 -0.98 105.19 112.15 1ajd n GLY 403 Ca -0.07 -1.41 0.09 0.00 0.00 0.00 0.00 46.02 44.63 1ajd n GLY 403 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ajd n ASN 404 N -0.53 2.70 -3.65 1.61 0.23 -1.26 -4.93 115.26 109.44 1ajd n ASN 404 Ca 0.16 -3.15 -0.01 0.00 -0.53 0.00 0.00 54.58 51.05 1ajd n ASN 404 Cb 0.87 -0.47 -0.07 0.00 -2.08 0.00 0.00 39.78 38.03 1ajd n ASN 404 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1ajd s SER 405 N -2.65 -0.10 0.11 0.53 0.15 -1.26 -4.29 113.70 106.18 1ajd s SER 405 Ca 0.35 0.18 0.23 0.00 0.70 0.00 0.00 55.95 57.41 1ajd s SER 405 Cb 0.31 0.67 0.06 0.00 -1.71 0.00 0.00 66.02 65.34 1ajd s SER 405 CO 0.04 -0.03 1.05 -0.62 1.20 0.00 0.00 173.24 174.87 1ajd n GLU 406 N 2.50 0.44 -3.19 5.44 1.02 -1.26 -4.89 120.64 120.70 1ajd n GLU 406 Ca -0.14 0.04 -0.22 0.00 -0.02 0.00 0.00 57.16 56.82 1ajd n GLU 406 Cb 0.57 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 1ajd n GLU 406 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1ajd s GLU 407 N -3.28 3.17 0.00 3.49 0.41 -1.26 -4.96 118.70 116.27 1ajd s GLU 407 Ca 0.02 -0.56 0.00 0.00 -0.41 0.00 0.00 54.97 54.02 1ajd s GLU 407 Cb 0.12 -2.64 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1ajd s GLU 407 CO 0.79 -0.10 0.00 -0.25 -0.49 0.00 0.00 175.26 175.21 1ajd n ASP 408 N -1.92 0.00 -4.54 -0.19 9.92 -1.26 -4.46 116.55 114.10 1ajd n ASP 408 Ca -0.01 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 53.99 1ajd n ASP 408 Cb 0.57 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.95 1ajd n ASP 408 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1ajd s SER 409 N -0.09 3.32 -0.21 -2.24 0.01 -1.26 -4.93 113.70 108.30 1ajd s SER 409 Ca 0.00 -1.44 -0.10 0.00 1.31 0.00 0.00 55.95 55.72 1ajd s SER 409 Cb 0.00 -0.07 -0.05 0.00 0.21 0.00 0.00 66.02 66.11 1ajd s SER 409 CO 0.00 -0.61 0.13 -1.10 0.41 0.00 0.00 173.24 172.07 1ajd s GLN 410 N -3.80 4.14 0.83 12.44 -1.52 -0.97 -4.67 119.66 126.12 1ajd s GLN 410 Ca 0.30 -0.25 -0.12 0.00 -1.95 0.00 0.00 55.36 53.35 1ajd s GLN 410 Cb 0.08 -3.42 0.09 0.00 -0.22 0.00 0.00 33.01 29.53 1ajd s GLN 410 CO 0.15 0.24 1.10 -1.21 -0.25 0.00 0.00 175.29 175.32 1ajd s GLU 411 N 0.52 1.80 0.81 2.91 2.02 -1.26 -4.24 118.70 121.25 1ajd s GLU 411 Ca 0.07 0.65 -0.12 0.00 0.02 0.00 0.00 54.97 55.60 1ajd s GLU 411 Cb -0.12 -1.88 0.08 0.00 0.10 0.00 0.00 34.13 32.31 1ajd s GLU 411 CO -0.00 -1.82 1.11 -1.01 0.02 0.00 0.00 175.26 173.56 1ajd s HIS 412 N -3.11 2.84 0.15 1.61 3.76 -1.26 -3.19 115.29 116.09 1ajd s HIS 412 Ca 0.62 1.03 0.05 0.00 -0.15 0.00 0.00 55.06 56.61 1ajd s HIS 412 Cb -0.15 -3.21 -0.04 0.00 1.11 0.00 0.00 32.58 30.28 1ajd s HIS 412 CO 0.55 -1.82 -0.12 0.95 -0.85 0.00 0.00 174.74 173.45 1ajd s THR 413 N -3.26 1.27 -0.67 1.30 -4.23 -0.68 -4.86 115.64 104.51 1ajd s THR 413 Ca 0.61 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 59.24 1ajd s THR 413 Cb -0.14 -1.78 0.56 0.00 1.34 0.00 0.00 72.50 72.48 1ajd s THR 413 CO 0.53 -0.65 1.37 0.61 -0.54 0.00 0.00 174.62 175.94 1ajd n GLY 414 N -0.03 2.39 3.78 3.99 0.00 -1.26 -2.82 105.19 111.24 1ajd n GLY 414 Ca -0.11 -0.63 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 1ajd n GLY 414 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ajd s SER 415 N -0.60 5.94 0.53 1.61 0.15 -1.26 -4.91 113.70 115.16 1ajd s SER 415 Ca 0.37 2.06 -0.20 0.00 0.70 0.00 0.00 55.95 58.88 1ajd s SER 415 Cb 0.28 -2.57 -0.06 0.00 -1.71 0.00 0.00 66.02 61.95 1ajd s SER 415 CO 0.13 -1.06 1.13 0.00 1.20 0.00 0.00 173.24 174.63 1ajd s GLN 416 N -3.33 3.43 0.26 5.44 -2.07 -1.26 -4.31 119.66 117.82 1ajd s GLN 416 Ca 0.70 1.61 0.02 0.00 -1.82 0.00 0.00 55.36 55.87 1ajd s GLN 416 Cb -0.20 -2.05 -0.04 0.00 -1.09 0.00 0.00 33.01 29.63 1ajd s GLN 416 CO 0.25 -0.79 0.18 -0.48 -1.32 0.00 0.00 175.29 173.14 1ajd s LEU 417 N -3.70 1.45 0.64 2.60 0.05 -1.24 -4.91 118.68 113.57 1ajd s LEU 417 Ca 0.71 -1.54 -0.18 0.00 0.05 0.00 0.00 54.13 53.18 1ajd s LEU 417 Cb -0.24 0.40 -0.01 0.00 -2.05 0.00 0.00 46.19 44.29 1ajd s LEU 417 CO 0.27 -0.92 1.21 -0.60 -0.55 0.00 0.00 176.35 175.76 1ajd s ARG 418 N -3.86 2.72 -0.19 1.48 3.52 -1.26 -2.13 118.95 119.23 1ajd s ARG 418 Ca 0.39 1.82 -0.12 0.00 -0.13 0.00 0.00 55.73 57.69 1ajd s ARG 418 Cb 0.05 -1.90 0.06 0.00 -1.56 0.00 0.00 34.95 31.60 1ajd s ARG 418 CO 0.18 -1.40 0.46 -1.50 -0.81 0.00 0.00 175.30 172.23 1ajd s ILE 419 N -1.70 -0.02 0.09 4.11 2.07 -1.01 -4.34 121.20 120.39 1ajd s ILE 419 Ca 0.77 0.06 0.01 0.00 -1.41 0.00 0.00 60.65 60.08 1ajd s ILE 419 Cb -0.30 -0.67 -0.04 0.00 0.13 0.00 0.00 42.46 41.57 1ajd s ILE 419 CO 0.37 0.02 -0.06 0.00 -1.91 0.00 0.00 174.94 173.36 1ajd s ALA 420 N 1.17 0.89 0.20 1.50 0.00 -1.03 -1.62 121.76 122.88 1ajd s ALA 420 Ca -0.07 -1.30 -0.17 0.00 0.00 0.00 0.00 51.96 50.42 1ajd s ALA 420 Cb -0.07 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.24 1ajd s ALA 420 CO -0.11 -0.24 0.53 0.00 0.00 0.00 0.00 175.76 175.95 1ajd s ALA 421 N -3.52 -0.91 -0.09 0.00 0.00 0.15 -2.01 121.76 115.38 1ajd s ALA 421 Ca 0.10 -0.27 -0.04 0.00 0.00 0.00 0.00 51.96 51.74 1ajd s ALA 421 Cb 0.05 0.87 0.04 0.00 0.00 0.00 0.00 23.12 24.08 1ajd s ALA 421 CO -0.05 -0.82 0.21 -0.47 0.00 0.00 0.00 175.76 174.63 1ajd s TYR 422 N -3.89 -0.27 0.00 0.00 5.04 -0.36 -2.36 117.35 115.50 1ajd s TYR 422 Ca 0.10 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.42 1ajd s TYR 422 Cb -0.01 0.00 0.00 0.00 0.35 0.00 0.00 41.96 42.30 1ajd s TYR 422 CO -0.01 -0.21 0.00 0.41 -1.34 0.00 0.00 175.55 174.39 1ajd n GLY 423 N 4.25 -0.42 3.64 8.97 0.00 -1.26 -1.38 105.19 118.99 1ajd n GLY 423 Ca -0.25 -2.25 -0.53 0.00 0.00 0.00 0.00 46.02 42.99 1ajd n GLY 423 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ajd n PRO 424 N -0.18 1.35 -0.88 1.61 -0.02 -1.23 -1.14 135.00 134.50 1ajd n PRO 424 Ca 0.00 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1ajd n PRO 424 Cb 0.00 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1ajd n PRO 424 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1ajd n HIS 425 N 3.79 0.00 0.26 6.00 8.25 0.47 -4.76 115.22 129.23 1ajd n HIS 425 Ca 0.21 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.83 1ajd n HIS 425 Cb 0.19 -0.71 0.86 0.00 1.12 0.00 0.00 29.99 31.44 1ajd n HIS 425 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ajd h ALA 426 N 0.00 1.06 0.00 -1.41 0.00 -1.38 0.23 119.26 117.77 1ajd h ALA 426 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ajd h ALA 426 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ajd h ALA 426 CO 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1ajd n ALA 427 N -1.89 1.06 1.34 0.00 0.00 -1.26 -2.34 120.51 117.41 1ajd n ALA 427 Ca -0.02 0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.62 1ajd n ALA 427 Cb 0.12 -1.24 0.19 0.00 0.00 0.00 0.00 19.45 18.53 1ajd n ALA 427 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ajd n ASN 428 N -2.05 1.17 -0.03 0.00 3.02 0.07 -3.46 115.26 113.98 1ajd n ASN 428 Ca -0.01 -1.89 0.01 0.00 -0.03 0.00 0.00 54.58 52.65 1ajd n ASN 428 Cb 0.03 -0.13 -0.10 0.00 -0.61 0.00 0.00 39.78 38.98 1ajd n ASN 428 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1ajd n VAL 429 N 0.10 0.39 -1.65 2.41 0.24 -0.99 -4.96 118.33 113.87 1ajd n VAL 429 Ca 0.10 -0.39 -0.42 0.00 -2.04 0.00 0.00 64.34 61.58 1ajd n VAL 429 Cb 0.20 -0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 1ajd n VAL 429 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1ajd n VAL 430 N -2.18 2.29 -4.02 3.34 0.31 -1.22 -3.62 118.33 113.22 1ajd n VAL 430 Ca -0.10 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 1ajd n VAL 430 Cb 0.60 -1.32 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 1ajd n VAL 430 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ajd n GLY 431 N 1.00 -1.15 3.62 2.92 0.00 -1.22 -4.77 105.19 105.58 1ajd n GLY 431 Ca 0.08 -1.25 -0.38 0.00 0.00 0.00 0.00 46.02 44.47 1ajd n GLY 431 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajd s LEU 432 N 0.00 4.06 0.00 0.99 2.96 -1.26 -0.45 118.68 124.99 1ajd s LEU 432 Ca 0.00 0.20 0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1ajd s LEU 432 Cb 0.00 -2.29 0.00 0.00 0.50 0.00 0.00 46.19 44.40 1ajd s LEU 432 CO 0.00 -0.09 0.00 0.35 -1.32 0.00 0.00 176.35 175.29 1ajd n THR 433 N 4.87 0.00 -4.31 3.68 -2.24 -0.50 -4.98 114.28 110.80 1ajd n THR 433 Ca -0.11 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.49 1ajd n THR 433 Cb 0.51 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.61 1ajd n THR 433 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ajd s ASP 434 N -0.07 1.30 0.60 3.42 -1.08 -1.26 -0.84 116.67 118.73 1ajd s ASP 434 Ca 0.00 -0.35 0.29 0.00 -0.52 0.00 0.00 52.55 51.96 1ajd s ASP 434 Cb 0.00 -0.09 1.31 0.00 -1.46 0.00 0.00 42.92 42.68 1ajd s ASP 434 CO 0.00 0.03 1.70 -0.61 0.52 0.00 0.00 175.17 176.81 1ajd h GLN 435 N 5.26 0.00 0.03 4.34 4.15 -0.79 0.22 115.11 128.31 1ajd h GLN 435 Ca -0.35 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 58.85 1ajd h GLN 435 Cb 1.18 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 1ajd h GLN 435 CO 0.46 0.00 -0.99 1.79 -1.93 0.00 0.00 178.83 178.16 1ajd h THR 436 N 0.00 1.49 -0.79 2.39 1.35 -1.84 -3.13 112.91 112.37 1ajd h THR 436 Ca 0.32 -2.74 0.18 0.00 -0.55 0.00 0.00 66.41 63.61 1ajd h THR 436 Cb 1.79 2.60 -0.11 0.00 -1.73 0.00 0.00 68.15 70.69 1ajd h THR 436 CO -0.00 0.80 0.27 0.44 -0.25 0.00 0.00 175.52 176.77 1ajd h ASP 437 N 0.12 0.16 -0.70 5.36 3.32 -0.86 -0.27 116.42 123.55 1ajd h ASP 437 Ca -0.07 0.14 0.15 0.00 0.02 0.00 0.00 57.03 57.27 1ajd h ASP 437 Cb 1.65 0.16 -0.12 0.00 0.22 0.00 0.00 39.33 41.24 1ajd h ASP 437 CO 0.16 0.00 -0.04 0.25 -1.72 0.00 0.00 179.24 177.89 1ajd h LEU 438 N 0.35 -0.41 -0.82 1.55 5.85 -1.56 0.23 115.31 120.50 1ajd h LEU 438 Ca 0.46 0.19 0.13 0.00 0.84 0.00 0.00 57.88 59.50 1ajd h LEU 438 Cb 0.80 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 42.09 1ajd h LEU 438 CO -0.50 -0.18 0.41 0.15 -0.34 0.00 0.00 178.44 177.98 1ajd h PHE 439 N 0.08 0.72 -0.12 1.25 3.57 -1.10 0.40 116.94 121.73 1ajd h PHE 439 Ca 0.37 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.72 1ajd h PHE 439 Cb 0.61 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 1ajd h PHE 439 CO -0.44 0.18 -0.68 1.88 -2.23 0.00 0.00 178.31 177.03 1ajd h TYR 440 N 0.61 0.67 -0.32 0.41 -1.99 -0.63 -0.36 116.97 115.35 1ajd h TYR 440 Ca 0.44 -0.28 0.00 0.00 2.00 0.00 0.00 58.73 60.89 1ajd h TYR 440 Cb 0.59 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 39.19 1ajd h TYR 440 CO -0.10 1.03 0.21 1.15 -0.00 0.00 0.00 178.16 180.45 1ajd h THR 441 N 0.36 1.09 -0.43 -2.88 2.02 0.17 0.23 112.91 113.47 1ajd h THR 441 Ca -0.02 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.86 1ajd h THR 441 Cb 1.25 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 1ajd h THR 441 CO 0.12 0.09 -0.19 0.24 0.37 0.00 0.00 175.52 176.16 1ajd h MET 442 N 0.43 0.83 0.55 6.66 2.86 -0.92 -1.73 114.93 123.60 1ajd h MET 442 Ca 0.12 -0.32 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 1ajd h MET 442 Cb -0.03 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 31.59 1ajd h MET 442 CO -0.02 0.95 -0.26 -0.22 1.06 0.00 0.00 176.91 178.41 1ajd h LYS 443 N 0.73 -0.71 -0.50 1.72 3.11 -0.03 -2.09 116.57 118.79 1ajd h LYS 443 Ca 0.11 0.05 -0.05 0.00 -2.81 0.00 0.00 60.65 57.94 1ajd h LYS 443 Cb 0.70 0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 32.07 1ajd h LYS 443 CO 0.05 -0.42 0.10 0.00 -2.81 0.00 0.00 179.45 176.38 1ajd h ALA 444 N -0.51 1.24 -0.16 5.00 0.00 -0.64 -2.10 119.26 122.09 1ajd h ALA 444 Ca -0.07 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.67 1ajd h ALA 444 Cb 0.62 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1ajd h ALA 444 CO 0.12 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.81 1ajd h ALA 445 N 1.37 0.04 0.00 0.00 0.00 -1.18 -0.92 119.26 118.58 1ajd h ALA 445 Ca 0.16 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1ajd h ALA 445 Cb 0.30 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ajd h ALA 445 CO 0.00 -0.53 -0.10 -0.07 0.00 0.00 0.00 179.25 178.55 1ajd h LEU 446 N -0.08 0.00 0.00 0.00 4.07 -1.19 -2.49 115.31 115.62 1ajd h LEU 446 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1ajd h LEU 446 Cb 0.22 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1ajd h LEU 446 CO -0.21 0.10 0.00 0.61 -1.08 0.00 0.00 178.44 177.86 1ajd n GLY 447 N -0.11 0.75 3.76 0.83 0.00 -0.35 -4.91 105.19 105.16 1ajd n GLY 447 Ca -0.00 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1ajd n GLY 447 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajd s LEU 448 N 0.00 4.53 0.00 0.99 1.02 -0.90 -5.02 118.68 119.29 1ajd s LEU 448 Ca 0.00 2.30 0.00 0.00 0.02 0.00 0.00 54.13 56.45 1ajd s LEU 448 Cb 0.00 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.58 1ajd s LEU 448 CO 0.00 -0.21 0.00 0.29 0.02 0.00 0.00 176.35 176.45