#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 3.65 1.21 -3.48 0.40 -1.26 -5.09 117.98 113.42 3mka s PHE 6 Ca 0.00 0.92 -0.15 0.00 -0.60 0.00 0.00 56.93 57.10 3mka s PHE 6 Cb 0.00 -2.24 0.30 0.00 0.51 0.00 0.00 43.02 41.58 3mka s PHE 6 CO 0.00 0.56 1.01 -1.50 0.70 0.00 0.00 175.22 176.00 3mka s ILE 7 N -1.26 1.82 -0.54 0.64 2.07 -1.26 -4.93 121.20 117.74 3mka s ILE 7 Ca 0.29 0.00 -0.21 0.00 -1.41 0.00 0.00 60.65 59.32 3mka s ILE 7 Cb -0.15 -2.13 0.05 0.00 0.13 0.00 0.00 42.46 40.36 3mka s ILE 7 CO 0.16 0.00 0.78 -0.55 -1.91 0.00 0.00 174.94 173.42 3mka s SER 8 N -2.81 6.26 0.07 4.50 0.15 -1.26 -4.96 113.70 115.65 3mka s SER 8 Ca 0.68 -0.72 -0.30 0.00 0.70 0.00 0.00 55.95 56.32 3mka s SER 8 Cb -0.21 -2.36 -0.14 0.00 -1.71 0.00 0.00 66.02 61.60 3mka s SER 8 CO 0.62 -1.07 1.47 1.55 1.20 0.00 0.00 173.24 177.01 3mka h PRO 9 N 9.17 -0.81 -0.88 5.44 0.13 -1.99 -2.57 132.00 140.50 3mka h PRO 9 Ca -0.27 0.05 0.15 0.00 -0.87 0.00 0.00 66.00 65.06 3mka h PRO 9 Cb 1.08 0.18 -0.15 0.00 0.13 0.00 0.00 31.00 32.25 3mka h PRO 9 CO 1.04 -0.54 -0.32 -1.91 -0.23 0.00 0.00 178.00 176.04 3mka n GLU 10 N -5.02 -0.18 0.23 0.86 4.07 -1.26 0.54 120.64 119.88 3mka n GLU 10 Ca -0.10 1.37 -0.10 0.00 -0.06 0.00 0.00 57.16 58.27 3mka n GLU 10 Cb 0.39 -2.03 -0.05 0.00 -0.06 0.00 0.00 31.44 29.69 3mka n GLU 10 CO 0.00 0.00 0.00 0.37 -0.06 0.00 0.00 177.13 177.44 3mka h GLN 11 N 0.00 -0.62 -0.98 5.31 5.75 -1.99 -2.63 115.11 119.96 3mka h GLN 11 Ca 0.33 0.04 0.30 0.00 -0.15 0.00 0.00 58.65 59.18 3mka h GLN 11 Cb 0.55 0.14 -0.18 0.00 1.07 0.00 0.00 27.48 29.07 3mka h GLN 11 CO -0.89 -0.41 0.19 0.00 -2.65 0.00 0.00 178.83 175.08 3mka h ALA 12 N -1.18 1.45 -0.25 3.38 0.00 -0.99 0.27 119.26 121.94 3mka h ALA 12 Ca -0.07 0.30 0.06 0.00 0.00 0.00 0.00 54.91 55.21 3mka h ALA 12 Cb 0.49 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.69 3mka h ALA 12 CO 0.11 -0.65 -0.35 1.98 0.00 0.00 0.00 179.25 180.33 3mka h MET 13 N 0.04 -0.34 0.00 0.00 1.85 0.26 -0.98 114.93 115.76 3mka h MET 13 Ca 0.66 0.02 -0.04 0.00 -0.61 0.00 0.00 59.70 59.73 3mka h MET 13 Cb 1.48 0.08 -0.01 0.00 0.43 0.00 0.00 31.60 33.58 3mka h MET 13 CO -0.84 -0.23 -0.19 0.07 -0.40 0.00 0.00 176.91 175.32 3mka h ARG 14 N -0.36 0.00 0.27 0.39 0.11 -0.17 -2.10 114.38 112.52 3mka h ARG 14 Ca 0.12 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.19 3mka h ARG 14 Cb 0.56 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.64 3mka h ARG 14 CO -0.45 0.19 -0.13 0.93 0.10 0.00 0.00 179.97 180.61 3mka h GLU 15 N 0.00 -0.35 -0.54 0.08 5.08 -0.51 0.15 114.58 118.49 3mka h GLU 15 Ca -0.00 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.46 3mka h GLU 15 Cb 0.95 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.22 3mka h GLU 15 CO 0.02 -0.07 0.20 0.00 -1.00 0.00 0.00 179.01 178.17 3mka h ARG 16 N -0.61 0.38 -0.77 2.33 3.08 -1.22 0.14 114.38 117.71 3mka h ARG 16 Ca -0.04 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.02 3mka h ARG 16 Cb 0.44 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 3mka h ARG 16 CO 0.06 0.25 0.51 1.03 -1.07 0.00 0.00 179.97 180.75 3mka h SER 17 N 0.39 0.82 -0.02 7.04 0.87 -1.17 -1.52 113.55 119.96 3mka h SER 17 Ca 0.27 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.80 3mka h SER 17 Cb 0.29 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 3mka h SER 17 CO -0.26 0.57 -0.06 -0.33 -0.53 0.00 0.00 176.83 176.22 3mka h GLU 18 N 0.96 0.08 -0.86 2.24 4.39 0.81 -1.32 114.58 120.88 3mka h GLU 18 Ca 0.31 -0.06 0.20 0.00 0.34 0.00 0.00 59.36 60.15 3mka h GLU 18 Cb 0.03 0.01 -0.12 0.00 -0.10 0.00 0.00 28.75 28.57 3mka h GLU 18 CO -0.09 0.65 0.35 1.25 -1.16 0.00 0.00 179.01 180.02 3mka h LEU 19 N -0.48 0.28 0.47 1.33 6.46 -0.62 0.37 115.31 123.12 3mka h LEU 19 Ca -0.00 0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.88 3mka h LEU 19 Cb 0.66 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.73 3mka h LEU 19 CO 0.01 0.01 -0.23 0.00 -0.62 0.00 0.00 178.44 177.62 3mka h ALA 20 N 1.67 -0.63 -0.79 1.25 0.00 -1.25 -2.69 119.26 116.81 3mka h ALA 20 Ca 0.52 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 55.46 3mka h ALA 20 Cb 0.94 0.24 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 3mka h ALA 20 CO -0.51 -0.60 0.21 -0.09 0.00 0.00 0.00 179.25 178.26 3mka h ARG 21 N -1.14 0.26 0.58 0.00 2.43 -0.55 -2.05 114.38 113.91 3mka h ARG 21 Ca -0.06 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 3mka h ARG 21 Cb 0.51 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 3mka h ARG 21 CO 0.11 0.17 -0.33 0.87 -1.51 0.00 0.00 179.97 179.28 3mka h LYS 22 N 0.26 -0.81 -0.89 0.20 1.57 -0.35 -0.52 116.57 116.03 3mka h LYS 22 Ca 0.47 0.06 0.23 0.00 -1.87 0.00 0.00 60.65 59.53 3mka h LYS 22 Cb 0.85 0.18 -0.16 0.00 0.08 0.00 0.00 32.23 33.18 3mka h LYS 22 CO -0.56 -0.54 0.02 0.78 -0.57 0.00 0.00 179.45 178.58 3mka h GLY 23 N -0.84 1.07 0.96 3.86 0.00 -1.09 0.52 103.07 107.55 3mka h GLY 23 Ca -0.08 0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3mka h GLY 23 CO 0.10 -0.41 0.21 -2.22 0.00 0.00 0.00 176.54 174.22 3mka h ILE 24 N 0.06 1.15 -0.92 2.60 2.04 -1.16 -2.71 117.51 118.58 3mka h ILE 24 Ca 0.52 -0.40 0.08 0.00 1.00 0.00 0.00 64.86 66.06 3mka h ILE 24 Cb 0.99 0.71 -0.07 0.00 -0.74 0.00 0.00 36.82 37.72 3mka h ILE 24 CO -0.81 0.16 0.57 0.00 0.00 0.00 0.00 178.15 178.06 3mka h ALA 25 N 1.06 1.30 0.00 1.87 0.00 0.74 -0.42 119.26 123.81 3mka h ALA 25 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3mka h ALA 25 Cb 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3mka h ALA 25 CO -0.02 0.27 0.00 -2.13 0.00 0.00 0.00 179.25 177.37 3mka n ARG 26 N -4.61 0.88 -3.92 0.00 0.63 -0.52 -3.06 116.66 106.05 3mka n ARG 26 Ca 0.15 0.00 -0.23 0.00 -0.92 0.00 0.00 57.85 56.85 3mka n ARG 26 Cb 0.23 -1.09 -0.05 0.00 0.45 0.00 0.00 32.46 32.00 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 -1.80 3.72 0.98 5.13 0.00 -0.29 -4.94 121.76 124.58 3mka s ALA 27 Ca 0.00 -1.91 -0.11 0.00 0.00 0.00 0.00 51.96 49.94 3mka s ALA 27 Cb 0.00 -0.76 0.18 0.00 0.00 0.00 0.00 23.12 22.54 3mka s ALA 27 CO 0.00 -0.10 1.10 0.15 0.00 0.00 0.00 175.76 176.91 3mka s LYS 28 N -3.96 0.51 0.17 0.00 3.01 -1.26 -1.55 119.74 116.65 3mka s LYS 28 Ca 0.42 1.18 0.07 0.00 -1.01 0.00 0.00 55.97 56.64 3mka s LYS 28 Cb -0.01 -1.69 -0.04 0.00 -1.01 0.00 0.00 37.83 35.07 3mka s LYS 28 CO 0.25 -2.86 -0.01 -1.12 0.51 0.00 0.00 175.35 172.12 3mka s SER 29 N -2.79 4.74 0.00 2.83 0.01 -1.26 -3.83 113.70 113.41 3mka s SER 29 Ca 0.66 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 57.54 3mka s SER 29 Cb -0.22 -1.00 -0.01 0.00 0.21 0.00 0.00 66.02 65.00 3mka s SER 29 CO 0.60 0.10 -0.04 -0.69 0.41 0.00 0.00 173.24 173.62 3mka s VAL 30 N -1.70 0.28 0.06 3.43 1.01 0.85 -1.62 120.40 122.70 3mka s VAL 30 Ca 0.27 -0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.00 3mka s VAL 30 Cb -0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 3mka s VAL 30 CO 0.18 -0.02 -0.16 0.68 0.00 0.00 0.00 175.10 175.78 3mka s VAL 31 N -0.33 1.25 -0.02 2.92 -7.23 0.11 -0.97 120.40 116.12 3mka s VAL 31 Ca -0.01 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 58.99 3mka s VAL 31 Cb -0.03 -1.15 0.02 0.00 0.56 0.00 0.00 36.38 35.78 3mka s VAL 31 CO -0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 175.10 174.74 3mka s ALA 32 N -1.00 0.24 -0.03 1.32 0.00 -0.44 -0.92 121.76 120.93 3mka s ALA 32 Ca 0.02 0.09 -0.11 0.00 0.00 0.00 0.00 51.96 51.96 3mka s ALA 32 Cb -0.09 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.84 3mka s ALA 32 CO 0.02 -0.03 0.24 -0.48 0.00 0.00 0.00 175.76 175.51 3mka s LEU 33 N 0.62 1.11 0.44 0.00 0.05 -0.60 0.11 118.68 120.41 3mka s LEU 33 Ca -0.06 0.12 -0.23 0.00 0.05 0.00 0.00 54.13 54.01 3mka s LEU 33 Cb -0.09 0.98 -0.08 0.00 -2.05 0.00 0.00 46.19 44.95 3mka s LEU 33 CO -0.01 -0.32 1.14 0.00 -0.55 0.00 0.00 176.35 176.61 3mka s ALA 34 N -0.93 3.02 0.29 1.48 0.00 0.69 -1.14 121.76 125.16 3mka s ALA 34 Ca -0.10 0.89 -0.15 0.00 0.00 0.00 0.00 51.96 52.60 3mka s ALA 34 Cb -0.05 -3.36 0.01 0.00 0.00 0.00 0.00 23.12 19.72 3mka s ALA 34 CO 0.02 -0.55 0.61 1.52 0.00 0.00 0.00 175.76 177.36 3mka s TYR 35 N -1.55 0.18 0.28 0.00 -0.85 0.32 -4.72 117.35 111.01 3mka s TYR 35 Ca 0.62 -0.61 -0.02 0.00 -0.52 0.00 0.00 57.07 56.53 3mka s TYR 35 Cb -0.27 0.45 0.41 0.00 0.38 0.00 0.00 41.96 42.92 3mka s TYR 35 CO 0.34 -1.17 1.94 0.00 -1.52 0.00 0.00 175.55 175.13 3mka h ALA 36 N 2.11 1.40 0.00 9.51 0.00 -1.75 0.21 119.26 130.74 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 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3mka h ALA 36 CO 0.32 0.53 -0.08 0.78 0.00 0.00 0.00 179.25 180.80 3mka h GLY 37 N 1.17 0.00 0.00 0.00 0.00 -1.94 -3.48 103.07 98.81 3mka h GLY 37 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 3mka h GLY 37 CO -0.09 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.06 3mka n GLY 38 N -0.71 0.89 3.24 4.60 0.00 0.74 -2.25 105.19 111.70 3mka n GLY 38 Ca -0.02 -0.85 -0.31 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 2.00 -0.10 1.61 1.01 -1.18 0.12 120.40 123.86 3mka s VAL 39 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 3mka s VAL 39 Cb 0.00 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 3mka s VAL 39 CO 0.00 0.55 -0.04 -0.22 0.00 0.00 0.00 175.10 175.39 3mka s LEU 40 N -0.01 3.30 -0.20 3.92 2.96 -0.30 -0.86 118.68 127.50 3mka s LEU 40 Ca -0.08 -0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 3mka s LEU 40 Cb -0.15 -1.75 0.01 0.00 0.50 0.00 0.00 46.19 44.80 3mka s LEU 40 CO 0.05 0.31 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.90 3mka s PHE 41 N -0.51 2.86 -0.05 5.38 0.08 0.95 -1.56 117.98 125.13 3mka s PHE 41 Ca 0.08 -1.37 0.01 0.00 0.12 0.00 0.00 56.93 55.77 3mka s PHE 41 Cb -0.12 -2.00 0.02 0.00 -0.57 0.00 0.00 43.02 40.35 3mka s PHE 41 CO 0.02 -0.70 -0.06 0.08 -0.10 0.00 0.00 175.22 174.45 3mka s VAL 42 N 1.36 0.68 0.00 -0.44 1.01 -0.10 -2.09 120.40 120.83 3mka s VAL 42 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 3mka s VAL 42 Cb -0.14 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 3mka s VAL 42 CO -0.09 0.26 0.02 0.00 0.00 0.00 0.00 175.10 175.29 3mka s ALA 43 N 0.94 -0.03 -0.22 5.51 0.00 -0.66 0.03 121.76 127.32 3mka s ALA 43 Ca -0.11 -0.17 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 3mka s ALA 43 Cb -0.14 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.02 3mka s ALA 43 CO 0.00 -0.08 1.05 -1.83 0.00 0.00 0.00 175.76 174.90 3mka s GLU 44 N -0.63 4.26 -0.25 0.00 -1.05 -0.64 -1.11 118.70 119.28 3mka s GLU 44 Ca -0.07 1.37 -0.02 0.00 -0.15 0.00 0.00 54.97 56.10 3mka s GLU 44 Cb -0.04 -3.64 0.13 0.00 -0.44 0.00 0.00 34.13 30.14 3mka s GLU 44 CO -0.00 -0.62 0.36 1.21 0.95 0.00 0.00 175.26 177.15 3mka s ASN 45 N 1.22 0.45 0.14 0.83 3.84 -1.19 -4.47 114.94 115.77 3mka s ASN 45 Ca 0.44 0.05 -0.13 0.00 0.21 0.00 0.00 52.86 53.44 3mka s ASN 45 Cb -0.15 1.01 0.01 0.00 -0.55 0.00 0.00 41.25 41.56 3mka s ASN 45 CO 0.07 -0.31 1.59 1.55 -2.79 0.00 0.00 177.10 177.21 3mka h PRO 46 N 8.20 0.81 -7.06 0.43 0.13 -1.90 -3.37 132.00 129.25 3mka h PRO 46 Ca -0.18 -0.25 -0.53 0.00 -0.87 0.00 0.00 66.00 64.17 3mka h PRO 46 Cb 1.15 -0.08 0.11 0.00 0.13 0.00 0.00 31.00 32.31 3mka h PRO 46 CO 0.28 0.86 0.53 0.45 -0.23 0.00 0.00 178.00 179.89 3mka s SER 47 N -6.30 5.39 -0.01 1.44 0.15 -1.26 -4.94 113.70 108.17 3mka s SER 47 Ca -0.13 2.53 0.19 0.00 0.70 0.00 0.00 55.95 59.24 3mka s SER 47 Cb 0.11 -2.62 -0.23 0.00 -1.71 0.00 0.00 66.02 61.57 3mka s SER 47 CO 0.81 -1.47 0.69 -1.14 1.20 0.00 0.00 173.24 173.33 3mka n ARG 48 N -1.16 0.76 -0.02 5.44 0.63 -1.26 -4.52 116.66 116.52 3mka n ARG 48 Ca 0.11 -0.05 0.05 0.00 -0.92 0.00 0.00 57.85 57.04 3mka n ARG 48 Cb 0.47 -1.40 -0.12 0.00 0.45 0.00 0.00 32.46 31.86 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 -1.65 1.40 -4.42 6.15 7.64 -1.26 -4.94 113.62 116.54 3mka n SER 49 Ca 0.02 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.49 3mka n SER 49 Cb 0.35 1.55 -0.11 0.00 -1.01 0.00 0.00 64.21 64.99 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 -4.29 4.53 0.44 -3.43 1.43 -1.26 -5.08 118.68 111.01 3mka s LEU 50 Ca -0.06 -0.77 -0.18 0.00 -1.03 0.00 0.00 54.13 52.08 3mka s LEU 50 Cb 0.09 -2.04 -0.10 0.00 0.03 0.00 0.00 46.19 44.17 3mka s LEU 50 CO 0.64 -0.31 0.92 0.00 0.23 0.00 0.00 176.35 177.83 3mka s GLN 51 N 1.60 4.09 0.00 1.70 -2.07 -1.26 -4.87 119.66 118.86 3mka s GLN 51 Ca 0.04 0.97 0.00 0.00 -1.82 0.00 0.00 55.36 54.55 3mka s GLN 51 Cb -0.18 -2.21 0.00 0.00 -1.09 0.00 0.00 33.01 29.52 3mka s GLN 51 CO 0.07 -0.07 0.04 1.63 -1.32 0.00 0.00 175.29 175.64 3mka n LYS 52 N -0.91 3.35 -4.47 9.60 5.02 -1.26 -5.00 118.16 124.49 3mka n LYS 52 Ca 0.06 -0.04 -0.26 0.00 -2.02 0.00 0.00 58.31 56.05 3mka n LYS 52 Cb 0.54 -0.37 -0.17 0.00 -0.02 0.00 0.00 35.03 35.02 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 1.22 0.13 -0.18 1.01 -1.26 -0.99 121.20 120.65 3mka s ILE 53 Ca 0.00 -0.50 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 3mka s ILE 53 Cb 0.00 -1.13 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 3mka s ILE 53 CO 0.00 0.38 0.20 -0.44 0.00 0.00 0.00 174.94 175.08 3mka s SER 54 N 0.89 0.14 0.17 3.58 0.01 0.10 -5.01 113.70 113.58 3mka s SER 54 Ca -0.10 -0.90 -0.26 0.00 1.31 0.00 0.00 55.95 56.00 3mka s SER 54 Cb -0.15 0.37 -0.08 0.00 0.21 0.00 0.00 66.02 66.37 3mka s SER 54 CO 0.01 -0.81 0.81 -0.70 0.41 0.00 0.00 173.24 172.96 3mka s GLU 55 N -3.96 4.62 -0.17 12.44 2.12 -1.26 -0.36 118.70 132.13 3mka s GLU 55 Ca 0.15 1.22 -0.09 0.00 0.36 0.00 0.00 54.97 56.61 3mka s GLU 55 Cb 0.05 -3.28 -0.07 0.00 0.26 0.00 0.00 34.13 31.09 3mka s GLU 55 CO -0.03 0.52 -0.23 1.28 -0.54 0.00 0.00 175.26 176.27 3mka n LEU 56 N 1.74 1.29 0.00 2.70 4.77 0.05 -4.84 117.00 122.70 3mka n LEU 56 Ca -0.04 0.22 -0.03 0.00 -0.03 0.00 0.00 56.01 56.13 3mka n LEU 56 Cb 0.49 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 3mka n LEU 56 CO 0.47 0.28 0.02 0.00 -1.33 0.00 0.00 177.39 176.83 3mka n TYR 57 N -3.83 -0.47 -0.29 -1.77 9.36 -0.87 -4.72 117.16 114.57 3mka n TYR 57 Ca -0.32 -0.47 -0.12 0.00 3.32 0.00 0.00 57.90 60.31 3mka n TYR 57 Cb 0.70 0.09 -0.09 0.00 -0.63 0.00 0.00 39.34 39.41 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 0.37 -1.98 -0.13 2.98 3.32 -1.95 -2.88 116.42 116.16 3mka h ASP 58 Ca -0.05 0.29 -0.05 0.00 0.02 0.00 0.00 57.03 57.25 3mka h ASP 58 Cb 0.22 0.86 -0.03 0.00 0.22 0.00 0.00 39.33 40.60 3mka h ASP 58 CO 0.07 -0.31 -0.19 0.54 -1.72 0.00 0.00 179.24 177.63 3mka n ARG 59 N -5.32 1.75 -4.12 3.56 5.12 -1.26 -0.27 116.66 116.12 3mka n ARG 59 Ca 0.00 -3.02 -0.27 0.00 -1.93 0.00 0.00 57.85 52.63 3mka n ARG 59 Cb 0.30 -1.67 -0.17 0.00 -1.16 0.00 0.00 32.46 29.77 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 -3.09 1.22 0.29 1.55 1.01 -1.09 -1.97 120.40 118.33 3mka s VAL 60 Ca 0.39 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 62.01 3mka s VAL 60 Cb 0.35 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 3mka s VAL 60 CO -0.00 0.39 0.08 -0.83 0.00 0.00 0.00 175.10 174.74 3mka s GLY 61 N 1.39 1.74 -0.01 4.51 0.00 0.19 -0.77 107.32 114.37 3mka s GLY 61 Ca 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 44.72 43.05 3mka s GLY 61 CO -0.06 -1.70 -0.07 -0.12 0.00 0.00 0.00 173.10 171.16 3mka s PHE 62 N -2.34 0.67 -0.01 1.90 5.36 0.51 -0.98 117.98 123.09 3mka s PHE 62 Ca 0.34 -0.14 -0.02 0.00 -0.96 0.00 0.00 56.93 56.15 3mka s PHE 62 Cb -0.05 -0.47 -0.00 0.00 -0.34 0.00 0.00 43.02 42.16 3mka s PHE 62 CO 0.22 -0.05 0.05 0.00 -1.46 0.00 0.00 175.22 173.97 3mka s ALA 63 N 0.08 -0.10 0.13 11.12 0.00 -0.51 0.01 121.76 132.50 3mka s ALA 63 Ca -0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 51.96 51.83 3mka s ALA 63 Cb -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3mka s ALA 63 CO -0.00 -0.07 0.23 0.00 0.00 0.00 0.00 175.76 175.91 3mka s ALA 64 N -0.44 -0.02 -0.00 0.00 0.00 -0.16 -0.50 121.76 120.63 3mka s ALA 64 Ca -0.05 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.09 3mka s ALA 64 Cb -0.03 0.72 -0.00 0.00 0.00 0.00 0.00 23.12 23.80 3mka s ALA 64 CO 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 175.76 175.16 3mka s ALA 65 N -3.93 0.18 0.00 0.00 0.00 -0.65 -4.86 121.76 112.50 3mka s ALA 65 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3mka s ALA 65 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3mka s ALA 65 CO -0.04 0.04 0.00 0.41 0.00 0.00 0.00 175.76 176.17 3mka n GLY 66 N 2.98 0.64 3.67 0.00 0.00 -1.26 -1.00 105.19 110.23 3mka n GLY 66 Ca -0.13 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.00 4.28 0.08 1.61 2.20 -0.09 -4.90 119.74 120.93 3mka s LYS 67 Ca 0.00 1.55 -0.29 0.00 -0.36 0.00 0.00 55.97 56.87 3mka s LYS 67 Cb 0.00 -3.67 -0.12 0.00 -1.51 0.00 0.00 37.83 32.52 3mka s LYS 67 CO 0.00 -0.61 1.46 0.35 -0.36 0.00 0.00 175.35 176.19 3mka h PHE 68 N 7.76 -1.27 -1.03 4.03 3.57 -1.96 -1.67 116.94 126.37 3mka h PHE 68 Ca -0.26 0.03 0.29 0.00 3.53 0.00 0.00 57.97 61.57 3mka h PHE 68 Cb 1.10 0.54 -0.05 0.00 2.79 0.00 0.00 35.95 40.33 3mka h PHE 68 CO 0.77 -0.50 0.73 -2.95 -2.23 0.00 0.00 178.31 174.12 3mka h ASN 69 N -0.64 0.07 0.43 0.41 7.08 -1.99 0.20 115.58 121.13 3mka h ASN 69 Ca -0.01 0.01 -0.30 0.00 -3.08 0.00 0.00 56.30 52.92 3mka h ASN 69 Cb 0.64 -0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.90 3mka h ASN 69 CO -0.22 0.02 -1.32 -0.33 -2.08 0.00 0.00 177.43 173.49 3mka h GLU 70 N 0.06 0.42 0.00 4.14 5.08 -1.76 -3.04 114.58 119.48 3mka h GLU 70 Ca 0.50 -0.68 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3mka h GLU 70 Cb 1.89 0.25 0.00 0.00 0.50 0.00 0.00 28.75 31.38 3mka h GLU 70 CO -0.05 1.32 -0.62 1.97 -1.00 0.00 0.00 179.01 180.64 3mka n PHE 71 N -3.64 0.55 -0.10 4.33 1.16 -0.28 -3.04 117.46 116.44 3mka n PHE 71 Ca -0.12 0.16 -0.12 0.00 -1.87 0.00 0.00 57.45 55.50 3mka n PHE 71 Cb 1.04 -0.66 -0.04 0.00 -1.61 0.00 0.00 39.48 38.22 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 0.64 -0.68 5.98 3.58 -0.78 -0.88 116.42 124.29 3mka h ASP 72 Ca 0.00 -0.42 0.13 0.00 0.42 0.00 0.00 57.03 57.16 3mka h ASP 72 Cb 0.74 -0.18 -0.09 0.00 1.72 0.00 0.00 39.33 41.52 3mka h ASP 72 CO 0.00 0.92 0.21 -1.13 -2.88 0.00 0.00 179.24 176.36 3mka h ASN 73 N 0.36 0.13 0.97 2.28 -0.73 -1.57 -0.42 115.58 116.60 3mka h ASN 73 Ca 0.06 0.11 -0.09 0.00 1.87 0.00 0.00 56.30 58.25 3mka h ASN 73 Cb 0.69 0.12 -0.01 0.00 0.27 0.00 0.00 38.32 39.39 3mka h ASN 73 CO 0.05 0.05 -0.44 -0.07 -0.37 0.00 0.00 177.43 176.65 3mka h LEU 74 N 0.34 0.00 -0.26 0.34 4.07 -1.41 -2.38 115.31 116.02 3mka h LEU 74 Ca 0.36 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.20 3mka h LEU 74 Cb 0.55 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.28 3mka h LEU 74 CO -0.41 0.44 -0.33 -0.09 -1.08 0.00 0.00 178.44 176.98 3mka h ARG 75 N 0.00 0.68 0.06 1.13 2.43 0.31 -2.01 114.38 116.98 3mka h ARG 75 Ca -0.00 -0.38 -0.00 0.00 -0.81 0.00 0.00 59.98 58.78 3mka h ARG 75 Cb 1.04 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3mka h ARG 75 CO 0.06 1.00 -0.03 0.00 -1.51 0.00 0.00 179.97 179.49 3mka h ARG 76 N 0.40 -0.07 0.00 0.20 3.08 -1.10 -1.52 114.38 115.36 3mka h ARG 76 Ca 0.03 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 3mka h ARG 76 Cb 0.91 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.97 3mka h ARG 76 CO 0.08 0.02 -0.10 0.78 -1.07 0.00 0.00 179.97 179.67 3mka h GLY 77 N -0.15 0.00 1.98 0.04 0.00 -1.42 -0.77 103.07 102.76 3mka h GLY 77 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.12 3mka h GLY 77 CO 0.01 0.00 -0.94 -1.33 0.00 0.00 0.00 176.54 174.29 3mka h GLY 78 N 0.57 0.02 1.31 4.60 0.00 -0.75 -1.57 103.07 107.24 3mka h GLY 78 Ca -0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 47.33 47.14 3mka h GLY 78 CO 0.01 0.03 -0.44 -2.22 0.00 0.00 0.00 176.54 173.93 3mka h ILE 79 N 0.01 1.29 -0.52 2.60 2.04 -0.20 -1.06 117.51 121.66 3mka h ILE 79 Ca -0.01 -1.62 -0.12 0.00 1.00 0.00 0.00 64.86 64.10 3mka h ILE 79 Cb 1.65 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 3mka h ILE 79 CO 0.12 0.53 -0.15 1.56 0.00 0.00 0.00 178.15 180.21 3mka h GLN 80 N 0.61 1.02 -0.54 2.37 4.20 -1.13 -1.41 115.11 120.23 3mka h GLN 80 Ca 0.04 -0.40 -0.11 0.00 0.06 0.00 0.00 58.65 58.24 3mka h GLN 80 Cb 1.00 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 3mka h GLN 80 CO 0.09 1.09 -0.10 0.35 -0.67 0.00 0.00 178.83 179.60 3mka h PHE 81 N 0.89 1.13 -0.21 2.96 3.57 -1.22 -2.29 116.94 121.78 3mka h PHE 81 Ca 0.13 -0.23 -0.09 0.00 3.53 0.00 0.00 57.97 61.31 3mka h PHE 81 Cb 0.73 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 3mka h PHE 81 CO 0.05 1.05 -0.22 0.00 -2.23 0.00 0.00 178.31 176.96 3mka h ALA 82 N 0.92 0.31 -0.74 2.41 0.00 -1.10 -2.04 119.26 119.03 3mka h ALA 82 Ca 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 3mka h ALA 82 Cb 0.66 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 3mka h ALA 82 CO 0.05 0.26 0.33 -0.44 0.00 0.00 0.00 179.25 179.44 3mka h ASP 83 N 0.20 0.99 -0.60 0.00 3.32 -1.30 -0.43 116.42 118.59 3mka h ASP 83 Ca 0.03 -0.15 -0.09 0.00 0.02 0.00 0.00 57.03 56.84 3mka h ASP 83 Cb 0.77 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 3mka h ASP 83 CO 0.05 0.87 0.02 0.74 -1.72 0.00 0.00 179.24 179.20 3mka h THR 84 N 1.05 1.27 -0.09 0.35 2.02 -1.38 -1.77 112.91 114.35 3mka h THR 84 Ca 0.25 -1.13 -0.17 0.00 0.77 0.00 0.00 66.41 66.14 3mka h THR 84 Cb 0.16 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 3mka h THR 84 CO -0.03 0.41 -0.66 0.03 0.37 0.00 0.00 175.52 175.64 3mka h ARG 85 N 0.94 0.36 0.00 6.66 2.47 -1.16 -1.42 114.38 122.24 3mka h ARG 85 Ca 0.17 -0.27 -0.06 0.00 -1.26 0.00 0.00 59.98 58.56 3mka h ARG 85 Cb 0.54 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.90 3mka h ARG 85 CO 0.03 0.89 -0.31 0.78 0.56 0.00 0.00 179.97 181.92 3mka h GLY 86 N 1.34 0.00 0.57 0.04 0.00 -0.93 -2.44 103.07 101.65 3mka h GLY 86 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.11 3mka h GLY 86 CO 0.11 0.00 -0.98 -1.82 0.00 0.00 0.00 176.54 173.85 3mka h TYR 87 N 0.00 0.45 0.00 5.60 3.20 -1.15 -3.10 116.97 121.96 3mka h TYR 87 Ca -0.00 -0.33 -0.04 0.00 3.14 0.00 0.00 58.73 61.50 3mka h TYR 87 Cb 0.65 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 3mka h TYR 87 CO 0.00 1.38 -0.18 0.00 -1.64 0.00 0.00 178.16 177.72 3mka h ALA 88 N 0.01 1.24 -3.00 1.82 0.00 -1.24 -3.43 119.26 114.65 3mka h ALA 88 Ca -0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3mka h ALA 88 Cb 1.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3mka h ALA 88 CO 0.09 0.22 0.00 0.66 0.00 0.00 0.00 179.25 180.23 3mka n TYR 89 N -3.65 0.00 -4.06 0.00 4.01 -0.92 -5.10 117.16 107.45 3mka n TYR 89 Ca -0.01 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.63 3mka n TYR 89 Cb 0.30 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.23 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 0.57 0.39 7.72 2.15 -1.20 -4.93 116.67 122.37 3mka s ASP 90 Ca 0.00 -0.75 0.18 0.00 0.43 0.00 0.00 52.55 52.41 3mka s ASP 90 Cb 0.00 0.12 1.10 0.00 -0.30 0.00 0.00 42.92 43.84 3mka s ASP 90 CO 0.00 -0.41 1.74 0.03 -0.17 0.00 0.00 175.17 176.37 3mka h ARG 91 N 3.87 0.38 0.00 4.34 3.08 -1.87 0.11 114.38 124.29 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 1.18 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.14 3mka h ARG 91 CO 0.53 0.25 0.00 -2.13 -1.07 0.00 0.00 179.97 177.55 3mka n ARG 92 N -4.70 0.17 0.00 0.04 3.00 -1.26 -2.35 116.66 111.55 3mka n ARG 92 Ca 0.27 0.17 0.12 0.00 -0.00 0.00 0.00 57.85 58.41 3mka n ARG 92 Cb 0.92 -1.50 0.24 0.00 0.00 0.00 0.00 32.46 32.13 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 -1.34 1.16 -4.68 6.15 8.00 0.37 -4.84 116.55 121.37 3mka n ASP 93 Ca 0.06 -0.93 -0.41 0.00 0.71 0.00 0.00 54.79 54.22 3mka n ASP 93 Cb 0.13 0.29 -0.04 0.00 -0.02 0.00 0.00 41.12 41.48 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 -2.61 4.94 0.18 2.53 1.01 -0.99 -5.02 120.40 120.44 3mka s VAL 94 Ca 0.20 1.53 0.08 0.00 0.00 0.00 0.00 61.98 63.79 3mka s VAL 94 Cb 0.18 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 3mka s VAL 94 CO 0.58 0.09 -0.17 0.42 0.00 0.00 0.00 175.10 176.03 3mka s THR 95 N 1.79 1.78 0.24 3.92 -4.23 -1.26 -5.02 115.64 112.85 3mka s THR 95 Ca 0.37 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.82 3mka s THR 95 Cb -0.17 -1.89 0.23 0.00 1.34 0.00 0.00 72.50 72.02 3mka s THR 95 CO 0.14 -0.40 1.89 1.23 -0.54 0.00 0.00 174.62 176.94 3mka h GLY 96 N 3.06 1.37 1.02 3.99 0.00 -1.92 -2.24 103.07 108.35 3mka h GLY 96 Ca -0.41 -0.56 0.03 0.00 0.00 0.00 0.00 47.33 46.39 3mka h GLY 96 CO 0.54 0.54 0.58 -0.09 0.00 0.00 0.00 176.54 178.12 3mka h ARG 97 N 1.31 1.08 -0.40 4.80 2.43 -1.95 -1.51 114.38 120.12 3mka h ARG 97 Ca 0.34 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.32 3mka h ARG 97 Cb -0.07 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.22 3mka h ARG 97 CO -0.07 0.71 -0.24 1.96 -1.51 0.00 0.00 179.97 180.82 3mka h GLN 98 N 1.11 0.88 -0.71 0.20 4.20 -1.83 -1.83 115.11 117.13 3mka h GLN 98 Ca 0.35 -0.41 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 3mka h GLN 98 Cb 0.01 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.75 3mka h GLN 98 CO -0.10 1.05 0.26 -0.07 -0.67 0.00 0.00 178.83 179.29 3mka h LEU 99 N 0.69 0.98 -0.01 1.46 -0.00 -0.97 -1.93 115.31 115.54 3mka h LEU 99 Ca 0.08 -0.16 -0.00 0.00 -0.00 0.00 0.00 57.88 57.81 3mka h LEU 99 Cb 0.82 -0.25 -0.00 0.00 -0.00 0.00 0.00 40.66 41.22 3mka h LEU 99 CO 0.07 0.89 0.00 0.00 -0.00 0.00 0.00 178.44 179.40 3mka h ALA 100 N 1.24 0.01 -0.89 1.53 0.00 -1.20 -1.77 119.26 118.19 3mka h ALA 100 Ca 0.23 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 55.18 3mka h ALA 100 Cb 0.24 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 3mka h ALA 100 CO -0.02 -0.37 0.57 -0.97 0.00 0.00 0.00 179.25 178.46 3mka h ASN 101 N -0.21 0.63 -0.10 0.00 -0.73 -1.21 0.48 115.58 114.44 3mka h ASN 101 Ca 0.00 0.04 -0.05 0.00 1.87 0.00 0.00 56.30 58.16 3mka h ASN 101 Cb 0.23 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 38.74 3mka h ASN 101 CO 0.00 0.31 -0.14 0.58 -0.37 0.00 0.00 177.43 177.82 3mka h VAL 102 N 0.66 1.38 -0.83 2.57 2.07 -1.07 -2.22 116.25 118.81 3mka h VAL 102 Ca 0.45 -1.35 0.03 0.00 0.82 0.00 0.00 66.70 66.64 3mka h VAL 102 Cb 0.76 2.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.51 3mka h VAL 102 CO -0.20 0.39 0.53 1.88 0.02 0.00 0.00 177.57 180.19 3mka h TYR 103 N -0.15 1.00 0.02 1.57 0.05 -0.59 0.04 116.97 118.91 3mka h TYR 103 Ca 0.01 0.03 0.03 0.00 0.05 0.00 0.00 58.73 58.85 3mka h TYR 103 Cb 0.69 -0.33 -0.04 0.00 1.01 0.00 0.00 36.73 38.05 3mka h TYR 103 CO 0.10 0.58 -0.26 0.00 -1.05 0.00 0.00 178.16 177.53 3mka h ALA 104 N 1.34 -0.37 -0.99 3.88 0.00 -0.86 0.32 119.26 122.59 3mka h ALA 104 Ca 0.33 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.31 3mka h ALA 104 Cb -0.01 0.45 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 3mka h ALA 104 CO -0.11 -0.77 0.63 0.37 0.00 0.00 0.00 179.25 179.37 3mka h GLN 105 N -0.42 1.05 0.12 0.00 5.75 -1.06 -0.06 115.11 120.49 3mka h GLN 105 Ca 0.06 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 3mka h GLN 105 Cb 0.49 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.80 3mka h GLN 105 CO -0.21 0.69 -0.06 1.15 -2.65 0.00 0.00 178.83 177.75 3mka h THR 106 N 1.08 1.06 -0.73 2.39 2.02 0.09 -2.02 112.91 116.79 3mka h THR 106 Ca 0.45 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 3mka h THR 106 Cb 0.29 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 3mka h THR 106 CO -0.21 0.25 0.43 -0.07 0.37 0.00 0.00 175.52 176.28 3mka h LEU 107 N -0.71 0.90 -0.82 2.58 3.38 -0.39 0.42 115.31 120.66 3mka h LEU 107 Ca -0.02 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.02 3mka h LEU 107 Cb 0.53 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 40.96 3mka h LEU 107 CO 0.03 0.71 0.40 1.23 0.09 0.00 0.00 178.44 180.90 3mka h GLY 108 N 1.01 1.31 1.17 0.83 0.00 -0.97 0.41 103.07 106.84 3mka h GLY 108 Ca 0.26 -0.23 -0.24 0.00 0.00 0.00 0.00 47.33 47.12 3mka h GLY 108 CO -0.05 -0.05 -0.91 -0.84 0.00 0.00 0.00 176.54 174.69 3mka h THR 109 N 0.58 1.28 -0.99 4.70 2.02 -0.58 -2.72 112.91 117.20 3mka h THR 109 Ca 0.45 -2.12 0.02 0.00 0.77 0.00 0.00 66.41 65.53 3mka h THR 109 Cb 0.64 2.22 -0.05 0.00 -1.74 0.00 0.00 68.15 69.22 3mka h THR 109 CO -0.37 0.66 0.66 0.40 0.37 0.00 0.00 175.52 177.24 3mka h ILE 110 N 0.43 1.23 -0.36 3.11 2.04 0.09 -0.15 117.51 123.90 3mka h ILE 110 Ca -0.10 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 3mka h ILE 110 Cb 1.56 -0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3mka h ILE 110 CO 0.18 0.24 0.18 0.15 0.00 0.00 0.00 178.15 178.90 3mka h PHE 111 N 1.32 0.52 -0.29 1.37 3.57 -0.94 -1.87 116.94 120.61 3mka h PHE 111 Ca 0.37 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.76 3mka h PHE 111 Cb -0.11 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 3mka h PHE 111 CO -0.00 0.43 -0.19 1.15 -2.23 0.00 0.00 178.31 177.47 3mka h THR 112 N 0.45 1.30 0.00 4.41 2.02 -1.00 -3.40 112.91 116.69 3mka h THR 112 Ca 0.12 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 65.99 3mka h THR 112 Cb 0.11 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 3mka h THR 112 CO -0.02 0.42 -0.65 -1.84 0.37 0.00 0.00 175.52 173.80 3mka n GLU 113 N -4.36 3.24 -1.71 6.66 0.28 -0.15 -5.04 120.64 119.56 3mka n GLU 113 Ca -0.03 -0.02 -0.32 0.00 -0.16 0.00 0.00 57.16 56.63 3mka n GLU 113 Cb 0.41 -0.93 0.04 0.00 1.43 0.00 0.00 31.44 32.39 3mka n GLU 113 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 3mka s GLN 114 N -1.91 2.95 0.18 3.44 -0.21 -0.70 -4.94 119.66 118.47 3mka s GLN 114 Ca 0.01 1.12 -0.13 0.00 0.02 0.00 0.00 55.36 56.38 3mka s GLN 114 Cb 0.05 -1.99 0.09 0.00 1.00 0.00 0.00 33.01 32.16 3mka s GLN 114 CO 0.27 -1.10 1.82 0.00 -2.12 0.00 0.00 175.29 174.16 3mka h ALA 115 N -0.30 0.76 -3.88 6.09 0.00 -1.95 -3.42 119.26 116.55 3mka h ALA 115 Ca -0.45 -0.07 -0.40 0.00 0.00 0.00 0.00 54.91 53.99 3mka h ALA 115 Cb 1.22 -0.24 -0.30 0.00 0.00 0.00 0.00 17.79 18.47 3mka h ALA 115 CO 0.56 0.24 -0.78 -1.59 0.00 0.00 0.00 179.25 177.68 3mka s LYS 116 N -5.98 0.77 0.58 0.00 -2.85 -1.26 -5.13 119.74 105.87 3mka s LYS 116 Ca -0.13 -0.27 -0.18 0.00 -1.00 0.00 0.00 55.97 54.38 3mka s LYS 116 Cb 0.13 -0.74 -0.04 0.00 -2.06 0.00 0.00 37.83 35.12 3mka s LYS 116 CO 0.76 0.13 1.14 -1.25 0.10 0.00 0.00 175.35 176.23 3mka s PRO 117 N 0.05 3.17 0.07 1.78 0.04 -1.26 -4.91 135.00 133.94 3mka s PRO 117 Ca -0.01 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 3mka s PRO 117 Cb -0.06 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 3mka s PRO 117 CO -0.00 -0.99 1.19 0.71 0.04 0.00 0.00 177.00 177.94 3mka s TYR 118 N -1.87 3.45 -1.32 0.56 1.51 -1.26 -4.82 117.35 113.61 3mka s TYR 118 Ca 0.72 1.34 -0.11 0.00 -1.01 0.00 0.00 57.07 58.01 3mka s TYR 118 Cb -0.24 -3.40 0.14 0.00 -0.11 0.00 0.00 41.96 38.34 3mka s TYR 118 CO 0.31 -1.20 1.93 0.39 -1.11 0.00 0.00 175.55 175.88 3mka n GLU 119 N 3.76 3.43 -3.84 -0.62 1.02 -1.26 -4.74 120.64 118.39 3mka n GLU 119 Ca 0.08 -3.33 -0.10 0.00 -0.02 0.00 0.00 57.16 53.80 3mka n GLU 119 Cb 0.46 -3.02 -0.07 0.00 -0.02 0.00 0.00 31.44 28.79 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 1.15 0.13 -0.02 2.62 -7.23 -1.26 -0.91 120.40 114.88 3mka s VAL 120 Ca 0.42 -1.04 0.00 0.00 -1.81 0.00 0.00 61.98 59.55 3mka s VAL 120 Cb 0.10 -1.17 0.03 0.00 0.56 0.00 0.00 36.38 35.89 3mka s VAL 120 CO -0.02 -0.57 0.02 -0.70 -0.31 0.00 0.00 175.10 173.53 3mka s GLU 121 N -3.37 0.00 0.13 4.82 2.12 -0.17 -3.36 118.70 118.87 3mka s GLU 121 Ca 0.01 0.16 0.02 0.00 0.36 0.00 0.00 54.97 55.52 3mka s GLU 121 Cb 0.03 -0.25 -0.04 0.00 0.26 0.00 0.00 34.13 34.12 3mka s GLU 121 CO -0.08 -0.15 -0.05 -0.48 -0.54 0.00 0.00 175.26 173.96 3mka s LEU 122 N 0.96 2.39 -0.08 2.70 0.05 -0.62 -1.63 118.68 122.45 3mka s LEU 122 Ca -0.08 -1.06 0.04 0.00 0.05 0.00 0.00 54.13 53.07 3mka s LEU 122 Cb -0.12 -0.10 0.00 0.00 -2.05 0.00 0.00 46.19 43.93 3mka s LEU 122 CO -0.03 -0.48 -0.19 0.00 -0.55 0.00 0.00 176.35 175.10 3mka s VAL 124 N 0.36 2.61 0.03 0.00 1.01 -0.75 -1.42 120.40 122.25 3mka s VAL 124 Ca -0.14 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.15 3mka s VAL 124 Cb -0.16 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 3mka s VAL 124 CO 0.06 0.50 -0.23 0.00 0.00 0.00 0.00 175.10 175.43 3mka s ALA 125 N 1.10 1.92 -0.05 5.51 0.00 -0.15 -1.22 121.76 128.87 3mka s ALA 125 Ca 0.00 -1.10 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 3mka s ALA 125 Cb -0.14 -0.41 0.03 0.00 0.00 0.00 0.00 23.12 22.60 3mka s ALA 125 CO -0.05 0.45 -0.02 -2.00 0.00 0.00 0.00 175.76 174.14 3mka s GLU 126 N -1.08 0.68 0.43 0.00 2.12 -0.71 0.56 118.70 120.71 3mka s GLU 126 Ca 0.09 0.01 0.08 0.00 0.36 0.00 0.00 54.97 55.50 3mka s GLU 126 Cb -0.09 -0.86 0.01 0.00 0.26 0.00 0.00 34.13 33.44 3mka s GLU 126 CO 0.01 -0.19 0.52 0.14 -0.54 0.00 0.00 175.26 175.21 3mka s VAL 127 N 1.39 2.79 0.83 3.70 -7.23 -0.83 -1.36 120.40 119.68 3mka s VAL 127 Ca -0.04 -1.13 -0.12 0.00 -1.81 0.00 0.00 61.98 58.89 3mka s VAL 127 Cb -0.13 -2.92 0.09 0.00 0.56 0.00 0.00 36.38 33.98 3mka s VAL 127 CO -0.03 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 175.87 3mka s ALA 128 N -2.43 2.11 0.50 1.32 0.00 -1.26 -4.86 121.76 117.14 3mka s ALA 128 Ca 0.53 -0.29 -0.19 0.00 0.00 0.00 0.00 51.96 52.01 3mka s ALA 128 Cb -0.07 -3.09 -0.08 0.00 0.00 0.00 0.00 23.12 19.88 3mka s ALA 128 CO 0.31 -1.89 1.01 -1.01 0.00 0.00 0.00 175.76 174.18 3mka s HIS 129 N -3.19 3.19 -0.37 0.00 3.76 -1.26 -4.81 115.29 112.61 3mka s HIS 129 Ca 0.62 1.55 -0.43 0.00 -0.15 0.00 0.00 55.06 56.64 3mka s HIS 129 Cb -0.15 -2.93 -0.18 0.00 1.11 0.00 0.00 32.58 30.44 3mka s HIS 129 CO 0.54 -0.58 1.67 0.98 -0.85 0.00 0.00 174.74 176.50 3mka n TYR 130 N -1.23 1.90 0.00 1.40 9.36 -1.26 -0.09 117.16 127.24 3mka n TYR 130 Ca 0.08 0.82 0.00 0.00 3.32 0.00 0.00 57.90 62.12 3mka n TYR 130 Cb 0.53 -2.35 0.00 0.00 -0.63 0.00 0.00 39.34 36.89 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 4.07 2.98 3.82 2.98 0.00 -1.26 -5.04 105.19 112.73 3mka n GLY 131 Ca 0.28 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 -0.15 1.04 -0.33 1.61 2.02 0.88 -5.04 118.70 118.73 3mka s GLU 132 Ca 0.00 0.11 -0.01 0.00 0.02 0.00 0.00 54.97 55.09 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 -2.23 0.14 0.95 0.02 0.00 0.00 175.26 174.14 3mka s THR 133 N -3.42 0.66 -0.00 3.63 -4.23 -1.26 -4.77 115.64 106.25 3mka s THR 133 Ca 0.66 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.71 3mka s THR 133 Cb -0.12 -1.50 -0.00 0.00 1.34 0.00 0.00 72.50 72.22 3mka s THR 133 CO 0.53 -0.76 -0.04 -0.75 -0.54 0.00 0.00 174.62 173.06 3mka s LYS 134 N 1.47 0.36 0.13 3.99 2.20 -1.26 -5.10 119.74 121.52 3mka s LYS 134 Ca 0.12 -0.15 -0.31 0.00 -0.36 0.00 0.00 55.97 55.27 3mka s LYS 134 Cb -0.19 -0.35 -0.09 0.00 -1.51 0.00 0.00 37.83 35.70 3mka s LYS 134 CO -0.21 0.09 1.48 1.03 -0.36 0.00 0.00 175.35 177.38 3mka s ARG 135 N -0.06 4.27 0.96 4.03 0.52 -1.26 -4.36 118.95 123.04 3mka s ARG 135 Ca 0.01 2.20 -0.13 0.00 -0.52 0.00 0.00 55.73 57.29 3mka s ARG 135 Cb -0.02 -3.24 0.01 0.00 0.52 0.00 0.00 34.95 32.22 3mka s ARG 135 CO -0.00 -0.53 0.24 -2.30 0.02 0.00 0.00 175.30 172.73 3mka n PRO 136 N 4.12 -0.27 -4.84 3.54 -0.02 -1.26 -4.88 135.00 131.38 3mka n PRO 136 Ca 0.13 -0.04 -0.25 0.00 -2.02 0.00 0.00 63.50 61.31 3mka n PRO 136 Cb 0.41 -1.74 -0.15 0.00 -0.02 0.00 0.00 33.50 31.99 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 -3.43 1.45 -0.02 -0.52 2.02 -0.47 -4.99 118.70 112.74 3mka s GLU 137 Ca 0.55 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.94 3mka s GLU 137 Cb -0.21 -1.39 -0.00 0.00 0.10 0.00 0.00 34.13 32.63 3mka s GLU 137 CO 0.69 0.37 -0.11 -0.51 0.02 0.00 0.00 175.26 175.72 3mka s LEU 138 N -0.38 1.91 0.02 1.80 1.43 -1.24 -1.73 118.68 120.49 3mka s LEU 138 Ca 0.06 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.98 3mka s LEU 138 Cb -0.07 -0.63 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 3mka s LEU 138 CO -0.00 0.11 -0.12 -0.31 0.23 0.00 0.00 176.35 176.26 3mka s TYR 139 N -0.04 1.03 -0.05 0.29 2.02 -0.36 -1.15 117.35 119.09 3mka s TYR 139 Ca 0.00 -0.28 0.06 0.00 -0.37 0.00 0.00 57.07 56.48 3mka s TYR 139 Cb -0.07 -0.63 -0.01 0.00 -0.40 0.00 0.00 41.96 40.84 3mka s TYR 139 CO 0.00 0.00 -0.25 0.50 -1.57 0.00 0.00 175.55 174.23 3mka s ARG 140 N -0.77 2.40 -0.13 -0.62 3.52 0.12 -1.81 118.95 121.66 3mka s ARG 140 Ca 0.02 -0.90 0.01 0.00 -0.13 0.00 0.00 55.73 54.73 3mka s ARG 140 Cb -0.06 -2.10 0.02 0.00 -1.56 0.00 0.00 34.95 31.25 3mka s ARG 140 CO 0.00 0.42 -0.14 0.42 -0.81 0.00 0.00 175.30 175.19 3mka s ILE 141 N -0.26 1.50 0.65 4.11 1.09 0.61 0.21 121.20 129.11 3mka s ILE 141 Ca -0.00 -0.61 -0.07 0.00 -1.10 0.00 0.00 60.65 58.87 3mka s ILE 141 Cb -0.13 -1.41 0.03 0.00 -1.06 0.00 0.00 42.46 39.89 3mka s ILE 141 CO 0.02 0.45 0.98 0.42 -0.10 0.00 0.00 174.94 176.71 3mka s THR 142 N 1.35 3.17 0.46 2.92 -4.23 -0.41 -1.58 115.64 117.30 3mka s THR 142 Ca 0.01 -0.00 0.12 0.00 -1.18 0.00 0.00 61.69 60.64 3mka s THR 142 Cb -0.13 -3.31 0.25 0.00 1.34 0.00 0.00 72.50 70.65 3mka s THR 142 CO -0.08 -0.34 2.08 0.10 -0.54 0.00 0.00 174.62 175.84 3mka h TYR 143 N -0.41 0.23 0.00 3.99 -0.00 -1.84 0.15 116.97 119.09 3mka h TYR 143 Ca -0.45 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.26 3mka h TYR 143 Cb 1.28 -0.08 -0.00 0.00 0.00 0.00 0.00 36.73 37.93 3mka h TYR 143 CO 0.43 0.18 -0.08 0.22 -0.00 0.00 0.00 178.16 178.91 3mka h ASP 144 N 0.25 0.00 0.00 0.10 3.58 -1.90 -3.40 116.42 115.05 3mka h ASP 144 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3mka h ASP 144 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 3mka h ASP 144 CO -0.01 0.08 0.00 0.61 -2.88 0.00 0.00 179.24 177.04 3mka n GLY 145 N -1.28 0.64 3.77 -0.78 0.00 0.53 -4.29 105.19 103.78 3mka n GLY 145 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.62 6.83 -0.06 1.61 0.01 -1.26 -4.69 113.70 113.52 3mka s SER 146 Ca 0.00 2.47 0.06 0.00 1.31 0.00 0.00 55.95 59.79 3mka s SER 146 Cb 0.00 -2.63 -0.01 0.00 0.21 0.00 0.00 66.02 63.59 3mka s SER 146 CO 0.00 -0.47 -0.24 -0.51 0.41 0.00 0.00 173.24 172.43 3mka s ILE 147 N -1.23 1.98 -0.03 1.44 2.07 -1.26 -1.29 121.20 122.88 3mka s ILE 147 Ca 0.50 -1.02 0.06 0.00 -1.41 0.00 0.00 60.65 58.78 3mka s ILE 147 Cb -0.35 -1.68 -0.01 0.00 0.13 0.00 0.00 42.46 40.55 3mka s ILE 147 CO 0.45 0.55 -0.20 0.00 -1.91 0.00 0.00 174.94 173.84 3mka s ALA 148 N -0.10 1.69 -0.70 1.50 0.00 0.13 -4.95 121.76 119.33 3mka s ALA 148 Ca -0.05 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 50.88 3mka s ALA 148 Cb -0.14 -0.47 0.12 0.00 0.00 0.00 0.00 23.12 22.63 3mka s ALA 148 CO 0.04 0.38 0.84 0.34 0.00 0.00 0.00 175.76 177.36 3mka s ASP 149 N -0.32 6.34 -0.18 0.00 -1.08 -1.26 -0.70 116.67 119.46 3mka s ASP 149 Ca 0.04 -1.63 -0.18 0.00 -0.52 0.00 0.00 52.55 50.26 3mka s ASP 149 Cb -0.09 -2.33 -0.04 0.00 -1.46 0.00 0.00 42.92 39.00 3mka s ASP 149 CO 0.00 -1.10 0.49 -1.61 0.52 0.00 0.00 175.17 173.47 3mka s GLU 150 N 2.64 4.22 0.18 4.34 0.41 -0.30 -5.01 118.70 125.17 3mka s GLU 150 Ca 0.18 0.38 -0.07 0.00 -0.41 0.00 0.00 54.97 55.06 3mka s GLU 150 Cb -0.17 -3.53 0.07 0.00 -1.78 0.00 0.00 34.13 28.71 3mka s GLU 150 CO 0.02 -0.07 1.52 -1.35 -0.49 0.00 0.00 175.26 174.89 3mka h PRO 151 N 7.29 0.76 0.00 0.39 0.11 -1.96 -3.29 132.00 135.31 3mka h PRO 151 Ca -0.36 -0.40 0.00 0.00 0.11 0.00 0.00 66.00 65.35 3mka h PRO 151 Cb 1.16 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3mka h PRO 151 CO 0.74 1.03 -0.80 0.72 -0.21 0.00 0.00 178.00 179.48 3mka n HIS 152 N -4.04 0.00 -3.70 0.65 8.25 -1.26 -4.87 115.22 110.26 3mka n HIS 152 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.35 3mka n HIS 152 Cb 0.54 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.63 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 -1.80 -0.32 0.01 4.41 -0.12 -1.26 -0.22 117.98 118.68 3mka s PHE 153 Ca 0.00 -0.05 -0.00 0.00 -0.05 0.00 0.00 56.93 56.83 3mka s PHE 153 Cb 0.00 0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 3mka s PHE 153 CO 0.00 -1.09 -0.01 0.08 -0.05 0.00 0.00 175.22 174.15 3mka s VAL 154 N -3.85 0.06 -0.04 -2.49 1.01 0.12 -4.89 120.40 110.31 3mka s VAL 154 Ca 0.07 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.60 3mka s VAL 154 Cb -0.04 -0.14 0.01 0.00 0.00 0.00 0.00 36.38 36.21 3mka s VAL 154 CO -0.00 -0.26 -0.08 -0.69 0.00 0.00 0.00 175.10 174.06 3mka s VAL 155 N -0.76 0.77 0.02 2.92 1.01 -1.26 -1.33 120.40 121.77 3mka s VAL 155 Ca -0.08 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 3mka s VAL 155 Cb -0.05 -0.72 0.00 0.00 0.00 0.00 0.00 36.38 35.60 3mka s VAL 155 CO -0.00 0.26 0.16 -0.04 0.00 0.00 0.00 175.10 175.48 3mka s MET 156 N 0.55 0.58 0.00 2.72 -1.94 -0.15 -5.01 119.30 116.05 3mka s MET 156 Ca -0.09 -0.52 0.00 0.00 -1.71 0.00 0.00 55.69 53.37 3mka s MET 156 Cb -0.12 0.24 0.00 0.00 2.01 0.00 0.00 34.83 36.96 3mka s MET 156 CO 0.01 -0.15 0.00 0.41 -0.01 0.00 0.00 175.02 175.28 3mka n GLY 157 N 1.08 1.55 7.00 -0.03 0.00 -1.26 -0.11 105.19 113.41 3mka n GLY 157 Ca -0.21 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 1.61 2.06 3.51 -0.02 0.00 -0.50 -4.23 105.19 107.62 3mka n GLY 158 Ca 0.00 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.43 115.64 113.23 3mka s THR 159 Ca 0.00 -0.12 -0.14 0.00 -1.18 0.00 0.00 61.69 60.24 3mka s THR 159 Cb 0.00 -4.01 -0.23 0.00 1.34 0.00 0.00 72.50 69.59 3mka s THR 159 CO 0.00 -0.36 0.33 0.71 -0.54 0.00 0.00 174.62 174.76 3mka h THR 160 N 5.70 0.80 -0.76 3.99 1.35 -1.97 -3.41 112.91 118.61 3mka h THR 160 Ca -0.27 -2.28 0.13 0.00 -0.55 0.00 0.00 66.41 63.43 3mka h THR 160 Cb 1.12 2.42 -0.13 0.00 -1.73 0.00 0.00 68.15 69.82 3mka h THR 160 CO 0.79 0.63 -0.27 -0.62 -0.25 0.00 0.00 175.52 175.80 3mka n GLU 161 N -3.94 -0.15 0.22 4.72 4.71 -1.26 0.58 120.64 125.51 3mka n GLU 161 Ca -0.31 1.18 -0.16 0.00 -0.01 0.00 0.00 57.16 57.86 3mka n GLU 161 Cb 0.88 -1.75 -0.08 0.00 -1.01 0.00 0.00 31.44 29.48 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 -0.72 -0.44 3.49 0.13 -1.97 0.56 132.00 133.06 3mka h PRO 162 Ca 0.29 0.05 0.06 0.00 -0.87 0.00 0.00 66.00 65.53 3mka h PRO 162 Cb 0.48 0.16 -0.05 0.00 0.13 0.00 0.00 31.00 31.73 3mka h PRO 162 CO -0.77 -0.48 0.14 0.82 -0.23 0.00 0.00 178.00 177.49 3mka h ILE 163 N -0.74 0.84 0.12 -3.56 2.04 -0.89 0.37 117.51 115.69 3mka h ILE 163 Ca -0.02 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.75 3mka h ILE 163 Cb 0.68 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3mka h ILE 163 CO -0.08 0.05 -0.15 0.00 0.00 0.00 0.00 178.15 177.97 3mka h ALA 164 N 1.30 -0.28 0.37 1.87 0.00 0.35 -2.17 119.26 120.70 3mka h ALA 164 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3mka h ALA 164 Cb 0.21 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3mka h ALA 164 CO -0.22 -0.68 -0.18 -0.91 0.00 0.00 0.00 179.25 177.26 3mka h ASN 165 N -0.32 -0.42 -0.86 0.00 2.35 -0.56 -0.85 115.58 114.93 3mka h ASN 165 Ca 0.01 -0.10 0.16 0.00 -0.55 0.00 0.00 56.30 55.83 3mka h ASN 165 Cb 0.32 0.11 -0.10 0.00 0.05 0.00 0.00 38.32 38.70 3mka h ASN 165 CO -0.06 -0.14 0.43 0.00 -1.65 0.00 0.00 177.43 176.00 3mka h ALA 166 N -0.14 1.31 -0.75 -0.83 0.00 -0.93 -0.96 119.26 116.95 3mka h ALA 166 Ca -0.05 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3mka h ALA 166 Cb 0.49 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3mka h ALA 166 CO 0.08 -0.14 0.27 1.25 0.00 0.00 0.00 179.25 180.71 3mka h LEU 167 N 0.57 1.05 -0.25 0.00 5.85 -1.33 0.43 115.31 121.64 3mka h LEU 167 Ca 0.48 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3mka h LEU 167 Cb 0.74 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 3mka h LEU 167 CO -0.40 0.95 0.16 0.50 -0.34 0.00 0.00 178.44 179.32 3mka h LYS 168 N 1.10 0.34 -0.28 1.25 3.64 0.21 2.76 116.57 125.58 3mka h LYS 168 Ca 0.25 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.50 3mka h LYS 168 Cb 0.25 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 3mka h LYS 168 CO -0.02 0.25 -0.23 1.49 -2.27 0.00 0.00 179.45 178.67 3mka h GLU 169 N 0.33 0.66 -0.62 1.90 4.57 -1.24 -3.28 114.58 116.90 3mka h GLU 169 Ca 0.09 -0.33 -0.09 0.00 -1.18 0.00 0.00 59.36 57.85 3mka h GLU 169 Cb -0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3mka h GLU 169 CO -0.02 0.93 0.03 0.66 -1.18 0.00 0.00 179.01 179.44 3mka h SER 170 N 0.40 1.03 -3.60 1.04 4.64 0.36 -3.46 113.55 113.96 3mka h SER 170 Ca 0.05 -0.28 -0.53 0.00 -0.47 0.00 0.00 61.79 60.56 3mka h SER 170 Cb 0.79 -0.28 0.08 0.00 -0.31 0.00 0.00 62.40 62.68 3mka h SER 170 CO 0.06 1.06 0.77 -0.47 -0.87 0.00 0.00 176.83 177.39 3mka s TYR 171 N -5.07 2.86 -0.04 4.77 5.04 0.92 -5.01 117.35 120.81 3mka s TYR 171 Ca -0.12 1.08 0.02 0.00 -2.44 0.00 0.00 57.07 55.62 3mka s TYR 171 Cb 0.14 -3.90 0.01 0.00 0.35 0.00 0.00 41.96 38.56 3mka s TYR 171 CO 0.85 -2.80 -0.09 0.00 -1.34 0.00 0.00 175.55 172.17 3mka s ALA 172 N -0.50 0.91 0.44 3.97 0.00 -1.26 -4.97 121.76 120.35 3mka s ALA 172 Ca 0.57 -0.29 -0.24 0.00 0.00 0.00 0.00 51.96 52.00 3mka s ALA 172 Cb -0.44 -0.40 -0.08 0.00 0.00 0.00 0.00 23.12 22.21 3mka s ALA 172 CO 0.51 0.10 1.19 -2.00 0.00 0.00 0.00 175.76 175.57 3mka s GLU 173 N 0.45 3.85 -1.56 0.00 2.12 -1.26 -3.44 118.70 118.86 3mka s GLU 173 Ca -0.08 1.86 -0.03 0.00 0.36 0.00 0.00 54.97 57.08 3mka s GLU 173 Cb -0.12 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.75 3mka s GLU 173 CO 0.01 -0.50 0.44 0.09 -0.54 0.00 0.00 175.26 174.76 3mka n ASN 174 N -0.25 -5.93 -4.79 -1.70 3.02 -1.26 -4.98 115.26 99.37 3mka n ASN 174 Ca 0.06 -0.21 -0.34 0.00 -0.03 0.00 0.00 54.58 54.06 3mka n ASN 174 Cb 0.47 -4.80 -0.00 0.00 -0.61 0.00 0.00 39.78 34.83 3mka n ASN 174 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mka s ALA 175 N -3.12 2.75 0.78 5.41 0.00 -1.22 -4.46 121.76 121.89 3mka s ALA 175 Ca 0.22 0.58 -0.11 0.00 0.00 0.00 0.00 51.96 52.65 3mka s ALA 175 Cb -0.10 -3.28 0.06 0.00 0.00 0.00 0.00 23.12 19.81 3mka s ALA 175 CO 0.27 -0.67 1.11 -1.54 0.00 0.00 0.00 175.76 174.93 3mka s SER 176 N -2.26 4.31 0.15 0.00 1.04 -1.26 -2.92 113.70 112.76 3mka s SER 176 Ca 0.67 1.93 -0.16 0.00 0.48 0.00 0.00 55.95 58.87 3mka s SER 176 Cb -0.18 -2.53 0.01 0.00 0.10 0.00 0.00 66.02 63.42 3mka s SER 176 CO 0.29 -2.17 1.80 0.25 0.98 0.00 0.00 173.24 174.39 3mka h LEU 177 N -1.08 0.48 -0.46 2.42 5.85 -1.99 -0.05 115.31 120.49 3mka h LEU 177 Ca -0.44 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 3mka h LEU 177 Cb 1.24 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.13 3mka h LEU 177 CO 0.50 0.37 0.24 0.74 -0.34 0.00 0.00 178.44 179.94 3mka h THR 178 N 0.55 1.17 -0.65 1.05 2.02 -1.91 0.05 112.91 115.19 3mka h THR 178 Ca 0.15 -0.46 -0.03 0.00 0.77 0.00 0.00 66.41 66.84 3mka h THR 178 Cb -0.04 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3mka h THR 178 CO -0.03 0.18 0.29 0.44 0.37 0.00 0.00 175.52 176.78 3mka h ASP 179 N 0.60 0.87 -0.58 4.18 3.32 -1.88 -0.71 116.42 122.21 3mka h ASP 179 Ca 0.16 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 3mka h ASP 179 Cb 0.08 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 3mka h ASP 179 CO -0.02 0.78 0.27 0.00 -1.72 0.00 0.00 179.24 178.55 3mka h ALA 180 N 1.13 0.75 -0.46 3.45 0.00 -0.66 -0.45 119.26 123.02 3mka h ALA 180 Ca 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3mka h ALA 180 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3mka h ALA 180 CO -0.02 0.33 0.26 1.25 0.00 0.00 0.00 179.25 181.07 3mka h LEU 181 N 0.80 0.56 -0.58 0.00 5.85 -0.54 0.16 115.31 121.56 3mka h LEU 181 Ca 0.20 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3mka h LEU 181 Cb 0.13 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3mka h LEU 181 CO -0.02 0.47 0.27 -0.09 -0.34 0.00 0.00 178.44 178.73 3mka h ARG 182 N 0.61 0.85 -0.68 1.25 2.43 -0.71 -0.34 114.38 117.79 3mka h ARG 182 Ca 0.16 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3mka h ARG 182 Cb 0.02 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 3mka h ARG 182 CO -0.03 0.70 0.32 0.82 -1.51 0.00 0.00 179.97 180.27 3mka h ILE 183 N 0.80 1.23 -0.59 1.20 2.04 -0.73 -0.73 117.51 120.73 3mka h ILE 183 Ca 0.20 -0.64 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 3mka h ILE 183 Cb 0.13 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 3mka h ILE 183 CO -0.02 0.27 0.27 0.00 0.00 0.00 0.00 178.15 178.66 3mka h ALA 184 N 1.15 0.77 -0.58 1.87 0.00 -0.58 -0.45 119.26 121.44 3mka h ALA 184 Ca 0.23 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3mka h ALA 184 Cb 0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3mka h ALA 184 CO -0.03 0.34 0.24 0.28 0.00 0.00 0.00 179.25 180.08 3mka h VAL 185 N 0.81 1.22 -0.67 0.00 2.07 -0.64 -0.22 116.25 118.83 3mka h VAL 185 Ca 0.20 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 3mka h VAL 185 Cb 0.14 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3mka h VAL 185 CO -0.02 0.27 0.39 0.00 0.02 0.00 0.00 177.57 178.22 3mka h ALA 186 N 1.08 0.85 -0.57 1.67 0.00 -0.72 -0.39 119.26 121.18 3mka h ALA 186 Ca 0.19 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3mka h ALA 186 Cb 0.19 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3mka h ALA 186 CO -0.02 0.34 0.19 0.00 0.00 0.00 0.00 179.25 179.76 3mka h ALA 187 N 1.20 0.75 -0.53 0.00 0.00 -0.62 -0.50 119.26 119.55 3mka h ALA 187 Ca 0.24 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 3mka h ALA 187 Cb -0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3mka h ALA 187 CO -0.04 0.40 0.10 1.25 0.00 0.00 0.00 179.25 180.96 3mka h LEU 188 N 0.80 0.83 0.00 0.00 6.46 -0.66 -2.17 115.31 120.57 3mka h LEU 188 Ca 0.18 -0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 3mka h LEU 188 Cb 0.27 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 3mka h LEU 188 CO -0.01 0.87 0.00 -1.14 -0.62 0.00 0.00 178.44 177.55 3mka n ARG 189 N -4.39 0.68 -0.32 1.25 0.63 -0.19 -3.42 116.66 110.91 3mka n ARG 189 Ca 0.02 0.01 -0.05 0.00 -0.92 0.00 0.00 57.85 56.91 3mka n ARG 189 Cb 0.25 -1.50 0.08 0.00 0.45 0.00 0.00 32.46 31.74 3mka n ARG 189 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3mka h ALA 190 N 3.63 1.11 -3.26 5.13 0.00 -0.40 -3.40 119.26 122.07 3mka h ALA 190 Ca 0.00 -0.16 -0.66 0.00 0.00 0.00 0.00 54.91 54.10 3mka h ALA 190 Cb 0.13 -0.34 -0.27 0.00 0.00 0.00 0.00 17.79 17.31 3mka h ALA 190 CO 0.00 0.66 -0.76 0.20 0.00 0.00 0.00 179.25 179.36 3mka s GLY 191 N -3.27 1.56 0.00 0.00 0.00 -1.22 -4.90 107.32 99.48 3mka s GLY 191 Ca -0.13 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 43.66 3mka s GLY 191 CO 0.83 -0.08 0.00 -1.26 0.00 0.00 0.00 173.10 172.59 3mka n SER 192 N 3.74 -1.51 0.00 1.64 2.88 -1.26 -4.99 113.62 114.11 3mka n SER 192 Ca -0.18 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 3mka n SER 192 Cb 0.52 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 3mka n SER 192 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3mka n LEU 203 N 1.58 0.00 -4.79 2.46 4.32 -1.26 -4.88 117.00 114.43 3mka n LEU 203 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.69 3mka n LEU 203 Cb 0.00 0.00 0.09 0.00 -1.62 0.00 0.00 43.42 41.89 3mka n LEU 203 CO 0.00 0.00 0.70 -0.83 -1.22 0.00 0.00 177.39 176.04 3mka s GLY 204 N 0.00 1.64 0.45 -0.72 0.00 -1.26 -4.78 107.32 102.66 3mka s GLY 204 Ca 0.00 -0.03 0.17 0.00 0.00 0.00 0.00 44.72 44.86 3mka s GLY 204 CO 0.00 0.36 1.97 -2.08 0.00 0.00 0.00 173.10 173.35 3mka h VAL 205 N -1.06 0.84 0.00 1.40 2.07 -1.95 3.13 116.25 120.68 3mka h VAL 205 Ca -0.46 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 66.95 3mka h VAL 205 Cb 1.25 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3mka h VAL 205 CO 0.57 0.06 0.00 0.00 0.02 0.00 0.00 177.57 178.21 3mka n ALA 206 N -2.54 1.88 -0.03 1.67 0.00 -1.26 -3.13 120.51 117.10 3mka n ALA 206 Ca 0.11 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.65 3mka n ALA 206 Cb 0.45 -1.37 0.25 0.00 0.00 0.00 0.00 19.45 18.78 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 -1.88 3.60 -4.40 0.00 3.41 1.04 -4.87 113.62 110.51 3mka n SER 207 Ca 0.04 -1.98 -0.20 0.00 -0.26 0.00 0.00 58.87 56.46 3mka n SER 207 Cb 0.26 -0.35 -0.10 0.00 -0.26 0.00 0.00 64.21 63.77 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 -1.22 2.52 -0.17 1.04 1.02 -1.06 -3.17 118.68 117.64 3mka s LEU 208 Ca 0.41 -1.12 0.00 0.00 0.02 0.00 0.00 54.13 53.44 3mka s LEU 208 Cb 0.23 -0.68 0.03 0.00 0.02 0.00 0.00 46.19 45.79 3mka s LEU 208 CO 0.31 -0.26 -0.11 -0.70 0.02 0.00 0.00 176.35 175.61 3mka s GLU 209 N -3.68 2.00 -0.01 1.70 2.12 -0.27 -4.78 118.70 115.78 3mka s GLU 209 Ca 0.27 -0.63 0.05 0.00 0.36 0.00 0.00 54.97 55.02 3mka s GLU 209 Cb 0.02 -2.16 -0.01 0.00 0.26 0.00 0.00 34.13 32.23 3mka s GLU 209 CO 0.10 -0.34 -0.14 0.08 -0.54 0.00 0.00 175.26 174.42 3mka s VAL 210 N 1.50 1.14 0.18 3.70 1.01 -1.26 -1.66 120.40 125.01 3mka s VAL 210 Ca 0.02 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.12 3mka s VAL 210 Cb -0.14 -0.96 0.06 0.00 0.00 0.00 0.00 36.38 35.33 3mka s VAL 210 CO -0.09 0.29 0.61 0.00 0.00 0.00 0.00 175.10 175.91 3mka s ALA 211 N -0.39 -1.47 0.09 5.51 0.00 -0.89 -0.98 121.76 123.62 3mka s ALA 211 Ca 0.05 0.29 -0.09 0.00 0.00 0.00 0.00 51.96 52.21 3mka s ALA 211 Cb -0.06 0.87 -0.00 0.00 0.00 0.00 0.00 23.12 23.93 3mka s ALA 211 CO -0.00 -0.81 0.19 0.14 0.00 0.00 0.00 175.76 175.28 3mka s VAL 212 N -3.79 0.14 -0.35 0.00 -7.23 -0.15 -0.03 120.40 108.99 3mka s VAL 212 Ca 0.03 -1.16 -0.12 0.00 -1.81 0.00 0.00 61.98 58.92 3mka s VAL 212 Cb -0.02 -1.32 -0.00 0.00 0.56 0.00 0.00 36.38 35.60 3mka s VAL 212 CO -0.09 -0.64 0.23 -0.76 -0.31 0.00 0.00 175.10 173.53 3mka s LEU 213 N -2.83 4.57 -0.56 1.32 1.43 -0.04 -1.01 118.68 121.56 3mka s LEU 213 Ca 0.05 -0.62 -0.21 0.00 -1.03 0.00 0.00 54.13 52.32 3mka s LEU 213 Cb 0.05 -2.10 0.07 0.00 0.03 0.00 0.00 46.19 44.24 3mka s LEU 213 CO -0.11 -0.29 0.76 -0.62 0.23 0.00 0.00 176.35 176.33 3mka s ASP 214 N 1.67 6.23 0.63 2.29 -1.08 0.58 -3.13 116.67 123.85 3mka s ASP 214 Ca 0.05 -0.95 0.42 0.00 -0.52 0.00 0.00 52.55 51.55 3mka s ASP 214 Cb -0.18 -2.34 2.18 0.00 -1.46 0.00 0.00 42.92 41.11 3mka s ASP 214 CO 0.09 -1.11 2.27 0.00 0.52 0.00 0.00 175.17 176.95 3mka h ALA 215 N 9.20 1.00 -0.00 3.66 0.00 -1.72 -1.97 119.26 129.43 3mka h ALA 215 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3mka h ALA 215 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3mka h ALA 215 CO 1.06 0.00 -0.12 -1.71 0.00 0.00 0.00 179.25 178.48 3mka n ASN 216 N -3.05 0.22 -4.83 0.00 5.15 -1.26 -4.36 115.26 107.13 3mka n ASN 216 Ca -0.02 -0.04 -0.34 0.00 -0.60 0.00 0.00 54.58 53.58 3mka n ASN 216 Cb 0.12 -0.21 -0.06 0.00 -0.53 0.00 0.00 39.78 39.09 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 -2.78 4.19 0.10 1.20 0.52 -0.74 -5.00 118.95 116.43 3mka s ARG 217 Ca 0.20 0.94 -0.23 0.00 -0.52 0.00 0.00 55.73 56.12 3mka s ARG 217 Cb 0.19 -2.44 -0.13 0.00 0.52 0.00 0.00 34.95 33.08 3mka s ARG 217 CO 0.53 0.14 1.74 -1.00 0.02 0.00 0.00 175.30 176.72 3mka h PRO 218 N 2.39 0.01 0.00 3.54 0.13 -1.89 -3.41 132.00 132.78 3mka h PRO 218 Ca -0.48 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3mka h PRO 218 Cb 1.18 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3mka h PRO 218 CO 0.64 0.01 0.00 -2.13 -0.23 0.00 0.00 178.00 176.28 3mka n ARG 219 N -5.09 0.00 -2.61 0.86 0.63 -1.26 -4.30 116.66 104.89 3mka n ARG 219 Ca -0.06 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.45 3mka n ARG 219 Cb 0.04 -0.11 -0.03 0.00 0.45 0.00 0.00 32.46 32.81 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 -1.23 3.37 0.43 -0.14 0.52 -1.26 -4.40 118.95 116.24 3mka s ARG 220 Ca 0.00 -0.02 0.21 0.00 -0.52 0.00 0.00 55.73 55.40 3mka s ARG 220 Cb 0.00 -4.09 0.97 0.00 0.52 0.00 0.00 34.95 32.35 3mka s ARG 220 CO 0.00 -1.83 1.87 0.00 0.02 0.00 0.00 175.30 175.36 3mka h ALA 221 N 9.69 1.16 -2.43 2.13 0.00 -0.86 -3.46 119.26 125.50 3mka h ALA 221 Ca -0.26 -0.24 -0.54 0.00 0.00 0.00 0.00 54.91 53.87 3mka h ALA 221 Cb 1.06 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.81 3mka h ALA 221 CO 1.21 0.34 0.89 0.12 0.00 0.00 0.00 179.25 181.80 3mka s PHE 222 N -3.90 2.73 -0.07 0.00 5.36 -1.26 0.22 117.98 121.06 3mka s PHE 222 Ca -0.01 0.63 -0.03 0.00 -0.96 0.00 0.00 56.93 56.56 3mka s PHE 222 Cb 0.12 -3.79 0.04 0.00 -0.34 0.00 0.00 43.02 39.05 3mka s PHE 222 CO 0.65 -3.03 0.15 1.03 -1.46 0.00 0.00 175.22 172.57 3mka s ARG 223 N 2.32 0.10 -0.09 10.12 0.52 -0.18 -4.92 118.95 126.83 3mka s ARG 223 Ca 0.68 0.38 -0.20 0.00 -0.52 0.00 0.00 55.73 56.07 3mka s ARG 223 Cb -0.36 -0.17 -0.04 0.00 0.52 0.00 0.00 34.95 34.90 3mka s ARG 223 CO 0.29 -0.16 0.54 1.03 0.02 0.00 0.00 175.30 177.02 3mka s ARG 224 N 1.15 4.35 -0.43 3.54 0.52 -1.26 -0.97 118.95 125.84 3mka s ARG 224 Ca -0.09 0.59 -0.16 0.00 -0.52 0.00 0.00 55.73 55.55 3mka s ARG 224 Cb -0.11 -3.42 0.03 0.00 0.52 0.00 0.00 34.95 31.97 3mka s ARG 224 CO -0.06 0.18 0.36 0.42 0.02 0.00 0.00 175.30 176.23 3mka s ILE 225 N 0.50 5.20 0.23 1.52 1.01 -0.15 -4.96 121.20 124.55 3mka s ILE 225 Ca 0.29 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 60.34 3mka s ILE 225 Cb -0.16 -4.02 -0.05 0.00 0.01 0.00 0.00 42.46 38.24 3mka s ILE 225 CO 0.13 -0.42 -0.15 0.28 0.00 0.00 0.00 174.94 174.78 3mka s THR 226 N 1.80 1.88 0.00 2.92 -1.32 -1.26 -4.33 115.64 115.33 3mka s THR 226 Ca 0.07 -2.24 0.00 0.00 -1.21 0.00 0.00 61.69 58.30 3mka s THR 226 Cb -0.20 -2.13 0.00 0.00 -1.51 0.00 0.00 72.50 68.66 3mka s THR 226 CO 0.10 -0.53 0.00 0.61 -2.21 0.00 0.00 174.62 172.59 3mka n GLY 227 N -0.45 2.13 0.30 6.08 0.00 -1.26 -2.22 105.19 109.77 3mka n GLY 227 Ca -0.07 0.42 -0.05 0.00 0.00 0.00 0.00 46.02 46.31 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 0.93 -0.68 1.61 0.02 -2.00 -2.28 113.55 111.14 3mka h SER 228 Ca 0.00 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 3mka h SER 228 Cb 0.00 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 3mka h SER 228 CO 0.00 0.75 0.29 0.00 -1.14 0.00 0.00 176.83 176.73 3mka h ALA 229 N 1.21 0.89 -0.73 3.77 0.00 -1.85 -2.87 119.26 119.68 3mka h ALA 229 Ca 0.26 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3mka h ALA 229 Cb 0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3mka h ALA 229 CO -0.04 0.49 0.23 1.25 0.00 0.00 0.00 179.25 181.18 3mka h LEU 230 N 0.97 1.06 -0.87 0.00 5.85 -1.31 -3.15 115.31 117.85 3mka h LEU 230 Ca 0.23 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3mka h LEU 230 Cb 0.19 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3mka h LEU 230 CO -0.02 0.99 0.46 -0.61 -0.34 0.00 0.00 178.44 178.92 3mka h GLN 231 N 1.08 1.23 -0.61 1.25 5.75 -1.20 -2.86 115.11 119.75 3mka h GLN 231 Ca 0.24 -0.16 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 3mka h GLN 231 Cb 0.31 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.59 3mka h GLN 231 CO -0.01 0.92 0.35 0.00 -2.65 0.00 0.00 178.83 177.44 3mka h ALA 232 N 1.25 0.78 -0.65 3.38 0.00 -1.48 -1.82 119.26 120.72 3mka h ALA 232 Ca 0.30 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 3mka h ALA 232 Cb 0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3mka h ALA 232 CO -0.05 0.29 0.14 1.37 0.00 0.00 0.00 179.25 181.01 3mka h LEU 233 N 0.83 0.98 -0.63 0.00 -0.00 -1.60 -2.94 115.31 111.95 3mka h LEU 233 Ca 0.22 -0.21 -0.03 0.00 -0.00 0.00 0.00 57.88 57.86 3mka h LEU 233 Cb 0.02 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 40.40 3mka h LEU 233 CO -0.04 0.95 0.26 -0.07 -0.00 0.00 0.00 178.44 179.54 3mka h LEU 234 N 0.98 0.86 -1.39 0.17 4.07 -1.25 -3.47 115.31 115.29 3mka h LEU 234 Ca 0.20 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.00 3mka h LEU 234 Cb 0.37 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.88 3mka h LEU 234 CO 0.00 0.79 0.00 0.52 -1.08 0.00 0.00 178.44 178.67