#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mka s ILE 7 N 0.00 3.56 -0.42 4.37 1.01 -1.26 -4.94 121.20 123.52 3mka s ILE 7 Ca 0.00 0.52 -0.29 0.00 0.00 0.00 0.00 60.65 60.88 3mka s ILE 7 Cb 0.00 -3.09 0.02 0.00 0.01 0.00 0.00 42.46 39.40 3mka s ILE 7 CO 0.00 -0.65 1.15 -0.55 0.00 0.00 0.00 174.94 174.89 3mka s SER 8 N -3.47 6.69 0.17 3.58 0.15 -1.26 -4.95 113.70 114.61 3mka s SER 8 Ca 0.60 0.68 -0.28 0.00 0.70 0.00 0.00 55.95 57.66 3mka s SER 8 Cb -0.16 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 3mka s SER 8 CO 0.55 -1.16 1.55 -0.65 1.20 0.00 0.00 173.24 174.72 3mka h PRO 9 N 9.05 -0.06 0.00 5.44 0.11 -2.00 0.24 132.00 144.78 3mka h PRO 9 Ca -0.23 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.80 3mka h PRO 9 Cb 1.07 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3mka h PRO 9 CO 1.10 -0.04 -0.39 1.49 -0.21 0.00 0.00 178.00 179.95 3mka h GLU 10 N -0.06 0.00 -0.00 1.05 4.57 -2.00 -2.31 114.58 115.83 3mka h GLU 10 Ca 0.19 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 3mka h GLU 10 Cb 0.48 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.07 3mka h GLU 10 CO -0.90 0.39 -0.02 1.96 -1.18 0.00 0.00 179.01 179.26 3mka h GLN 11 N 0.00 -0.03 0.67 1.92 1.08 -1.39 -3.22 115.11 114.14 3mka h GLN 11 Ca -0.00 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.17 3mka h GLN 11 Cb 0.86 0.01 0.01 0.00 -0.05 0.00 0.00 27.48 28.31 3mka h GLN 11 CO 0.05 -0.02 -0.32 0.00 -0.95 0.00 0.00 178.83 177.59 3mka h ALA 12 N 0.96 -1.05 -0.92 3.87 0.00 -1.19 -3.11 119.26 117.83 3mka h ALA 12 Ca 0.01 -0.20 0.27 0.00 0.00 0.00 0.00 54.91 54.99 3mka h ALA 12 Cb 0.05 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 3mka h ALA 12 CO -0.02 -0.98 0.82 1.98 0.00 0.00 0.00 179.25 181.05 3mka h MET 13 N -1.06 0.00 0.19 0.00 1.85 -1.54 -0.18 114.93 114.19 3mka h MET 13 Ca -0.09 0.00 -0.31 0.00 -0.61 0.00 0.00 59.70 58.69 3mka h MET 13 Cb 0.69 0.00 0.03 0.00 0.43 0.00 0.00 31.60 32.75 3mka h MET 13 CO 0.15 0.00 -1.36 0.07 -0.40 0.00 0.00 176.91 175.37 3mka h ARG 14 N 0.00 0.49 -0.15 0.39 0.11 -1.56 -2.19 114.38 111.47 3mka h ARG 14 Ca 0.44 -0.78 -0.05 0.00 0.10 0.00 0.00 59.98 59.69 3mka h ARG 14 Cb 2.07 0.28 -0.00 0.00 1.11 0.00 0.00 29.97 33.43 3mka h ARG 14 CO -0.00 1.36 -0.11 0.93 0.10 0.00 0.00 179.97 182.25 3mka h GLU 15 N 0.16 0.34 0.18 0.08 5.08 -0.99 -1.61 114.58 117.81 3mka h GLU 15 Ca -0.21 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 3mka h GLU 15 Cb 2.05 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.29 3mka h GLU 15 CO 0.25 0.69 -0.15 0.00 -1.00 0.00 0.00 179.01 178.80 3mka h ARG 16 N -0.01 -0.34 -0.80 2.33 3.08 -1.46 -0.16 114.38 117.03 3mka h ARG 16 Ca 0.03 0.02 0.16 0.00 0.07 0.00 0.00 59.98 60.26 3mka h ARG 16 Cb 0.61 0.08 -0.10 0.00 0.08 0.00 0.00 29.97 30.63 3mka h ARG 16 CO 0.03 -0.22 0.35 1.03 -1.07 0.00 0.00 179.97 180.08 3mka h SER 17 N -0.35 0.34 -0.18 7.04 0.87 -1.35 -0.95 113.55 118.97 3mka h SER 17 Ca -0.00 0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 3mka h SER 17 Cb 0.32 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3mka h SER 17 CO -0.02 0.11 -0.00 -0.33 -0.53 0.00 0.00 176.83 176.05 3mka h GLU 18 N 0.47 0.32 -0.86 2.24 4.39 -0.69 -1.71 114.58 118.76 3mka h GLU 18 Ca 0.45 -0.10 0.16 0.00 0.34 0.00 0.00 59.36 60.21 3mka h GLU 18 Cb 0.71 -0.03 -0.10 0.00 -0.10 0.00 0.00 28.75 29.23 3mka h GLU 18 CO -0.42 0.54 0.42 1.25 -1.16 0.00 0.00 179.01 179.64 3mka h LEU 19 N 0.07 0.47 0.28 1.33 6.46 -0.05 0.22 115.31 124.10 3mka h LEU 19 Ca 0.05 0.11 -0.01 0.00 -0.12 0.00 0.00 57.88 57.90 3mka h LEU 19 Cb 0.39 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 3mka h LEU 19 CO 0.01 0.16 -0.14 0.00 -0.62 0.00 0.00 178.44 177.86 3mka h ALA 20 N 1.59 -0.38 -0.85 1.25 0.00 -1.08 -2.96 119.26 116.83 3mka h ALA 20 Ca 0.48 -0.19 0.22 0.00 0.00 0.00 0.00 54.91 55.43 3mka h ALA 20 Cb 0.75 0.15 -0.14 0.00 0.00 0.00 0.00 17.79 18.55 3mka h ALA 20 CO -0.40 -0.43 0.17 -0.09 0.00 0.00 0.00 179.25 178.49 3mka h ARG 21 N -0.94 0.17 0.24 0.00 2.43 -0.64 -1.49 114.38 114.17 3mka h ARG 21 Ca -0.04 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3mka h ARG 21 Cb 0.50 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 3mka h ARG 21 CO 0.06 0.11 -0.12 0.87 -1.51 0.00 0.00 179.97 179.39 3mka h LYS 22 N 0.18 -0.32 -0.97 0.20 1.57 -1.06 0.20 116.57 116.38 3mka h LYS 22 Ca 0.52 0.02 0.13 0.00 -1.87 0.00 0.00 60.65 59.45 3mka h LYS 22 Cb 1.01 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 33.31 3mka h LYS 22 CO -0.66 -0.10 0.59 0.78 -0.57 0.00 0.00 179.45 179.48 3mka h GLY 23 N -0.48 1.59 0.74 3.86 0.00 -1.22 0.15 103.07 107.71 3mka h GLY 23 Ca -0.03 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3mka h GLY 23 CO 0.06 0.11 -0.02 -2.22 0.00 0.00 0.00 176.54 174.47 3mka h ILE 24 N 0.91 1.28 -0.81 2.60 2.04 -1.01 -2.95 117.51 119.56 3mka h ILE 24 Ca 0.49 -0.91 0.17 0.00 1.00 0.00 0.00 64.86 65.62 3mka h ILE 24 Cb 0.54 1.65 -0.11 0.00 -0.74 0.00 0.00 36.82 38.16 3mka h ILE 24 CO -0.29 0.26 0.33 0.00 0.00 0.00 0.00 178.15 178.45 3mka h ALA 25 N 0.71 1.19 0.00 1.87 0.00 0.33 -1.30 119.26 122.06 3mka h ALA 25 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3mka h ALA 25 Cb 0.41 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3mka h ALA 25 CO 0.01 -0.26 0.00 -2.13 0.00 0.00 0.00 179.25 176.87 3mka n ARG 26 N -5.03 0.93 -4.05 0.00 0.63 -0.05 -3.13 116.66 105.97 3mka n ARG 26 Ca 0.17 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.88 3mka n ARG 26 Cb 0.50 -1.06 -0.05 0.00 0.45 0.00 0.00 32.46 32.30 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 -2.00 3.56 0.96 5.13 0.00 -0.58 -4.92 121.76 123.92 3mka s ALA 27 Ca 0.05 -1.71 -0.12 0.00 0.00 0.00 0.00 51.96 50.18 3mka s ALA 27 Cb 0.02 -0.92 0.11 0.00 0.00 0.00 0.00 23.12 22.34 3mka s ALA 27 CO 0.04 0.08 0.77 1.63 0.00 0.00 0.00 175.76 178.28 3mka n LYS 28 N -1.18 -0.61 -4.20 0.00 4.01 -1.26 -0.56 118.16 114.35 3mka n LYS 28 Ca -0.04 -0.13 -0.23 0.00 -0.51 0.00 0.00 58.31 57.41 3mka n LYS 28 Cb 0.60 -2.11 -0.06 0.00 -0.51 0.00 0.00 35.03 32.95 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 -2.32 5.00 -0.02 4.39 0.01 -1.26 -3.89 113.70 115.61 3mka s SER 29 Ca 0.62 -0.43 -0.03 0.00 1.31 0.00 0.00 55.95 57.42 3mka s SER 29 Cb -0.22 -1.11 0.00 0.00 0.21 0.00 0.00 66.02 64.90 3mka s SER 29 CO 0.63 0.00 0.07 -0.69 0.41 0.00 0.00 173.24 173.67 3mka s VAL 30 N -2.14 0.04 0.06 3.43 1.01 0.38 -1.45 120.40 121.73 3mka s VAL 30 Ca 0.31 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.04 3mka s VAL 30 Cb -0.08 -0.21 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3mka s VAL 30 CO 0.22 -0.16 -0.13 0.68 0.00 0.00 0.00 175.10 175.71 3mka s VAL 31 N -0.49 0.98 -0.03 2.92 -7.23 0.11 -1.46 120.40 115.21 3mka s VAL 31 Ca -0.06 -1.19 0.01 0.00 -1.81 0.00 0.00 61.98 58.94 3mka s VAL 31 Cb -0.04 -0.95 0.02 0.00 0.56 0.00 0.00 36.38 35.97 3mka s VAL 31 CO 0.00 -0.21 -0.01 0.00 -0.31 0.00 0.00 175.10 174.57 3mka s ALA 32 N -1.20 0.38 -0.02 1.32 0.00 0.04 -1.14 121.76 121.14 3mka s ALA 32 Ca -0.03 0.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.92 3mka s ALA 32 Cb -0.09 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.75 3mka s ALA 32 CO 0.02 -0.03 0.17 -0.48 0.00 0.00 0.00 175.76 175.44 3mka s LEU 33 N 0.78 1.41 0.51 0.00 0.05 -0.72 0.45 118.68 121.16 3mka s LEU 33 Ca -0.08 0.00 -0.20 0.00 0.05 0.00 0.00 54.13 53.89 3mka s LEU 33 Cb -0.12 0.72 -0.07 0.00 -2.05 0.00 0.00 46.19 44.67 3mka s LEU 33 CO -0.01 -0.28 1.09 0.00 -0.55 0.00 0.00 176.35 176.59 3mka s ALA 34 N -0.92 2.81 0.28 1.48 0.00 0.54 -1.17 121.76 124.78 3mka s ALA 34 Ca -0.10 0.73 -0.15 0.00 0.00 0.00 0.00 51.96 52.44 3mka s ALA 34 Cb -0.05 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.77 3mka s ALA 34 CO 0.01 -0.53 0.60 1.52 0.00 0.00 0.00 175.76 177.36 3mka s TYR 35 N -1.85 0.21 0.30 0.00 -0.85 0.59 -4.67 117.35 111.09 3mka s TYR 35 Ca 0.69 -0.64 -0.01 0.00 -0.52 0.00 0.00 57.07 56.60 3mka s TYR 35 Cb -0.21 0.42 0.48 0.00 0.38 0.00 0.00 41.96 43.03 3mka s TYR 35 CO 0.24 -1.16 1.95 0.00 -1.52 0.00 0.00 175.55 175.06 3mka h ALA 36 N 2.13 1.46 0.00 9.51 0.00 -1.74 0.45 119.26 131.06 3mka h ALA 36 Ca -0.25 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3mka h ALA 36 Cb 1.25 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3mka h ALA 36 CO 0.32 0.46 -0.14 0.78 0.00 0.00 0.00 179.25 180.68 3mka h GLY 37 N 1.08 0.00 0.00 0.00 0.00 -1.93 -3.48 103.07 98.73 3mka h GLY 37 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 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 -1.02 0.85 3.33 4.60 0.00 0.16 -3.09 105.19 110.02 3mka n GLY 38 Ca -0.02 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 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 2.61 -0.07 1.61 1.01 -1.10 0.22 120.40 124.67 3mka s VAL 39 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3mka s VAL 39 Cb 0.00 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 3mka s VAL 39 CO 0.00 0.55 -0.08 -0.22 0.00 0.00 0.00 175.10 175.35 3mka s LEU 40 N 0.07 3.08 -0.17 3.92 2.96 -0.32 -0.86 118.68 127.35 3mka s LEU 40 Ca -0.08 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 3mka s LEU 40 Cb -0.15 -1.67 0.02 0.00 0.50 0.00 0.00 46.19 44.89 3mka s LEU 40 CO 0.05 0.35 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.88 3mka s PHE 41 N -0.71 2.65 -0.06 5.38 0.08 0.17 -1.76 117.98 123.73 3mka s PHE 41 Ca 0.11 -1.56 0.01 0.00 0.12 0.00 0.00 56.93 55.61 3mka s PHE 41 Cb -0.11 -1.84 0.02 0.00 -0.57 0.00 0.00 43.02 40.51 3mka s PHE 41 CO 0.01 -0.78 -0.08 0.08 -0.10 0.00 0.00 175.22 174.36 3mka s VAL 42 N 1.33 0.84 0.01 -0.44 1.01 -0.29 -1.93 120.40 120.93 3mka s VAL 42 Ca 0.05 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.76 3mka s VAL 42 Cb -0.13 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 3mka s VAL 42 CO -0.12 0.30 -0.03 0.00 0.00 0.00 0.00 175.10 175.25 3mka s ALA 43 N 0.97 0.19 -0.26 5.51 0.00 -0.64 0.06 121.76 127.60 3mka s ALA 43 Ca -0.10 -0.30 -0.29 0.00 0.00 0.00 0.00 51.96 51.28 3mka s ALA 43 Cb -0.15 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.01 3mka s ALA 43 CO 0.00 -0.02 1.10 -1.83 0.00 0.00 0.00 175.76 175.01 3mka s GLU 44 N -0.61 4.17 -0.23 0.00 -1.05 -0.52 -1.23 118.70 119.22 3mka s GLU 44 Ca -0.05 1.30 -0.03 0.00 -0.15 0.00 0.00 54.97 56.04 3mka s GLU 44 Cb -0.04 -3.70 0.12 0.00 -0.44 0.00 0.00 34.13 30.06 3mka s GLU 44 CO -0.00 -0.76 0.30 1.21 0.95 0.00 0.00 175.26 176.96 3mka s ASN 45 N 1.56 0.92 0.17 0.83 3.84 -0.91 -4.48 114.94 116.86 3mka s ASN 45 Ca 0.47 -0.12 -0.11 0.00 0.21 0.00 0.00 52.86 53.31 3mka s ASN 45 Cb -0.15 0.72 0.05 0.00 -0.55 0.00 0.00 41.25 41.32 3mka s ASN 45 CO 0.11 -0.32 1.64 1.55 -2.79 0.00 0.00 177.10 177.29 3mka h PRO 46 N 8.25 0.96 -7.09 0.43 0.13 -1.84 -3.30 132.00 129.54 3mka h PRO 46 Ca -0.17 -0.28 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 3mka h PRO 46 Cb 1.14 -0.10 0.11 0.00 0.13 0.00 0.00 31.00 32.28 3mka h PRO 46 CO 0.29 0.94 0.48 0.45 -0.23 0.00 0.00 178.00 179.92 3mka s SER 47 N -6.39 5.33 0.00 1.44 0.15 -1.26 -4.83 113.70 108.13 3mka s SER 47 Ca -0.12 2.39 0.15 0.00 0.70 0.00 0.00 55.95 59.06 3mka s SER 47 Cb 0.13 -2.60 -0.10 0.00 -1.71 0.00 0.00 66.02 61.74 3mka s SER 47 CO 0.83 -1.50 0.70 -1.14 1.20 0.00 0.00 173.24 173.33 3mka n ARG 48 N -1.43 2.04 -0.02 5.44 0.63 -1.26 -4.55 116.66 117.49 3mka n ARG 48 Ca 0.13 -0.30 0.03 0.00 -0.92 0.00 0.00 57.85 56.79 3mka n ARG 48 Cb 0.49 -1.21 -0.12 0.00 0.45 0.00 0.00 32.46 32.08 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 -0.88 1.55 -4.41 6.15 7.64 -1.26 -4.95 113.62 117.45 3mka n SER 49 Ca 0.04 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.51 3mka n SER 49 Cb 0.26 1.45 -0.11 0.00 -1.01 0.00 0.00 64.21 64.80 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 -4.33 4.89 0.50 -3.43 1.43 -1.26 -5.08 118.68 111.40 3mka s LEU 50 Ca -0.06 -0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 51.90 3mka s LEU 50 Cb 0.08 -2.08 -0.08 0.00 0.03 0.00 0.00 46.19 44.14 3mka s LEU 50 CO 0.61 -0.42 0.98 0.00 0.23 0.00 0.00 176.35 177.76 3mka s GLN 51 N 1.60 3.97 0.00 1.70 -2.07 -1.26 -4.87 119.66 118.73 3mka s GLN 51 Ca 0.03 1.00 0.00 0.00 -1.82 0.00 0.00 55.36 54.57 3mka s GLN 51 Cb -0.19 -2.14 0.00 0.00 -1.09 0.00 0.00 33.01 29.59 3mka s GLN 51 CO 0.08 -0.25 0.09 1.63 -1.32 0.00 0.00 175.29 175.52 3mka n LYS 52 N -1.43 1.55 -4.47 9.60 5.02 -1.26 -5.01 118.16 122.16 3mka n LYS 52 Ca 0.07 -0.09 -0.23 0.00 -2.02 0.00 0.00 58.31 56.04 3mka n LYS 52 Cb 0.54 -0.42 -0.16 0.00 -0.02 0.00 0.00 35.03 34.96 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 -0.25 0.94 0.20 -0.18 1.01 -1.26 -0.67 121.20 121.00 3mka s ILE 53 Ca 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 60.65 60.16 3mka s ILE 53 Cb 0.00 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.59 3mka s ILE 53 CO 0.00 0.30 0.36 -0.44 0.00 0.00 0.00 174.94 175.16 3mka s SER 54 N 0.55 -0.02 0.05 3.58 0.01 0.06 -5.01 113.70 112.93 3mka s SER 54 Ca -0.11 -0.92 -0.21 0.00 1.31 0.00 0.00 55.95 56.03 3mka s SER 54 Cb -0.14 0.50 -0.06 0.00 0.21 0.00 0.00 66.02 66.53 3mka s SER 54 CO 0.02 -0.99 0.62 -0.70 0.41 0.00 0.00 173.24 172.59 3mka s GLU 55 N -4.00 4.31 -0.17 12.44 2.12 -1.26 -0.42 118.70 131.72 3mka s GLU 55 Ca 0.21 0.81 -0.13 0.00 0.36 0.00 0.00 54.97 56.22 3mka s GLU 55 Cb 0.02 -3.29 -0.07 0.00 0.26 0.00 0.00 34.13 31.05 3mka s GLU 55 CO 0.05 0.50 -0.29 1.28 -0.54 0.00 0.00 175.26 176.26 3mka n LEU 56 N 2.18 1.69 0.00 2.70 4.77 -0.05 -4.86 117.00 123.44 3mka n LEU 56 Ca -0.08 0.29 -0.02 0.00 -0.03 0.00 0.00 56.01 56.17 3mka n LEU 56 Cb 0.51 -0.66 -0.01 0.00 -2.33 0.00 0.00 43.42 40.93 3mka n LEU 56 CO 0.43 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.50 3mka n TYR 57 N -4.16 -0.29 -0.20 -1.77 9.36 -0.94 -4.75 117.16 114.42 3mka n TYR 57 Ca -0.26 -0.24 -0.12 0.00 3.32 0.00 0.00 57.90 60.59 3mka n TYR 57 Cb 0.59 0.04 -0.09 0.00 -0.63 0.00 0.00 39.34 39.25 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 0.19 -1.84 -0.23 2.98 3.32 -1.95 -2.76 116.42 116.13 3mka h ASP 58 Ca -0.02 0.25 -0.06 0.00 0.02 0.00 0.00 57.03 57.22 3mka h ASP 58 Cb 0.11 0.77 -0.04 0.00 0.22 0.00 0.00 39.33 40.40 3mka h ASP 58 CO 0.03 -0.33 -0.05 0.54 -1.72 0.00 0.00 179.24 177.71 3mka n ARG 59 N -5.18 2.20 -4.17 3.56 5.12 -1.26 -1.09 116.66 115.83 3mka n ARG 59 Ca -0.02 -2.93 -0.28 0.00 -1.93 0.00 0.00 57.85 52.69 3mka n ARG 59 Cb 0.30 -1.76 -0.17 0.00 -1.16 0.00 0.00 32.46 29.67 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 -3.00 1.31 0.34 1.55 1.01 -1.04 -1.80 120.40 118.76 3mka s VAL 60 Ca 0.41 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.98 3mka s VAL 60 Cb 0.35 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 3mka s VAL 60 CO 0.04 0.41 0.13 -0.83 0.00 0.00 0.00 175.10 174.85 3mka s GLY 61 N 1.32 1.97 -0.01 4.51 0.00 0.15 -0.87 107.32 114.39 3mka s GLY 61 Ca -0.01 -1.85 0.01 0.00 0.00 0.00 0.00 44.72 42.87 3mka s GLY 61 CO -0.06 -1.78 -0.03 -0.12 0.00 0.00 0.00 173.10 171.11 3mka s PHE 62 N -2.44 0.36 0.01 1.90 5.36 0.44 -1.51 117.98 122.10 3mka s PHE 62 Ca 0.38 -0.06 -0.00 0.00 -0.96 0.00 0.00 56.93 56.28 3mka s PHE 62 Cb -0.02 -0.28 -0.01 0.00 -0.34 0.00 0.00 43.02 42.38 3mka s PHE 62 CO 0.22 -0.04 -0.01 0.00 -1.46 0.00 0.00 175.22 173.94 3mka s ALA 63 N 0.16 0.03 0.11 11.12 0.00 -0.35 -0.76 121.76 132.07 3mka s ALA 63 Ca -0.01 -0.17 -0.08 0.00 0.00 0.00 0.00 51.96 51.69 3mka s ALA 63 Cb -0.04 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 3mka s ALA 63 CO -0.00 -0.05 0.20 0.00 0.00 0.00 0.00 175.76 175.91 3mka s ALA 64 N -0.45 -0.06 0.01 0.00 0.00 0.16 -1.03 121.76 120.39 3mka s ALA 64 Ca -0.05 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.15 3mka s ALA 64 Cb -0.03 0.62 -0.01 0.00 0.00 0.00 0.00 23.12 23.70 3mka s ALA 64 CO -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 175.76 175.17 3mka s ALA 65 N -3.91 0.32 0.00 0.00 0.00 -0.19 -4.86 121.76 113.13 3mka s ALA 65 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.73 3mka s ALA 65 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.15 3mka s ALA 65 CO -0.07 0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.13 3mka n GLY 66 N 2.50 0.72 3.67 0.00 0.00 -1.26 -0.97 105.19 109.86 3mka n GLY 66 Ca -0.16 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.71 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 -1.73 4.29 0.07 1.61 2.20 -0.14 -4.92 119.74 121.12 3mka s LYS 67 Ca 0.00 1.68 -0.28 0.00 -0.36 0.00 0.00 55.97 57.00 3mka s LYS 67 Cb 0.00 -3.66 -0.13 0.00 -1.51 0.00 0.00 37.83 32.52 3mka s LYS 67 CO 0.00 -0.58 1.45 0.35 -0.36 0.00 0.00 175.35 176.20 3mka h PHE 68 N 7.86 -1.17 -1.12 4.03 3.57 -1.96 -1.62 116.94 126.52 3mka h PHE 68 Ca -0.30 0.02 0.32 0.00 3.53 0.00 0.00 57.97 61.53 3mka h PHE 68 Cb 1.13 0.47 -0.06 0.00 2.79 0.00 0.00 35.95 40.29 3mka h PHE 68 CO 0.77 -0.52 0.79 -2.95 -2.23 0.00 0.00 178.31 174.17 3mka h ASN 69 N -0.73 0.10 0.63 0.41 7.08 -1.99 0.17 115.58 121.25 3mka h ASN 69 Ca -0.03 0.02 -0.26 0.00 -3.08 0.00 0.00 56.30 52.95 3mka h ASN 69 Cb 0.67 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.91 3mka h ASN 69 CO -0.12 0.02 -1.17 -0.33 -2.08 0.00 0.00 177.43 173.74 3mka h GLU 70 N 0.09 0.26 0.00 4.14 5.08 -1.78 -2.90 114.58 119.47 3mka h GLU 70 Ca 0.56 -0.41 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3mka h GLU 70 Cb 2.04 0.15 0.00 0.00 0.50 0.00 0.00 28.75 31.43 3mka h GLU 70 CO -0.08 1.18 -0.81 1.97 -1.00 0.00 0.00 179.01 180.28 3mka n PHE 71 N -3.55 0.20 -0.06 4.33 1.16 -0.07 -2.94 117.46 116.53 3mka n PHE 71 Ca -0.07 0.06 -0.16 0.00 -1.87 0.00 0.00 57.45 55.41 3mka n PHE 71 Cb 0.99 -0.37 -0.06 0.00 -1.61 0.00 0.00 39.48 38.43 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 0.90 -0.56 5.98 3.58 -0.85 -1.40 116.42 124.07 3mka h ASP 72 Ca 0.00 -0.57 0.09 0.00 0.42 0.00 0.00 57.03 56.98 3mka h ASP 72 Cb 0.64 -0.26 -0.07 0.00 1.72 0.00 0.00 39.33 41.35 3mka h ASP 72 CO 0.00 1.30 0.15 -1.13 -2.88 0.00 0.00 179.24 176.68 3mka h ASN 73 N 0.53 0.07 0.64 2.28 -0.73 -1.54 -0.46 115.58 116.37 3mka h ASN 73 Ca -0.01 0.09 -0.12 0.00 1.87 0.00 0.00 56.30 58.14 3mka h ASN 73 Cb 1.19 0.11 -0.02 0.00 0.27 0.00 0.00 38.32 39.87 3mka h ASN 73 CO 0.12 0.06 -0.55 -0.07 -0.37 0.00 0.00 177.43 176.62 3mka h LEU 74 N 0.29 0.00 -0.16 0.34 4.07 -1.41 -2.63 115.31 115.82 3mka h LEU 74 Ca 0.28 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.21 3mka h LEU 74 Cb 0.38 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 3mka h LEU 74 CO -0.34 0.55 -0.02 -0.09 -1.08 0.00 0.00 178.44 177.46 3mka h ARG 75 N 0.00 0.31 0.18 1.13 2.43 -0.19 -1.53 114.38 116.70 3mka h ARG 75 Ca -0.01 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3mka h ARG 75 Cb 1.02 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 3mka h ARG 75 CO 0.07 0.56 -0.26 0.00 -1.51 0.00 0.00 179.97 178.83 3mka h ARG 76 N 0.02 -0.48 0.00 0.20 3.08 -1.08 -0.83 114.38 115.29 3mka h ARG 76 Ca 0.04 0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 3mka h ARG 76 Cb 0.44 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 3mka h ARG 76 CO 0.01 -0.32 -0.08 0.78 -1.07 0.00 0.00 179.97 179.30 3mka h GLY 77 N -0.50 0.00 1.52 0.04 0.00 -1.48 -0.12 103.07 102.52 3mka h GLY 77 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.14 3mka h GLY 77 CO -0.11 0.00 -0.80 -1.33 0.00 0.00 0.00 176.54 174.30 3mka h GLY 78 N 0.44 0.51 1.31 4.60 0.00 -0.47 -0.98 103.07 108.48 3mka h GLY 78 Ca -0.00 -0.77 -0.10 0.00 0.00 0.00 0.00 47.33 46.46 3mka h GLY 78 CO 0.01 0.68 -0.12 -2.22 0.00 0.00 0.00 176.54 174.89 3mka h ILE 79 N 0.30 1.26 -0.44 2.60 2.04 0.15 -0.58 117.51 122.85 3mka h ILE 79 Ca -0.05 -1.20 -0.06 0.00 1.00 0.00 0.00 64.86 64.55 3mka h ILE 79 Cb 1.40 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 3mka h ILE 79 CO 0.14 0.41 0.03 1.56 0.00 0.00 0.00 178.15 180.29 3mka h GLN 80 N 0.73 0.75 -0.20 2.37 4.20 -0.88 -1.66 115.11 120.43 3mka h GLN 80 Ca 0.12 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 3mka h GLN 80 Cb 0.61 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 3mka h GLN 80 CO 0.04 0.80 0.09 0.35 -0.67 0.00 0.00 178.83 179.45 3mka h PHE 81 N 0.60 0.29 -0.21 2.96 3.57 -0.97 -1.16 116.94 122.02 3mka h PHE 81 Ca 0.13 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 3mka h PHE 81 Cb 0.45 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 3mka h PHE 81 CO 0.03 0.31 0.07 0.00 -2.23 0.00 0.00 178.31 176.49 3mka h ALA 82 N 0.95 0.27 -0.49 2.41 0.00 -1.01 -1.77 119.26 119.63 3mka h ALA 82 Ca 0.07 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3mka h ALA 82 Cb 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3mka h ALA 82 CO -0.01 -0.10 0.30 -0.44 0.00 0.00 0.00 179.25 178.99 3mka h ASP 83 N 0.17 0.49 -0.76 0.00 3.32 -1.27 -0.55 116.42 117.81 3mka h ASP 83 Ca 0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3mka h ASP 83 Cb 0.23 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 3mka h ASP 83 CO -0.00 0.35 0.44 0.74 -1.72 0.00 0.00 179.24 179.04 3mka h THR 84 N 0.59 1.22 -0.05 0.35 2.02 -1.13 -1.61 112.91 114.31 3mka h THR 84 Ca 0.19 -0.52 -0.18 0.00 0.77 0.00 0.00 66.41 66.67 3mka h THR 84 Cb -0.00 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 3mka h THR 84 CO -0.08 0.24 -0.74 0.03 0.37 0.00 0.00 175.52 175.34 3mka h ARG 85 N 1.05 0.29 0.00 6.66 2.47 -1.04 -1.91 114.38 121.90 3mka h ARG 85 Ca 0.27 -0.25 -0.07 0.00 -1.26 0.00 0.00 59.98 58.67 3mka h ARG 85 Cb -0.00 0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 3mka h ARG 85 CO -0.05 0.91 -0.33 0.78 0.56 0.00 0.00 179.97 181.84 3mka h GLY 86 N 1.51 0.00 0.24 0.04 0.00 -0.83 -1.98 103.07 102.05 3mka h GLY 86 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.27 3mka h GLY 86 CO 0.12 0.00 -0.15 -1.82 0.00 0.00 0.00 176.54 174.69 3mka h TYR 87 N 0.00 0.12 0.00 5.60 3.20 -1.17 -3.19 116.97 121.53 3mka h TYR 87 Ca -0.00 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 3mka h TYR 87 Cb 0.79 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.04 3mka h TYR 87 CO 0.00 0.96 -0.10 0.00 -1.64 0.00 0.00 178.16 177.38 3mka h ALA 88 N 0.13 1.76 -3.00 1.82 0.00 -1.29 -3.43 119.26 115.25 3mka h ALA 88 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3mka h ALA 88 Cb 1.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3mka h ALA 88 CO 0.03 0.12 0.00 0.66 0.00 0.00 0.00 179.25 180.06 3mka n TYR 89 N -4.30 0.00 -4.13 0.00 4.01 -0.75 -5.09 117.16 106.89 3mka n TYR 89 Ca -0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.57 3mka n TYR 89 Cb 0.17 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.25 0.43 7.72 2.15 -1.21 -4.91 116.67 123.10 3mka s ASP 90 Ca 0.00 -0.68 0.23 0.00 0.43 0.00 0.00 52.55 52.53 3mka s ASP 90 Cb 0.00 0.01 1.23 0.00 -0.30 0.00 0.00 42.92 43.86 3mka s ASP 90 CO 0.00 -0.21 1.77 0.03 -0.17 0.00 0.00 175.17 176.59 3mka h ARG 91 N 4.04 0.27 0.00 4.34 3.08 -1.88 0.20 114.38 124.42 3mka h ARG 91 Ca -0.37 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.66 3mka h ARG 91 Cb 1.19 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3mka h ARG 91 CO 0.46 0.18 0.00 -2.13 -1.07 0.00 0.00 179.97 177.41 3mka n ARG 92 N -4.53 0.58 0.00 0.04 3.00 -1.26 -2.55 116.66 111.95 3mka n ARG 92 Ca 0.26 0.03 0.11 0.00 -0.00 0.00 0.00 57.85 58.25 3mka n ARG 92 Cb 1.00 -1.50 0.04 0.00 0.00 0.00 0.00 32.46 32.00 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 -1.09 1.17 -4.66 6.15 8.00 0.69 -4.88 116.55 121.93 3mka n ASP 93 Ca 0.15 -0.98 -0.42 0.00 0.71 0.00 0.00 54.79 54.25 3mka n ASP 93 Cb 0.11 0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 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 -2.81 4.79 0.24 2.53 1.01 -1.06 -5.02 120.40 120.09 3mka s VAL 94 Ca 0.13 1.81 0.10 0.00 0.00 0.00 0.00 61.98 64.02 3mka s VAL 94 Cb 0.17 -4.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 3mka s VAL 94 CO 0.72 -0.06 -0.18 0.42 0.00 0.00 0.00 175.10 176.00 3mka s THR 95 N 2.61 2.16 0.19 3.92 -4.23 -1.26 -5.02 115.64 114.00 3mka s THR 95 Ca 0.41 -2.27 -0.09 0.00 -1.18 0.00 0.00 61.69 58.57 3mka s THR 95 Cb -0.16 -2.16 0.06 0.00 1.34 0.00 0.00 72.50 71.59 3mka s THR 95 CO 0.10 -0.44 1.64 1.23 -0.54 0.00 0.00 174.62 176.61 3mka h GLY 96 N 2.53 1.13 0.27 3.99 0.00 -1.93 -2.57 103.07 106.50 3mka h GLY 96 Ca -0.40 -0.85 0.09 0.00 0.00 0.00 0.00 47.33 46.17 3mka h GLY 96 CO 0.59 0.78 0.04 -0.09 0.00 0.00 0.00 176.54 177.86 3mka h ARG 97 N 0.95 0.16 -0.43 4.80 2.43 -1.95 -0.93 114.38 119.41 3mka h ARG 97 Ca 0.16 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3mka h ARG 97 Cb 0.59 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3mka h ARG 97 CO 0.04 0.11 0.27 1.96 -1.51 0.00 0.00 179.97 180.83 3mka h GLN 98 N 0.16 0.58 -0.85 0.20 4.20 -1.88 -1.33 115.11 116.19 3mka h GLN 98 Ca 0.25 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.93 3mka h GLN 98 Cb 0.35 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 3mka h GLN 98 CO -0.37 0.41 0.56 -0.07 -0.67 0.00 0.00 178.83 178.69 3mka h LEU 99 N 0.57 0.93 -0.16 1.46 -0.00 -1.05 -1.62 115.31 115.44 3mka h LEU 99 Ca 0.15 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 58.00 3mka h LEU 99 Cb -0.02 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.41 3mka h LEU 99 CO -0.03 0.65 0.04 0.00 -0.00 0.00 0.00 178.44 179.10 3mka h ALA 100 N 1.49 0.21 -0.73 1.53 0.00 -0.81 -1.54 119.26 119.41 3mka h ALA 100 Ca 0.33 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.15 3mka h ALA 100 Cb -0.03 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 3mka h ALA 100 CO -0.09 -0.15 0.48 -0.97 0.00 0.00 0.00 179.25 178.52 3mka h ASN 101 N 0.06 0.68 -0.22 0.00 -0.73 -0.97 -0.61 115.58 113.78 3mka h ASN 101 Ca 0.05 0.00 -0.11 0.00 1.87 0.00 0.00 56.30 58.12 3mka h ASN 101 Cb 0.26 -0.14 -0.00 0.00 0.27 0.00 0.00 38.32 38.71 3mka h ASN 101 CO 0.00 0.44 -0.27 0.58 -0.37 0.00 0.00 177.43 177.81 3mka h VAL 102 N 0.78 1.32 -0.87 2.57 2.07 -0.87 -2.23 116.25 119.02 3mka h VAL 102 Ca 0.31 -1.46 -0.00 0.00 0.82 0.00 0.00 66.70 66.37 3mka h VAL 102 Cb 0.23 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.71 3mka h VAL 102 CO -0.10 0.45 0.54 1.88 0.02 0.00 0.00 177.57 180.36 3mka h TYR 103 N 0.27 1.14 -0.15 1.57 0.05 -0.49 -0.52 116.97 118.83 3mka h TYR 103 Ca 0.03 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.83 3mka h TYR 103 Cb 0.84 -0.38 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 3mka h TYR 103 CO 0.08 0.75 0.04 0.00 -1.05 0.00 0.00 178.16 177.98 3mka h ALA 104 N 1.29 0.16 -0.63 3.88 0.00 -1.08 0.14 119.26 123.02 3mka h ALA 104 Ca 0.31 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 3mka h ALA 104 Cb -0.07 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3mka h ALA 104 CO -0.06 -0.40 0.34 0.37 0.00 0.00 0.00 179.25 179.49 3mka h GLN 105 N 0.11 0.87 0.26 0.00 5.75 -0.98 -0.93 115.11 120.18 3mka h GLN 105 Ca 0.07 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 3mka h GLN 105 Cb 0.05 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.43 3mka h GLN 105 CO -0.08 0.65 -0.12 1.15 -2.65 0.00 0.00 178.83 177.78 3mka h THR 106 N 0.88 0.61 -0.75 2.39 2.02 -0.30 -1.89 112.91 115.86 3mka h THR 106 Ca 0.22 -0.88 0.03 0.00 0.77 0.00 0.00 66.41 66.55 3mka h THR 106 Cb 0.04 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 3mka h THR 106 CO -0.04 0.14 0.48 -0.07 0.37 0.00 0.00 175.52 176.40 3mka h LEU 107 N -0.91 0.78 -0.91 2.58 3.38 -0.78 0.19 115.31 119.64 3mka h LEU 107 Ca -0.04 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.08 3mka h LEU 107 Cb 0.50 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 40.99 3mka h LEU 107 CO 0.06 0.54 0.51 1.23 0.09 0.00 0.00 178.44 180.87 3mka h GLY 108 N 0.92 1.51 1.01 0.83 0.00 -1.18 0.25 103.07 106.42 3mka h GLY 108 Ca 0.30 -0.31 -0.23 0.00 0.00 0.00 0.00 47.33 47.09 3mka h GLY 108 CO -0.11 0.00 -0.96 -0.84 0.00 0.00 0.00 176.54 174.63 3mka h THR 109 N 0.73 1.36 -0.50 4.70 2.02 -0.23 -2.80 112.91 118.19 3mka h THR 109 Ca 0.49 -2.32 0.04 0.00 0.77 0.00 0.00 66.41 65.39 3mka h THR 109 Cb 0.66 2.70 -0.04 0.00 -1.74 0.00 0.00 68.15 69.72 3mka h THR 109 CO -0.34 0.69 0.26 0.40 0.37 0.00 0.00 175.52 176.91 3mka h ILE 110 N 0.08 0.98 -0.83 3.11 2.04 0.04 0.71 117.51 123.64 3mka h ILE 110 Ca -0.14 -0.18 0.12 0.00 1.00 0.00 0.00 64.86 65.66 3mka h ILE 110 Cb 1.67 0.41 -0.08 0.00 -0.74 0.00 0.00 36.82 38.07 3mka h ILE 110 CO 0.19 0.09 0.44 0.15 0.00 0.00 0.00 178.15 179.02 3mka h PHE 111 N 0.52 0.79 0.00 1.37 3.57 -0.53 -0.85 116.94 121.81 3mka h PHE 111 Ca 0.22 0.03 -0.23 0.00 3.53 0.00 0.00 57.97 61.52 3mka h PHE 111 Cb 0.11 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 3mka h PHE 111 CO -0.09 0.26 -1.18 1.15 -2.23 0.00 0.00 178.31 176.22 3mka h THR 112 N 0.69 1.43 0.00 4.41 2.02 -1.13 -3.42 112.91 116.91 3mka h THR 112 Ca 0.42 -3.16 -0.01 0.00 0.77 0.00 0.00 66.41 64.44 3mka h THR 112 Cb 0.50 2.70 -0.00 0.00 -1.74 0.00 0.00 68.15 69.61 3mka h THR 112 CO -0.30 0.81 -1.25 -0.62 0.37 0.00 0.00 175.52 174.53 3mka n GLU 113 N -3.25 0.45 -1.51 6.66 -0.58 0.19 -5.05 120.64 117.55 3mka n GLU 113 Ca -0.05 -0.04 -0.29 0.00 -0.42 0.00 0.00 57.16 56.36 3mka n GLU 113 Cb 0.96 -1.12 0.15 0.00 -0.57 0.00 0.00 31.44 30.86 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 -2.34 0.87 -0.02 3.49 -1.52 -0.36 -4.96 119.66 114.81 3mka s GLN 114 Ca -0.02 0.22 -0.25 0.00 -1.95 0.00 0.00 55.36 53.36 3mka s GLN 114 Cb 0.03 -1.81 -0.19 0.00 -0.22 0.00 0.00 33.01 30.81 3mka s GLN 114 CO 0.21 -2.37 1.23 0.00 -0.25 0.00 0.00 175.29 174.11 3mka h ALA 115 N -1.62 -0.07 -3.53 6.09 0.00 -1.96 -3.44 119.26 114.73 3mka h ALA 115 Ca -0.50 -0.23 -0.67 0.00 0.00 0.00 0.00 54.91 53.51 3mka h ALA 115 Cb 1.32 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 18.98 3mka h ALA 115 CO 0.58 -0.30 -0.70 0.21 0.00 0.00 0.00 179.25 179.04 3mka s LYS 116 N -4.23 2.50 0.74 0.00 2.20 -1.26 -5.11 119.74 114.58 3mka s LYS 116 Ca -0.15 -0.78 -0.07 0.00 -0.36 0.00 0.00 55.97 54.60 3mka s LYS 116 Cb 0.02 -2.49 0.08 0.00 -1.51 0.00 0.00 37.83 33.93 3mka s LYS 116 CO 0.64 0.58 1.05 -1.25 -0.36 0.00 0.00 175.35 176.01 3mka s PRO 117 N -1.72 1.98 -0.00 4.03 0.04 -1.26 -4.85 135.00 133.22 3mka s PRO 117 Ca 0.20 -0.32 -0.26 0.00 0.04 0.00 0.00 61.00 60.65 3mka s PRO 117 Cb -0.11 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 3mka s PRO 117 CO 0.11 -1.40 0.83 0.71 0.04 0.00 0.00 177.00 177.29 3mka s TYR 118 N -3.32 3.67 -1.24 0.56 1.51 -1.26 -4.93 117.35 112.33 3mka s TYR 118 Ca 0.62 1.50 -0.10 0.00 -1.01 0.00 0.00 57.07 58.08 3mka s TYR 118 Cb -0.10 -2.93 0.18 0.00 -0.11 0.00 0.00 41.96 39.01 3mka s TYR 118 CO 0.46 0.12 1.73 0.39 -1.11 0.00 0.00 175.55 177.14 3mka n GLU 119 N 3.47 3.65 -3.75 -0.62 1.02 -1.26 -4.72 120.64 118.43 3mka n GLU 119 Ca 0.01 -3.71 -0.10 0.00 -0.02 0.00 0.00 57.16 53.34 3mka n GLU 119 Cb 0.51 -2.90 -0.06 0.00 -0.02 0.00 0.00 31.44 28.97 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 0.28 0.10 -0.04 2.62 -7.23 -1.26 -0.97 120.40 113.90 3mka s VAL 120 Ca 0.39 -0.84 -0.03 0.00 -1.81 0.00 0.00 61.98 59.69 3mka s VAL 120 Cb 0.06 -1.20 0.02 0.00 0.56 0.00 0.00 36.38 35.82 3mka s VAL 120 CO 0.01 -0.47 0.10 -0.70 -0.31 0.00 0.00 175.10 173.73 3mka s GLU 121 N -3.62 0.08 0.06 4.82 2.12 -0.14 -3.47 118.70 118.54 3mka s GLU 121 Ca 0.02 0.21 -0.00 0.00 0.36 0.00 0.00 54.97 55.57 3mka s GLU 121 Cb 0.03 -0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.31 3mka s GLU 121 CO -0.10 -0.08 -0.04 -0.48 -0.54 0.00 0.00 175.26 174.01 3mka s LEU 122 N 0.56 2.49 -0.08 2.70 0.05 -0.76 -1.02 118.68 122.61 3mka s LEU 122 Ca -0.04 -0.99 0.03 0.00 0.05 0.00 0.00 54.13 53.18 3mka s LEU 122 Cb -0.06 0.11 0.01 0.00 -2.05 0.00 0.00 46.19 44.20 3mka s LEU 122 CO -0.02 -0.55 -0.19 0.00 -0.55 0.00 0.00 176.35 175.04 3mka s VAL 124 N 0.45 2.63 0.02 0.00 1.01 -0.64 -1.21 120.40 122.66 3mka s VAL 124 Ca -0.16 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.13 3mka s VAL 124 Cb -0.17 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 3mka s VAL 124 CO 0.06 0.51 -0.24 0.00 0.00 0.00 0.00 175.10 175.43 3mka s ALA 125 N 1.02 2.05 -0.06 5.51 0.00 -0.57 -1.23 121.76 128.49 3mka s ALA 125 Ca -0.01 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3mka s ALA 125 Cb -0.15 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.54 3mka s ALA 125 CO -0.03 0.49 -0.04 -2.00 0.00 0.00 0.00 175.76 174.18 3mka s GLU 126 N -0.96 0.86 0.45 0.00 2.12 -0.73 0.31 118.70 120.74 3mka s GLU 126 Ca 0.10 -0.07 0.08 0.00 0.36 0.00 0.00 54.97 55.44 3mka s GLU 126 Cb -0.09 -0.95 0.02 0.00 0.26 0.00 0.00 34.13 33.36 3mka s GLU 126 CO 0.01 -0.15 0.58 0.14 -0.54 0.00 0.00 175.26 175.31 3mka s VAL 127 N 1.23 2.82 0.84 3.70 -7.23 -0.75 -1.48 120.40 119.54 3mka s VAL 127 Ca -0.06 -1.04 -0.12 0.00 -1.81 0.00 0.00 61.98 58.96 3mka s VAL 127 Cb -0.14 -2.86 0.10 0.00 0.56 0.00 0.00 36.38 34.04 3mka s VAL 127 CO -0.02 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 175.88 3mka s ALA 128 N -2.42 2.02 0.43 1.32 0.00 -1.26 -4.87 121.76 116.99 3mka s ALA 128 Ca 0.55 -0.30 -0.22 0.00 0.00 0.00 0.00 51.96 51.99 3mka s ALA 128 Cb -0.09 -3.09 -0.10 0.00 0.00 0.00 0.00 23.12 19.85 3mka s ALA 128 CO 0.33 -1.97 0.99 -1.01 0.00 0.00 0.00 175.76 174.10 3mka s HIS 129 N -3.18 3.26 -0.43 0.00 3.76 -1.26 -4.74 115.29 112.70 3mka s HIS 129 Ca 0.62 1.62 -0.44 0.00 -0.15 0.00 0.00 55.06 56.71 3mka s HIS 129 Cb -0.15 -2.96 -0.18 0.00 1.11 0.00 0.00 32.58 30.40 3mka s HIS 129 CO 0.54 -0.35 1.73 0.98 -0.85 0.00 0.00 174.74 176.80 3mka n TYR 130 N -0.52 1.77 0.00 1.40 9.36 -1.26 -0.09 117.16 127.82 3mka n TYR 130 Ca 0.07 0.90 0.00 0.00 3.32 0.00 0.00 57.90 62.19 3mka n TYR 130 Cb 0.53 -2.31 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 4.57 3.01 3.82 2.98 0.00 -1.26 -5.05 105.19 113.27 3mka n GLY 131 Ca 0.33 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.17 0.97 -0.33 1.61 2.02 0.88 -5.04 118.70 118.64 3mka s GLU 132 Ca 0.00 0.08 -0.01 0.00 0.02 0.00 0.00 54.97 55.06 3mka s GLU 132 Cb 0.00 -1.84 0.11 0.00 0.10 0.00 0.00 34.13 32.50 3mka s GLU 132 CO 0.00 -2.27 0.15 0.95 0.02 0.00 0.00 175.26 174.11 3mka s THR 133 N -3.44 0.61 -0.00 3.63 -4.23 -1.26 -4.77 115.64 106.18 3mka s THR 133 Ca 0.66 -1.48 0.01 0.00 -1.18 0.00 0.00 61.69 59.70 3mka s THR 133 Cb -0.11 -1.46 -0.00 0.00 1.34 0.00 0.00 72.50 72.27 3mka s THR 133 CO 0.53 -0.78 -0.05 -0.75 -0.54 0.00 0.00 174.62 173.03 3mka s LYS 134 N 1.44 0.38 0.13 3.99 2.20 -1.26 -5.11 119.74 121.51 3mka s LYS 134 Ca 0.12 -0.16 -0.31 0.00 -0.36 0.00 0.00 55.97 55.26 3mka s LYS 134 Cb -0.19 -0.37 -0.09 0.00 -1.51 0.00 0.00 37.83 35.67 3mka s LYS 134 CO -0.19 0.10 1.46 1.03 -0.36 0.00 0.00 175.35 177.38 3mka s ARG 135 N -0.09 4.28 0.99 4.03 0.52 -1.26 -4.37 118.95 123.05 3mka s ARG 135 Ca 0.02 2.19 -0.15 0.00 -0.52 0.00 0.00 55.73 57.26 3mka s ARG 135 Cb -0.02 -3.22 0.02 0.00 0.52 0.00 0.00 34.95 32.25 3mka s ARG 135 CO -0.00 -0.51 0.09 -2.30 0.02 0.00 0.00 175.30 172.60 3mka n PRO 136 N 3.99 -0.51 -4.68 3.54 -0.02 -1.26 -4.88 135.00 131.18 3mka n PRO 136 Ca 0.12 -0.12 -0.23 0.00 -2.02 0.00 0.00 63.50 61.26 3mka n PRO 136 Cb 0.41 -1.68 -0.15 0.00 -0.02 0.00 0.00 33.50 32.06 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 -3.32 1.22 -0.00 -0.52 2.02 -0.55 -5.00 118.70 112.55 3mka s GLU 137 Ca 0.54 -0.52 0.04 0.00 0.02 0.00 0.00 54.97 55.04 3mka s GLU 137 Cb -0.18 -1.17 -0.01 0.00 0.10 0.00 0.00 34.13 32.87 3mka s GLU 137 CO 0.69 0.30 -0.12 -0.51 0.02 0.00 0.00 175.26 175.65 3mka s LEU 138 N -0.30 2.04 0.02 1.80 1.43 -1.24 -1.77 118.68 120.66 3mka s LEU 138 Ca 0.05 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.93 3mka s LEU 138 Cb -0.06 -0.61 -0.01 0.00 0.03 0.00 0.00 46.19 45.54 3mka s LEU 138 CO -0.00 0.13 -0.08 -0.31 0.23 0.00 0.00 176.35 176.32 3mka s TYR 139 N -0.34 0.72 -0.02 0.29 2.02 -0.36 -1.56 117.35 118.10 3mka s TYR 139 Ca 0.04 -0.29 0.07 0.00 -0.37 0.00 0.00 57.07 56.53 3mka s TYR 139 Cb -0.05 -0.44 -0.02 0.00 -0.40 0.00 0.00 41.96 41.05 3mka s TYR 139 CO -0.00 -0.03 -0.24 0.50 -1.57 0.00 0.00 175.55 174.21 3mka s ARG 140 N -0.82 1.91 -0.10 -0.62 3.52 -0.09 -1.61 118.95 121.14 3mka s ARG 140 Ca -0.02 -0.86 0.02 0.00 -0.13 0.00 0.00 55.73 54.74 3mka s ARG 140 Cb -0.06 -1.85 0.01 0.00 -1.56 0.00 0.00 34.95 31.49 3mka s ARG 140 CO 0.00 0.51 -0.15 0.42 -0.81 0.00 0.00 175.30 175.27 3mka s ILE 141 N -0.57 1.47 0.75 4.11 1.09 0.12 -0.23 121.20 127.94 3mka s ILE 141 Ca 0.09 -0.64 -0.08 0.00 -1.10 0.00 0.00 60.65 58.93 3mka s ILE 141 Cb -0.09 -1.33 0.08 0.00 -1.06 0.00 0.00 42.46 40.06 3mka s ILE 141 CO -0.01 0.43 1.07 0.42 -0.10 0.00 0.00 174.94 176.75 3mka s THR 142 N 0.87 2.20 0.48 2.92 -4.23 0.19 -1.83 115.64 116.23 3mka s THR 142 Ca -0.09 -0.23 0.14 0.00 -1.18 0.00 0.00 61.69 60.33 3mka s THR 142 Cb -0.15 -2.97 0.24 0.00 1.34 0.00 0.00 72.50 70.95 3mka s THR 142 CO 0.01 0.00 2.08 0.10 -0.54 0.00 0.00 174.62 176.26 3mka h TYR 143 N -0.77 0.06 -0.09 3.99 -0.00 -1.84 -1.39 116.97 116.93 3mka h TYR 143 Ca -0.44 -0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.29 3mka h TYR 143 Cb 1.31 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 38.02 3mka h TYR 143 CO 0.14 0.11 0.00 -0.40 -0.00 0.00 0.00 178.16 178.01 3mka n ASP 144 N -4.45 1.38 0.00 0.10 5.75 -1.26 -4.52 116.55 113.54 3mka n ASP 144 Ca -0.02 -1.56 0.00 0.00 -0.01 0.00 0.00 54.79 53.20 3mka n ASP 144 Cb 0.15 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 3mka n ASP 144 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3mka n GLY 145 N 1.11 0.75 3.77 6.12 0.00 -0.52 -4.01 105.19 112.41 3mka n GLY 145 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.45 6.27 -0.02 1.61 0.01 -1.26 -4.65 113.70 113.22 3mka s SER 146 Ca 0.00 2.31 0.05 0.00 1.31 0.00 0.00 55.95 59.62 3mka s SER 146 Cb 0.00 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 3mka s SER 146 CO 0.00 -0.85 -0.15 -0.51 0.41 0.00 0.00 173.24 172.14 3mka s ILE 147 N -1.52 1.24 -0.01 1.44 2.07 -1.26 -0.64 121.20 122.53 3mka s ILE 147 Ca 0.62 -0.65 0.05 0.00 -1.41 0.00 0.00 60.65 59.25 3mka s ILE 147 Cb -0.29 -1.04 -0.01 0.00 0.13 0.00 0.00 42.46 41.25 3mka s ILE 147 CO 0.36 0.35 -0.15 0.00 -1.91 0.00 0.00 174.94 173.59 3mka s ALA 148 N -0.23 1.26 -0.80 1.50 0.00 0.68 -4.96 121.76 119.21 3mka s ALA 148 Ca 0.03 -0.67 -0.17 0.00 0.00 0.00 0.00 51.96 51.15 3mka s ALA 148 Cb -0.07 -0.31 0.16 0.00 0.00 0.00 0.00 23.12 22.89 3mka s ALA 148 CO 0.00 0.30 0.89 0.34 0.00 0.00 0.00 175.76 177.29 3mka s ASP 149 N -0.41 6.56 -0.13 0.00 -1.08 -1.26 -0.91 116.67 119.43 3mka s ASP 149 Ca 0.06 -2.11 -0.22 0.00 -0.52 0.00 0.00 52.55 49.75 3mka s ASP 149 Cb -0.06 -2.31 -0.03 0.00 -1.46 0.00 0.00 42.92 39.06 3mka s ASP 149 CO -0.00 -0.90 0.66 -1.61 0.52 0.00 0.00 175.17 173.83 3mka s GLU 150 N 1.79 4.33 0.18 4.34 0.41 -0.60 -4.99 118.70 124.16 3mka s GLU 150 Ca 0.22 0.75 -0.02 0.00 -0.41 0.00 0.00 54.97 55.51 3mka s GLU 150 Cb -0.12 -3.51 0.06 0.00 -1.78 0.00 0.00 34.13 28.79 3mka s GLU 150 CO -0.05 -0.07 1.44 -1.35 -0.49 0.00 0.00 175.26 174.74 3mka h PRO 151 N 7.07 0.42 0.00 0.39 0.11 -1.97 -3.28 132.00 134.73 3mka h PRO 151 Ca -0.36 -0.33 0.00 0.00 0.11 0.00 0.00 66.00 65.41 3mka h PRO 151 Cb 1.17 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3mka h PRO 151 CO 0.77 0.97 -0.71 0.72 -0.21 0.00 0.00 178.00 179.54 3mka n HIS 152 N -3.85 0.00 -3.81 0.65 8.25 -1.26 -4.87 115.22 110.33 3mka n HIS 152 Ca -0.04 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.33 3mka n HIS 152 Cb 0.70 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.77 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 -1.71 -0.05 -0.01 4.41 -0.12 -1.26 -0.34 117.98 118.90 3mka s PHE 153 Ca 0.00 -0.32 -0.02 0.00 -0.05 0.00 0.00 56.93 56.53 3mka s PHE 153 Cb 0.00 0.44 0.00 0.00 -0.63 0.00 0.00 43.02 42.83 3mka s PHE 153 CO 0.00 -1.01 0.06 0.08 -0.05 0.00 0.00 175.22 174.29 3mka s VAL 154 N -3.91 0.03 -0.03 -2.49 1.01 0.17 -4.88 120.40 110.30 3mka s VAL 154 Ca 0.12 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3mka s VAL 154 Cb -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 36.38 36.20 3mka s VAL 154 CO 0.02 -0.13 -0.09 -0.69 0.00 0.00 0.00 175.10 174.21 3mka s VAL 155 N -0.38 0.77 0.03 2.92 1.01 -1.26 -0.78 120.40 122.71 3mka s VAL 155 Ca -0.04 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 3mka s VAL 155 Cb -0.03 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.69 3mka s VAL 155 CO 0.00 0.24 0.30 -0.04 0.00 0.00 0.00 175.10 175.61 3mka s MET 156 N 0.20 0.79 0.00 2.72 -1.94 -0.53 -5.02 119.30 115.52 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 -0.08 0.34 0.00 0.00 2.01 0.00 0.00 34.83 37.10 3mka s MET 156 CO 0.00 -0.25 0.00 0.41 -0.01 0.00 0.00 175.02 175.18 3mka n GLY 157 N 0.68 0.55 7.00 -0.03 0.00 -1.26 -0.47 105.19 111.66 3mka n GLY 157 Ca -0.19 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.33 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 1.00 2.38 3.50 -0.02 0.00 0.28 -4.29 105.19 108.03 3mka n GLY 158 Ca 0.00 -0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 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 5.06 -0.15 2.61 -4.23 -1.26 -4.42 115.64 113.26 3mka s THR 159 Ca 0.00 -0.23 -0.20 0.00 -1.18 0.00 0.00 61.69 60.08 3mka s THR 159 Cb 0.00 -4.04 -0.24 0.00 1.34 0.00 0.00 72.50 69.56 3mka s THR 159 CO 0.00 -0.41 0.47 0.71 -0.54 0.00 0.00 174.62 174.85 3mka h THR 160 N 5.73 1.12 -0.66 3.99 1.35 -1.97 -3.41 112.91 119.06 3mka h THR 160 Ca -0.27 -2.31 0.10 0.00 -0.55 0.00 0.00 66.41 63.39 3mka h THR 160 Cb 1.11 2.66 -0.11 0.00 -1.73 0.00 0.00 68.15 70.08 3mka h THR 160 CO 0.80 0.56 -0.25 -0.62 -0.25 0.00 0.00 175.52 175.75 3mka n GLU 161 N -4.21 -0.15 0.21 4.72 4.71 -1.26 0.21 120.64 124.88 3mka n GLU 161 Ca -0.25 1.01 -0.16 0.00 -0.01 0.00 0.00 57.16 57.76 3mka n GLU 161 Cb 0.75 -1.51 -0.08 0.00 -1.01 0.00 0.00 31.44 29.60 3mka n GLU 161 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 3mka h PRO 162 N 0.00 -0.74 -0.68 3.49 0.13 -1.97 0.13 132.00 132.36 3mka h PRO 162 Ca 0.23 0.05 0.09 0.00 -0.87 0.00 0.00 66.00 65.50 3mka h PRO 162 Cb 0.40 0.17 -0.07 0.00 0.13 0.00 0.00 31.00 31.63 3mka h PRO 162 CO -0.66 -0.50 0.33 0.82 -0.23 0.00 0.00 178.00 177.77 3mka h ILE 163 N -0.77 0.86 0.09 -3.56 2.04 -0.86 0.15 117.51 115.46 3mka h ILE 163 Ca -0.02 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 3mka h ILE 163 Cb 0.71 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3mka h ILE 163 CO -0.11 0.11 -0.04 0.00 0.00 0.00 0.00 178.15 178.10 3mka h ALA 164 N 1.41 -0.12 -0.33 1.87 0.00 0.07 -1.54 119.26 120.62 3mka h ALA 164 Ca 0.33 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3mka h ALA 164 Cb 0.34 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3mka h ALA 164 CO -0.26 -0.53 -0.01 -0.91 0.00 0.00 0.00 179.25 177.54 3mka h ASN 165 N -0.19 0.58 -0.76 0.00 2.35 -0.28 0.21 115.58 117.49 3mka h ASN 165 Ca -0.01 -0.32 0.08 0.00 -0.55 0.00 0.00 56.30 55.50 3mka h ASN 165 Cb 0.16 -0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.30 3mka h ASN 165 CO 0.02 0.76 0.42 0.00 -1.65 0.00 0.00 177.43 176.98 3mka h ALA 166 N 0.84 1.05 -0.66 -0.83 0.00 -0.67 0.13 119.26 119.13 3mka h ALA 166 Ca 0.09 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3mka h ALA 166 Cb 0.47 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3mka h ALA 166 CO 0.02 0.06 0.39 -0.07 0.00 0.00 0.00 179.25 179.65 3mka h LEU 167 N 0.73 0.79 -0.48 0.00 3.38 -0.53 0.16 115.31 119.37 3mka h LEU 167 Ca 0.36 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 3mka h LEU 167 Cb 0.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3mka h LEU 167 CO -0.23 0.63 0.18 0.50 0.09 0.00 0.00 178.44 179.61 3mka h LYS 168 N 0.89 0.73 -0.48 1.13 3.64 0.51 1.37 116.57 124.37 3mka h LYS 168 Ca 0.23 -0.14 -0.12 0.00 -1.27 0.00 0.00 60.65 59.35 3mka h LYS 168 Cb -0.02 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3mka h LYS 168 CO -0.04 0.66 -0.19 0.93 -2.27 0.00 0.00 179.45 178.54 3mka h GLU 169 N 0.64 0.95 -0.02 1.90 5.08 -0.42 -3.30 114.58 119.40 3mka h GLU 169 Ca 0.16 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 3mka h GLU 169 Cb 0.22 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3mka h GLU 169 CO -0.01 1.05 -0.06 -1.13 -1.00 0.00 0.00 179.01 177.85 3mka n SER 170 N -4.12 2.58 -4.75 1.42 3.41 0.54 -5.01 113.62 107.69 3mka n SER 170 Ca 0.01 -1.79 -0.41 0.00 -0.26 0.00 0.00 58.87 56.41 3mka n SER 170 Cb 0.44 0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 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 -1.79 3.02 -0.08 7.33 5.04 0.47 -5.00 117.35 126.34 3mka s TYR 171 Ca 0.23 1.07 0.02 0.00 -2.44 0.00 0.00 57.07 55.95 3mka s TYR 171 Cb 0.17 -3.81 0.01 0.00 0.35 0.00 0.00 41.96 38.69 3mka s TYR 171 CO 0.29 -2.58 -0.12 0.00 -1.34 0.00 0.00 175.55 171.80 3mka s ALA 172 N -0.14 1.35 0.33 3.97 0.00 -1.26 -5.02 121.76 120.99 3mka s ALA 172 Ca 0.58 -0.48 -0.28 0.00 0.00 0.00 0.00 51.96 51.78 3mka s ALA 172 Cb -0.42 -0.65 -0.09 0.00 0.00 0.00 0.00 23.12 21.96 3mka s ALA 172 CO 0.45 0.03 1.12 -2.00 0.00 0.00 0.00 175.76 175.36 3mka s GLU 173 N 0.83 4.43 -1.47 0.00 2.12 -1.26 -3.57 118.70 119.78 3mka s GLU 173 Ca -0.11 1.80 -0.08 0.00 0.36 0.00 0.00 54.97 56.94 3mka s GLU 173 Cb -0.15 -2.98 0.03 0.00 0.26 0.00 0.00 34.13 31.29 3mka s GLU 173 CO 0.02 0.03 0.72 0.09 -0.54 0.00 0.00 175.26 175.57 3mka n ASN 174 N 0.75 -5.49 -4.79 -1.70 5.03 -1.26 -4.94 115.26 102.86 3mka n ASN 174 Ca 0.01 -0.41 -0.34 0.00 0.87 0.00 0.00 54.58 54.71 3mka n ASN 174 Cb 0.46 -4.42 0.01 0.00 -1.02 0.00 0.00 39.78 34.80 3mka n ASN 174 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3mka s ALA 175 N -3.16 2.70 0.82 5.41 0.00 -1.23 -4.34 121.76 121.96 3mka s ALA 175 Ca 0.42 0.57 -0.11 0.00 0.00 0.00 0.00 51.96 52.84 3mka s ALA 175 Cb -0.20 -3.29 0.09 0.00 0.00 0.00 0.00 23.12 19.73 3mka s ALA 175 CO 0.51 -0.80 1.13 -1.54 0.00 0.00 0.00 175.76 175.06 3mka s SER 176 N -2.33 3.80 0.18 0.00 1.04 -1.26 -3.19 113.70 111.94 3mka s SER 176 Ca 0.67 2.05 -0.13 0.00 0.48 0.00 0.00 55.95 59.02 3mka s SER 176 Cb -0.19 -2.55 0.10 0.00 0.10 0.00 0.00 66.02 63.48 3mka s SER 176 CO 0.32 -2.51 1.83 0.25 0.98 0.00 0.00 173.24 174.11 3mka h LEU 177 N -1.31 0.59 -0.55 2.42 5.85 -1.99 0.02 115.31 120.35 3mka h LEU 177 Ca -0.44 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 3mka h LEU 177 Cb 1.25 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 3mka h LEU 177 CO 0.47 0.42 0.32 0.74 -0.34 0.00 0.00 178.44 180.05 3mka h THR 178 N 0.71 1.17 -0.61 1.05 2.02 -1.90 0.08 112.91 115.43 3mka h THR 178 Ca 0.22 -0.38 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 3mka h THR 178 Cb -0.03 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 3mka h THR 178 CO -0.07 0.17 0.25 0.44 0.37 0.00 0.00 175.52 176.68 3mka h ASP 179 N 0.73 0.84 -0.68 4.18 3.32 -1.82 -0.52 116.42 122.48 3mka h ASP 179 Ca 0.20 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3mka h ASP 179 Cb -0.00 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 3mka h ASP 179 CO -0.04 0.78 0.28 0.00 -1.72 0.00 0.00 179.24 178.54 3mka h ALA 180 N 1.10 0.88 -0.53 3.45 0.00 -0.65 -0.78 119.26 122.73 3mka h ALA 180 Ca 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3mka h ALA 180 Cb 0.19 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3mka h ALA 180 CO -0.02 0.50 0.30 1.25 0.00 0.00 0.00 179.25 181.28 3mka h LEU 181 N 0.96 0.66 -0.56 0.00 5.85 -0.57 -0.36 115.31 121.29 3mka h LEU 181 Ca 0.23 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3mka h LEU 181 Cb 0.20 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3mka h LEU 181 CO -0.02 0.55 0.27 -0.09 -0.34 0.00 0.00 178.44 178.82 3mka h ARG 182 N 0.71 0.80 -0.63 1.25 2.43 -0.62 0.13 114.38 118.45 3mka h ARG 182 Ca 0.19 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3mka h ARG 182 Cb 0.03 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 3mka h ARG 182 CO -0.03 0.65 0.32 0.82 -1.51 0.00 0.00 179.97 180.22 3mka h ILE 183 N 0.75 1.21 -0.64 1.20 2.04 -0.72 -0.39 117.51 120.96 3mka h ILE 183 Ca 0.19 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3mka h ILE 183 Cb 0.11 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 3mka h ILE 183 CO -0.03 0.24 0.29 0.00 0.00 0.00 0.00 178.15 178.65 3mka h ALA 184 N 1.15 0.82 -0.70 1.87 0.00 -0.69 -0.90 119.26 120.81 3mka h ALA 184 Ca 0.22 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3mka h ALA 184 Cb 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3mka h ALA 184 CO -0.03 0.40 0.31 0.28 0.00 0.00 0.00 179.25 180.21 3mka h VAL 185 N 0.88 1.24 -0.42 0.00 2.07 -0.58 -0.22 116.25 119.22 3mka h VAL 185 Ca 0.22 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 3mka h VAL 185 Cb 0.14 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 3mka h VAL 185 CO -0.02 0.29 0.20 0.00 0.02 0.00 0.00 177.57 178.06 3mka h ALA 186 N 1.15 0.54 -0.79 1.67 0.00 -0.64 0.27 119.26 121.46 3mka h ALA 186 Ca 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3mka h ALA 186 Cb 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3mka h ALA 186 CO -0.03 0.10 0.44 0.00 0.00 0.00 0.00 179.25 179.77 3mka h ALA 187 N 1.05 1.01 -0.68 0.00 0.00 -0.76 -2.62 119.26 117.26 3mka h ALA 187 Ca 0.14 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3mka h ALA 187 Cb 0.12 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3mka h ALA 187 CO -0.02 0.51 0.18 1.25 0.00 0.00 0.00 179.25 181.17 3mka h LEU 188 N 1.09 1.01 -1.47 0.00 5.85 -0.63 -3.07 115.31 118.08 3mka h LEU 188 Ca 0.28 -0.22 0.17 0.00 0.84 0.00 0.00 57.88 58.95 3mka h LEU 188 Cb 0.01 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.71 3mka h LEU 188 CO -0.05 0.97 0.57 -0.09 -0.34 0.00 0.00 178.44 179.50 3mka h ARG 189 N 1.00 0.47 -0.90 1.25 2.43 -0.56 -1.08 114.38 116.98 3mka h ARG 189 Ca 0.21 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 3mka h ARG 189 Cb 0.34 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 3mka h ARG 189 CO -0.00 0.31 0.49 0.00 -1.51 0.00 0.00 179.97 179.26 3mka h ALA 190 N 1.62 1.17 -0.86 2.80 0.00 -1.48 -2.58 119.26 119.94 3mka h ALA 190 Ca 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3mka h ALA 190 Cb 0.97 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 3mka h ALA 190 CO -0.17 0.67 0.42 0.78 0.00 0.00 0.00 179.25 180.95 3mka h GLY 191 N 1.26 1.31 0.00 0.00 0.00 -1.32 -3.49 103.07 100.84 3mka h GLY 191 Ca 0.32 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 47.01 3mka h GLY 191 CO -0.05 0.61 0.00 -1.26 0.00 0.00 0.00 176.54 175.84 3mka n SER 192 N -4.31 0.00 0.00 0.19 2.88 -0.98 -4.93 113.62 106.48 3mka n SER 192 Ca 0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 3mka n SER 192 Cb 0.13 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 3mka n SER 192 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3mka n GLY 204 N 0.00 2.26 0.36 0.46 0.00 -1.26 -5.08 105.19 101.93 3mka n GLY 204 Ca 0.00 -0.66 0.11 0.00 0.00 0.00 0.00 46.02 45.47 3mka n GLY 204 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3mka h VAL 205 N 0.00 0.90 0.00 1.61 2.07 -1.98 2.30 116.25 121.15 3mka h VAL 205 Ca 0.00 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.33 3mka h VAL 205 Cb 0.00 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.06 3mka h VAL 205 CO 0.00 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.69 3mka n ALA 206 N -2.48 1.65 -1.38 1.67 0.00 -1.26 -3.60 120.51 115.10 3mka n ALA 206 Ca 0.12 0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.71 3mka n ALA 206 Cb 0.38 -1.37 0.12 0.00 0.00 0.00 0.00 19.45 18.58 3mka n ALA 206 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3mka n SER 207 N -2.15 1.78 -4.16 0.00 3.41 0.77 -4.70 113.62 108.56 3mka n SER 207 Ca 0.02 -2.98 -0.18 0.00 -0.26 0.00 0.00 58.87 55.47 3mka n SER 207 Cb 0.22 -0.40 -0.12 0.00 -0.26 0.00 0.00 64.21 63.65 3mka n SER 207 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3mka s LEU 208 N -2.30 2.27 -0.15 1.04 1.02 -0.78 -2.15 118.68 117.64 3mka s LEU 208 Ca 0.27 -0.60 0.00 0.00 0.02 0.00 0.00 54.13 53.82 3mka s LEU 208 Cb 0.25 -0.49 0.03 0.00 0.02 0.00 0.00 46.19 45.99 3mka s LEU 208 CO 0.00 -0.08 -0.12 -0.70 0.02 0.00 0.00 176.35 175.47 3mka s GLU 209 N -1.70 2.06 0.02 1.70 2.12 -0.37 -4.75 118.70 117.80 3mka s GLU 209 Ca -0.02 -0.51 0.04 0.00 0.36 0.00 0.00 54.97 54.84 3mka s GLU 209 Cb -0.10 -2.01 -0.02 0.00 0.26 0.00 0.00 34.13 32.26 3mka s GLU 209 CO 0.02 -0.27 -0.12 0.08 -0.54 0.00 0.00 175.26 174.43 3mka s VAL 210 N 1.54 0.97 0.11 3.70 1.01 -1.26 -1.62 120.40 124.85 3mka s VAL 210 Ca 0.04 -0.81 -0.25 0.00 0.00 0.00 0.00 61.98 60.96 3mka s VAL 210 Cb -0.13 -0.87 0.08 0.00 0.00 0.00 0.00 36.38 35.46 3mka s VAL 210 CO -0.10 0.05 0.67 0.00 0.00 0.00 0.00 175.10 175.73 3mka s ALA 211 N -0.68 -1.66 0.07 5.51 0.00 -0.81 -1.61 121.76 122.57 3mka s ALA 211 Ca 0.01 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.64 3mka s ALA 211 Cb -0.07 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 3mka s ALA 211 CO 0.01 -0.73 -0.07 0.14 0.00 0.00 0.00 175.76 175.10 3mka s VAL 212 N -3.50 0.56 -0.28 0.00 -7.23 0.55 -0.65 120.40 109.84 3mka s VAL 212 Ca 0.02 -1.48 -0.10 0.00 -1.81 0.00 0.00 61.98 58.60 3mka s VAL 212 Cb -0.01 -1.10 -0.04 0.00 0.56 0.00 0.00 36.38 35.79 3mka s VAL 212 CO -0.11 -0.64 0.16 -0.76 -0.31 0.00 0.00 175.10 173.44 3mka s LEU 213 N -2.28 3.96 -0.23 1.32 1.43 -0.04 -0.87 118.68 121.97 3mka s LEU 213 Ca 0.00 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 52.89 3mka s LEU 213 Cb -0.02 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.12 3mka s LEU 213 CO -0.03 -0.09 -0.03 -0.62 0.23 0.00 0.00 176.35 175.82 3mka s ASP 214 N 1.70 4.40 0.36 2.29 -1.08 0.25 -2.71 116.67 121.88 3mka s ASP 214 Ca 0.06 -0.40 0.03 0.00 -0.52 0.00 0.00 52.55 51.72 3mka s ASP 214 Cb -0.16 -1.76 0.66 0.00 -1.46 0.00 0.00 42.92 40.20 3mka s ASP 214 CO 0.09 -0.03 2.01 0.00 0.52 0.00 0.00 175.17 177.76 3mka h ALA 215 N 8.13 1.56 -0.56 3.66 0.00 -1.83 -2.65 119.26 127.55 3mka h ALA 215 Ca -0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3mka h ALA 215 Cb 1.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 3mka h ALA 215 CO 0.60 0.40 0.31 -0.91 0.00 0.00 0.00 179.25 179.65 3mka h ASN 216 N 0.80 0.69 -3.53 0.00 2.35 -1.93 -3.37 115.58 110.58 3mka h ASN 216 Ca 0.21 -0.05 -0.53 0.00 -0.55 0.00 0.00 56.30 55.38 3mka h ASN 216 Cb -0.07 -0.17 0.09 0.00 0.05 0.00 0.00 38.32 38.22 3mka h ASN 216 CO -0.04 0.56 0.86 -0.13 -1.65 0.00 0.00 177.43 177.02 3mka s ARG 217 N -5.53 4.11 0.14 0.81 1.81 -1.00 -4.91 118.95 114.38 3mka s ARG 217 Ca -0.10 2.59 -0.15 0.00 -1.72 0.00 0.00 55.73 56.35 3mka s ARG 217 Cb 0.17 -3.00 0.01 0.00 -0.45 0.00 0.00 34.95 31.68 3mka s ARG 217 CO 0.77 -0.61 1.70 -1.00 -0.68 0.00 0.00 175.30 175.48 3mka h PRO 218 N 4.23 0.65 0.00 3.54 0.13 -1.88 -3.40 132.00 135.27 3mka h PRO 218 Ca -0.48 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 3mka h PRO 218 Cb 1.23 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3mka h PRO 218 CO 0.74 0.59 -0.04 -2.13 -0.23 0.00 0.00 178.00 176.93 3mka n ARG 219 N -4.62 0.00 -3.25 0.86 0.63 -1.26 -4.29 116.66 104.73 3mka n ARG 219 Ca 0.01 0.00 -0.44 0.00 -0.92 0.00 0.00 57.85 56.50 3mka n ARG 219 Cb 0.14 -0.47 -0.07 0.00 0.45 0.00 0.00 32.46 32.51 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 -2.00 3.06 0.26 -0.14 0.52 -1.26 -4.32 118.95 115.07 3mka s ARG 220 Ca 0.00 -1.08 -0.02 0.00 -0.52 0.00 0.00 55.73 54.11 3mka s ARG 220 Cb 0.00 -4.11 0.34 0.00 0.52 0.00 0.00 34.95 31.69 3mka s ARG 220 CO 0.00 -1.14 1.77 0.00 0.02 0.00 0.00 175.30 175.94 3mka h ALA 221 N 8.90 1.11 -2.80 2.13 0.00 -1.30 -3.46 119.26 123.85 3mka h ALA 221 Ca -0.28 -0.26 -0.53 0.00 0.00 0.00 0.00 54.91 53.85 3mka h ALA 221 Cb 1.10 -0.20 0.08 0.00 0.00 0.00 0.00 17.79 18.78 3mka h ALA 221 CO 0.93 0.57 0.90 0.12 0.00 0.00 0.00 179.25 181.77 3mka s PHE 222 N -5.02 2.75 -0.20 0.00 5.36 -1.25 0.87 117.98 120.48 3mka s PHE 222 Ca -0.10 0.75 -0.11 0.00 -0.96 0.00 0.00 56.93 56.51 3mka s PHE 222 Cb 0.15 -4.08 0.06 0.00 -0.34 0.00 0.00 43.02 38.81 3mka s PHE 222 CO 0.81 -3.67 0.50 1.03 -1.46 0.00 0.00 175.22 172.43 3mka s ARG 223 N -0.41 0.49 -0.05 10.12 0.52 -0.05 -4.91 118.95 124.67 3mka s ARG 223 Ca 0.64 0.92 -0.21 0.00 -0.52 0.00 0.00 55.73 56.55 3mka s ARG 223 Cb -0.48 0.03 -0.04 0.00 0.52 0.00 0.00 34.95 34.98 3mka s ARG 223 CO 0.47 -0.15 0.62 1.03 0.02 0.00 0.00 175.30 177.29 3mka s ARG 224 N 1.44 4.38 -0.42 3.54 0.52 -1.26 -0.33 118.95 126.81 3mka s ARG 224 Ca -0.09 0.75 -0.13 0.00 -0.52 0.00 0.00 55.73 55.73 3mka s ARG 224 Cb -0.07 -3.40 0.04 0.00 0.52 0.00 0.00 34.95 32.04 3mka s ARG 224 CO -0.14 0.20 0.29 0.42 0.02 0.00 0.00 175.30 176.09 3mka s ILE 225 N 0.37 4.90 0.24 1.52 1.01 -0.63 -4.96 121.20 123.65 3mka s ILE 225 Ca 0.33 -0.93 0.09 0.00 0.00 0.00 0.00 60.65 60.14 3mka s ILE 225 Cb -0.17 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 3mka s ILE 225 CO 0.16 -0.38 -0.16 0.28 0.00 0.00 0.00 174.94 174.84 3mka s THR 226 N 1.60 2.01 0.00 2.92 -1.32 -1.26 -4.32 115.64 115.26 3mka s THR 226 Ca 0.03 -2.27 0.00 0.00 -1.21 0.00 0.00 61.69 58.24 3mka s THR 226 Cb -0.21 -2.18 0.00 0.00 -1.51 0.00 0.00 72.50 68.60 3mka s THR 226 CO 0.07 -0.49 0.00 0.61 -2.21 0.00 0.00 174.62 172.60 3mka n GLY 227 N -0.49 2.11 0.29 6.08 0.00 -1.26 -2.35 105.19 109.56 3mka n GLY 227 Ca -0.07 0.44 -0.06 0.00 0.00 0.00 0.00 46.02 46.34 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 0.88 -0.84 1.61 0.02 -1.99 -1.15 113.55 112.08 3mka h SER 228 Ca 0.00 -0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 3mka h SER 228 Cb 0.00 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 3mka h SER 228 CO 0.00 0.71 0.39 0.00 -1.14 0.00 0.00 176.83 176.80 3mka h ALA 229 N 1.20 1.08 -0.65 3.77 0.00 -1.87 -1.40 119.26 121.39 3mka h ALA 229 Ca 0.25 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3mka h ALA 229 Cb 0.03 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 3mka h ALA 229 CO -0.04 0.65 0.24 1.25 0.00 0.00 0.00 179.25 181.35 3mka h LEU 230 N 1.19 0.91 -0.51 0.00 5.85 -1.40 -2.37 115.31 118.99 3mka h LEU 230 Ca 0.29 -0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.73 3mka h LEU 230 Cb 0.13 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3mka h LEU 230 CO -0.03 0.85 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.27 3mka h GLN 231 N 0.92 0.92 -0.72 1.25 5.75 -0.66 -2.47 115.11 120.10 3mka h GLN 231 Ca 0.21 -0.31 -0.04 0.00 -0.15 0.00 0.00 58.65 58.36 3mka h GLN 231 Cb 0.24 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 3mka h GLN 231 CO -0.01 0.96 0.29 0.00 -2.65 0.00 0.00 178.83 177.42 3mka h ALA 232 N 0.93 0.94 -0.72 3.38 0.00 -1.19 -2.69 119.26 119.90 3mka h ALA 232 Ca 0.14 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3mka h ALA 232 Cb 0.57 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3mka h ALA 232 CO 0.03 0.56 0.26 -0.07 0.00 0.00 0.00 179.25 180.03 3mka h LEU 233 N 1.03 1.00 -0.86 0.00 3.38 -1.29 -2.77 115.31 115.80 3mka h LEU 233 Ca 0.24 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 3mka h LEU 233 Cb 0.21 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 3mka h LEU 233 CO -0.02 0.90 0.45 -0.07 0.09 0.00 0.00 178.44 179.79 3mka h LEU 234 N 1.05 1.09 -1.02 1.67 3.38 -1.13 -3.46 115.31 116.89 3mka h LEU 234 Ca 0.24 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3mka h LEU 234 Cb 0.24 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3mka h LEU 234 CO -0.02 0.89 0.00 0.52 0.09 0.00 0.00 178.44 179.92