#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajs n PRO 2 N 0.00 1.61 -1.45 0.00 -0.04 -1.26 -4.90 135.00 128.96 1ajs n PRO 2 Ca 0.00 0.57 -0.33 0.00 -0.04 0.00 0.00 63.50 63.70 1ajs n PRO 2 Cb 0.00 -2.10 0.08 0.00 -0.04 0.00 0.00 33.50 31.45 1ajs n PRO 2 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1ajs s PRO 3 N -1.87 2.28 0.48 0.54 0.04 -1.26 -4.98 135.00 130.23 1ajs s PRO 3 Ca 0.60 1.52 -0.23 0.00 0.04 0.00 0.00 61.00 62.93 1ajs s PRO 3 Cb -0.59 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.00 1ajs s PRO 3 CO 0.59 -1.68 1.24 0.45 0.04 0.00 0.00 177.00 177.64 1ajs s SER 4 N -2.48 5.92 0.00 6.66 0.15 -1.26 -4.90 113.70 117.80 1ajs s SER 4 Ca 0.69 2.48 0.21 0.00 0.70 0.00 0.00 55.95 60.03 1ajs s SER 4 Cb -0.24 -2.62 1.05 0.00 -1.71 0.00 0.00 66.02 62.50 1ajs s SER 4 CO 0.46 -1.10 1.66 1.33 1.20 0.00 0.00 173.24 176.79 1ajs n VAL 5 N -0.57 0.36 -0.38 4.45 0.24 -1.26 -2.08 118.33 119.08 1ajs n VAL 5 Ca 0.08 0.09 0.08 0.00 -2.04 0.00 0.00 64.34 62.54 1ajs n VAL 5 Cb 0.47 -0.75 0.22 0.00 -1.47 0.00 0.00 33.84 32.31 1ajs n VAL 5 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1ajs n PHE 6 N -1.29 0.75 -0.31 6.34 3.72 -1.26 -4.71 117.46 120.70 1ajs n PHE 6 Ca 0.10 -0.57 0.05 0.00 -0.05 0.00 0.00 57.45 56.98 1ajs n PHE 6 Cb 0.17 -0.09 0.25 0.00 -0.94 0.00 0.00 39.48 38.86 1ajs n PHE 6 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ajs h ALA 7 N 2.65 1.53 -0.65 4.37 0.00 -1.80 -2.95 119.26 122.41 1ajs h ALA 7 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ajs h ALA 7 Cb 0.97 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1ajs h ALA 7 CO 0.06 0.32 0.00 0.39 0.00 0.00 0.00 179.25 180.02 1ajs n GLU 8 N -4.50 2.67 -2.36 0.00 1.02 -1.26 -4.94 120.64 111.27 1ajs n GLU 8 Ca 0.14 -2.58 -0.42 0.00 -0.02 0.00 0.00 57.16 54.28 1ajs n GLU 8 Cb 0.22 -1.56 -0.03 0.00 -0.02 0.00 0.00 31.44 30.06 1ajs n GLU 8 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ajs s VAL 9 N -1.14 4.04 0.71 2.62 1.01 -1.12 -4.99 120.40 121.53 1ajs s VAL 9 Ca 0.47 1.38 -0.11 0.00 0.00 0.00 0.00 61.98 63.72 1ajs s VAL 9 Cb 0.25 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1ajs s VAL 9 CO 0.33 -0.02 1.06 -2.16 0.00 0.00 0.00 175.10 174.32 1ajs s PRO 10 N 2.45 2.86 -0.10 2.72 0.04 -1.26 -5.01 135.00 136.70 1ajs s PRO 10 Ca 0.59 0.92 -0.30 0.00 0.04 0.00 0.00 61.00 62.25 1ajs s PRO 10 Cb -0.27 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1ajs s PRO 10 CO 0.23 -1.15 1.09 -1.14 0.04 0.00 0.00 177.00 176.08 1ajs s GLN 11 N -5.06 4.37 0.52 4.56 2.00 -1.26 -5.03 119.66 119.77 1ajs s GLN 11 Ca 0.58 1.51 -0.13 0.00 -2.00 0.00 0.00 55.36 55.32 1ajs s GLN 11 Cb -0.14 -3.57 -0.06 0.00 0.80 0.00 0.00 33.01 30.04 1ajs s GLN 11 CO 0.55 -0.41 0.93 0.00 -0.50 0.00 0.00 175.29 175.86 1ajs s ALA 12 N 2.26 3.16 0.38 1.58 0.00 -1.26 -5.04 121.76 122.84 1ajs s ALA 12 Ca 0.51 -0.03 -0.25 0.00 0.00 0.00 0.00 51.96 52.19 1ajs s ALA 12 Cb -0.20 -2.97 -0.09 0.00 0.00 0.00 0.00 23.12 19.85 1ajs s ALA 12 CO 0.18 -0.32 1.10 -0.65 0.00 0.00 0.00 175.76 176.07 1ajs s GLN 13 N -4.37 4.19 0.76 0.00 -0.21 -1.26 -5.00 119.66 113.78 1ajs s GLN 13 Ca 0.55 1.66 -0.11 0.00 0.02 0.00 0.00 55.36 57.49 1ajs s GLN 13 Cb -0.10 -2.68 0.05 0.00 1.00 0.00 0.00 33.01 31.27 1ajs s GLN 13 CO 0.38 -0.15 1.08 -1.25 -2.12 0.00 0.00 175.29 173.23 1ajs s PRO 14 N -2.27 2.36 -0.55 2.91 0.04 -1.26 -4.96 135.00 131.27 1ajs s PRO 14 Ca 0.56 1.00 -0.27 0.00 0.04 0.00 0.00 61.00 62.32 1ajs s PRO 14 Cb -0.26 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.39 1ajs s PRO 14 CO 0.33 -1.52 1.08 0.08 0.04 0.00 0.00 177.00 177.02 1ajs s VAL 15 N -2.99 4.20 0.17 -0.36 1.01 -1.26 -4.90 120.40 116.27 1ajs s VAL 15 Ca 0.60 0.71 -0.21 0.00 0.00 0.00 0.00 61.98 63.09 1ajs s VAL 15 Cb -0.16 -4.63 0.10 0.00 0.00 0.00 0.00 36.38 31.69 1ajs s VAL 15 CO 0.56 -1.19 1.60 0.25 0.00 0.00 0.00 175.10 176.32 1ajs h LEU 16 N 11.43 -1.01 -1.25 3.92 6.46 -1.98 0.22 115.31 133.10 1ajs h LEU 16 Ca -0.25 0.19 0.10 0.00 -0.12 0.00 0.00 57.88 57.80 1ajs h LEU 16 Cb 1.06 0.50 -0.06 0.00 -0.73 0.00 0.00 40.66 41.43 1ajs h LEU 16 CO 1.13 -0.30 0.56 1.62 -0.62 0.00 0.00 178.44 180.83 1ajs h VAL 17 N -0.20 0.96 0.12 1.05 3.04 -2.00 0.17 116.25 119.38 1ajs h VAL 17 Ca 0.20 -0.28 -0.27 0.00 -1.01 0.00 0.00 66.70 65.33 1ajs h VAL 17 Cb 0.52 0.06 0.01 0.00 -2.01 0.00 0.00 31.29 29.87 1ajs h VAL 17 CO -0.57 0.15 -1.21 -0.26 -1.01 0.00 0.00 177.57 174.67 1ajs h PHE 18 N 0.83 0.59 -0.50 3.17 -1.00 -1.72 -3.20 116.94 115.10 1ajs h PHE 18 Ca 0.40 -0.40 0.05 0.00 2.81 0.00 0.00 57.97 60.83 1ajs h PHE 18 Cb 0.43 -0.03 -0.05 0.00 3.61 0.00 0.00 35.95 39.91 1ajs h PHE 18 CO -0.00 1.29 0.24 -0.22 -1.61 0.00 0.00 178.31 178.01 1ajs h LYS 19 N 0.12 0.45 -0.34 1.51 1.63 0.52 -1.79 116.57 118.67 1ajs h LYS 19 Ca -0.14 -0.03 0.05 0.00 -0.85 0.00 0.00 60.65 59.69 1ajs h LYS 19 Cb 1.91 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 33.42 1ajs h LYS 19 CO 0.20 0.30 0.23 -0.07 -3.45 0.00 0.00 179.45 176.67 1ajs h LEU 20 N 0.47 0.22 -0.50 5.20 3.38 -1.06 -0.18 115.31 122.83 1ajs h LEU 20 Ca 0.23 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1ajs h LEU 20 Cb 0.16 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1ajs h LEU 20 CO -0.17 0.15 0.03 0.40 0.09 0.00 0.00 178.44 178.93 1ajs h ILE 21 N 0.25 1.26 0.10 1.22 2.04 -1.32 0.86 117.51 121.92 1ajs h ILE 21 Ca 0.15 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1ajs h ILE 21 Cb 0.28 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1ajs h ILE 21 CO -0.03 0.37 -0.05 0.00 0.00 0.00 0.00 178.15 178.44 1ajs h ALA 22 N 0.95 -0.14 -0.46 1.87 0.00 -1.09 -2.21 119.26 118.17 1ajs h ALA 22 Ca 0.15 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1ajs h ALA 22 Cb 0.48 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 1ajs h ALA 22 CO 0.02 -0.41 -0.05 -0.44 0.00 0.00 0.00 179.25 178.37 1ajs h ASP 23 N -0.48 -0.30 -0.89 0.00 3.32 -1.03 -0.89 116.42 116.14 1ajs h ASP 23 Ca -0.01 0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1ajs h ASP 23 Cb 0.39 0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.13 1ajs h ASP 23 CO 0.02 -0.11 0.59 0.15 -1.72 0.00 0.00 179.24 178.18 1ajs h PHE 24 N 0.06 1.13 -0.10 4.55 3.57 -0.81 -2.73 116.94 122.61 1ajs h PHE 24 Ca 0.23 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.64 1ajs h PHE 24 Cb 0.35 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1ajs h PHE 24 CO -0.34 0.71 -0.44 0.00 -2.23 0.00 0.00 178.31 176.02 1ajs h ARG 25 N 1.21 0.24 -0.03 1.11 3.08 -0.59 -2.59 114.38 116.81 1ajs h ARG 25 Ca 0.33 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1ajs h ARG 25 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1ajs h ARG 25 CO -0.07 0.64 0.00 0.39 -1.07 0.00 0.00 179.97 179.86 1ajs n GLU 26 N -4.01 1.24 -2.95 0.04 -0.58 -0.46 -4.79 120.64 109.14 1ajs n GLU 26 Ca -0.02 -0.35 -0.42 0.00 -0.42 0.00 0.00 57.16 55.95 1ajs n GLU 26 Cb 0.50 -1.40 -0.05 0.00 -0.57 0.00 0.00 31.44 29.91 1ajs n GLU 26 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1ajs s ASP 27 N -1.77 6.52 0.24 1.62 -1.08 -0.98 -4.90 116.67 116.32 1ajs s ASP 27 Ca 0.36 0.24 0.11 0.00 -0.52 0.00 0.00 52.55 52.74 1ajs s ASP 27 Cb 0.18 -2.40 0.20 0.00 -1.46 0.00 0.00 42.92 39.44 1ajs s ASP 27 CO 0.29 -0.80 1.51 1.55 0.52 0.00 0.00 175.17 178.24 1ajs h PRO 28 N 8.63 0.00 -6.27 4.34 0.13 -1.88 -3.45 132.00 133.50 1ajs h PRO 28 Ca -0.25 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.21 1ajs h PRO 28 Cb 1.09 0.00 0.06 0.00 0.13 0.00 0.00 31.00 32.28 1ajs h PRO 28 CO 0.93 0.70 0.42 -3.47 -0.23 0.00 0.00 178.00 176.34 1ajs n ASP 29 N -3.59 1.56 0.25 1.44 -0.08 -1.26 -4.86 116.55 110.01 1ajs n ASP 29 Ca -0.00 1.12 0.14 0.00 -1.51 0.00 0.00 54.79 54.54 1ajs n ASP 29 Cb 0.71 -1.19 0.48 0.00 2.34 0.00 0.00 41.12 43.46 1ajs n ASP 29 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1ajs h PRO 30 N 4.34 0.00 -0.01 -0.67 0.13 -2.01 -3.26 132.00 130.53 1ajs h PRO 30 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ajs h PRO 30 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1ajs h PRO 30 CO 0.76 0.07 -0.19 0.54 -0.23 0.00 0.00 178.00 178.96 1ajs n ARG 31 N -3.16 1.17 -1.68 0.86 1.74 -1.26 -4.99 116.66 109.34 1ajs n ARG 31 Ca 0.01 -0.73 -0.43 0.00 -0.77 0.00 0.00 57.85 55.93 1ajs n ARG 31 Cb 0.41 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 30.35 1ajs n ARG 31 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1ajs n LYS 32 N -0.28 2.03 -3.83 5.56 2.85 -1.23 -4.87 118.16 118.38 1ajs n LYS 32 Ca 0.14 0.71 -0.15 0.00 -1.05 0.00 0.00 58.31 57.96 1ajs n LYS 32 Cb 0.37 -2.30 -0.16 0.00 -0.65 0.00 0.00 35.03 32.29 1ajs n LYS 32 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 1ajs s VAL 33 N -0.77 0.01 -0.41 0.58 -7.23 -0.47 -5.02 120.40 107.09 1ajs s VAL 33 Ca 0.60 0.15 -0.16 0.00 -1.81 0.00 0.00 61.98 60.75 1ajs s VAL 33 Cb -0.61 -0.12 0.02 0.00 0.56 0.00 0.00 36.38 36.23 1ajs s VAL 33 CO 0.58 0.09 0.37 0.21 -0.31 0.00 0.00 175.10 176.04 1ajs s ASN 34 N 0.88 6.16 -0.20 4.85 2.47 -1.26 -0.07 114.94 127.77 1ajs s ASN 34 Ca -0.08 -0.71 0.13 0.00 0.42 0.00 0.00 52.86 52.62 1ajs s ASN 34 Cb -0.11 -2.20 0.40 0.00 -1.45 0.00 0.00 41.25 37.90 1ajs s ASN 34 CO -0.02 -0.50 1.24 0.18 -3.72 0.00 0.00 177.10 174.28 1ajs n LEU 35 N 5.40 2.84 0.00 3.21 4.32 0.35 -4.57 117.00 128.55 1ajs n LEU 35 Ca -0.09 -3.67 0.00 0.00 -0.02 0.00 0.00 56.01 52.23 1ajs n LEU 35 Cb 0.47 -0.52 0.00 0.00 -1.62 0.00 0.00 43.42 41.75 1ajs n LEU 35 CO 0.43 1.20 0.00 0.61 -1.22 0.00 0.00 177.39 178.42 1ajs n GLY 36 N -1.18 1.13 3.46 -0.72 0.00 -0.91 -1.41 105.19 105.57 1ajs n GLY 36 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1ajs n GLY 36 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1ajs n VAL 37 N 0.00 1.78 -2.62 1.61 3.14 -1.26 -4.29 118.33 116.69 1ajs n VAL 37 Ca 0.00 -0.50 -0.42 0.00 -2.96 0.00 0.00 64.34 60.46 1ajs n VAL 37 Cb 0.00 -0.54 -0.03 0.00 -1.06 0.00 0.00 33.84 32.22 1ajs n VAL 37 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1ajs s GLY 38 N -0.91 1.39 -0.01 7.55 0.00 -1.26 -4.83 107.32 109.24 1ajs s GLY 38 Ca 0.63 -2.37 0.01 0.00 0.00 0.00 0.00 44.72 42.99 1ajs s GLY 38 CO 0.58 2.58 -0.03 0.00 0.00 0.00 0.00 173.10 176.23 1ajs s ALA 39 N 4.58 0.35 0.37 3.20 0.00 -1.26 -4.99 121.76 124.01 1ajs s ALA 39 Ca 0.44 -0.10 -0.25 0.00 0.00 0.00 0.00 51.96 52.06 1ajs s ALA 39 Cb -0.01 -0.15 -0.09 0.00 0.00 0.00 0.00 23.12 22.87 1ajs s ALA 39 CO -0.09 0.05 1.03 -0.47 0.00 0.00 0.00 175.76 176.28 1ajs s TYR 40 N 0.18 3.38 0.01 0.00 5.04 -1.26 -4.63 117.35 120.07 1ajs s TYR 40 Ca -0.02 1.67 -0.00 0.00 -2.44 0.00 0.00 57.07 56.28 1ajs s TYR 40 Cb -0.05 -3.10 -0.01 0.00 0.35 0.00 0.00 41.96 39.15 1ajs s TYR 40 CO -0.00 -0.46 -0.01 1.03 -1.34 0.00 0.00 175.55 174.76 1ajs s ARG 41 N -2.32 0.25 1.07 4.97 1.81 -1.24 -4.32 118.95 119.17 1ajs s ARG 41 Ca 0.55 -0.45 -0.18 0.00 -1.72 0.00 0.00 55.73 53.92 1ajs s ARG 41 Cb -0.22 0.09 0.25 0.00 -0.45 0.00 0.00 34.95 34.62 1ajs s ARG 41 CO 0.28 -0.04 1.28 0.95 -0.68 0.00 0.00 175.30 177.09 1ajs s THR 42 N -1.11 1.84 0.18 0.02 -4.23 0.58 -4.84 115.64 108.09 1ajs s THR 42 Ca -0.12 0.00 0.35 0.00 -1.18 0.00 0.00 61.69 60.74 1ajs s THR 42 Cb -0.08 -2.84 0.39 0.00 1.34 0.00 0.00 72.50 71.31 1ajs s THR 42 CO -0.01 0.00 2.05 -0.78 -0.54 0.00 0.00 174.62 175.34 1ajs h ASP 43 N -2.07 0.00 0.21 3.99 3.58 -1.89 0.20 116.42 120.43 1ajs h ASP 43 Ca -0.43 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.02 1ajs h ASP 43 Cb 1.23 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.28 1ajs h ASP 43 CO 0.31 0.00 -0.07 0.47 -2.88 0.00 0.00 179.24 177.07 1ajs n ASP 44 N -2.98 0.56 -1.67 2.28 8.00 -1.26 -4.42 116.55 117.06 1ajs n ASP 44 Ca -0.00 -0.84 -0.13 0.00 0.71 0.00 0.00 54.79 54.53 1ajs n ASP 44 Cb 0.23 -0.04 0.01 0.00 -0.02 0.00 0.00 41.12 41.30 1ajs n ASP 44 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ajs s GLN 46 N -4.95 2.16 0.61 0.00 -1.52 -1.26 -4.81 119.66 109.90 1ajs s GLN 46 Ca 0.10 -1.07 -0.19 0.00 -1.95 0.00 0.00 55.36 52.25 1ajs s GLN 46 Cb -0.04 -2.30 -0.02 0.00 -0.22 0.00 0.00 33.01 30.43 1ajs s GLN 46 CO 0.12 0.49 1.29 -2.14 -0.25 0.00 0.00 175.29 174.80 1ajs s PRO 47 N -2.40 2.77 -0.23 2.91 0.02 -1.26 -0.31 135.00 136.50 1ajs s PRO 47 Ca 0.23 2.05 0.02 0.00 0.02 0.00 0.00 61.00 63.32 1ajs s PRO 47 Cb -0.11 -1.96 0.05 0.00 0.02 0.00 0.00 34.50 32.51 1ajs s PRO 47 CO 0.15 -1.42 -0.11 -0.46 -0.33 0.00 0.00 177.00 174.82 1ajs s TRP 48 N -1.41 2.86 -0.26 6.54 -0.00 -1.26 -4.79 118.94 120.62 1ajs s TRP 48 Ca 0.79 -1.96 -0.24 0.00 -0.00 0.00 0.00 56.10 54.69 1ajs s TRP 48 Cb -0.37 -1.80 -0.00 0.00 -0.00 0.00 0.00 33.47 31.29 1ajs s TRP 48 CO 0.40 -0.82 0.80 0.08 -0.00 0.00 0.00 176.95 177.41 1ajs s VAL 49 N 1.24 4.83 0.30 5.86 1.01 -1.26 -4.91 120.40 127.48 1ajs s VAL 49 Ca -0.05 1.44 -0.29 0.00 0.00 0.00 0.00 61.98 63.08 1ajs s VAL 49 Cb -0.18 -4.11 -0.12 0.00 0.00 0.00 0.00 36.38 31.97 1ajs s VAL 49 CO -0.07 -0.11 1.41 0.18 0.00 0.00 0.00 175.10 176.50 1ajs n LEU 50 N 6.05 3.68 -0.26 3.92 4.32 -1.26 -4.80 117.00 128.64 1ajs n LEU 50 Ca 0.05 1.18 0.07 0.00 -0.02 0.00 0.00 56.01 57.28 1ajs n LEU 50 Cb 0.48 -1.50 0.20 0.00 -1.62 0.00 0.00 43.42 40.98 1ajs n LEU 50 CO 0.48 -0.30 0.94 -0.65 -1.22 0.00 0.00 177.39 176.64 1ajs h PRO 51 N 3.56 0.27 -0.60 3.23 0.11 -1.98 0.17 132.00 136.75 1ajs h PRO 51 Ca -0.46 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 1ajs h PRO 51 Cb 1.27 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1ajs h PRO 51 CO 0.70 0.18 0.19 -0.24 -0.21 0.00 0.00 178.00 178.62 1ajs h VAL 52 N 0.27 1.23 -0.12 3.15 3.04 -1.90 -2.20 116.25 119.71 1ajs h VAL 52 Ca 0.44 -0.77 -0.01 0.00 -1.01 0.00 0.00 66.70 65.35 1ajs h VAL 52 Cb 0.78 0.56 -0.01 0.00 -2.01 0.00 0.00 31.29 30.62 1ajs h VAL 52 CO -0.53 0.30 0.05 0.58 -1.01 0.00 0.00 177.57 176.95 1ajs h VAL 53 N 0.88 1.16 -0.96 1.51 2.07 -1.37 -0.97 116.25 118.56 1ajs h VAL 53 Ca 0.20 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.30 1ajs h VAL 53 Cb 0.24 1.25 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1ajs h VAL 53 CO -0.01 0.14 0.62 0.03 0.02 0.00 0.00 177.57 178.37 1ajs h ARG 54 N 0.04 1.10 0.13 1.57 3.08 -1.08 -0.13 114.38 119.09 1ajs h ARG 54 Ca 0.04 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ajs h ARG 54 Cb 0.18 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1ajs h ARG 54 CO -0.00 0.73 -0.06 -0.22 -1.07 0.00 0.00 179.97 179.34 1ajs h LYS 55 N 1.13 -0.17 -0.58 0.04 3.64 -1.16 -2.56 116.57 116.92 1ajs h LYS 55 Ca 0.41 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.73 1ajs h LYS 55 Cb 0.15 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1ajs h LYS 55 CO -0.17 -0.02 0.07 0.28 -2.27 0.00 0.00 179.45 177.34 1ajs h VAL 56 N -0.29 1.25 -0.75 2.00 2.07 -0.85 -2.44 116.25 117.24 1ajs h VAL 56 Ca -0.02 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.52 1ajs h VAL 56 Cb 0.23 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 1ajs h VAL 56 CO 0.03 0.37 0.49 -0.33 0.02 0.00 0.00 177.57 178.14 1ajs h GLU 57 N 0.89 0.95 -0.62 1.57 5.08 -0.96 0.15 114.58 121.64 1ajs h GLU 57 Ca 0.18 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.39 1ajs h GLU 57 Cb 0.43 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1ajs h GLU 57 CO 0.01 0.63 0.04 1.96 -1.00 0.00 0.00 179.01 180.65 1ajs h GLN 58 N 0.98 1.07 -0.29 2.33 1.08 -1.27 0.71 115.11 119.71 1ajs h GLN 58 Ca 0.29 -0.32 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1ajs h GLN 58 Cb -0.06 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 1ajs h GLN 58 CO -0.08 1.02 0.17 0.00 -0.95 0.00 0.00 178.83 178.99 1ajs h ARG 59 N 0.97 0.39 -0.24 1.46 3.08 -0.90 -2.10 114.38 117.04 1ajs h ARG 59 Ca 0.18 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1ajs h ARG 59 Cb 0.51 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 1ajs h ARG 59 CO 0.02 0.30 0.16 0.82 -1.07 0.00 0.00 179.97 180.20 1ajs h ILE 60 N 0.37 1.06 -0.16 2.04 2.04 -0.41 -2.49 117.51 119.96 1ajs h ILE 60 Ca 0.10 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1ajs h ILE 60 Cb 0.01 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1ajs h ILE 60 CO -0.02 0.06 0.13 0.00 0.00 0.00 0.00 178.15 178.32 1ajs h ALA 61 N 1.09 1.98 -0.68 1.87 0.00 -0.58 -1.98 119.26 120.95 1ajs h ALA 61 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ajs h ALA 61 Cb -0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ajs h ALA 61 CO -0.02 -0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.11 1ajs n ASN 62 N -4.20 3.91 -4.30 0.00 3.02 -0.81 -4.80 115.26 108.08 1ajs n ASN 62 Ca 0.01 -2.05 -0.46 0.00 -0.03 0.00 0.00 54.58 52.06 1ajs n ASN 62 Cb 0.26 -0.47 -0.04 0.00 -0.61 0.00 0.00 39.78 38.92 1ajs n ASN 62 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1ajs s ASN 63 N -1.00 6.41 0.45 6.41 3.04 -0.75 -4.90 114.94 124.60 1ajs s ASN 63 Ca 0.46 -2.38 0.31 0.00 0.04 0.00 0.00 52.86 51.29 1ajs s ASN 63 Cb 0.25 -2.17 1.46 0.00 -1.54 0.00 0.00 41.25 39.25 1ajs s ASN 63 CO 0.30 -0.65 1.93 0.28 -3.04 0.00 0.00 177.10 175.92 1ajs h SER 64 N 8.10 0.00 0.77 -4.21 0.02 -1.87 -2.54 113.55 113.82 1ajs h SER 64 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1ajs h SER 64 Cb 1.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1ajs h SER 64 CO 0.84 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.99 1ajs n SER 65 N -2.68 0.41 -4.83 3.07 3.41 -1.26 -4.82 113.62 106.92 1ajs n SER 65 Ca -0.00 0.59 -0.36 0.00 -0.26 0.00 0.00 58.87 58.83 1ajs n SER 65 Cb 0.18 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.39 1ajs n SER 65 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ajs s LEU 66 N -3.87 4.37 0.00 1.04 1.43 -0.96 -5.08 118.68 115.61 1ajs s LEU 66 Ca 0.07 1.18 0.01 0.00 -1.03 0.00 0.00 54.13 54.36 1ajs s LEU 66 Cb 0.11 -3.27 -0.00 0.00 0.03 0.00 0.00 46.19 43.05 1ajs s LEU 66 CO 0.39 0.12 0.03 -0.46 0.23 0.00 0.00 176.35 176.66 1ajs n ASN 67 N 0.95 2.09 -0.55 2.29 0.23 -1.26 -5.07 115.26 113.93 1ajs n ASN 67 Ca -0.06 -2.16 0.07 0.00 -0.53 0.00 0.00 54.58 51.91 1ajs n ASN 67 Cb 0.51 0.33 0.20 0.00 -2.08 0.00 0.00 39.78 38.74 1ajs n ASN 67 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1ajs n HIS 68 N -0.59 0.47 -2.23 -2.53 8.25 -1.26 -5.04 115.22 112.29 1ajs n HIS 68 Ca -0.08 -1.08 -0.35 0.00 -0.26 0.00 0.00 57.72 55.95 1ajs n HIS 68 Cb 0.33 -0.26 0.01 0.00 1.12 0.00 0.00 29.99 31.19 1ajs n HIS 68 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ajs s GLU 69 N -2.94 3.31 0.26 -0.41 0.41 -1.26 -4.92 118.70 113.15 1ajs s GLU 69 Ca 0.38 1.64 -0.29 0.00 -0.41 0.00 0.00 54.97 56.29 1ajs s GLU 69 Cb 0.33 -2.00 -0.14 0.00 -1.78 0.00 0.00 34.13 30.54 1ajs s GLU 69 CO 0.04 -0.89 1.04 0.66 -0.49 0.00 0.00 175.26 175.61 1ajs n TYR 70 N -1.33 1.25 -1.88 1.61 4.01 -1.26 -4.98 117.16 114.58 1ajs n TYR 70 Ca 0.12 0.70 -0.30 0.00 -0.16 0.00 0.00 57.90 58.26 1ajs n TYR 70 Cb 0.51 -2.25 0.06 0.00 -0.31 0.00 0.00 39.34 37.34 1ajs n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1ajs s LEU 71 N 0.56 2.79 0.81 7.72 1.43 -1.26 -5.01 118.68 125.70 1ajs s LEU 71 Ca 0.62 1.05 -0.14 0.00 -1.03 0.00 0.00 54.13 54.63 1ajs s LEU 71 Cb -0.73 -3.76 0.07 0.00 0.03 0.00 0.00 46.19 41.80 1ajs s LEU 71 CO 0.58 -1.50 1.15 -2.65 0.23 0.00 0.00 176.35 174.16 1ajs n PRO 72 N -3.10 0.19 -0.22 1.29 -0.02 -1.26 -4.83 135.00 127.06 1ajs n PRO 72 Ca 0.07 0.14 0.03 0.00 -2.02 0.00 0.00 63.50 61.72 1ajs n PRO 72 Cb 0.58 -2.39 0.14 0.00 -0.02 0.00 0.00 33.50 31.80 1ajs n PRO 72 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1ajs h ILE 73 N -0.87 0.59 0.00 4.25 2.04 -1.95 -0.65 117.51 120.91 1ajs h ILE 73 Ca -0.46 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1ajs h ILE 73 Cb 1.30 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1ajs h ILE 73 CO 0.46 0.05 0.00 0.18 0.00 0.00 0.00 178.15 178.83 1ajs n LEU 74 N -5.14 0.03 0.00 1.44 4.77 -1.26 -4.39 117.00 112.45 1ajs n LEU 74 Ca 0.11 0.50 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1ajs n LEU 74 Cb 0.38 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1ajs n LEU 74 CO 0.15 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 1ajs n GLY 75 N 1.13 -1.63 3.64 -0.72 0.00 -0.25 -0.60 105.19 106.76 1ajs n GLY 75 Ca 0.06 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 1ajs n GLY 75 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajs s LEU 76 N 0.00 4.07 0.16 0.99 2.96 -1.26 -4.40 118.68 121.20 1ajs s LEU 76 Ca 0.00 2.22 -0.17 0.00 -0.22 0.00 0.00 54.13 55.96 1ajs s LEU 76 Cb 0.00 -3.53 0.09 0.00 0.50 0.00 0.00 46.19 43.25 1ajs s LEU 76 CO 0.00 -1.30 1.69 0.00 -1.32 0.00 0.00 176.35 175.42 1ajs h ALA 77 N 11.56 0.30 -0.43 5.97 0.00 -1.98 -0.81 119.26 133.87 1ajs h ALA 77 Ca -0.43 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1ajs h ALA 77 Cb 1.21 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1ajs h ALA 77 CO 0.96 -0.43 0.22 0.93 0.00 0.00 0.00 179.25 180.93 1ajs h GLU 78 N 0.05 0.60 -0.00 0.00 3.07 -1.99 -1.27 114.58 115.03 1ajs h GLU 78 Ca 0.18 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1ajs h GLU 78 Cb 0.27 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1ajs h GLU 78 CO -0.35 0.46 -0.01 0.35 -1.40 0.00 0.00 179.01 178.07 1ajs h PHE 79 N 0.60 0.01 -0.56 4.33 3.57 -1.62 -1.73 116.94 121.53 1ajs h PHE 79 Ca 0.15 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.73 1ajs h PHE 79 Cb 0.05 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.72 1ajs h PHE 79 CO 0.00 0.53 0.20 0.00 -2.23 0.00 0.00 178.31 176.81 1ajs h ARG 80 N -0.50 0.37 0.14 1.11 3.08 -0.67 0.79 114.38 118.70 1ajs h ARG 80 Ca 0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1ajs h ARG 80 Cb 0.52 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1ajs h ARG 80 CO 0.00 0.25 -0.07 1.15 -1.07 0.00 0.00 179.97 180.23 1ajs h THR 81 N 0.38 0.92 -0.77 2.04 2.02 -1.30 -1.85 112.91 114.35 1ajs h THR 81 Ca 0.28 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1ajs h THR 81 Cb 0.33 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 1ajs h THR 81 CO -0.28 0.07 0.37 0.00 0.37 0.00 0.00 175.52 176.04 1ajs h ALA 83 N 1.31 0.41 -0.79 0.00 0.00 -0.78 -1.61 119.26 117.80 1ajs h ALA 83 Ca 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ajs h ALA 83 Cb 0.11 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1ajs h ALA 83 CO -0.03 0.14 0.39 0.77 0.00 0.00 0.00 179.25 180.51 1ajs h SER 84 N 0.33 1.02 -0.87 0.00 0.02 -1.19 -2.67 113.55 110.18 1ajs h SER 84 Ca 0.09 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1ajs h SER 84 Cb 0.41 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.65 1ajs h SER 84 CO 0.01 0.86 0.53 -0.09 -1.14 0.00 0.00 176.83 177.00 1ajs h ARG 85 N 1.11 1.19 -0.49 3.45 2.43 -1.24 -0.62 114.38 120.20 1ajs h ARG 85 Ca 0.27 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1ajs h ARG 85 Cb 0.10 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 1ajs h ARG 85 CO -0.04 0.83 0.29 1.25 -1.51 0.00 0.00 179.97 180.80 1ajs h LEU 86 N 1.20 0.47 -0.11 3.80 5.85 -0.96 0.39 115.31 125.96 1ajs h LEU 86 Ca 0.31 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.93 1ajs h LEU 86 Cb -0.05 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1ajs h LEU 86 CO -0.06 0.34 -0.36 0.00 -0.34 0.00 0.00 178.44 178.02 1ajs h ALA 87 N 1.21 0.19 0.00 1.25 0.00 -1.25 -3.37 119.26 117.30 1ajs h ALA 87 Ca 0.19 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1ajs h ALA 87 Cb 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ajs h ALA 87 CO -0.08 0.26 -0.85 -0.07 0.00 0.00 0.00 179.25 178.51 1ajs h LEU 88 N 0.00 0.00 0.00 0.00 3.38 -1.00 -3.42 115.31 114.27 1ajs h LEU 88 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ajs h LEU 88 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1ajs h LEU 88 CO 0.08 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.47 1ajs n GLY 89 N 1.23 0.23 0.39 0.83 0.00 0.14 -4.24 105.19 103.77 1ajs n GLY 89 Ca -0.02 -1.47 0.17 0.00 0.00 0.00 0.00 46.02 44.70 1ajs n GLY 89 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ajs h ASP 90 N 0.00 0.44 -0.37 1.61 5.19 -1.94 -1.47 116.42 119.87 1ajs h ASP 90 Ca 0.00 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1ajs h ASP 90 Cb 0.00 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1ajs h ASP 90 CO 0.00 0.20 0.00 -0.90 -3.12 0.00 0.00 179.24 175.42 1ajs n ASP 91 N -4.51 2.82 -4.63 6.45 5.68 -1.26 -4.94 116.55 116.16 1ajs n ASP 91 Ca 0.17 -1.92 -0.47 0.00 -0.50 0.00 0.00 54.79 52.08 1ajs n ASP 91 Cb 0.61 -0.24 -0.03 0.00 -1.14 0.00 0.00 41.12 40.31 1ajs n ASP 91 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1ajs n SER 92 N 1.07 2.10 -0.18 -1.12 2.88 -0.56 -4.86 113.62 112.95 1ajs n SER 92 Ca 0.18 1.14 -0.00 0.00 -1.33 0.00 0.00 58.87 58.86 1ajs n SER 92 Cb 0.49 -1.32 0.23 0.00 -0.75 0.00 0.00 64.21 62.86 1ajs n SER 92 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ajs h PRO 93 N 3.95 0.93 -0.93 -1.46 0.13 -1.92 -1.81 132.00 130.89 1ajs h PRO 93 Ca -0.44 -0.09 0.03 0.00 -0.87 0.00 0.00 66.00 64.63 1ajs h PRO 93 Cb 1.31 -0.19 -0.05 0.00 0.13 0.00 0.00 31.00 32.20 1ajs h PRO 93 CO 0.74 0.68 0.61 0.00 -0.23 0.00 0.00 178.00 179.80 1ajs h ALA 94 N 1.48 1.40 -0.19 -0.56 0.00 -1.95 0.52 119.26 119.96 1ajs h ALA 94 Ca 0.24 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.90 1ajs h ALA 94 Cb 0.01 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.48 1ajs h ALA 94 CO -0.04 0.51 -0.67 -0.07 0.00 0.00 0.00 179.25 178.98 1ajs h LEU 95 N 1.17 0.92 -0.76 0.00 3.38 -1.77 -0.30 115.31 117.95 1ajs h LEU 95 Ca 0.37 -0.60 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 1ajs h LEU 95 Cb 0.00 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1ajs h LEU 95 CO -0.11 1.36 0.25 1.56 0.09 0.00 0.00 178.44 181.59 1ajs h GLN 96 N 0.52 1.17 -0.05 1.13 4.20 -0.52 -2.25 115.11 119.33 1ajs h GLN 96 Ca -0.03 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.43 1ajs h GLN 96 Cb 1.29 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.90 1ajs h GLN 96 CO 0.14 0.99 0.00 0.39 -0.67 0.00 0.00 178.83 179.68 1ajs n GLU 97 N -4.25 1.18 -3.89 1.46 1.02 0.18 -4.92 120.64 111.41 1ajs n GLU 97 Ca 0.06 -0.27 -0.30 0.00 -0.02 0.00 0.00 57.16 56.63 1ajs n GLU 97 Cb 0.22 -1.28 0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1ajs n GLU 97 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ajs n LYS 98 N -0.48 -5.74 -1.69 3.49 5.02 -0.85 -4.61 118.16 113.30 1ajs n LYS 98 Ca 0.13 0.62 -0.19 0.00 -2.02 0.00 0.00 58.31 56.84 1ajs n LYS 98 Cb 0.12 -5.53 0.06 0.00 -0.02 0.00 0.00 35.03 29.66 1ajs n LYS 98 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 1ajs n ARG 99 N -4.72 3.15 -5.09 1.97 1.85 -0.18 -4.35 116.66 109.29 1ajs n ARG 99 Ca 0.04 -3.93 -0.29 0.00 -1.00 0.00 0.00 57.85 52.68 1ajs n ARG 99 Cb 0.53 -2.15 -0.16 0.00 -1.05 0.00 0.00 32.46 29.62 1ajs n ARG 99 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1ajs s VAL 100 N -4.34 1.76 0.10 8.89 1.01 -1.25 -1.59 120.40 124.98 1ajs s VAL 100 Ca 0.50 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.58 1ajs s VAL 100 Cb 0.41 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1ajs s VAL 100 CO 0.02 0.50 -0.12 -0.83 0.00 0.00 0.00 175.10 174.67 1ajs s GLY 101 N -0.37 0.92 -0.02 4.51 0.00 -0.09 -4.98 107.32 107.30 1ajs s GLY 101 Ca 0.04 -1.20 -0.01 0.00 0.00 0.00 0.00 44.72 43.55 1ajs s GLY 101 CO 0.00 -1.26 0.04 -0.32 0.00 0.00 0.00 173.10 171.56 1ajs s GLY 102 N -2.37 -0.01 -0.24 0.20 0.00 -1.26 -0.41 107.32 103.23 1ajs s GLY 102 Ca 0.06 0.14 0.02 0.00 0.00 0.00 0.00 44.72 44.94 1ajs s GLY 102 CO 0.01 0.19 -0.10 0.14 0.00 0.00 0.00 173.10 173.34 1ajs s VAL 103 N 0.18 1.88 0.32 1.40 1.01 -0.34 -4.94 120.40 119.91 1ajs s VAL 103 Ca -0.01 -1.37 -0.29 0.00 0.00 0.00 0.00 61.98 60.31 1ajs s VAL 103 Cb -0.02 -2.02 -0.11 0.00 0.00 0.00 0.00 36.38 34.23 1ajs s VAL 103 CO -0.01 0.01 1.51 -1.58 0.00 0.00 0.00 175.10 175.04 1ajs s GLN 104 N 1.25 4.16 0.26 2.72 0.74 0.23 -0.73 119.66 128.29 1ajs s GLN 104 Ca -0.06 2.50 0.03 0.00 0.05 0.00 0.00 55.36 57.87 1ajs s GLN 104 Cb -0.19 -3.02 -0.04 0.00 1.10 0.00 0.00 33.01 30.86 1ajs s GLN 104 CO -0.06 -0.53 0.18 -1.54 -0.55 0.00 0.00 175.29 172.79 1ajs s SER 105 N 0.18 0.90 -1.04 6.67 1.04 -0.13 -4.76 113.70 116.56 1ajs s SER 105 Ca 0.58 -1.54 -0.20 0.00 0.48 0.00 0.00 55.95 55.27 1ajs s SER 105 Cb -0.46 0.44 0.09 0.00 0.10 0.00 0.00 66.02 66.19 1ajs s SER 105 CO 0.53 -0.92 1.37 -0.76 0.98 0.00 0.00 173.24 174.43 1ajs s LEU 106 N -3.27 4.21 0.00 2.42 2.01 -1.26 -1.58 118.68 121.22 1ajs s LEU 106 Ca 0.39 -1.90 0.00 0.00 0.01 0.00 0.00 54.13 52.63 1ajs s LEU 106 Cb 0.05 -2.50 0.00 0.00 0.01 0.00 0.00 46.19 43.75 1ajs s LEU 106 CO 0.18 -1.25 0.00 0.61 1.01 0.00 0.00 176.35 176.90 1ajs n GLY 107 N 6.00 -1.60 0.26 -3.19 0.00 -0.86 -0.90 105.19 104.90 1ajs n GLY 107 Ca 0.32 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1ajs n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ajs h GLY 108 N -0.36 0.47 0.99 -0.02 0.00 -1.78 -2.58 103.07 99.78 1ajs h GLY 108 Ca 0.01 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1ajs h GLY 108 CO 0.00 0.27 0.10 -0.84 0.00 0.00 0.00 176.54 176.07 1ajs h THR 109 N 0.41 1.05 -0.75 4.70 2.02 -1.92 -0.87 112.91 117.55 1ajs h THR 109 Ca 0.08 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1ajs h THR 109 Cb 0.40 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.63 1ajs h THR 109 CO 0.02 0.05 0.37 1.23 0.37 0.00 0.00 175.52 177.56 1ajs h GLY 110 N 0.19 1.13 0.97 2.16 0.00 -0.87 0.02 103.07 106.67 1ajs h GLY 110 Ca 0.06 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 1ajs h GLY 110 CO -0.01 0.52 0.22 0.00 0.00 0.00 0.00 176.54 177.26 1ajs h ALA 111 N 1.35 0.64 -0.41 3.60 0.00 -1.15 -1.27 119.26 122.02 1ajs h ALA 111 Ca 0.26 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ajs h ALA 111 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1ajs h ALA 111 CO -0.04 0.23 0.26 -0.07 0.00 0.00 0.00 179.25 179.63 1ajs h LEU 112 N 0.65 0.49 -0.25 0.00 3.38 -0.66 -2.05 115.31 116.87 1ajs h LEU 112 Ca 0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ajs h LEU 112 Cb 0.16 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1ajs h LEU 112 CO -0.02 0.39 0.15 -0.09 0.09 0.00 0.00 178.44 178.96 1ajs h ARG 113 N 0.55 0.35 -0.61 1.13 9.65 -0.70 -0.95 114.38 123.80 1ajs h ARG 113 Ca 0.15 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1ajs h ARG 113 Cb -0.01 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.47 1ajs h ARG 113 CO -0.03 0.29 0.37 0.82 2.80 0.00 0.00 179.97 184.23 1ajs h ILE 114 N 0.31 1.17 -0.31 1.20 1.08 -1.15 -0.79 117.51 119.03 1ajs h ILE 114 Ca 0.09 -0.38 -0.00 0.00 -0.39 0.00 0.00 64.86 64.18 1ajs h ILE 114 Cb 0.04 0.33 -0.01 0.00 -3.07 0.00 0.00 36.82 34.11 1ajs h ILE 114 CO -0.02 0.18 0.18 1.23 -0.69 0.00 0.00 178.15 179.03 1ajs h GLY 115 N 0.82 0.45 0.99 5.37 0.00 -1.21 -0.98 103.07 108.51 1ajs h GLY 115 Ca 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1ajs h GLY 115 CO -0.04 0.19 0.31 0.00 0.00 0.00 0.00 176.54 177.00 1ajs h ALA 116 N 1.06 0.68 -0.68 3.60 0.00 -0.98 -0.74 119.26 122.19 1ajs h ALA 116 Ca 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ajs h ALA 116 Cb 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1ajs h ALA 116 CO -0.02 0.17 0.38 0.93 0.00 0.00 0.00 179.25 180.72 1ajs h GLU 117 N 0.71 0.95 0.12 0.00 4.39 -0.95 -1.24 114.58 118.57 1ajs h GLU 117 Ca 0.19 -0.11 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1ajs h GLU 117 Cb 0.01 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.47 1ajs h GLU 117 CO -0.03 0.71 -0.06 0.35 -1.16 0.00 0.00 179.01 178.81 1ajs h PHE 118 N 0.94 -0.15 -0.96 4.33 3.04 -0.82 -3.00 116.94 120.32 1ajs h PHE 118 Ca 0.24 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.23 1ajs h PHE 118 Cb 0.03 0.05 -0.06 0.00 2.56 0.00 0.00 35.95 38.53 1ajs h PHE 118 CO -0.01 -0.05 0.63 -0.07 -2.02 0.00 0.00 178.31 176.79 1ajs h LEU 119 N -0.22 1.03 -1.63 0.59 3.38 -0.86 -0.42 115.31 117.18 1ajs h LEU 119 Ca -0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ajs h LEU 119 Cb 0.18 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1ajs h LEU 119 CO 0.03 0.69 0.00 0.00 0.09 0.00 0.00 178.44 179.25 1ajs h ALA 120 N 1.45 1.00 0.00 1.53 0.00 -1.12 -2.03 119.26 120.09 1ajs h ALA 120 Ca 0.39 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 55.02 1ajs h ALA 120 Cb 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1ajs h ALA 120 CO -0.13 0.00 -2.04 0.54 0.00 0.00 0.00 179.25 177.62 1ajs n ARG 121 N -2.72 0.99 0.00 0.00 1.74 -0.66 -3.17 116.66 112.84 1ajs n ARG 121 Ca -0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 1ajs n ARG 121 Cb 0.18 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1ajs n ARG 121 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1ajs n TRP 122 N -2.82 0.00 -4.16 -1.55 7.02 -0.26 -0.82 117.44 114.85 1ajs n TRP 122 Ca -0.29 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 55.84 1ajs n TRP 122 Cb 0.91 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.71 1ajs n TRP 122 CO 0.00 0.00 0.00 -0.47 -2.02 0.00 0.00 177.69 175.20 1ajs s TYR 123 N -0.15 3.29 -1.34 -5.99 5.04 -0.77 -4.49 117.35 112.95 1ajs s TYR 123 Ca 0.00 0.24 -0.07 0.00 -2.44 0.00 0.00 57.07 54.80 1ajs s TYR 123 Cb 0.00 -1.90 0.02 0.00 0.35 0.00 0.00 41.96 40.43 1ajs s TYR 123 CO 0.00 0.46 1.09 -1.71 -1.34 0.00 0.00 175.55 174.04 1ajs n ASN 124 N 2.45 -4.80 0.00 4.32 4.05 -1.26 -4.55 115.26 115.46 1ajs n ASN 124 Ca -0.18 -0.61 0.00 0.00 0.45 0.00 0.00 54.58 54.24 1ajs n ASN 124 Cb 0.54 -4.85 0.00 0.00 1.23 0.00 0.00 39.78 36.70 1ajs n ASN 124 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1ajs n GLY 125 N -1.73 -0.40 3.51 8.20 0.00 -1.26 -4.75 105.19 108.76 1ajs n GLY 125 Ca -0.08 -2.23 -0.35 0.00 0.00 0.00 0.00 46.02 43.37 1ajs n GLY 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ajs s THR 126 N 0.00 4.26 -1.41 2.61 2.01 -1.26 -4.07 115.64 117.78 1ajs s THR 126 Ca 0.00 -0.21 -0.03 0.00 0.31 0.00 0.00 61.69 61.76 1ajs s THR 126 Cb 0.00 -2.93 0.02 0.00 0.01 0.00 0.00 72.50 69.61 1ajs s THR 126 CO 0.00 0.43 0.60 0.59 -0.69 0.00 0.00 174.62 175.56 1ajs n ASN 127 N 4.01 -1.34 -4.40 3.53 3.02 0.00 -4.92 115.26 115.16 1ajs n ASN 127 Ca -0.17 -0.92 -0.44 0.00 -0.03 0.00 0.00 54.58 53.02 1ajs n ASN 127 Cb 0.52 -3.45 -0.05 0.00 -0.61 0.00 0.00 39.78 36.19 1ajs n ASN 127 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1ajs s ASN 128 N -4.16 6.20 0.00 6.41 3.84 -1.19 -4.84 114.94 121.20 1ajs s ASN 128 Ca 0.14 -1.23 0.23 0.00 0.21 0.00 0.00 52.86 52.21 1ajs s ASN 128 Cb -0.07 -2.29 0.48 0.00 -0.55 0.00 0.00 41.25 38.82 1ajs s ASN 128 CO 0.86 -1.01 1.43 0.29 -2.79 0.00 0.00 177.10 175.88 1ajs n LYS 129 N 6.22 2.29 0.03 0.43 4.76 -1.26 -4.14 118.16 126.48 1ajs n LYS 129 Ca -0.08 -1.94 0.12 0.00 -2.87 0.00 0.00 58.31 53.53 1ajs n LYS 129 Cb 0.44 -1.48 0.15 0.00 -1.84 0.00 0.00 35.03 32.29 1ajs n LYS 129 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1ajs n ASP 130 N 1.18 0.62 -4.71 4.39 8.00 -1.26 -1.95 116.55 122.81 1ajs n ASP 130 Ca 0.18 -0.12 -0.42 0.00 0.71 0.00 0.00 54.79 55.14 1ajs n ASP 130 Cb 0.54 0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 42.00 1ajs n ASP 130 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1ajs s THR 131 N -3.12 2.99 0.45 -3.53 -1.32 -1.26 -4.75 115.64 105.11 1ajs s THR 131 Ca 0.07 0.70 -0.25 0.00 -1.21 0.00 0.00 61.69 61.00 1ajs s THR 131 Cb 0.15 -3.45 -0.08 0.00 -1.51 0.00 0.00 72.50 67.61 1ajs s THR 131 CO 0.74 0.05 1.41 -2.84 -2.21 0.00 0.00 174.62 171.77 1ajs s PRO 132 N 1.22 3.67 -0.15 7.08 0.02 -1.26 -4.69 135.00 140.90 1ajs s PRO 132 Ca 0.67 2.38 0.00 0.00 0.02 0.00 0.00 61.00 64.08 1ajs s PRO 132 Cb -0.40 -2.64 -0.00 0.00 0.02 0.00 0.00 34.50 31.48 1ajs s PRO 132 CO 0.31 -0.81 -0.16 0.08 -0.33 0.00 0.00 177.00 176.09 1ajs s VAL 133 N -1.22 2.65 -0.14 3.83 1.01 -0.27 -1.43 120.40 124.83 1ajs s VAL 133 Ca 0.61 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 1ajs s VAL 133 Cb -0.43 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 1ajs s VAL 133 CO 0.55 0.52 -0.06 -0.31 0.00 0.00 0.00 175.10 175.79 1ajs s TYR 134 N 0.77 2.97 0.22 5.22 1.51 0.11 0.84 117.35 128.98 1ajs s TYR 134 Ca -0.06 -0.33 0.10 0.00 -1.01 0.00 0.00 57.07 55.78 1ajs s TYR 134 Cb -0.15 -1.90 -0.05 0.00 -0.11 0.00 0.00 41.96 39.75 1ajs s TYR 134 CO 0.01 -0.02 -0.20 0.14 -1.11 0.00 0.00 175.55 174.37 1ajs s VAL 135 N 0.19 2.18 0.67 0.71 -7.23 -0.13 -0.70 120.40 116.08 1ajs s VAL 135 Ca -0.03 -2.16 -0.13 0.00 -1.81 0.00 0.00 61.98 57.85 1ajs s VAL 135 Cb -0.14 -2.11 -0.00 0.00 0.56 0.00 0.00 36.38 34.69 1ajs s VAL 135 CO 0.03 -0.33 1.07 -0.94 -0.31 0.00 0.00 175.10 174.62 1ajs s SER 136 N -3.05 5.36 -0.37 4.85 1.04 -1.26 -0.73 113.70 119.53 1ajs s SER 136 Ca 0.23 1.75 -0.01 0.00 0.48 0.00 0.00 55.95 58.40 1ajs s SER 136 Cb -0.05 -2.52 0.09 0.00 0.10 0.00 0.00 66.02 63.64 1ajs s SER 136 CO 0.10 -1.46 0.12 -0.55 0.98 0.00 0.00 173.24 172.44 1ajs s SER 137 N -3.27 5.06 0.80 7.02 0.15 -0.77 -2.85 113.70 119.84 1ajs s SER 137 Ca 0.61 -1.89 -0.04 0.00 0.70 0.00 0.00 55.95 55.33 1ajs s SER 137 Cb -0.16 -1.76 0.16 0.00 -1.71 0.00 0.00 66.02 62.56 1ajs s SER 137 CO 0.48 -0.44 1.08 -0.81 1.20 0.00 0.00 173.24 174.75 1ajs n PRO 138 N 4.52 -0.40 -4.06 5.44 -0.04 -1.26 -2.43 135.00 136.77 1ajs n PRO 138 Ca -0.03 -2.57 -0.14 0.00 -0.04 0.00 0.00 63.50 60.72 1ajs n PRO 138 Cb 0.42 -0.83 -0.03 0.00 -0.04 0.00 0.00 33.50 33.01 1ajs n PRO 138 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1ajs s THR 139 N -3.29 0.00 -0.07 0.52 -1.32 -1.13 -4.63 115.64 105.71 1ajs s THR 139 Ca 0.69 -1.54 -0.30 0.00 -1.21 0.00 0.00 61.69 59.32 1ajs s THR 139 Cb -0.03 -2.67 -0.04 0.00 -1.51 0.00 0.00 72.50 68.25 1ajs s THR 139 CO 0.46 0.00 1.48 0.86 -2.21 0.00 0.00 174.62 175.21 1ajs s TRP 140 N -2.96 2.43 0.41 9.09 -0.00 -1.16 -4.65 118.94 122.09 1ajs s TRP 140 Ca 0.29 0.57 0.21 0.00 -0.00 0.00 0.00 56.10 57.17 1ajs s TRP 140 Cb -0.01 -3.74 1.18 0.00 -0.00 0.00 0.00 33.47 30.91 1ajs s TRP 140 CO 0.20 -2.92 1.74 1.05 -0.00 0.00 0.00 176.95 177.02 1ajs h GLU 141 N 8.76 0.30 0.00 5.86 -0.00 -2.00 -0.24 114.58 127.27 1ajs h GLU 141 Ca -0.35 -0.02 0.00 0.00 -0.00 0.00 0.00 59.36 58.99 1ajs h GLU 141 Cb 1.16 -0.07 0.00 0.00 -0.00 0.00 0.00 28.75 29.84 1ajs h GLU 141 CO 0.95 0.20 0.00 -0.97 -0.00 0.00 0.00 179.01 179.19 1ajs h ASN 142 N 0.31 0.00 -0.20 3.06 -1.24 -2.00 -2.32 115.58 113.20 1ajs h ASN 142 Ca 0.64 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.67 1ajs h ASN 142 Cb 1.76 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.79 1ajs h ASN 142 CO -0.32 0.00 0.08 0.45 -1.29 0.00 0.00 177.43 176.35 1ajs h HIS 143 N 0.00 0.15 -0.13 0.67 3.86 -1.42 -0.88 115.15 117.41 1ajs h HIS 143 Ca 0.00 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1ajs h HIS 143 Cb 0.24 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 1ajs h HIS 143 CO 0.00 0.08 0.08 -0.91 0.86 0.00 0.00 177.93 178.04 1ajs h ASN 144 N 0.19 0.16 -0.24 2.45 4.21 -1.62 -2.63 115.58 118.09 1ajs h ASN 144 Ca 0.08 -0.04 0.04 0.00 1.21 0.00 0.00 56.30 57.59 1ajs h ASN 144 Cb 0.03 -0.04 -0.04 0.00 -1.12 0.00 0.00 38.32 37.16 1ajs h ASN 144 CO -0.07 0.15 0.01 1.23 -1.29 0.00 0.00 177.43 177.46 1ajs h GLY 145 N 0.15 0.24 0.90 2.83 0.00 -1.43 0.14 103.07 105.91 1ajs h GLY 145 Ca 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 1ajs h GLY 145 CO -0.01 -0.04 0.08 -2.08 0.00 0.00 0.00 176.54 174.49 1ajs h VAL 146 N 0.08 1.14 -0.25 4.60 2.07 -1.08 -1.51 116.25 121.30 1ajs h VAL 146 Ca 0.11 -0.41 -0.12 0.00 0.82 0.00 0.00 66.70 67.11 1ajs h VAL 146 Cb 0.14 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1ajs h VAL 146 CO -0.19 0.13 -0.33 -0.26 0.02 0.00 0.00 177.57 176.94 1ajs h PHE 147 N 0.14 0.63 -0.35 1.57 -1.00 -1.28 -2.02 116.94 114.63 1ajs h PHE 147 Ca 0.06 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.66 1ajs h PHE 147 Cb 0.14 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1ajs h PHE 147 CO -0.02 0.81 0.15 1.15 -1.61 0.00 0.00 178.31 178.79 1ajs h THR 148 N 0.46 1.18 -0.26 -1.55 2.02 -0.62 -2.81 112.91 111.32 1ajs h THR 148 Ca 0.05 -0.55 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 1ajs h THR 148 Cb 0.80 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1ajs h THR 148 CO 0.07 0.20 -0.03 0.74 0.37 0.00 0.00 175.52 176.86 1ajs h THR 149 N 0.42 1.18 0.00 3.16 2.02 -1.09 -1.28 112.91 117.31 1ajs h THR 149 Ca 0.12 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1ajs h THR 149 Cb 0.17 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 1ajs h THR 149 CO -0.01 0.24 0.00 0.00 0.37 0.00 0.00 175.52 176.12 1ajs n ALA 150 N -2.48 1.72 0.00 6.16 0.00 -0.77 -4.90 120.51 120.23 1ajs n ALA 150 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ajs n ALA 150 Cb 0.23 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1ajs n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ajs n GLY 151 N 0.13 0.80 3.68 0.00 0.00 -0.48 -4.86 105.19 104.46 1ajs n GLY 151 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1ajs n GLY 151 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ajs s PHE 152 N -2.00 2.17 -0.19 1.61 0.08 -1.08 -4.83 117.98 113.74 1ajs s PHE 152 Ca 0.00 0.13 0.18 0.00 0.12 0.00 0.00 56.93 57.36 1ajs s PHE 152 Cb 0.00 -4.04 -0.02 0.00 -0.57 0.00 0.00 43.02 38.39 1ajs s PHE 152 CO 0.00 -4.30 1.09 0.87 -0.10 0.00 0.00 175.22 172.78 1ajs h LYS 153 N 8.80 0.00 -3.42 0.44 1.57 -1.72 -3.41 116.57 118.84 1ajs h LYS 153 Ca -0.44 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.71 1ajs h LYS 153 Cb 1.21 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.11 1ajs h LYS 153 CO 0.94 0.24 -0.65 0.34 -0.57 0.00 0.00 179.45 179.75 1ajs s ASP 154 N -5.87 4.24 -0.25 0.86 -1.08 -1.26 -5.07 116.67 108.24 1ajs s ASP 154 Ca 0.00 -2.88 -0.08 0.00 -0.52 0.00 0.00 52.55 49.07 1ajs s ASP 154 Cb 0.08 -1.54 -0.03 0.00 -1.46 0.00 0.00 42.92 39.97 1ajs s ASP 154 CO 0.78 -0.25 0.09 -0.63 0.52 0.00 0.00 175.17 175.68 1ajs s ILE 155 N -0.09 4.58 0.42 4.11 1.01 -1.26 -1.12 121.20 128.85 1ajs s ILE 155 Ca 0.17 -0.08 0.07 0.00 0.00 0.00 0.00 60.65 60.80 1ajs s ILE 155 Cb -0.25 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.02 1ajs s ILE 155 CO -0.01 0.34 0.13 -0.13 0.00 0.00 0.00 174.94 175.27 1ajs s ARG 156 N 1.46 2.14 0.06 2.79 0.52 0.25 -4.96 118.95 121.21 1ajs s ARG 156 Ca 0.06 -1.95 0.09 0.00 -0.52 0.00 0.00 55.73 53.41 1ajs s ARG 156 Cb -0.15 -1.86 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 1ajs s ARG 156 CO 0.05 -0.11 -0.23 -1.12 0.02 0.00 0.00 175.30 173.91 1ajs s SER 157 N -3.85 3.48 -0.02 0.23 0.01 -1.26 -0.96 113.70 111.34 1ajs s SER 157 Ca 0.38 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 57.13 1ajs s SER 157 Cb 0.06 -0.42 -0.03 0.00 0.21 0.00 0.00 66.02 65.83 1ajs s SER 157 CO 0.21 0.24 -0.10 -0.72 0.41 0.00 0.00 173.24 173.28 1ajs s TYR 158 N -0.90 2.82 0.45 2.43 -0.85 0.09 -4.87 117.35 116.51 1ajs s TYR 158 Ca 0.14 -0.08 -0.25 0.00 -0.52 0.00 0.00 57.07 56.35 1ajs s TYR 158 Cb -0.10 -1.61 -0.08 0.00 0.38 0.00 0.00 41.96 40.54 1ajs s TYR 158 CO 0.04 0.31 1.40 1.03 -1.52 0.00 0.00 175.55 176.82 1ajs s ARG 159 N -1.16 3.71 0.16 -3.49 0.52 -1.26 -1.85 118.95 115.58 1ajs s ARG 159 Ca 0.15 2.36 0.00 0.00 -0.52 0.00 0.00 55.73 57.72 1ajs s ARG 159 Cb -0.11 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.71 1ajs s ARG 159 CO 0.05 -0.78 0.00 0.98 0.02 0.00 0.00 175.30 175.57 1ajs n TYR 160 N -0.18 -1.81 -3.69 -0.53 9.36 -1.22 -3.58 117.16 115.52 1ajs n TYR 160 Ca 0.05 0.36 -0.37 0.00 3.32 0.00 0.00 57.90 61.26 1ajs n TYR 160 Cb 0.42 0.96 -0.06 0.00 -0.63 0.00 0.00 39.34 40.03 1ajs n TYR 160 CO 0.00 0.00 0.00 -0.46 0.22 0.00 0.00 176.86 176.62 1ajs s TRP 161 N -2.00 3.63 -0.40 2.98 -0.11 -1.02 0.63 118.94 122.64 1ajs s TRP 161 Ca 0.00 0.71 -0.09 0.00 1.22 0.00 0.00 56.10 57.94 1ajs s TRP 161 Cb 0.00 -2.13 0.07 0.00 -1.50 0.00 0.00 33.47 29.91 1ajs s TRP 161 CO 0.00 0.63 0.23 0.34 -4.62 0.00 0.00 176.95 173.53 1ajs s ASP 162 N -0.83 5.60 0.50 5.86 -1.08 0.25 -4.74 116.67 122.24 1ajs s ASP 162 Ca 0.18 -1.39 0.15 0.00 -0.52 0.00 0.00 52.55 50.97 1ajs s ASP 162 Cb -0.14 -1.97 1.20 0.00 -1.46 0.00 0.00 42.92 40.55 1ajs s ASP 162 CO 0.07 -0.49 2.13 0.71 0.52 0.00 0.00 175.17 178.12 1ajs h THR 163 N 6.06 1.01 0.26 1.71 1.35 -1.96 0.80 112.91 122.15 1ajs h THR 163 Ca -0.23 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.58 1ajs h THR 163 Cb 1.08 0.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1ajs h THR 163 CO 0.72 0.02 -0.13 -0.33 -0.25 0.00 0.00 175.52 175.55 1ajs h GLU 164 N 0.09 -0.34 0.00 4.72 4.39 -1.94 -3.26 114.58 118.24 1ajs h GLU 164 Ca 0.03 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1ajs h GLU 164 Cb 0.01 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1ajs h GLU 164 CO -0.01 -0.23 0.00 1.63 -1.16 0.00 0.00 179.01 179.25 1ajs n LYS 165 N -4.14 0.11 -3.56 2.33 4.76 -1.18 -4.88 118.16 111.60 1ajs n LYS 165 Ca -0.04 0.27 -0.21 0.00 -2.87 0.00 0.00 58.31 55.46 1ajs n LYS 165 Cb 0.14 -1.69 0.05 0.00 -1.84 0.00 0.00 35.03 31.70 1ajs n LYS 165 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1ajs n ARG 166 N -1.89 -4.17 -1.13 1.97 1.74 0.27 -4.95 116.66 108.51 1ajs n ARG 166 Ca 0.04 0.69 -0.00 0.00 -0.77 0.00 0.00 57.85 57.81 1ajs n ARG 166 Cb 0.26 -5.28 0.00 0.00 -1.02 0.00 0.00 32.46 26.42 1ajs n ARG 166 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ajs n GLY 167 N -1.44 1.79 3.70 -0.13 0.00 -0.78 -4.96 105.19 103.37 1ajs n GLY 167 Ca -0.22 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 1ajs n GLY 167 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ajs s LEU 168 N 0.00 4.34 -1.22 0.99 2.96 -1.26 0.88 118.68 125.37 1ajs s LEU 168 Ca 0.00 2.08 -0.12 0.00 -0.22 0.00 0.00 54.13 55.87 1ajs s LEU 168 Cb -0.00 -3.57 0.18 0.00 0.50 0.00 0.00 46.19 43.30 1ajs s LEU 168 CO 0.00 -0.60 1.50 -0.67 -1.32 0.00 0.00 176.35 175.26 1ajs n ASP 169 N 4.55 5.25 -0.30 3.68 2.03 0.20 -4.79 116.55 127.17 1ajs n ASP 169 Ca 0.11 -3.02 0.01 0.00 0.52 0.00 0.00 54.79 52.41 1ajs n ASP 169 Cb 0.45 -1.53 0.20 0.00 -0.72 0.00 0.00 41.12 39.51 1ajs n ASP 169 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1ajs h LEU 170 N 9.06 0.98 -0.49 -2.67 5.85 -1.93 -1.21 115.31 124.89 1ajs h LEU 170 Ca 0.32 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 1ajs h LEU 170 Cb 0.82 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1ajs h LEU 170 CO 1.30 0.69 0.20 1.56 -0.34 0.00 0.00 178.44 181.86 1ajs h GLN 171 N 1.14 0.74 -0.46 1.25 1.08 -1.97 0.43 115.11 117.32 1ajs h GLN 171 Ca 0.34 -0.13 -0.06 0.00 -1.45 0.00 0.00 58.65 57.35 1ajs h GLN 171 Cb -0.05 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 27.24 1ajs h GLN 171 CO -0.09 0.65 0.05 0.78 -0.95 0.00 0.00 178.83 179.27 1ajs h GLY 172 N 0.66 0.83 0.79 3.46 0.00 -1.81 -1.28 103.07 105.72 1ajs h GLY 172 Ca 0.17 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1ajs h GLY 172 CO -0.01 0.53 -0.32 -2.75 0.00 0.00 0.00 176.54 173.98 1ajs h PHE 173 N 0.63 -0.85 -0.75 5.60 3.04 -0.93 -1.04 116.94 122.64 1ajs h PHE 173 Ca 0.14 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.15 1ajs h PHE 173 Cb 0.42 0.31 -0.06 0.00 2.56 0.00 0.00 35.95 39.18 1ajs h PHE 173 CO 0.03 -0.48 0.43 -0.07 -2.02 0.00 0.00 178.31 176.20 1ajs h LEU 174 N -0.76 0.64 -0.96 0.59 3.38 -0.86 -1.35 115.31 115.99 1ajs h LEU 174 Ca -0.05 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1ajs h LEU 174 Cb 0.64 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 1ajs h LEU 174 CO 0.02 0.40 0.38 -1.28 0.09 0.00 0.00 178.44 178.05 1ajs h SER 175 N 0.77 1.01 -0.41 -0.43 0.87 -0.93 0.06 113.55 114.50 1ajs h SER 175 Ca 0.34 -0.11 -0.07 0.00 -1.23 0.00 0.00 61.79 60.71 1ajs h SER 175 Cb 0.23 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 1ajs h SER 175 CO -0.20 0.85 0.01 0.44 -0.53 0.00 0.00 176.83 177.41 1ajs h ASP 176 N 1.11 0.76 -0.35 6.23 3.32 -0.58 -0.50 116.42 126.42 1ajs h ASP 176 Ca 0.27 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 1ajs h ASP 176 Cb 0.10 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1ajs h ASP 176 CO -0.04 0.82 -0.13 -0.07 -1.72 0.00 0.00 179.24 178.11 1ajs h LEU 177 N 0.74 0.71 -1.22 1.55 3.38 -0.79 -2.22 115.31 117.46 1ajs h LEU 177 Ca 0.15 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 1ajs h LEU 177 Cb 0.43 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1ajs h LEU 177 CO 0.02 0.93 -0.06 -0.33 0.09 0.00 0.00 178.44 179.09 1ajs h GLU 178 N 0.48 0.46 0.00 1.13 4.39 -0.38 -2.70 114.58 117.96 1ajs h GLU 178 Ca 0.08 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1ajs h GLU 178 Cb 0.65 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1ajs h GLU 178 CO 0.04 0.54 -0.22 0.09 -1.16 0.00 0.00 179.01 178.31 1ajs n ASN 179 N -4.25 0.25 -4.76 1.42 3.02 -0.25 -4.90 115.26 105.78 1ajs n ASN 179 Ca 0.01 0.20 -0.41 0.00 -0.03 0.00 0.00 54.58 54.35 1ajs n ASN 179 Cb 0.27 -0.20 -0.04 0.00 -0.61 0.00 0.00 39.78 39.21 1ajs n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ajs s ALA 180 N -3.01 3.43 0.50 5.41 0.00 -0.84 -4.99 121.76 122.25 1ajs s ALA 180 Ca 0.12 0.97 -0.23 0.00 0.00 0.00 0.00 51.96 52.83 1ajs s ALA 180 Cb 0.18 -3.37 -0.07 0.00 0.00 0.00 0.00 23.12 19.85 1ajs s ALA 180 CO 0.61 -0.29 1.20 -2.30 0.00 0.00 0.00 175.76 174.98 1ajs n PRO 181 N 1.39 1.57 -1.69 0.00 -0.02 -1.26 -4.89 135.00 130.10 1ajs n PRO 181 Ca 0.00 0.57 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 1ajs n PRO 181 Cb 0.44 -2.35 0.02 0.00 -0.02 0.00 0.00 33.50 31.59 1ajs n PRO 181 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ajs n GLU 182 N -0.47 1.77 -0.94 -0.52 1.02 -1.26 -1.91 120.64 118.33 1ajs n GLU 182 Ca 0.10 0.64 0.00 0.00 -0.02 0.00 0.00 57.16 57.87 1ajs n GLU 182 Cb 0.43 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.50 1ajs n GLU 182 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ajs n PHE 183 N -0.41 0.00 -1.32 -0.32 3.72 -0.70 -5.01 117.46 113.42 1ajs n PHE 183 Ca 0.08 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.13 1ajs n PHE 183 Cb 0.40 -0.00 0.10 0.00 -0.94 0.00 0.00 39.48 39.04 1ajs n PHE 183 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ajs n SER 184 N 0.00 0.84 -4.72 4.37 7.64 -0.80 -4.51 113.62 116.45 1ajs n SER 184 Ca 0.00 0.66 -0.36 0.00 1.01 0.00 0.00 58.87 60.18 1ajs n SER 184 Cb 0.00 -1.46 -0.08 0.00 -1.01 0.00 0.00 64.21 61.66 1ajs n SER 184 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ajs s ILE 185 N -1.86 5.38 -0.22 0.44 1.01 -0.51 -0.89 121.20 124.55 1ajs s ILE 185 Ca 0.74 0.24 -0.04 0.00 0.00 0.00 0.00 60.65 61.60 1ajs s ILE 185 Cb -0.33 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 1ajs s ILE 185 CO 0.49 0.41 -0.03 -0.36 0.00 0.00 0.00 174.94 175.45 1ajs s PHE 186 N 0.53 2.97 -0.44 3.97 0.40 -0.11 0.04 117.98 125.34 1ajs s PHE 186 Ca 0.09 -0.89 -0.22 0.00 -0.60 0.00 0.00 56.93 55.31 1ajs s PHE 186 Cb -0.12 -2.11 0.02 0.00 0.51 0.00 0.00 43.02 41.32 1ajs s PHE 186 CO 0.00 -0.53 0.74 0.08 0.70 0.00 0.00 175.22 176.22 1ajs s VAL 187 N 1.48 4.70 -0.08 -0.44 1.01 0.13 -0.24 120.40 126.95 1ajs s VAL 187 Ca 0.06 0.37 -0.00 0.00 0.00 0.00 0.00 61.98 62.41 1ajs s VAL 187 Cb -0.14 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1ajs s VAL 187 CO -0.03 -0.66 -0.05 -0.76 0.00 0.00 0.00 175.10 173.60 1ajs s LEU 188 N 3.15 3.25 -0.20 3.92 1.43 -0.31 -4.38 118.68 125.53 1ajs s LEU 188 Ca 0.28 -0.01 -0.24 0.00 -1.03 0.00 0.00 54.13 53.13 1ajs s LEU 188 Cb -0.13 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1ajs s LEU 188 CO 0.21 0.33 0.80 -1.00 0.23 0.00 0.00 176.35 176.92 1ajs s HIS 189 N -0.64 3.37 0.26 0.29 3.76 -1.26 0.04 115.29 121.11 1ajs s HIS 189 Ca 0.10 1.15 -0.05 0.00 -0.15 0.00 0.00 55.06 56.11 1ajs s HIS 189 Cb -0.12 -2.99 0.29 0.00 1.11 0.00 0.00 32.58 30.87 1ajs s HIS 189 CO 0.02 -0.30 1.90 0.00 -0.85 0.00 0.00 174.74 175.51 1ajs h ALA 190 N 7.51 1.26 -2.06 -1.40 0.00 -1.61 -3.46 119.26 119.49 1ajs h ALA 190 Ca -0.27 -0.10 0.19 0.00 0.00 0.00 0.00 54.91 54.73 1ajs h ALA 190 Cb 1.12 -0.36 -0.12 0.00 0.00 0.00 0.00 17.79 18.43 1ajs h ALA 190 CO 0.84 0.63 0.59 0.00 0.00 0.00 0.00 179.25 181.31 1ajs n ALA 192 N -0.35 -2.47 -1.57 0.00 0.00 -1.26 -4.70 120.51 110.16 1ajs n ALA 192 Ca -0.07 -0.22 -0.49 0.00 0.00 0.00 0.00 53.44 52.67 1ajs n ALA 192 Cb 0.61 -3.88 -0.04 0.00 0.00 0.00 0.00 19.45 16.14 1ajs n ALA 192 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1ajs n HIS 193 N -4.15 1.27 -3.93 0.00 -0.00 -1.26 -4.79 115.22 102.35 1ajs n HIS 193 Ca -0.12 0.69 -0.35 0.00 0.46 0.00 0.00 57.72 58.40 1ajs n HIS 193 Cb 0.61 -2.27 -0.14 0.00 -0.12 0.00 0.00 29.99 28.06 1ajs n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1ajs s ASN 194 N 0.02 4.27 0.00 0.26 2.47 -1.26 -0.26 114.94 120.44 1ajs s ASN 194 Ca 0.74 -0.58 0.22 0.00 0.42 0.00 0.00 52.86 53.66 1ajs s ASN 194 Cb -0.87 -1.71 0.18 0.00 -1.45 0.00 0.00 41.25 37.40 1ajs s ASN 194 CO 0.52 -0.07 1.21 -0.81 -3.72 0.00 0.00 177.10 174.23 1ajs n PRO 195 N 4.75 2.10 0.24 0.43 -0.04 -1.26 -2.99 135.00 138.23 1ajs n PRO 195 Ca -0.18 -1.84 0.14 0.00 -0.04 0.00 0.00 63.50 61.59 1ajs n PRO 195 Cb 0.49 -1.43 0.38 0.00 -0.04 0.00 0.00 33.50 32.91 1ajs n PRO 195 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1ajs h THR 196 N 4.37 0.00 -1.15 0.52 1.35 -1.90 -3.36 112.91 112.74 1ajs h THR 196 Ca 0.00 -0.79 -0.36 0.00 -0.55 0.00 0.00 66.41 64.71 1ajs h THR 196 Cb 0.93 1.79 -0.12 0.00 -1.73 0.00 0.00 68.15 69.02 1ajs h THR 196 CO 0.00 0.00 -0.35 0.61 -0.25 0.00 0.00 175.52 175.53 1ajs n GLY 197 N 0.67 1.37 3.11 5.82 0.00 0.64 -4.47 105.19 112.34 1ajs n GLY 197 Ca 0.03 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 1ajs n GLY 197 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ajs s THR 198 N -2.70 2.00 0.21 2.61 2.01 -1.26 -1.00 115.64 117.51 1ajs s THR 198 Ca 0.00 -0.91 0.10 0.00 0.31 0.00 0.00 61.69 61.20 1ajs s THR 198 Cb 0.00 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 1ajs s THR 198 CO 0.00 0.53 -0.14 -1.81 -0.69 0.00 0.00 174.62 172.51 1ajs s ASP 199 N 1.27 3.95 0.63 3.53 1.01 -1.26 -4.51 116.67 121.29 1ajs s ASP 199 Ca 0.04 -0.74 -0.16 0.00 0.71 0.00 0.00 52.55 52.40 1ajs s ASP 199 Cb -0.13 -0.54 -0.01 0.00 1.01 0.00 0.00 42.92 43.25 1ajs s ASP 199 CO -0.12 0.09 1.13 -2.84 0.21 0.00 0.00 175.17 173.64 1ajs s PRO 200 N -2.99 2.89 0.74 8.23 0.02 -1.26 -5.02 135.00 137.62 1ajs s PRO 200 Ca 0.25 1.51 -0.11 0.00 0.02 0.00 0.00 61.00 62.67 1ajs s PRO 200 Cb -0.08 -1.95 0.05 0.00 0.02 0.00 0.00 34.50 32.54 1ajs s PRO 200 CO 0.14 -1.20 1.11 0.95 -0.33 0.00 0.00 177.00 177.67 1ajs s THR 201 N -2.12 2.75 0.28 0.99 -4.23 -1.26 -4.80 115.64 107.25 1ajs s THR 201 Ca 0.70 0.16 0.01 0.00 -1.18 0.00 0.00 61.69 61.38 1ajs s THR 201 Cb -0.23 -3.22 0.26 0.00 1.34 0.00 0.00 72.50 70.65 1ajs s THR 201 CO 0.38 -0.28 1.76 -0.65 -0.54 0.00 0.00 174.62 175.29 1ajs h PRO 202 N -0.78 0.64 -0.60 3.99 0.11 -1.99 0.17 132.00 133.55 1ajs h PRO 202 Ca -0.45 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1ajs h PRO 202 Cb 1.29 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1ajs h PRO 202 CO 0.64 0.43 0.08 1.49 -0.21 0.00 0.00 178.00 180.43 1ajs h GLU 203 N 0.66 0.99 -0.29 1.05 4.81 -2.00 -1.04 114.58 118.77 1ajs h GLU 203 Ca 0.50 -0.26 -0.15 0.00 -0.13 0.00 0.00 59.36 59.33 1ajs h GLU 203 Cb 0.74 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1ajs h GLU 203 CO -0.37 0.92 -0.42 1.96 -0.73 0.00 0.00 179.01 180.37 1ajs h GLN 204 N 0.93 0.71 -0.74 1.92 4.20 -1.40 -2.74 115.11 117.99 1ajs h GLN 204 Ca 0.18 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.51 1ajs h GLN 204 Cb 0.43 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.19 1ajs h GLN 204 CO 0.01 0.99 0.45 -1.49 -0.67 0.00 0.00 178.83 178.13 1ajs h TRP 205 N 0.57 0.96 -0.26 2.96 4.06 -0.30 -0.71 115.95 123.23 1ajs h TRP 205 Ca 0.04 0.01 -0.05 0.00 2.06 0.00 0.00 58.89 60.95 1ajs h TRP 205 Cb 0.97 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 28.79 1ajs h TRP 205 CO 0.05 0.63 -0.04 0.87 -3.56 0.00 0.00 178.44 176.39 1ajs h LYS 206 N 1.01 0.40 -0.28 0.49 1.57 -0.92 0.83 116.57 119.68 1ajs h LYS 206 Ca 0.27 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.82 1ajs h LYS 206 Cb -0.05 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1ajs h LYS 206 CO -0.05 0.46 -0.39 1.96 -0.57 0.00 0.00 179.45 180.86 1ajs h GLN 207 N 0.39 0.76 -0.23 3.15 4.20 -0.93 -1.84 115.11 120.60 1ajs h GLN 207 Ca 0.08 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1ajs h GLN 207 Cb 0.32 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1ajs h GLN 207 CO 0.01 1.07 0.15 0.82 -0.67 0.00 0.00 178.83 180.21 1ajs h ILE 208 N 0.50 1.07 -0.98 2.54 2.04 -0.78 -2.76 117.51 119.14 1ajs h ILE 208 Ca 0.03 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1ajs h ILE 208 Cb 0.99 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 1ajs h ILE 208 CO 0.09 0.07 0.65 0.00 0.00 0.00 0.00 178.15 178.95 1ajs h ALA 209 N 1.07 1.34 -0.58 1.87 0.00 -0.79 -2.13 119.26 120.04 1ajs h ALA 209 Ca 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1ajs h ALA 209 Cb -0.02 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.37 1ajs h ALA 209 CO -0.02 0.58 0.36 1.03 0.00 0.00 0.00 179.25 181.20 1ajs h SER 210 N 1.27 0.59 -0.30 0.00 0.87 -1.05 0.00 113.55 114.94 1ajs h SER 210 Ca 0.38 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.84 1ajs h SER 210 Cb -0.06 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1ajs h SER 210 CO -0.10 0.42 -0.18 0.58 -0.53 0.00 0.00 176.83 177.01 1ajs h VAL 211 N 0.71 1.30 -0.69 2.23 2.07 -1.31 -2.30 116.25 118.26 1ajs h VAL 211 Ca 0.23 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.48 1ajs h VAL 211 Cb 0.00 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 1ajs h VAL 211 CO -0.09 0.42 0.43 0.24 0.02 0.00 0.00 177.57 178.59 1ajs h MET 212 N 0.40 0.82 -0.30 1.57 2.86 -1.14 -0.12 114.93 119.02 1ajs h MET 212 Ca 0.06 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1ajs h MET 212 Cb 0.72 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1ajs h MET 212 CO 0.05 0.54 0.12 -0.22 1.06 0.00 0.00 176.91 178.47 1ajs h LYS 213 N 0.85 0.45 -0.35 1.72 3.64 -0.95 0.44 116.57 122.37 1ajs h LYS 213 Ca 0.28 -0.08 0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1ajs h LYS 213 Cb 0.02 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1ajs h LYS 213 CO -0.11 0.47 0.17 -0.09 -2.27 0.00 0.00 179.45 177.61 1ajs h ARG 214 N 0.34 0.34 -0.62 1.90 2.43 -0.95 -3.06 114.38 114.76 1ajs h ARG 214 Ca 0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1ajs h ARG 214 Cb 0.18 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1ajs h ARG 214 CO -0.01 0.22 0.00 0.54 -1.51 0.00 0.00 179.97 179.21 1ajs n ARG 215 N -4.95 2.86 -3.74 0.20 1.74 -0.10 -4.95 116.66 107.72 1ajs n ARG 215 Ca 0.01 -2.29 -0.24 0.00 -0.77 0.00 0.00 57.85 54.55 1ajs n ARG 215 Cb 0.09 -1.64 0.04 0.00 -1.02 0.00 0.00 32.46 29.94 1ajs n ARG 215 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1ajs n PHE 216 N 1.09 -2.20 -3.00 -1.55 3.72 -0.48 -3.04 117.46 112.00 1ajs n PHE 216 Ca 0.21 0.90 -0.40 0.00 -0.05 0.00 0.00 57.45 58.11 1ajs n PHE 216 Cb 0.64 -4.40 -0.06 0.00 -0.94 0.00 0.00 39.48 34.73 1ajs n PHE 216 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1ajs s LEU 217 N -6.95 4.53 -0.21 4.37 1.43 0.02 -1.72 118.68 120.15 1ajs s LEU 217 Ca 0.31 1.54 -0.20 0.00 -1.03 0.00 0.00 54.13 54.75 1ajs s LEU 217 Cb -0.15 -3.25 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 1ajs s LEU 217 CO 0.80 0.13 0.60 0.12 0.23 0.00 0.00 176.35 178.23 1ajs s PHE 218 N -0.67 3.35 -0.24 0.29 5.36 -0.07 -4.77 117.98 121.24 1ajs s PHE 218 Ca 0.37 0.85 -0.27 0.00 -0.96 0.00 0.00 56.93 56.92 1ajs s PHE 218 Cb -0.22 -2.77 0.00 0.00 -0.34 0.00 0.00 43.02 39.69 1ajs s PHE 218 CO 0.24 -0.19 0.95 -1.25 -1.46 0.00 0.00 175.22 173.51 1ajs s PRO 219 N 1.98 4.22 -0.49 10.12 0.05 -1.26 -0.93 135.00 148.69 1ajs s PRO 219 Ca 0.27 1.17 -0.03 0.00 0.05 0.00 0.00 61.00 62.46 1ajs s PRO 219 Cb -0.16 -3.65 0.13 0.00 0.05 0.00 0.00 34.50 30.88 1ajs s PRO 219 CO 0.10 -0.59 0.30 0.12 0.05 0.00 0.00 177.00 176.97 1ajs s PHE 220 N 3.06 3.51 0.27 0.56 2.19 0.67 -2.59 117.98 125.65 1ajs s PHE 220 Ca 0.40 -2.52 -0.29 0.00 0.33 0.00 0.00 56.93 54.85 1ajs s PHE 220 Cb -0.15 -3.22 -0.09 0.00 -1.31 0.00 0.00 43.02 38.25 1ajs s PHE 220 CO 0.07 -0.92 0.96 -0.06 1.83 0.00 0.00 175.22 177.10 1ajs s PHE 221 N 0.68 3.85 -0.31 10.12 0.08 0.21 -1.16 117.98 131.46 1ajs s PHE 221 Ca 0.11 1.85 -0.02 0.00 0.12 0.00 0.00 56.93 58.99 1ajs s PHE 221 Cb -0.22 -3.00 0.05 0.00 -0.57 0.00 0.00 43.02 39.28 1ajs s PHE 221 CO -0.04 0.25 0.02 0.34 -0.10 0.00 0.00 175.22 175.70 1ajs s ASP 222 N -1.27 4.97 -0.85 1.36 -1.08 0.11 -0.37 116.67 119.53 1ajs s ASP 222 Ca 0.44 -1.27 0.00 0.00 -0.52 0.00 0.00 52.55 51.20 1ajs s ASP 222 Cb -0.25 -1.74 0.21 0.00 -1.46 0.00 0.00 42.92 39.69 1ajs s ASP 222 CO 0.31 -0.28 0.73 -0.24 0.52 0.00 0.00 175.17 176.21 1ajs n SER 223 N 4.65 3.96 0.06 -0.34 2.88 0.53 -1.40 113.62 123.96 1ajs n SER 223 Ca -0.13 -3.18 0.11 0.00 -1.33 0.00 0.00 58.87 54.35 1ajs n SER 223 Cb 0.43 -0.97 -0.03 0.00 -0.75 0.00 0.00 64.21 62.89 1ajs n SER 223 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ajs n ALA 224 N 2.12 2.79 -1.82 -1.46 0.00 -1.26 -2.35 120.51 118.52 1ajs n ALA 224 Ca 0.22 -0.34 0.02 0.00 0.00 0.00 0.00 53.44 53.34 1ajs n ALA 224 Cb 0.37 -0.99 0.16 0.00 0.00 0.00 0.00 19.45 18.98 1ajs n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ajs n TYR 225 N -2.41 0.34 -1.69 0.00 4.01 -1.26 -4.54 117.16 111.62 1ajs n TYR 225 Ca -0.01 -1.44 -0.50 0.00 -0.16 0.00 0.00 57.90 55.79 1ajs n TYR 225 Cb 0.53 -0.24 -0.05 0.00 -0.31 0.00 0.00 39.34 39.26 1ajs n TYR 225 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1ajs n GLN 226 N -0.81 1.94 0.00 -0.72 7.27 -1.26 -0.66 117.38 123.13 1ajs n GLN 226 Ca 0.20 0.71 0.00 0.00 0.07 0.00 0.00 57.00 57.97 1ajs n GLN 226 Cb 0.80 -2.51 0.00 0.00 2.41 0.00 0.00 30.24 30.93 1ajs n GLN 226 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ajs n GLY 227 N 4.25 2.17 0.12 1.69 0.00 -1.26 -4.78 105.19 107.38 1ajs n GLY 227 Ca 0.23 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1ajs n GLY 227 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ajs h PHE 228 N 0.00 0.00 -0.42 1.61 0.04 -1.24 0.31 116.94 117.24 1ajs h PHE 228 Ca 0.00 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.62 1ajs h PHE 228 Cb 0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 1ajs h PHE 228 CO 0.00 0.00 -0.31 0.00 -0.60 0.00 0.00 178.31 177.40 1ajs h ALA 229 N 2.15 0.64 0.00 2.45 0.00 -1.92 -3.08 119.26 119.50 1ajs h ALA 229 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ajs h ALA 229 Cb 0.92 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1ajs h ALA 229 CO 0.00 0.68 0.00 -1.13 0.00 0.00 0.00 179.25 178.80 1ajs n SER 230 N -4.08 0.12 0.00 0.00 3.41 -1.25 -4.29 113.62 107.53 1ajs n SER 230 Ca -0.01 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 1ajs n SER 230 Cb 0.51 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 1ajs n SER 230 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ajs n GLY 231 N 0.22 1.33 3.04 5.00 0.00 0.11 -5.01 105.19 109.87 1ajs n GLY 231 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ajs n GLY 231 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ajs s ASN 232 N -3.14 2.70 0.29 1.61 3.84 -1.24 -4.26 114.94 114.74 1ajs s ASN 232 Ca 0.00 -0.49 -0.00 0.00 0.21 0.00 0.00 52.86 52.57 1ajs s ASN 232 Cb 0.00 -1.20 0.45 0.00 -0.55 0.00 0.00 41.25 39.95 1ajs s ASN 232 CO 0.00 -0.03 1.86 -0.07 -2.79 0.00 0.00 177.10 176.06 1ajs h LEU 233 N 7.90 0.75 -0.14 3.21 3.38 -1.91 -2.12 115.31 126.37 1ajs h LEU 233 Ca -0.37 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.41 1ajs h LEU 233 Cb 1.15 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1ajs h LEU 233 CO 0.53 0.71 -0.19 -0.33 0.09 0.00 0.00 178.44 179.25 1ajs h GLU 234 N 0.79 0.38 -0.44 1.13 4.39 -1.96 -2.99 114.58 115.88 1ajs h GLU 234 Ca 0.18 -0.22 0.02 0.00 0.34 0.00 0.00 59.36 59.68 1ajs h GLU 234 Cb 0.24 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 1ajs h GLU 234 CO -0.01 0.80 0.25 -0.22 -1.16 0.00 0.00 179.01 178.67 1ajs h LYS 235 N -0.01 0.49 0.00 2.33 3.64 -1.97 -2.57 116.57 118.48 1ajs h LYS 235 Ca 0.02 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1ajs h LYS 235 Cb 0.75 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1ajs h LYS 235 CO 0.05 0.32 -0.06 -0.44 -2.27 0.00 0.00 179.45 177.05 1ajs h ASP 236 N 0.51 0.00 -0.08 4.20 5.19 -1.40 -2.19 116.42 122.65 1ajs h ASP 236 Ca 0.18 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 1ajs h ASP 236 Cb 0.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.54 1ajs h ASP 236 CO -0.09 0.06 0.00 0.00 -3.12 0.00 0.00 179.24 176.08 1ajs n ALA 237 N -2.18 2.51 -0.18 3.45 0.00 -0.98 -4.58 120.51 118.56 1ajs n ALA 237 Ca -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 53.44 52.81 1ajs n ALA 237 Cb 0.21 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 18.69 1ajs n ALA 237 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1ajs h TRP 238 N 3.32 -0.41 -0.73 0.00 7.01 -1.29 -2.31 115.95 121.54 1ajs h TRP 238 Ca 0.00 0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.07 1ajs h TRP 238 Cb 0.71 0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 28.00 1ajs h TRP 238 CO 0.04 -0.27 0.48 0.00 -2.79 0.00 0.00 178.44 175.89 1ajs h ALA 239 N 1.44 0.93 -0.25 2.65 0.00 -1.83 0.98 119.26 123.18 1ajs h ALA 239 Ca 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ajs h ALA 239 Cb 0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ajs h ALA 239 CO -0.59 0.32 0.16 0.82 0.00 0.00 0.00 179.25 179.96 1ajs h ILE 240 N 0.97 1.08 -0.61 0.00 2.04 -1.77 -1.73 117.51 117.49 1ajs h ILE 240 Ca 0.27 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 1ajs h ILE 240 Cb -0.08 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 1ajs h ILE 240 CO -0.07 0.07 0.23 0.03 0.00 0.00 0.00 178.15 178.42 1ajs h ARG 241 N 0.32 0.89 -0.45 2.37 3.08 -0.91 -1.30 114.38 118.38 1ajs h ARG 241 Ca 0.09 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1ajs h ARG 241 Cb -0.01 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1ajs h ARG 241 CO -0.02 0.74 0.22 -0.92 -1.07 0.00 0.00 179.97 178.92 1ajs h TYR 242 N 0.88 0.65 -0.81 3.04 3.20 -0.50 0.34 116.97 123.77 1ajs h TYR 242 Ca 0.21 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 1ajs h TYR 242 Cb 0.19 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 1ajs h TYR 242 CO 0.01 0.52 0.38 0.74 -1.64 0.00 0.00 178.16 178.18 1ajs h PHE 243 N 0.59 1.17 -0.12 -3.82 -1.00 -0.91 -0.08 116.94 112.77 1ajs h PHE 243 Ca 0.16 -0.06 -0.00 0.00 2.81 0.00 0.00 57.97 60.88 1ajs h PHE 243 Cb 0.11 -0.36 -0.01 0.00 3.61 0.00 0.00 35.95 39.30 1ajs h PHE 243 CO -0.01 0.85 0.06 0.28 -1.61 0.00 0.00 178.31 177.88 1ajs h VAL 244 N 1.16 1.10 0.00 -0.55 2.07 -0.79 -1.81 116.25 117.43 1ajs h VAL 244 Ca 0.28 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1ajs h VAL 244 Cb 0.12 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1ajs h VAL 244 CO -0.03 0.09 -0.00 0.77 0.02 0.00 0.00 177.57 178.41 1ajs h SER 245 N 0.09 0.00 -0.01 0.57 4.64 -0.50 0.12 113.55 118.45 1ajs h SER 245 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ajs h SER 245 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1ajs h SER 245 CO -0.01 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 1ajs n GLU 246 N -4.26 1.08 -0.88 4.77 -0.58 -0.08 -4.89 120.64 115.80 1ajs n GLU 246 Ca -0.03 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.59 1ajs n GLU 246 Cb 0.09 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1ajs n GLU 246 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ajs n GLY 247 N 0.92 0.46 3.81 0.62 0.00 0.40 -5.05 105.19 106.35 1ajs n GLY 247 Ca 0.18 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.91 1ajs n GLY 247 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ajs s PHE 248 N -2.00 3.18 -0.10 1.61 0.40 -0.73 -4.98 117.98 115.36 1ajs s PHE 248 Ca 0.00 1.59 -0.12 0.00 -0.60 0.00 0.00 56.93 57.80 1ajs s PHE 248 Cb 0.00 -2.94 -0.05 0.00 0.51 0.00 0.00 43.02 40.54 1ajs s PHE 248 CO 0.00 -0.45 0.27 -1.21 0.70 0.00 0.00 175.22 174.54 1ajs s GLU 249 N -3.27 3.90 0.30 0.44 2.02 -1.26 -4.66 118.70 116.16 1ajs s GLU 249 Ca 0.64 0.10 -0.20 0.00 0.02 0.00 0.00 54.97 55.53 1ajs s GLU 249 Cb -0.12 -3.29 0.03 0.00 0.10 0.00 0.00 34.13 30.85 1ajs s GLU 249 CO 0.17 0.54 0.75 -0.48 0.02 0.00 0.00 175.26 176.26 1ajs s LEU 250 N -0.46 -0.20 0.07 1.80 0.05 -0.77 -4.44 118.68 114.74 1ajs s LEU 250 Ca 0.18 -0.72 0.09 0.00 0.05 0.00 0.00 54.13 53.73 1ajs s LEU 250 Cb -0.14 2.73 -0.03 0.00 -2.05 0.00 0.00 46.19 46.70 1ajs s LEU 250 CO 0.06 -1.41 -0.25 -0.36 -0.55 0.00 0.00 176.35 173.85 1ajs s PHE 251 N -3.54 2.37 -0.19 3.48 0.08 -1.07 -1.13 117.98 117.98 1ajs s PHE 251 Ca 0.12 -0.37 -0.03 0.00 0.12 0.00 0.00 56.93 56.77 1ajs s PHE 251 Cb -0.06 -1.37 0.06 0.00 -0.57 0.00 0.00 43.02 41.09 1ajs s PHE 251 CO 0.08 0.21 0.04 0.00 -0.10 0.00 0.00 175.22 175.45 1ajs s ALA 253 N 1.90 3.45 -0.08 0.00 0.00 0.50 -0.52 121.76 127.00 1ajs s ALA 253 Ca -0.01 -0.54 -0.02 0.00 0.00 0.00 0.00 51.96 51.40 1ajs s ALA 253 Cb -0.17 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1ajs s ALA 253 CO -0.08 -1.45 0.01 -0.65 0.00 0.00 0.00 175.76 173.59 1ajs s GLN 254 N 3.17 3.00 -0.03 0.00 -0.21 0.13 -0.35 119.66 125.37 1ajs s GLN 254 Ca 0.33 -0.40 0.07 0.00 0.02 0.00 0.00 55.36 55.38 1ajs s GLN 254 Cb -0.13 -2.81 -0.02 0.00 1.00 0.00 0.00 33.01 31.05 1ajs s GLN 254 CO 0.16 0.70 -0.23 0.45 -2.12 0.00 0.00 175.29 174.25 1ajs s SER 255 N -0.95 3.27 -0.04 5.90 0.15 -0.99 -1.11 113.70 119.93 1ajs s SER 255 Ca 0.14 -0.41 0.14 0.00 0.70 0.00 0.00 55.95 56.52 1ajs s SER 255 Cb -0.11 -0.46 0.43 0.00 -1.71 0.00 0.00 66.02 64.17 1ajs s SER 255 CO 0.03 0.33 1.36 0.49 1.20 0.00 0.00 173.24 176.65 1ajs n PHE 256 N 2.41 0.72 -0.12 3.44 3.72 -0.31 -4.68 117.46 122.64 1ajs n PHE 256 Ca -0.16 -0.57 -0.08 0.00 -0.05 0.00 0.00 57.45 56.59 1ajs n PHE 256 Cb 0.51 -0.09 -0.00 0.00 -0.94 0.00 0.00 39.48 38.96 1ajs n PHE 256 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1ajs h SER 257 N 2.52 0.47 0.05 4.37 0.02 -1.84 -2.61 113.55 116.52 1ajs h SER 257 Ca 0.00 -0.05 -0.23 0.00 -0.84 0.00 0.00 61.79 60.66 1ajs h SER 257 Cb 0.95 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 1ajs h SER 257 CO 0.06 0.38 -1.24 0.11 -1.14 0.00 0.00 176.83 175.00 1ajs h LYS 258 N 0.51 0.10 0.00 3.45 6.56 -1.83 -0.79 116.57 124.57 1ajs h LYS 258 Ca 0.14 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1ajs h LYS 258 Cb 0.00 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 31.72 1ajs h LYS 258 CO -0.03 1.08 0.00 -2.95 -2.06 0.00 0.00 179.45 175.49 1ajs h ASN 259 N -0.69 0.00 -0.01 0.86 7.08 -1.83 -2.52 115.58 118.47 1ajs h ASN 259 Ca -0.30 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.92 1ajs h ASN 259 Cb 1.47 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.71 1ajs h ASN 259 CO -0.08 0.00 -0.32 0.49 -2.08 0.00 0.00 177.43 175.44 1ajs n PHE 260 N -2.96 0.00 -2.75 4.14 3.01 -0.99 -4.84 117.46 113.08 1ajs n PHE 260 Ca 0.01 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.26 1ajs n PHE 260 Cb 0.33 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.81 1ajs n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ajs n GLY 261 N 1.05 -0.47 2.16 1.37 0.00 -0.78 -4.66 105.19 103.86 1ajs n GLY 261 Ca 0.04 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1ajs n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ajs n LEU 262 N -3.48 6.75 -0.39 0.99 4.77 -0.37 -4.82 117.00 120.44 1ajs n LEU 262 Ca -0.16 -4.26 -0.02 0.00 -0.03 0.00 0.00 56.01 51.54 1ajs n LEU 262 Cb 0.64 -0.81 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 1ajs n LEU 262 CO 0.38 1.53 0.57 -1.22 -1.33 0.00 0.00 177.39 177.33 1ajs n TYR 263 N -0.92 -0.03 1.73 -1.77 4.02 -1.17 -1.01 117.16 118.01 1ajs n TYR 263 Ca 0.56 1.23 0.06 0.00 -0.01 0.00 0.00 57.90 59.75 1ajs n TYR 263 Cb 0.88 -0.84 0.31 0.00 -0.02 0.00 0.00 39.34 39.67 1ajs n TYR 263 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1ajs n ASN 264 N -5.44 0.51 -0.54 7.72 2.04 -1.26 -3.22 115.26 115.06 1ajs n ASN 264 Ca 0.09 -1.71 0.08 0.00 -0.44 0.00 0.00 54.58 52.60 1ajs n ASN 264 Cb 0.38 -0.05 0.04 0.00 -2.53 0.00 0.00 39.78 37.62 1ajs n ASN 264 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1ajs n GLU 265 N -0.35 1.54 -3.61 -3.83 -0.58 -0.18 -5.03 120.64 108.60 1ajs n GLU 265 Ca 0.10 -1.19 -0.25 0.00 -0.42 0.00 0.00 57.16 55.41 1ajs n GLU 265 Cb 0.12 -1.31 0.02 0.00 -0.57 0.00 0.00 31.44 29.70 1ajs n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1ajs n ARG 266 N 0.44 -1.26 -3.72 3.49 5.12 -1.20 -4.56 116.66 114.98 1ajs n ARG 266 Ca 0.09 0.71 -0.38 0.00 -1.93 0.00 0.00 57.85 56.34 1ajs n ARG 266 Cb 0.39 -3.91 -0.12 0.00 -1.16 0.00 0.00 32.46 27.66 1ajs n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ajs s VAL 267 N -3.26 4.17 0.22 1.55 1.01 -1.26 -2.02 120.40 120.81 1ajs s VAL 267 Ca 0.27 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 1ajs s VAL 267 Cb -0.10 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1ajs s VAL 267 CO 0.85 0.02 0.26 -0.83 0.00 0.00 0.00 175.10 175.41 1ajs s GLY 268 N 1.52 1.13 -0.11 4.51 0.00 -0.61 -1.16 107.32 112.60 1ajs s GLY 268 Ca 0.03 -1.41 -0.09 0.00 0.00 0.00 0.00 44.72 43.25 1ajs s GLY 268 CO 0.04 -1.11 0.28 0.21 0.00 0.00 0.00 173.10 172.52 1ajs s ASN 269 N -3.11 -0.30 -0.40 1.64 3.04 -0.27 -0.95 114.94 114.59 1ajs s ASN 269 Ca 0.33 0.58 -0.13 0.00 0.04 0.00 0.00 52.86 53.67 1ajs s ASN 269 Cb 0.04 0.56 0.02 0.00 -1.54 0.00 0.00 41.25 40.33 1ajs s ASN 269 CO 0.11 -0.11 0.27 -0.22 -3.04 0.00 0.00 177.10 174.11 1ajs s LEU 270 N 0.40 4.98 -0.08 3.21 2.96 0.09 0.17 118.68 130.40 1ajs s LEU 270 Ca -0.02 -0.95 -0.18 0.00 -0.22 0.00 0.00 54.13 52.76 1ajs s LEU 270 Cb -0.04 -2.11 -0.05 0.00 0.50 0.00 0.00 46.19 44.50 1ajs s LEU 270 CO -0.02 -0.43 0.47 -0.89 -1.32 0.00 0.00 176.35 174.16 1ajs s THR 271 N 1.63 5.12 -0.09 3.68 2.01 0.32 -1.20 115.64 127.11 1ajs s THR 271 Ca 0.04 0.96 0.03 0.00 0.31 0.00 0.00 61.69 63.03 1ajs s THR 271 Cb -0.19 -3.81 -0.01 0.00 0.01 0.00 0.00 72.50 68.50 1ajs s THR 271 CO 0.09 0.39 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.52 1ajs s VAL 272 N 0.20 2.50 -0.17 3.82 1.01 0.45 -0.46 120.40 127.76 1ajs s VAL 272 Ca 0.26 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1ajs s VAL 272 Cb -0.16 -1.98 0.02 0.00 0.00 0.00 0.00 36.38 34.26 1ajs s VAL 272 CO 0.11 0.55 -0.19 -0.69 0.00 0.00 0.00 175.10 174.89 1ajs s VAL 273 N 0.08 1.94 0.39 2.92 1.01 -0.29 -0.91 120.40 125.54 1ajs s VAL 273 Ca -0.09 -0.86 0.08 0.00 0.00 0.00 0.00 61.98 61.11 1ajs s VAL 273 Cb -0.15 -1.76 -0.06 0.00 0.00 0.00 0.00 36.38 34.40 1ajs s VAL 273 CO 0.05 0.52 0.08 0.00 0.00 0.00 0.00 175.10 175.75 1ajs s ALA 274 N 1.31 3.34 0.21 5.51 0.00 -0.62 -1.84 121.76 129.67 1ajs s ALA 274 Ca 0.04 -2.15 -0.03 0.00 0.00 0.00 0.00 51.96 49.82 1ajs s ALA 274 Cb -0.13 -0.17 0.18 0.00 0.00 0.00 0.00 23.12 23.00 1ajs s ALA 274 CO -0.12 -0.10 1.58 0.87 0.00 0.00 0.00 175.76 178.00 1ajs h LYS 275 N 1.65 0.64 -4.45 0.00 1.57 -1.91 -3.46 116.57 110.60 1ajs h LYS 275 Ca -0.43 -0.32 -0.20 0.00 -1.87 0.00 0.00 60.65 57.83 1ajs h LYS 275 Cb 1.25 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.39 1ajs h LYS 275 CO 0.73 0.92 -0.70 -1.83 -0.57 0.00 0.00 179.45 178.00 1ajs s GLU 276 N -4.30 0.64 0.30 3.15 1.03 -1.26 -5.03 118.70 113.23 1ajs s GLU 276 Ca -0.08 -1.08 -0.01 0.00 0.03 0.00 0.00 54.97 53.83 1ajs s GLU 276 Cb 0.12 -0.09 0.47 0.00 -0.80 0.00 0.00 34.13 33.84 1ajs s GLU 276 CO 0.83 -0.03 1.95 -1.35 -1.33 0.00 0.00 175.26 175.33 1ajs h PRO 277 N 3.59 1.06 -0.89 -4.83 0.11 -1.82 -2.99 132.00 126.23 1ajs h PRO 277 Ca -0.35 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.72 1ajs h PRO 277 Cb 1.17 -0.24 -0.05 0.00 0.11 0.00 0.00 31.00 32.00 1ajs h PRO 277 CO 0.56 0.70 0.58 -0.44 -0.21 0.00 0.00 178.00 179.20 1ajs h ASP 278 N 1.09 0.99 -0.81 -2.05 3.32 -1.97 -2.55 116.42 114.44 1ajs h ASP 278 Ca 0.33 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.43 1ajs h ASP 278 Cb -0.01 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 39.24 1ajs h ASP 278 CO -0.09 0.70 0.49 0.28 -1.72 0.00 0.00 179.24 178.90 1ajs h SER 279 N 1.16 0.77 -0.58 6.45 0.02 -1.95 -2.45 113.55 116.97 1ajs h SER 279 Ca 0.34 0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.38 1ajs h SER 279 Cb -0.06 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.27 1ajs h SER 279 CO -0.10 0.50 0.25 0.40 -1.14 0.00 0.00 176.83 176.74 1ajs h ILE 280 N 0.91 0.85 -0.37 3.27 1.08 -1.54 0.21 117.51 121.92 1ajs h ILE 280 Ca 0.35 -0.16 0.05 0.00 -0.39 0.00 0.00 64.86 64.71 1ajs h ILE 280 Cb 0.16 0.35 -0.04 0.00 -3.07 0.00 0.00 36.82 34.21 1ajs h ILE 280 CO -0.17 0.08 0.11 -0.07 -0.69 0.00 0.00 178.15 177.41 1ajs h LEU 281 N 0.46 0.09 -0.35 1.44 -0.00 -1.47 0.21 115.31 115.69 1ajs h LEU 281 Ca 0.28 0.05 -0.06 0.00 -0.00 0.00 0.00 57.88 58.14 1ajs h LEU 281 Cb 0.28 0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.98 1ajs h LEU 281 CO -0.25 0.09 -0.03 0.03 -0.00 0.00 0.00 178.44 178.28 1ajs h ARG 282 N 0.25 0.64 0.04 1.13 3.08 -1.26 -1.98 114.38 116.28 1ajs h ARG 282 Ca 0.17 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1ajs h ARG 282 Cb 0.17 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1ajs h ARG 282 CO -0.19 0.78 -0.02 0.28 -1.07 0.00 0.00 179.97 179.74 1ajs h VAL 283 N 0.44 0.97 -0.72 2.04 2.07 -0.77 -2.62 116.25 117.66 1ajs h VAL 283 Ca 0.10 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.58 1ajs h VAL 283 Cb 0.51 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 1ajs h VAL 283 CO 0.02 0.01 0.48 -0.07 0.02 0.00 0.00 177.57 178.04 1ajs h LEU 284 N -0.08 0.82 -1.27 2.57 3.38 -0.95 0.41 115.31 120.19 1ajs h LEU 284 Ca -0.01 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ajs h LEU 284 Cb 0.07 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1ajs h LEU 284 CO 0.01 0.59 0.39 0.77 0.09 0.00 0.00 178.44 180.29 1ajs h SER 285 N 0.96 0.78 0.38 -0.43 4.64 -1.00 -0.69 113.55 118.19 1ajs h SER 285 Ca 0.27 -0.04 -0.25 0.00 -0.47 0.00 0.00 61.79 61.30 1ajs h SER 285 Cb -0.08 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 61.81 1ajs h SER 285 CO -0.06 0.61 -1.05 1.56 -0.87 0.00 0.00 176.83 177.01 1ajs h GLN 286 N 0.90 0.41 -0.57 4.77 1.08 -0.99 -3.16 115.11 117.55 1ajs h GLN 286 Ca 0.24 -0.50 -0.04 0.00 -1.45 0.00 0.00 58.65 56.90 1ajs h GLN 286 Cb -0.03 0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 27.53 1ajs h GLN 286 CO -0.04 1.17 0.20 0.52 -0.95 0.00 0.00 178.83 179.72 1ajs h MET 287 N 0.20 0.84 -0.77 1.46 2.86 -0.41 -2.47 114.93 116.64 1ajs h MET 287 Ca -0.11 -0.14 0.05 0.00 -2.06 0.00 0.00 59.70 57.44 1ajs h MET 287 Cb 1.72 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 33.18 1ajs h MET 287 CO 0.18 0.71 0.47 1.96 1.06 0.00 0.00 176.91 181.30 1ajs h GLN 288 N 0.82 0.86 -0.90 1.72 4.20 -1.11 -1.20 115.11 119.49 1ajs h GLN 288 Ca 0.19 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1ajs h GLN 288 Cb 0.21 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.75 1ajs h GLN 288 CO -0.01 0.57 0.55 0.87 -0.67 0.00 0.00 178.83 180.13 1ajs h LYS 289 N 0.88 1.23 -0.20 1.46 1.57 -1.47 -0.36 116.57 119.67 1ajs h LYS 289 Ca 0.33 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.95 1ajs h LYS 289 Cb 0.11 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1ajs h LYS 289 CO -0.15 0.86 -0.05 0.82 -0.57 0.00 0.00 179.45 180.36 1ajs h ILE 290 N 1.24 1.28 -0.48 1.86 2.04 -1.11 -3.17 117.51 119.18 1ajs h ILE 290 Ca 0.32 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1ajs h ILE 290 Cb -0.05 1.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 1ajs h ILE 290 CO -0.06 0.31 0.31 0.58 0.00 0.00 0.00 178.15 179.29 1ajs h VAL 291 N 0.12 1.14 -0.99 1.67 2.07 -1.10 -3.06 116.25 116.10 1ajs h VAL 291 Ca 0.05 -0.28 0.17 0.00 0.82 0.00 0.00 66.70 67.46 1ajs h VAL 291 Cb 0.49 0.46 -0.10 0.00 -1.52 0.00 0.00 31.29 30.62 1ajs h VAL 291 CO 0.02 0.14 0.60 -0.09 0.02 0.00 0.00 177.57 178.26 1ajs h ARG 292 N 0.65 0.79 -0.26 1.57 2.43 -1.04 -0.76 114.38 117.76 1ajs h ARG 292 Ca 0.18 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1ajs h ARG 292 Cb -0.04 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.33 1ajs h ARG 292 CO -0.04 0.52 0.00 1.33 -1.51 0.00 0.00 179.97 180.28 1ajs n VAL 293 N -4.74 0.34 -0.01 0.20 0.24 -1.17 -3.28 118.33 109.92 1ajs n VAL 293 Ca 0.22 -0.49 -0.02 0.00 -2.04 0.00 0.00 64.34 62.00 1ajs n VAL 293 Cb 0.50 0.53 -0.01 0.00 -1.47 0.00 0.00 33.84 33.40 1ajs n VAL 293 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1ajs n THR 294 N 0.71 0.69 -0.46 3.34 -1.04 -0.42 -4.92 114.28 112.18 1ajs n THR 294 Ca 0.17 0.26 0.00 0.00 -2.04 0.00 0.00 64.05 62.44 1ajs n THR 294 Cb 0.41 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.31 1ajs n THR 294 CO 0.00 0.00 0.00 -2.67 -0.64 0.00 0.00 175.07 171.76 1ajs n TRP 295 N -3.25 0.00 0.00 -1.42 2.14 -0.58 -5.05 117.44 109.28 1ajs n TRP 295 Ca -0.04 -0.05 0.00 0.00 2.07 0.00 0.00 57.50 59.48 1ajs n TRP 295 Cb 0.13 -0.01 0.00 0.00 -0.81 0.00 0.00 31.31 30.63 1ajs n TRP 295 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 1ajs n SER 296 N -0.05 0.00 -3.49 -0.67 2.88 -0.46 -4.68 113.62 107.15 1ajs n SER 296 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 1ajs n SER 296 Cb 0.17 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.58 1ajs n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ajs s ASN 297 N 0.00 -0.57 0.52 -3.46 2.20 -1.26 -4.28 114.94 108.09 1ajs s ASN 297 Ca 0.00 0.39 -0.05 0.00 -0.94 0.00 0.00 52.86 52.27 1ajs s ASN 297 Cb 0.00 0.52 -0.01 0.00 -2.00 0.00 0.00 41.25 39.75 1ajs s ASN 297 CO 0.00 -0.69 0.81 -2.16 -2.94 0.00 0.00 177.10 172.12 1ajs s PRO 298 N -2.16 3.24 0.60 3.55 0.04 -1.26 -5.03 135.00 133.97 1ajs s PRO 298 Ca -0.05 0.02 -0.16 0.00 0.04 0.00 0.00 61.00 60.86 1ajs s PRO 298 Cb -0.00 -2.36 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 1ajs s PRO 298 CO 0.00 -0.40 1.07 -1.25 0.04 0.00 0.00 177.00 176.46 1ajs s PRO 299 N -4.81 3.27 -0.17 0.56 0.04 -1.26 -4.65 135.00 127.98 1ajs s PRO 299 Ca 0.50 1.24 0.03 0.00 0.04 0.00 0.00 61.00 62.81 1ajs s PRO 299 Cb -0.10 -2.02 -0.22 0.00 0.04 0.00 0.00 34.50 32.19 1ajs s PRO 299 CO 0.44 -0.86 0.17 0.00 0.04 0.00 0.00 177.00 176.79 1ajs n ALA 300 N -2.02 1.25 -0.06 8.56 0.00 -1.26 -4.57 120.51 122.41 1ajs n ALA 300 Ca 0.09 -0.90 -0.11 0.00 0.00 0.00 0.00 53.44 52.52 1ajs n ALA 300 Cb 0.53 -0.44 -0.05 0.00 0.00 0.00 0.00 19.45 19.48 1ajs n ALA 300 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1ajs h GLN 301 N 0.03 -0.39 -0.29 0.00 5.75 -1.95 -0.90 115.11 117.36 1ajs h GLN 301 Ca -0.47 0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.05 1ajs h GLN 301 Cb 2.02 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 30.64 1ajs h GLN 301 CO 0.02 -0.26 0.16 0.78 -2.65 0.00 0.00 178.83 176.88 1ajs h GLY 302 N -0.41 0.42 1.26 2.39 0.00 -1.84 -2.44 103.07 102.46 1ajs h GLY 302 Ca 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1ajs h GLY 302 CO -0.48 0.18 0.40 0.00 0.00 0.00 0.00 176.54 176.64 1ajs h ALA 303 N 1.04 1.36 -0.57 3.60 0.00 -1.76 -0.82 119.26 122.11 1ajs h ALA 303 Ca 0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1ajs h ALA 303 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1ajs h ALA 303 CO -0.02 0.53 0.18 0.00 0.00 0.00 0.00 179.25 179.94 1ajs h ARG 304 N 0.99 0.88 -0.06 0.00 3.08 -0.95 0.16 114.38 118.48 1ajs h ARG 304 Ca 0.25 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1ajs h ARG 304 Cb 0.01 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 1ajs h ARG 304 CO -0.04 0.79 0.02 0.82 -1.07 0.00 0.00 179.97 180.49 1ajs h ILE 305 N 0.80 1.17 -0.53 2.04 2.04 -0.93 -0.93 117.51 121.17 1ajs h ILE 305 Ca 0.18 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.46 1ajs h ILE 305 Cb 0.28 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1ajs h ILE 305 CO -0.01 0.15 0.09 0.58 0.00 0.00 0.00 178.15 178.96 1ajs h VAL 306 N -0.11 1.25 -0.47 1.67 2.07 -1.01 -2.22 116.25 117.44 1ajs h VAL 306 Ca 0.02 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 1ajs h VAL 306 Cb 0.22 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1ajs h VAL 306 CO -0.00 0.34 0.23 0.00 0.02 0.00 0.00 177.57 178.16 1ajs h ALA 307 N 0.99 0.60 -0.73 1.67 0.00 -0.60 -1.65 119.26 119.55 1ajs h ALA 307 Ca 0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ajs h ALA 307 Cb 0.40 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ajs h ALA 307 CO 0.01 0.16 0.33 0.00 0.00 0.00 0.00 179.25 179.75 1ajs h ARG 308 N 0.61 1.05 -0.02 0.00 3.08 -1.06 -1.80 114.38 116.25 1ajs h ARG 308 Ca 0.16 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1ajs h ARG 308 Cb 0.11 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 1ajs h ARG 308 CO -0.02 0.83 -0.02 1.15 -1.07 0.00 0.00 179.97 180.83 1ajs h THR 309 N 1.04 1.41 0.00 2.04 2.02 -1.16 -3.14 112.91 115.12 1ajs h THR 309 Ca 0.25 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 66.18 1ajs h THR 309 Cb 0.14 2.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1ajs h THR 309 CO -0.03 0.33 0.00 -0.07 0.37 0.00 0.00 175.52 176.12 1ajs h LEU 310 N -0.46 0.00 -1.09 2.58 3.38 -1.24 -2.42 115.31 116.07 1ajs h LEU 310 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ajs h LEU 310 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1ajs h LEU 310 CO 0.01 0.00 -0.42 -1.54 0.09 0.00 0.00 178.44 176.58 1ajs n SER 311 N -2.32 2.11 -4.21 -0.43 3.41 -0.68 -4.75 113.62 106.76 1ajs n SER 311 Ca 0.03 -1.55 -0.38 0.00 -0.26 0.00 0.00 58.87 56.71 1ajs n SER 311 Cb 0.31 0.43 -0.12 0.00 -0.26 0.00 0.00 64.21 64.58 1ajs n SER 311 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ajs s ASP 312 N -2.38 5.32 0.38 4.04 -1.08 -1.16 -5.00 116.67 116.78 1ajs s ASP 312 Ca 0.19 -1.55 0.19 0.00 -0.52 0.00 0.00 52.55 50.85 1ajs s ASP 312 Cb 0.18 -1.87 1.13 0.00 -1.46 0.00 0.00 42.92 40.91 1ajs s ASP 312 CO 0.53 -0.45 1.72 -0.65 0.52 0.00 0.00 175.17 176.84 1ajs h PRO 313 N 8.19 0.34 -0.23 4.34 0.11 -1.85 0.57 132.00 143.46 1ajs h PRO 313 Ca -0.20 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.76 1ajs h PRO 313 Cb 1.07 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1ajs h PRO 313 CO 0.67 0.22 -0.37 1.49 -0.21 0.00 0.00 178.00 179.80 1ajs h GLU 314 N 0.35 0.67 -0.44 1.05 4.81 -1.94 -1.47 114.58 117.60 1ajs h GLU 314 Ca 0.67 -0.40 -0.11 0.00 -0.13 0.00 0.00 59.36 59.38 1ajs h GLU 314 Cb 1.70 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.11 1ajs h GLU 314 CO -0.40 1.02 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.66 1ajs h LEU 315 N 0.38 0.91 -0.58 1.64 4.07 -1.39 -1.29 115.31 119.04 1ajs h LEU 315 Ca 0.02 -0.39 0.04 0.00 0.08 0.00 0.00 57.88 57.63 1ajs h LEU 315 Cb 0.97 -0.25 -0.05 0.00 1.08 0.00 0.00 40.66 42.41 1ajs h LEU 315 CO 0.09 1.09 0.33 0.15 -1.08 0.00 0.00 178.44 179.01 1ajs h PHE 316 N 0.72 0.60 -0.17 1.13 3.04 0.60 -0.94 116.94 121.91 1ajs h PHE 316 Ca 0.10 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.06 1ajs h PHE 316 Cb 0.73 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 39.05 1ajs h PHE 316 CO 0.05 0.31 0.07 1.25 -2.02 0.00 0.00 178.31 177.97 1ajs h HIS 317 N 0.62 0.26 -0.92 0.41 2.76 -1.06 -1.45 115.15 115.79 1ajs h HIS 317 Ca 0.25 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.45 1ajs h HIS 317 Cb 0.11 -0.08 -0.06 0.00 1.55 0.00 0.00 27.41 28.94 1ajs h HIS 317 CO -0.08 0.32 0.59 1.49 -1.30 0.00 0.00 177.93 178.95 1ajs h GLU 318 N 0.13 1.07 -0.18 5.26 4.81 -0.86 -2.54 114.58 122.28 1ajs h GLU 318 Ca 0.06 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1ajs h GLU 318 Cb 0.17 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1ajs h GLU 318 CO -0.01 0.71 0.08 2.35 -0.73 0.00 0.00 179.01 181.41 1ajs h TRP 319 N 1.11 0.26 -0.57 0.92 7.01 -0.93 -2.04 115.95 121.70 1ajs h TRP 319 Ca 0.38 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.44 1ajs h TRP 319 Cb 0.08 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.03 1ajs h TRP 319 CO -0.02 0.30 0.38 1.79 -2.79 0.00 0.00 178.44 178.10 1ajs h THR 320 N 0.15 0.95 -0.54 2.65 1.35 -0.86 -0.20 112.91 116.41 1ajs h THR 320 Ca 0.06 -0.16 -0.08 0.00 -0.55 0.00 0.00 66.41 65.68 1ajs h THR 320 Cb 0.14 0.44 -0.02 0.00 -1.73 0.00 0.00 68.15 66.98 1ajs h THR 320 CO -0.01 0.09 0.04 1.23 -0.25 0.00 0.00 175.52 176.62 1ajs h GLY 321 N 0.47 0.99 1.14 5.82 0.00 -1.14 -1.18 103.07 109.17 1ajs h GLY 321 Ca 0.25 -0.70 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 1ajs h GLY 321 CO -0.07 0.65 0.30 3.43 0.00 0.00 0.00 176.54 180.85 1ajs h ASN 322 N 0.80 1.01 -0.13 0.19 -0.26 -0.40 -0.65 115.58 116.14 1ajs h ASN 322 Ca 0.16 -0.15 -0.03 0.00 -0.56 0.00 0.00 56.30 55.72 1ajs h ASN 322 Cb 0.47 -0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 37.47 1ajs h ASN 322 CO 0.02 0.89 -0.02 0.58 -1.06 0.00 0.00 177.43 177.84 1ajs h VAL 323 N 1.08 1.28 -0.81 2.81 2.07 -0.95 -2.63 116.25 119.10 1ajs h VAL 323 Ca 0.25 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.88 1ajs h VAL 323 Cb 0.19 1.64 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1ajs h VAL 323 CO -0.02 0.27 0.50 0.50 0.02 0.00 0.00 177.57 178.84 1ajs h LYS 324 N -0.05 0.93 -0.41 1.57 1.63 -0.99 -1.35 116.57 117.90 1ajs h LYS 324 Ca 0.03 -0.06 0.08 0.00 -0.85 0.00 0.00 60.65 59.86 1ajs h LYS 324 Cb 0.43 -0.21 -0.07 0.00 -0.60 0.00 0.00 32.23 31.78 1ajs h LYS 324 CO 0.01 0.61 -0.06 1.15 -3.45 0.00 0.00 179.45 177.72 1ajs h THR 325 N 0.95 0.63 -0.28 1.00 2.02 -0.98 0.32 112.91 116.57 1ajs h THR 325 Ca 0.34 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.49 1ajs h THR 325 Cb 0.09 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1ajs h THR 325 CO -0.14 0.01 0.13 0.24 0.37 0.00 0.00 175.52 176.12 1ajs h MET 326 N 0.04 0.41 -0.59 6.66 2.86 -1.02 -2.17 114.93 121.12 1ajs h MET 326 Ca 0.20 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.74 1ajs h MET 326 Cb 0.30 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1ajs h MET 326 CO -0.39 0.41 0.24 0.00 1.06 0.00 0.00 176.91 178.24 1ajs h ALA 327 N 0.98 0.77 -0.90 6.32 0.00 -0.78 -2.37 119.26 123.29 1ajs h ALA 327 Ca 0.10 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1ajs h ALA 327 Cb 0.14 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1ajs h ALA 327 CO -0.01 0.39 0.59 -0.44 0.00 0.00 0.00 179.25 179.78 1ajs h ASP 328 N 0.82 1.03 -0.57 0.00 3.32 -0.27 -1.90 116.42 118.86 1ajs h ASP 328 Ca 0.20 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.17 1ajs h ASP 328 Cb 0.20 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1ajs h ASP 328 CO -0.02 0.74 0.16 -0.09 -1.72 0.00 0.00 179.24 178.32 1ajs h ARG 329 N 1.21 0.93 -0.43 3.56 2.43 -1.14 -2.27 114.38 118.67 1ajs h ARG 329 Ca 0.33 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 1ajs h ARG 329 Cb -0.14 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.25 1ajs h ARG 329 CO -0.07 0.82 0.14 0.82 -1.51 0.00 0.00 179.97 180.17 1ajs h ILE 330 N 0.90 1.22 -0.82 1.20 2.04 -0.85 -2.17 117.51 119.03 1ajs h ILE 330 Ca 0.20 -0.73 0.07 0.00 1.00 0.00 0.00 64.86 65.40 1ajs h ILE 330 Cb 0.30 0.88 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 1ajs h ILE 330 CO -0.00 0.26 0.49 -0.07 0.00 0.00 0.00 178.15 178.82 1ajs h LEU 331 N 0.56 0.74 -0.67 1.44 3.38 -1.05 -1.69 115.31 118.03 1ajs h LEU 331 Ca 0.14 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1ajs h LEU 331 Cb 0.26 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1ajs h LEU 331 CO -0.00 0.45 0.30 -1.28 0.09 0.00 0.00 178.44 178.00 1ajs h SER 332 N 0.86 0.89 0.48 -0.43 0.87 -1.14 -2.65 113.55 112.43 1ajs h SER 332 Ca 0.37 -0.15 -0.11 0.00 -1.23 0.00 0.00 61.79 60.67 1ajs h SER 332 Cb 0.25 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1ajs h SER 332 CO -0.20 0.79 -0.52 0.24 -0.53 0.00 0.00 176.83 176.60 1ajs h MET 333 N 0.93 0.05 -0.56 2.24 2.86 -0.74 -2.35 114.93 117.35 1ajs h MET 333 Ca 0.23 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.80 1ajs h MET 333 Cb 0.15 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1ajs h MET 333 CO -0.02 0.56 0.20 0.00 1.06 0.00 0.00 176.91 178.70 1ajs h ARG 334 N 0.04 0.86 0.35 1.72 3.08 -1.06 -0.67 114.38 118.70 1ajs h ARG 334 Ca -0.00 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1ajs h ARG 334 Cb 0.94 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1ajs h ARG 334 CO 0.07 0.77 -0.17 0.77 -1.07 0.00 0.00 179.97 180.34 1ajs h SER 335 N 0.78 -0.40 -0.67 7.04 0.02 -1.29 -1.71 113.55 117.32 1ajs h SER 335 Ca 0.18 -0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1ajs h SER 335 Cb 0.25 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.85 1ajs h SER 335 CO -0.01 -0.13 0.43 -0.33 -1.14 0.00 0.00 176.83 175.65 1ajs h GLU 336 N -0.66 0.83 -0.42 3.45 4.39 -1.41 0.15 114.58 120.91 1ajs h GLU 336 Ca -0.05 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.48 1ajs h GLU 336 Cb 0.47 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 1ajs h GLU 336 CO 0.08 0.55 -0.24 1.25 -1.16 0.00 0.00 179.01 179.49 1ajs h LEU 337 N 0.86 0.89 0.32 1.33 5.85 -1.12 -1.72 115.31 121.72 1ajs h LEU 337 Ca 0.26 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1ajs h LEU 337 Cb -0.03 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.75 1ajs h LEU 337 CO -0.08 1.09 -0.15 -0.09 -0.34 0.00 0.00 178.44 178.86 1ajs h ARG 338 N 0.75 -0.42 -0.39 1.25 2.43 -0.96 -2.38 114.38 114.66 1ajs h ARG 338 Ca 0.10 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.38 1ajs h ARG 338 Cb 0.79 0.09 -0.09 0.00 -0.42 0.00 0.00 29.97 30.35 1ajs h ARG 338 CO 0.07 -0.18 -0.21 0.00 -1.51 0.00 0.00 179.97 178.14 1ajs h ALA 339 N 0.03 0.07 -0.47 2.80 0.00 -0.67 -2.25 119.26 118.76 1ajs h ALA 339 Ca -0.04 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ajs h ALA 339 Cb 0.43 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1ajs h ALA 339 CO 0.07 -0.58 0.27 0.00 0.00 0.00 0.00 179.25 179.02 1ajs h ARG 340 N -0.14 0.65 -0.45 0.00 3.08 -1.31 -1.49 114.38 114.73 1ajs h ARG 340 Ca 0.19 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 1ajs h ARG 340 Cb 0.44 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1ajs h ARG 340 CO -0.48 0.49 0.25 -0.07 -1.07 0.00 0.00 179.97 179.09 1ajs h LEU 341 N 0.63 0.54 -0.05 3.04 3.38 -1.01 -1.18 115.31 120.65 1ajs h LEU 341 Ca 0.17 -0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.86 1ajs h LEU 341 Cb 0.02 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ajs h LEU 341 CO -0.03 0.43 -1.07 -0.33 0.09 0.00 0.00 178.44 177.53 1ajs h GLU 342 N 0.62 0.42 0.00 1.13 5.08 -1.16 0.14 114.58 120.80 1ajs h GLU 342 Ca 0.16 -0.52 -0.05 0.00 -1.00 0.00 0.00 59.36 57.95 1ajs h GLU 342 Cb 0.00 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1ajs h GLU 342 CO -0.03 1.18 -0.24 0.00 -1.00 0.00 0.00 179.01 178.92 1ajs h ALA 343 N 0.62 1.23 -0.01 3.43 0.00 -0.83 0.33 119.26 124.03 1ajs h ALA 343 Ca -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ajs h ALA 343 Cb 1.74 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1ajs h ALA 343 CO 0.19 0.31 -0.08 1.28 0.00 0.00 0.00 179.25 180.94 1ajs n LEU 344 N -3.72 0.84 -3.53 0.00 4.32 -0.49 -4.90 117.00 109.52 1ajs n LEU 344 Ca -0.01 -0.21 -0.19 0.00 -0.02 0.00 0.00 56.01 55.57 1ajs n LEU 344 Cb 0.36 -0.08 0.07 0.00 -1.62 0.00 0.00 43.42 42.15 1ajs n LEU 344 CO 0.34 0.15 0.08 0.29 -1.22 0.00 0.00 177.39 177.03 1ajs n LYS 345 N -0.53 -6.31 -2.41 3.23 4.76 0.10 -4.90 118.16 112.10 1ajs n LYS 345 Ca 0.17 0.78 -0.42 0.00 -2.87 0.00 0.00 58.31 55.98 1ajs n LYS 345 Cb 0.29 -5.69 -0.03 0.00 -1.84 0.00 0.00 35.03 27.76 1ajs n LYS 345 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1ajs s THR 346 N -3.43 3.89 0.26 -0.18 2.01 0.48 -4.96 115.64 113.72 1ajs s THR 346 Ca 0.09 1.43 -0.31 0.00 0.31 0.00 0.00 61.69 63.21 1ajs s THR 346 Cb -0.04 -3.92 -0.13 0.00 0.01 0.00 0.00 72.50 68.43 1ajs s THR 346 CO 0.75 0.15 1.51 -0.81 -0.69 0.00 0.00 174.62 175.53 1ajs n PRO 347 N 3.44 2.37 0.00 4.92 -0.04 -1.26 -4.76 135.00 139.66 1ajs n PRO 347 Ca 0.07 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.37 1ajs n PRO 347 Cb 0.46 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.35 1ajs n PRO 347 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ajs n GLY 348 N 2.25 0.20 3.92 0.55 0.00 -1.26 -5.00 105.19 105.85 1ajs n GLY 348 Ca 0.10 -1.99 -0.28 0.00 0.00 0.00 0.00 46.02 43.85 1ajs n GLY 348 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ajs s THR 349 N -1.16 5.11 -0.02 2.61 -4.23 -1.26 -5.01 115.64 111.67 1ajs s THR 349 Ca 0.00 -0.16 0.03 0.00 -1.18 0.00 0.00 61.69 60.39 1ajs s THR 349 Cb 0.00 -3.74 0.05 0.00 1.34 0.00 0.00 72.50 70.15 1ajs s THR 349 CO 0.00 -0.27 0.96 0.79 -0.54 0.00 0.00 174.62 175.56 1ajs n TRP 350 N -0.86 0.00 0.21 3.99 7.02 -1.26 -4.79 117.44 121.74 1ajs n TRP 350 Ca -0.03 -0.19 0.07 0.00 -1.02 0.00 0.00 57.50 56.33 1ajs n TRP 350 Cb 0.54 -0.06 0.44 0.00 -2.42 0.00 0.00 31.31 29.81 1ajs n TRP 350 CO 0.00 0.00 0.00 -2.95 -2.02 0.00 0.00 177.69 172.72 1ajs h ASN 351 N 0.00 0.00 0.06 -0.99 -1.07 -1.97 -2.65 115.58 108.95 1ajs h ASN 351 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 56.30 56.36 1ajs h ASN 351 Cb 1.25 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.50 1ajs h ASN 351 CO 0.00 0.31 -0.05 1.12 0.07 0.00 0.00 177.43 178.88 1ajs h HIS 352 N 0.00 0.00 -0.86 4.14 2.07 -1.95 -1.16 115.15 117.40 1ajs h HIS 352 Ca -0.00 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.54 1ajs h HIS 352 Cb 0.69 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.63 1ajs h HIS 352 CO 0.00 0.05 0.56 0.82 -3.07 0.00 0.00 177.93 176.29 1ajs h ILE 353 N 0.00 1.17 0.00 6.12 1.08 -1.83 -2.38 117.51 121.68 1ajs h ILE 353 Ca -0.00 -0.38 0.00 0.00 -0.39 0.00 0.00 64.86 64.09 1ajs h ILE 353 Cb 0.10 -0.03 0.00 0.00 -3.07 0.00 0.00 36.82 33.81 1ajs h ILE 353 CO 0.01 0.20 -0.81 0.35 -0.69 0.00 0.00 178.15 177.21 1ajs n THR 354 N -4.52 0.29 0.07 -0.27 -2.24 -0.62 -4.02 114.28 102.97 1ajs n THR 354 Ca 0.10 -0.27 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 1ajs n THR 354 Cb 0.05 -0.01 -0.13 0.00 -2.10 0.00 0.00 70.33 68.15 1ajs n THR 354 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ajs h ASP 355 N 0.00 0.14 -4.01 3.42 3.32 -1.01 -3.46 116.42 114.82 1ajs h ASP 355 Ca 0.00 -0.15 -0.48 0.00 0.02 0.00 0.00 57.03 56.41 1ajs h ASP 355 Cb 0.75 -0.05 0.03 0.00 0.22 0.00 0.00 39.33 40.29 1ajs h ASP 355 CO 0.00 1.12 0.42 -1.10 -1.72 0.00 0.00 179.24 177.96 1ajs s GLN 356 N -2.69 3.93 0.29 3.56 -0.21 -0.92 -4.98 119.66 118.64 1ajs s GLN 356 Ca -0.01 1.52 0.06 0.00 0.02 0.00 0.00 55.36 56.95 1ajs s GLN 356 Cb 0.09 -2.35 -0.06 0.00 1.00 0.00 0.00 33.01 31.69 1ajs s GLN 356 CO 0.84 -0.35 -0.03 0.96 -2.12 0.00 0.00 175.29 174.59 1ajs s ILE 357 N -1.74 1.50 0.00 1.08 -0.00 -0.17 -5.00 121.20 116.87 1ajs s ILE 357 Ca 0.63 -2.08 0.00 0.00 -0.00 0.00 0.00 60.65 59.19 1ajs s ILE 357 Cb -0.22 -2.53 0.00 0.00 -0.00 0.00 0.00 42.46 39.72 1ajs s ILE 357 CO 0.27 -0.23 0.00 0.61 -0.00 0.00 0.00 174.94 175.58 1ajs n GLY 358 N -0.60 -1.65 0.16 6.27 0.00 -1.16 -4.40 105.19 103.80 1ajs n GLY 358 Ca -0.05 -1.90 0.10 0.00 0.00 0.00 0.00 46.02 44.18 1ajs n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ajs h MET 359 N 0.00 0.00 -6.15 1.61 2.86 -1.91 -3.48 114.93 107.86 1ajs h MET 359 Ca 0.00 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.11 1ajs h MET 359 Cb 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.59 1ajs h MET 359 CO 0.00 0.07 -0.55 -0.06 1.06 0.00 0.00 176.91 177.43 1ajs s PHE 360 N -3.23 2.80 -0.08 -0.22 0.08 -1.26 -0.64 117.98 115.42 1ajs s PHE 360 Ca 0.03 -0.29 0.02 0.00 0.12 0.00 0.00 56.93 56.81 1ajs s PHE 360 Cb 0.07 -1.52 0.02 0.00 -0.57 0.00 0.00 43.02 41.02 1ajs s PHE 360 CO 0.74 0.41 -0.12 -1.12 -0.10 0.00 0.00 175.22 175.03 1ajs s SER 361 N -3.83 1.94 -0.88 1.36 0.01 -0.68 -4.57 113.70 107.05 1ajs s SER 361 Ca 0.36 -0.32 -0.14 0.00 1.31 0.00 0.00 55.95 57.16 1ajs s SER 361 Cb -0.05 -0.87 0.21 0.00 0.21 0.00 0.00 66.02 65.52 1ajs s SER 361 CO 0.23 0.01 0.88 0.12 0.41 0.00 0.00 173.24 174.89 1ajs s PHE 362 N 0.87 3.70 0.24 2.43 5.36 -1.26 -0.88 117.98 128.44 1ajs s PHE 362 Ca -0.10 -1.97 -0.06 0.00 -0.96 0.00 0.00 56.93 53.83 1ajs s PHE 362 Cb -0.15 -3.91 0.23 0.00 -0.34 0.00 0.00 43.02 38.85 1ajs s PHE 362 CO 0.01 -1.08 1.86 1.79 -1.46 0.00 0.00 175.22 176.34 1ajs h THR 363 N 4.84 1.26 0.00 0.12 1.35 -1.80 -3.48 112.91 115.19 1ajs h THR 363 Ca 0.13 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1ajs h THR 363 Cb 1.02 0.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1ajs h THR 363 CO 0.85 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 177.02 1ajs n GLY 364 N -1.13 0.45 3.78 5.82 0.00 -1.26 -5.04 105.19 107.81 1ajs n GLY 364 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1ajs n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajs s LEU 365 N 0.00 4.32 0.84 0.99 1.43 -1.26 -4.99 118.68 120.01 1ajs s LEU 365 Ca 0.00 3.05 -0.12 0.00 -1.03 0.00 0.00 54.13 56.04 1ajs s LEU 365 Cb 0.00 -3.66 0.10 0.00 0.03 0.00 0.00 46.19 42.65 1ajs s LEU 365 CO 0.00 -0.90 1.13 0.54 0.23 0.00 0.00 176.35 177.35 1ajs s ASN 366 N -0.03 4.13 0.56 2.29 2.20 -1.26 -4.37 114.94 118.46 1ajs s ASN 366 Ca 0.55 1.06 0.34 0.00 -0.94 0.00 0.00 52.86 53.86 1ajs s ASN 366 Cb -0.47 -1.69 1.59 0.00 -2.00 0.00 0.00 41.25 38.67 1ajs s ASN 366 CO 0.61 -2.17 2.08 1.55 -2.94 0.00 0.00 177.10 176.23 1ajs h PRO 367 N -1.23 0.00 -0.11 3.55 0.13 -1.95 -2.22 132.00 130.17 1ajs h PRO 367 Ca -0.48 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.45 1ajs h PRO 367 Cb 1.31 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.45 1ajs h PRO 367 CO 0.62 0.05 -0.71 0.87 -0.23 0.00 0.00 178.00 178.59 1ajs h LYS 368 N 0.00 0.68 0.00 0.86 1.57 -1.92 -2.64 116.57 115.12 1ajs h LYS 368 Ca -0.00 -0.58 -0.08 0.00 -1.87 0.00 0.00 60.65 58.12 1ajs h LYS 368 Cb 0.38 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1ajs h LYS 368 CO 0.01 1.19 -0.38 1.96 -0.57 0.00 0.00 179.45 181.66 1ajs h GLN 369 N 0.36 0.00 -0.08 3.15 4.20 -1.74 -2.11 115.11 118.89 1ajs h GLN 369 Ca -0.06 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1ajs h GLN 369 Cb 1.36 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.13 1ajs h GLN 369 CO 0.15 0.38 -0.09 0.28 -0.67 0.00 0.00 178.83 178.88 1ajs h VAL 370 N 0.00 1.38 -0.42 -0.54 2.07 -1.37 -2.26 116.25 115.10 1ajs h VAL 370 Ca -0.00 -1.27 0.07 0.00 0.82 0.00 0.00 66.70 66.32 1ajs h VAL 370 Cb 0.80 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 1ajs h VAL 370 CO 0.05 0.35 0.06 -0.08 0.02 0.00 0.00 177.57 177.97 1ajs h GLU 371 N -0.25 0.18 0.17 1.57 4.81 -1.43 0.17 114.58 119.81 1ajs h GLU 371 Ca 0.01 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1ajs h GLU 371 Cb 0.61 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1ajs h GLU 371 CO 0.02 0.12 -0.25 -0.92 -0.73 0.00 0.00 179.01 177.25 1ajs h TYR 372 N 0.19 -0.66 -0.75 0.92 3.20 -1.36 0.00 116.97 118.51 1ajs h TYR 372 Ca 0.21 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.19 1ajs h TYR 372 Cb 0.27 0.27 -0.08 0.00 1.54 0.00 0.00 36.73 38.73 1ajs h TYR 372 CO -0.23 -0.36 0.38 -0.07 -1.64 0.00 0.00 178.16 176.25 1ajs h LEU 373 N -0.48 0.49 -0.01 2.82 3.38 -0.72 0.25 115.31 121.04 1ajs h LEU 373 Ca 0.02 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ajs h LEU 373 Cb 0.48 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ajs h LEU 373 CO -0.11 0.26 -0.02 0.40 0.09 0.00 0.00 178.44 179.07 1ajs h ILE 374 N 0.62 1.44 0.10 1.22 2.04 -0.36 0.51 117.51 123.08 1ajs h ILE 374 Ca 0.38 -1.34 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 1ajs h ILE 374 Cb 0.43 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1ajs h ILE 374 CO -0.29 0.35 -0.05 0.78 0.00 0.00 0.00 178.15 178.95 1ajs h ASN 375 N -0.52 -0.11 0.04 1.72 2.35 -0.79 -2.61 115.58 115.66 1ajs h ASN 375 Ca 0.00 -0.43 -0.08 0.00 -0.55 0.00 0.00 56.30 55.24 1ajs h ASN 375 Cb 0.58 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1ajs h ASN 375 CO 0.00 0.42 -0.39 1.56 -1.65 0.00 0.00 177.43 177.37 1ajs h GLN 376 N -0.68 0.09 0.00 0.81 1.08 -0.68 -3.39 115.11 112.34 1ajs h GLN 376 Ca -0.01 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 1ajs h GLN 376 Cb 0.53 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 1ajs h GLN 376 CO 0.02 1.07 -1.00 1.63 -0.95 0.00 0.00 178.83 179.61 1ajs n LYS 377 N -4.43 0.20 -2.63 1.46 4.76 -0.99 -4.98 118.16 111.54 1ajs n LYS 377 Ca -0.14 -0.01 -0.13 0.00 -2.87 0.00 0.00 58.31 55.16 1ajs n LYS 377 Cb 0.61 -1.55 0.02 0.00 -1.84 0.00 0.00 35.03 32.26 1ajs n LYS 377 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1ajs n HIS 378 N -1.80 -1.07 -3.71 2.13 8.25 0.02 -4.57 115.22 114.47 1ajs n HIS 378 Ca 0.03 0.26 -0.38 0.00 -0.26 0.00 0.00 57.72 57.36 1ajs n HIS 378 Cb 0.40 -3.03 -0.12 0.00 1.12 0.00 0.00 29.99 28.36 1ajs n HIS 378 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1ajs s ILE 379 N -2.87 3.95 -0.14 1.59 1.01 -0.32 -1.37 121.20 123.05 1ajs s ILE 379 Ca 0.15 -1.11 -0.24 0.00 0.00 0.00 0.00 60.65 59.44 1ajs s ILE 379 Cb -0.07 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.13 1ajs s ILE 379 CO 0.19 -0.22 0.78 -0.31 0.00 0.00 0.00 174.94 175.38 1ajs s TYR 380 N 1.43 3.46 0.26 3.97 1.51 0.90 -3.01 117.35 125.86 1ajs s TYR 380 Ca -0.01 1.22 -0.16 0.00 -1.01 0.00 0.00 57.07 57.11 1ajs s TYR 380 Cb -0.20 -2.94 0.01 0.00 -0.11 0.00 0.00 41.96 38.72 1ajs s TYR 380 CO 0.03 -0.15 0.58 -0.48 -1.11 0.00 0.00 175.55 174.42 1ajs s LEU 381 N 1.77 0.07 0.43 -1.29 2.34 -1.26 0.13 118.68 120.87 1ajs s LEU 381 Ca 0.37 -0.78 -0.21 0.00 0.06 0.00 0.00 54.13 53.57 1ajs s LEU 381 Cb -0.17 2.18 -0.11 0.00 -0.56 0.00 0.00 46.19 47.53 1ajs s LEU 381 CO 0.14 -1.22 0.95 -0.76 -1.06 0.00 0.00 176.35 174.40 1ajs s LEU 382 N -2.97 3.95 0.53 1.48 1.43 -1.16 -4.92 118.68 117.02 1ajs s LEU 382 Ca 0.17 1.71 0.30 0.00 -1.03 0.00 0.00 54.13 55.28 1ajs s LEU 382 Cb -0.03 -4.52 1.45 0.00 0.03 0.00 0.00 46.19 43.12 1ajs s LEU 382 CO 0.08 -0.36 1.90 -0.65 0.23 0.00 0.00 176.35 177.54 1ajs h PRO 383 N 1.95 0.03 0.00 1.29 0.10 -1.97 -0.64 132.00 132.75 1ajs h PRO 383 Ca -0.49 -0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.61 1ajs h PRO 383 Cb 1.18 -0.01 0.00 0.00 0.10 0.00 0.00 31.00 32.28 1ajs h PRO 383 CO 0.61 0.02 0.00 0.66 0.10 0.00 0.00 178.00 179.39 1ajs h SER 384 N 0.03 0.00 0.00 -2.05 4.64 -1.92 -3.39 113.55 110.86 1ajs h SER 384 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1ajs h SER 384 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1ajs h SER 384 CO -0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 1ajs n GLY 385 N -0.36 0.90 3.72 -0.77 0.00 -0.25 -4.75 105.19 103.68 1ajs n GLY 385 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ajs n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ajs s ARG 386 N -0.86 4.54 0.05 1.61 3.52 -1.24 -2.36 118.95 124.21 1ajs s ARG 386 Ca 0.00 1.55 0.08 0.00 -0.13 0.00 0.00 55.73 57.23 1ajs s ARG 386 Cb 0.00 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1ajs s ARG 386 CO 0.00 -0.07 -0.23 0.96 -0.81 0.00 0.00 175.30 175.16 1ajs s ILE 387 N 0.81 1.83 -0.46 4.11 -4.36 -0.06 -3.01 121.20 120.06 1ajs s ILE 387 Ca 0.53 -1.30 -0.25 0.00 -0.26 0.00 0.00 60.65 59.37 1ajs s ILE 387 Cb -0.24 -1.59 0.03 0.00 1.25 0.00 0.00 42.46 41.90 1ajs s ILE 387 CO 0.29 0.23 0.91 0.21 0.24 0.00 0.00 174.94 176.82 1ajs s ASN 388 N -1.28 6.49 0.57 4.36 2.47 -0.50 -1.68 114.94 125.38 1ajs s ASN 388 Ca 0.09 0.10 0.32 0.00 0.42 0.00 0.00 52.86 53.79 1ajs s ASN 388 Cb -0.09 -2.44 1.75 0.00 -1.45 0.00 0.00 41.25 39.01 1ajs s ASN 388 CO 0.02 -1.04 2.18 0.24 -3.72 0.00 0.00 177.10 174.79 1ajs h MET 389 N 9.06 0.00 0.00 0.43 2.86 -1.23 -2.63 114.93 123.42 1ajs h MET 389 Ca -0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1ajs h MET 389 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 1ajs h MET 389 CO 1.02 0.05 0.00 0.00 1.06 0.00 0.00 176.91 179.04 1ajs n GLY 391 N 0.79 -1.57 3.79 0.00 0.00 -0.99 -3.63 105.19 103.58 1ajs n GLY 391 Ca 0.05 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 1ajs n GLY 391 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ajs s LEU 392 N -4.10 4.54 0.19 0.99 1.43 -1.06 -4.81 118.68 115.86 1ajs s LEU 392 Ca 0.10 1.51 -0.01 0.00 -1.03 0.00 0.00 54.13 54.70 1ajs s LEU 392 Cb 0.14 -3.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.08 1ajs s LEU 392 CO 0.62 0.20 0.13 0.42 0.23 0.00 0.00 176.35 177.95 1ajs s THR 393 N -1.20 0.02 0.45 5.49 -4.23 -1.26 -4.87 115.64 110.03 1ajs s THR 393 Ca 0.35 -1.98 0.14 0.00 -1.18 0.00 0.00 61.69 59.03 1ajs s THR 393 Cb -0.21 -2.43 0.19 0.00 1.34 0.00 0.00 72.50 71.39 1ajs s THR 393 CO 0.24 -0.07 2.00 0.71 -0.54 0.00 0.00 174.62 176.96 1ajs h THR 394 N 2.65 1.12 0.00 3.99 1.35 -1.96 -0.67 112.91 119.39 1ajs h THR 394 Ca -0.36 -0.57 -0.12 0.00 -0.55 0.00 0.00 66.41 64.81 1ajs h THR 394 Cb 1.24 1.28 -0.02 0.00 -1.73 0.00 0.00 68.15 68.93 1ajs h THR 394 CO 0.54 0.16 -0.57 0.07 -0.25 0.00 0.00 175.52 175.47 1ajs h LYS 395 N 0.02 0.00 -0.00 4.72 -0.00 -1.96 -3.33 116.57 116.02 1ajs h LYS 395 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.65 1ajs h LYS 395 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.52 1ajs h LYS 395 CO 0.02 0.57 -0.25 0.27 -0.00 0.00 0.00 179.45 180.06 1ajs n ASN 396 N -3.47 0.90 -0.34 7.07 0.23 -1.01 -4.62 115.26 114.02 1ajs n ASN 396 Ca 0.00 -0.95 0.13 0.00 -0.53 0.00 0.00 54.58 53.24 1ajs n ASN 396 Cb 0.67 0.64 0.32 0.00 -2.08 0.00 0.00 39.78 39.33 1ajs n ASN 396 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 1ajs h LEU 397 N 0.67 0.68 -0.15 -4.53 5.85 -1.24 -1.37 115.31 115.22 1ajs h LEU 397 Ca 0.00 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 1ajs h LEU 397 Cb 0.27 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1ajs h LEU 397 CO 0.00 0.20 -0.13 0.44 -0.34 0.00 0.00 178.44 178.60 1ajs h ASP 398 N 0.67 0.38 -0.65 1.25 3.32 -1.82 -1.51 116.42 118.05 1ajs h ASP 398 Ca 0.58 -0.47 0.06 0.00 0.02 0.00 0.00 57.03 57.21 1ajs h ASP 398 Cb 0.96 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.35 1ajs h ASP 398 CO -0.42 0.77 0.36 0.22 -1.72 0.00 0.00 179.24 178.45 1ajs h TYR 399 N -0.01 0.67 0.08 4.55 3.20 -1.75 0.40 116.97 124.10 1ajs h TYR 399 Ca 0.03 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ajs h TYR 399 Cb 0.66 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.72 1ajs h TYR 399 CO 0.08 0.32 -0.04 0.28 -1.64 0.00 0.00 178.16 177.17 1ajs h VAL 400 N 0.67 1.08 -0.81 1.81 2.07 -1.23 0.25 116.25 120.10 1ajs h VAL 400 Ca 0.29 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.34 1ajs h VAL 400 Cb 0.18 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.32 1ajs h VAL 400 CO -0.18 0.14 0.47 0.00 0.02 0.00 0.00 177.57 178.02 1ajs h ALA 401 N 0.56 1.13 -0.13 1.67 0.00 -1.00 0.72 119.26 122.20 1ajs h ALA 401 Ca -0.01 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1ajs h ALA 401 Cb 0.30 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ajs h ALA 401 CO 0.02 0.15 -0.32 1.79 0.00 0.00 0.00 179.25 180.89 1ajs h THR 402 N 0.83 1.37 -0.64 0.00 1.35 -0.85 -2.49 112.91 112.49 1ajs h THR 402 Ca 0.37 -1.60 -0.01 0.00 -0.55 0.00 0.00 66.41 64.62 1ajs h THR 402 Cb 0.27 2.05 -0.03 0.00 -1.73 0.00 0.00 68.15 68.71 1ajs h THR 402 CO -0.21 0.48 0.34 0.28 -0.25 0.00 0.00 175.52 176.16 1ajs h SER 403 N 0.05 0.79 -0.38 5.36 0.02 0.10 -2.31 113.55 117.19 1ajs h SER 403 Ca -0.00 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1ajs h SER 403 Cb 0.92 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1ajs h SER 403 CO 0.07 0.64 -0.05 0.40 -1.14 0.00 0.00 176.83 176.75 1ajs h ILE 404 N 0.89 1.27 -0.81 3.27 2.04 -0.88 -2.45 117.51 120.83 1ajs h ILE 404 Ca 0.23 -1.10 0.12 0.00 1.00 0.00 0.00 64.86 65.10 1ajs h ILE 404 Cb 0.04 1.21 -0.08 0.00 -0.74 0.00 0.00 36.82 37.25 1ajs h ILE 404 CO -0.04 0.37 0.43 -0.74 0.00 0.00 0.00 178.15 178.17 1ajs h HIS 405 N 0.52 0.76 -0.03 1.37 2.76 -0.95 -1.32 115.15 118.26 1ajs h HIS 405 Ca 0.10 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.28 1ajs h HIS 405 Cb 0.55 -0.22 -0.00 0.00 1.55 0.00 0.00 27.41 29.30 1ajs h HIS 405 CO 0.05 0.24 -0.05 0.93 -1.30 0.00 0.00 177.93 177.79 1ajs h GLU 406 N 0.66 0.09 -0.66 5.26 5.08 -1.38 -2.46 114.58 121.17 1ajs h GLU 406 Ca 0.42 -0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.86 1ajs h GLU 406 Cb 0.51 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 29.67 1ajs h GLU 406 CO -0.31 0.62 0.13 0.00 -1.00 0.00 0.00 179.01 178.44 1ajs h ALA 407 N 0.47 0.79 -0.42 3.43 0.00 -1.10 0.75 119.26 123.20 1ajs h ALA 407 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1ajs h ALA 407 Cb 0.61 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1ajs h ALA 407 CO 0.01 -0.33 -0.03 0.28 0.00 0.00 0.00 179.25 179.18 1ajs h VAL 408 N 0.24 1.24 0.01 0.00 2.07 -1.27 0.18 116.25 118.73 1ajs h VAL 408 Ca 0.36 -0.99 -0.31 0.00 0.82 0.00 0.00 66.70 66.57 1ajs h VAL 408 Cb 0.58 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 1ajs h VAL 408 CO -0.47 0.34 -1.87 0.35 0.02 0.00 0.00 177.57 175.95 1ajs n THR 409 N -4.22 1.59 -0.01 2.57 -2.24 -0.51 -4.52 114.28 106.95 1ajs n THR 409 Ca 0.02 -0.79 -0.22 0.00 -2.27 0.00 0.00 64.05 60.80 1ajs n THR 409 Cb 0.30 -1.03 -0.14 0.00 -2.10 0.00 0.00 70.33 67.37 1ajs n THR 409 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1ajs h LYS 410 N 0.01 0.22 -1.24 -0.78 1.57 0.47 -3.39 116.57 113.42 1ajs h LYS 410 Ca -0.35 -0.38 -0.28 0.00 -1.87 0.00 0.00 60.65 57.78 1ajs h LYS 410 Cb 2.05 0.14 -0.14 0.00 0.08 0.00 0.00 32.23 34.36 1ajs h LYS 410 CO 0.07 1.18 0.35 -0.89 -0.57 0.00 0.00 179.45 179.59 1ajs n ILE 411 N -3.81 2.36 0.00 1.86 2.08 0.64 -5.05 119.36 117.44 1ajs n ILE 411 Ca -0.29 -1.22 0.00 0.00 0.56 0.00 0.00 62.75 61.79 1ajs n ILE 411 Cb 0.94 -1.02 0.00 0.00 -0.75 0.00 0.00 39.64 38.81 1ajs n ILE 411 CO 0.00 0.00 0.00 1.67 0.56 0.00 0.00 176.55 178.78