#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajd n PRO 2 N 0.00 0.63 -2.61 -2.82 -0.04 -1.26 -4.90 135.00 124.00 1ajd n PRO 2 Ca 0.00 -0.71 -0.43 0.00 -0.04 0.00 0.00 63.50 62.32 1ajd n PRO 2 Cb 0.00 -3.63 -0.02 0.00 -0.04 0.00 0.00 33.50 29.81 1ajd n PRO 2 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1ajd s GLU 3 N 8.81 4.23 0.00 0.54 2.56 -1.26 -4.88 118.70 128.70 1ajd s GLU 3 Ca 0.94 1.40 0.00 0.00 0.00 0.00 0.00 54.97 57.31 1ajd s GLU 3 Cb -0.15 -3.68 0.00 0.00 2.00 0.00 0.00 34.13 32.31 1ajd s GLU 3 CO 0.12 -0.67 0.00 -1.33 -0.56 0.00 0.00 175.26 172.81 1ajd n MET 4 N 6.44 0.00 -2.97 4.30 2.81 -1.21 -4.97 117.12 121.52 1ajd n MET 4 Ca 0.12 0.00 -0.24 0.00 -1.81 0.00 0.00 57.70 55.78 1ajd n MET 4 Cb 0.46 0.00 0.01 0.00 -0.71 0.00 0.00 33.22 32.98 1ajd n MET 4 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1ajd s PRO 5 N 0.00 3.16 -0.02 0.03 0.04 -1.26 -4.99 135.00 131.97 1ajd s PRO 5 Ca 0.00 -0.36 0.05 0.00 0.04 0.00 0.00 61.00 60.72 1ajd s PRO 5 Cb 0.00 -2.54 -0.03 0.00 0.04 0.00 0.00 34.50 31.98 1ajd s PRO 5 CO 0.00 -0.23 -0.15 0.08 0.04 0.00 0.00 177.00 176.74 1ajd s VAL 6 N -2.57 3.00 -0.84 -0.36 1.01 -1.26 -4.81 120.40 114.58 1ajd s VAL 6 Ca 0.47 -0.88 -0.22 0.00 0.00 0.00 0.00 61.98 61.35 1ajd s VAL 6 Cb -0.10 -2.21 -0.18 0.00 0.00 0.00 0.00 36.38 33.89 1ajd s VAL 6 CO 0.39 0.50 2.34 0.18 0.00 0.00 0.00 175.10 178.51 1ajd n LEU 7 N 2.02 1.10 -0.29 3.92 4.77 -0.67 -4.78 117.00 123.06 1ajd n LEU 7 Ca -0.17 -1.34 0.07 0.00 -0.03 0.00 0.00 56.01 54.54 1ajd n LEU 7 Cb 0.52 -1.43 0.17 0.00 -2.33 0.00 0.00 43.42 40.35 1ajd n LEU 7 CO 0.26 -2.43 0.77 1.05 -1.33 0.00 0.00 177.39 175.71 1ajd h GLU 8 N 12.29 0.04 -0.94 3.23 -0.00 -1.95 -3.42 114.58 123.84 1ajd h GLU 8 Ca 0.01 -0.00 0.03 0.00 -0.00 0.00 0.00 59.36 59.40 1ajd h GLU 8 Cb 1.03 -0.01 -0.21 0.00 -0.00 0.00 0.00 28.75 29.56 1ajd h GLU 8 CO 1.13 0.03 -0.36 1.21 -0.00 0.00 0.00 179.01 181.02 1ajd s ASN 9 N -5.17 -1.52 0.00 3.06 2.47 -1.26 -4.99 114.94 107.53 1ajd s ASN 9 Ca -0.14 0.05 0.21 0.00 0.42 0.00 0.00 52.86 53.40 1ajd s ASN 9 Cb 0.25 1.96 0.59 0.00 -1.45 0.00 0.00 41.25 42.59 1ajd s ASN 9 CO 0.76 -0.26 1.47 0.54 -3.72 0.00 0.00 177.10 175.89 1ajd n ARG 10 N 5.25 2.03 -1.03 0.43 5.12 -1.26 -4.86 116.66 122.34 1ajd n ARG 10 Ca 0.06 -1.56 -0.31 0.00 -1.93 0.00 0.00 57.85 54.11 1ajd n ARG 10 Cb 0.55 -1.43 0.13 0.00 -1.16 0.00 0.00 32.46 30.55 1ajd n ARG 10 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ajd s ALA 11 N -1.65 1.87 0.28 7.54 0.00 -1.26 -4.60 121.76 123.94 1ajd s ALA 11 Ca 0.34 0.51 -0.30 0.00 0.00 0.00 0.00 51.96 52.51 1ajd s ALA 11 Cb 0.19 -3.39 -0.13 0.00 0.00 0.00 0.00 23.12 19.80 1ajd s ALA 11 CO 0.27 -2.25 1.45 0.00 0.00 0.00 0.00 175.76 175.24 1ajd n ALA 12 N -3.73 1.67 0.03 0.00 0.00 -0.09 -4.45 120.51 113.93 1ajd n ALA 12 Ca 0.11 0.39 -0.13 0.00 0.00 0.00 0.00 53.44 53.81 1ajd n ALA 12 Cb 0.52 -2.34 -0.09 0.00 0.00 0.00 0.00 19.45 17.55 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 4.06 -0.05 0.00 0.00 7.50 -0.25 -3.48 115.11 122.89 1ajd h GLN 13 Ca -0.46 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.69 1ajd h GLN 13 Cb 1.26 0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.80 1ajd h GLN 13 CO 0.74 0.24 0.00 0.41 -1.50 0.00 0.00 178.83 178.72 1ajd n GLY 14 N -0.33 3.87 3.46 3.46 0.00 0.15 -5.06 105.19 110.74 1ajd n GLY 14 Ca -0.08 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 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 1.00 6.25 0.53 1.61 2.15 -1.25 -4.78 116.67 122.19 1ajd s ASP 15 Ca 0.00 -0.77 0.36 0.00 0.43 0.00 0.00 52.55 52.56 1ajd s ASP 15 Cb 0.00 -2.32 1.52 0.00 -0.30 0.00 0.00 42.92 41.82 1ajd s ASP 15 CO 0.00 -0.96 1.80 0.16 -0.17 0.00 0.00 175.17 175.99 1ajd h ILE 16 N 5.90 0.41 0.00 4.11 3.07 -1.96 0.51 117.51 129.55 1ajd h ILE 16 Ca -0.27 -0.01 -0.01 0.00 1.55 0.00 0.00 64.86 66.11 1ajd h ILE 16 Cb 1.09 0.37 -0.00 0.00 -0.27 0.00 0.00 36.82 38.01 1ajd h ILE 16 CO 0.99 0.01 -0.06 0.71 -1.05 0.00 0.00 178.15 178.74 1ajd h THR 17 N 0.03 0.13 -3.61 0.16 1.35 -1.92 -3.37 112.91 105.68 1ajd h THR 17 Ca 0.58 -0.93 -0.50 0.00 -0.55 0.00 0.00 66.41 65.00 1ajd h THR 17 Cb 2.24 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 70.48 1ajd h THR 17 CO -0.03 0.06 0.05 0.00 -0.25 0.00 0.00 175.52 175.35 1ajd s ALA 18 N -3.41 3.40 0.14 6.62 0.00 0.18 -4.99 121.76 123.71 1ajd s ALA 18 Ca 0.04 -0.20 -0.33 0.00 0.00 0.00 0.00 51.96 51.48 1ajd s ALA 18 Cb 0.07 -2.63 -0.12 0.00 0.00 0.00 0.00 23.12 20.44 1ajd s ALA 18 CO 0.63 0.17 1.73 -2.30 0.00 0.00 0.00 175.76 175.99 1ajd n PRO 19 N -0.87 2.52 -0.82 0.00 -0.02 -1.26 -0.47 135.00 134.07 1ajd n PRO 19 Ca 0.02 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 1ajd n PRO 19 Cb 0.54 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1ajd n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ajd n GLY 20 N 3.91 0.45 0.23 -1.23 0.00 -1.26 -4.86 105.19 102.43 1ajd n GLY 20 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 0.70 1.00 -0.02 0.00 -0.87 -3.01 103.07 100.88 1ajd h GLY 21 Ca 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.56 1ajd h GLY 21 CO 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 176.54 177.19 1ajd n ALA 22 N -2.52 2.65 -1.60 3.60 0.00 -1.26 -0.67 120.51 120.70 1ajd n ALA 22 Ca -0.03 -0.23 -0.38 0.00 0.00 0.00 0.00 53.44 52.80 1ajd n ALA 22 Cb 0.57 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.65 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 -0.97 0.96 -0.05 0.00 1.74 -1.14 -4.56 116.66 112.65 1ajd n ARG 23 Ca 0.18 0.36 -0.04 0.00 -0.77 0.00 0.00 57.85 57.58 1ajd n ARG 23 Cb 0.22 -2.10 -0.08 0.00 -1.02 0.00 0.00 32.46 29.48 1ajd n ARG 23 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ajd n ARG 24 N -0.68 2.14 -3.38 5.56 1.74 -1.26 0.08 116.66 120.86 1ajd n ARG 24 Ca 0.12 -0.01 -0.27 0.00 -0.77 0.00 0.00 57.85 56.92 1ajd n ARG 24 Cb 0.46 -1.26 -0.03 0.00 -1.02 0.00 0.00 32.46 30.61 1ajd n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ajd s LEU 25 N -4.66 4.06 -0.00 0.55 1.43 -1.26 -4.59 118.68 114.21 1ajd s LEU 25 Ca -0.05 0.61 0.03 0.00 -1.03 0.00 0.00 54.13 53.69 1ajd s LEU 25 Cb 0.03 -3.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.78 1ajd s LEU 25 CO 0.42 -0.20 0.08 0.35 0.23 0.00 0.00 176.35 177.23 1ajd n THR 26 N -1.11 0.00 -1.16 5.49 -2.24 -1.26 -4.98 114.28 109.01 1ajd n THR 26 Ca -0.03 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1ajd n THR 26 Cb 0.54 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 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 1.80 3.62 3.70 3.38 0.00 -1.26 -5.14 105.19 111.29 1ajd n GLY 27 Ca -0.00 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 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 1.88 6.34 0.36 1.61 -1.08 -1.26 -4.99 116.67 119.54 1ajd s ASP 28 Ca 0.00 0.40 0.19 0.00 -0.52 0.00 0.00 52.55 52.62 1ajd s ASP 28 Cb 0.00 -2.17 0.30 0.00 -1.46 0.00 0.00 42.92 39.59 1ajd s ASP 28 CO 0.00 0.05 1.56 -0.61 0.52 0.00 0.00 175.17 176.69 1ajd h GLN 29 N 7.07 0.00 -0.56 4.34 5.75 -2.01 -3.39 115.11 126.31 1ajd h GLN 29 Ca -0.39 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.16 1ajd h GLN 29 Cb 1.16 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.65 1ajd h GLN 29 CO 0.72 0.29 -0.33 2.41 -2.65 0.00 0.00 178.83 179.28 1ajd n THR 30 N -3.20 -0.38 -0.15 2.39 -1.04 -1.26 -0.55 114.28 110.09 1ajd n THR 30 Ca 0.02 1.35 -0.09 0.00 -2.04 0.00 0.00 64.05 63.29 1ajd n THR 30 Cb 0.62 -1.67 0.05 0.00 -1.82 0.00 0.00 70.33 67.50 1ajd n THR 30 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ajd h ALA 31 N 0.30 0.81 -0.17 2.41 0.00 -2.00 -0.79 119.26 119.82 1ajd h ALA 31 Ca 0.09 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1ajd h ALA 31 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ajd h ALA 31 CO -0.52 0.66 -0.15 0.00 0.00 0.00 0.00 179.25 179.23 1ajd h ALA 32 N 0.99 1.42 -0.20 0.00 0.00 -1.07 -2.33 119.26 118.08 1ajd h ALA 32 Ca 0.13 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.60 1ajd h ALA 32 Cb 0.69 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ajd h ALA 32 CO 0.05 0.40 -0.67 1.25 0.00 0.00 0.00 179.25 180.28 1ajd h LEU 33 N 0.27 0.88 -1.60 0.00 5.85 -0.69 -3.14 115.31 116.88 1ajd h LEU 33 Ca 0.05 -0.53 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1ajd h LEU 33 Cb 0.43 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1ajd h LEU 33 CO 0.03 1.32 0.10 0.03 -0.34 0.00 0.00 178.44 179.57 1ajd h ARG 34 N 0.55 0.36 -0.17 1.25 3.08 -0.61 -0.18 114.38 118.65 1ajd h ARG 34 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1ajd h ARG 34 Cb 1.28 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1ajd h ARG 34 CO 0.14 0.31 0.00 -0.25 -1.07 0.00 0.00 179.97 179.10 1ajd n ASP 35 N -4.42 1.55 0.04 7.04 8.00 -1.01 -3.51 116.55 124.23 1ajd n ASP 35 Ca 0.01 -1.72 0.11 0.00 0.71 0.00 0.00 54.79 53.90 1ajd n ASP 35 Cb 0.13 -0.11 -0.10 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 0.25 0.37 -4.62 -2.24 7.64 -0.09 -3.29 113.62 111.64 1ajd n SER 36 Ca 0.15 0.14 -0.42 0.00 1.01 0.00 0.00 58.87 59.75 1ajd n SER 36 Cb 0.30 1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 64.79 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 -4.89 4.04 -0.12 -3.43 1.02 -1.16 -4.69 118.68 109.46 1ajd s LEU 37 Ca -0.05 0.73 -0.04 0.00 0.02 0.00 0.00 54.13 54.80 1ajd s LEU 37 Cb 0.12 -3.22 0.06 0.00 0.02 0.00 0.00 46.19 43.17 1ajd s LEU 37 CO 0.86 -0.72 0.20 -0.55 0.02 0.00 0.00 176.35 176.15 1ajd s SER 38 N 1.67 0.79 -0.32 2.29 0.15 -1.26 -5.01 113.70 112.01 1ajd s SER 38 Ca 0.36 0.28 0.04 0.00 0.70 0.00 0.00 55.95 57.33 1ajd s SER 38 Cb -0.13 0.39 0.51 0.00 -1.71 0.00 0.00 66.02 65.08 1ajd s SER 38 CO 0.14 -0.26 1.66 -0.90 1.20 0.00 0.00 173.24 175.08 1ajd n ASP 39 N 5.33 3.68 -4.93 5.45 5.68 -1.26 0.39 116.55 130.89 1ajd n ASP 39 Ca -0.05 -3.15 -0.26 0.00 -0.50 0.00 0.00 54.79 50.83 1ajd n ASP 39 Cb 0.50 -0.74 0.04 0.00 -1.14 0.00 0.00 41.12 39.78 1ajd n ASP 39 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1ajd s LYS 40 N -2.45 2.67 -0.04 0.11 -0.14 -1.26 -4.93 119.74 113.70 1ajd s LYS 40 Ca 0.42 -0.14 -0.30 0.00 -1.36 0.00 0.00 55.97 54.60 1ajd s LYS 40 Cb 0.35 -2.26 -0.06 0.00 -1.68 0.00 0.00 37.83 34.19 1ajd s LYS 40 CO 0.09 -0.86 1.66 -2.14 -0.76 0.00 0.00 175.35 173.33 1ajd s PRO 41 N -5.05 4.18 0.07 -1.68 0.02 -1.26 -4.43 135.00 126.85 1ajd s PRO 41 Ca 0.56 2.21 -0.30 0.00 0.02 0.00 0.00 61.00 63.49 1ajd s PRO 41 Cb -0.11 -3.95 -0.05 0.00 0.02 0.00 0.00 34.50 30.41 1ajd s PRO 41 CO 0.44 -0.83 1.12 0.00 -0.33 0.00 0.00 177.00 177.40 1ajd s ALA 42 N 3.90 3.33 -0.01 -1.55 0.00 -0.25 -4.93 121.76 122.25 1ajd s ALA 42 Ca 0.74 0.76 0.07 0.00 0.00 0.00 0.00 51.96 53.53 1ajd s ALA 42 Cb -0.34 -3.40 -0.24 0.00 0.00 0.00 0.00 23.12 19.14 1ajd s ALA 42 CO 0.30 -0.33 0.79 -0.22 0.00 0.00 0.00 175.76 176.30 1ajd h LYS 43 N 6.44 0.07 -3.73 0.00 3.64 -0.83 -3.36 116.57 118.81 1ajd h LYS 43 Ca -0.42 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 58.70 1ajd h LYS 43 Cb 1.21 0.05 -0.19 0.00 -0.41 0.00 0.00 32.23 32.89 1ajd h LYS 43 CO 0.78 0.78 -0.54 -0.80 -2.27 0.00 0.00 179.45 177.40 1ajd s ASN 44 N -6.47 0.14 -0.10 4.20 0.01 -1.17 -3.00 114.94 108.55 1ajd s ASN 44 Ca -0.06 -0.43 0.02 0.00 -0.71 0.00 0.00 52.86 51.68 1ajd s ASN 44 Cb 0.08 0.20 0.02 0.00 0.41 0.00 0.00 41.25 41.96 1ajd s ASN 44 CO 0.82 -0.44 -0.14 -0.63 -1.51 0.00 0.00 177.10 175.21 1ajd s ILE 45 N -2.07 1.40 -0.20 0.60 1.01 0.17 -2.01 121.20 120.10 1ajd s ILE 45 Ca -0.10 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 59.95 1ajd s ILE 45 Cb -0.04 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.13 1ajd s ILE 45 CO -0.02 0.42 -0.11 -0.63 0.00 0.00 0.00 174.94 174.60 1ajd s ILE 46 N 1.01 2.84 -0.21 2.92 1.01 -0.65 0.10 121.20 128.22 1ajd s ILE 46 Ca -0.07 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 59.93 1ajd s ILE 46 Cb -0.15 -2.26 0.04 0.00 0.01 0.00 0.00 42.46 40.10 1ajd s ILE 46 CO -0.02 0.47 -0.16 -0.22 0.00 0.00 0.00 174.94 175.02 1ajd s LEU 47 N 1.36 2.59 -0.24 2.97 0.20 -0.26 -1.12 118.68 124.17 1ajd s LEU 47 Ca 0.05 -0.92 -0.08 0.00 0.69 0.00 0.00 54.13 53.87 1ajd s LEU 47 Cb -0.14 -1.48 -0.04 0.00 -0.43 0.00 0.00 46.19 44.10 1ajd s LEU 47 CO -0.07 -0.08 0.10 -0.76 -0.29 0.00 0.00 176.35 175.26 1ajd s LEU 48 N 1.23 3.66 -0.10 -0.68 2.01 0.14 -0.17 118.68 124.77 1ajd s LEU 48 Ca -0.00 -0.10 0.02 0.00 0.01 0.00 0.00 54.13 54.06 1ajd s LEU 48 Cb -0.16 -1.98 -0.01 0.00 0.01 0.00 0.00 46.19 44.05 1ajd s LEU 48 CO -0.10 -0.00 -0.19 -0.63 1.01 0.00 0.00 176.35 176.45 1ajd s ILE 49 N 1.42 2.58 -0.37 -0.59 -1.09 0.35 -1.17 121.20 122.34 1ajd s ILE 49 Ca 0.06 -0.84 -0.09 0.00 -2.23 0.00 0.00 60.65 57.55 1ajd s ILE 49 Cb -0.15 -2.03 0.04 0.00 -1.58 0.00 0.00 42.46 38.74 1ajd s ILE 49 CO 0.05 0.55 0.17 -0.83 -1.23 0.00 0.00 174.94 173.65 1ajd s GLY 50 N 0.17 1.90 -0.25 6.18 0.00 0.63 0.65 107.32 116.60 1ajd s GLY 50 Ca -0.10 -1.81 -0.28 0.00 0.00 0.00 0.00 44.72 42.52 1ajd s GLY 50 CO 0.06 0.84 1.93 -0.35 0.00 0.00 0.00 173.10 175.57 1ajd s ASP 51 N 1.58 5.85 -0.09 1.64 -1.08 0.12 -1.57 116.67 123.12 1ajd s ASP 51 Ca 0.00 1.65 0.00 0.00 -0.52 0.00 0.00 52.55 53.68 1ajd s ASP 51 Cb -0.20 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 1ajd s ASP 51 CO 0.04 -1.68 0.00 0.61 0.52 0.00 0.00 175.17 174.66 1ajd n GLY 52 N 5.37 0.47 2.85 2.66 0.00 -1.23 -0.88 105.19 114.42 1ajd n GLY 52 Ca 0.24 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.90 3.37 -1.54 1.61 1.56 -0.61 -4.10 117.12 114.52 1ajd n MET 53 Ca -0.01 -3.24 -0.29 0.00 -0.27 0.00 0.00 57.70 53.89 1ajd n MET 53 Cb 0.04 -3.05 0.22 0.00 2.15 0.00 0.00 33.22 32.58 1ajd n MET 53 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1ajd n GLY 54 N 3.27 -2.02 0.31 -5.12 0.00 -1.26 -4.54 105.19 95.82 1ajd n GLY 54 Ca 0.44 -1.62 0.19 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.14 0.00 0.07 1.61 3.32 -1.93 -0.56 116.42 116.79 1ajd h ASP 55 Ca -0.42 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.46 1ajd h ASP 55 Cb 1.21 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.77 1ajd h ASP 55 CO 0.29 0.02 -0.72 -1.28 -1.72 0.00 0.00 179.24 175.83 1ajd h SER 56 N 0.00 0.51 -0.16 6.45 0.87 -1.91 -0.44 113.55 118.87 1ajd h SER 56 Ca -0.00 -0.85 0.00 0.00 -1.23 0.00 0.00 61.79 59.71 1ajd h SER 56 Cb 0.19 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.98 1ajd h SER 56 CO 0.00 1.31 0.10 -0.33 -0.53 0.00 0.00 176.83 177.39 1ajd h GLU 57 N -0.22 0.22 0.01 2.24 3.07 -1.60 -2.28 114.58 116.02 1ajd h GLU 57 Ca -0.11 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.71 1ajd h GLU 57 Cb 1.48 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.35 1ajd h GLU 57 CO 0.14 0.15 -0.12 0.82 -1.40 0.00 0.00 179.01 178.60 1ajd h ILE 58 N 0.22 1.66 -0.56 3.13 2.04 -1.07 -3.21 117.51 119.73 1ajd h ILE 58 Ca 0.06 -2.08 0.04 0.00 1.00 0.00 0.00 64.86 63.88 1ajd h ILE 58 Cb -0.02 3.05 -0.05 0.00 -0.74 0.00 0.00 36.82 39.06 1ajd h ILE 58 CO -0.01 0.55 0.30 0.74 0.00 0.00 0.00 178.15 179.73 1ajd h THR 59 N -0.76 0.98 -0.02 -0.27 2.02 -0.68 -1.96 112.91 112.22 1ajd h THR 59 Ca -0.02 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1ajd h THR 59 Cb 0.97 0.35 -0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1ajd h THR 59 CO 0.02 0.11 0.01 0.00 0.37 0.00 0.00 175.52 176.03 1ajd h ALA 60 N 1.29 0.02 -0.92 6.16 0.00 -1.58 -0.33 119.26 123.90 1ajd h ALA 60 Ca 0.24 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.21 1ajd h ALA 60 Cb 0.13 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.83 1ajd h ALA 60 CO -0.15 -0.44 0.56 0.00 0.00 0.00 0.00 179.25 179.22 1ajd h ALA 61 N 0.92 1.34 0.18 0.00 0.00 -1.50 0.12 119.26 120.32 1ajd h ALA 61 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ajd h ALA 61 Cb 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1ajd h ALA 61 CO -0.00 0.20 -0.08 -0.09 0.00 0.00 0.00 179.25 179.28 1ajd h ARG 62 N 0.93 -0.23 -0.97 0.00 2.43 -1.00 -0.04 114.38 115.49 1ajd h ARG 62 Ca 0.44 0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.78 1ajd h ARG 62 Cb 0.38 0.05 -0.10 0.00 -0.42 0.00 0.00 29.97 29.88 1ajd h ARG 62 CO -0.24 0.04 0.59 -0.91 -1.51 0.00 0.00 179.97 177.93 1ajd h ASN 63 N -0.48 0.80 0.16 -3.80 2.35 -0.33 0.57 115.58 114.85 1ajd h ASN 63 Ca -0.02 0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1ajd h ASN 63 Cb 0.37 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1ajd h ASN 63 CO 0.04 0.35 -0.08 0.22 -1.65 0.00 0.00 177.43 176.32 1ajd h TYR 64 N 0.83 -0.20 0.00 1.19 3.20 -0.58 -1.91 116.97 119.50 1ajd h TYR 64 Ca 0.53 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.29 1ajd h TYR 64 Cb 0.69 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 1ajd h TYR 64 CO -0.02 -0.13 -0.48 0.00 -1.64 0.00 0.00 178.16 175.90 1ajd h ALA 65 N -1.67 0.97 0.00 1.82 0.00 -0.93 -2.14 119.26 117.31 1ajd h ALA 65 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ajd h ALA 65 Cb 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ajd h ALA 65 CO 0.04 0.60 -0.37 0.39 0.00 0.00 0.00 179.25 179.90 1ajd n GLU 66 N -3.62 4.01 0.00 0.00 -0.58 0.16 -4.87 120.64 115.75 1ajd n GLU 66 Ca -0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1ajd n GLU 66 Cb 0.56 -0.66 0.00 0.00 -0.57 0.00 0.00 31.44 30.77 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 -2.08 0.30 0.62 0.00 0.73 -3.40 105.19 102.83 1ajd n GLY 67 Ca 0.00 -1.40 0.11 0.00 0.00 0.00 0.00 46.02 44.73 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 1.18 0.00 4.61 0.00 -1.79 0.93 119.26 124.19 1ajd h ALA 68 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ajd h ALA 68 Cb 0.00 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ajd h ALA 68 CO 0.00 -0.43 0.00 0.41 0.00 0.00 0.00 179.25 179.23 1ajd n GLY 69 N -1.38 -1.03 2.85 0.00 0.00 -1.26 -4.85 105.19 99.52 1ajd n GLY 69 Ca 0.19 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 0.63 -3.96 3.64 -0.02 0.00 0.32 -0.91 105.19 104.89 1ajd n GLY 70 Ca 0.11 -1.28 -0.07 0.00 0.00 0.00 0.00 46.02 44.77 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 -1.98 -0.99 -0.36 1.61 5.36 -1.26 -4.46 117.98 115.89 1ajd s PHE 71 Ca 0.60 2.00 -0.26 0.00 -0.96 0.00 0.00 56.93 58.31 1ajd s PHE 71 Cb -0.11 0.58 0.02 0.00 -0.34 0.00 0.00 43.02 43.17 1ajd s PHE 71 CO 0.50 -0.49 0.96 -0.06 -1.46 0.00 0.00 175.22 174.67 1ajd s PHE 72 N 1.51 3.09 0.45 10.12 0.08 -1.26 -4.93 117.98 127.04 1ajd s PHE 72 Ca -0.09 0.85 0.28 0.00 0.12 0.00 0.00 56.93 58.09 1ajd s PHE 72 Cb -0.05 -3.67 1.34 0.00 -0.57 0.00 0.00 43.02 40.07 1ajd s PHE 72 CO -0.18 -0.82 1.72 0.87 -0.10 0.00 0.00 175.22 176.71 1ajd h LYS 73 N 8.42 0.18 0.00 0.44 6.56 -1.97 -1.62 116.57 128.59 1ajd h LYS 73 Ca -0.23 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.35 1ajd h LYS 73 Cb 1.08 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1ajd h LYS 73 CO 0.99 0.12 -0.53 0.41 -2.06 0.00 0.00 179.45 178.38 1ajd n GLY 74 N -1.58 -0.32 0.29 3.86 0.00 -1.26 -4.21 105.19 101.97 1ajd n GLY 74 Ca 0.30 -0.18 0.09 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.53 0.36 0.00 -0.61 2.04 -1.77 -0.46 117.51 116.53 1ajd h ILE 75 Ca 0.00 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1ajd h ILE 75 Cb 0.53 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1ajd h ILE 75 CO 0.00 0.03 -0.71 0.47 0.00 0.00 0.00 178.15 177.94 1ajd n ASP 76 N -5.25 0.61 0.08 1.72 8.00 -0.62 -4.08 116.55 117.02 1ajd n ASP 76 Ca 0.18 -0.16 0.11 0.00 0.71 0.00 0.00 54.79 55.63 1ajd n ASP 76 Cb 0.58 0.41 0.44 0.00 -0.02 0.00 0.00 41.12 42.52 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 -1.69 1.77 -1.93 2.24 0.00 -0.18 -4.76 120.51 115.96 1ajd n ALA 77 Ca 0.04 0.02 -0.40 0.00 0.00 0.00 0.00 53.44 53.10 1ajd n ALA 77 Cb 0.40 -1.36 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 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 -3.94 3.39 0.29 0.00 1.43 -1.22 -1.67 118.68 116.96 1ajd s LEU 78 Ca 0.06 0.86 0.03 0.00 -1.03 0.00 0.00 54.13 54.06 1ajd s LEU 78 Cb 0.10 -2.91 0.69 0.00 0.03 0.00 0.00 46.19 44.11 1ajd s LEU 78 CO 0.38 -2.22 1.74 1.55 0.23 0.00 0.00 176.35 178.03 1ajd h PRO 79 N 15.03 0.54 -5.49 1.29 0.13 -1.86 -3.41 132.00 138.24 1ajd h PRO 79 Ca -0.29 -0.03 -0.64 0.00 -0.87 0.00 0.00 66.00 64.17 1ajd h PRO 79 Cb 1.19 -0.12 -0.12 0.00 0.13 0.00 0.00 31.00 32.07 1ajd h PRO 79 CO 1.13 0.36 -0.53 -0.51 -0.23 0.00 0.00 178.00 178.23 1ajd s LEU 80 N -10.39 4.06 0.05 1.56 1.43 -1.06 -4.98 118.68 109.36 1ajd s LEU 80 Ca -0.12 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.23 1ajd s LEU 80 Cb 0.24 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 1ajd s LEU 80 CO 0.79 0.28 -0.04 0.42 0.23 0.00 0.00 176.35 178.03 1ajd s THR 81 N -0.25 0.29 0.00 5.49 -4.23 -1.26 0.22 115.64 115.90 1ajd s THR 81 Ca 0.09 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1ajd s THR 81 Cb -0.12 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.37 1ajd s THR 81 CO 0.01 -0.90 0.00 0.61 -0.54 0.00 0.00 174.62 173.80 1ajd n GLY 82 N 0.32 2.40 3.06 3.99 0.00 0.22 -4.06 105.19 111.13 1ajd n GLY 82 Ca -0.15 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.49 0.61 -0.09 1.61 1.11 -1.02 -1.87 119.66 119.53 1ajd s GLN 83 Ca 0.00 -0.64 -0.08 0.00 0.01 0.00 0.00 55.36 54.66 1ajd s GLN 83 Cb 0.00 -0.50 0.02 0.00 -1.01 0.00 0.00 33.01 31.52 1ajd s GLN 83 CO 0.00 0.11 0.23 1.52 0.01 0.00 0.00 175.29 177.16 1ajd s TYR 84 N -0.96 -0.25 0.13 0.91 1.13 -0.12 -2.15 117.35 116.03 1ajd s TYR 84 Ca -0.04 0.61 -0.27 0.00 -1.41 0.00 0.00 57.07 55.96 1ajd s TYR 84 Cb -0.08 0.08 -0.07 0.00 -1.10 0.00 0.00 41.96 40.80 1ajd s TYR 84 CO 0.01 -0.13 0.85 0.95 -2.51 0.00 0.00 175.55 174.72 1ajd s THR 85 N 0.21 4.46 -0.30 -3.49 -4.23 0.07 -3.09 115.64 109.27 1ajd s THR 85 Ca -0.01 1.84 0.18 0.00 -1.18 0.00 0.00 61.69 62.52 1ajd s THR 85 Cb -0.02 -4.21 0.48 0.00 1.34 0.00 0.00 72.50 70.08 1ajd s THR 85 CO -0.00 0.42 1.05 0.00 -0.54 0.00 0.00 174.62 175.55 1ajd n HIS 86 N 2.26 1.56 -1.28 3.99 1.44 -1.26 -1.23 115.22 120.70 1ajd n HIS 86 Ca -0.02 -2.50 -0.30 0.00 -2.01 0.00 0.00 57.72 52.89 1ajd n HIS 86 Cb 0.49 -0.29 0.12 0.00 0.12 0.00 0.00 29.99 30.43 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 -3.49 2.46 0.11 -1.40 1.13 -1.26 -4.54 117.35 110.36 1ajd s TYR 87 Ca 0.31 1.28 0.01 0.00 -1.41 0.00 0.00 57.07 57.27 1ajd s TYR 87 Cb 0.39 -3.13 0.01 0.00 -1.10 0.00 0.00 41.96 38.13 1ajd s TYR 87 CO -0.01 -2.17 0.08 0.00 -2.51 0.00 0.00 175.55 170.93 1ajd n ALA 88 N -3.73 0.17 -2.38 9.51 0.00 0.13 -4.86 120.51 119.35 1ajd n ALA 88 Ca 0.07 -0.45 -0.29 0.00 0.00 0.00 0.00 53.44 52.78 1ajd n ALA 88 Cb 0.55 0.19 -0.15 0.00 0.00 0.00 0.00 19.45 20.04 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 2.16 -0.36 0.00 1.43 0.09 0.20 118.68 122.20 1ajd s LEU 89 Ca 0.06 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.33 1ajd s LEU 89 Cb -0.00 -1.20 0.02 0.00 0.03 0.00 0.00 46.19 45.03 1ajd s LEU 89 CO 0.04 0.24 0.98 0.21 0.23 0.00 0.00 176.35 178.04 1ajd s ASN 90 N -1.16 6.75 0.19 2.29 3.84 0.10 -4.09 114.94 122.86 1ajd s ASN 90 Ca 0.10 0.72 -0.23 0.00 0.21 0.00 0.00 52.86 53.67 1ajd s ASN 90 Cb -0.10 -2.49 0.10 0.00 -0.55 0.00 0.00 41.25 38.21 1ajd s ASN 90 CO 0.02 -0.88 1.56 0.50 -2.79 0.00 0.00 177.10 175.51 1ajd h LYS 91 N 8.39 -0.13 -0.54 0.43 3.64 -1.92 0.44 116.57 126.89 1ajd h LYS 91 Ca -0.22 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.05 1ajd h LYS 91 Cb 1.07 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1ajd h LYS 91 CO 1.00 -0.09 -0.12 -0.22 -2.27 0.00 0.00 179.45 177.75 1ajd h LYS 92 N -0.14 1.03 0.00 1.90 1.63 -1.92 -3.33 116.57 115.74 1ajd h LYS 92 Ca 0.23 -0.39 -0.22 0.00 -0.85 0.00 0.00 60.65 59.42 1ajd h LYS 92 Cb 0.56 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 1ajd h LYS 92 CO -0.79 1.08 -1.74 0.25 -3.45 0.00 0.00 179.45 174.80 1ajd n THR 93 N -4.14 1.22 0.00 1.00 -2.24 -1.11 -4.99 114.28 104.02 1ajd n THR 93 Ca 0.01 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1ajd n THR 93 Cb 0.41 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1ajd n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajd n GLY 94 N 1.49 3.00 3.70 3.38 0.00 0.15 -5.02 105.19 111.90 1ajd n GLY 94 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1ajd n GLY 94 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ajd n LYS 95 N -1.00 0.42 -1.67 1.61 5.02 -1.26 -4.51 118.16 116.78 1ajd n LYS 95 Ca 0.00 0.22 -0.37 0.00 -2.02 0.00 0.00 58.31 56.13 1ajd n LYS 95 Cb 0.00 -2.46 0.06 0.00 -0.02 0.00 0.00 35.03 32.62 1ajd n LYS 95 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1ajd n PRO 96 N -2.90 0.97 -3.82 1.97 -0.02 -1.26 0.03 135.00 129.98 1ajd n PRO 96 Ca 0.14 0.38 -0.29 0.00 -2.02 0.00 0.00 63.50 61.71 1ajd n PRO 96 Cb 0.50 -2.33 -0.13 0.00 -0.02 0.00 0.00 33.50 31.51 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 -1.33 3.98 0.12 2.55 -1.08 0.52 -4.50 116.67 116.93 1ajd s ASP 97 Ca 0.79 -3.00 -0.23 0.00 -0.52 0.00 0.00 52.55 49.60 1ajd s ASP 97 Cb -0.40 -1.33 -0.05 0.00 -1.46 0.00 0.00 42.92 39.68 1ajd s ASP 97 CO 0.44 -0.22 1.12 -1.22 0.52 0.00 0.00 175.17 175.81 1ajd n TYR 98 N 3.09 -0.32 -3.52 -5.34 4.01 -1.26 0.22 117.16 114.03 1ajd n TYR 98 Ca 0.10 0.91 -0.41 0.00 -0.16 0.00 0.00 57.90 58.35 1ajd n TYR 98 Cb 0.34 -0.56 -0.10 0.00 -0.31 0.00 0.00 39.34 38.71 1ajd n TYR 98 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1ajd s VAL 99 N -5.37 5.28 0.57 -0.72 1.01 -1.26 -4.42 120.40 115.49 1ajd s VAL 99 Ca -0.09 -0.25 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 1ajd s VAL 99 Cb 0.08 -3.74 0.03 0.00 0.00 0.00 0.00 36.38 32.75 1ajd s VAL 99 CO 0.45 -0.04 0.83 0.28 0.00 0.00 0.00 175.10 176.62 1ajd s THR 100 N 1.72 3.05 0.27 3.92 -1.32 -1.25 -4.82 115.64 117.21 1ajd s THR 100 Ca 0.06 -0.42 0.08 0.00 -1.21 0.00 0.00 61.69 60.20 1ajd s THR 100 Cb -0.18 -3.19 -0.04 0.00 -1.51 0.00 0.00 72.50 67.59 1ajd s THR 100 CO 0.11 -0.16 0.14 1.51 -2.21 0.00 0.00 174.62 174.00 1ajd s ASP 101 N -4.38 5.14 0.54 8.08 -4.77 -1.26 -4.89 116.67 115.13 1ajd s ASP 101 Ca 0.55 -0.43 0.28 0.00 -3.30 0.00 0.00 52.55 49.65 1ajd s ASP 101 Cb -0.10 -1.15 1.44 0.00 -1.09 0.00 0.00 42.92 42.01 1ajd s ASP 101 CO 0.41 -0.06 1.95 0.28 0.70 0.00 0.00 175.17 178.45 1ajd h SER 102 N 1.60 0.00 0.14 2.11 0.02 -2.00 -2.75 113.55 112.68 1ajd h SER 102 Ca -0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.48 1ajd h SER 102 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1ajd h SER 102 CO 0.61 0.00 -0.07 0.00 -1.14 0.00 0.00 176.83 176.23 1ajd h ALA 103 N 1.65 -0.19 -0.76 3.77 0.00 -1.90 -2.55 119.26 119.28 1ajd h ALA 103 Ca 0.30 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ajd h ALA 103 Cb 1.25 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 1ajd h ALA 103 CO -0.00 -0.36 0.50 0.00 0.00 0.00 0.00 179.25 179.39 1ajd h ALA 104 N 0.05 0.96 -0.52 0.00 0.00 -1.64 -2.84 119.26 115.28 1ajd h ALA 104 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ajd h ALA 104 Cb 0.50 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1ajd h ALA 104 CO 0.03 0.37 0.25 0.66 0.00 0.00 0.00 179.25 180.56 1ajd h SER 105 N 1.02 0.68 -0.30 0.00 4.64 -1.56 -2.53 113.55 115.51 1ajd h SER 105 Ca 0.28 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1ajd h SER 105 Cb -0.11 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.79 1ajd h SER 105 CO -0.06 0.63 0.19 0.00 -0.87 0.00 0.00 176.83 176.72 1ajd h ALA 106 N 1.09 0.38 -0.82 5.18 0.00 -1.34 -2.20 119.26 121.55 1ajd h ALA 106 Ca 0.18 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1ajd h ALA 106 Cb 0.13 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1ajd h ALA 106 CO -0.02 -0.15 0.54 1.15 0.00 0.00 0.00 179.25 180.77 1ajd h THR 107 N 0.40 1.11 -0.99 0.00 2.02 -1.38 0.94 112.91 115.00 1ajd h THR 107 Ca 0.11 -0.34 0.08 0.00 0.77 0.00 0.00 66.41 67.03 1ajd h THR 107 Cb -0.03 0.04 -0.07 0.00 -1.74 0.00 0.00 68.15 66.35 1ajd h THR 107 CO -0.02 0.18 0.64 0.00 0.37 0.00 0.00 175.52 176.68 1ajd h ALA 108 N 1.53 1.46 0.00 6.16 0.00 -0.96 0.47 119.26 127.93 1ajd h ALA 108 Ca 0.33 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.06 1ajd h ALA 108 Cb 0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1ajd h ALA 108 CO -0.10 0.37 -1.55 -2.67 0.00 0.00 0.00 179.25 175.29 1ajd n TRP 109 N -4.53 0.80 0.09 0.00 2.14 -0.89 -1.64 117.44 113.42 1ajd n TRP 109 Ca 0.16 0.27 -0.05 0.00 2.07 0.00 0.00 57.50 59.95 1ajd n TRP 109 Cb 0.24 -1.03 0.01 0.00 -0.81 0.00 0.00 31.31 29.73 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 0.01 0.00 -0.67 4.64 -0.28 -3.31 113.55 113.94 1ajd h SER 110 Ca -0.18 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1ajd h SER 110 Cb 1.58 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 1ajd h SER 110 CO 0.04 0.83 -0.60 0.35 -0.87 0.00 0.00 176.83 176.58 1ajd n THR 111 N -3.56 0.00 -1.71 2.95 -2.24 0.16 -0.12 114.28 109.76 1ajd n THR 111 Ca -0.01 -0.10 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1ajd n THR 111 Cb 0.79 0.55 -0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1ajd n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajd n GLY 112 N 1.70 0.37 2.87 3.38 0.00 -0.65 -4.94 105.19 107.91 1ajd n GLY 112 Ca 0.00 -0.88 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.08 0.26 -0.20 1.61 0.11 -1.25 -4.96 120.40 113.89 1ajd s VAL 113 Ca 0.00 -0.02 -0.29 0.00 -2.93 0.00 0.00 61.98 58.74 1ajd s VAL 113 Cb 0.00 -0.30 0.00 0.00 -1.53 0.00 0.00 36.38 34.56 1ajd s VAL 113 CO 0.00 0.13 1.05 -0.54 -3.33 0.00 0.00 175.10 172.41 1ajd s LYS 114 N 0.62 4.29 0.00 1.54 -0.14 -1.26 -3.83 119.74 120.97 1ajd s LYS 114 Ca -0.07 1.39 0.00 0.00 -1.36 0.00 0.00 55.97 55.94 1ajd s LYS 114 Cb -0.10 -3.63 0.00 0.00 -1.68 0.00 0.00 37.83 32.43 1ajd s LYS 114 CO -0.01 -0.57 0.00 -2.37 -0.76 0.00 0.00 175.35 171.64 1ajd n THR 115 N 5.15 0.00 -4.18 2.17 5.66 -1.26 -4.55 114.28 117.27 1ajd n THR 115 Ca 0.11 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.83 1ajd n THR 115 Cb 0.46 -0.40 -0.08 0.00 -1.55 0.00 0.00 70.33 68.76 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 1.31 2.88 -0.67 1.09 1.13 -1.26 -0.73 117.35 121.11 1ajd s TYR 116 Ca 0.00 -0.10 -0.28 0.00 -1.41 0.00 0.00 57.07 55.28 1ajd s TYR 116 Cb 0.00 -1.46 -0.13 0.00 -1.10 0.00 0.00 41.96 39.27 1ajd s TYR 116 CO 0.00 0.48 2.51 0.09 -2.51 0.00 0.00 175.55 176.11 1ajd n ASN 117 N 0.38 1.57 0.00 -0.18 3.02 -1.26 -2.08 115.26 116.71 1ajd n ASN 117 Ca -0.11 -0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.24 1ajd n ASN 117 Cb 0.53 -1.32 0.00 0.00 -0.61 0.00 0.00 39.78 38.38 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 6.22 3.49 3.57 7.41 0.00 -1.26 -4.94 105.19 119.69 1ajd n GLY 118 Ca 0.48 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.06 0.44 -0.21 4.61 0.00 -0.88 -2.22 121.76 123.44 1ajd s ALA 119 Ca 0.00 0.28 -0.05 0.00 0.00 0.00 0.00 51.96 52.19 1ajd s ALA 119 Cb 0.00 -3.37 0.10 0.00 0.00 0.00 0.00 23.12 19.86 1ajd s ALA 119 CO 0.00 -3.37 0.36 -0.51 0.00 0.00 0.00 175.76 172.24 1ajd s LEU 120 N -6.97 -0.54 -0.04 0.00 1.43 0.60 -4.07 118.68 109.10 1ajd s LEU 120 Ca 0.68 0.51 0.00 0.00 -1.03 0.00 0.00 54.13 54.28 1ajd s LEU 120 Cb -0.24 1.07 0.00 0.00 0.03 0.00 0.00 46.19 47.05 1ajd s LEU 120 CO 0.62 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.54 1ajd n GLY 121 N 5.37 0.17 3.21 -3.19 0.00 -1.25 -0.01 105.19 109.48 1ajd n GLY 121 Ca -0.06 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.30 1.17 0.00 1.61 -7.23 -1.26 -1.06 120.40 112.32 1ajd s VAL 122 Ca 0.00 -1.63 0.00 0.00 -1.81 0.00 0.00 61.98 58.54 1ajd s VAL 122 Cb 0.00 -1.41 0.00 0.00 0.56 0.00 0.00 36.38 35.53 1ajd s VAL 122 CO 0.00 -0.44 0.00 -0.90 -0.31 0.00 0.00 175.10 173.45 1ajd n ASP 123 N 0.64 0.00 0.27 4.85 5.68 0.85 -4.72 116.55 124.11 1ajd n ASP 123 Ca -0.16 -0.85 0.15 0.00 -0.50 0.00 0.00 54.79 53.43 1ajd n ASP 123 Cb 0.57 0.00 0.72 0.00 -1.14 0.00 0.00 41.12 41.27 1ajd n ASP 123 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 1ajd h ILE 124 N -0.46 0.32 -0.44 2.12 3.07 -1.89 0.30 117.51 120.53 1ajd h ILE 124 Ca 0.00 -0.60 0.00 0.00 1.55 0.00 0.00 64.86 65.81 1ajd h ILE 124 Cb 0.00 1.45 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 1ajd h ILE 124 CO 0.00 0.09 0.00 1.41 -1.05 0.00 0.00 178.15 178.60 1ajd n HIS 125 N -3.34 0.58 -0.98 0.16 8.25 -1.26 -4.90 115.22 113.72 1ajd n HIS 125 Ca -0.01 -0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.16 1ajd n HIS 125 Cb 0.28 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.39 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 0.86 -1.14 -2.42 -0.41 1.02 0.09 -4.97 120.64 113.67 1ajd n GLU 126 Ca 0.16 0.28 -0.40 0.00 -0.02 0.00 0.00 57.16 57.18 1ajd n GLU 126 Cb 0.40 -4.18 -0.04 0.00 -0.02 0.00 0.00 31.44 27.61 1ajd n GLU 126 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ajd s LYS 127 N -1.17 4.60 0.74 3.49 -0.14 -1.26 -4.58 119.74 121.42 1ajd s LYS 127 Ca 0.00 1.86 -0.11 0.00 -1.36 0.00 0.00 55.97 56.36 1ajd s LYS 127 Cb 0.00 -3.17 0.04 0.00 -1.68 0.00 0.00 37.83 33.02 1ajd s LYS 127 CO 0.00 0.15 1.08 -0.51 -0.76 0.00 0.00 175.35 175.31 1ajd s ASP 128 N -0.83 4.91 -0.08 2.83 1.11 -1.26 -0.11 116.67 123.24 1ajd s ASP 128 Ca 0.45 1.63 -0.03 0.00 0.18 0.00 0.00 52.55 54.78 1ajd s ASP 128 Cb -0.33 -2.43 0.04 0.00 1.07 0.00 0.00 42.92 41.27 1ajd s ASP 128 CO 0.43 -1.75 0.17 -1.00 1.18 0.00 0.00 175.17 174.20 1ajd s HIS 129 N -3.01 -0.21 0.31 4.23 3.76 -0.23 -4.83 115.29 115.31 1ajd s HIS 129 Ca 0.60 0.57 -0.29 0.00 -0.15 0.00 0.00 55.06 55.78 1ajd s HIS 129 Cb -0.15 -0.05 -0.12 0.00 1.11 0.00 0.00 32.58 33.37 1ajd s HIS 129 CO 0.55 -0.19 1.40 -0.35 -0.85 0.00 0.00 174.74 175.31 1ajd n PRO 130 N 4.22 2.27 -3.03 8.40 -0.04 -1.26 -4.83 135.00 140.73 1ajd n PRO 130 Ca -0.26 0.80 -0.23 0.00 -0.04 0.00 0.00 63.50 63.77 1ajd n PRO 130 Cb 0.52 -2.46 0.01 0.00 -0.04 0.00 0.00 33.50 31.53 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 -0.61 4.16 0.28 0.52 -4.23 -1.26 -4.58 115.64 109.90 1ajd s THR 131 Ca 0.60 -0.48 -0.02 0.00 -1.18 0.00 0.00 61.69 60.61 1ajd s THR 131 Cb -0.57 -3.53 0.16 0.00 1.34 0.00 0.00 72.50 69.90 1ajd s THR 131 CO 0.56 -0.37 1.83 -0.29 -0.54 0.00 0.00 174.62 175.81 1ajd h ILE 132 N 0.45 1.23 -0.31 2.99 6.09 -0.83 0.26 117.51 127.37 1ajd h ILE 132 Ca -0.47 -0.80 -0.13 0.00 -1.37 0.00 0.00 64.86 62.09 1ajd h ILE 132 Cb 1.25 0.64 -0.01 0.00 0.47 0.00 0.00 36.82 39.16 1ajd h ILE 132 CO 0.58 0.30 -0.35 0.25 -3.07 0.00 0.00 178.15 175.86 1ajd h LEU 133 N 0.83 0.73 -0.75 2.19 6.46 -1.83 0.34 115.31 123.27 1ajd h LEU 133 Ca 0.18 -0.31 -0.12 0.00 -0.12 0.00 0.00 57.88 57.52 1ajd h LEU 133 Cb 0.28 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 1ajd h LEU 133 CO -0.00 1.01 -0.33 -0.33 -0.62 0.00 0.00 178.44 178.17 1ajd h GLU 134 N 0.59 0.57 0.01 1.25 5.08 -1.57 -2.16 114.58 118.35 1ajd h GLU 134 Ca 0.06 -0.26 -0.27 0.00 -1.00 0.00 0.00 59.36 57.89 1ajd h GLU 134 Cb 0.87 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 30.13 1ajd h GLU 134 CO 0.08 0.83 -1.06 0.52 -1.00 0.00 0.00 179.01 178.37 1ajd h MET 135 N 0.48 0.70 0.30 2.33 2.86 -0.24 -2.10 114.93 119.25 1ajd h MET 135 Ca 0.05 -0.77 -0.01 0.00 -2.06 0.00 0.00 59.70 56.91 1ajd h MET 135 Cb 0.81 0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1ajd h MET 135 CO 0.07 1.34 -0.15 0.00 1.06 0.00 0.00 176.91 179.22 1ajd h ALA 136 N 0.38 -0.42 -0.39 6.32 0.00 -0.89 -1.68 119.26 122.59 1ajd h ALA 136 Ca -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ajd h ALA 136 Cb 1.72 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 1ajd h ALA 136 CO 0.21 -0.74 0.25 -0.22 0.00 0.00 0.00 179.25 178.75 1ajd h LYS 137 N -0.42 0.51 0.00 0.00 3.64 -1.49 -1.03 116.57 117.79 1ajd h LYS 137 Ca -0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1ajd h LYS 137 Cb 0.33 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1ajd h LYS 137 CO 0.06 0.36 0.00 0.00 -2.27 0.00 0.00 179.45 177.60 1ajd h ALA 138 N 1.13 1.00 -0.01 5.00 0.00 -1.25 -0.18 119.26 124.96 1ajd h ALA 138 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ajd h ALA 138 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ajd h ALA 138 CO -0.03 0.00 -0.65 0.00 0.00 0.00 0.00 179.25 178.57 1ajd n ALA 139 N -1.82 3.96 0.00 0.00 0.00 -0.64 -4.97 120.51 117.02 1ajd n ALA 139 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1ajd n ALA 139 Cb 0.15 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 1.45 1.53 3.78 0.00 0.00 -0.08 -5.08 105.19 106.80 1ajd n GLY 140 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 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 3.73 0.15 0.99 1.02 -0.47 -4.83 118.68 119.27 1ajd s LEU 141 Ca 0.00 2.09 -0.29 0.00 0.02 0.00 0.00 54.13 55.95 1ajd s LEU 141 Cb 0.00 -4.57 -0.07 0.00 0.02 0.00 0.00 46.19 41.57 1ajd s LEU 141 CO 0.00 -1.16 0.91 0.00 0.02 0.00 0.00 176.35 176.13 1ajd s ALA 142 N -1.90 3.31 0.12 4.21 0.00 -0.41 -4.02 121.76 123.08 1ajd s ALA 142 Ca 0.71 0.53 0.09 0.00 0.00 0.00 0.00 51.96 53.29 1ajd s ALA 142 Cb -0.22 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1ajd s ALA 142 CO 0.27 0.09 -0.23 0.95 0.00 0.00 0.00 175.76 176.84 1ajd s THR 143 N -0.50 1.93 0.00 0.00 -4.23 -1.26 -0.88 115.64 110.70 1ajd s THR 143 Ca 0.43 -1.66 -0.00 0.00 -1.18 0.00 0.00 61.69 59.28 1ajd s THR 143 Cb -0.24 -1.74 -0.00 0.00 1.34 0.00 0.00 72.50 71.85 1ajd s THR 143 CO 0.29 -0.03 0.00 -0.83 -0.54 0.00 0.00 174.62 173.52 1ajd s GLY 144 N -2.03 0.04 -0.15 3.99 0.00 0.16 -1.90 107.32 107.43 1ajd s GLY 144 Ca 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 44.72 44.71 1ajd s GLY 144 CO 0.05 -0.11 -0.02 0.21 0.00 0.00 0.00 173.10 173.23 1ajd s ASN 145 N -0.28 2.59 0.01 1.64 3.84 -0.37 -1.88 114.94 120.48 1ajd s ASN 145 Ca -0.03 -0.58 0.04 0.00 0.21 0.00 0.00 52.86 52.50 1ajd s ASN 145 Cb -0.02 -0.74 -0.01 0.00 -0.55 0.00 0.00 41.25 39.92 1ajd s ASN 145 CO -0.00 -0.21 -0.12 -0.69 -2.79 0.00 0.00 177.10 173.29 1ajd s VAL 146 N 1.76 0.92 0.11 -5.21 1.01 0.22 -1.71 120.40 117.49 1ajd s VAL 146 Ca 0.01 -0.72 -0.26 0.00 0.00 0.00 0.00 61.98 61.02 1ajd s VAL 146 Cb -0.15 -0.82 0.07 0.00 0.00 0.00 0.00 36.38 35.49 1ajd s VAL 146 CO -0.07 0.10 0.88 -0.55 0.00 0.00 0.00 175.10 175.45 1ajd s SER 147 N -0.70 -0.29 0.02 3.32 0.15 -1.14 -0.97 113.70 114.08 1ajd s SER 147 Ca 0.02 -0.23 0.23 0.00 0.70 0.00 0.00 55.95 56.67 1ajd s SER 147 Cb -0.06 0.48 0.05 0.00 -1.71 0.00 0.00 66.02 64.78 1ajd s SER 147 CO 0.00 -0.84 1.05 0.35 1.20 0.00 0.00 173.24 175.00 1ajd n THR 148 N -0.38 0.07 -2.56 6.45 -2.24 -1.20 -3.95 114.28 110.47 1ajd n THR 148 Ca -0.08 -0.12 -0.23 0.00 -2.27 0.00 0.00 64.05 61.35 1ajd n THR 148 Cb 0.61 0.47 0.09 0.00 -2.10 0.00 0.00 70.33 69.40 1ajd n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajd s ALA 149 N -3.10 3.68 0.31 6.98 0.00 -1.26 -0.59 121.76 127.78 1ajd s ALA 149 Ca 0.06 -1.58 -0.29 0.00 0.00 0.00 0.00 51.96 50.15 1ajd s ALA 149 Cb 0.16 -2.08 -0.12 0.00 0.00 0.00 0.00 23.12 21.08 1ajd s ALA 149 CO 0.80 -1.31 1.48 -0.85 0.00 0.00 0.00 175.76 175.88 1ajd n GLU 150 N -2.75 2.46 0.00 0.00 0.28 -1.24 -1.85 120.64 117.54 1ajd n GLU 150 Ca 0.13 0.87 0.01 0.00 -0.16 0.00 0.00 57.16 58.01 1ajd n GLU 150 Cb 0.60 -2.58 0.05 0.00 1.43 0.00 0.00 31.44 30.94 1ajd n GLU 150 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1ajd n LEU 151 N 1.50 0.00 -1.21 -1.84 4.77 0.68 -0.49 117.00 120.42 1ajd n LEU 151 Ca 0.07 0.43 0.11 0.00 -0.03 0.00 0.00 56.01 56.59 1ajd n LEU 151 Cb 0.36 -0.43 0.28 0.00 -2.33 0.00 0.00 43.42 41.30 1ajd n LEU 151 CO 0.63 -0.40 0.74 0.00 -1.33 0.00 0.00 177.39 177.03 1ajd n GLN 152 N -1.43 2.53 -2.54 3.23 3.00 -1.26 -3.82 117.38 117.08 1ajd n GLN 152 Ca 0.01 -2.36 -0.34 0.00 -0.01 0.00 0.00 57.00 54.30 1ajd n GLN 152 Cb 0.02 -1.52 -0.03 0.00 0.00 0.00 0.00 30.24 28.71 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 -1.15 2.52 0.09 1.08 0.00 0.36 -4.79 107.32 105.43 1ajd s GLY 153 Ca 0.43 0.62 -0.21 0.00 0.00 0.00 0.00 44.72 45.56 1ajd s GLY 153 CO 0.31 0.94 1.36 0.00 0.00 0.00 0.00 173.10 175.71 1ajd h ALA 154 N 1.56 -0.51 -0.62 3.20 0.00 -1.91 -1.33 119.26 119.65 1ajd h ALA 154 Ca -0.50 0.03 0.12 0.00 0.00 0.00 0.00 54.91 54.57 1ajd h ALA 154 Cb 1.22 1.10 -0.12 0.00 0.00 0.00 0.00 17.79 19.99 1ajd h ALA 154 CO 0.59 -0.73 -0.15 1.15 0.00 0.00 0.00 179.25 180.11 1ajd h THR 155 N -0.15 0.39 0.01 0.00 2.02 -1.94 -1.10 112.91 112.12 1ajd h THR 155 Ca 0.07 -0.00 -0.19 0.00 0.77 0.00 0.00 66.41 67.06 1ajd h THR 155 Cb 0.34 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1ajd h THR 155 CO -0.49 0.00 -0.88 1.55 0.37 0.00 0.00 175.52 176.07 1ajd h PRO 156 N 0.01 0.13 -0.51 6.66 0.13 -1.82 -3.32 132.00 133.27 1ajd h PRO 156 Ca 0.30 -0.15 -0.07 0.00 -0.87 0.00 0.00 66.00 65.21 1ajd h PRO 156 Cb 0.46 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 1ajd h PRO 156 CO -0.63 0.92 0.04 0.00 -0.23 0.00 0.00 178.00 178.10 1ajd h ALA 157 N 1.02 1.11 0.00 -0.56 0.00 -0.47 -3.08 119.26 117.29 1ajd h ALA 157 Ca -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ajd h ALA 157 Cb 1.52 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1ajd h ALA 157 CO 0.13 0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.96 1ajd n ALA 158 N -2.47 1.03 0.11 0.00 0.00 -0.49 -0.36 120.51 118.34 1ajd n ALA 158 Ca 0.03 0.18 0.08 0.00 0.00 0.00 0.00 53.44 53.73 1ajd n ALA 158 Cb 0.28 -1.29 0.02 0.00 0.00 0.00 0.00 19.45 18.47 1ajd n ALA 158 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ajd h LEU 159 N 0.00 0.00 0.00 0.00 4.07 -1.73 -3.42 115.31 114.22 1ajd h LEU 159 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1ajd h LEU 159 Cb 0.01 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.75 1ajd h LEU 159 CO 0.00 0.19 -0.73 1.33 -1.08 0.00 0.00 178.44 178.15 1ajd n VAL 160 N -2.87 0.00 -4.09 1.22 0.24 -0.63 -4.40 118.33 107.80 1ajd n VAL 160 Ca -0.01 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.98 1ajd n VAL 160 Cb 0.63 -0.51 -0.07 0.00 -1.47 0.00 0.00 33.84 32.42 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 -1.68 3.51 -0.31 2.33 0.00 0.51 -4.56 121.76 121.57 1ajd s ALA 161 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.00 1ajd s ALA 161 Cb 0.00 -1.44 0.09 0.00 0.00 0.00 0.00 23.12 21.77 1ajd s ALA 161 CO 0.00 0.72 0.02 -1.01 0.00 0.00 0.00 175.76 175.49 1ajd s HIS 162 N -1.30 3.14 0.05 0.00 0.09 -1.25 -3.76 115.29 112.26 1ajd s HIS 162 Ca 0.26 -2.50 -0.16 0.00 -0.00 0.00 0.00 55.06 52.67 1ajd s HIS 162 Cb -0.12 -2.36 0.03 0.00 -0.00 0.00 0.00 32.58 30.13 1ajd s HIS 162 CO 0.19 -0.90 0.36 0.14 -0.00 0.00 0.00 174.74 174.52 1ajd s VAL 163 N 1.13 0.07 0.10 -0.90 -7.23 0.98 -4.96 120.40 109.59 1ajd s VAL 163 Ca 0.05 -0.58 0.21 0.00 -1.81 0.00 0.00 61.98 59.85 1ajd s VAL 163 Cb -0.19 -0.98 0.18 0.00 0.56 0.00 0.00 36.38 35.96 1ajd s VAL 163 CO -0.10 -0.32 1.75 0.71 -0.31 0.00 0.00 175.10 176.83 1ajd h THR 164 N 3.03 0.69 -3.58 5.32 1.35 -1.89 0.17 112.91 118.01 1ajd h THR 164 Ca -0.32 -1.37 -0.29 0.00 -0.55 0.00 0.00 66.41 63.89 1ajd h THR 164 Cb 1.21 1.89 -0.32 0.00 -1.73 0.00 0.00 68.15 69.20 1ajd h THR 164 CO 0.45 0.29 -0.73 -0.55 -0.25 0.00 0.00 175.52 174.74 1ajd s SER 165 N -6.30 0.08 0.30 5.36 0.15 -1.26 -3.26 113.70 108.77 1ajd s SER 165 Ca 0.01 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.69 1ajd s SER 165 Cb 0.10 -0.06 0.52 0.00 -1.71 0.00 0.00 66.02 64.87 1ajd s SER 165 CO 0.67 -0.09 1.91 0.08 1.20 0.00 0.00 173.24 177.01 1ajd h ARG 166 N 6.99 1.01 -0.45 5.44 0.11 -1.74 -2.27 114.38 123.46 1ajd h ARG 166 Ca -0.40 -0.06 0.13 0.00 0.10 0.00 0.00 59.98 59.75 1ajd h ARG 166 Cb 1.14 -0.23 -0.02 0.00 1.11 0.00 0.00 29.97 31.98 1ajd h ARG 166 CO 0.49 0.67 0.54 0.87 0.10 0.00 0.00 179.97 182.63 1ajd h LYS 167 N 1.04 0.00 -3.12 0.08 6.56 -1.93 -3.25 116.57 115.95 1ajd h LYS 167 Ca 0.39 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.52 1ajd h LYS 167 Cb 0.18 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.86 1ajd h LYS 167 CO -0.14 0.00 2.70 0.00 -2.06 0.00 0.00 179.45 179.94 1ajd n TYR 169 N 3.76 0.00 -4.64 0.00 4.02 -1.23 -1.28 117.16 117.79 1ajd n TYR 169 Ca 0.55 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 58.15 1ajd n TYR 169 Cb 0.24 -0.36 -0.08 0.00 -0.02 0.00 0.00 39.34 39.13 1ajd n TYR 169 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1ajd s GLY 170 N -0.72 2.86 0.00 2.72 0.00 -1.26 -0.43 107.32 110.49 1ajd s GLY 170 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 43.98 1ajd s GLY 170 CO 0.00 -2.01 0.04 -1.05 0.00 0.00 0.00 173.10 170.09 1ajd n PRO 171 N -1.10 0.00 -0.34 2.90 -0.02 -1.26 -2.12 135.00 133.06 1ajd n PRO 171 Ca -0.13 0.04 -0.08 0.00 -2.02 0.00 0.00 63.50 61.31 1ajd n PRO 171 Cb 0.66 -0.07 -0.07 0.00 -0.02 0.00 0.00 33.50 33.99 1ajd n PRO 171 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1ajd n SER 172 N -1.64 -0.84 0.01 2.55 7.64 -1.26 -1.47 113.62 118.61 1ajd n SER 172 Ca 0.00 1.45 -0.13 0.00 1.01 0.00 0.00 58.87 61.20 1ajd n SER 172 Cb 0.00 -0.20 -0.09 0.00 -1.01 0.00 0.00 64.21 62.91 1ajd n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ajd h ALA 173 N 0.46 -0.04 -0.79 -0.43 0.00 -1.75 -3.16 119.26 113.55 1ajd h ALA 173 Ca 0.14 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.04 1ajd h ALA 173 Cb 0.34 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.03 1ajd h ALA 173 CO -0.77 -0.32 0.17 1.15 0.00 0.00 0.00 179.25 179.48 1ajd h THR 174 N -0.45 0.42 -0.70 0.00 2.02 -1.25 0.84 112.91 113.79 1ajd h THR 174 Ca -0.00 -0.08 0.09 0.00 0.77 0.00 0.00 66.41 67.19 1ajd h THR 174 Cb 0.42 0.18 -0.07 0.00 -1.74 0.00 0.00 68.15 66.93 1ajd h THR 174 CO 0.01 0.04 0.34 0.28 0.37 0.00 0.00 175.52 176.56 1ajd h SER 175 N 0.23 0.44 0.03 4.18 0.02 -1.23 0.84 113.55 118.06 1ajd h SER 175 Ca 0.46 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.47 1ajd h SER 175 Cb 0.84 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1ajd h SER 175 CO -0.58 0.25 -0.88 -1.84 -1.14 0.00 0.00 176.83 172.65 1ajd n GLU 176 N -4.87 0.20 -0.02 3.45 0.28 0.20 -4.18 120.64 115.70 1ajd n GLU 176 Ca 0.11 -0.16 -0.03 0.00 -0.16 0.00 0.00 57.16 56.92 1ajd n GLU 176 Cb 0.27 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.61 1ajd n GLU 176 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1ajd n LYS 177 N -1.26 2.56 -3.24 3.44 5.02 0.27 -4.83 118.16 120.12 1ajd n LYS 177 Ca 0.05 0.01 -0.24 0.00 -2.02 0.00 0.00 58.31 56.10 1ajd n LYS 177 Cb 0.35 -1.12 -0.07 0.00 -0.02 0.00 0.00 35.03 34.18 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 3.87 -0.53 -0.00 0.00 0.11 -1.66 -0.79 132.00 132.99 1ajd h PRO 179 Ca 0.12 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1ajd h PRO 179 Cb 0.80 0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ajd h PRO 179 CO 0.60 -0.36 0.12 0.78 -0.21 0.00 0.00 178.00 178.94 1ajd h GLY 180 N -0.55 0.00 0.63 -0.55 0.00 -1.89 0.33 103.07 101.03 1ajd h GLY 180 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1ajd h GLY 180 CO -0.30 0.00 -0.87 0.70 0.00 0.00 0.00 176.54 176.07 1ajd n ASN 181 N -3.03 0.65 -4.74 0.19 5.03 -0.46 -3.50 115.26 109.39 1ajd n ASN 181 Ca -0.03 -0.33 -0.41 0.00 0.87 0.00 0.00 54.58 54.68 1ajd n ASN 181 Cb 0.18 0.66 -0.02 0.00 -1.02 0.00 0.00 39.78 39.58 1ajd n ASN 181 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ajd s ALA 182 N -3.11 3.65 0.41 5.41 0.00 0.12 -0.35 121.76 127.89 1ajd s ALA 182 Ca 0.06 1.36 0.08 0.00 0.00 0.00 0.00 51.96 53.46 1ajd s ALA 182 Cb 0.15 -3.57 0.87 0.00 0.00 0.00 0.00 23.12 20.58 1ajd s ALA 182 CO 0.78 -0.77 2.04 1.25 0.00 0.00 0.00 175.76 179.06 1ajd h LEU 183 N 5.18 0.47 -0.14 0.00 5.85 -1.86 0.86 115.31 125.67 1ajd h LEU 183 Ca -0.46 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.23 1ajd h LEU 183 Cb 1.22 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1ajd h LEU 183 CO 0.79 0.33 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.87 1ajd h GLU 184 N 0.55 0.26 -1.52 1.25 3.07 -1.88 -2.89 114.58 113.42 1ajd h GLU 184 Ca 0.19 -0.09 -0.10 0.00 -0.50 0.00 0.00 59.36 58.86 1ajd h GLU 184 Cb 0.07 -0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 27.91 1ajd h GLU 184 CO -0.05 0.53 0.12 1.63 -1.40 0.00 0.00 179.01 179.85 1ajd n LYS 185 N -4.73 1.24 -0.86 2.33 5.02 -0.75 -4.81 118.16 115.59 1ajd n LYS 185 Ca -0.06 -0.49 0.00 0.00 -2.02 0.00 0.00 58.31 55.74 1ajd n LYS 185 Cb 0.24 -1.19 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 1ajd n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ajd n GLY 186 N 0.79 0.11 3.73 0.72 0.00 -1.08 -4.74 105.19 104.72 1ajd n GLY 186 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 1.60 0.00 -0.02 0.00 0.29 -4.94 107.32 102.25 1ajd s GLY 187 Ca 0.00 -0.68 0.26 0.00 0.00 0.00 0.00 44.72 44.30 1ajd s GLY 187 CO 0.00 -0.00 1.85 0.28 0.00 0.00 0.00 173.10 175.23 1ajd n LYS 188 N -4.12 0.05 0.00 2.90 5.02 -1.14 -4.12 118.16 116.75 1ajd n LYS 188 Ca 0.09 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1ajd n LYS 188 Cb 0.59 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 1ajd n LYS 188 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ajd n GLY 189 N 1.18 2.53 3.67 0.72 0.00 0.53 -4.46 105.19 109.36 1ajd n GLY 189 Ca 0.07 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.66 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 1.73 0.09 1.61 1.04 -1.26 -4.65 113.70 112.26 1ajd s SER 190 Ca 0.00 0.69 -0.27 0.00 0.48 0.00 0.00 55.95 56.85 1ajd s SER 190 Cb 0.00 -1.00 -0.13 0.00 0.10 0.00 0.00 66.02 64.99 1ajd s SER 190 CO 0.00 -3.63 1.66 0.40 0.98 0.00 0.00 173.24 172.65 1ajd h ILE 191 N -2.24 0.56 -0.53 -1.02 2.04 0.26 0.16 117.51 116.74 1ajd h ILE 191 Ca -0.47 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1ajd h ILE 191 Cb 1.30 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1ajd h ILE 191 CO 0.41 0.00 0.18 0.74 0.00 0.00 0.00 178.15 179.48 1ajd h THR 192 N -0.46 1.20 -0.49 -0.27 2.02 -0.99 0.47 112.91 114.40 1ajd h THR 192 Ca -0.01 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 1ajd h THR 192 Cb 0.41 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1ajd h THR 192 CO -0.02 0.26 0.21 -0.33 0.37 0.00 0.00 175.52 176.01 1ajd h GLU 193 N 0.76 0.72 -0.35 6.66 5.08 -1.61 -2.49 114.58 123.35 1ajd h GLU 193 Ca 0.18 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1ajd h GLU 193 Cb 0.19 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1ajd h GLU 193 CO -0.01 0.63 -0.06 1.96 -1.00 0.00 0.00 179.01 180.53 1ajd h GLN 194 N 0.65 0.66 -0.86 2.33 4.20 -0.19 -2.09 115.11 119.81 1ajd h GLN 194 Ca 0.17 -0.24 0.19 0.00 0.06 0.00 0.00 58.65 58.83 1ajd h GLN 194 Cb 0.16 -0.04 -0.16 0.00 0.30 0.00 0.00 27.48 27.74 1ajd h GLN 194 CO -0.02 0.81 -0.09 1.25 -0.67 0.00 0.00 178.83 180.11 1ajd h LEU 195 N 0.45 -0.58 -0.11 1.46 7.12 -0.74 0.62 115.31 123.53 1ajd h LEU 195 Ca 0.09 0.24 -0.01 0.00 0.13 0.00 0.00 57.88 58.33 1ajd h LEU 195 Cb 0.55 0.46 -0.00 0.00 -0.53 0.00 0.00 40.66 41.13 1ajd h LEU 195 CO 0.03 -0.27 0.02 -0.07 -0.13 0.00 0.00 178.44 178.03 1ajd h LEU 196 N 0.04 0.17 -2.25 2.25 4.07 -1.11 -2.45 115.31 116.02 1ajd h LEU 196 Ca 0.46 -0.25 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 1ajd h LEU 196 Cb 0.80 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 1ajd h LEU 196 CO -0.82 0.37 -0.03 0.78 -1.08 0.00 0.00 178.44 177.66 1ajd h ASN 197 N -0.04 0.00 0.04 -0.43 2.35 -0.02 -2.79 115.58 114.69 1ajd h ASN 197 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1ajd h ASN 197 Cb 0.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1ajd h ASN 197 CO 0.00 0.03 -0.02 0.00 -1.65 0.00 0.00 177.43 175.79 1ajd h ALA 198 N 1.97 -0.05 -5.55 -0.83 0.00 0.55 -3.49 119.26 111.86 1ajd h ALA 198 Ca -0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1ajd h ALA 198 Cb 0.06 0.02 0.03 0.00 0.00 0.00 0.00 17.79 17.90 1ajd h ALA 198 CO 0.00 -0.34 -0.25 -2.13 0.00 0.00 0.00 179.25 176.54 1ajd n ARG 199 N -4.93 -1.46 -2.81 0.00 0.63 -1.01 -4.99 116.66 102.10 1ajd n ARG 199 Ca -0.08 1.31 -0.38 0.00 -0.92 0.00 0.00 57.85 57.78 1ajd n ARG 199 Cb 0.21 -5.38 -0.06 0.00 0.45 0.00 0.00 32.46 27.68 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 -3.07 3.28 0.26 5.13 0.00 -1.26 -4.94 121.76 121.16 1ajd s ALA 200 Ca 0.08 0.52 -0.02 0.00 0.00 0.00 0.00 51.96 52.53 1ajd s ALA 200 Cb -0.01 -3.15 0.55 0.00 0.00 0.00 0.00 23.12 20.51 1ajd s ALA 200 CO 0.77 0.20 1.69 -0.44 0.00 0.00 0.00 175.76 177.98 1ajd h ASP 201 N 3.56 0.12 -3.45 0.00 3.32 -1.83 -3.41 116.42 114.72 1ajd h ASP 201 Ca -0.46 0.15 -0.44 0.00 0.02 0.00 0.00 57.03 56.29 1ajd h ASP 201 Cb 1.19 0.18 -0.34 0.00 0.22 0.00 0.00 39.33 40.59 1ajd h ASP 201 CO 0.66 -0.02 -0.79 -0.69 -1.72 0.00 0.00 179.24 176.68 1ajd s VAL 202 N -5.99 0.73 -0.12 -1.35 1.01 -0.80 -0.72 120.40 113.16 1ajd s VAL 202 Ca -0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1ajd s VAL 202 Cb 0.23 -0.71 0.04 0.00 0.00 0.00 0.00 36.38 35.94 1ajd s VAL 202 CO 0.76 0.27 0.05 -0.89 0.00 0.00 0.00 175.10 175.29 1ajd s THR 203 N 0.80 0.12 0.07 3.92 2.01 0.22 -1.24 115.64 121.54 1ajd s THR 203 Ca -0.13 -0.01 0.06 0.00 0.31 0.00 0.00 61.69 61.92 1ajd s THR 203 Cb -0.15 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1ajd s THR 203 CO 0.01 -0.02 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.00 1ajd s LEU 204 N 2.06 2.26 0.00 4.42 1.43 -0.70 0.19 118.68 128.35 1ajd s LEU 204 Ca 0.03 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 1ajd s LEU 204 Cb -0.14 -0.66 0.00 0.00 0.03 0.00 0.00 46.19 45.42 1ajd s LEU 204 CO -0.06 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.12 1ajd n GLY 205 N 1.34 0.42 0.00 -3.19 0.00 -0.01 -2.91 105.19 100.85 1ajd n GLY 205 Ca -0.20 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.00 1.02 0.00 -0.02 0.00 -0.77 -1.05 105.19 103.36 1ajd n GLY 206 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 5.00 1.02 0.31 -0.02 0.00 0.29 -0.23 105.19 111.56 1ajd n GLY 207 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.27 1ajd n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ajd n ALA 208 N -1.41 0.87 -0.25 4.61 0.00 -0.20 -1.76 120.51 122.37 1ajd n ALA 208 Ca 0.00 0.44 -0.09 0.00 0.00 0.00 0.00 53.44 53.79 1ajd n ALA 208 Cb 0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 19.45 18.80 1ajd n ALA 208 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1ajd h LYS 209 N 0.00 -0.19 0.00 0.00 3.11 -1.35 0.53 116.57 118.68 1ajd h LYS 209 Ca 0.50 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 58.35 1ajd h LYS 209 Cb 1.77 0.04 0.00 0.00 -1.00 0.00 0.00 32.23 33.04 1ajd h LYS 209 CO -0.17 -0.13 0.00 2.41 -2.81 0.00 0.00 179.45 178.76 1ajd n THR 210 N -5.38 1.09 0.56 1.00 -1.04 -0.72 -2.59 114.28 107.19 1ajd n THR 210 Ca 0.02 0.36 0.13 0.00 -2.04 0.00 0.00 64.05 62.51 1ajd n THR 210 Cb 0.34 -1.25 0.44 0.00 -1.82 0.00 0.00 70.33 68.04 1ajd n THR 210 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1ajd n PHE 211 N -1.90 0.87 0.21 -1.42 3.01 0.18 -2.33 117.46 116.08 1ajd n PHE 211 Ca 0.02 0.28 0.10 0.00 1.01 0.00 0.00 57.45 58.86 1ajd n PHE 211 Cb 0.15 -0.95 0.24 0.00 -0.01 0.00 0.00 39.48 38.90 1ajd n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ajd h ALA 212 N 2.45 0.92 -2.37 4.37 0.00 -1.58 -0.26 119.26 122.81 1ajd h ALA 212 Ca 0.00 -0.13 -0.58 0.00 0.00 0.00 0.00 54.91 54.20 1ajd h ALA 212 Cb 0.61 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 18.47 1ajd h ALA 212 CO 0.00 0.18 0.52 -1.91 0.00 0.00 0.00 179.25 178.04 1ajd n GLU 213 N -3.16 2.00 -4.19 0.00 2.13 -0.99 -4.58 120.64 111.85 1ajd n GLU 213 Ca 0.03 0.71 -0.35 0.00 0.66 0.00 0.00 57.16 58.20 1ajd n GLU 213 Cb 0.54 -2.30 -0.08 0.00 0.27 0.00 0.00 31.44 29.86 1ajd n GLU 213 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 1ajd s THR 214 N -0.56 4.72 0.61 6.31 -1.32 -1.26 -0.36 115.64 123.79 1ajd s THR 214 Ca 0.62 -0.13 -0.19 0.00 -1.21 0.00 0.00 61.69 60.79 1ajd s THR 214 Cb -0.63 -3.03 -0.03 0.00 -1.51 0.00 0.00 72.50 67.31 1ajd s THR 214 CO 0.56 0.58 1.25 0.00 -2.21 0.00 0.00 174.62 174.79 1ajd s ALA 215 N -0.97 2.49 -0.73 11.08 0.00 -0.37 -4.85 121.76 128.42 1ajd s ALA 215 Ca 0.15 1.11 0.10 0.00 0.00 0.00 0.00 51.96 53.32 1ajd s ALA 215 Cb -0.12 -3.50 0.27 0.00 0.00 0.00 0.00 23.12 19.78 1ajd s ALA 215 CO 0.04 -1.36 1.23 0.25 0.00 0.00 0.00 175.76 175.92 1ajd n THR 216 N -1.69 1.10 -3.24 0.00 -2.24 -1.26 -1.07 114.28 105.86 1ajd n THR 216 Ca 0.14 -1.07 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 1ajd n THR 216 Cb 0.49 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1ajd n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajd n ALA 217 N 0.27 0.00 -0.93 6.98 0.00 -1.26 -4.73 120.51 120.83 1ajd n ALA 217 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.67 1ajd n ALA 217 Cb 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 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 -2.19 0.00 0.00 0.00 -1.26 -2.39 105.19 99.34 1ajd n GLY 218 Ca 0.00 -1.26 0.04 0.00 0.00 0.00 0.00 46.02 44.81 1ajd n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ajd n GLU 219 N -3.51 0.42 -1.53 1.61 -0.58 -1.26 -2.11 120.64 113.68 1ajd n GLU 219 Ca -0.02 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.72 1ajd n GLU 219 Cb 0.43 -1.32 0.09 0.00 -0.57 0.00 0.00 31.44 30.07 1ajd n GLU 219 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1ajd n TRP 220 N -0.82 0.68 -1.14 -0.32 8.01 -1.26 -5.08 117.44 117.51 1ajd n TRP 220 Ca 0.06 -1.39 -0.32 0.00 -1.31 0.00 0.00 57.50 54.54 1ajd n TRP 220 Cb 0.03 -0.23 0.12 0.00 -2.01 0.00 0.00 31.31 29.22 1ajd n TRP 220 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.69 175.54 1ajd s GLN 221 N -2.31 1.77 0.00 -0.99 0.74 -0.90 -2.56 119.66 115.41 1ajd s GLN 221 Ca 0.37 1.54 0.00 0.00 0.05 0.00 0.00 55.36 57.32 1ajd s GLN 221 Cb 0.37 -1.81 0.00 0.00 1.10 0.00 0.00 33.01 32.67 1ajd s GLN 221 CO -0.08 -2.07 0.00 0.41 -0.55 0.00 0.00 175.29 173.00 1ajd n GLY 222 N -0.05 0.44 3.87 2.59 0.00 -0.24 -4.85 105.19 106.95 1ajd n GLY 222 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1ajd n GLY 222 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ajd s LYS 223 N 0.00 3.37 0.78 1.61 2.47 -1.06 -4.77 119.74 122.15 1ajd s LYS 223 Ca 0.00 -0.26 -0.11 0.00 -1.56 0.00 0.00 55.97 54.05 1ajd s LYS 223 Cb 0.00 -3.10 0.06 0.00 -1.46 0.00 0.00 37.83 33.34 1ajd s LYS 223 CO 0.00 0.72 1.09 0.95 0.16 0.00 0.00 175.35 178.27 1ajd s THR 224 N -1.15 3.27 0.46 3.43 -4.23 -1.26 -1.23 115.64 114.93 1ajd s THR 224 Ca 0.20 0.41 0.22 0.00 -1.18 0.00 0.00 61.69 61.35 1ajd s THR 224 Cb -0.12 -2.89 0.26 0.00 1.34 0.00 0.00 72.50 71.08 1ajd s THR 224 CO 0.10 -0.54 2.07 -0.07 -0.54 0.00 0.00 174.62 175.65 1ajd h LEU 225 N -1.17 0.00 0.09 4.79 4.07 -0.32 0.12 115.31 122.88 1ajd h LEU 225 Ca -0.44 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.32 1ajd h LEU 225 Cb 1.23 0.00 0.02 0.00 1.08 0.00 0.00 40.66 43.00 1ajd h LEU 225 CO 0.51 0.12 -0.84 -0.09 -1.08 0.00 0.00 178.44 177.07 1ajd h ARG 226 N 0.00 0.42 -0.81 1.13 2.43 -1.31 -0.21 114.38 116.02 1ajd h ARG 226 Ca -0.00 -0.56 -0.01 0.00 -0.81 0.00 0.00 59.98 58.60 1ajd h ARG 226 Cb 0.27 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 1ajd h ARG 226 CO 0.02 1.22 0.48 0.93 -1.51 0.00 0.00 179.97 181.11 1ajd h GLU 227 N -0.12 1.11 0.00 0.20 5.08 -1.68 -2.09 114.58 117.08 1ajd h GLU 227 Ca -0.13 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1ajd h GLU 227 Cb 1.58 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1ajd h GLU 227 CO 0.16 0.78 -0.00 0.37 -1.00 0.00 0.00 179.01 179.32 1ajd h GLN 228 N 1.12 -0.01 -0.59 2.33 4.15 -0.80 -2.09 115.11 119.23 1ajd h GLN 228 Ca 0.29 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.77 1ajd h GLN 228 Cb -0.03 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 27.57 1ajd h GLN 228 CO -0.05 0.35 -0.55 0.00 -1.93 0.00 0.00 178.83 176.65 1ajd h ALA 229 N 0.63 -0.69 0.23 3.38 0.00 -0.48 0.48 119.26 122.80 1ajd h ALA 229 Ca -0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ajd h ALA 229 Cb 0.36 1.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 1ajd h ALA 229 CO 0.00 -1.00 -0.34 0.93 0.00 0.00 0.00 179.25 178.84 1ajd h GLU 230 N -0.26 -0.61 -0.94 0.00 5.08 -1.45 -1.34 114.58 115.07 1ajd h GLU 230 Ca 0.10 0.04 0.22 0.00 -1.00 0.00 0.00 59.36 58.72 1ajd h GLU 230 Cb 0.52 0.14 -0.12 0.00 0.50 0.00 0.00 28.75 29.78 1ajd h GLU 230 CO -0.69 -0.41 0.48 0.00 -1.00 0.00 0.00 179.01 177.39 1ajd h ALA 231 N -0.08 1.57 0.00 3.43 0.00 -0.50 0.16 119.26 123.83 1ajd h ALA 231 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ajd h ALA 231 Cb 0.61 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ajd h ALA 231 CO -0.13 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 178.85 1ajd h ARG 232 N 0.51 0.00 0.00 0.00 3.08 0.32 -3.46 114.38 114.83 1ajd h ARG 232 Ca 0.58 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.63 1ajd h ARG 232 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1ajd h ARG 232 CO -0.49 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.82 1ajd n GLY 233 N 0.34 1.01 3.83 0.04 0.00 0.55 -5.05 105.19 105.91 1ajd n GLY 233 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.84 3.27 -0.22 1.61 1.51 -0.54 -3.79 117.35 117.35 1ajd s TYR 234 Ca 0.00 1.45 -0.01 0.00 -1.01 0.00 0.00 57.07 57.50 1ajd s TYR 234 Cb 0.00 -2.87 0.02 0.00 -0.11 0.00 0.00 41.96 39.00 1ajd s TYR 234 CO 0.00 -0.79 -0.11 1.14 -1.11 0.00 0.00 175.55 174.67 1ajd s GLN 235 N -4.37 2.99 0.28 -0.62 -2.07 0.15 -4.40 119.66 111.62 1ajd s GLN 235 Ca 0.60 -0.86 -0.07 0.00 -1.82 0.00 0.00 55.36 53.21 1ajd s GLN 235 Cb -0.13 -2.83 -0.06 0.00 -1.09 0.00 0.00 33.01 28.90 1ajd s GLN 235 CO 0.40 -0.29 0.57 -0.51 -1.32 0.00 0.00 175.29 174.13 1ajd s LEU 236 N 1.34 4.08 -0.26 2.60 1.02 -1.26 -0.77 118.68 125.42 1ajd s LEU 236 Ca 0.03 0.81 -0.10 0.00 0.02 0.00 0.00 54.13 54.89 1ajd s LEU 236 Cb -0.15 -3.62 0.11 0.00 0.02 0.00 0.00 46.19 42.55 1ajd s LEU 236 CO -0.07 -0.17 0.57 -0.69 0.02 0.00 0.00 176.35 176.01 1ajd s VAL 237 N -2.02 -0.69 -1.91 -1.59 1.01 -0.77 -4.93 120.40 109.51 1ajd s VAL 237 Ca 0.46 0.06 0.21 0.00 0.00 0.00 0.00 61.98 62.71 1ajd s VAL 237 Cb -0.11 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 1ajd s VAL 237 CO 0.27 0.02 1.04 -1.54 0.00 0.00 0.00 175.10 174.90 1ajd n SER 238 N 5.20 1.93 -3.38 3.32 3.41 -1.26 -1.80 113.62 121.04 1ajd n SER 238 Ca -0.13 -1.47 -0.18 0.00 -0.26 0.00 0.00 58.87 56.84 1ajd n SER 238 Cb 0.51 0.50 -0.07 0.00 -0.26 0.00 0.00 64.21 64.89 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 -2.41 1.37 0.12 4.04 1.47 -1.26 -4.42 116.67 115.59 1ajd s ASP 239 Ca 0.17 -1.66 -0.13 0.00 1.18 0.00 0.00 52.55 52.11 1ajd s ASP 239 Cb 0.17 0.57 -0.05 0.00 -0.34 0.00 0.00 42.92 43.28 1ajd s ASP 239 CO 0.56 -1.11 1.48 0.00 0.68 0.00 0.00 175.17 176.78 1ajd h ALA 240 N 2.16 0.53 -0.14 2.11 0.00 -0.11 -2.57 119.26 121.24 1ajd h ALA 240 Ca -0.27 -0.39 0.03 0.00 0.00 0.00 0.00 54.91 54.28 1ajd h ALA 240 Cb 1.23 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 1ajd h ALA 240 CO 0.38 0.52 -0.49 0.00 0.00 0.00 0.00 179.25 179.67 1ajd h ALA 241 N 0.78 -0.84 -0.08 0.00 0.00 -1.89 -1.32 119.26 115.93 1ajd h ALA 241 Ca 0.07 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1ajd h ALA 241 Cb 0.81 0.97 -0.01 0.00 0.00 0.00 0.00 17.79 19.57 1ajd h ALA 241 CO 0.07 -1.02 -0.23 0.66 0.00 0.00 0.00 179.25 178.73 1ajd h SER 242 N -0.51 0.12 -0.60 0.00 4.64 -1.96 -2.26 113.55 112.98 1ajd h SER 242 Ca 0.03 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1ajd h SER 242 Cb 0.60 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 1ajd h SER 242 CO -0.40 0.36 0.23 0.25 -0.87 0.00 0.00 176.83 176.40 1ajd h LEU 243 N 0.12 0.87 -0.81 5.97 5.85 -0.98 -2.40 115.31 123.93 1ajd h LEU 243 Ca 0.02 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 1ajd h LEU 243 Cb 0.48 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1ajd h LEU 243 CO 0.03 0.79 -0.22 0.78 -0.34 0.00 0.00 178.44 179.48 1ajd h ASN 244 N 0.92 0.00 1.54 1.25 2.35 -0.67 -2.85 115.58 118.12 1ajd h ASN 244 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1ajd h ASN 244 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1ajd h ASN 244 CO -0.02 0.22 0.00 0.77 -1.65 0.00 0.00 177.43 176.76 1ajd h SER 245 N 0.00 0.00 -2.53 5.81 4.64 -1.16 -3.43 113.55 116.88 1ajd h SER 245 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1ajd h SER 245 Cb 0.87 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.94 1ajd h SER 245 CO 0.03 0.00 1.31 -0.69 -0.87 0.00 0.00 176.83 176.61 1ajd s VAL 246 N -3.24 3.41 -2.81 0.95 1.01 -1.08 -4.83 120.40 113.80 1ajd s VAL 246 Ca 0.07 0.40 0.23 0.00 0.00 0.00 0.00 61.98 62.69 1ajd s VAL 246 Cb 0.09 -3.58 0.23 0.00 0.00 0.00 0.00 36.38 33.12 1ajd s VAL 246 CO 0.60 -0.39 1.27 0.35 0.00 0.00 0.00 175.10 176.92 1ajd n THR 247 N 7.45 0.10 -3.98 3.92 -2.24 -1.26 -4.96 114.28 113.31 1ajd n THR 247 Ca 0.24 -0.55 -0.09 0.00 -2.27 0.00 0.00 64.05 61.38 1ajd n THR 247 Cb 0.47 1.38 -0.11 0.00 -2.10 0.00 0.00 70.33 69.98 1ajd n THR 247 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ajd s GLU 248 N -1.85 0.38 -0.32 -0.78 8.01 -1.26 -5.04 118.70 117.83 1ajd s GLU 248 Ca 0.29 -0.67 0.04 0.00 0.01 0.00 0.00 54.97 54.64 1ajd s GLU 248 Cb 0.20 0.14 0.19 0.00 -4.31 0.00 0.00 34.13 30.35 1ajd s GLU 248 CO 0.30 -0.07 0.67 0.00 0.01 0.00 0.00 175.26 176.16 1ajd s ALA 249 N -1.81 -2.65 0.28 5.21 0.00 -1.26 -4.87 121.76 116.66 1ajd s ALA 249 Ca -0.13 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.72 1ajd s ALA 249 Cb -0.07 -2.64 -0.00 0.00 0.00 0.00 0.00 23.12 20.40 1ajd s ALA 249 CO -0.02 -1.99 0.35 0.27 0.00 0.00 0.00 175.76 174.37 1ajd n ASN 250 N 5.05 -0.97 0.21 0.00 2.04 -0.98 -4.82 115.26 115.80 1ajd n ASN 250 Ca 0.07 -2.58 0.06 0.00 -0.44 0.00 0.00 54.58 51.69 1ajd n ASN 250 Cb 0.56 1.88 0.54 0.00 -2.53 0.00 0.00 39.78 40.23 1ajd n ASN 250 CO 0.00 0.00 0.00 1.56 -0.44 0.00 0.00 177.26 178.38 1ajd h GLN 251 N 0.00 0.06 -0.68 -3.83 1.08 -1.94 -1.24 115.11 108.56 1ajd h GLN 251 Ca -0.21 -0.01 -0.42 0.00 -1.45 0.00 0.00 58.65 56.56 1ajd h GLN 251 Cb 0.96 -0.01 -0.24 0.00 -0.05 0.00 0.00 27.48 28.13 1ajd h GLN 251 CO 0.29 0.14 0.11 1.04 -0.95 0.00 0.00 178.83 179.46 1ajd n GLN 252 N -4.42 2.42 -2.66 1.46 1.13 -1.26 -4.45 117.38 109.60 1ajd n GLN 252 Ca -0.02 -3.37 -0.03 0.00 -1.94 0.00 0.00 57.00 51.64 1ajd n GLN 252 Cb 0.17 -2.07 0.09 0.00 0.11 0.00 0.00 30.24 28.54 1ajd n GLN 252 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1ajd n LYS 253 N -1.01 0.14 -2.04 -1.09 5.02 -0.94 -5.01 118.16 113.23 1ajd n LYS 253 Ca 0.46 -0.68 -0.34 0.00 -2.02 0.00 0.00 58.31 55.73 1ajd n LYS 253 Cb 1.05 -0.11 0.02 0.00 -0.02 0.00 0.00 35.03 35.98 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 0.03 3.10 -0.17 1.97 0.04 -0.51 -2.31 135.00 137.14 1ajd s PRO 254 Ca 0.17 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 62.70 1ajd s PRO 254 Cb 0.25 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.78 1ajd s PRO 254 CO -0.17 -1.04 0.05 -1.17 0.04 0.00 0.00 177.00 174.71 1ajd s LEU 255 N -4.23 3.76 -0.29 -3.56 2.96 0.10 0.30 118.68 117.72 1ajd s LEU 255 Ca 0.71 0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 54.69 1ajd s LEU 255 Cb -0.23 -1.94 0.09 0.00 0.50 0.00 0.00 46.19 44.61 1ajd s LEU 255 CO 0.33 0.20 0.08 -0.22 -1.32 0.00 0.00 176.35 175.42 1ajd s LEU 256 N 0.23 2.05 -0.57 -0.68 2.96 0.05 -0.61 118.68 122.11 1ajd s LEU 256 Ca 0.03 -1.47 -0.14 0.00 -0.22 0.00 0.00 54.13 52.33 1ajd s LEU 256 Cb -0.12 -0.83 0.14 0.00 0.50 0.00 0.00 46.19 45.88 1ajd s LEU 256 CO 0.01 -0.39 0.51 -0.83 -1.32 0.00 0.00 176.35 174.32 1ajd s GLY 257 N 1.65 2.17 -0.58 7.98 0.00 0.13 -1.84 107.32 116.83 1ajd s GLY 257 Ca 0.07 -2.67 -0.19 0.00 0.00 0.00 0.00 44.72 41.93 1ajd s GLY 257 CO -0.22 1.19 0.69 1.08 0.00 0.00 0.00 173.10 175.84 1ajd s LEU 258 N 1.31 5.42 0.00 0.66 1.43 -0.75 -0.83 118.68 125.91 1ajd s LEU 258 Ca 0.06 -1.43 0.28 0.00 -1.03 0.00 0.00 54.13 52.01 1ajd s LEU 258 Cb -0.26 -2.30 1.05 0.00 0.03 0.00 0.00 46.19 44.71 1ajd s LEU 258 CO 0.00 -1.09 1.74 0.49 0.23 0.00 0.00 176.35 177.73 1ajd n PHE 259 N 6.26 0.00 -3.60 0.29 3.72 -0.22 -4.27 117.46 119.64 1ajd n PHE 259 Ca -0.10 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.21 1ajd n PHE 259 Cb 0.42 -0.05 -0.06 0.00 -0.94 0.00 0.00 39.48 38.86 1ajd n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ajd s ALA 260 N -2.18 -1.97 0.39 4.37 0.00 -1.26 -4.93 121.76 116.17 1ajd s ALA 260 Ca 0.34 1.69 0.15 0.00 0.00 0.00 0.00 51.96 54.14 1ajd s ALA 260 Cb 0.20 -1.03 0.87 0.00 0.00 0.00 0.00 23.12 23.16 1ajd s ALA 260 CO 0.40 -0.27 1.90 -0.44 0.00 0.00 0.00 175.76 177.35 1ajd h ASP 261 N 3.01 0.00 0.00 0.00 3.32 -1.90 0.88 116.42 121.73 1ajd h ASP 261 Ca -0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.84 1ajd h ASP 261 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1ajd h ASP 261 CO 0.24 0.29 0.00 0.61 -1.72 0.00 0.00 179.24 178.66 1ajd n GLY 262 N -0.64 3.15 3.79 2.75 0.00 -1.26 -1.15 105.19 111.83 1ajd n GLY 262 Ca -0.02 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.96 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 0.83 7.30 1.09 1.61 0.01 -1.26 -0.59 114.94 123.92 1ajd s ASN 263 Ca 0.00 1.59 -0.12 0.00 -0.71 0.00 0.00 52.86 53.61 1ajd s ASN 263 Cb 0.00 -2.48 0.24 0.00 0.41 0.00 0.00 41.25 39.42 1ajd s ASN 263 CO 0.00 0.16 1.06 -0.04 -1.51 0.00 0.00 177.10 176.77 1ajd s MET 264 N -1.38 -0.30 0.36 -0.60 -1.94 0.25 -4.95 119.30 110.74 1ajd s MET 264 Ca 0.38 0.81 -0.27 0.00 -1.71 0.00 0.00 55.69 54.90 1ajd s MET 264 Cb -0.21 -1.63 -0.09 0.00 2.01 0.00 0.00 34.83 34.91 1ajd s MET 264 CO 0.25 -3.30 1.22 -2.14 -0.01 0.00 0.00 175.02 171.03 1ajd s PRO 265 N -4.64 4.24 0.29 2.03 0.02 -1.26 -4.96 135.00 130.73 1ajd s PRO 265 Ca 0.67 1.99 -0.25 0.00 0.02 0.00 0.00 61.00 63.44 1ajd s PRO 265 Cb -0.23 -2.90 -0.09 0.00 0.02 0.00 0.00 34.50 31.30 1ajd s PRO 265 CO 0.62 -0.21 0.89 0.14 -0.33 0.00 0.00 177.00 178.11 1ajd s VAL 266 N -1.26 4.29 0.12 3.83 -7.23 -1.26 -5.00 120.40 113.88 1ajd s VAL 266 Ca 0.52 1.71 -0.30 0.00 -1.81 0.00 0.00 61.98 62.10 1ajd s VAL 266 Cb -0.35 -3.99 -0.09 0.00 0.56 0.00 0.00 36.38 32.51 1ajd s VAL 266 CO 0.45 0.18 1.59 -0.09 -0.31 0.00 0.00 175.10 176.92 1ajd h ARG 267 N 3.29 -0.59 -5.94 4.82 2.43 -1.88 -3.43 114.38 113.07 1ajd h ARG 267 Ca -0.47 0.04 -0.55 0.00 -0.81 0.00 0.00 59.98 58.19 1ajd h ARG 267 Cb 1.19 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 30.80 1ajd h ARG 267 CO 0.65 -0.39 -0.46 -1.58 -1.51 0.00 0.00 179.97 176.68 1ajd s TRP 268 N -5.94 2.57 0.32 2.20 0.51 -1.26 0.18 118.94 117.52 1ajd s TRP 268 Ca -0.16 -0.59 0.05 0.00 -2.12 0.00 0.00 56.10 53.28 1ajd s TRP 268 Cb 0.08 -2.00 -0.06 0.00 -0.81 0.00 0.00 33.47 30.68 1ajd s TRP 268 CO 0.64 0.09 0.02 -0.51 -0.51 0.00 0.00 176.95 176.68 1ajd s LEU 269 N -3.97 2.35 0.00 2.99 1.43 0.17 -4.39 118.68 117.27 1ajd s LEU 269 Ca 0.42 -1.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 1ajd s LEU 269 Cb 0.02 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 45.73 1ajd s LEU 269 CO 0.23 -0.52 0.00 0.61 0.23 0.00 0.00 176.35 176.90 1ajd n GLY 270 N -0.70 1.09 3.78 -3.19 0.00 -1.26 -2.19 105.19 102.72 1ajd n GLY 270 Ca -0.03 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.72 1ajd n GLY 270 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ajd s PRO 271 N -2.00 4.26 0.52 1.61 0.04 -1.26 -4.96 135.00 133.21 1ajd s PRO 271 Ca 0.00 1.59 -0.19 0.00 0.04 0.00 0.00 61.00 62.43 1ajd s PRO 271 Cb 0.00 -2.69 -0.07 0.00 0.04 0.00 0.00 34.50 31.79 1ajd s PRO 271 CO 0.00 -0.07 1.08 0.21 0.04 0.00 0.00 177.00 178.25 1ajd s LYS 272 N -2.26 3.56 0.54 4.56 2.20 -1.26 -4.65 119.74 122.42 1ajd s LYS 272 Ca 0.55 1.45 -0.22 0.00 -0.36 0.00 0.00 55.97 57.39 1ajd s LYS 272 Cb -0.25 -2.05 -0.05 0.00 -1.51 0.00 0.00 37.83 33.97 1ajd s LYS 272 CO 0.31 -0.65 1.31 0.00 -0.36 0.00 0.00 175.35 175.96 1ajd s ALA 273 N -1.94 2.82 0.39 3.13 0.00 -0.46 -5.01 121.76 120.68 1ajd s ALA 273 Ca 0.69 1.23 0.04 0.00 0.00 0.00 0.00 51.96 53.92 1ajd s ALA 273 Cb -0.19 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 1ajd s ALA 273 CO 0.24 -1.22 0.05 0.95 0.00 0.00 0.00 175.76 175.79 1ajd s THR 274 N -1.38 1.24 0.03 0.00 -4.23 -1.22 -4.74 115.64 105.34 1ajd s THR 274 Ca 0.71 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.91 1ajd s THR 274 Cb -0.37 -2.66 -0.06 0.00 1.34 0.00 0.00 72.50 70.75 1ajd s THR 274 CO 0.44 0.00 1.48 -0.47 -0.54 0.00 0.00 174.62 175.53 1ajd s TYR 275 N -3.09 2.74 -1.64 3.99 5.04 -1.26 -1.11 117.35 122.01 1ajd s TYR 275 Ca 0.29 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 1ajd s TYR 275 Cb 0.07 -3.76 0.00 0.00 0.35 0.00 0.00 41.96 38.62 1ajd s TYR 275 CO 0.14 -2.89 0.00 0.72 -1.34 0.00 0.00 175.55 172.18 1ajd n HIS 276 N 5.37 -0.99 0.26 4.97 8.25 -1.26 -4.84 115.22 126.98 1ajd n HIS 276 Ca 0.14 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.78 1ajd n HIS 276 Cb 0.43 -3.61 0.90 0.00 1.12 0.00 0.00 29.99 28.83 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 0.00 0.00 1.23 -1.41 0.00 -1.19 0.28 103.07 101.98 1ajd h GLY 277 Ca -0.44 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.60 1ajd h GLY 277 CO 0.53 0.00 -1.54 3.45 0.00 0.00 0.00 176.54 178.98 1ajd h ASN 278 N 0.00 0.27 0.48 0.19 -1.07 -1.80 -3.12 115.58 110.52 1ajd h ASN 278 Ca 0.05 -0.40 -0.30 0.00 0.07 0.00 0.00 56.30 55.72 1ajd h ASN 278 Cb 0.47 -0.09 -0.01 0.00 -2.07 0.00 0.00 38.32 36.63 1ajd h ASN 278 CO -0.00 1.34 -1.51 0.40 0.07 0.00 0.00 177.43 177.72 1ajd h ILE 279 N 0.05 1.17 0.00 6.14 2.04 -1.29 -3.39 117.51 122.22 1ajd h ILE 279 Ca -0.24 -2.82 -0.18 0.00 1.00 0.00 0.00 64.86 62.63 1ajd h ILE 279 Cb 1.99 2.75 -0.03 0.00 -0.74 0.00 0.00 36.82 40.78 1ajd h ILE 279 CO 0.14 0.81 -1.93 0.47 0.00 0.00 0.00 178.15 177.64 1ajd n ASP 280 N -3.43 0.28 -4.58 1.72 8.00 0.77 -4.96 116.55 114.35 1ajd n ASP 280 Ca -0.16 0.12 -0.28 0.00 0.71 0.00 0.00 54.79 55.19 1ajd n ASP 280 Cb 1.04 1.07 -0.09 0.00 -0.02 0.00 0.00 41.12 43.11 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 -2.99 2.10 0.82 -1.24 1.02 -1.18 -5.06 119.74 113.22 1ajd s LYS 281 Ca -0.07 -1.18 -0.11 0.00 0.02 0.00 0.00 55.97 54.63 1ajd s LYS 281 Cb 0.10 -2.22 0.09 0.00 -0.52 0.00 0.00 37.83 35.27 1ajd s LYS 281 CO 0.85 0.46 1.12 -2.14 -0.92 0.00 0.00 175.35 174.72 1ajd s PRO 282 N -2.65 1.79 1.21 -1.68 0.02 -1.26 -4.63 135.00 127.79 1ajd s PRO 282 Ca 0.24 1.35 -0.16 0.00 0.02 0.00 0.00 61.00 62.44 1ajd s PRO 282 Cb -0.10 -1.83 0.29 0.00 0.02 0.00 0.00 34.50 32.88 1ajd s PRO 282 CO 0.15 -2.02 1.03 0.00 -0.33 0.00 0.00 177.00 175.82 1ajd s ALA 283 N -2.76 -0.17 0.21 -1.55 0.00 -1.26 -4.79 121.76 111.44 1ajd s ALA 283 Ca 0.64 -0.47 0.07 0.00 0.00 0.00 0.00 51.96 52.20 1ajd s ALA 283 Cb -0.20 -3.09 -0.05 0.00 0.00 0.00 0.00 23.12 19.78 1ajd s ALA 283 CO 0.56 -3.83 -0.13 0.08 0.00 0.00 0.00 175.76 172.44 1ajd s VAL 284 N -2.59 1.68 -0.04 0.00 1.01 -0.25 -4.91 120.40 115.30 1ajd s VAL 284 Ca 0.68 -2.19 -0.01 0.00 0.00 0.00 0.00 61.98 60.46 1ajd s VAL 284 Cb -0.19 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.15 1ajd s VAL 284 CO 0.61 -0.58 0.05 -0.89 0.00 0.00 0.00 175.10 174.29 1ajd s THR 285 N -3.01 -0.07 0.29 3.92 2.01 -1.26 -0.09 115.64 117.44 1ajd s THR 285 Ca 0.23 0.36 -0.30 0.00 0.31 0.00 0.00 61.69 62.29 1ajd s THR 285 Cb -0.00 -0.16 -0.11 0.00 0.01 0.00 0.00 72.50 72.25 1ajd s THR 285 CO 0.07 0.16 1.47 0.00 -0.69 0.00 0.00 174.62 175.63 1ajd s THR 287 N -0.33 5.27 0.23 0.00 2.01 -0.93 -4.90 115.64 116.99 1ajd s THR 287 Ca 0.58 0.11 -0.32 0.00 0.31 0.00 0.00 61.69 62.37 1ajd s THR 287 Cb -0.44 -3.63 -0.12 0.00 0.01 0.00 0.00 72.50 68.32 1ajd s THR 287 CO 0.49 0.13 1.60 -2.65 -0.69 0.00 0.00 174.62 173.49 1ajd n PRO 288 N 5.14 2.50 -1.95 4.92 -0.02 -1.26 0.46 135.00 144.78 1ajd n PRO 288 Ca -0.12 0.89 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 1ajd n PRO 288 Cb 0.51 -2.67 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 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 0.73 6.48 0.28 2.55 3.84 0.13 -4.76 114.94 124.18 1ajd s ASN 289 Ca 0.71 2.13 -0.01 0.00 0.21 0.00 0.00 52.86 55.90 1ajd s ASN 289 Cb -0.56 -2.53 0.39 0.00 -0.55 0.00 0.00 41.25 38.00 1ajd s ASN 289 CO 0.42 -1.09 1.80 -0.65 -2.79 0.00 0.00 177.10 174.78 1ajd h PRO 290 N 10.36 0.76 -0.20 0.43 0.11 -1.88 -3.10 132.00 138.48 1ajd h PRO 290 Ca -0.40 -0.18 0.00 0.00 0.11 0.00 0.00 66.00 65.53 1ajd h PRO 290 Cb 1.19 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ajd h PRO 290 CO 0.96 0.75 0.00 1.04 -0.21 0.00 0.00 178.00 180.54 1ajd n GLN 291 N -4.24 1.21 0.11 1.05 6.02 -1.26 -3.94 117.38 116.33 1ajd n GLN 291 Ca 0.03 -0.28 -0.02 0.00 -0.01 0.00 0.00 57.00 56.71 1ajd n GLN 291 Cb 0.27 -1.13 0.19 0.00 1.02 0.00 0.00 30.24 30.59 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 0.45 0.15 -0.30 -1.09 0.11 -1.87 -3.48 114.38 108.35 1ajd h ARG 292 Ca 0.00 -0.09 0.02 0.00 0.10 0.00 0.00 59.98 60.01 1ajd h ARG 292 Cb 0.18 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.26 1ajd h ARG 292 CO 0.01 0.63 -0.10 0.09 0.10 0.00 0.00 179.97 180.70 1ajd n ASN 293 N -3.93 -0.68 -0.12 0.08 3.02 -1.25 -4.32 115.26 108.06 1ajd n ASN 293 Ca -0.02 0.13 0.11 0.00 -0.03 0.00 0.00 54.58 54.78 1ajd n ASN 293 Cb 0.55 -0.12 0.06 0.00 -0.61 0.00 0.00 39.78 39.66 1ajd n ASN 293 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ajd n ASP 294 N -2.00 1.05 0.07 6.41 9.92 -1.26 -3.89 116.55 126.85 1ajd n ASP 294 Ca -0.01 -0.87 0.09 0.00 -0.53 0.00 0.00 54.79 53.47 1ajd n ASP 294 Cb 0.05 0.60 -0.05 0.00 -0.64 0.00 0.00 41.12 41.08 1ajd n ASP 294 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1ajd n SER 295 N -1.13 0.67 -4.58 -2.24 3.41 -1.26 -4.80 113.62 103.69 1ajd n SER 295 Ca 0.06 0.27 -0.40 0.00 -0.26 0.00 0.00 58.87 58.54 1ajd n SER 295 Cb 0.36 0.71 -0.09 0.00 -0.26 0.00 0.00 64.21 64.93 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 -3.30 5.15 0.52 -3.33 1.01 -1.25 0.64 120.40 119.84 1ajd s VAL 296 Ca -0.03 0.36 -0.23 0.00 0.00 0.00 0.00 61.98 62.08 1ajd s VAL 296 Cb 0.10 -3.78 -0.06 0.00 0.00 0.00 0.00 36.38 32.65 1ajd s VAL 296 CO 0.82 0.02 1.37 -2.16 0.00 0.00 0.00 175.10 175.15 1ajd s PRO 297 N 2.10 3.28 0.67 2.72 0.04 -1.26 -4.84 135.00 137.71 1ajd s PRO 297 Ca 0.14 2.28 -0.09 0.00 0.04 0.00 0.00 61.00 63.37 1ajd s PRO 297 Cb -0.16 -2.36 0.02 0.00 0.04 0.00 0.00 34.50 32.05 1ajd s PRO 297 CO 0.11 -1.09 1.02 0.95 0.04 0.00 0.00 177.00 178.02 1ajd s THR 298 N -1.28 3.27 0.26 1.26 -4.23 -1.26 -4.88 115.64 108.78 1ajd s THR 298 Ca 0.69 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 61.30 1ajd s THR 298 Cb -0.41 -3.37 0.26 0.00 1.34 0.00 0.00 72.50 70.33 1ajd s THR 298 CO 0.50 -0.43 1.93 0.25 -0.54 0.00 0.00 174.62 176.33 1ajd h LEU 299 N -0.49 1.11 -0.56 4.79 5.85 -1.95 -1.04 115.31 123.01 1ajd h LEU 299 Ca -0.45 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.16 1ajd h LEU 299 Cb 1.27 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 1ajd h LEU 299 CO 0.62 0.79 0.01 0.00 -0.34 0.00 0.00 178.44 179.53 1ajd h ALA 300 N 1.40 0.76 -0.02 1.25 0.00 -1.91 -1.68 119.26 119.06 1ajd h ALA 300 Ca 0.37 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ajd h ALA 300 Cb -0.12 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1ajd h ALA 300 CO -0.09 0.58 0.00 1.96 0.00 0.00 0.00 179.25 181.70 1ajd h GLN 301 N 0.87 0.03 -0.66 0.00 4.20 -1.83 -0.37 115.11 117.35 1ajd h GLN 301 Ca 0.16 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.95 1ajd h GLN 301 Cb 0.53 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.23 1ajd h GLN 301 CO 0.03 0.27 0.30 0.52 -0.67 0.00 0.00 178.83 179.28 1ajd h MET 302 N -0.22 0.50 -0.65 1.46 2.86 -1.10 0.77 114.93 118.56 1ajd h MET 302 Ca 0.01 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1ajd h MET 302 Cb 0.26 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 1ajd h MET 302 CO 0.00 0.33 0.41 1.15 1.06 0.00 0.00 176.91 179.86 1ajd h THR 303 N 0.52 1.11 -0.58 2.22 2.02 -1.12 0.14 112.91 117.23 1ajd h THR 303 Ca 0.33 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 1ajd h THR 303 Cb 0.36 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1ajd h THR 303 CO -0.28 0.15 0.18 -0.78 0.37 0.00 0.00 175.52 175.16 1ajd h ASP 304 N 0.82 0.86 0.03 4.18 3.58 0.63 -0.80 116.42 125.71 1ajd h ASP 304 Ca 0.25 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 1ajd h ASP 304 Cb -0.02 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 40.80 1ajd h ASP 304 CO -0.09 0.84 -0.01 0.11 -2.88 0.00 0.00 179.24 177.21 1ajd h LYS 305 N 0.83 -0.04 -0.36 0.28 1.79 -0.51 -2.60 116.57 115.95 1ajd h LYS 305 Ca 0.19 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.74 1ajd h LYS 305 Cb 0.29 0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 30.87 1ajd h LYS 305 CO -0.00 0.28 -0.31 0.00 -1.08 0.00 0.00 179.45 178.34 1ajd h ALA 306 N 0.60 -0.17 -0.76 3.86 0.00 -0.55 -1.50 119.26 120.74 1ajd h ALA 306 Ca -0.00 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.04 1ajd h ALA 306 Cb 0.34 0.66 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1ajd h ALA 306 CO 0.01 -0.71 0.48 0.82 0.00 0.00 0.00 179.25 179.85 1ajd h ILE 307 N -0.25 1.11 0.75 0.00 2.04 -1.11 0.21 117.51 120.26 1ajd h ILE 307 Ca 0.17 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1ajd h ILE 307 Cb 0.52 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 1ajd h ILE 307 CO -0.50 0.17 -0.48 -0.08 0.00 0.00 0.00 178.15 177.26 1ajd h GLU 308 N 0.94 -1.12 -0.40 2.37 4.81 -0.92 0.56 114.58 120.82 1ajd h GLU 308 Ca 0.31 0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.62 1ajd h GLU 308 Cb 0.02 0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1ajd h GLU 308 CO -0.11 -0.75 0.25 -0.07 -0.73 0.00 0.00 179.01 177.60 1ajd h LEU 309 N -1.16 0.42 -2.03 1.64 3.38 -1.15 -2.47 115.31 113.94 1ajd h LEU 309 Ca -0.10 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1ajd h LEU 309 Cb 0.94 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 1ajd h LEU 309 CO 0.09 0.30 -0.00 -0.07 0.09 0.00 0.00 178.44 178.85 1ajd h LEU 310 N 0.51 0.00 0.00 1.67 3.38 -0.46 -2.92 115.31 117.49 1ajd h LEU 310 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1ajd h LEU 310 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1ajd h LEU 310 CO -0.05 0.00 -0.31 -1.54 0.09 0.00 0.00 178.44 176.63 1ajd n SER 311 N -3.10 0.35 0.22 -0.43 3.41 0.18 -3.61 113.62 110.64 1ajd n SER 311 Ca -0.01 0.08 0.15 0.00 -0.26 0.00 0.00 58.87 58.84 1ajd n SER 311 Cb 0.22 -0.06 0.65 0.00 -0.26 0.00 0.00 64.21 64.76 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 0.00 -6.31 4.33 1.79 -1.52 -3.42 116.57 111.44 1ajd h LYS 312 Ca 0.00 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.90 1ajd h LYS 312 Cb 0.53 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.13 1ajd h LYS 312 CO 0.00 0.00 0.95 1.21 -1.08 0.00 0.00 179.45 180.53 1ajd s ASN 313 N -4.94 6.74 0.49 0.86 3.84 -1.24 -4.93 114.94 115.77 1ajd s ASN 313 Ca 0.01 1.28 0.18 0.00 0.21 0.00 0.00 52.86 54.54 1ajd s ASN 313 Cb 0.09 -2.54 1.22 0.00 -0.55 0.00 0.00 41.25 39.47 1ajd s ASN 313 CO 0.44 -1.01 2.08 -0.33 -2.79 0.00 0.00 177.10 175.50 1ajd h GLU 314 N 9.00 0.00 0.00 0.43 4.39 -1.92 -2.96 114.58 123.52 1ajd h GLU 314 Ca -0.26 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.37 1ajd h GLU 314 Cb 1.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 1ajd h GLU 314 CO 1.02 0.10 -0.37 -0.22 -1.16 0.00 0.00 179.01 178.38 1ajd h LYS 315 N 0.00 0.00 0.00 2.33 3.11 -1.91 -3.50 116.57 116.60 1ajd h LYS 315 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1ajd h LYS 315 Cb 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.41 1ajd h LYS 315 CO 0.01 0.37 0.00 0.41 -2.81 0.00 0.00 179.45 177.44 1ajd n GLY 316 N 0.10 0.80 3.38 5.01 0.00 -1.12 -4.86 105.19 108.50 1ajd n GLY 316 Ca -0.01 -2.32 -0.10 0.00 0.00 0.00 0.00 46.02 43.59 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 -0.88 -0.18 -0.10 1.61 -0.12 -1.16 -1.28 117.98 115.87 1ajd s PHE 317 Ca 0.00 -0.14 0.01 0.00 -0.05 0.00 0.00 56.93 56.74 1ajd s PHE 317 Cb 0.00 0.30 0.02 0.00 -0.63 0.00 0.00 43.02 42.71 1ajd s PHE 317 CO 0.00 -0.77 -0.09 0.12 -0.05 0.00 0.00 175.22 174.43 1ajd s PHE 318 N -3.83 1.47 0.06 3.49 5.36 -0.06 -0.66 117.98 123.82 1ajd s PHE 318 Ca 0.05 -0.67 0.06 0.00 -0.96 0.00 0.00 56.93 55.42 1ajd s PHE 318 Cb 0.01 -1.17 -0.03 0.00 -0.34 0.00 0.00 43.02 41.49 1ajd s PHE 318 CO -0.09 -0.43 -0.17 -1.17 -1.46 0.00 0.00 175.22 171.90 1ajd s LEU 319 N 1.32 2.23 -0.09 6.12 2.96 0.11 -0.66 118.68 130.67 1ajd s LEU 319 Ca -0.02 -0.56 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 1ajd s LEU 319 Cb -0.14 -0.71 0.02 0.00 0.50 0.00 0.00 46.19 45.86 1ajd s LEU 319 CO -0.04 0.03 -0.09 -1.58 -1.32 0.00 0.00 176.35 173.35 1ajd s GLN 320 N -1.47 1.56 -0.13 1.98 0.74 -0.79 -1.11 119.66 120.44 1ajd s GLN 320 Ca 0.03 -0.31 0.03 0.00 0.05 0.00 0.00 55.36 55.16 1ajd s GLN 320 Cb -0.09 -1.48 0.01 0.00 1.10 0.00 0.00 33.01 32.55 1ajd s GLN 320 CO 0.02 -0.14 -0.22 0.08 -0.55 0.00 0.00 175.29 174.48 1ajd s VAL 321 N 1.27 2.11 -0.07 1.34 1.01 0.76 -0.61 120.40 126.20 1ajd s VAL 321 Ca -0.03 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.01 1ajd s VAL 321 Cb -0.14 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 1ajd s VAL 321 CO -0.03 0.55 -0.21 -0.70 0.00 0.00 0.00 175.10 174.71 1ajd s GLU 322 N 0.62 2.76 -0.82 2.72 2.56 -0.14 -0.49 118.70 125.91 1ajd s GLU 322 Ca -0.12 -0.83 -0.16 0.00 0.00 0.00 0.00 54.97 53.86 1ajd s GLU 322 Cb -0.16 -2.29 0.18 0.00 2.00 0.00 0.00 34.13 33.86 1ajd s GLU 322 CO 0.02 0.36 0.84 0.20 -0.56 0.00 0.00 175.26 176.12 1ajd s GLY 323 N -0.09 2.39 -0.04 -1.50 0.00 0.21 -3.24 107.32 105.05 1ajd s GLY 323 Ca -0.05 -3.06 -0.21 0.00 0.00 0.00 0.00 44.72 41.40 1ajd s GLY 323 CO 0.04 1.46 0.91 0.00 0.00 0.00 0.00 173.10 175.52 1ajd h ALA 324 N 8.21 -0.30 0.00 3.20 0.00 -1.92 0.36 119.26 128.81 1ajd h ALA 324 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ajd h ALA 324 Cb 1.04 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ajd h ALA 324 CO 0.88 -0.38 0.00 0.43 0.00 0.00 0.00 179.25 180.18 1ajd n SER 325 N -4.99 0.00 -0.16 0.00 7.64 -1.26 -3.21 113.62 111.64 1ajd n SER 325 Ca -0.08 -0.93 -0.09 0.00 1.01 0.00 0.00 58.87 58.78 1ajd n SER 325 Cb 0.26 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 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 1.23 -0.44 0.44 2.04 -1.75 0.24 117.51 119.28 1ajd h ILE 326 Ca 0.00 -0.82 -0.14 0.00 1.00 0.00 0.00 64.86 64.91 1ajd h ILE 326 Cb 0.00 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1ajd h ILE 326 CO 0.00 0.29 -0.26 -0.78 0.00 0.00 0.00 178.15 177.40 1ajd h ASP 327 N 0.62 0.98 -0.21 1.72 1.82 -0.97 0.15 116.42 120.52 1ajd h ASP 327 Ca 0.15 -0.39 -0.15 0.00 -0.39 0.00 0.00 57.03 56.25 1ajd h ASP 327 Cb 0.32 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.05 1ajd h ASP 327 CO 0.00 1.17 -0.42 0.11 -1.61 0.00 0.00 179.24 178.50 1ajd h LYS 328 N 0.81 0.76 0.00 0.28 1.57 -1.62 0.16 116.57 118.52 1ajd h LYS 328 Ca 0.10 -0.41 -0.07 0.00 -1.87 0.00 0.00 60.65 58.40 1ajd h LYS 328 Cb 0.83 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 1ajd h LYS 328 CO 0.07 1.03 -0.40 1.96 -0.57 0.00 0.00 179.45 181.54 1ajd h GLN 329 N 0.62 0.00 0.01 3.15 1.08 -0.44 0.12 115.11 119.64 1ajd h GLN 329 Ca 0.05 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.98 1ajd h GLN 329 Cb 0.97 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.42 1ajd h GLN 329 CO 0.09 0.30 -1.04 0.22 -0.95 0.00 0.00 178.83 177.45 1ajd h ASP 330 N 0.00 0.85 -0.45 1.46 1.82 -0.54 -0.58 116.42 118.99 1ajd h ASP 330 Ca -0.01 -0.69 -0.03 0.00 -0.39 0.00 0.00 57.03 55.91 1ajd h ASP 330 Cb 1.25 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.98 1ajd h ASP 330 CO 0.04 1.49 0.17 0.45 -1.61 0.00 0.00 179.24 179.78 1ajd h HIS 331 N 0.36 0.69 0.00 0.28 3.86 -0.57 -2.25 115.15 117.53 1ajd h HIS 331 Ca -0.13 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.03 1ajd h HIS 331 Cb 1.70 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.96 1ajd h HIS 331 CO 0.10 0.60 0.00 0.00 0.86 0.00 0.00 177.93 179.49 1ajd n ALA 332 N -2.32 2.02 -3.67 2.45 0.00 0.02 -1.74 120.51 117.26 1ajd n ALA 332 Ca 0.01 -0.09 -0.28 0.00 0.00 0.00 0.00 53.44 53.08 1ajd n ALA 332 Cb 0.16 -1.25 0.01 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.09 -1.16 -3.86 0.00 0.00 -0.85 -4.75 120.51 108.81 1ajd n ALA 333 Ca 0.10 0.14 -0.33 0.00 0.00 0.00 0.00 53.44 53.35 1ajd n ALA 333 Cb 0.07 -3.66 -0.12 0.00 0.00 0.00 0.00 19.45 15.74 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 -3.02 4.74 0.15 0.00 3.84 -0.28 -1.36 114.94 119.02 1ajd s ASN 334 Ca 0.55 -2.85 -0.32 0.00 0.21 0.00 0.00 52.86 50.45 1ajd s ASN 334 Cb -0.28 -1.73 -0.08 0.00 -0.55 0.00 0.00 41.25 38.61 1ajd s ASN 334 CO 0.67 -0.31 1.54 -0.65 -2.79 0.00 0.00 177.10 175.57 1ajd h PRO 335 N 6.84 -0.12 -0.90 0.43 0.11 -1.83 -2.18 132.00 134.36 1ajd h PRO 335 Ca -0.05 0.01 0.17 0.00 0.11 0.00 0.00 66.00 66.24 1ajd h PRO 335 Cb 0.93 0.03 -0.10 0.00 0.11 0.00 0.00 31.00 31.96 1ajd h PRO 335 CO 0.69 -0.08 0.47 0.00 -0.21 0.00 0.00 178.00 178.87 1ajd h GLY 337 N 0.61 0.78 0.86 0.00 0.00 -1.65 -0.60 103.07 103.07 1ajd h GLY 337 Ca 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1ajd h GLY 337 CO -0.40 0.90 -0.14 -1.61 0.00 0.00 0.00 176.54 175.29 1ajd h GLN 338 N 0.41 -0.31 -0.47 4.80 4.15 -0.75 -2.48 115.11 120.47 1ajd h GLN 338 Ca -0.02 0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.47 1ajd h GLN 338 Cb 1.19 0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.91 1ajd h GLN 338 CO 0.12 -0.21 0.21 0.82 -1.93 0.00 0.00 178.83 177.85 1ajd h ILE 339 N -0.32 0.92 -0.39 2.39 2.04 -0.50 -1.84 117.51 119.81 1ajd h ILE 339 Ca -0.00 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 1ajd h ILE 339 Cb 0.29 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1ajd h ILE 339 CO -0.02 0.08 0.08 1.23 0.00 0.00 0.00 178.15 179.52 1ajd h GLY 340 N 0.42 0.63 2.00 5.37 0.00 -1.06 -1.87 103.07 108.56 1ajd h GLY 340 Ca 0.21 -0.34 -0.12 0.00 0.00 0.00 0.00 47.33 47.09 1ajd h GLY 340 CO -0.18 0.32 -0.56 0.83 0.00 0.00 0.00 176.54 176.95 1ajd h GLU 341 N 0.57 0.00 0.00 4.80 4.39 -0.89 -1.01 114.58 122.44 1ajd h GLU 341 Ca 0.13 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 1ajd h GLU 341 Cb 0.24 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1ajd h GLU 341 CO -0.00 0.56 -0.18 1.15 -1.16 0.00 0.00 179.01 179.38 1ajd h THR 342 N 0.00 0.38 0.16 1.13 2.02 -0.58 -2.63 112.91 113.39 1ajd h THR 342 Ca -0.01 -1.16 -0.26 0.00 0.77 0.00 0.00 66.41 65.76 1ajd h THR 342 Cb 1.03 1.87 0.02 0.00 -1.74 0.00 0.00 68.15 69.33 1ajd h THR 342 CO 0.07 0.18 -1.22 0.58 0.37 0.00 0.00 175.52 175.50 1ajd h VAL 343 N 0.00 1.26 -0.83 3.16 2.07 -0.98 -3.10 116.25 117.83 1ajd h VAL 343 Ca -0.00 -2.52 0.09 0.00 0.82 0.00 0.00 66.70 65.08 1ajd h VAL 343 Cb 0.86 2.98 -0.07 0.00 -1.52 0.00 0.00 31.29 33.54 1ajd h VAL 343 CO 0.02 0.74 0.48 -0.78 0.02 0.00 0.00 177.57 178.06 1ajd h ASP 344 N -0.21 0.71 -0.20 0.57 3.58 -1.11 -1.03 116.42 118.73 1ajd h ASP 344 Ca -0.24 0.04 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 1ajd h ASP 344 Cb 1.82 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 42.77 1ajd h ASP 344 CO 0.15 0.42 0.05 0.25 -2.88 0.00 0.00 179.24 177.22 1ajd h LEU 345 N 0.83 0.31 -0.92 2.28 5.85 -1.59 -2.72 115.31 119.35 1ajd h LEU 345 Ca 0.39 -0.23 0.26 0.00 0.84 0.00 0.00 57.88 59.14 1ajd h LEU 345 Cb 0.32 -0.08 -0.15 0.00 0.37 0.00 0.00 40.66 41.12 1ajd h LEU 345 CO -0.23 0.46 0.30 -0.78 -0.34 0.00 0.00 178.44 177.85 1ajd h ASP 346 N 0.14 0.08 -0.39 1.25 3.58 -1.12 0.40 116.42 120.36 1ajd h ASP 346 Ca 0.06 0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 1ajd h ASP 346 Cb 0.28 0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.56 1ajd h ASP 346 CO 0.00 -0.18 0.23 -0.33 -2.88 0.00 0.00 179.24 176.08 1ajd h GLU 347 N 0.21 0.54 -0.50 0.28 5.08 -1.14 -0.90 114.58 118.15 1ajd h GLU 347 Ca 0.60 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.88 1ajd h GLU 347 Cb 1.27 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1ajd h GLU 347 CO -0.67 0.42 0.21 0.00 -1.00 0.00 0.00 179.01 177.97 1ajd h ALA 348 N 1.09 0.64 -0.41 3.43 0.00 -0.15 -1.02 119.26 122.84 1ajd h ALA 348 Ca 0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ajd h ALA 348 Cb 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ajd h ALA 348 CO -0.02 0.24 0.24 0.28 0.00 0.00 0.00 179.25 179.99 1ajd h VAL 349 N 0.66 1.12 0.33 0.00 2.07 -0.60 -0.17 116.25 119.67 1ajd h VAL 349 Ca 0.17 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1ajd h VAL 349 Cb 0.17 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1ajd h VAL 349 CO -0.02 0.13 -0.16 1.56 0.02 0.00 0.00 177.57 179.10 1ajd h GLN 350 N 0.57 -0.43 -0.95 1.57 4.20 0.05 0.21 115.11 120.33 1ajd h GLN 350 Ca 0.15 0.03 0.12 0.00 0.06 0.00 0.00 58.65 59.01 1ajd h GLN 350 Cb -0.01 0.10 -0.08 0.00 0.30 0.00 0.00 27.48 27.78 1ajd h GLN 350 CO -0.03 -0.22 0.58 0.00 -0.67 0.00 0.00 178.83 178.49 1ajd h ARG 351 N -0.55 0.88 0.10 1.46 -0.00 -0.49 0.15 114.38 115.93 1ajd h ARG 351 Ca -0.05 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.98 59.38 1ajd h ARG 351 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 29.97 30.18 1ajd h ARG 351 CO 0.07 0.58 -0.05 0.00 0.00 0.00 0.00 179.97 180.58 1ajd h ALA 352 N 1.52 -0.14 -0.17 0.04 0.00 -0.73 -1.89 119.26 117.89 1ajd h ALA 352 Ca 0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1ajd h ALA 352 Cb 0.49 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ajd h ALA 352 CO -0.27 -0.47 -0.03 -0.07 0.00 0.00 0.00 179.25 178.41 1ajd h LEU 353 N -0.35 0.23 0.15 0.00 3.38 -0.51 -0.40 115.31 117.81 1ajd h LEU 353 Ca -0.01 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1ajd h LEU 353 Cb 0.29 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1ajd h LEU 353 CO 0.02 0.30 -0.09 -0.08 0.09 0.00 0.00 178.44 178.68 1ajd h GLU 354 N 0.25 -0.22 -0.44 1.13 4.81 -0.36 0.31 114.58 120.05 1ajd h GLU 354 Ca 0.06 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.39 1ajd h GLU 354 Cb 0.22 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.56 1ajd h GLU 354 CO 0.01 -0.15 -0.10 0.35 -0.73 0.00 0.00 179.01 178.39 1ajd h PHE 355 N -0.23 -0.22 0.11 0.92 3.57 -1.27 -2.53 116.94 117.29 1ajd h PHE 355 Ca -0.02 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1ajd h PHE 355 Cb 0.18 0.16 -0.04 0.00 2.79 0.00 0.00 35.95 39.05 1ajd h PHE 355 CO 0.08 -0.18 -0.43 0.00 -2.23 0.00 0.00 178.31 175.55 1ajd h ALA 356 N 1.44 -0.92 -0.99 2.41 0.00 -0.99 0.53 119.26 120.74 1ajd h ALA 356 Ca 0.21 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.24 1ajd h ALA 356 Cb 0.32 0.81 -0.11 0.00 0.00 0.00 0.00 17.79 18.81 1ajd h ALA 356 CO -0.45 -1.03 0.58 -0.22 0.00 0.00 0.00 179.25 178.13 1ajd h LYS 357 N -0.62 0.64 -0.01 0.00 1.63 -0.21 0.53 116.57 118.52 1ajd h LYS 357 Ca -0.01 -0.04 -0.12 0.00 -0.85 0.00 0.00 60.65 59.63 1ajd h LYS 357 Cb 0.62 -0.14 0.01 0.00 -0.60 0.00 0.00 32.23 32.12 1ajd h LYS 357 CO -0.23 0.42 -0.46 0.87 -3.45 0.00 0.00 179.45 176.60 1ajd h LYS 358 N 0.66 0.33 -0.57 1.90 1.57 -1.01 -3.34 116.57 116.09 1ajd h LYS 358 Ca 0.60 -0.34 0.05 0.00 -1.87 0.00 0.00 60.65 59.08 1ajd h LYS 358 Cb 1.02 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.38 1ajd h LYS 358 CO -0.43 1.03 0.31 1.49 -0.57 0.00 0.00 179.45 181.28 1ajd h GLU 359 N -0.24 0.58 0.00 3.15 4.22 0.12 -3.47 114.58 118.94 1ajd h GLU 359 Ca -0.06 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.35 1ajd h GLU 359 Cb 1.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1ajd h GLU 359 CO 0.09 0.38 0.00 0.41 -2.18 0.00 0.00 179.01 177.71 1ajd n GLY 360 N -1.26 0.78 0.83 1.92 0.00 0.06 -4.85 105.19 102.67 1ajd n GLY 360 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 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 0.01 -4.45 1.61 3.02 -1.26 -4.90 115.26 109.29 1ajd n ASN 361 Ca 0.00 -1.72 -0.36 0.00 -0.03 0.00 0.00 54.58 52.47 1ajd n ASN 361 Cb 0.00 -0.06 -0.12 0.00 -0.61 0.00 0.00 39.78 38.99 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 0.00 4.29 -0.30 3.41 2.01 -1.26 -0.14 115.64 123.65 1ajd s THR 362 Ca 0.07 -0.18 -0.24 0.00 0.31 0.00 0.00 61.69 61.66 1ajd s THR 362 Cb 0.09 -3.00 -0.00 0.00 0.01 0.00 0.00 72.50 69.60 1ajd s THR 362 CO -0.04 0.35 0.80 -0.22 -0.69 0.00 0.00 174.62 174.83 1ajd s LEU 363 N 1.54 4.08 -0.20 4.42 2.96 -0.85 -4.38 118.68 126.24 1ajd s LEU 363 Ca 0.06 0.74 -0.07 0.00 -0.22 0.00 0.00 54.13 54.64 1ajd s LEU 363 Cb -0.15 -3.11 -0.04 0.00 0.50 0.00 0.00 46.19 43.40 1ajd s LEU 363 CO 0.03 -0.60 0.06 -0.69 -1.32 0.00 0.00 176.35 173.83 1ajd s VAL 364 N 2.96 4.60 -0.07 1.68 1.01 0.01 -1.64 120.40 128.95 1ajd s VAL 364 Ca 0.33 -0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.25 1ajd s VAL 364 Cb -0.14 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1ajd s VAL 364 CO 0.12 0.42 -0.18 -0.63 0.00 0.00 0.00 175.10 174.83 1ajd s ILE 365 N 0.74 1.57 -0.21 2.22 1.01 -0.28 -1.24 121.20 125.01 1ajd s ILE 365 Ca 0.03 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.94 1ajd s ILE 365 Cb -0.13 -1.38 0.05 0.00 0.01 0.00 0.00 42.46 41.01 1ajd s ILE 365 CO 0.02 0.45 -0.07 -0.69 0.00 0.00 0.00 174.94 174.65 1ajd s VAL 366 N 0.41 1.51 0.02 2.92 1.01 -0.65 0.26 120.40 125.89 1ajd s VAL 366 Ca -0.14 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 1ajd s VAL 366 Cb -0.16 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1ajd s VAL 366 CO 0.05 0.06 0.04 1.07 0.00 0.00 0.00 175.10 176.32 1ajd n THR 367 N 4.71 0.00 -4.34 3.92 5.66 -0.32 -2.77 114.28 121.15 1ajd n THR 367 Ca -0.13 -0.10 -0.18 0.00 -3.05 0.00 0.00 64.05 60.59 1ajd n THR 367 Cb 0.46 0.07 -0.10 0.00 -1.55 0.00 0.00 70.33 69.21 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 -1.47 1.92 0.12 1.79 0.00 -1.26 -0.27 121.76 122.59 1ajd s ALA 368 Ca 0.02 -1.69 0.08 0.00 0.00 0.00 0.00 51.96 50.37 1ajd s ALA 368 Cb -0.00 0.09 -0.12 0.00 0.00 0.00 0.00 23.12 23.09 1ajd s ALA 368 CO 0.01 -0.05 1.33 0.38 0.00 0.00 0.00 175.76 177.44 1ajd h ASP 369 N 2.54 0.00 -5.09 0.00 2.03 -1.94 -3.48 116.42 110.48 1ajd h ASP 369 Ca -0.38 0.00 0.22 0.00 -0.73 0.00 0.00 57.03 56.14 1ajd h ASP 369 Cb 1.22 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.59 1ajd h ASP 369 CO 0.64 0.92 0.64 -1.38 -1.03 0.00 0.00 179.24 179.03 1ajd s HIS 370 N -2.84 -0.15 0.76 4.15 -3.43 -1.26 -4.87 115.29 107.65 1ajd s HIS 370 Ca 0.01 -0.01 -0.12 0.00 -0.80 0.00 0.00 55.06 54.14 1ajd s HIS 370 Cb 0.10 0.57 0.05 0.00 -1.43 0.00 0.00 32.58 31.87 1ajd s HIS 370 CO 0.81 -0.50 1.13 0.00 -2.00 0.00 0.00 174.74 174.18 1ajd s ALA 371 N -2.85 2.72 0.00 -1.38 0.00 -1.15 -3.57 121.76 115.53 1ajd s ALA 371 Ca 0.11 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1ajd s ALA 371 Cb 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 20.12 1ajd s ALA 371 CO -0.03 -1.43 0.00 1.58 0.00 0.00 0.00 175.76 175.88 1ajd n HIS 372 N -3.18 0.00 -0.03 0.00 -0.00 -1.26 -0.63 115.22 110.12 1ajd n HIS 372 Ca 0.07 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.12 1ajd n HIS 372 Cb 0.59 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.35 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 1.00 -0.03 -1.20 1.57 0.00 -1.80 -3.38 119.26 115.43 1ajd h ALA 373 Ca 0.00 -0.35 -0.64 0.00 0.00 0.00 0.00 54.91 53.92 1ajd h ALA 373 Cb 0.00 0.01 0.12 0.00 0.00 0.00 0.00 17.79 17.92 1ajd h ALA 373 CO 0.00 -0.14 -0.65 -1.13 0.00 0.00 0.00 179.25 177.32 1ajd n SER 374 N -4.75 -1.75 -3.74 0.00 3.41 -1.26 -4.76 113.62 100.77 1ajd n SER 374 Ca -0.09 1.00 -0.13 0.00 -0.26 0.00 0.00 58.87 59.39 1ajd n SER 374 Cb 0.35 -0.91 -0.10 0.00 -0.26 0.00 0.00 64.21 63.29 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 -0.98 0.48 -0.37 4.33 -0.21 -0.88 -4.78 119.66 117.26 1ajd s GLN 375 Ca 0.61 0.49 -0.20 0.00 0.02 0.00 0.00 55.36 56.28 1ajd s GLN 375 Cb -0.82 0.23 0.00 0.00 1.00 0.00 0.00 33.01 33.43 1ajd s GLN 375 CO 0.57 -0.07 0.61 0.42 -2.12 0.00 0.00 175.29 174.70 1ajd s ILE 376 N 0.08 4.91 0.32 1.08 1.01 -1.26 -0.23 121.20 127.11 1ajd s ILE 376 Ca -0.01 0.46 0.09 0.00 0.00 0.00 0.00 60.65 61.18 1ajd s ILE 376 Cb -0.03 -4.07 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1ajd s ILE 376 CO 0.01 -0.33 0.11 0.68 0.00 0.00 0.00 174.94 175.40 1ajd s VAL 377 N 2.65 3.16 0.45 2.92 -7.23 0.40 -4.99 120.40 117.75 1ajd s VAL 377 Ca 0.23 -1.75 -0.25 0.00 -1.81 0.00 0.00 61.98 58.40 1ajd s VAL 377 Cb -0.15 -2.96 -0.08 0.00 0.56 0.00 0.00 36.38 33.75 1ajd s VAL 377 CO 0.15 -0.23 1.43 0.00 -0.31 0.00 0.00 175.10 176.13 1ajd s ALA 378 N -2.40 3.25 0.46 1.32 0.00 -1.26 -3.93 121.76 119.21 1ajd s ALA 378 Ca 0.36 1.47 0.31 0.00 0.00 0.00 0.00 51.96 54.09 1ajd s ALA 378 Cb -0.03 -3.59 1.67 0.00 0.00 0.00 0.00 23.12 21.16 1ajd s ALA 378 CO 0.22 -1.18 1.92 -1.00 0.00 0.00 0.00 175.76 175.72 1ajd h PRO 379 N 2.36 0.00 -0.60 0.00 0.13 -1.89 -1.26 132.00 130.74 1ajd h PRO 379 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1ajd h PRO 379 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1ajd h PRO 379 CO 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 1ajd n ASP 380 N -2.74 3.66 -4.72 1.44 5.75 -1.26 -4.79 116.55 113.90 1ajd n ASP 380 Ca -0.02 -1.99 -0.42 0.00 -0.01 0.00 0.00 54.79 52.35 1ajd n ASP 380 Cb 0.24 -0.40 -0.03 0.00 -1.03 0.00 0.00 41.12 39.90 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 -1.08 3.13 -0.51 2.12 2.01 -0.48 -5.00 115.64 115.83 1ajd s THR 381 Ca 0.42 0.83 -0.14 0.00 0.31 0.00 0.00 61.69 63.11 1ajd s THR 381 Cb 0.22 -3.53 0.12 0.00 0.01 0.00 0.00 72.50 69.32 1ajd s THR 381 CO 0.30 0.08 0.44 -0.75 -0.69 0.00 0.00 174.62 173.99 1ajd s LYS 382 N 0.87 2.83 0.25 4.92 2.47 -1.26 -4.86 119.74 124.95 1ajd s LYS 382 Ca 0.64 -1.69 0.09 0.00 -1.56 0.00 0.00 55.97 53.45 1ajd s LYS 382 Cb -0.38 -4.16 -0.04 0.00 -1.46 0.00 0.00 37.83 31.78 1ajd s LYS 382 CO 0.32 -1.26 0.06 0.00 0.16 0.00 0.00 175.35 174.63 1ajd s ALA 383 N 1.53 3.29 0.37 3.13 0.00 -1.26 -5.03 121.76 123.78 1ajd s ALA 383 Ca 0.04 -1.56 0.20 0.00 0.00 0.00 0.00 51.96 50.64 1ajd s ALA 383 Cb -0.28 -0.95 1.08 0.00 0.00 0.00 0.00 23.12 22.97 1ajd s ALA 383 CO 0.02 0.28 1.95 -1.35 0.00 0.00 0.00 175.76 176.66 1ajd h PRO 384 N 1.84 0.00 0.00 0.00 0.11 -1.96 -3.43 132.00 128.56 1ajd h PRO 384 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ajd h PRO 384 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ajd h PRO 384 CO 0.60 0.23 0.00 0.41 -0.21 0.00 0.00 178.00 179.03 1ajd n GLY 385 N -0.54 2.91 3.69 -0.55 0.00 -1.26 -5.02 105.19 104.43 1ajd n GLY 385 Ca -0.02 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 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 4.22 -0.01 0.99 1.43 0.01 -4.19 118.68 121.13 1ajd s LEU 386 Ca 0.00 0.76 0.04 0.00 -1.03 0.00 0.00 54.13 53.89 1ajd s LEU 386 Cb 0.00 -2.71 -0.01 0.00 0.03 0.00 0.00 46.19 43.50 1ajd s LEU 386 CO 0.00 -0.09 -0.12 0.42 0.23 0.00 0.00 176.35 176.79 1ajd s THR 387 N 1.10 0.99 -0.01 5.49 -4.23 -0.27 -0.34 115.64 118.36 1ajd s THR 387 Ca 0.25 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 60.21 1ajd s THR 387 Cb -0.15 -0.83 0.01 0.00 1.34 0.00 0.00 72.50 72.88 1ajd s THR 387 CO 0.10 0.27 0.00 -1.58 -0.54 0.00 0.00 174.62 172.87 1ajd s GLN 388 N -0.33 0.09 -0.12 3.99 0.74 -0.50 -2.96 119.66 120.57 1ajd s GLN 388 Ca 0.05 0.05 -0.10 0.00 0.05 0.00 0.00 55.36 55.41 1ajd s GLN 388 Cb -0.05 -0.22 -0.05 0.00 1.10 0.00 0.00 33.01 33.80 1ajd s GLN 388 CO -0.00 -0.07 0.22 0.00 -0.55 0.00 0.00 175.29 174.89 1ajd s ALA 389 N 0.53 3.75 0.14 1.58 0.00 -1.26 -0.82 121.76 125.69 1ajd s ALA 389 Ca -0.05 -0.53 0.10 0.00 0.00 0.00 0.00 51.96 51.48 1ajd s ALA 389 Cb -0.07 -2.17 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1ajd s ALA 389 CO -0.01 0.40 -0.23 -0.51 0.00 0.00 0.00 175.76 175.41 1ajd s LEU 390 N -0.47 2.36 -0.51 0.00 1.02 0.28 -1.09 118.68 120.27 1ajd s LEU 390 Ca 0.16 -0.78 -0.15 0.00 0.02 0.00 0.00 54.13 53.38 1ajd s LEU 390 Cb -0.13 -1.04 0.11 0.00 0.02 0.00 0.00 46.19 45.15 1ajd s LEU 390 CO 0.05 0.09 0.45 0.20 0.02 0.00 0.00 176.35 177.16 1ajd s ASN 391 N -2.28 6.11 0.81 2.29 0.02 0.87 -0.66 114.94 122.10 1ajd s ASN 391 Ca 0.14 -1.67 -0.11 0.00 -1.02 0.00 0.00 52.86 50.20 1ajd s ASN 391 Cb -0.09 -2.18 0.10 0.00 0.02 0.00 0.00 41.25 39.11 1ajd s ASN 391 CO 0.07 -0.78 1.16 0.42 0.02 0.00 0.00 177.10 177.99 1ajd s THR 392 N 1.58 2.08 0.56 1.60 -4.23 -0.09 -4.80 115.64 112.34 1ajd s THR 392 Ca 0.04 -0.10 0.25 0.00 -1.18 0.00 0.00 61.69 60.69 1ajd s THR 392 Cb -0.28 -2.98 0.33 0.00 1.34 0.00 0.00 72.50 70.91 1ajd s THR 392 CO 0.04 0.00 2.16 0.50 -0.54 0.00 0.00 174.62 176.77 1ajd h LYS 393 N -1.04 0.00 0.00 3.99 1.63 -1.48 0.21 116.57 119.88 1ajd h LYS 393 Ca -0.45 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 1ajd h LYS 393 Cb 1.30 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.93 1ajd h LYS 393 CO 0.57 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 176.32 1ajd n ASP 394 N -4.12 0.03 -1.18 4.20 8.00 -1.26 -4.85 116.55 117.37 1ajd n ASP 394 Ca -0.01 0.51 -0.09 0.00 0.71 0.00 0.00 54.79 55.91 1ajd n ASP 394 Cb 0.20 -0.51 0.01 0.00 -0.02 0.00 0.00 41.12 40.79 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 0.28 0.10 3.43 0.44 0.00 0.73 -5.03 105.19 105.14 1ajd n GLY 395 Ca 0.04 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.60 2.27 -0.18 4.61 0.00 -1.25 -4.94 121.76 119.66 1ajd s ALA 396 Ca 0.06 -1.93 -0.06 0.00 0.00 0.00 0.00 51.96 50.04 1ajd s ALA 396 Cb -0.03 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 1ajd s ALA 396 CO 0.07 -0.35 0.02 0.14 0.00 0.00 0.00 175.76 175.64 1ajd s VAL 397 N -3.40 4.30 -0.10 0.00 -7.23 -1.25 -0.91 120.40 111.81 1ajd s VAL 397 Ca 0.35 -0.20 -0.02 0.00 -1.81 0.00 0.00 61.98 60.30 1ajd s VAL 397 Cb 0.08 -2.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.06 1ajd s VAL 397 CO 0.15 0.45 -0.02 -0.32 -0.31 0.00 0.00 175.10 175.06 1ajd s MET 398 N 0.59 3.16 -0.25 4.82 0.00 0.16 -4.84 119.30 122.94 1ajd s MET 398 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 55.69 55.22 1ajd s MET 398 Cb -0.14 -2.81 0.02 0.00 0.00 0.00 0.00 34.83 31.91 1ajd s MET 398 CO 0.02 0.56 -0.06 0.08 0.00 0.00 0.00 175.02 175.62 1ajd s VAL 399 N -0.51 2.90 -0.07 10.11 1.01 -1.25 0.98 120.40 133.58 1ajd s VAL 399 Ca 0.08 -0.99 -0.09 0.00 0.00 0.00 0.00 61.98 60.98 1ajd s VAL 399 Cb -0.12 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 1ajd s VAL 399 CO 0.02 0.22 0.24 -0.04 0.00 0.00 0.00 175.10 175.54 1ajd s MET 400 N 1.33 3.61 0.13 2.72 -1.94 0.00 -0.45 119.30 124.71 1ajd s MET 400 Ca 0.01 0.05 0.10 0.00 -1.71 0.00 0.00 55.69 54.13 1ajd s MET 400 Cb -0.16 -3.19 -0.04 0.00 2.01 0.00 0.00 34.83 33.45 1ajd s MET 400 CO -0.04 0.74 -0.21 0.45 -0.01 0.00 0.00 175.02 175.94 1ajd s SER 401 N -1.13 3.70 -0.32 3.03 0.15 0.68 -1.41 113.70 118.40 1ajd s SER 401 Ca 0.19 -0.64 -0.02 0.00 0.70 0.00 0.00 55.95 56.18 1ajd s SER 401 Cb -0.14 -0.43 0.12 0.00 -1.71 0.00 0.00 66.02 63.87 1ajd s SER 401 CO 0.08 0.17 0.20 -0.31 1.20 0.00 0.00 173.24 174.58 1ajd s TYR 402 N -1.19 0.36 -0.23 3.44 2.02 0.54 -2.07 117.35 120.22 1ajd s TYR 402 Ca 0.17 -1.12 0.21 0.00 -0.37 0.00 0.00 57.07 55.96 1ajd s TYR 402 Cb -0.10 -0.83 0.49 0.00 -0.40 0.00 0.00 41.96 41.12 1ajd s TYR 402 CO 0.09 -0.85 1.13 0.41 -1.57 0.00 0.00 175.55 174.77 1ajd n GLY 403 N 4.69 2.51 0.97 0.71 0.00 -1.26 -0.81 105.19 112.00 1ajd n GLY 403 Ca 0.03 -1.29 0.08 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.48 3.86 -3.56 1.61 6.94 -1.26 -4.83 115.26 117.53 1ajd n ASN 404 Ca 0.13 -2.68 -0.16 0.00 -0.02 0.00 0.00 54.58 51.85 1ajd n ASN 404 Cb 0.87 -0.47 -0.06 0.00 -2.36 0.00 0.00 39.78 37.75 1ajd n ASN 404 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1ajd s SER 405 N -1.49 -0.64 0.00 0.53 0.15 -1.26 -4.50 113.70 106.48 1ajd s SER 405 Ca 0.39 0.89 0.10 0.00 0.70 0.00 0.00 55.95 58.03 1ajd s SER 405 Cb 0.29 0.78 -0.03 0.00 -1.71 0.00 0.00 66.02 65.35 1ajd s SER 405 CO 0.13 -0.46 0.57 -0.62 1.20 0.00 0.00 173.24 174.06 1ajd n GLU 406 N 1.44 2.61 -1.22 5.44 1.02 -1.26 -4.98 120.64 123.68 1ajd n GLU 406 Ca -0.16 -0.42 -0.04 0.00 -0.02 0.00 0.00 57.16 56.51 1ajd n GLU 406 Cb 0.56 -1.04 0.02 0.00 -0.02 0.00 0.00 31.44 30.96 1ajd n GLU 406 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ajd n GLU 407 N -0.55 0.74 -0.27 3.49 1.02 -1.26 -5.02 120.64 118.79 1ajd n GLU 407 Ca 0.03 -0.58 -0.07 0.00 -0.02 0.00 0.00 57.16 56.53 1ajd n GLU 407 Cb 0.19 -0.08 -0.06 0.00 -0.02 0.00 0.00 31.44 31.48 1ajd n GLU 407 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ajd n ASP 408 N -2.92 -0.66 -4.51 1.62 5.75 -1.26 -4.74 116.55 109.83 1ajd n ASP 408 Ca 0.03 1.16 -0.25 0.00 -0.01 0.00 0.00 54.79 55.72 1ajd n ASP 408 Cb 0.12 -0.16 -0.10 0.00 -1.03 0.00 0.00 41.12 39.94 1ajd n ASP 408 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1ajd s SER 409 N -5.32 3.08 -0.11 -1.12 0.01 -1.26 -4.96 113.70 104.01 1ajd s SER 409 Ca -0.08 -1.42 -0.22 0.00 1.31 0.00 0.00 55.95 55.54 1ajd s SER 409 Cb 0.08 -0.09 -0.03 0.00 0.21 0.00 0.00 66.02 66.19 1ajd s SER 409 CO 0.41 -0.60 0.65 -1.10 0.41 0.00 0.00 173.24 173.01 1ajd s GLN 410 N -3.81 4.36 0.97 12.44 -1.52 -0.71 -4.69 119.66 126.69 1ajd s GLN 410 Ca 0.32 0.75 -0.12 0.00 -1.95 0.00 0.00 55.36 54.36 1ajd s GLN 410 Cb 0.08 -3.49 0.17 0.00 -0.22 0.00 0.00 33.01 29.56 1ajd s GLN 410 CO 0.15 -0.02 1.09 -1.21 -0.25 0.00 0.00 175.29 175.05 1ajd s GLU 411 N 1.13 0.67 0.83 2.91 2.02 -1.26 -4.40 118.70 120.60 1ajd s GLU 411 Ca 0.33 0.75 -0.12 0.00 0.02 0.00 0.00 54.97 55.96 1ajd s GLU 411 Cb -0.17 -1.75 0.09 0.00 0.10 0.00 0.00 34.13 32.41 1ajd s GLU 411 CO 0.14 -2.62 1.18 -1.01 0.02 0.00 0.00 175.26 172.97 1ajd s HIS 412 N -2.87 2.86 0.15 1.61 3.76 -1.26 -2.62 115.29 116.92 1ajd s HIS 412 Ca 0.65 0.76 0.05 0.00 -0.15 0.00 0.00 55.06 56.36 1ajd s HIS 412 Cb -0.19 -3.50 -0.04 0.00 1.11 0.00 0.00 32.58 29.96 1ajd s HIS 412 CO 0.58 -1.88 -0.10 0.95 -0.85 0.00 0.00 174.74 173.43 1ajd s THR 413 N -3.54 1.21 -0.32 1.30 -4.23 0.20 -4.79 115.64 105.47 1ajd s THR 413 Ca 0.62 -2.07 0.10 0.00 -1.18 0.00 0.00 61.69 59.16 1ajd s THR 413 Cb -0.11 -1.86 0.75 0.00 1.34 0.00 0.00 72.50 72.62 1ajd s THR 413 CO 0.50 -0.73 1.81 0.61 -0.54 0.00 0.00 174.62 176.27 1ajd n GLY 414 N -0.21 3.66 3.81 3.99 0.00 -1.26 -2.92 105.19 112.26 1ajd n GLY 414 Ca -0.10 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 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 -1.04 5.36 0.35 1.61 0.15 -1.26 -4.88 113.70 113.99 1ajd s SER 415 Ca 0.55 1.72 -0.22 0.00 0.70 0.00 0.00 55.95 58.70 1ajd s SER 415 Cb 0.44 -2.51 -0.10 0.00 -1.71 0.00 0.00 66.02 62.14 1ajd s SER 415 CO 0.14 -1.45 0.90 0.00 1.20 0.00 0.00 173.24 174.02 1ajd s GLN 416 N -4.71 4.35 0.38 5.44 -2.07 -1.26 -4.40 119.66 117.39 1ajd s GLN 416 Ca 0.60 1.13 0.05 0.00 -1.82 0.00 0.00 55.36 55.33 1ajd s GLN 416 Cb -0.15 -2.53 -0.02 0.00 -1.09 0.00 0.00 33.01 29.21 1ajd s GLN 416 CO 0.49 0.16 0.20 -0.48 -1.32 0.00 0.00 175.29 174.34 1ajd s LEU 417 N -2.58 1.88 0.63 2.60 0.05 -1.18 -4.88 118.68 115.20 1ajd s LEU 417 Ca 0.54 -1.73 -0.17 0.00 0.05 0.00 0.00 54.13 52.82 1ajd s LEU 417 Cb -0.14 0.21 -0.01 0.00 -2.05 0.00 0.00 46.19 44.20 1ajd s LEU 417 CO 0.19 -1.01 1.17 -0.60 -0.55 0.00 0.00 176.35 175.55 1ajd s ARG 418 N -3.58 2.80 -0.14 1.48 3.52 -1.26 -0.95 118.95 120.83 1ajd s ARG 418 Ca 0.31 1.68 -0.06 0.00 -0.13 0.00 0.00 55.73 57.53 1ajd s ARG 418 Cb 0.02 -1.92 0.07 0.00 -1.56 0.00 0.00 34.95 31.55 1ajd s ARG 418 CO 0.20 -1.30 0.30 -1.50 -0.81 0.00 0.00 175.30 172.19 1ajd s ILE 419 N -1.88 -0.37 0.02 4.11 2.07 -0.78 -4.44 121.20 119.93 1ajd s ILE 419 Ca 0.74 0.22 0.07 0.00 -1.41 0.00 0.00 60.65 60.27 1ajd s ILE 419 Cb -0.27 -0.49 -0.02 0.00 0.13 0.00 0.00 42.46 41.81 1ajd s ILE 419 CO 0.37 0.09 -0.22 0.00 -1.91 0.00 0.00 174.94 173.27 1ajd s ALA 420 N 2.18 1.83 0.21 1.50 0.00 -1.11 0.71 121.76 127.07 1ajd s ALA 420 Ca -0.02 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 50.90 1ajd s ALA 420 Cb -0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 1ajd s ALA 420 CO -0.10 0.43 0.12 0.00 0.00 0.00 0.00 175.76 176.21 1ajd s ALA 421 N -0.69 1.31 -0.23 0.00 0.00 0.13 -1.63 121.76 120.66 1ajd s ALA 421 Ca 0.08 -1.74 -0.15 0.00 0.00 0.00 0.00 51.96 50.16 1ajd s ALA 421 Cb -0.09 1.29 0.07 0.00 0.00 0.00 0.00 23.12 24.38 1ajd s ALA 421 CO 0.01 -0.55 0.57 -0.47 0.00 0.00 0.00 175.76 175.31 1ajd s TYR 422 N -4.05 -0.81 0.00 0.00 5.04 -0.37 -2.55 117.35 114.61 1ajd s TYR 422 Ca 0.38 1.71 0.00 0.00 -2.44 0.00 0.00 57.07 56.72 1ajd s TYR 422 Cb 0.07 0.41 0.00 0.00 0.35 0.00 0.00 41.96 42.79 1ajd s TYR 422 CO 0.12 -0.41 0.00 0.41 -1.34 0.00 0.00 175.55 174.33 1ajd n GLY 423 N 3.93 -0.66 3.73 8.97 0.00 -1.26 -0.81 105.19 119.10 1ajd n GLY 423 Ca -0.20 -2.19 -0.42 0.00 0.00 0.00 0.00 46.02 43.22 1ajd n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ajd s PRO 424 N 0.00 4.18 0.00 1.61 0.04 -1.26 -2.62 135.00 136.95 1ajd s PRO 424 Ca 0.00 2.46 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1ajd s PRO 424 Cb 0.00 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.45 1ajd s PRO 424 CO 0.00 -0.60 0.00 0.72 0.04 0.00 0.00 177.00 177.16 1ajd n HIS 425 N 3.16 0.00 0.27 0.56 8.25 0.16 -4.69 115.22 122.94 1ajd n HIS 425 Ca 0.11 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.70 1ajd n HIS 425 Cb 0.38 -0.10 0.78 0.00 1.12 0.00 0.00 29.99 32.17 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 1.45 -0.75 -1.41 0.00 -1.75 -2.56 119.26 114.24 1ajd h ALA 426 Ca 0.00 -0.06 0.22 0.00 0.00 0.00 0.00 54.91 55.06 1ajd h ALA 426 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1ajd h ALA 426 CO 0.00 0.09 0.56 0.00 0.00 0.00 0.00 179.25 179.89 1ajd h ALA 427 N 1.93 2.69 0.00 0.00 0.00 -1.89 -2.26 119.26 119.73 1ajd h ALA 427 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ajd h ALA 427 Cb 0.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ajd h ALA 427 CO 0.01 -0.94 0.00 0.09 0.00 0.00 0.00 179.25 178.41 1ajd n ASN 428 N -4.24 0.00 -0.19 0.00 3.02 -0.97 -2.59 115.26 110.29 1ajd n ASN 428 Ca 0.15 -0.94 0.04 0.00 -0.03 0.00 0.00 54.58 53.80 1ajd n ASN 428 Cb 0.83 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.01 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 -0.67 0.00 -2.86 2.41 0.24 -0.85 -4.98 118.33 111.61 1ajd n VAL 429 Ca 0.05 -0.43 -0.35 0.00 -2.04 0.00 0.00 64.34 61.57 1ajd n VAL 429 Cb 0.02 1.10 -0.07 0.00 -1.47 0.00 0.00 33.84 33.43 1ajd n VAL 429 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1ajd s VAL 430 N -1.10 4.36 0.00 3.34 1.01 -1.07 -3.03 120.40 123.92 1ajd s VAL 430 Ca 0.07 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.61 1ajd s VAL 430 Cb 0.06 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.64 1ajd s VAL 430 CO 0.18 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.84 1ajd n GLY 431 N 0.04 -2.16 3.73 4.51 0.00 -1.26 -4.81 105.19 105.26 1ajd n GLY 431 Ca 0.04 -1.47 -0.40 0.00 0.00 0.00 0.00 46.02 44.19 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 4.38 0.22 0.99 2.96 -1.26 -2.45 118.68 123.53 1ajd s LEU 432 Ca 0.00 1.29 -0.00 0.00 -0.22 0.00 0.00 54.13 55.20 1ajd s LEU 432 Cb 0.00 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.54 1ajd s LEU 432 CO 0.00 -0.03 0.17 0.42 -1.32 0.00 0.00 176.35 175.58 1ajd s THR 433 N 0.32 0.00 0.08 3.68 -4.23 -0.91 -5.01 115.64 109.56 1ajd s THR 433 Ca 0.37 -1.98 0.05 0.00 -1.18 0.00 0.00 61.69 58.95 1ajd s THR 433 Cb -0.19 -2.49 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 1ajd s THR 433 CO 0.20 0.00 -0.02 -0.62 -0.54 0.00 0.00 174.62 173.64 1ajd s ASP 434 N -3.19 4.93 0.57 3.99 2.15 -1.26 -0.75 116.67 123.11 1ajd s ASP 434 Ca 0.39 -0.19 0.29 0.00 0.43 0.00 0.00 52.55 53.46 1ajd s ASP 434 Cb 0.06 -1.15 1.47 0.00 -0.30 0.00 0.00 42.92 42.99 1ajd s ASP 434 CO 0.14 0.19 1.90 -0.61 -0.17 0.00 0.00 175.17 176.62 1ajd h GLN 435 N 3.56 0.00 0.00 4.34 4.15 -1.49 -0.76 115.11 124.90 1ajd h GLN 435 Ca -0.48 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 58.84 1ajd h GLN 435 Cb 1.17 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.84 1ajd h GLN 435 CO 0.58 0.00 -0.48 1.79 -1.93 0.00 0.00 178.83 178.79 1ajd h THR 436 N 0.00 1.02 -0.88 2.39 1.35 -1.86 -2.82 112.91 112.11 1ajd h THR 436 Ca 0.28 -1.88 0.04 0.00 -0.55 0.00 0.00 66.41 64.30 1ajd h THR 436 Cb 1.32 2.12 -0.05 0.00 -1.73 0.00 0.00 68.15 69.80 1ajd h THR 436 CO -0.00 0.47 0.58 0.44 -0.25 0.00 0.00 175.52 176.76 1ajd h ASP 437 N 0.00 0.93 -0.99 5.36 3.32 -1.42 -1.16 116.42 122.45 1ajd h ASP 437 Ca -0.00 -0.01 0.20 0.00 0.02 0.00 0.00 57.03 57.24 1ajd h ASP 437 Cb 1.08 -0.21 -0.10 0.00 0.22 0.00 0.00 39.33 40.32 1ajd h ASP 437 CO 0.06 0.63 0.62 0.25 -1.72 0.00 0.00 179.24 179.08 1ajd h LEU 438 N 1.08 0.71 0.64 1.55 5.85 -1.58 0.69 115.31 124.24 1ajd h LEU 438 Ca 0.36 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 59.14 1ajd h LEU 438 Cb 0.07 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.07 1ajd h LEU 438 CO -0.12 0.24 -0.31 0.15 -0.34 0.00 0.00 178.44 178.07 1ajd h PHE 439 N 0.68 -0.80 -0.47 1.25 3.57 -1.30 0.79 116.94 120.66 1ajd h PHE 439 Ca 0.57 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 62.10 1ajd h PHE 439 Cb 1.00 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.98 1ajd h PHE 439 CO -0.00 -0.46 0.32 1.88 -2.23 0.00 0.00 178.31 177.81 1ajd h TYR 440 N -0.99 0.44 -0.09 0.41 0.05 -0.75 0.22 116.97 116.25 1ajd h TYR 440 Ca -0.09 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.65 1ajd h TYR 440 Cb 0.70 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 38.29 1ajd h TYR 440 CO -0.01 0.25 -0.14 1.15 -1.05 0.00 0.00 178.16 178.36 1ajd h THR 441 N 0.45 1.38 -0.42 -2.88 2.02 0.46 -1.29 112.91 112.63 1ajd h THR 441 Ca 0.20 -1.37 -0.04 0.00 0.77 0.00 0.00 66.41 65.96 1ajd h THR 441 Cb 0.23 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 1ajd h THR 441 CO -0.05 0.39 0.07 0.24 0.37 0.00 0.00 175.52 176.54 1ajd h MET 442 N -0.18 0.64 -0.27 6.66 2.86 -0.25 0.22 114.93 124.60 1ajd h MET 442 Ca 0.01 -0.12 -0.11 0.00 -2.06 0.00 0.00 59.70 57.42 1ajd h MET 442 Cb 0.69 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 1ajd h MET 442 CO 0.03 0.60 -0.25 -0.22 1.06 0.00 0.00 176.91 178.14 1ajd h LYS 443 N 0.62 0.65 -0.28 1.72 3.64 -0.88 -2.62 116.57 119.40 1ajd h LYS 443 Ca 0.14 -0.33 -0.17 0.00 -1.27 0.00 0.00 60.65 59.01 1ajd h LYS 443 Cb 0.28 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1ajd h LYS 443 CO 0.00 0.94 -0.50 0.00 -2.27 0.00 0.00 179.45 177.62 1ajd h ALA 444 N 0.70 0.44 -0.20 5.00 0.00 -0.98 -0.82 119.26 123.41 1ajd h ALA 444 Ca 0.05 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.51 1ajd h ALA 444 Cb 0.81 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1ajd h ALA 444 CO 0.06 0.63 -0.13 0.00 0.00 0.00 0.00 179.25 179.81 1ajd h ALA 445 N 0.68 0.02 -0.23 0.00 0.00 -0.96 -2.05 119.26 116.72 1ajd h ALA 445 Ca 0.02 0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1ajd h ALA 445 Cb 1.11 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1ajd h ALA 445 CO 0.11 -0.56 -0.34 -0.07 0.00 0.00 0.00 179.25 178.39 1ajd h LEU 446 N -0.13 0.50 0.00 0.00 4.07 -1.47 -0.65 115.31 117.63 1ajd h LEU 446 Ca 0.11 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.88 1ajd h LEU 446 Cb 0.30 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1ajd h LEU 446 CO -0.28 0.80 0.00 0.61 -1.08 0.00 0.00 178.44 178.50 1ajd n GLY 447 N -0.19 0.96 3.76 0.83 0.00 -0.40 -4.82 105.19 105.33 1ajd n GLY 447 Ca -0.01 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 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 4.38 0.00 0.99 1.02 -0.68 -5.01 118.68 119.37 1ajd s LEU 448 Ca 0.00 2.78 0.04 0.00 0.02 0.00 0.00 54.13 56.97 1ajd s LEU 448 Cb 0.00 -3.64 0.03 0.00 0.02 0.00 0.00 46.19 42.60 1ajd s LEU 448 CO 0.00 -0.72 0.62 0.29 0.02 0.00 0.00 176.35 176.55