#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hka s VAL 2 N 0.00 5.02 -0.03 12.58 1.01 -1.26 -0.58 120.40 137.14 1hka s VAL 2 Ca 0.00 0.55 -0.07 0.00 0.00 0.00 0.00 61.98 62.46 1hka s VAL 2 Cb 0.00 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1hka s VAL 2 CO 0.00 -0.12 0.24 0.00 0.00 0.00 0.00 175.10 175.22 1hka s ALA 3 N 2.40 3.85 -0.21 5.51 0.00 0.62 -0.49 121.76 133.44 1hka s ALA 3 Ca 0.20 -0.57 -0.03 0.00 0.00 0.00 0.00 51.96 51.56 1hka s ALA 3 Cb -0.15 -2.06 -0.01 0.00 0.00 0.00 0.00 23.12 20.90 1hka s ALA 3 CO 0.12 0.63 -0.06 0.71 0.00 0.00 0.00 175.76 177.16 1hka s TYR 4 N -1.20 2.94 -0.11 0.00 2.02 -0.35 -0.17 117.35 120.48 1hka s TYR 4 Ca 0.23 -0.91 0.01 0.00 -0.37 0.00 0.00 57.07 56.04 1hka s TYR 4 Cb -0.13 -2.06 -0.02 0.00 -0.40 0.00 0.00 41.96 39.35 1hka s TYR 4 CO 0.12 -0.50 -0.14 0.42 -1.57 0.00 0.00 175.55 173.89 1hka s ILE 5 N 1.30 2.99 0.01 2.71 1.01 -0.01 0.04 121.20 129.24 1hka s ILE 5 Ca 0.04 -0.70 -0.18 0.00 0.00 0.00 0.00 60.65 59.81 1hka s ILE 5 Cb -0.14 -2.23 -0.06 0.00 0.01 0.00 0.00 42.46 40.04 1hka s ILE 5 CO -0.03 0.54 0.50 0.00 0.00 0.00 0.00 174.94 175.95 1hka s ALA 6 N 0.14 3.60 -0.07 9.38 0.00 0.58 -0.58 121.76 134.81 1hka s ALA 6 Ca -0.07 -0.10 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1hka s ALA 6 Cb -0.15 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.40 1hka s ALA 6 CO 0.05 0.34 -0.25 0.42 0.00 0.00 0.00 175.76 176.32 1hka s ILE 7 N -0.71 2.07 -0.11 0.00 1.01 0.20 -1.49 121.20 122.17 1hka s ILE 7 Ca 0.27 -1.06 -0.06 0.00 0.00 0.00 0.00 60.65 59.80 1hka s ILE 7 Cb -0.18 -1.75 0.04 0.00 0.01 0.00 0.00 42.46 40.59 1hka s ILE 7 CO 0.15 0.57 0.25 -0.83 0.00 0.00 0.00 174.94 175.08 1hka s GLY 8 N -0.07 -0.16 -0.06 6.18 0.00 -0.02 -1.37 107.32 111.82 1hka s GLY 8 Ca -0.06 0.98 -0.14 0.00 0.00 0.00 0.00 44.72 45.49 1hka s GLY 8 CO 0.05 1.17 0.34 -0.45 0.00 0.00 0.00 173.10 174.21 1hka s SER 9 N 1.09 -0.28 -0.38 1.64 0.15 -0.77 -0.43 113.70 114.72 1hka s SER 9 Ca -0.08 0.37 0.11 0.00 0.70 0.00 0.00 55.95 57.04 1hka s SER 9 Cb -0.09 0.49 0.44 0.00 -1.71 0.00 0.00 66.02 65.15 1hka s SER 9 CO -0.07 -0.32 1.06 -0.46 1.20 0.00 0.00 173.24 174.64 1hka n ASN 10 N 1.91 3.43 -4.82 5.45 6.94 -1.26 -1.60 115.26 125.31 1hka n ASN 10 Ca -0.18 -3.29 -0.37 0.00 -0.02 0.00 0.00 54.58 50.72 1hka n ASN 10 Cb 0.57 -0.48 -0.06 0.00 -2.36 0.00 0.00 39.78 37.45 1hka n ASN 10 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1hka s LEU 11 N -3.41 4.45 -0.52 -4.53 2.96 -1.26 -4.75 118.68 111.62 1hka s LEU 11 Ca 0.40 1.29 -0.40 0.00 -0.22 0.00 0.00 54.13 55.21 1hka s LEU 11 Cb 0.42 -3.18 -0.17 0.00 0.50 0.00 0.00 46.19 43.76 1hka s LEU 11 CO -0.09 0.17 2.23 0.00 -1.32 0.00 0.00 176.35 177.35 1hka n ALA 12 N 1.27 0.47 -2.43 5.97 0.00 -1.26 0.58 120.51 125.10 1hka n ALA 12 Ca -0.07 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.37 1hka n ALA 12 Cb 0.51 -2.25 0.02 0.00 0.00 0.00 0.00 19.45 17.72 1hka n ALA 12 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1hka n SER 13 N 8.69 -5.00 0.27 0.00 7.64 -1.26 -4.92 113.62 119.05 1hka n SER 13 Ca 0.52 -0.20 0.15 0.00 1.01 0.00 0.00 58.87 60.35 1hka n SER 13 Cb 0.05 -3.32 0.69 0.00 -1.01 0.00 0.00 64.21 60.62 1hka n SER 13 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1hka h PRO 14 N -0.13 0.00 -0.35 1.43 0.13 -0.21 -3.25 132.00 129.63 1hka h PRO 14 Ca -0.15 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.02 1hka h PRO 14 Cb 1.08 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.17 1hka h PRO 14 CO 0.21 0.08 0.11 1.25 -0.23 0.00 0.00 178.00 179.41 1hka h LEU 15 N 0.00 0.11 -0.49 1.56 7.12 -1.91 0.61 115.31 122.31 1hka h LEU 15 Ca -0.00 0.04 0.06 0.00 0.13 0.00 0.00 57.88 58.11 1hka h LEU 15 Cb 0.50 0.03 -0.05 0.00 -0.53 0.00 0.00 40.66 40.61 1hka h LEU 15 CO 0.01 0.10 0.20 -0.08 -0.13 0.00 0.00 178.44 178.54 1hka h GLU 16 N 0.25 0.39 -0.60 1.25 4.81 -1.95 -1.00 114.58 117.73 1hka h GLU 16 Ca 0.16 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1hka h GLU 16 Cb 0.14 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1hka h GLU 16 CO -0.17 0.26 0.27 1.96 -0.73 0.00 0.00 179.01 180.60 1hka h GLN 17 N 0.40 0.88 -0.30 1.92 1.08 -1.10 -1.86 115.11 116.13 1hka h GLN 17 Ca 0.23 -0.14 -0.14 0.00 -1.45 0.00 0.00 58.65 57.15 1hka h GLN 17 Cb 0.20 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1hka h GLN 17 CO -0.20 0.72 -0.35 0.28 -0.95 0.00 0.00 178.83 178.32 1hka h VAL 18 N 0.83 1.29 -0.98 -0.54 2.07 0.41 -0.66 116.25 118.68 1hka h VAL 18 Ca 0.20 -1.53 0.01 0.00 0.82 0.00 0.00 66.70 66.20 1hka h VAL 18 Cb 0.15 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 1hka h VAL 18 CO -0.02 0.50 0.65 0.78 0.02 0.00 0.00 177.57 179.49 1hka h ASN 19 N 0.53 1.12 -0.40 0.57 2.35 -1.14 0.46 115.58 119.07 1hka h ASN 19 Ca 0.04 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.70 1hka h ASN 19 Cb 0.94 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.01 1hka h ASN 19 CO 0.08 0.81 0.03 0.00 -1.65 0.00 0.00 177.43 176.71 1hka h ALA 20 N 1.39 1.16 -0.41 -0.83 0.00 -1.04 -1.99 119.26 117.54 1hka h ALA 20 Ca 0.36 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1hka h ALA 20 Cb -0.15 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1hka h ALA 20 CO -0.08 0.55 -0.16 0.00 0.00 0.00 0.00 179.25 179.56 1hka h ALA 21 N 1.30 0.95 -0.59 0.00 0.00 -0.21 -1.84 119.26 118.88 1hka h ALA 21 Ca 0.15 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1hka h ALA 21 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1hka h ALA 21 CO 0.01 0.61 0.30 -0.07 0.00 0.00 0.00 179.25 180.10 1hka h LEU 22 N 0.68 0.76 -0.46 0.00 3.38 -0.61 0.94 115.31 119.99 1hka h LEU 22 Ca 0.11 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1hka h LEU 22 Cb 0.65 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1hka h LEU 22 CO 0.05 0.66 0.29 0.50 0.09 0.00 0.00 178.44 180.03 1hka h LYS 23 N 0.80 0.62 -0.80 1.13 3.64 -1.19 -0.81 116.57 119.97 1hka h LYS 23 Ca 0.20 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1hka h LYS 23 Cb 0.09 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 1hka h LYS 23 CO -0.03 0.44 0.51 0.00 -2.27 0.00 0.00 179.45 178.10 1hka h ALA 24 N 1.15 1.04 -0.71 5.00 0.00 -0.95 -1.68 119.26 123.11 1hka h ALA 24 Ca 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1hka h ALA 24 Cb -0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1hka h ALA 24 CO -0.03 0.34 0.27 -0.07 0.00 0.00 0.00 179.25 179.75 1hka h LEU 25 N 1.00 0.99 -1.96 0.00 3.38 -0.31 -1.90 115.31 116.50 1hka h LEU 25 Ca 0.32 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1hka h LEU 25 Cb -0.01 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 1hka h LEU 25 CO -0.11 0.90 -0.10 1.23 0.09 0.00 0.00 178.44 180.46 1hka h GLY 26 N 1.02 0.00 0.98 0.83 0.00 -0.71 -2.49 103.07 102.70 1hka h GLY 26 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1hka h GLY 26 CO -0.02 0.00 -0.14 1.22 0.00 0.00 0.00 176.54 177.61 1hka n ASP 27 N -4.07 0.45 -4.76 0.19 8.00 -0.67 -4.72 116.55 110.98 1hka n ASP 27 Ca -0.02 -0.47 -0.41 0.00 0.71 0.00 0.00 54.79 54.60 1hka n ASP 27 Cb 0.18 -0.08 -0.01 0.00 -0.02 0.00 0.00 41.12 41.19 1hka n ASP 27 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1hka s ILE 28 N -2.56 2.13 0.64 0.53 1.01 -0.94 -4.94 121.20 117.07 1hka s ILE 28 Ca 0.26 0.12 -0.17 0.00 0.00 0.00 0.00 60.65 60.86 1hka s ILE 28 Cb 0.20 -3.08 -0.01 0.00 0.01 0.00 0.00 42.46 39.58 1hka s ILE 28 CO 0.50 0.02 1.17 -2.16 0.00 0.00 0.00 174.94 174.47 1hka s PRO 29 N -0.92 2.77 -1.57 2.79 0.04 -1.26 -3.13 135.00 133.72 1hka s PRO 29 Ca 0.60 1.68 -0.01 0.00 0.04 0.00 0.00 61.00 63.31 1hka s PRO 29 Cb -0.47 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1hka s PRO 29 CO 0.51 -1.33 0.14 0.39 0.04 0.00 0.00 177.00 176.75 1hka n GLU 30 N -2.03 -2.48 -3.72 4.56 1.02 -1.26 -4.79 120.64 111.94 1hka n GLU 30 Ca 0.13 0.89 -0.14 0.00 -0.02 0.00 0.00 57.16 58.01 1hka n GLU 30 Cb 0.50 -5.58 -0.08 0.00 -0.02 0.00 0.00 31.44 26.27 1hka n GLU 30 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1hka s SER 31 N -2.20 -0.25 0.03 1.62 0.01 -1.18 -1.62 113.70 110.11 1hka s SER 31 Ca 0.07 0.13 -0.10 0.00 1.31 0.00 0.00 55.95 57.36 1hka s SER 31 Cb -0.03 0.35 0.01 0.00 0.21 0.00 0.00 66.02 66.55 1hka s SER 31 CO 0.09 -0.50 0.21 -1.38 0.41 0.00 0.00 173.24 172.07 1hka s HIS 32 N -1.52 0.02 -0.00 2.43 -3.43 -0.21 -4.75 115.29 107.83 1hka s HIS 32 Ca -0.12 -0.19 -0.30 0.00 -0.80 0.00 0.00 55.06 53.66 1hka s HIS 32 Cb -0.04 -0.01 -0.03 0.00 -1.43 0.00 0.00 32.58 31.07 1hka s HIS 32 CO 0.04 -0.42 1.06 0.42 -2.00 0.00 0.00 174.74 173.84 1hka s ILE 33 N -2.32 4.58 -0.14 -5.38 1.01 -1.26 -0.85 121.20 116.83 1hka s ILE 33 Ca -0.07 1.86 -0.19 0.00 0.00 0.00 0.00 60.65 62.24 1hka s ILE 33 Cb -0.02 -4.19 -0.24 0.00 0.01 0.00 0.00 42.46 38.01 1hka s ILE 33 CO -0.02 0.11 0.48 -0.07 0.00 0.00 0.00 174.94 175.43 1hka h LEU 34 N 7.11 0.20 -7.00 2.97 3.38 -0.98 -3.47 115.31 117.52 1hka h LEU 34 Ca -0.39 -0.77 -0.04 0.00 0.09 0.00 0.00 57.88 56.77 1hka h LEU 34 Cb 1.20 -0.06 -0.17 0.00 0.09 0.00 0.00 40.66 41.71 1hka h LEU 34 CO 0.79 1.49 0.22 0.28 0.09 0.00 0.00 178.44 181.31 1hka s THR 35 N -2.40 0.00 -0.05 0.22 -1.32 -1.16 -5.01 115.64 105.92 1hka s THR 35 Ca -0.23 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.31 1hka s THR 35 Cb 0.04 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.02 1hka s THR 35 CO 0.70 0.00 -0.23 -0.69 -2.21 0.00 0.00 174.62 172.19 1hka s VAL 36 N -1.85 1.88 1.12 5.08 1.01 -1.26 -0.72 120.40 125.65 1hka s VAL 36 Ca -0.07 -0.98 -0.15 0.00 0.00 0.00 0.00 61.98 60.78 1hka s VAL 36 Cb -0.00 -1.58 0.25 0.00 0.00 0.00 0.00 36.38 35.04 1hka s VAL 36 CO 0.03 0.53 1.08 -0.94 0.00 0.00 0.00 175.10 175.80 1hka s SER 37 N -0.20 1.58 0.94 3.32 1.04 0.19 -5.02 113.70 115.55 1hka s SER 37 Ca -0.01 1.04 -0.12 0.00 0.48 0.00 0.00 55.95 57.34 1hka s SER 37 Cb -0.12 -1.59 0.07 0.00 0.10 0.00 0.00 66.02 64.48 1hka s SER 37 CO 0.02 -3.76 0.66 -1.20 0.98 0.00 0.00 173.24 169.94 1hka n SER 38 N -4.58 -1.25 -4.70 7.02 7.64 -1.26 -4.81 113.62 111.67 1hka n SER 38 Ca 0.07 0.36 -0.39 0.00 1.01 0.00 0.00 58.87 59.92 1hka n SER 38 Cb 0.58 -1.30 -0.05 0.00 -1.01 0.00 0.00 64.21 62.42 1hka n SER 38 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1hka s PHE 39 N -2.47 3.50 0.26 1.43 0.08 -1.26 -4.62 117.98 114.90 1hka s PHE 39 Ca 0.60 1.06 0.09 0.00 0.12 0.00 0.00 56.93 58.80 1hka s PHE 39 Cb -0.22 -2.73 -0.04 0.00 -0.57 0.00 0.00 43.02 39.46 1hka s PHE 39 CO 0.64 0.04 0.05 0.71 -0.10 0.00 0.00 175.22 176.56 1hka s TYR 40 N 1.07 2.82 -0.13 0.36 1.51 -0.05 -0.30 117.35 122.62 1hka s TYR 40 Ca 0.32 -0.19 0.00 0.00 -1.01 0.00 0.00 57.07 56.19 1hka s TYR 40 Cb -0.16 -1.25 -0.01 0.00 -0.11 0.00 0.00 41.96 40.42 1hka s TYR 40 CO 0.14 0.59 -0.14 0.50 -1.11 0.00 0.00 175.55 175.53 1hka s ARG 41 N -3.72 3.35 -0.02 -0.62 3.52 0.12 -1.28 118.95 120.30 1hka s ARG 41 Ca 0.32 -0.70 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 1hka s ARG 41 Cb -0.07 -2.62 0.00 0.00 -1.56 0.00 0.00 34.95 30.70 1hka s ARG 41 CO 0.21 0.19 -0.08 0.95 -0.81 0.00 0.00 175.30 175.76 1hka s THR 42 N 0.41 0.72 0.56 4.11 -4.23 0.03 -3.93 115.64 113.30 1hka s THR 42 Ca -0.11 -0.34 -0.20 0.00 -1.18 0.00 0.00 61.69 59.86 1hka s THR 42 Cb -0.16 -0.63 -0.04 0.00 1.34 0.00 0.00 72.50 73.01 1hka s THR 42 CO 0.05 0.22 1.26 -2.16 -0.54 0.00 0.00 174.62 173.45 1hka s PRO 43 N 0.08 3.09 0.97 3.99 0.04 -1.26 -0.40 135.00 141.51 1hka s PRO 43 Ca -0.01 1.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.90 1hka s PRO 43 Cb -0.07 -2.10 0.14 0.00 0.04 0.00 0.00 34.50 32.52 1hka s PRO 43 CO 0.00 -1.15 0.91 -0.35 0.04 0.00 0.00 177.00 176.45 1hka n PRO 44 N -1.28 -0.78 -3.84 0.56 -0.04 -1.26 -4.73 135.00 123.63 1hka n PRO 44 Ca 0.12 -0.17 -0.35 0.00 -0.04 0.00 0.00 63.50 63.06 1hka n PRO 44 Cb 0.48 -2.20 -0.09 0.00 -0.04 0.00 0.00 33.50 31.64 1hka n PRO 44 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1hka s LEU 45 N -5.22 3.97 0.00 1.53 1.98 -1.26 -4.96 118.68 114.71 1hka s LEU 45 Ca 0.64 0.11 0.00 0.00 -2.89 0.00 0.00 54.13 52.00 1hka s LEU 45 Cb -0.22 -2.03 0.00 0.00 0.66 0.00 0.00 46.19 44.60 1hka s LEU 45 CO 0.62 0.14 0.00 0.61 -1.89 0.00 0.00 176.35 175.83 1hka n GLY 46 N 3.77 2.95 0.05 7.98 0.00 -1.26 -4.86 105.19 113.81 1hka n GLY 46 Ca -0.16 -1.52 0.09 0.00 0.00 0.00 0.00 46.02 44.43 1hka n GLY 46 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hka n PRO 47 N 0.90 0.07 0.08 1.61 -0.04 -1.26 -2.95 135.00 133.41 1hka n PRO 47 Ca 0.00 0.32 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 1hka n PRO 47 Cb 0.00 -1.64 0.40 0.00 -0.04 0.00 0.00 33.50 32.21 1hka n PRO 47 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1hka n GLN 48 N -1.78 0.11 -2.34 0.54 3.00 -1.26 -4.90 117.38 110.74 1hka n GLN 48 Ca 0.03 0.40 -0.03 0.00 -0.01 0.00 0.00 57.00 57.39 1hka n GLN 48 Cb 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 30.24 28.71 1hka n GLN 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1hka n ASP 49 N -1.93 -5.88 -4.82 1.08 -0.08 -1.15 -5.07 116.55 98.69 1hka n ASP 49 Ca 0.02 0.57 -0.22 0.00 -1.51 0.00 0.00 54.79 53.65 1hka n ASP 49 Cb 0.16 -3.84 0.09 0.00 2.34 0.00 0.00 41.12 39.87 1hka n ASP 49 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1hka s GLN 50 N -1.67 1.95 0.77 -0.67 -1.52 -1.26 -5.08 119.66 112.17 1hka s GLN 50 Ca 0.10 -1.31 -0.12 0.00 -1.95 0.00 0.00 55.36 52.09 1hka s GLN 50 Cb -0.03 -2.46 0.06 0.00 -0.22 0.00 0.00 33.01 30.36 1hka s GLN 50 CO 0.50 -1.19 1.11 -2.14 -0.25 0.00 0.00 175.29 173.33 1hka s PRO 51 N -4.94 2.16 0.53 2.91 0.02 -1.26 -4.63 135.00 129.79 1hka s PRO 51 Ca 0.64 1.30 -0.21 0.00 0.02 0.00 0.00 61.00 62.75 1hka s PRO 51 Cb -0.06 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 32.53 1hka s PRO 51 CO 0.42 -1.73 1.23 -0.51 -0.33 0.00 0.00 177.00 176.08 1hka s ASP 52 N -3.05 5.62 0.11 2.53 1.01 -1.26 -4.22 116.67 117.41 1hka s ASP 52 Ca 0.64 2.45 -0.21 0.00 0.71 0.00 0.00 52.55 56.15 1hka s ASP 52 Cb -0.19 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 41.06 1hka s ASP 52 CO 0.53 -1.31 0.63 -0.31 0.21 0.00 0.00 175.17 174.92 1hka s TYR 53 N -1.50 3.81 -0.17 4.23 1.51 0.46 -4.56 117.35 121.14 1hka s TYR 53 Ca 0.70 1.36 -0.15 0.00 -1.01 0.00 0.00 57.07 57.97 1hka s TYR 53 Cb -0.32 -2.56 -0.04 0.00 -0.11 0.00 0.00 41.96 38.92 1hka s TYR 53 CO 0.38 0.55 0.36 -1.17 -1.11 0.00 0.00 175.55 174.56 1hka s LEU 54 N -1.22 4.21 -0.02 -1.29 0.20 -0.63 -0.79 118.68 119.14 1hka s LEU 54 Ca 0.32 0.55 0.06 0.00 0.69 0.00 0.00 54.13 55.75 1hka s LEU 54 Cb -0.20 -2.48 -0.01 0.00 -0.43 0.00 0.00 46.19 43.07 1hka s LEU 54 CO 0.21 0.01 -0.21 0.20 -0.29 0.00 0.00 176.35 176.27 1hka s ASN 55 N 0.75 2.49 0.28 3.68 0.01 -0.41 -1.85 114.94 119.89 1hka s ASN 55 Ca 0.19 -0.39 -0.16 0.00 -0.71 0.00 0.00 52.86 51.80 1hka s ASN 55 Cb -0.14 -0.35 0.01 0.00 0.41 0.00 0.00 41.25 41.19 1hka s ASN 55 CO 0.07 0.25 0.61 0.00 -1.51 0.00 0.00 177.10 176.51 1hka s ALA 56 N -0.42 -0.60 0.01 0.60 0.00 -0.47 -0.87 121.76 120.00 1hka s ALA 56 Ca 0.06 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.39 1hka s ALA 56 Cb -0.09 0.95 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 1hka s ALA 56 CO -0.00 -0.94 -0.18 0.00 0.00 0.00 0.00 175.76 174.64 1hka s ALA 57 N -3.72 1.50 -0.05 0.00 0.00 -1.26 -0.63 121.76 117.61 1hka s ALA 57 Ca 0.18 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1hka s ALA 57 Cb -0.03 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.76 1hka s ALA 57 CO 0.09 0.35 -0.15 0.08 0.00 0.00 0.00 175.76 176.12 1hka s VAL 58 N -0.61 1.32 -0.27 0.00 1.01 0.25 -0.64 120.40 121.46 1hka s VAL 58 Ca 0.06 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.28 1hka s VAL 58 Cb -0.08 -1.15 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 1hka s VAL 58 CO 0.00 0.39 0.23 0.00 0.00 0.00 0.00 175.10 175.72 1hka s ALA 59 N 0.21 3.55 -0.20 5.51 0.00 0.11 -0.83 121.76 130.10 1hka s ALA 59 Ca -0.07 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1hka s ALA 59 Cb -0.12 -2.51 0.03 0.00 0.00 0.00 0.00 23.12 20.52 1hka s ALA 59 CO 0.03 -0.52 -0.17 -1.17 0.00 0.00 0.00 175.76 173.93 1hka s LEU 60 N 1.72 2.51 0.02 0.00 2.96 0.76 -0.24 118.68 126.41 1hka s LEU 60 Ca 0.09 -0.83 -0.29 0.00 -0.22 0.00 0.00 54.13 52.88 1hka s LEU 60 Cb -0.16 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 1hka s LEU 60 CO 0.10 -0.05 0.92 -0.70 -1.32 0.00 0.00 176.35 175.30 1hka s GLU 61 N 1.25 4.57 -0.05 1.98 2.56 -0.03 -0.28 118.70 128.71 1hka s GLU 61 Ca 0.02 1.33 -0.17 0.00 0.00 0.00 0.00 54.97 56.15 1hka s GLU 61 Cb -0.15 -3.43 0.03 0.00 2.00 0.00 0.00 34.13 32.58 1hka s GLU 61 CO -0.10 0.06 0.38 -0.08 -0.56 0.00 0.00 175.26 174.95 1hka s THR 62 N 0.64 0.04 -1.28 -1.70 -1.32 0.25 -1.04 115.64 111.23 1hka s THR 62 Ca 0.48 -0.31 0.14 0.00 -1.21 0.00 0.00 61.69 60.78 1hka s THR 62 Cb -0.21 -0.65 0.34 0.00 -1.51 0.00 0.00 72.50 70.46 1hka s THR 62 CO 0.27 -0.17 1.26 -1.54 -2.21 0.00 0.00 174.62 172.23 1hka n SER 63 N 1.56 3.00 -4.77 8.08 3.41 -0.64 -1.33 113.62 122.94 1hka n SER 63 Ca -0.19 -1.93 -0.34 0.00 -0.26 0.00 0.00 58.87 56.15 1hka n SER 63 Cb 0.56 -0.24 0.02 0.00 -0.26 0.00 0.00 64.21 64.29 1hka n SER 63 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1hka s LEU 64 N -1.03 3.59 0.63 1.04 1.43 -1.26 -5.03 118.68 118.05 1hka s LEU 64 Ca 0.27 2.10 -0.15 0.00 -1.03 0.00 0.00 54.13 55.32 1hka s LEU 64 Cb 0.15 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.78 1hka s LEU 64 CO 0.20 -1.40 1.08 0.00 0.23 0.00 0.00 176.35 176.46 1hka s ALA 65 N -2.02 2.59 0.24 4.21 0.00 -1.26 -4.82 121.76 120.70 1hka s ALA 65 Ca 0.70 0.45 -0.05 0.00 0.00 0.00 0.00 51.96 53.07 1hka s ALA 65 Cb -0.22 -3.27 0.42 0.00 0.00 0.00 0.00 23.12 20.05 1hka s ALA 65 CO 0.33 -1.08 1.76 -1.00 0.00 0.00 0.00 175.76 175.77 1hka h PRO 66 N 0.15 0.53 0.00 0.00 0.13 -2.00 -0.59 132.00 130.22 1hka h PRO 66 Ca -0.47 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 1hka h PRO 66 Cb 1.23 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1hka h PRO 66 CO 0.56 0.35 -0.19 0.93 -0.23 0.00 0.00 178.00 179.42 1hka h GLU 67 N 0.55 0.00 -0.41 0.86 5.08 -1.99 -1.40 114.58 117.26 1hka h GLU 67 Ca 0.40 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.68 1hka h GLU 67 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1hka h GLU 67 CO -0.34 0.19 -0.06 0.93 -1.00 0.00 0.00 179.01 178.73 1hka h GLU 68 N 0.00 0.77 -0.75 2.33 5.08 -1.53 -1.37 114.58 119.11 1hka h GLU 68 Ca -0.00 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 1hka h GLU 68 Cb 0.83 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.99 1hka h GLU 68 CO 0.02 0.88 0.34 1.25 -1.00 0.00 0.00 179.01 180.51 1hka h LEU 69 N 0.60 0.98 -0.66 1.33 5.85 -0.68 -2.15 115.31 120.58 1hka h LEU 69 Ca 0.11 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1hka h LEU 69 Cb 0.57 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 1hka h LEU 69 CO 0.03 0.84 0.37 0.25 -0.34 0.00 0.00 178.44 179.59 1hka h LEU 70 N 1.07 0.54 -0.78 2.25 5.85 -1.02 0.29 115.31 123.51 1hka h LEU 70 Ca 0.26 0.03 0.12 0.00 0.84 0.00 0.00 57.88 59.13 1hka h LEU 70 Cb 0.13 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 1hka h LEU 70 CO -0.03 0.35 0.38 0.78 -0.34 0.00 0.00 178.44 179.59 1hka h ASN 71 N 0.68 0.47 -0.22 1.25 2.35 -0.61 0.33 115.58 119.82 1hka h ASN 71 Ca 0.29 0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.99 1hka h ASN 71 Cb 0.18 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1hka h ASN 71 CO -0.18 0.23 -0.39 0.45 -1.65 0.00 0.00 177.43 175.89 1hka h HIS 72 N 0.60 0.82 -0.47 1.19 3.86 -0.89 0.06 115.15 120.32 1hka h HIS 72 Ca 0.41 -0.29 -0.08 0.00 -1.16 0.00 0.00 60.37 59.25 1hka h HIS 72 Cb 0.52 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 1hka h HIS 72 CO -0.11 1.05 -0.02 1.79 0.86 0.00 0.00 177.93 181.50 1hka h THR 73 N 0.36 1.25 -0.70 2.45 1.35 -0.46 0.32 112.91 117.48 1hka h THR 73 Ca 0.01 -1.04 -0.06 0.00 -0.55 0.00 0.00 66.41 64.78 1hka h THR 73 Cb 0.99 0.91 -0.03 0.00 -1.73 0.00 0.00 68.15 68.28 1hka h THR 73 CO 0.09 0.36 0.21 1.56 -0.25 0.00 0.00 175.52 177.50 1hka h GLN 74 N 0.74 1.09 -0.43 4.72 4.20 -0.85 -0.58 115.11 124.00 1hka h GLN 74 Ca 0.14 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1hka h GLN 74 Cb 0.48 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1hka h GLN 74 CO 0.02 0.94 0.22 -0.09 -0.67 0.00 0.00 178.83 179.26 1hka h ARG 75 N 1.03 0.60 -0.81 1.46 2.43 -0.46 -1.01 114.38 117.62 1hka h ARG 75 Ca 0.22 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1hka h ARG 75 Cb 0.31 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1hka h ARG 75 CO -0.01 0.50 0.34 0.82 -1.51 0.00 0.00 179.97 180.11 1hka h ILE 76 N 0.56 1.26 -0.81 1.20 2.04 -0.67 0.25 117.51 121.34 1hka h ILE 76 Ca 0.15 -0.80 0.04 0.00 1.00 0.00 0.00 64.86 65.25 1hka h ILE 76 Cb 0.08 0.28 -0.05 0.00 -0.74 0.00 0.00 36.82 36.39 1hka h ILE 76 CO -0.02 0.33 0.51 -0.33 0.00 0.00 0.00 178.15 178.64 1hka h GLU 77 N 1.17 0.96 -0.56 2.37 5.08 -0.78 0.23 114.58 123.05 1hka h GLU 77 Ca 0.27 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1hka h GLU 77 Cb 0.19 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1hka h GLU 77 CO -0.03 0.63 0.06 -0.07 -1.00 0.00 0.00 179.01 178.60 1hka h LEU 78 N 0.99 0.91 0.02 1.33 3.38 -0.53 -2.08 115.31 119.33 1hka h LEU 78 Ca 0.33 -0.28 -0.23 0.00 0.09 0.00 0.00 57.88 57.79 1hka h LEU 78 Cb 0.05 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1hka h LEU 78 CO -0.13 0.97 -1.08 1.56 0.09 0.00 0.00 178.44 179.85 1hka h GLN 79 N 0.83 0.13 -0.02 1.13 4.20 -0.01 -3.35 115.11 118.02 1hka h GLN 79 Ca 0.16 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1hka h GLN 79 Cb 0.46 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1hka h GLN 79 CO 0.02 1.08 -0.20 1.04 -0.67 0.00 0.00 178.83 180.10 1hka n GLN 80 N -3.46 1.56 -2.93 1.46 1.13 0.76 -5.03 117.38 110.88 1hka n GLN 80 Ca -0.04 -1.15 -0.08 0.00 -1.94 0.00 0.00 57.00 53.80 1hka n GLN 80 Cb 0.96 -1.32 -0.01 0.00 0.11 0.00 0.00 30.24 29.98 1hka n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1hka n GLY 81 N 1.11 2.11 3.56 1.08 0.00 -0.78 -4.83 105.19 107.43 1hka n GLY 81 Ca 0.08 -1.40 -0.09 0.00 0.00 0.00 0.00 46.02 44.62 1hka n GLY 81 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1hka s ARG 82 N -2.34 1.48 0.56 1.61 1.70 -1.26 -4.58 118.95 116.11 1hka s ARG 82 Ca 0.15 -1.16 -0.08 0.00 -0.47 0.00 0.00 55.73 54.17 1hka s ARG 82 Cb -0.01 0.48 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 1hka s ARG 82 CO 0.11 -0.61 0.91 0.14 -1.08 0.00 0.00 175.30 174.77 1hka s VAL 83 N -3.98 4.72 -0.32 4.99 -7.23 -1.26 -0.34 120.40 116.99 1hka s VAL 83 Ca 0.19 0.52 -0.24 0.00 -1.81 0.00 0.00 61.98 60.63 1hka s VAL 83 Cb -0.00 -3.84 0.00 0.00 0.56 0.00 0.00 36.38 33.10 1hka s VAL 83 CO 0.06 -0.97 0.84 -0.13 -0.31 0.00 0.00 175.10 174.58 1hka s ARG 84 N -4.98 3.96 0.44 4.82 1.81 -1.26 -4.87 118.95 118.87 1hka s ARG 84 Ca 0.52 0.64 0.17 0.00 -1.72 0.00 0.00 55.73 55.33 1hka s ARG 84 Cb -0.11 -3.74 1.09 0.00 -0.45 0.00 0.00 34.95 31.74 1hka s ARG 84 CO 0.49 -0.74 1.92 -0.22 -0.68 0.00 0.00 175.30 176.08 1hka h LYS 85 N 8.15 0.37 0.03 3.54 3.64 -1.96 0.37 116.57 130.71 1hka h LYS 85 Ca -0.24 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 58.90 1hka h LYS 85 Cb 1.09 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.81 1hka h LYS 85 CO 0.91 0.24 -1.03 0.00 -2.27 0.00 0.00 179.45 177.31 1hka h ALA 86 N 1.65 0.33 -2.14 5.00 0.00 -2.04 -3.36 119.26 118.70 1hka h ALA 86 Ca 0.36 -0.88 -0.57 0.00 0.00 0.00 0.00 54.91 53.82 1hka h ALA 86 Cb 0.88 -0.12 -0.42 0.00 0.00 0.00 0.00 17.79 18.13 1hka h ALA 86 CO -0.11 1.16 -0.73 0.39 0.00 0.00 0.00 179.25 179.96 1hka n GLU 87 N -3.42 2.94 -0.32 0.00 1.02 0.11 -4.91 120.64 116.06 1hka n GLU 87 Ca -0.02 -4.61 0.31 0.00 -0.02 0.00 0.00 57.16 52.82 1hka n GLU 87 Cb 0.94 -2.15 0.57 0.00 -0.02 0.00 0.00 31.44 30.77 1hka n GLU 87 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1hka n ARG 88 N -0.21 -0.06 0.19 3.49 1.74 -0.19 0.19 116.66 121.82 1hka n ARG 88 Ca 0.31 1.39 0.09 0.00 -0.77 0.00 0.00 57.85 58.86 1hka n ARG 88 Cb 0.46 -2.47 0.13 0.00 -1.02 0.00 0.00 32.46 29.57 1hka n ARG 88 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1hka h TRP 89 N 0.00 0.00 -1.54 -1.55 0.09 -1.91 -3.43 115.95 107.60 1hka h TRP 89 Ca 0.83 0.00 -0.05 0.00 0.09 0.00 0.00 58.89 59.76 1hka h TRP 89 Cb 2.17 0.00 0.03 0.00 0.08 0.00 0.00 29.16 31.44 1hka h TRP 89 CO -0.05 0.17 0.00 0.41 0.09 0.00 0.00 178.44 179.06 1hka n GLY 90 N 1.12 -2.98 3.78 11.11 0.00 0.50 -4.97 105.19 113.76 1hka n GLY 90 Ca 0.03 -1.37 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 1hka n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hka s PRO 91 N -3.29 3.08 0.69 1.61 0.04 -1.26 -4.88 135.00 130.99 1hka s PRO 91 Ca 0.09 1.37 -0.07 0.00 0.04 0.00 0.00 61.00 62.42 1hka s PRO 91 Cb -0.01 -1.99 0.05 0.00 0.04 0.00 0.00 34.50 32.59 1hka s PRO 91 CO 0.07 -1.02 1.01 1.03 0.04 0.00 0.00 177.00 178.13 1hka s ARG 92 N -3.93 2.33 0.51 4.56 0.52 -1.26 -4.45 118.95 117.23 1hka s ARG 92 Ca 0.67 -0.16 0.34 0.00 -0.52 0.00 0.00 55.73 56.05 1hka s ARG 92 Cb -0.19 -2.17 1.51 0.00 0.52 0.00 0.00 34.95 34.61 1hka s ARG 92 CO 0.37 -1.16 2.00 1.79 0.02 0.00 0.00 175.30 178.32 1hka h THR 93 N -0.55 0.00 -3.25 0.02 1.35 -1.02 -3.39 112.91 106.07 1hka h THR 93 Ca -0.45 -0.33 -0.42 0.00 -0.55 0.00 0.00 66.41 64.66 1hka h THR 93 Cb 1.30 1.26 -0.39 0.00 -1.73 0.00 0.00 68.15 68.59 1hka h THR 93 CO 0.61 0.00 -0.75 -0.22 -0.25 0.00 0.00 175.52 174.91 1hka s LEU 94 N -5.79 0.41 -0.17 3.87 2.96 -1.26 -4.03 118.68 114.67 1hka s LEU 94 Ca 0.00 -0.15 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 1hka s LEU 94 Cb 0.10 -0.30 -0.03 0.00 0.50 0.00 0.00 46.19 46.46 1hka s LEU 94 CO 0.47 -0.25 0.01 -1.81 -1.32 0.00 0.00 176.35 173.45 1hka s ASP 95 N 2.07 5.14 -0.13 3.68 1.11 0.43 -4.81 116.67 124.16 1hka s ASP 95 Ca 0.04 -0.06 0.01 0.00 0.18 0.00 0.00 52.55 52.73 1hka s ASP 95 Cb -0.13 -1.86 0.02 0.00 1.07 0.00 0.00 42.92 42.01 1hka s ASP 95 CO -0.05 0.15 -0.16 -0.76 1.18 0.00 0.00 175.17 175.54 1hka s LEU 96 N 0.47 1.75 -0.07 1.23 1.43 -1.26 -0.84 118.68 121.40 1hka s LEU 96 Ca -0.00 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1hka s LEU 96 Cb -0.14 -1.17 0.01 0.00 0.03 0.00 0.00 46.19 44.92 1hka s LEU 96 CO 0.02 -0.01 -0.16 -1.81 0.23 0.00 0.00 176.35 174.62 1hka s ASP 97 N 1.18 2.22 -0.37 2.29 1.01 -0.56 -4.96 116.67 117.48 1hka s ASP 97 Ca -0.02 -0.39 -0.29 0.00 0.71 0.00 0.00 52.55 52.57 1hka s ASP 97 Cb -0.14 -0.99 0.02 0.00 1.01 0.00 0.00 42.92 42.81 1hka s ASP 97 CO -0.06 0.08 1.21 -0.63 0.21 0.00 0.00 175.17 175.99 1hka s ILE 98 N 0.51 4.22 -0.09 0.77 1.01 -1.26 -0.31 121.20 126.05 1hka s ILE 98 Ca -0.15 1.34 -0.19 0.00 0.00 0.00 0.00 60.65 61.65 1hka s ILE 98 Cb -0.16 -4.37 -0.28 0.00 0.01 0.00 0.00 42.46 37.66 1hka s ILE 98 CO 0.05 -0.68 0.68 0.24 0.00 0.00 0.00 174.94 175.24 1hka h MET 99 N 9.15 0.25 -3.64 2.79 2.86 -0.76 -3.37 114.93 122.20 1hka h MET 99 Ca -0.24 -0.42 -0.15 0.00 -2.06 0.00 0.00 59.70 56.83 1hka h MET 99 Cb 1.08 0.16 -0.21 0.00 0.06 0.00 0.00 31.60 32.68 1hka h MET 99 CO 1.07 1.20 -0.55 -0.51 1.06 0.00 0.00 176.91 179.18 1hka s LEU 100 N -7.72 1.75 -0.36 1.22 1.43 -1.13 -1.22 118.68 112.66 1hka s LEU 100 Ca -0.18 -0.28 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1hka s LEU 100 Cb 0.03 0.50 0.12 0.00 0.03 0.00 0.00 46.19 46.87 1hka s LEU 100 CO 0.78 -0.34 0.18 0.12 0.23 0.00 0.00 176.35 177.32 1hka s PHE 101 N -1.36 1.33 0.00 0.29 2.19 -1.26 -1.21 117.98 117.95 1hka s PHE 101 Ca -0.15 -1.82 0.00 0.00 0.33 0.00 0.00 56.93 55.30 1hka s PHE 101 Cb -0.08 -1.43 0.00 0.00 -1.31 0.00 0.00 43.02 40.20 1hka s PHE 101 CO 0.01 -0.83 0.00 0.41 1.83 0.00 0.00 175.22 176.64 1hka n GLY 102 N 4.24 2.83 1.35 13.12 0.00 0.36 -1.26 105.19 125.84 1hka n GLY 102 Ca 0.05 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.99 1hka n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hka n ASN 103 N 1.96 4.68 -4.79 1.61 5.15 -1.26 -4.91 115.26 117.71 1hka n ASN 103 Ca 0.00 -2.88 -0.36 0.00 -0.60 0.00 0.00 54.58 50.74 1hka n ASN 103 Cb 0.00 -0.59 -0.06 0.00 -0.53 0.00 0.00 39.78 38.60 1hka n ASN 103 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1hka s GLU 104 N -2.62 4.41 -0.14 1.20 2.02 -0.39 -4.69 118.70 118.49 1hka s GLU 104 Ca 0.47 1.34 -0.02 0.00 0.02 0.00 0.00 54.97 56.78 1hka s GLU 104 Cb 0.36 -2.62 -0.02 0.00 0.10 0.00 0.00 34.13 31.95 1hka s GLU 104 CO 0.14 0.12 -0.09 0.08 0.02 0.00 0.00 175.26 175.52 1hka s VAL 105 N -1.73 3.42 -0.03 2.63 1.01 -1.26 -4.46 120.40 119.98 1hka s VAL 105 Ca 0.54 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 1hka s VAL 105 Cb -0.18 -2.47 0.03 0.00 0.00 0.00 0.00 36.38 33.77 1hka s VAL 105 CO 0.23 0.51 0.02 -0.63 0.00 0.00 0.00 175.10 175.23 1hka s ILE 106 N 0.31 0.10 -0.45 2.22 1.01 0.03 -4.98 121.20 119.43 1hka s ILE 106 Ca -0.07 0.17 0.06 0.00 0.00 0.00 0.00 60.65 60.80 1hka s ILE 106 Cb -0.15 -0.23 0.20 0.00 0.01 0.00 0.00 42.46 42.29 1hka s ILE 106 CO 0.04 0.15 0.45 0.59 0.00 0.00 0.00 174.94 176.17 1hka n ASN 107 N 4.40 0.42 -4.71 3.58 4.13 -1.25 -0.61 115.26 121.22 1hka n ASN 107 Ca -0.22 -2.65 -0.24 0.00 1.68 0.00 0.00 54.58 53.15 1hka n ASN 107 Cb 0.50 -0.61 -0.07 0.00 -1.54 0.00 0.00 39.78 38.06 1hka n ASN 107 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1hka s THR 108 N -0.72 2.62 0.27 3.41 -4.23 -0.07 -5.01 115.64 111.92 1hka s THR 108 Ca 0.33 -1.75 -0.00 0.00 -1.18 0.00 0.00 61.69 59.09 1hka s THR 108 Cb 0.08 -2.94 0.27 0.00 1.34 0.00 0.00 72.50 71.25 1hka s THR 108 CO -0.15 -0.11 1.83 -0.08 -0.54 0.00 0.00 174.62 175.57 1hka h GLU 109 N 1.55 0.94 0.00 3.99 4.81 -2.05 -2.72 114.58 121.09 1hka h GLU 109 Ca -0.43 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1hka h GLU 109 Cb 1.25 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1hka h GLU 109 CO 0.67 0.62 -1.10 2.89 -0.73 0.00 0.00 179.01 181.36 1hka n ARG 110 N -4.64 0.28 -3.74 1.92 1.85 -1.26 -4.92 116.66 106.14 1hka n ARG 110 Ca 0.18 -0.02 -0.16 0.00 -1.00 0.00 0.00 57.85 56.85 1hka n ARG 110 Cb 0.33 -1.57 -0.16 0.00 -1.05 0.00 0.00 32.46 30.00 1hka n ARG 110 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1hka s LEU 111 N -3.83 0.79 -0.19 2.89 2.96 -1.03 -5.11 118.68 115.16 1hka s LEU 111 Ca 0.03 0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 1hka s LEU 111 Cb 0.15 -0.01 0.03 0.00 0.50 0.00 0.00 46.19 46.86 1hka s LEU 111 CO 0.82 -0.16 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.65 1hka s THR 112 N 1.36 1.83 -0.04 3.68 2.01 -1.26 -0.89 115.64 122.33 1hka s THR 112 Ca -0.06 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.02 1hka s THR 112 Cb -0.13 -1.76 0.00 0.00 0.01 0.00 0.00 72.50 70.62 1hka s THR 112 CO -0.04 0.35 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.44 1hka s VAL 113 N 1.35 1.06 0.80 3.82 1.01 0.22 -3.86 120.40 124.80 1hka s VAL 113 Ca 0.02 -0.50 -0.14 0.00 0.00 0.00 0.00 61.98 61.36 1hka s VAL 113 Cb -0.15 -0.93 0.06 0.00 0.00 0.00 0.00 36.38 35.37 1hka s VAL 113 CO -0.10 0.32 1.06 -2.65 0.00 0.00 0.00 175.10 173.73 1hka n PRO 114 N 3.31 0.20 -1.62 2.72 -0.02 -1.26 -0.79 135.00 137.53 1hka n PRO 114 Ca -0.19 0.14 -0.49 0.00 -2.02 0.00 0.00 63.50 60.94 1hka n PRO 114 Cb 0.53 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.64 1hka n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1hka n HIS 115 N -3.15 1.81 0.29 6.00 -0.00 -0.35 -4.81 115.22 115.01 1hka n HIS 115 Ca 0.13 0.50 0.14 0.00 -0.00 0.00 0.00 57.72 58.48 1hka n HIS 115 Cb 0.50 -2.41 0.65 0.00 -0.00 0.00 0.00 29.99 28.73 1hka n HIS 115 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 1hka h TYR 116 N 4.86 0.00 0.00 1.57 -0.00 -1.94 -2.81 116.97 118.66 1hka h TYR 116 Ca -0.46 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.27 1hka h TYR 116 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.03 1hka h TYR 116 CO 0.60 0.00 0.00 -3.47 -0.00 0.00 0.00 178.16 175.29 1hka n ASP 117 N -2.47 1.38 0.25 0.10 2.03 -1.26 -4.81 116.55 111.78 1hka n ASP 117 Ca -0.00 -1.45 0.09 0.00 0.52 0.00 0.00 54.79 53.94 1hka n ASP 117 Cb 0.15 0.00 0.65 0.00 -0.72 0.00 0.00 41.12 41.19 1hka n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hka h MET 118 N 0.00 0.00 0.00 -0.67 -0.00 -1.87 -0.38 114.93 112.01 1hka h MET 118 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1hka h MET 118 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.88 1hka h MET 118 CO 0.00 0.06 0.00 1.63 -0.00 0.00 0.00 176.91 178.60 1hka n LYS 119 N -4.31 0.10 0.00 -0.10 5.02 -1.26 -1.74 118.16 115.88 1hka n LYS 119 Ca -0.03 0.18 0.11 0.00 -2.02 0.00 0.00 58.31 56.56 1hka n LYS 119 Cb 0.15 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 33.75 1hka n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1hka n ASN 120 N -1.41 2.87 -4.05 4.39 3.02 -0.16 -4.89 115.26 115.03 1hka n ASN 120 Ca 0.06 -1.93 -0.32 0.00 -0.03 0.00 0.00 54.58 52.35 1hka n ASN 120 Cb 0.16 0.02 -0.14 0.00 -0.61 0.00 0.00 39.78 39.21 1hka n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1hka s ARG 121 N -1.92 1.67 0.46 3.52 0.52 -0.71 -4.95 118.95 117.54 1hka s ARG 121 Ca 0.26 -1.80 0.18 0.00 -0.52 0.00 0.00 55.73 53.85 1hka s ARG 121 Cb 0.19 -3.24 1.14 0.00 0.52 0.00 0.00 34.95 33.56 1hka s ARG 121 CO 0.29 -0.92 1.96 0.78 0.02 0.00 0.00 175.30 177.44 1hka h GLY 122 N 7.71 0.47 2.00 -3.53 0.00 -1.90 -0.31 103.07 107.50 1hka h GLY 122 Ca -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1hka h GLY 122 CO 0.54 0.06 0.00 0.27 0.00 0.00 0.00 176.54 177.41 1hka h PHE 123 N 0.30 0.00 0.12 5.60 -5.15 -1.94 -0.36 116.94 115.51 1hka h PHE 123 Ca 0.30 0.00 -0.36 0.00 -0.20 0.00 0.00 57.97 57.72 1hka h PHE 123 Cb 0.78 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.93 1hka h PHE 123 CO -0.00 0.00 -1.94 -1.33 -2.00 0.00 0.00 178.31 173.04 1hka n MET 124 N -2.84 0.75 -0.06 6.09 2.81 -0.24 -4.46 117.12 119.17 1hka n MET 124 Ca 0.01 0.29 -0.15 0.00 -1.81 0.00 0.00 57.70 56.03 1hka n MET 124 Cb 0.29 -1.72 -0.06 0.00 -0.71 0.00 0.00 33.22 31.02 1hka n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1hka h LEU 125 N -0.00 0.82 -0.16 4.03 3.38 -0.85 -2.93 115.31 119.59 1hka h LEU 125 Ca -0.42 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 56.97 1hka h LEU 125 Cb 1.99 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.49 1hka h LEU 125 CO 0.07 1.23 0.04 -0.50 0.09 0.00 0.00 178.44 179.38 1hka h TRP 126 N 0.43 0.26 -0.57 1.13 4.06 -1.32 0.36 115.95 120.30 1hka h TRP 126 Ca -0.00 -0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.89 1hka h TRP 126 Cb 1.13 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 29.18 1hka h TRP 126 CO 0.09 0.38 0.24 -1.35 -3.56 0.00 0.00 178.44 174.24 1hka h PRO 127 N 0.07 0.83 -0.63 0.49 0.11 -1.78 -1.51 132.00 129.58 1hka h PRO 127 Ca 0.05 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1hka h PRO 127 Cb 0.25 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.18 1hka h PRO 127 CO -0.00 0.67 0.40 1.25 -0.21 0.00 0.00 178.00 180.11 1hka h LEU 128 N 0.82 0.74 -1.42 2.35 5.85 -1.28 -2.57 115.31 119.80 1hka h LEU 128 Ca 0.20 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 1hka h LEU 128 Cb 0.15 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1hka h LEU 128 CO -0.02 0.56 -0.21 0.15 -0.34 0.00 0.00 178.44 178.57 1hka h PHE 129 N 0.85 0.12 -0.67 1.25 3.57 -0.41 0.14 116.94 121.80 1hka h PHE 129 Ca 0.23 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 1hka h PHE 129 Cb -0.06 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 1hka h PHE 129 CO -0.02 0.33 0.24 1.49 -2.23 0.00 0.00 178.31 178.11 1hka h GLU 130 N 0.11 1.00 -0.00 1.11 4.81 -0.88 -2.52 114.58 118.21 1hka h GLU 130 Ca 0.02 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1hka h GLU 130 Cb 0.44 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1hka h GLU 130 CO 0.03 0.84 -0.88 0.44 -0.73 0.00 0.00 179.01 178.71 1hka n ILE 131 N -4.28 0.00 -3.03 2.32 -5.35 -0.84 -4.61 119.36 103.57 1hka n ILE 131 Ca 0.06 -0.06 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 1hka n ILE 131 Cb 0.20 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.13 1hka n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1hka n ALA 132 N -1.29 1.02 0.28 -1.28 0.00 0.43 -4.99 120.51 114.67 1hka n ALA 132 Ca 0.04 -2.70 0.14 0.00 0.00 0.00 0.00 53.44 50.92 1hka n ALA 132 Cb 0.33 -1.01 0.80 0.00 0.00 0.00 0.00 19.45 19.57 1hka n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1hka h PRO 133 N 3.31 0.00 -0.64 0.00 0.13 -1.65 -2.07 132.00 131.09 1hka h PRO 133 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1hka h PRO 133 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1hka h PRO 133 CO 0.38 0.08 0.00 0.39 -0.23 0.00 0.00 178.00 178.62 1hka n GLU 134 N -3.70 3.34 -1.88 0.86 -0.58 -1.26 -4.39 120.64 113.03 1hka n GLU 134 Ca -0.02 -2.40 -0.41 0.00 -0.42 0.00 0.00 57.16 53.91 1hka n GLU 134 Cb 0.18 -1.81 -0.01 0.00 -0.57 0.00 0.00 31.44 29.22 1hka n GLU 134 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1hka s LEU 135 N -1.65 4.36 -0.08 -4.62 0.20 -0.78 -4.90 118.68 111.22 1hka s LEU 135 Ca 0.43 2.88 0.05 0.00 0.69 0.00 0.00 54.13 58.18 1hka s LEU 135 Cb 0.28 -3.64 -0.00 0.00 -0.43 0.00 0.00 46.19 42.39 1hka s LEU 135 CO 0.20 -0.81 -0.24 -0.69 -0.29 0.00 0.00 176.35 174.52 1hka s VAL 136 N -0.39 2.01 0.72 1.68 1.01 -1.26 -0.82 120.40 123.36 1hka s VAL 136 Ca 0.58 -1.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.43 1hka s VAL 136 Cb -0.45 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.23 1hka s VAL 136 CO 0.51 0.56 1.08 -0.36 0.00 0.00 0.00 175.10 176.89 1hka s PHE 137 N 0.10 2.78 0.54 5.22 0.40 0.12 -4.90 117.98 122.24 1hka s PHE 137 Ca -0.11 1.51 0.24 0.00 -0.60 0.00 0.00 56.93 57.97 1hka s PHE 137 Cb -0.16 -3.01 1.43 0.00 0.51 0.00 0.00 43.02 41.80 1hka s PHE 137 CO 0.06 -1.55 2.05 -1.35 0.70 0.00 0.00 175.22 175.13 1hka h PRO 138 N -0.73 0.00 0.00 0.24 0.11 -1.88 0.19 132.00 129.93 1hka h PRO 138 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1hka h PRO 138 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1hka h PRO 138 CO 0.54 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.93 1hka n ASP 139 N -4.26 0.00 0.00 -2.05 5.68 -1.26 -4.89 116.55 109.76 1hka n ASP 139 Ca 0.05 -0.98 0.00 0.00 -0.50 0.00 0.00 54.79 53.36 1hka n ASP 139 Cb 0.43 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 1hka n ASP 139 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hka n GLY 140 N 0.90 1.64 3.74 6.12 0.00 0.06 -5.05 105.19 112.59 1hka n GLY 140 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1hka n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hka s GLU 141 N -0.85 4.37 -0.05 1.61 2.02 -1.26 -4.71 118.70 119.84 1hka s GLU 141 Ca 0.00 2.10 -0.22 0.00 0.02 0.00 0.00 54.97 56.86 1hka s GLU 141 Cb 0.00 -3.17 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 1hka s GLU 141 CO 0.00 -0.27 0.66 -1.64 0.02 0.00 0.00 175.26 174.03 1hka s MET 142 N -0.26 4.41 0.22 1.61 -1.94 -1.26 0.12 119.30 122.20 1hka s MET 142 Ca 0.57 0.82 -0.07 0.00 -1.71 0.00 0.00 55.69 55.29 1hka s MET 142 Cb -0.37 -3.42 0.34 0.00 2.01 0.00 0.00 34.83 33.39 1hka s MET 142 CO 0.40 0.16 1.75 1.25 -0.01 0.00 0.00 175.02 178.56 1hka h LEU 143 N 6.42 0.29 -1.16 -0.03 5.85 -1.30 -0.94 115.31 124.43 1hka h LEU 143 Ca -0.42 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.43 1hka h LEU 143 Cb 1.20 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 1hka h LEU 143 CO 0.74 0.15 0.58 0.08 -0.34 0.00 0.00 178.44 179.65 1hka h ARG 144 N 0.46 1.04 -0.39 1.25 0.11 -1.78 -1.98 114.38 113.08 1hka h ARG 144 Ca 0.35 -0.06 -0.16 0.00 0.10 0.00 0.00 59.98 60.21 1hka h ARG 144 Cb 0.45 -0.23 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 1hka h ARG 144 CO -0.33 0.69 -0.37 0.37 0.10 0.00 0.00 179.97 180.43 1hka h GLN 145 N 1.07 0.93 -0.27 0.08 5.75 -1.59 -1.18 115.11 119.89 1hka h GLN 145 Ca 0.36 -0.48 -0.01 0.00 -0.15 0.00 0.00 58.65 58.37 1hka h GLN 145 Cb 0.08 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 1hka h GLN 145 CO -0.12 1.13 0.14 0.82 -2.65 0.00 0.00 178.83 178.15 1hka h ILE 146 N 0.76 1.14 -0.69 2.39 2.04 -0.79 0.82 117.51 123.19 1hka h ILE 146 Ca 0.07 -0.39 0.02 0.00 1.00 0.00 0.00 64.86 65.56 1hka h ILE 146 Cb 0.96 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1hka h ILE 146 CO 0.09 0.14 0.45 -0.07 0.00 0.00 0.00 178.15 178.76 1hka h LEU 147 N 0.31 0.75 0.15 1.44 3.38 -1.31 -0.91 115.31 119.11 1hka h LEU 147 Ca 0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1hka h LEU 147 Cb 0.10 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1hka h LEU 147 CO -0.01 0.53 -0.07 -0.74 0.09 0.00 0.00 178.44 178.24 1hka h HIS 148 N 0.88 -0.18 0.09 1.13 2.76 -0.81 -2.38 115.15 116.64 1hka h HIS 148 Ca 0.26 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.43 1hka h HIS 148 Cb -0.03 0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 1hka h HIS 148 CO -0.00 0.26 -0.10 1.15 -1.30 0.00 0.00 177.93 177.94 1hka h THR 149 N -0.89 0.78 -0.00 6.26 2.02 -0.87 -2.79 112.91 117.41 1hka h THR 149 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1hka h THR 149 Cb 0.52 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1hka h THR 149 CO 0.03 0.00 -0.00 0.54 0.37 0.00 0.00 175.52 176.46 1hka n ARG 150 N -5.21 0.35 -3.65 6.66 1.74 -0.35 -4.92 116.66 111.28 1hka n ARG 150 Ca -0.07 -0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.78 1hka n ARG 150 Cb 0.14 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.14 1hka n ARG 150 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1hka n ALA 151 N -1.32 -1.71 -1.72 7.54 0.00 -0.90 -4.92 120.51 117.48 1hka n ALA 151 Ca 0.13 0.06 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 1hka n ALA 151 Cb 0.26 -3.37 0.05 0.00 0.00 0.00 0.00 19.45 16.38 1hka n ALA 151 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1hka s PHE 152 N -3.44 2.29 0.27 0.00 0.08 -1.21 -4.99 117.98 110.99 1hka s PHE 152 Ca 0.27 1.51 -0.29 0.00 0.12 0.00 0.00 56.93 58.54 1hka s PHE 152 Cb -0.13 -3.53 -0.09 0.00 -0.57 0.00 0.00 43.02 38.70 1hka s PHE 152 CO 0.78 -2.42 1.03 -0.51 -0.10 0.00 0.00 175.22 174.00 1hka s ASP 153 N -1.59 7.41 0.97 1.36 1.01 -1.26 -5.04 116.67 119.54 1hka s ASP 153 Ca 0.78 2.11 -0.11 0.00 0.71 0.00 0.00 52.55 56.04 1hka s ASP 153 Cb -0.32 -2.62 0.18 0.00 1.01 0.00 0.00 42.92 41.17 1hka s ASP 153 CO 0.36 -0.03 1.09 -0.54 0.21 0.00 0.00 175.17 176.26 1hka s LYS 154 N -1.40 0.60 0.01 8.23 1.02 -1.26 -4.98 119.74 121.97 1hka s LYS 154 Ca 0.44 1.04 -0.05 0.00 0.02 0.00 0.00 55.97 57.41 1hka s LYS 154 Cb -0.29 -1.72 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 1hka s LYS 154 CO 0.36 -2.75 0.24 -0.51 -0.92 0.00 0.00 175.35 171.77 1hka s LEU 155 N -6.60 4.36 0.58 3.17 1.43 -1.26 -5.10 118.68 115.26 1hka s LEU 155 Ca 0.66 0.48 -0.16 0.00 -1.03 0.00 0.00 54.13 54.07 1hka s LEU 155 Cb -0.21 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.28 1hka s LEU 155 CO 0.59 0.24 1.05 0.20 0.23 0.00 0.00 176.35 178.67 1hka s ASN 156 N -1.84 5.87 0.52 2.29 0.01 -1.25 -4.88 114.94 115.66 1hka s ASN 156 Ca 0.28 1.81 -0.20 0.00 -0.71 0.00 0.00 52.86 54.05 1hka s ASN 156 Cb -0.13 -2.53 -0.07 0.00 0.41 0.00 0.00 41.25 38.93 1hka s ASN 156 CO 0.18 -1.10 1.09 -0.54 -1.51 0.00 0.00 177.10 175.21 1hka s LYS 157 N -4.00 3.52 0.00 -0.60 -0.14 -1.26 0.14 119.74 117.40 1hka s LYS 157 Ca 0.64 1.50 0.07 0.00 -1.36 0.00 0.00 55.97 56.82 1hka s LYS 157 Cb -0.16 -2.04 0.42 0.00 -1.68 0.00 0.00 37.83 34.37 1hka s LYS 157 CO 0.35 -0.69 0.88 1.87 -0.76 0.00 0.00 175.35 177.00