#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mka s PHE 6 N 0.00 0.87 0.00 -0.72 0.08 -1.26 -5.15 117.98 111.79 3mka s PHE 6 Ca 0.00 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.74 3mka s PHE 6 Cb 0.00 -0.53 0.00 0.00 -0.57 0.00 0.00 43.02 41.92 3mka s PHE 6 CO 0.00 -0.01 0.00 0.44 -0.10 0.00 0.00 175.22 175.55 3mka n ILE 7 N 2.13 0.00 -3.62 0.64 -5.35 -1.26 -5.13 119.36 106.77 3mka n ILE 7 Ca -0.18 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.04 3mka n ILE 7 Cb 0.56 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.43 3mka n ILE 7 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3mka s SER 8 N 0.42 6.37 0.28 7.28 1.04 -1.26 -4.91 113.70 122.93 3mka s SER 8 Ca 0.00 0.42 -0.02 0.00 0.48 0.00 0.00 55.95 56.83 3mka s SER 8 Cb 0.00 -2.02 0.42 0.00 0.10 0.00 0.00 66.02 64.52 3mka s SER 8 CO 0.00 -0.10 1.92 1.55 0.98 0.00 0.00 173.24 177.59 3mka h PRO 9 N 1.71 1.13 -0.38 4.02 0.13 -2.02 0.73 132.00 137.33 3mka h PRO 9 Ca -0.48 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.56 3mka h PRO 9 Cb 1.20 -0.26 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 3mka h PRO 9 CO 0.66 0.75 0.16 0.93 -0.23 0.00 0.00 178.00 180.27 3mka h GLU 10 N 1.17 0.56 -0.54 0.86 4.39 -1.98 1.22 114.58 120.26 3mka h GLU 10 Ca 0.37 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.91 3mka h GLU 10 Cb 0.03 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 3mka h GLU 10 CO -0.12 0.53 0.08 -0.56 -1.16 0.00 0.00 179.01 177.79 3mka h GLN 11 N 0.46 0.90 0.37 2.33 3.07 -1.72 0.53 115.11 121.06 3mka h GLN 11 Ca 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 58.65 58.60 3mka h GLN 11 Cb 0.18 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 27.64 3mka h GLN 11 CO -0.01 0.88 -0.18 0.00 0.09 0.00 0.00 178.83 179.61 3mka h ALA 12 N 0.99 -0.49 -0.15 0.06 0.00 1.00 0.30 119.26 120.96 3mka h ALA 12 Ca 0.16 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3mka h ALA 12 Cb 0.42 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 3mka h ALA 12 CO 0.01 -0.68 -0.20 1.98 0.00 0.00 0.00 179.25 180.37 3mka h MET 13 N -0.70 -0.23 -0.71 0.00 -1.53 0.15 0.74 114.93 112.65 3mka h MET 13 Ca -0.05 0.02 0.14 0.00 -3.44 0.00 0.00 59.70 56.37 3mka h MET 13 Cb 0.49 0.05 -0.10 0.00 -0.55 0.00 0.00 31.60 31.50 3mka h MET 13 CO 0.08 -0.16 0.22 -0.09 0.14 0.00 0.00 176.91 177.10 3mka h ARG 14 N -0.24 0.33 -0.62 0.39 2.43 -0.75 0.17 114.38 116.09 3mka h ARG 14 Ca 0.11 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 3mka h ARG 14 Cb 0.40 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 3mka h ARG 14 CO -0.30 0.22 0.21 0.93 -1.51 0.00 0.00 179.97 179.52 3mka h GLU 15 N 0.34 0.95 -0.50 0.20 5.08 0.12 -0.88 114.58 119.89 3mka h GLU 15 Ca 0.39 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 3mka h GLU 15 Cb 0.62 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3mka h GLU 15 CO -0.44 0.83 0.25 0.00 -1.00 0.00 0.00 179.01 178.65 3mka h ARG 16 N 0.88 0.71 -0.48 2.33 3.08 0.73 -0.36 114.38 121.28 3mka h ARG 16 Ca 0.20 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 3mka h ARG 16 Cb 0.26 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3mka h ARG 16 CO -0.01 0.59 0.10 1.03 -1.07 0.00 0.00 179.97 180.60 3mka h SER 17 N 0.66 0.74 -0.71 7.04 0.87 -0.64 -2.17 113.55 119.35 3mka h SER 17 Ca 0.17 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.46 3mka h SER 17 Cb 0.10 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 3mka h SER 17 CO -0.02 0.80 0.36 -0.33 -0.53 0.00 0.00 176.83 177.10 3mka h GLU 18 N 0.66 1.01 -0.35 2.24 4.39 -0.83 -0.56 114.58 121.14 3mka h GLU 18 Ca 0.15 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3mka h GLU 18 Cb 0.36 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.81 3mka h GLU 18 CO 0.01 0.78 0.22 1.25 -1.16 0.00 0.00 179.01 180.11 3mka h LEU 19 N 0.98 0.41 -0.62 1.33 6.46 -0.86 -0.02 115.31 122.99 3mka h LEU 19 Ca 0.25 -0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.94 3mka h LEU 19 Cb 0.09 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 39.89 3mka h LEU 19 CO -0.03 0.32 0.28 0.00 -0.62 0.00 0.00 178.44 178.39 3mka h ALA 20 N 1.11 0.81 -0.76 1.25 0.00 -0.98 -1.23 119.26 119.46 3mka h ALA 20 Ca 0.13 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3mka h ALA 20 Cb -0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3mka h ALA 20 CO -0.03 0.39 0.33 -0.09 0.00 0.00 0.00 179.25 179.86 3mka h ARG 21 N 0.86 1.12 -0.71 0.00 2.43 -0.72 -1.14 114.38 116.22 3mka h ARG 21 Ca 0.21 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3mka h ARG 21 Cb 0.16 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3mka h ARG 21 CO -0.02 0.90 0.37 0.87 -1.51 0.00 0.00 179.97 180.57 3mka h LYS 22 N 1.09 1.00 -0.58 0.20 1.57 -0.65 0.22 116.57 119.43 3mka h LYS 22 Ca 0.26 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 3mka h LYS 22 Cb 0.18 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 3mka h LYS 22 CO -0.03 0.77 0.27 0.78 -0.57 0.00 0.00 179.45 180.67 3mka h GLY 23 N 0.98 0.89 0.92 3.86 0.00 -0.65 -1.92 103.07 107.15 3mka h GLY 23 Ca 0.25 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 3mka h GLY 23 CO -0.04 0.43 0.04 -2.22 0.00 0.00 0.00 176.54 174.75 3mka h ILE 24 N 0.78 1.24 -0.97 2.60 2.04 -0.76 -3.07 117.51 119.38 3mka h ILE 24 Ca 0.20 -0.88 0.18 0.00 1.00 0.00 0.00 64.86 65.35 3mka h ILE 24 Cb 0.13 1.12 -0.10 0.00 -0.74 0.00 0.00 36.82 37.23 3mka h ILE 24 CO -0.02 0.30 0.57 0.00 0.00 0.00 0.00 178.15 178.99 3mka h ALA 25 N 0.89 1.56 -0.07 1.87 0.00 -0.75 0.13 119.26 122.89 3mka h ALA 25 Ca 0.11 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3mka h ALA 25 Cb 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3mka h ALA 25 CO 0.01 -0.05 0.00 -2.13 0.00 0.00 0.00 179.25 177.08 3mka n ARG 26 N -4.79 1.24 -4.03 0.00 0.63 -0.74 -3.34 116.66 105.63 3mka n ARG 26 Ca 0.22 -0.37 -0.22 0.00 -0.92 0.00 0.00 57.85 56.56 3mka n ARG 26 Cb 0.53 -1.27 -0.04 0.00 0.45 0.00 0.00 32.46 32.12 3mka n ARG 26 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3mka s ALA 27 N -1.91 3.63 0.98 5.13 0.00 -0.58 -4.90 121.76 124.10 3mka s ALA 27 Ca 0.25 -1.53 -0.13 0.00 0.00 0.00 0.00 51.96 50.54 3mka s ALA 27 Cb 0.12 -1.19 0.06 0.00 0.00 0.00 0.00 23.12 22.11 3mka s ALA 27 CO 0.19 0.16 0.42 1.63 0.00 0.00 0.00 175.76 178.17 3mka n LYS 28 N -1.22 -0.56 -4.19 0.00 4.01 -1.26 -0.74 118.16 114.20 3mka n LYS 28 Ca -0.06 -0.12 -0.25 0.00 -0.51 0.00 0.00 58.31 57.37 3mka n LYS 28 Cb 0.59 -1.88 -0.07 0.00 -0.51 0.00 0.00 35.03 33.16 3mka n LYS 28 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 3mka s SER 29 N -2.05 4.94 0.01 4.39 0.01 -1.26 -3.89 113.70 115.84 3mka s SER 29 Ca 0.58 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.46 3mka s SER 29 Cb -0.20 -1.10 -0.01 0.00 0.21 0.00 0.00 66.02 64.92 3mka s SER 29 CO 0.66 0.06 -0.02 -0.69 0.41 0.00 0.00 173.24 173.67 3mka s VAL 30 N -1.87 0.10 0.04 3.43 1.01 0.75 -1.49 120.40 122.37 3mka s VAL 30 Ca 0.29 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.02 3mka s VAL 30 Cb -0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.13 3mka s VAL 30 CO 0.20 -0.12 -0.13 0.68 0.00 0.00 0.00 175.10 175.73 3mka s VAL 31 N -0.42 1.02 -0.05 2.92 -7.23 0.88 -1.11 120.40 116.41 3mka s VAL 31 Ca -0.04 -0.97 0.00 0.00 -1.81 0.00 0.00 61.98 59.16 3mka s VAL 31 Cb -0.03 -0.94 0.02 0.00 0.56 0.00 0.00 36.38 36.00 3mka s VAL 31 CO -0.00 -0.03 -0.02 0.00 -0.31 0.00 0.00 175.10 174.74 3mka s ALA 32 N -0.87 0.56 0.01 1.32 0.00 -0.26 -1.17 121.76 121.36 3mka s ALA 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.97 3mka s ALA 32 Cb -0.08 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 3mka s ALA 32 CO 0.01 -0.14 -0.02 -0.48 0.00 0.00 0.00 175.76 175.14 3mka s LEU 33 N 1.19 2.14 0.41 0.00 0.05 -0.68 0.05 118.68 121.84 3mka s LEU 33 Ca -0.07 -0.29 -0.25 0.00 0.05 0.00 0.00 54.13 53.57 3mka s LEU 33 Cb -0.14 0.05 -0.08 0.00 -2.05 0.00 0.00 46.19 43.97 3mka s LEU 33 CO -0.02 -0.17 1.16 0.00 -0.55 0.00 0.00 176.35 176.77 3mka s ALA 34 N -0.84 3.12 0.29 1.48 0.00 0.23 -1.65 121.76 124.38 3mka s ALA 34 Ca -0.09 0.94 -0.16 0.00 0.00 0.00 0.00 51.96 52.65 3mka s ALA 34 Cb -0.06 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.71 3mka s ALA 34 CO -0.01 -0.52 0.64 1.52 0.00 0.00 0.00 175.76 177.39 3mka s TYR 35 N -1.45 0.12 0.27 0.00 -0.85 0.37 -4.77 117.35 111.04 3mka s TYR 35 Ca 0.58 -0.56 -0.04 0.00 -0.52 0.00 0.00 57.07 56.53 3mka s TYR 35 Cb -0.30 0.51 0.36 0.00 0.38 0.00 0.00 41.96 42.91 3mka s TYR 35 CO 0.37 -1.20 1.93 0.00 -1.52 0.00 0.00 175.55 175.12 3mka h ALA 36 N 2.09 1.36 0.00 9.51 0.00 -1.74 0.31 119.26 130.79 3mka h ALA 36 Ca -0.24 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3mka h ALA 36 Cb 1.25 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3mka h ALA 36 CO 0.31 0.56 -0.10 0.78 0.00 0.00 0.00 179.25 180.80 3mka h GLY 37 N 1.24 0.00 0.00 0.00 0.00 -1.94 -3.48 103.07 98.89 3mka h GLY 37 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 3mka h GLY 37 CO -0.10 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.05 3mka n GLY 38 N -0.72 0.94 3.27 4.60 0.00 0.11 -2.41 105.19 110.98 3mka n GLY 38 Ca -0.02 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 3mka n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mka s VAL 39 N 0.00 2.21 -0.09 1.61 1.01 -1.11 0.14 120.40 124.16 3mka s VAL 39 Ca 0.00 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 3mka s VAL 39 Cb 0.00 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 3mka s VAL 39 CO 0.00 0.56 -0.06 -0.22 0.00 0.00 0.00 175.10 175.39 3mka s LEU 40 N 0.04 3.21 -0.18 3.92 2.96 -0.66 -1.13 118.68 126.84 3mka s LEU 40 Ca -0.09 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3mka s LEU 40 Cb -0.15 -1.72 0.01 0.00 0.50 0.00 0.00 46.19 44.83 3mka s LEU 40 CO 0.06 0.31 -0.16 -0.36 -1.32 0.00 0.00 176.35 174.87 3mka s PHE 41 N -0.50 2.81 -0.05 5.38 0.08 0.40 -1.69 117.98 124.42 3mka s PHE 41 Ca 0.08 -1.42 0.00 0.00 0.12 0.00 0.00 56.93 55.71 3mka s PHE 41 Cb -0.12 -1.95 0.02 0.00 -0.57 0.00 0.00 43.02 40.41 3mka s PHE 41 CO 0.02 -0.71 -0.03 0.08 -0.10 0.00 0.00 175.22 174.48 3mka s VAL 42 N 1.25 0.45 0.02 -0.44 1.01 -0.31 -1.92 120.40 120.46 3mka s VAL 42 Ca 0.03 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.00 3mka s VAL 42 Cb -0.14 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 3mka s VAL 42 CO -0.09 0.22 -0.06 0.00 0.00 0.00 0.00 175.10 175.17 3mka s ALA 43 N 1.23 0.45 -0.21 5.51 0.00 -0.36 -0.08 121.76 128.29 3mka s ALA 43 Ca -0.06 -0.53 -0.28 0.00 0.00 0.00 0.00 51.96 51.09 3mka s ALA 43 Cb -0.14 0.00 0.00 0.00 0.00 0.00 0.00 23.12 22.99 3mka s ALA 43 CO -0.02 0.01 0.98 -1.83 0.00 0.00 0.00 175.76 174.89 3mka s GLU 44 N -1.01 4.27 -0.25 0.00 -1.05 -0.56 -0.31 118.70 119.80 3mka s GLU 44 Ca -0.06 1.25 -0.02 0.00 -0.15 0.00 0.00 54.97 55.99 3mka s GLU 44 Cb -0.07 -3.62 0.13 0.00 -0.44 0.00 0.00 34.13 30.13 3mka s GLU 44 CO 0.00 -0.54 0.35 1.21 0.95 0.00 0.00 175.26 177.23 3mka s ASN 45 N 1.21 0.61 0.13 0.83 3.84 0.96 -4.49 114.94 118.03 3mka s ASN 45 Ca 0.42 -0.03 -0.14 0.00 0.21 0.00 0.00 52.86 53.33 3mka s ASN 45 Cb -0.16 0.92 -0.01 0.00 -0.55 0.00 0.00 41.25 41.45 3mka s ASN 45 CO 0.09 -0.32 1.57 1.55 -2.79 0.00 0.00 177.10 177.19 3mka h PRO 46 N 8.21 0.77 -7.05 0.43 0.13 -1.77 -3.33 132.00 129.39 3mka h PRO 46 Ca -0.17 -0.26 -0.53 0.00 -0.87 0.00 0.00 66.00 64.16 3mka h PRO 46 Cb 1.14 -0.06 0.11 0.00 0.13 0.00 0.00 31.00 32.32 3mka h PRO 46 CO 0.28 0.86 0.53 0.45 -0.23 0.00 0.00 178.00 179.90 3mka s SER 47 N -6.31 5.47 -0.01 1.44 0.15 -1.26 -4.79 113.70 108.38 3mka s SER 47 Ca -0.13 2.53 0.20 0.00 0.70 0.00 0.00 55.95 59.25 3mka s SER 47 Cb 0.10 -2.62 -0.26 0.00 -1.71 0.00 0.00 66.02 61.54 3mka s SER 47 CO 0.81 -1.42 0.63 -1.14 1.20 0.00 0.00 173.24 173.32 3mka n ARG 48 N -1.06 0.59 -0.03 5.44 0.63 -1.26 -4.52 116.66 116.45 3mka n ARG 48 Ca 0.11 -0.09 0.05 0.00 -0.92 0.00 0.00 57.85 57.00 3mka n ARG 48 Cb 0.47 -1.45 -0.15 0.00 0.45 0.00 0.00 32.46 31.78 3mka n ARG 48 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3mka n SER 49 N -1.84 0.53 -4.39 6.15 7.64 -1.26 -4.92 113.62 115.53 3mka n SER 49 Ca -0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 3mka n SER 49 Cb 0.42 1.67 -0.10 0.00 -1.01 0.00 0.00 64.21 65.19 3mka n SER 49 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3mka s LEU 50 N -4.59 4.98 0.48 -3.43 1.43 -1.26 -5.08 118.68 111.22 3mka s LEU 50 Ca -0.08 -1.06 -0.19 0.00 -1.03 0.00 0.00 54.13 51.77 3mka s LEU 50 Cb 0.11 -2.08 -0.09 0.00 0.03 0.00 0.00 46.19 44.17 3mka s LEU 50 CO 0.80 -0.45 1.00 0.00 0.23 0.00 0.00 176.35 177.92 3mka s GLN 51 N 1.58 3.94 0.00 1.70 -2.07 -1.26 -4.88 119.66 118.67 3mka s GLN 51 Ca 0.03 1.16 0.00 0.00 -1.82 0.00 0.00 55.36 54.73 3mka s GLN 51 Cb -0.20 -2.13 0.00 0.00 -1.09 0.00 0.00 33.01 29.59 3mka s GLN 51 CO 0.07 -0.29 0.06 1.63 -1.32 0.00 0.00 175.29 175.44 3mka n LYS 52 N -1.11 3.30 -4.39 9.60 5.02 -1.26 -5.00 118.16 124.31 3mka n LYS 52 Ca 0.08 -0.06 -0.26 0.00 -2.02 0.00 0.00 58.31 56.05 3mka n LYS 52 Cb 0.53 -0.40 -0.17 0.00 -0.02 0.00 0.00 35.03 34.98 3mka n LYS 52 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3mka s ILE 53 N -0.49 1.17 0.17 -0.18 1.01 -1.26 -0.84 121.20 120.78 3mka s ILE 53 Ca 0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 3mka s ILE 53 Cb 0.00 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.35 3mka s ILE 53 CO 0.00 0.37 0.24 -0.44 0.00 0.00 0.00 174.94 175.12 3mka s SER 54 N 0.98 0.09 0.08 3.58 0.01 0.69 -5.01 113.70 114.13 3mka s SER 54 Ca -0.08 -1.03 -0.21 0.00 1.31 0.00 0.00 55.95 55.94 3mka s SER 54 Cb -0.15 0.42 -0.07 0.00 0.21 0.00 0.00 66.02 66.44 3mka s SER 54 CO -0.00 -0.89 0.64 -0.70 0.41 0.00 0.00 173.24 172.70 3mka s GLU 55 N -4.02 4.33 -0.20 12.44 2.12 -1.26 -0.21 118.70 131.90 3mka s GLU 55 Ca 0.23 0.87 -0.07 0.00 0.36 0.00 0.00 54.97 56.36 3mka s GLU 55 Cb 0.04 -3.27 -0.10 0.00 0.26 0.00 0.00 34.13 31.07 3mka s GLU 55 CO 0.04 0.56 -0.23 1.28 -0.54 0.00 0.00 175.26 176.36 3mka n LEU 56 N 1.90 1.90 0.00 2.70 4.77 -0.11 -4.83 117.00 123.34 3mka n LEU 56 Ca -0.08 0.14 -0.06 0.00 -0.03 0.00 0.00 56.01 55.98 3mka n LEU 56 Cb 0.50 -0.62 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 3mka n LEU 56 CO 0.43 0.54 0.09 0.00 -1.33 0.00 0.00 177.39 177.13 3mka n TYR 57 N -3.65 -0.97 -0.39 -1.77 9.36 -0.85 -4.70 117.16 114.19 3mka n TYR 57 Ca -0.38 -0.96 -0.11 0.00 3.32 0.00 0.00 57.90 59.77 3mka n TYR 57 Cb 0.81 0.26 -0.10 0.00 -0.63 0.00 0.00 39.34 39.67 3mka n TYR 57 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 3mka h ASP 58 N 0.83 -2.13 -0.19 2.98 3.32 -1.95 -2.70 116.42 116.58 3mka h ASP 58 Ca -0.12 0.32 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 3mka h ASP 58 Cb 0.50 0.94 -0.03 0.00 0.22 0.00 0.00 39.33 40.97 3mka h ASP 58 CO 0.16 -0.25 -0.06 0.54 -1.72 0.00 0.00 179.24 177.91 3mka n ARG 59 N -5.26 2.08 -4.36 3.56 5.12 -1.26 -0.50 116.66 116.04 3mka n ARG 59 Ca 0.02 -2.89 -0.27 0.00 -1.93 0.00 0.00 57.85 52.77 3mka n ARG 59 Cb 0.27 -1.72 -0.17 0.00 -1.16 0.00 0.00 32.46 29.68 3mka n ARG 59 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3mka s VAL 60 N -2.98 1.31 0.29 1.55 1.01 -1.02 -1.67 120.40 118.88 3mka s VAL 60 Ca 0.40 -0.53 0.10 0.00 0.00 0.00 0.00 61.98 61.94 3mka s VAL 60 Cb 0.34 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 3mka s VAL 60 CO 0.04 0.40 -0.00 -0.83 0.00 0.00 0.00 175.10 174.71 3mka s GLY 61 N 1.07 1.77 -0.02 4.51 0.00 0.15 -0.93 107.32 113.88 3mka s GLY 61 Ca -0.06 -1.74 0.03 0.00 0.00 0.00 0.00 44.72 42.95 3mka s GLY 61 CO -0.02 -1.78 -0.09 -0.12 0.00 0.00 0.00 173.10 171.09 3mka s PHE 62 N -2.38 0.88 -0.01 1.90 5.36 0.71 -1.10 117.98 123.34 3mka s PHE 62 Ca 0.33 -0.19 -0.01 0.00 -0.96 0.00 0.00 56.93 56.09 3mka s PHE 62 Cb -0.05 -0.60 0.01 0.00 -0.34 0.00 0.00 43.02 42.04 3mka s PHE 62 CO 0.20 -0.06 0.03 0.00 -1.46 0.00 0.00 175.22 173.93 3mka s ALA 63 N -0.02 -0.06 0.07 11.12 0.00 -0.35 -0.22 121.76 132.31 3mka s ALA 63 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 51.96 52.01 3mka s ALA 63 Cb -0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 3mka s ALA 63 CO -0.00 -0.02 0.11 0.00 0.00 0.00 0.00 175.76 175.85 3mka s ALA 64 N 0.14 0.02 0.02 0.00 0.00 -0.02 -0.17 121.76 121.74 3mka s ALA 64 Ca -0.01 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.19 3mka s ALA 64 Cb -0.02 0.39 -0.01 0.00 0.00 0.00 0.00 23.12 23.48 3mka s ALA 64 CO -0.00 -0.44 -0.08 0.00 0.00 0.00 0.00 175.76 175.23 3mka s ALA 65 N -3.72 0.68 0.00 0.00 0.00 -0.35 -4.84 121.76 113.53 3mka s ALA 65 Ca 0.04 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.46 3mka s ALA 65 Cb 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.08 3mka s ALA 65 CO -0.10 0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.17 3mka n GLY 66 N 2.25 0.78 3.66 0.00 0.00 -1.26 -1.13 105.19 109.49 3mka n GLY 66 Ca -0.17 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 3mka n GLY 66 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3mka s LYS 67 N -1.90 4.23 0.08 1.61 2.20 0.19 -4.92 119.74 121.22 3mka s LYS 67 Ca 0.00 1.48 -0.22 0.00 -0.36 0.00 0.00 55.97 56.87 3mka s LYS 67 Cb 0.00 -3.71 -0.09 0.00 -1.51 0.00 0.00 37.83 32.52 3mka s LYS 67 CO 0.00 -0.69 1.36 0.35 -0.36 0.00 0.00 175.35 176.01 3mka h PHE 68 N 7.89 -1.06 -1.14 4.03 3.57 -1.96 -1.56 116.94 126.71 3mka h PHE 68 Ca -0.23 0.04 0.32 0.00 3.53 0.00 0.00 57.97 61.63 3mka h PHE 68 Cb 1.08 0.47 -0.08 0.00 2.79 0.00 0.00 35.95 40.21 3mka h PHE 68 CO 0.78 -0.36 0.76 -2.95 -2.23 0.00 0.00 178.31 174.31 3mka h ASN 69 N -0.39 0.27 0.45 0.41 7.08 -1.99 0.21 115.58 121.62 3mka h ASN 69 Ca 0.02 0.06 -0.21 0.00 -3.08 0.00 0.00 56.30 53.09 3mka h ASN 69 Cb 0.45 0.02 -0.00 0.00 -2.08 0.00 0.00 38.32 36.71 3mka h ASN 69 CO -0.28 0.02 -0.90 -0.33 -2.08 0.00 0.00 177.43 173.86 3mka h GLU 70 N 0.22 0.30 0.00 4.14 5.08 -1.72 -2.96 114.58 119.64 3mka h GLU 70 Ca 0.62 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3mka h GLU 70 Cb 1.93 0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.27 3mka h GLU 70 CO -0.22 1.02 -0.92 1.97 -1.00 0.00 0.00 179.01 179.86 3mka n PHE 71 N -3.71 0.64 -0.15 4.33 1.16 0.18 -2.97 117.46 116.94 3mka n PHE 71 Ca -0.05 0.19 -0.12 0.00 -1.87 0.00 0.00 57.45 55.60 3mka n PHE 71 Cb 0.81 -0.72 -0.01 0.00 -1.61 0.00 0.00 39.48 37.95 3mka n PHE 71 CO 0.00 0.00 0.00 0.22 -1.87 0.00 0.00 176.76 175.11 3mka h ASP 72 N 0.00 0.98 -0.65 5.98 3.58 -0.78 -0.58 116.42 124.95 3mka h ASP 72 Ca 0.00 -0.40 0.09 0.00 0.42 0.00 0.00 57.03 57.15 3mka h ASP 72 Cb 0.85 -0.27 -0.07 0.00 1.72 0.00 0.00 39.33 41.56 3mka h ASP 72 CO 0.00 1.16 0.28 -1.13 -2.88 0.00 0.00 179.24 176.66 3mka h ASN 73 N 0.80 0.32 0.93 2.28 -0.73 -1.56 0.45 115.58 118.07 3mka h ASN 73 Ca 0.11 0.07 -0.10 0.00 1.87 0.00 0.00 56.30 58.24 3mka h ASN 73 Cb 0.78 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.38 3mka h ASN 73 CO 0.06 0.18 -0.50 -0.07 -0.37 0.00 0.00 177.43 176.74 3mka h LEU 74 N 0.48 0.00 -0.08 0.34 4.07 -1.37 -2.57 115.31 116.19 3mka h LEU 74 Ca 0.32 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.23 3mka h LEU 74 Cb 0.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3mka h LEU 74 CO -0.29 0.50 -0.14 -0.09 -1.08 0.00 0.00 178.44 177.33 3mka h ARG 75 N 0.00 0.23 -0.12 1.13 2.43 0.18 -2.15 114.38 116.08 3mka h ARG 75 Ca -0.00 -0.15 0.03 0.00 -0.81 0.00 0.00 59.98 59.05 3mka h ARG 75 Cb 1.10 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 3mka h ARG 75 CO 0.06 0.73 -0.07 0.00 -1.51 0.00 0.00 179.97 179.18 3mka h ARG 76 N -0.24 -0.07 0.00 0.20 3.08 -0.93 -1.43 114.38 114.99 3mka h ARG 76 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3mka h ARG 76 Cb 0.72 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.78 3mka h ARG 76 CO 0.03 -0.05 -0.07 0.78 -1.07 0.00 0.00 179.97 179.60 3mka h GLY 77 N -0.07 0.00 1.43 0.04 0.00 -1.49 -0.55 103.07 102.43 3mka h GLY 77 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.13 3mka h GLY 77 CO -0.16 0.00 -1.14 -1.33 0.00 0.00 0.00 176.54 173.90 3mka h GLY 78 N 0.85 0.54 1.08 4.60 0.00 -0.64 -1.51 103.07 107.99 3mka h GLY 78 Ca -0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 47.33 46.16 3mka h GLY 78 CO 0.01 0.97 0.20 -2.22 0.00 0.00 0.00 176.54 175.50 3mka h ILE 79 N 0.22 1.26 -0.51 2.60 2.04 -0.57 -0.39 117.51 122.16 3mka h ILE 79 Ca -0.14 -0.94 -0.07 0.00 1.00 0.00 0.00 64.86 64.71 3mka h ILE 79 Cb 1.82 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 3mka h ILE 79 CO 0.21 0.37 0.06 1.56 0.00 0.00 0.00 178.15 180.35 3mka h GLN 80 N 1.09 0.86 -0.44 2.37 4.20 -1.06 -1.62 115.11 120.50 3mka h GLN 80 Ca 0.23 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3mka h GLN 80 Cb 0.34 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 3mka h GLN 80 CO -0.00 0.86 0.20 0.35 -0.67 0.00 0.00 178.83 179.56 3mka h PHE 81 N 0.73 0.66 -0.07 2.96 3.57 -0.95 -1.76 116.94 122.08 3mka h PHE 81 Ca 0.15 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 3mka h PHE 81 Cb 0.43 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 3mka h PHE 81 CO 0.03 0.55 0.01 0.00 -2.23 0.00 0.00 178.31 176.67 3mka h ALA 82 N 1.04 0.09 -0.60 2.41 0.00 -0.99 -1.54 119.26 119.67 3mka h ALA 82 Ca 0.15 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3mka h ALA 82 Cb 0.15 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3mka h ALA 82 CO -0.02 -0.25 0.36 -0.44 0.00 0.00 0.00 179.25 178.91 3mka h ASP 83 N -0.14 0.59 -0.76 0.00 3.32 -1.29 -0.18 116.42 117.95 3mka h ASP 83 Ca 0.02 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 3mka h ASP 83 Cb 0.30 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 3mka h ASP 83 CO 0.00 0.41 0.24 0.74 -1.72 0.00 0.00 179.24 178.91 3mka h THR 84 N 0.71 1.26 -0.05 0.35 2.02 -1.23 -1.05 112.91 114.93 3mka h THR 84 Ca 0.24 -0.91 -0.18 0.00 0.77 0.00 0.00 66.41 66.34 3mka h THR 84 Cb 0.03 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 3mka h THR 84 CO -0.11 0.36 -0.74 0.03 0.37 0.00 0.00 175.52 175.44 3mka h ARG 85 N 1.13 0.30 0.00 6.66 2.47 -0.93 -1.83 114.38 122.17 3mka h ARG 85 Ca 0.25 -0.25 -0.06 0.00 -1.26 0.00 0.00 59.98 58.65 3mka h ARG 85 Cb 0.30 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.67 3mka h ARG 85 CO -0.01 0.91 -0.29 0.78 0.56 0.00 0.00 179.97 181.92 3mka h GLY 86 N 1.49 0.00 0.96 0.04 0.00 -0.75 -2.28 103.07 102.52 3mka h GLY 86 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.01 3mka h GLY 86 CO 0.12 0.00 -1.33 -1.82 0.00 0.00 0.00 176.54 173.51 3mka h TYR 87 N 0.00 0.76 0.00 5.60 3.20 -0.98 -3.13 116.97 122.42 3mka h TYR 87 Ca -0.00 -0.56 -0.03 0.00 3.14 0.00 0.00 58.73 61.28 3mka h TYR 87 Cb 0.76 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 3mka h TYR 87 CO 0.00 1.51 -0.14 0.00 -1.64 0.00 0.00 178.16 177.90 3mka h ALA 88 N 0.10 1.00 -3.00 1.82 0.00 -1.26 -3.43 119.26 114.48 3mka h ALA 88 Ca -0.25 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3mka h ALA 88 Cb 1.97 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.74 3mka h ALA 88 CO 0.20 0.17 0.00 0.66 0.00 0.00 0.00 179.25 180.28 3mka n TYR 89 N -3.26 0.00 -4.06 0.00 4.01 -0.87 -5.09 117.16 107.89 3mka n TYR 89 Ca 0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3mka n TYR 89 Cb 0.40 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.33 3mka n TYR 89 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3mka s ASP 90 N 1.00 0.65 0.37 7.72 2.15 -1.20 -4.92 116.67 122.44 3mka s ASP 90 Ca 0.00 -0.71 0.18 0.00 0.43 0.00 0.00 52.55 52.45 3mka s ASP 90 Cb 0.00 0.10 1.16 0.00 -0.30 0.00 0.00 42.92 43.88 3mka s ASP 90 CO 0.00 -0.36 1.67 0.03 -0.17 0.00 0.00 175.17 176.34 3mka h ARG 91 N 4.00 0.28 0.00 4.34 3.08 -1.88 0.14 114.38 124.34 3mka h ARG 91 Ca -0.34 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.69 3mka h ARG 91 Cb 1.19 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3mka h ARG 91 CO 0.50 0.19 0.00 -2.13 -1.07 0.00 0.00 179.97 177.46 3mka n ARG 92 N -4.92 0.40 0.00 0.04 3.00 -1.26 -2.53 116.66 111.40 3mka n ARG 92 Ca 0.32 0.07 0.11 0.00 -0.00 0.00 0.00 57.85 58.34 3mka n ARG 92 Cb 1.06 -1.50 0.05 0.00 0.00 0.00 0.00 32.46 32.07 3mka n ARG 92 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 3mka n ASP 93 N -1.16 0.85 -4.68 6.15 8.00 0.48 -4.87 116.55 121.31 3mka n ASP 93 Ca 0.11 -0.72 -0.42 0.00 0.71 0.00 0.00 54.79 54.47 3mka n ASP 93 Cb 0.11 0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 41.82 3mka n ASP 93 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mka s VAL 94 N -2.95 4.81 0.18 2.53 1.01 -1.05 -5.02 120.40 119.91 3mka s VAL 94 Ca 0.10 1.90 0.08 0.00 0.00 0.00 0.00 61.98 64.07 3mka s VAL 94 Cb 0.17 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 3mka s VAL 94 CO 0.77 0.00 -0.16 0.42 0.00 0.00 0.00 175.10 176.13 3mka s THR 95 N 2.13 1.78 0.25 3.92 -4.23 -1.26 -5.02 115.64 113.22 3mka s THR 95 Ca 0.45 -2.05 -0.04 0.00 -1.18 0.00 0.00 61.69 58.87 3mka s THR 95 Cb -0.17 -1.93 0.15 0.00 1.34 0.00 0.00 72.50 71.89 3mka s THR 95 CO 0.15 -0.45 1.79 1.23 -0.54 0.00 0.00 174.62 176.81 3mka h GLY 96 N 2.93 1.01 0.86 3.99 0.00 -1.93 -2.41 103.07 107.53 3mka h GLY 96 Ca -0.40 -0.60 0.04 0.00 0.00 0.00 0.00 47.33 46.37 3mka h GLY 96 CO 0.56 0.56 0.65 -0.09 0.00 0.00 0.00 176.54 178.22 3mka h ARG 97 N 0.91 1.21 -0.44 4.80 2.43 -1.95 -0.91 114.38 120.42 3mka h ARG 97 Ca 0.20 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 3mka h ARG 97 Cb 0.31 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 3mka h ARG 97 CO -0.00 0.80 0.03 1.96 -1.51 0.00 0.00 179.97 181.25 3mka h GLN 98 N 1.25 0.76 -0.83 0.20 4.20 -1.86 -1.46 115.11 117.37 3mka h GLN 98 Ca 0.40 -0.23 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 3mka h GLN 98 Cb 0.03 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 3mka h GLN 98 CO -0.13 0.81 0.39 -0.07 -0.67 0.00 0.00 178.83 179.16 3mka h LEU 99 N 0.61 1.10 0.00 1.46 -0.00 -1.02 -1.92 115.31 115.55 3mka h LEU 99 Ca 0.13 -0.14 -0.00 0.00 -0.00 0.00 0.00 57.88 57.87 3mka h LEU 99 Cb 0.44 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 3mka h LEU 99 CO 0.02 0.93 -0.00 0.00 -0.00 0.00 0.00 178.44 179.38 3mka h ALA 100 N 1.21 -0.00 -0.84 1.53 0.00 -0.99 -1.80 119.26 118.37 3mka h ALA 100 Ca 0.29 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.26 3mka h ALA 100 Cb 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3mka h ALA 100 CO -0.03 -0.41 0.55 -0.97 0.00 0.00 0.00 179.25 178.38 3mka h ASN 101 N -0.18 0.50 -0.10 0.00 -0.73 -1.12 0.64 115.58 114.59 3mka h ASN 101 Ca -0.00 0.03 -0.07 0.00 1.87 0.00 0.00 56.30 58.14 3mka h ASN 101 Cb 0.18 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.70 3mka h ASN 101 CO 0.00 0.25 -0.20 0.58 -0.37 0.00 0.00 177.43 177.69 3mka h VAL 102 N 0.52 1.39 -0.84 2.57 2.07 -0.96 -2.24 116.25 118.77 3mka h VAL 102 Ca 0.42 -1.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 3mka h VAL 102 Cb 0.86 2.12 -0.04 0.00 -1.52 0.00 0.00 31.29 32.71 3mka h VAL 102 CO -0.16 0.43 0.45 1.88 0.02 0.00 0.00 177.57 180.18 3mka h TYR 103 N -0.14 1.15 -0.27 1.57 0.05 -0.63 -0.45 116.97 118.24 3mka h TYR 103 Ca 0.00 -0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.78 3mka h TYR 103 Cb 0.78 -0.37 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 3mka h TYR 103 CO 0.11 0.80 0.11 0.00 -1.05 0.00 0.00 178.16 178.13 3mka h ALA 104 N 1.32 0.32 -0.63 3.88 0.00 -0.87 0.16 119.26 123.45 3mka h ALA 104 Ca 0.29 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 3mka h ALA 104 Cb 0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3mka h ALA 104 CO -0.05 -0.29 0.19 0.37 0.00 0.00 0.00 179.25 179.48 3mka h GLN 105 N 0.25 0.95 0.16 0.00 5.75 -0.92 -1.09 115.11 120.21 3mka h GLN 105 Ca 0.12 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 3mka h GLN 105 Cb 0.07 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.47 3mka h GLN 105 CO -0.10 0.82 -0.08 1.15 -2.65 0.00 0.00 178.83 177.97 3mka h THR 106 N 0.92 0.95 -0.90 2.39 2.02 -0.47 -1.73 112.91 116.10 3mka h THR 106 Ca 0.21 -0.96 -0.01 0.00 0.77 0.00 0.00 66.41 66.42 3mka h THR 106 Cb 0.27 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 3mka h THR 106 CO -0.01 0.21 0.52 -0.07 0.37 0.00 0.00 175.52 176.54 3mka h LEU 107 N -0.72 1.10 -0.96 2.58 3.38 -0.74 0.29 115.31 120.24 3mka h LEU 107 Ca -0.02 -0.08 0.11 0.00 0.09 0.00 0.00 57.88 57.97 3mka h LEU 107 Cb 0.51 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 3mka h LEU 107 CO 0.04 0.86 0.59 1.23 0.09 0.00 0.00 178.44 181.25 3mka h GLY 108 N 1.24 1.53 1.29 0.83 0.00 -1.17 0.16 103.07 106.96 3mka h GLY 108 Ca 0.32 -0.40 -0.30 0.00 0.00 0.00 0.00 47.33 46.95 3mka h GLY 108 CO -0.06 0.17 -1.24 -0.84 0.00 0.00 0.00 176.54 174.58 3mka h THR 109 N 0.96 1.31 -0.53 4.70 2.02 -0.55 -2.67 112.91 118.15 3mka h THR 109 Ca 0.46 -2.52 -0.00 0.00 0.77 0.00 0.00 66.41 65.13 3mka h THR 109 Cb 0.42 2.71 -0.03 0.00 -1.74 0.00 0.00 68.15 69.51 3mka h THR 109 CO -0.25 0.76 0.33 0.40 0.37 0.00 0.00 175.52 177.13 3mka h ILE 110 N 0.26 1.15 -0.64 3.11 2.04 -0.34 0.94 117.51 124.03 3mka h ILE 110 Ca -0.18 -0.33 0.02 0.00 1.00 0.00 0.00 64.86 65.37 3mka h ILE 110 Cb 1.91 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 38.37 3mka h ILE 110 CO 0.23 0.15 0.42 0.15 0.00 0.00 0.00 178.15 179.11 3mka h PHE 111 N 0.72 0.78 0.00 1.37 3.57 -0.73 -1.24 116.94 121.41 3mka h PHE 111 Ca 0.19 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.71 3mka h PHE 111 Cb -0.04 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.44 3mka h PHE 111 CO -0.03 0.48 -0.80 1.15 -2.23 0.00 0.00 178.31 176.88 3mka h THR 112 N 0.83 0.00 0.00 4.41 2.02 -1.05 -3.43 112.91 115.69 3mka h THR 112 Ca 0.24 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.70 3mka h THR 112 Cb -0.04 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3mka h THR 112 CO -0.06 0.00 -0.74 -0.62 0.37 0.00 0.00 175.52 174.47 3mka n GLU 113 N -2.37 1.65 -1.97 6.66 -0.58 0.27 -5.08 120.64 119.22 3mka n GLU 113 Ca 0.02 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.46 3mka n GLU 113 Cb 0.49 -0.87 0.17 0.00 -0.57 0.00 0.00 31.44 30.66 3mka n GLU 113 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3mka s GLN 114 N -1.50 0.82 0.01 3.49 -1.52 -0.49 -5.00 119.66 115.47 3mka s GLN 114 Ca 0.00 -0.41 -0.09 0.00 -1.95 0.00 0.00 55.36 52.91 3mka s GLN 114 Cb 0.00 -1.89 -0.05 0.00 -0.22 0.00 0.00 33.01 30.85 3mka s GLN 114 CO 0.00 -2.28 0.94 0.00 -0.25 0.00 0.00 175.29 173.70 3mka h ALA 115 N -1.52 -0.89 -4.14 6.09 0.00 -1.97 -3.44 119.26 113.40 3mka h ALA 115 Ca -0.44 -0.07 -0.69 0.00 0.00 0.00 0.00 54.91 53.71 3mka h ALA 115 Cb 1.24 0.13 -0.24 0.00 0.00 0.00 0.00 17.79 18.92 3mka h ALA 115 CO 0.41 -0.87 -0.80 -1.59 0.00 0.00 0.00 179.25 176.40 3mka s LYS 116 N -3.36 2.33 1.31 0.00 -2.85 -1.26 -5.12 119.74 110.80 3mka s LYS 116 Ca -0.05 -0.80 -0.21 0.00 -1.00 0.00 0.00 55.97 53.91 3mka s LYS 116 Cb 0.00 -2.27 0.33 0.00 -2.06 0.00 0.00 37.83 33.83 3mka s LYS 116 CO 0.14 0.59 1.02 -1.25 0.10 0.00 0.00 175.35 175.95 3mka s PRO 117 N -0.86 -2.10 -0.12 1.78 0.04 -1.26 -4.95 135.00 127.53 3mka s PRO 117 Ca 0.12 0.07 -0.18 0.00 0.04 0.00 0.00 61.00 61.04 3mka s PRO 117 Cb -0.10 -1.48 -0.04 0.00 0.04 0.00 0.00 34.50 32.91 3mka s PRO 117 CO 0.01 -4.31 0.48 0.71 0.04 0.00 0.00 177.00 173.93 3mka s TYR 118 N -2.62 3.51 -1.28 0.56 1.51 -1.26 -4.96 117.35 112.81 3mka s TYR 118 Ca 0.70 0.88 -0.10 0.00 -1.01 0.00 0.00 57.07 57.54 3mka s TYR 118 Cb -0.12 -2.55 0.16 0.00 -0.11 0.00 0.00 41.96 39.34 3mka s TYR 118 CO 0.57 0.16 1.85 0.39 -1.11 0.00 0.00 175.55 177.41 3mka n GLU 119 N 3.71 3.57 -3.79 -0.62 1.02 -1.26 -4.68 120.64 118.59 3mka n GLU 119 Ca -0.07 -3.52 -0.10 0.00 -0.02 0.00 0.00 57.16 53.45 3mka n GLU 119 Cb 0.52 -2.95 -0.07 0.00 -0.02 0.00 0.00 31.44 28.91 3mka n GLU 119 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3mka s VAL 120 N 0.62 0.11 -0.01 2.62 -7.23 -1.26 -0.64 120.40 114.60 3mka s VAL 120 Ca 0.40 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.67 3mka s VAL 120 Cb 0.09 -1.15 0.02 0.00 0.56 0.00 0.00 36.38 35.90 3mka s VAL 120 CO 0.00 -0.50 0.01 -0.70 -0.31 0.00 0.00 175.10 173.60 3mka s GLU 121 N -3.34 0.05 0.07 4.82 2.12 -0.28 -3.15 118.70 118.99 3mka s GLU 121 Ca 0.01 0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.45 3mka s GLU 121 Cb 0.02 -0.22 -0.04 0.00 0.26 0.00 0.00 34.13 34.15 3mka s GLU 121 CO -0.08 -0.10 -0.06 -0.48 -0.54 0.00 0.00 175.26 174.00 3mka s LEU 122 N 0.70 2.46 -0.08 2.70 0.05 -0.42 -1.21 118.68 122.88 3mka s LEU 122 Ca -0.06 -0.92 0.04 0.00 0.05 0.00 0.00 54.13 53.25 3mka s LEU 122 Cb -0.09 -0.00 -0.00 0.00 -2.05 0.00 0.00 46.19 44.05 3mka s LEU 122 CO -0.02 -0.46 -0.22 0.00 -0.55 0.00 0.00 176.35 175.10 3mka s VAL 124 N 0.20 2.41 0.01 0.00 1.01 -0.60 -1.21 120.40 122.22 3mka s VAL 124 Ca -0.12 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.11 3mka s VAL 124 Cb -0.16 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 3mka s VAL 124 CO 0.06 0.51 -0.25 0.00 0.00 0.00 0.00 175.10 175.42 3mka s ALA 125 N 1.25 2.25 -0.07 5.51 0.00 -0.25 -1.27 121.76 129.18 3mka s ALA 125 Ca 0.03 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3mka s ALA 125 Cb -0.14 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.45 3mka s ALA 125 CO -0.09 0.54 -0.04 -2.00 0.00 0.00 0.00 175.76 174.17 3mka s GLU 126 N -0.90 0.91 0.44 0.00 2.12 -0.76 0.34 118.70 120.85 3mka s GLU 126 Ca 0.11 -0.07 0.08 0.00 0.36 0.00 0.00 54.97 55.45 3mka s GLU 126 Cb -0.10 -1.03 0.01 0.00 0.26 0.00 0.00 34.13 33.27 3mka s GLU 126 CO 0.01 -0.18 0.57 0.14 -0.54 0.00 0.00 175.26 175.25 3mka s VAL 127 N 1.39 2.84 0.78 3.70 -7.23 -0.67 -1.96 120.40 119.24 3mka s VAL 127 Ca -0.03 -1.05 -0.12 0.00 -1.81 0.00 0.00 61.98 58.97 3mka s VAL 127 Cb -0.13 -2.90 0.06 0.00 0.56 0.00 0.00 36.38 33.97 3mka s VAL 127 CO -0.03 0.00 1.10 0.00 -0.31 0.00 0.00 175.10 175.87 3mka s ALA 128 N -2.41 2.42 0.48 1.32 0.00 -1.26 -4.86 121.76 117.46 3mka s ALA 128 Ca 0.54 -0.29 -0.20 0.00 0.00 0.00 0.00 51.96 52.01 3mka s ALA 128 Cb -0.08 -3.07 -0.09 0.00 0.00 0.00 0.00 23.12 19.88 3mka s ALA 128 CO 0.33 -1.59 1.02 -1.01 0.00 0.00 0.00 175.76 174.50 3mka s HIS 129 N -3.25 3.06 -0.38 0.00 3.76 -1.26 -4.79 115.29 112.44 3mka s HIS 129 Ca 0.60 1.58 -0.44 0.00 -0.15 0.00 0.00 55.06 56.66 3mka s HIS 129 Cb -0.13 -3.02 -0.18 0.00 1.11 0.00 0.00 32.58 30.36 3mka s HIS 129 CO 0.53 -0.69 1.63 0.98 -0.85 0.00 0.00 174.74 176.34 3mka n TYR 130 N -0.93 1.83 0.00 1.40 9.36 -1.26 0.03 117.16 127.59 3mka n TYR 130 Ca 0.09 0.89 0.00 0.00 3.32 0.00 0.00 57.90 62.20 3mka n TYR 130 Cb 0.53 -2.32 0.00 0.00 -0.63 0.00 0.00 39.34 36.92 3mka n TYR 130 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3mka n GLY 131 N 3.95 2.91 3.80 2.98 0.00 -1.26 -5.04 105.19 112.54 3mka n GLY 131 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 3mka n GLY 131 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mka s GLU 132 N -0.08 0.75 -0.34 1.61 2.02 0.10 -5.04 118.70 117.73 3mka s GLU 132 Ca 0.00 0.06 -0.01 0.00 0.02 0.00 0.00 54.97 55.04 3mka s GLU 132 Cb 0.00 -1.82 0.12 0.00 0.10 0.00 0.00 34.13 32.53 3mka s GLU 132 CO 0.00 -2.41 0.16 0.95 0.02 0.00 0.00 175.26 173.98 3mka s THR 133 N -3.41 0.66 -0.00 3.63 -4.23 -1.26 -4.78 115.64 106.25 3mka s THR 133 Ca 0.67 -1.61 0.02 0.00 -1.18 0.00 0.00 61.69 59.59 3mka s THR 133 Cb -0.11 -1.49 -0.01 0.00 1.34 0.00 0.00 72.50 72.23 3mka s THR 133 CO 0.53 -0.80 -0.07 -0.75 -0.54 0.00 0.00 174.62 172.98 3mka s LYS 134 N 1.30 0.59 0.19 3.99 2.20 -1.26 -5.11 119.74 121.63 3mka s LYS 134 Ca 0.13 -0.29 -0.31 0.00 -0.36 0.00 0.00 55.97 55.14 3mka s LYS 134 Cb -0.20 -0.56 -0.09 0.00 -1.51 0.00 0.00 37.83 35.47 3mka s LYS 134 CO -0.16 0.15 1.44 1.03 -0.36 0.00 0.00 175.35 177.45 3mka s ARG 135 N -0.27 4.29 0.96 4.03 0.52 -1.26 -4.41 118.95 122.80 3mka s ARG 135 Ca 0.02 2.22 -0.13 0.00 -0.52 0.00 0.00 55.73 57.33 3mka s ARG 135 Cb -0.03 -3.17 0.07 0.00 0.52 0.00 0.00 34.95 32.34 3mka s ARG 135 CO -0.00 -0.44 0.53 -2.30 0.02 0.00 0.00 175.30 173.10 3mka n PRO 136 N 3.16 -0.45 -4.70 3.54 -0.02 -1.26 -4.87 135.00 130.41 3mka n PRO 136 Ca 0.09 -0.09 -0.24 0.00 -2.02 0.00 0.00 63.50 61.25 3mka n PRO 136 Cb 0.41 -1.95 -0.15 0.00 -0.02 0.00 0.00 33.50 31.79 3mka n PRO 136 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3mka s GLU 137 N -3.82 1.29 -0.01 -0.52 2.02 -0.83 -5.00 118.70 111.84 3mka s GLU 137 Ca 0.59 -0.67 0.02 0.00 0.02 0.00 0.00 54.97 54.92 3mka s GLU 137 Cb -0.21 -1.28 -0.00 0.00 0.10 0.00 0.00 34.13 32.74 3mka s GLU 137 CO 0.66 0.34 -0.06 -0.51 0.02 0.00 0.00 175.26 175.71 3mka s LEU 138 N -0.63 1.95 0.01 1.80 1.43 -1.24 -1.84 118.68 120.16 3mka s LEU 138 Ca 0.06 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 3mka s LEU 138 Cb -0.07 -0.33 -0.01 0.00 0.03 0.00 0.00 46.19 45.81 3mka s LEU 138 CO 0.00 0.06 -0.09 -0.31 0.23 0.00 0.00 176.35 176.25 3mka s TYR 139 N -0.05 0.78 -0.05 0.29 2.02 -0.40 -1.40 117.35 118.54 3mka s TYR 139 Ca 0.01 -0.23 0.06 0.00 -0.37 0.00 0.00 57.07 56.54 3mka s TYR 139 Cb -0.03 -0.49 -0.01 0.00 -0.40 0.00 0.00 41.96 41.03 3mka s TYR 139 CO -0.00 -0.02 -0.24 0.50 -1.57 0.00 0.00 175.55 174.22 3mka s ARG 140 N -0.60 2.38 -0.10 -0.62 3.52 -0.19 -1.56 118.95 121.78 3mka s ARG 140 Ca 0.00 -0.86 0.03 0.00 -0.13 0.00 0.00 55.73 54.77 3mka s ARG 140 Cb -0.05 -2.04 0.01 0.00 -1.56 0.00 0.00 34.95 31.31 3mka s ARG 140 CO 0.00 0.37 -0.17 0.42 -0.81 0.00 0.00 175.30 175.11 3mka s ILE 141 N -0.17 1.59 0.52 4.11 1.09 0.98 -0.51 121.20 128.81 3mka s ILE 141 Ca -0.02 -0.73 0.02 0.00 -1.10 0.00 0.00 60.65 58.82 3mka s ILE 141 Cb -0.13 -1.42 0.03 0.00 -1.06 0.00 0.00 42.46 39.87 3mka s ILE 141 CO 0.03 0.46 0.73 0.42 -0.10 0.00 0.00 174.94 176.48 3mka s THR 142 N 0.69 2.85 0.46 2.92 -4.23 -0.71 -1.31 115.64 116.32 3mka s THR 142 Ca -0.13 -0.70 0.12 0.00 -1.18 0.00 0.00 61.69 59.80 3mka s THR 142 Cb -0.16 -3.05 0.25 0.00 1.34 0.00 0.00 72.50 70.88 3mka s THR 142 CO 0.03 -0.03 2.08 0.10 -0.54 0.00 0.00 174.62 176.26 3mka h TYR 143 N 0.19 0.21 -0.21 3.99 -0.00 -1.82 0.14 116.97 119.47 3mka h TYR 143 Ca -0.42 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.28 3mka h TYR 143 Cb 1.29 -0.07 -0.01 0.00 0.00 0.00 0.00 36.73 37.94 3mka h TYR 143 CO 0.38 0.16 0.02 0.22 -0.00 0.00 0.00 178.16 178.95 3mka h ASP 144 N 0.22 0.27 0.00 0.10 3.58 -1.89 -3.41 116.42 115.29 3mka h ASP 144 Ca 0.06 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 3mka h ASP 144 Cb 0.04 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.02 3mka h ASP 144 CO -0.01 0.31 0.00 0.61 -2.88 0.00 0.00 179.24 177.27 3mka n GLY 145 N -1.18 0.76 3.78 -0.78 0.00 0.49 -4.25 105.19 104.01 3mka n GLY 145 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3mka n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mka s SER 146 N -2.33 6.29 -0.06 1.61 0.01 -1.26 -4.68 113.70 113.29 3mka s SER 146 Ca 0.00 2.18 0.04 0.00 1.31 0.00 0.00 55.95 59.48 3mka s SER 146 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.64 3mka s SER 146 CO 0.00 -0.82 -0.18 -0.51 0.41 0.00 0.00 173.24 172.14 3mka s ILE 147 N -1.64 1.53 -0.04 1.44 2.07 -1.26 -1.73 121.20 121.56 3mka s ILE 147 Ca 0.63 -0.75 0.05 0.00 -1.41 0.00 0.00 60.65 59.18 3mka s ILE 147 Cb -0.25 -1.33 -0.01 0.00 0.13 0.00 0.00 42.46 41.00 3mka s ILE 147 CO 0.30 0.44 -0.20 0.00 -1.91 0.00 0.00 174.94 173.57 3mka s ALA 148 N 0.20 1.74 -0.62 1.50 0.00 0.34 -4.96 121.76 119.96 3mka s ALA 148 Ca -0.09 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 50.83 3mka s ALA 148 Cb -0.14 -0.52 0.09 0.00 0.00 0.00 0.00 23.12 22.55 3mka s ALA 148 CO 0.04 0.36 0.81 0.34 0.00 0.00 0.00 175.76 177.30 3mka s ASP 149 N -0.18 6.19 -0.20 0.00 -1.08 -1.26 -1.02 116.67 119.12 3mka s ASP 149 Ca 0.00 -1.29 -0.15 0.00 -0.52 0.00 0.00 52.55 50.59 3mka s ASP 149 Cb -0.11 -2.35 -0.04 0.00 -1.46 0.00 0.00 42.92 38.96 3mka s ASP 149 CO 0.02 -1.23 0.35 -1.61 0.52 0.00 0.00 175.17 173.21 3mka s GLU 150 N 3.18 4.17 0.18 4.34 0.41 -0.49 -5.01 118.70 125.48 3mka s GLU 150 Ca 0.16 0.12 -0.04 0.00 -0.41 0.00 0.00 54.97 54.79 3mka s GLU 150 Cb -0.21 -3.52 0.08 0.00 -1.78 0.00 0.00 34.13 28.70 3mka s GLU 150 CO 0.07 0.02 1.49 -1.35 -0.49 0.00 0.00 175.26 175.00 3mka h PRO 151 N 7.28 0.60 0.00 0.39 0.11 -1.96 -3.30 132.00 135.12 3mka h PRO 151 Ca -0.37 -0.38 0.00 0.00 0.11 0.00 0.00 66.00 65.36 3mka h PRO 151 Cb 1.16 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3mka h PRO 151 CO 0.71 0.99 -0.72 0.72 -0.21 0.00 0.00 178.00 179.50 3mka n HIS 152 N -3.96 0.00 -3.72 0.65 8.25 -1.26 -4.85 115.22 110.33 3mka n HIS 152 Ca -0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.33 3mka n HIS 152 Cb 0.61 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.69 3mka n HIS 152 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3mka s PHE 153 N -1.72 -0.17 0.00 4.41 -0.12 -1.26 0.78 117.98 119.90 3mka s PHE 153 Ca 0.00 -0.17 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 3mka s PHE 153 Cb 0.00 0.45 -0.00 0.00 -0.63 0.00 0.00 43.02 42.83 3mka s PHE 153 CO 0.00 -0.95 -0.03 0.08 -0.05 0.00 0.00 175.22 174.27 3mka s VAL 154 N -3.87 0.23 -0.03 -2.49 1.01 0.11 -4.90 120.40 110.46 3mka s VAL 154 Ca 0.09 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 61.86 3mka s VAL 154 Cb -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 36.38 36.14 3mka s VAL 154 CO -0.03 -0.01 -0.14 -0.69 0.00 0.00 0.00 175.10 174.23 3mka s VAL 155 N -0.26 1.20 0.02 2.92 1.01 -1.26 -1.10 120.40 122.94 3mka s VAL 155 Ca -0.01 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.26 3mka s VAL 155 Cb -0.02 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.33 3mka s VAL 155 CO -0.00 0.35 0.25 -0.04 0.00 0.00 0.00 175.10 175.66 3mka s MET 156 N 0.05 0.69 0.00 2.72 -1.94 -0.27 -5.01 119.30 115.54 3mka s MET 156 Ca -0.03 -0.46 0.00 0.00 -1.71 0.00 0.00 55.69 53.49 3mka s MET 156 Cb -0.10 0.30 0.00 0.00 2.01 0.00 0.00 34.83 37.04 3mka s MET 156 CO 0.01 -0.20 0.00 0.41 -0.01 0.00 0.00 175.02 175.23 3mka n GLY 157 N 0.89 0.60 7.00 -0.03 0.00 -1.26 -0.18 105.19 112.21 3mka n GLY 157 Ca -0.20 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.29 3mka n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mka n GLY 158 N 0.98 2.15 3.44 -0.02 0.00 0.08 -4.19 105.19 107.63 3mka n GLY 158 Ca 0.00 -0.35 -0.44 0.00 0.00 0.00 0.00 46.02 45.23 3mka n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mka s THR 159 N 0.00 4.98 -1.10 2.61 -4.23 -1.25 -4.32 115.64 112.33 3mka s THR 159 Ca 0.00 -0.57 0.22 0.00 -1.18 0.00 0.00 61.69 60.15 3mka s THR 159 Cb 0.00 -4.22 -0.17 0.00 1.34 0.00 0.00 72.50 69.46 3mka s THR 159 CO 0.00 -0.69 1.01 0.35 -0.54 0.00 0.00 174.62 174.75 3mka n THR 160 N 5.51 0.00 -0.12 3.99 -2.24 -1.26 -4.56 114.28 115.60 3mka n THR 160 Ca -0.08 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 3mka n THR 160 Cb 0.45 0.89 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 3mka n THR 160 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3mka h GLU 161 N 0.23 0.54 -0.52 -0.78 3.07 -1.96 -0.58 114.58 114.57 3mka h GLU 161 Ca 0.00 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.76 3mka h GLU 161 Cb 0.52 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 3mka h GLU 161 CO 0.00 0.47 0.24 -1.00 -1.40 0.00 0.00 179.01 177.32 3mka h PRO 162 N 0.48 0.76 -0.71 2.33 0.13 -1.94 -0.83 132.00 132.21 3mka h PRO 162 Ca 0.13 -0.12 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 3mka h PRO 162 Cb 0.10 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 31.06 3mka h PRO 162 CO -0.02 0.64 0.32 0.82 -0.23 0.00 0.00 178.00 179.53 3mka h ILE 163 N 0.70 1.24 -0.50 -3.56 2.04 -1.70 -0.55 117.51 115.17 3mka h ILE 163 Ca 0.18 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 3mka h ILE 163 Cb 0.14 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 3mka h ILE 163 CO -0.02 0.29 0.27 0.00 0.00 0.00 0.00 178.15 178.69 3mka h ALA 164 N 1.15 0.65 -0.72 1.87 0.00 -0.68 -0.52 119.26 121.01 3mka h ALA 164 Ca 0.24 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3mka h ALA 164 Cb 0.16 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3mka h ALA 164 CO -0.03 0.17 0.30 -0.91 0.00 0.00 0.00 179.25 178.79 3mka h ASN 165 N 0.67 0.97 -0.61 0.00 2.35 -0.70 -0.42 115.58 117.84 3mka h ASN 165 Ca 0.18 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 3mka h ASN 165 Cb 0.06 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 3mka h ASN 165 CO -0.03 0.87 0.34 0.00 -1.65 0.00 0.00 177.43 176.96 3mka h ALA 166 N 1.14 0.78 -0.71 -0.83 0.00 -0.68 -0.81 119.26 118.16 3mka h ALA 166 Ca 0.24 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3mka h ALA 166 Cb 0.18 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3mka h ALA 166 CO -0.02 0.30 0.18 -0.07 0.00 0.00 0.00 179.25 179.64 3mka h LEU 167 N 0.83 1.07 -0.81 0.00 4.07 -0.69 -1.66 115.31 118.13 3mka h LEU 167 Ca 0.22 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 3mka h LEU 167 Cb 0.03 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.46 3mka h LEU 167 CO -0.04 1.02 0.43 0.50 -1.08 0.00 0.00 178.44 179.27 3mka h LYS 168 N 1.07 1.14 -0.66 1.13 3.64 -0.63 0.40 116.57 122.66 3mka h LYS 168 Ca 0.22 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 3mka h LYS 168 Cb 0.36 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 3mka h LYS 168 CO 0.00 0.85 0.14 0.93 -2.27 0.00 0.00 179.45 179.09 3mka h GLU 169 N 1.13 1.08 -0.02 1.90 4.39 -0.70 -3.31 114.58 119.04 3mka h GLU 169 Ca 0.28 -0.27 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3mka h GLU 169 Cb 0.05 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3mka h GLU 169 CO -0.04 0.98 -0.02 -1.13 -1.16 0.00 0.00 179.01 177.64 3mka n SER 170 N -4.26 2.51 -4.72 1.42 3.41 -0.67 -5.00 113.62 106.31 3mka n SER 170 Ca 0.04 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.48 3mka n SER 170 Cb 0.27 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 3mka n SER 170 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3mka s TYR 171 N -1.57 3.38 -0.04 7.33 5.04 0.14 -5.02 117.35 126.61 3mka s TYR 171 Ca 0.21 1.24 0.03 0.00 -2.44 0.00 0.00 57.07 56.11 3mka s TYR 171 Cb 0.15 -3.49 0.01 0.00 0.35 0.00 0.00 41.96 38.98 3mka s TYR 171 CO 0.24 -1.54 -0.11 0.00 -1.34 0.00 0.00 175.55 172.80 3mka s ALA 172 N 0.78 1.08 0.31 3.97 0.00 -1.26 -5.02 121.76 121.62 3mka s ALA 172 Ca 0.59 -0.39 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 3mka s ALA 172 Cb -0.32 -0.44 -0.10 0.00 0.00 0.00 0.00 23.12 22.26 3mka s ALA 172 CO 0.31 0.14 1.36 -2.00 0.00 0.00 0.00 175.76 175.58 3mka s GLU 173 N 0.38 4.31 -1.46 0.00 2.56 -1.26 -3.34 118.70 119.89 3mka s GLU 173 Ca -0.08 2.27 -0.08 0.00 0.00 0.00 0.00 54.97 57.09 3mka s GLU 173 Cb -0.12 -3.08 0.02 0.00 2.00 0.00 0.00 34.13 32.95 3mka s GLU 173 CO 0.02 -0.29 0.90 0.09 -0.56 0.00 0.00 175.26 175.41 3mka n ASN 174 N 1.31 -6.07 -4.79 -1.70 4.13 -1.26 -4.97 115.26 101.90 3mka n ASN 174 Ca 0.02 -0.44 -0.32 0.00 1.68 0.00 0.00 54.58 55.52 3mka n ASN 174 Cb 0.41 -4.84 0.05 0.00 -1.54 0.00 0.00 39.78 33.86 3mka n ASN 174 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3mka s ALA 175 N -3.24 2.58 0.75 5.41 0.00 -1.21 -4.40 121.76 121.64 3mka s ALA 175 Ca 0.47 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 3mka s ALA 175 Cb -0.21 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 19.71 3mka s ALA 175 CO 0.58 -1.21 1.09 -1.54 0.00 0.00 0.00 175.76 174.68 3mka s SER 176 N -3.16 4.69 0.19 0.00 1.04 -1.26 -2.97 113.70 112.22 3mka s SER 176 Ca 0.62 1.83 -0.12 0.00 0.48 0.00 0.00 55.95 58.76 3mka s SER 176 Cb -0.16 -2.52 0.11 0.00 0.10 0.00 0.00 66.02 63.54 3mka s SER 176 CO 0.47 -1.91 1.82 0.25 0.98 0.00 0.00 173.24 174.84 3mka h LEU 177 N -0.90 0.78 -0.51 2.42 5.85 -1.98 0.82 115.31 121.80 3mka h LEU 177 Ca -0.44 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.17 3mka h LEU 177 Cb 1.23 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 3mka h LEU 177 CO 0.52 0.63 0.18 0.74 -0.34 0.00 0.00 178.44 180.17 3mka h THR 178 N 0.88 1.22 -0.50 1.05 2.02 -1.92 0.18 112.91 115.85 3mka h THR 178 Ca 0.23 -0.72 -0.06 0.00 0.77 0.00 0.00 66.41 66.63 3mka h THR 178 Cb -0.01 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 3mka h THR 178 CO -0.04 0.27 0.09 0.44 0.37 0.00 0.00 175.52 176.64 3mka h ASP 179 N 0.69 0.78 -0.48 4.18 3.32 -1.77 -2.01 116.42 121.13 3mka h ASP 179 Ca 0.17 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 3mka h ASP 179 Cb 0.23 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3mka h ASP 179 CO -0.01 0.84 0.10 0.00 -1.72 0.00 0.00 179.24 178.45 3mka h ALA 180 N 0.97 0.64 -0.67 3.45 0.00 0.95 -2.17 119.26 122.43 3mka h ALA 180 Ca 0.15 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3mka h ALA 180 Cb 0.39 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3mka h ALA 180 CO 0.01 0.34 0.22 1.25 0.00 0.00 0.00 179.25 181.08 3mka h LEU 181 N 0.66 0.97 -0.55 0.00 5.85 -0.57 -1.84 115.31 119.84 3mka h LEU 181 Ca 0.15 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 3mka h LEU 181 Cb 0.35 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3mka h LEU 181 CO 0.00 0.91 0.24 -0.09 -0.34 0.00 0.00 178.44 179.17 3mka h ARG 182 N 0.98 0.81 -0.64 1.25 2.43 -1.25 -2.55 114.38 115.42 3mka h ARG 182 Ca 0.22 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3mka h ARG 182 Cb 0.28 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 3mka h ARG 182 CO -0.01 0.69 0.19 0.82 -1.51 0.00 0.00 179.97 180.15 3mka h ILE 183 N 0.75 1.25 -0.61 1.20 2.04 -1.17 -2.94 117.51 118.04 3mka h ILE 183 Ca 0.19 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 3mka h ILE 183 Cb 0.17 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3mka h ILE 183 CO -0.02 0.33 0.22 0.00 0.00 0.00 0.00 178.15 178.68 3mka h ALA 184 N 1.07 0.80 -0.77 1.87 0.00 -1.18 -2.64 119.26 118.41 3mka h ALA 184 Ca 0.20 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3mka h ALA 184 Cb 0.31 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3mka h ALA 184 CO -0.00 0.44 0.30 0.28 0.00 0.00 0.00 179.25 180.26 3mka h VAL 185 N 0.86 1.26 -0.76 0.00 2.07 -1.41 -2.84 116.25 115.43 3mka h VAL 185 Ca 0.20 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 3mka h VAL 185 Cb 0.24 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 3mka h VAL 185 CO -0.01 0.33 0.34 0.00 0.02 0.00 0.00 177.57 178.25 3mka h ALA 186 N 1.15 0.99 -0.81 1.67 0.00 -1.37 -2.75 119.26 118.14 3mka h ALA 186 Ca 0.26 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3mka h ALA 186 Cb 0.23 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3mka h ALA 186 CO -0.02 0.58 0.45 0.00 0.00 0.00 0.00 179.25 180.26 3mka h ALA 187 N 1.17 1.27 -0.57 0.00 0.00 -1.25 -2.81 119.26 117.06 3mka h ALA 187 Ca 0.26 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3mka h ALA 187 Cb 0.17 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3mka h ALA 187 CO -0.03 0.60 0.18 -0.07 0.00 0.00 0.00 179.25 179.93 3mka h LEU 188 N 1.13 0.80 -0.62 0.00 3.38 -1.26 -2.93 115.31 115.81 3mka h LEU 188 Ca 0.29 -0.13 0.12 0.00 0.09 0.00 0.00 57.88 58.25 3mka h LEU 188 Cb 0.01 -0.21 -0.12 0.00 0.09 0.00 0.00 40.66 40.44 3mka h LEU 188 CO -0.05 0.76 -0.13 -0.09 0.09 0.00 0.00 178.44 179.02 3mka h ARG 189 N 0.84 0.01 0.00 1.13 9.65 -1.37 -3.48 114.38 121.16 3mka h ARG 189 Ca 0.19 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.07 3mka h ARG 189 Cb 0.25 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 3mka h ARG 189 CO -0.01 0.01 0.00 0.00 2.80 0.00 0.00 179.97 182.77 3mka n ALA 190 N -3.01 1.36 -0.34 2.80 0.00 -1.10 -5.09 120.51 115.13 3mka n ALA 190 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3mka n ALA 190 Cb 0.33 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.78 3mka n ALA 190 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3mka n LEU 203 N -0.22 0.00 -4.45 0.00 4.77 -1.26 -4.79 117.00 111.04 3mka n LEU 203 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 3mka n LEU 203 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3mka n LEU 203 CO 0.00 0.01 -0.19 -0.83 -1.33 0.00 0.00 177.39 175.05 3mka s GLY 204 N 0.00 2.45 0.52 -0.72 0.00 -1.26 -5.03 107.32 103.28 3mka s GLY 204 Ca 0.00 -1.48 0.18 0.00 0.00 0.00 0.00 44.72 43.42 3mka s GLY 204 CO 0.00 -1.74 2.12 -2.08 0.00 0.00 0.00 173.10 171.40 3mka h VAL 205 N 1.93 0.95 -0.01 1.40 2.07 -1.98 -0.68 116.25 119.93 3mka h VAL 205 Ca -0.34 -0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.00 3mka h VAL 205 Cb 1.26 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 3mka h VAL 205 CO 0.54 0.00 -0.79 0.00 0.02 0.00 0.00 177.57 177.34 3mka h ALA 206 N 1.94 0.65 -0.57 1.67 0.00 -1.95 -3.23 119.26 117.77 3mka h ALA 206 Ca 0.05 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3mka h ALA 206 Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3mka h ALA 206 CO -0.00 0.89 0.00 0.43 0.00 0.00 0.00 179.25 180.57 3mka n SER 207 N -3.69 3.72 -4.50 0.00 7.64 -0.87 -4.40 113.62 111.52 3mka n SER 207 Ca -0.02 -1.99 -0.31 0.00 1.01 0.00 0.00 58.87 57.55 3mka n SER 207 Cb 0.75 -0.38 -0.12 0.00 -1.01 0.00 0.00 64.21 63.46 3mka n SER 207 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3mka s LEU 208 N -1.22 2.79 -0.19 -3.43 2.96 -0.31 -0.02 118.68 119.25 3mka s LEU 208 Ca 0.44 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.03 3mka s LEU 208 Cb 0.24 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 45.35 3mka s LEU 208 CO 0.32 0.27 -0.10 -0.70 -1.32 0.00 0.00 176.35 174.82 3mka s GLU 209 N -1.41 1.95 0.04 1.98 2.12 0.58 -4.73 118.70 119.23 3mka s GLU 209 Ca 0.15 -0.77 0.05 0.00 0.36 0.00 0.00 54.97 54.76 3mka s GLU 209 Cb -0.11 -2.33 -0.02 0.00 0.26 0.00 0.00 34.13 31.93 3mka s GLU 209 CO 0.06 -0.42 -0.14 0.08 -0.54 0.00 0.00 175.26 174.30 3mka s VAL 210 N 1.44 1.13 0.05 3.70 1.01 -1.26 -1.23 120.40 125.24 3mka s VAL 210 Ca -0.01 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 60.69 3mka s VAL 210 Cb -0.16 -1.03 0.08 0.00 0.00 0.00 0.00 36.38 35.28 3mka s VAL 210 CO -0.08 0.01 0.73 0.00 0.00 0.00 0.00 175.10 175.76 3mka s ALA 211 N -0.86 -1.72 0.15 5.51 0.00 -0.81 -1.99 121.76 122.04 3mka s ALA 211 Ca 0.02 0.89 0.05 0.00 0.00 0.00 0.00 51.96 52.91 3mka s ALA 211 Cb -0.08 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 3mka s ALA 211 CO 0.01 -0.63 -0.10 0.14 0.00 0.00 0.00 175.76 175.18 3mka s VAL 212 N -2.86 1.20 -0.71 0.00 -7.23 0.71 -0.45 120.40 111.06 3mka s VAL 212 Ca -0.00 -2.07 -0.08 0.00 -1.81 0.00 0.00 61.98 58.02 3mka s VAL 212 Cb -0.01 -1.88 0.19 0.00 0.56 0.00 0.00 36.38 35.24 3mka s VAL 212 CO -0.06 -0.73 0.58 -0.76 -0.31 0.00 0.00 175.10 173.82 3mka s LEU 213 N -3.18 5.90 -0.72 1.32 1.43 -0.28 -0.77 118.68 122.37 3mka s LEU 213 Ca 0.17 -2.77 -0.27 0.00 -1.03 0.00 0.00 54.13 50.23 3mka s LEU 213 Cb 0.02 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.25 3mka s LEU 213 CO 0.01 -0.46 1.41 -0.62 0.23 0.00 0.00 176.35 176.92 3mka s ASP 214 N 1.35 5.97 0.00 2.29 2.15 0.00 -2.77 116.67 125.67 3mka s ASP 214 Ca 0.17 -0.31 0.02 0.00 0.43 0.00 0.00 52.55 52.86 3mka s ASP 214 Cb -0.16 -2.55 0.10 0.00 -0.30 0.00 0.00 42.92 40.00 3mka s ASP 214 CO -0.06 -1.95 1.02 0.00 -0.17 0.00 0.00 175.17 174.01 3mka n ALA 215 N 10.12 1.15 1.32 3.66 0.00 -1.01 -1.01 120.51 134.75 3mka n ALA 215 Ca 0.08 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.64 3mka n ALA 215 Cb 0.50 -1.04 0.43 0.00 0.00 0.00 0.00 19.45 19.34 3mka n ALA 215 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3mka n ASN 216 N -1.45 1.79 -4.79 0.00 5.15 -1.26 -4.36 115.26 110.34 3mka n ASN 216 Ca 0.01 -1.63 -0.37 0.00 -0.60 0.00 0.00 54.58 51.99 3mka n ASN 216 Cb 0.02 -0.04 -0.06 0.00 -0.53 0.00 0.00 39.78 39.17 3mka n ASN 216 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3mka s ARG 217 N -1.93 4.49 0.08 1.20 1.81 -0.18 -5.00 118.95 119.42 3mka s ARG 217 Ca 0.36 1.17 -0.32 0.00 -1.72 0.00 0.00 55.73 55.22 3mka s ARG 217 Cb 0.20 -2.88 -0.17 0.00 -0.45 0.00 0.00 34.95 31.66 3mka s ARG 217 CO 0.31 0.35 1.62 -1.00 -0.68 0.00 0.00 175.30 175.90 3mka h PRO 218 N 3.37 -0.81 0.00 3.54 0.13 -1.89 -3.39 132.00 132.96 3mka h PRO 218 Ca -0.47 0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3mka h PRO 218 Cb 1.19 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3mka h PRO 218 CO 0.65 -0.54 0.00 -2.13 -0.23 0.00 0.00 178.00 175.75 3mka n ARG 219 N -5.47 0.00 -2.54 0.86 0.63 -1.26 -4.30 116.66 104.57 3mka n ARG 219 Ca -0.12 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.40 3mka n ARG 219 Cb 0.37 -0.07 -0.03 0.00 0.45 0.00 0.00 32.46 33.18 3mka n ARG 219 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3mka s ARG 220 N -1.14 3.19 0.41 -0.14 0.52 -1.26 -4.43 118.95 116.10 3mka s ARG 220 Ca 0.00 -0.24 0.16 0.00 -0.52 0.00 0.00 55.73 55.13 3mka s ARG 220 Cb 0.00 -4.19 0.90 0.00 0.52 0.00 0.00 34.95 32.17 3mka s ARG 220 CO 0.00 -2.16 1.90 0.00 0.02 0.00 0.00 175.30 175.06 3mka h ALA 221 N 10.08 1.41 -2.44 2.13 0.00 -1.04 -3.45 119.26 125.95 3mka h ALA 221 Ca -0.28 -0.26 -0.54 0.00 0.00 0.00 0.00 54.91 53.84 3mka h ALA 221 Cb 1.05 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.81 3mka h ALA 221 CO 1.28 0.36 0.90 0.12 0.00 0.00 0.00 179.25 181.91 3mka s PHE 222 N -4.25 2.72 -0.08 0.00 5.36 -1.26 -0.82 117.98 119.66 3mka s PHE 222 Ca -0.03 0.60 -0.04 0.00 -0.96 0.00 0.00 56.93 56.50 3mka s PHE 222 Cb 0.14 -3.81 0.03 0.00 -0.34 0.00 0.00 43.02 39.04 3mka s PHE 222 CO 0.69 -3.12 0.18 1.03 -1.46 0.00 0.00 175.22 172.54 3mka s ARG 223 N 2.28 0.16 -0.14 10.12 0.52 0.05 -4.97 118.95 126.96 3mka s ARG 223 Ca 0.69 0.37 -0.19 0.00 -0.52 0.00 0.00 55.73 56.08 3mka s ARG 223 Cb -0.36 -0.08 -0.04 0.00 0.52 0.00 0.00 34.95 34.99 3mka s ARG 223 CO 0.30 -0.12 0.52 1.03 0.02 0.00 0.00 175.30 177.04 3mka s ARG 224 N 0.86 4.30 -0.49 3.54 0.52 -1.26 -0.20 118.95 126.21 3mka s ARG 224 Ca -0.06 0.48 -0.18 0.00 -0.52 0.00 0.00 55.73 55.45 3mka s ARG 224 Cb -0.08 -3.48 0.06 0.00 0.52 0.00 0.00 34.95 31.97 3mka s ARG 224 CO -0.05 0.04 0.54 0.42 0.02 0.00 0.00 175.30 176.28 3mka s ILE 225 N 1.00 5.00 0.21 1.52 1.01 -0.84 -4.96 121.20 124.13 3mka s ILE 225 Ca 0.27 -0.66 0.09 0.00 0.00 0.00 0.00 60.65 60.35 3mka s ILE 225 Cb -0.15 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.04 3mka s ILE 225 CO 0.11 -0.71 -0.16 0.28 0.00 0.00 0.00 174.94 174.46 3mka s THR 226 N 2.29 1.88 0.00 2.92 -1.32 -1.26 -4.40 115.64 115.75 3mka s THR 226 Ca 0.12 -2.19 0.00 0.00 -1.21 0.00 0.00 61.69 58.40 3mka s THR 226 Cb -0.21 -2.05 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 3mka s THR 226 CO 0.10 -0.51 0.00 0.61 -2.21 0.00 0.00 174.62 172.61 3mka n GLY 227 N -0.30 2.59 0.36 6.08 0.00 -1.26 -1.92 105.19 110.75 3mka n GLY 227 Ca -0.08 0.22 0.02 0.00 0.00 0.00 0.00 46.02 46.17 3mka n GLY 227 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3mka h SER 228 N 0.00 1.00 -0.69 1.61 0.02 -1.98 0.21 113.55 113.71 3mka h SER 228 Ca 0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 3mka h SER 228 Cb 0.00 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.31 3mka h SER 228 CO 0.00 0.63 0.41 0.00 -1.14 0.00 0.00 176.83 176.73 3mka h ALA 229 N 1.45 0.89 -0.67 3.77 0.00 -1.78 -1.50 119.26 121.42 3mka h ALA 229 Ca 0.43 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 3mka h ALA 229 Cb 0.18 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3mka h ALA 229 CO -0.18 0.37 0.13 1.25 0.00 0.00 0.00 179.25 180.83 3mka h LEU 230 N 0.95 1.04 -0.86 0.00 5.85 -0.72 -2.95 115.31 118.61 3mka h LEU 230 Ca 0.25 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 3mka h LEU 230 Cb -0.01 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.71 3mka h LEU 230 CO -0.04 1.02 0.45 -0.61 -0.34 0.00 0.00 178.44 178.91 3mka h GLN 231 N 1.01 1.22 -0.80 1.25 5.75 -0.12 -2.50 115.11 120.92 3mka h GLN 231 Ca 0.21 -0.16 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 3mka h GLN 231 Cb 0.41 -0.23 -0.04 0.00 1.07 0.00 0.00 27.48 28.69 3mka h GLN 231 CO 0.01 0.91 0.41 0.00 -2.65 0.00 0.00 178.83 177.51 3mka h ALA 232 N 1.24 1.04 -0.66 3.38 0.00 -1.17 -2.82 119.26 120.27 3mka h ALA 232 Ca 0.30 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3mka h ALA 232 Cb 0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3mka h ALA 232 CO -0.04 0.58 0.23 -0.07 0.00 0.00 0.00 179.25 179.94 3mka h LEU 233 N 1.13 0.92 -0.70 0.00 3.38 -1.30 -3.22 115.31 115.51 3mka h LEU 233 Ca 0.28 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 3mka h LEU 233 Cb 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3mka h LEU 233 CO -0.04 0.84 0.37 -0.07 0.09 0.00 0.00 178.44 179.63 3mka h LEU 234 N 0.96 0.90 -1.05 1.67 3.38 -1.20 -3.46 115.31 116.50 3mka h LEU 234 Ca 0.22 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3mka h LEU 234 Cb 0.24 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3mka h LEU 234 CO -0.01 0.75 0.00 1.33 0.09 0.00 0.00 178.44 180.60