#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fca h MET 2 N 0.00 0.82 -0.73 2.12 2.86 -1.99 -2.13 114.93 115.87 3fca h MET 2 Ca 0.00 -0.47 0.07 0.00 -2.06 0.00 0.00 59.70 57.24 3fca h MET 2 Cb 0.00 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 3fca h MET 2 CO 0.00 1.10 0.48 0.93 1.06 0.00 0.00 176.91 180.49 3fca h GLU 3 N 0.65 0.72 0.11 1.72 3.07 -2.01 -2.42 114.58 116.41 3fca h GLU 3 Ca 0.03 -0.04 -0.29 0.00 -0.50 0.00 0.00 59.36 58.56 3fca h GLU 3 Cb 1.05 -0.16 0.02 0.00 -0.84 0.00 0.00 28.75 28.83 3fca h GLU 3 CO 0.10 0.48 -1.22 0.00 -1.40 0.00 0.00 179.01 176.97 3fca h ARG 4 N 0.74 0.58 0.00 2.33 3.08 -1.96 -3.36 114.38 115.78 3fca h ARG 4 Ca 0.32 -0.77 -0.19 0.00 0.07 0.00 0.00 59.98 59.42 3fca h ARG 4 Cb 0.30 0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 3fca h ARG 4 CO -0.11 1.34 -0.89 -0.07 -1.07 0.00 0.00 179.97 179.17 3fca h LEU 5 N 0.26 0.00 -9.42 3.04 3.38 -1.20 -3.46 115.31 107.91 3fca h LEU 5 Ca -0.17 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.26 3fca h LEU 5 Cb 1.89 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.63 3fca h LEU 5 CO 0.23 0.88 0.38 -0.63 0.09 0.00 0.00 178.44 179.39 3fca s ILE 6 N -2.77 4.80 0.00 1.22 1.01 -0.93 -4.51 121.20 120.03 3fca s ILE 6 Ca 0.02 2.02 0.00 0.00 0.00 0.00 0.00 60.65 62.69 3fca s ILE 6 Cb 0.09 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 38.27 3fca s ILE 6 CO 0.80 0.16 0.00 0.61 0.00 0.00 0.00 174.94 176.52 3fca n GLY 7 N 2.89 -1.80 3.89 6.18 0.00 -1.26 -4.98 105.19 110.10 3fca n GLY 7 Ca 0.06 -1.83 -0.24 0.00 0.00 0.00 0.00 46.02 44.01 3fca n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3fca n SER 8 N 0.22 -0.56 -4.89 1.61 7.64 -1.26 -4.92 113.62 111.47 3fca n SER 8 Ca 0.00 -0.96 -0.30 0.00 1.01 0.00 0.00 58.87 58.63 3fca n SER 8 Cb 0.00 -3.32 -0.04 0.00 -1.01 0.00 0.00 64.21 59.84 3fca n SER 8 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3fca s THR 9 N -3.88 4.91 0.64 0.44 -4.23 -1.26 -5.08 115.64 107.18 3fca s THR 9 Ca 0.01 0.34 -0.12 0.00 -1.18 0.00 0.00 61.69 60.74 3fca s THR 9 Cb -0.00 -3.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.10 3fca s THR 9 CO 0.87 -0.36 1.04 -2.16 -0.54 0.00 0.00 174.62 173.47 3fca s PRO 10 N -3.55 3.30 0.10 3.99 0.04 -1.26 -4.82 135.00 132.79 3fca s PRO 10 Ca 0.47 0.91 0.08 0.00 0.04 0.00 0.00 61.00 62.50 3fca s PRO 10 Cb -0.11 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 3fca s PRO 10 CO 0.29 -0.81 -0.14 0.42 0.04 0.00 0.00 177.00 176.80 3fca s ILE 11 N -3.00 3.13 0.15 0.56 1.01 -1.26 -0.83 121.20 120.96 3fca s ILE 11 Ca 0.58 -1.34 0.05 0.00 0.00 0.00 0.00 60.65 59.93 3fca s ILE 11 Cb -0.13 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 3fca s ILE 11 CO 0.51 0.13 -0.11 0.68 0.00 0.00 0.00 174.94 176.15 3fca s VAL 12 N -1.16 1.25 -0.13 2.92 -7.23 -0.65 -4.93 120.40 110.48 3fca s VAL 12 Ca 0.19 -2.04 -0.05 0.00 -1.81 0.00 0.00 61.98 58.27 3fca s VAL 12 Cb -0.11 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 3fca s VAL 12 CO 0.12 -0.69 0.07 -0.60 -0.31 0.00 0.00 175.10 173.69 3fca s ARG 13 N -3.61 3.43 -1.28 4.82 3.52 -1.26 -0.32 118.95 124.25 3fca s ARG 13 Ca 0.16 -0.28 -0.07 0.00 -0.13 0.00 0.00 55.73 55.42 3fca s ARG 13 Cb 0.01 -3.07 0.16 0.00 -1.56 0.00 0.00 34.95 30.50 3fca s ARG 13 CO 0.02 0.62 2.08 1.28 -0.81 0.00 0.00 175.30 178.48 3fca n LEU 14 N 2.45 7.30 0.04 -0.88 4.77 0.80 -4.78 117.00 126.70 3fca n LEU 14 Ca -0.19 -4.82 0.16 0.00 -0.03 0.00 0.00 56.01 51.14 3fca n LEU 14 Cb 0.54 -1.40 0.65 0.00 -2.33 0.00 0.00 43.42 40.88 3fca n LEU 14 CO 0.31 1.74 1.16 0.44 -1.33 0.00 0.00 177.39 179.71 3fca h ASP 15 N 5.15 0.06 0.24 -1.43 3.32 -1.85 0.22 116.42 122.14 3fca h ASP 15 Ca 0.53 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.58 3fca h ASP 15 Cb 0.47 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3fca h ASP 15 CO 1.53 0.04 -0.20 -1.20 -1.72 0.00 0.00 179.24 177.68 3fca n SER 16 N -4.43 0.93 -0.02 6.45 7.64 -1.26 -4.36 113.62 118.57 3fca n SER 16 Ca 0.07 -0.87 -0.06 0.00 1.01 0.00 0.00 58.87 59.02 3fca n SER 16 Cb 0.46 0.08 -0.02 0.00 -1.01 0.00 0.00 64.21 63.72 3fca n SER 16 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3fca n ILE 17 N -0.65 0.96 -3.34 0.44 5.41 -0.40 -5.03 119.36 116.75 3fca n ILE 17 Ca 0.13 0.12 0.02 0.00 1.00 0.00 0.00 62.75 64.02 3fca n ILE 17 Cb 0.33 -1.75 -0.03 0.00 -0.71 0.00 0.00 39.64 37.48 3fca n ILE 17 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3fca s ASP 18 N -5.91 -0.62 0.00 4.38 3.68 0.65 -5.05 116.67 113.80 3fca s ASP 18 Ca -0.11 0.71 0.13 0.00 2.13 0.00 0.00 52.55 55.41 3fca s ASP 18 Cb 0.03 1.65 0.80 0.00 -1.45 0.00 0.00 42.92 43.95 3fca s ASP 18 CO 0.15 -0.12 1.26 -1.54 0.13 0.00 0.00 175.17 175.05 3fca n SER 19 N 5.11 0.00 0.00 -0.34 3.41 -1.24 -1.46 113.62 119.10 3fca n SER 19 Ca -0.08 -0.80 0.12 0.00 -0.26 0.00 0.00 58.87 57.85 3fca n SER 19 Cb 0.53 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.66 3fca n SER 19 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3fca n ARG 20 N -0.84 0.00 -3.00 4.33 1.74 -1.26 -4.85 116.66 112.77 3fca n ARG 20 Ca 0.10 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.99 3fca n ARG 20 Cb 0.05 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.04 3fca n ARG 20 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3fca s ILE 21 N -3.00 2.26 0.00 0.55 1.01 -0.54 -1.42 121.20 120.07 3fca s ILE 21 Ca 0.10 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.78 3fca s ILE 21 Cb 0.17 -2.29 0.00 0.00 0.01 0.00 0.00 42.46 40.35 3fca s ILE 21 CO 0.73 0.00 0.00 -0.11 0.00 0.00 0.00 174.94 175.56 3fca n LEU 23 N -2.22 0.00 -4.66 2.97 7.94 0.56 -0.14 117.00 121.44 3fca n LEU 23 Ca 0.15 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.63 3fca n LEU 23 Cb 0.61 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.52 3fca n LEU 23 CO 0.40 0.00 0.60 -0.75 -1.11 0.00 0.00 177.39 176.53 3fca s LYS 24 N 0.00 4.26 -0.85 1.96 2.20 0.03 -1.63 119.74 125.70 3fca s LYS 24 Ca 0.00 0.96 -0.16 0.00 -0.36 0.00 0.00 55.97 56.40 3fca s LYS 24 Cb 0.00 -3.59 0.17 0.00 -1.51 0.00 0.00 37.83 32.90 3fca s LYS 24 CO 0.00 -0.37 0.91 -0.51 -0.36 0.00 0.00 175.35 175.01 3fca s LEU 25 N 2.33 5.97 0.00 5.43 1.43 -0.01 -0.08 118.68 133.74 3fca s LEU 25 Ca 0.36 -2.33 0.28 0.00 -1.03 0.00 0.00 54.13 51.41 3fca s LEU 25 Cb -0.16 -2.29 1.29 0.00 0.03 0.00 0.00 46.19 45.05 3fca s LEU 25 CO 0.11 -0.81 1.93 -0.62 0.23 0.00 0.00 176.35 177.18 3fca n GLU 26 N 5.20 0.18 0.19 1.70 -0.58 -0.69 -2.96 120.64 123.67 3fca n GLU 26 Ca 0.16 0.02 0.14 0.00 -0.42 0.00 0.00 57.16 57.06 3fca n GLU 26 Cb 0.47 -1.50 0.63 0.00 -0.57 0.00 0.00 31.44 30.47 3fca n GLU 26 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 3fca h LYS 27 N 0.00 0.00 0.00 3.49 2.10 -1.75 -2.39 116.57 118.02 3fca h LYS 27 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3fca h LYS 27 Cb 0.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 3fca h LYS 27 CO 0.00 0.00 0.00 -0.91 -2.00 0.00 0.00 179.45 176.54 3fca h ASN 28 N 0.00 0.00 -4.08 7.07 4.21 -1.86 -3.37 115.58 117.54 3fca h ASN 28 Ca 0.00 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.97 3fca h ASN 28 Cb 0.29 0.00 0.12 0.00 -1.12 0.00 0.00 38.32 37.62 3fca h ASN 28 CO 0.00 0.00 0.50 0.20 -1.29 0.00 0.00 177.43 176.84 3fca s ASN 29 N -4.36 5.15 0.59 5.81 0.01 -0.90 -4.90 114.94 116.34 3fca s ASN 29 Ca 0.03 2.49 0.30 0.00 -0.71 0.00 0.00 52.86 54.98 3fca s ASN 29 Cb 0.09 -2.61 1.85 0.00 0.41 0.00 0.00 41.25 40.99 3fca s ASN 29 CO 0.38 -1.63 2.26 1.55 -1.51 0.00 0.00 177.10 178.16 3fca h PRO 30 N 0.99 0.00 -0.08 -0.60 0.13 -1.86 0.37 132.00 130.95 3fca h PRO 30 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3fca h PRO 30 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3fca h PRO 30 CO 0.55 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.73 3fca n GLY 31 N -1.31 0.24 2.26 1.56 0.00 -1.26 -4.95 105.19 101.74 3fca n GLY 31 Ca -0.03 -0.47 -0.06 0.00 0.00 0.00 0.00 46.02 45.46 3fca n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fca n GLY 32 N 1.19 0.84 3.66 -0.02 0.00 0.13 -4.81 105.19 106.18 3fca n GLY 32 Ca 0.18 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.58 3fca n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fca s SER 33 N -2.72 -0.20 0.62 1.61 1.04 -1.22 -3.79 113.70 109.05 3fca s SER 33 Ca 0.00 -0.68 0.37 0.00 0.48 0.00 0.00 55.95 56.12 3fca s SER 33 Cb 0.00 0.63 2.09 0.00 0.10 0.00 0.00 66.02 68.85 3fca s SER 33 CO 0.00 -1.18 2.30 1.62 0.98 0.00 0.00 173.24 176.96 3fca h VAL 34 N 2.15 0.28 0.00 5.02 3.04 -0.86 -3.02 116.25 122.86 3fca h VAL 34 Ca -0.24 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.42 3fca h VAL 34 Cb 1.25 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.55 3fca h VAL 34 CO 0.32 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 177.17 3fca n LYS 35 N -3.48 0.00 -0.21 4.17 4.76 -1.26 -2.34 118.16 119.81 3fca n LYS 35 Ca -0.03 0.14 0.09 0.00 -2.87 0.00 0.00 58.31 55.64 3fca n LYS 35 Cb 0.08 -1.50 0.37 0.00 -1.84 0.00 0.00 35.03 32.15 3fca n LYS 35 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 3fca h ASP 36 N 0.00 0.64 0.51 4.39 5.19 -1.86 -1.81 116.42 123.48 3fca h ASP 36 Ca 0.00 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.40 3fca h ASP 36 Cb 0.36 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.76 3fca h ASP 36 CO 0.00 0.38 -0.24 0.03 -3.12 0.00 0.00 179.24 176.28 3fca h ARG 37 N 0.71 -0.66 -0.82 3.56 3.08 -1.74 -1.59 114.38 116.91 3fca h ARG 37 Ca 0.36 0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.46 3fca h ARG 37 Cb 0.46 0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 3fca h ARG 37 CO -0.14 -0.38 0.51 -1.00 -1.07 0.00 0.00 179.97 177.89 3fca h PRO 38 N -1.11 1.10 -0.17 0.04 0.13 -1.75 -1.86 132.00 128.39 3fca h PRO 38 Ca -0.07 -0.09 0.02 0.00 -0.87 0.00 0.00 66.00 64.99 3fca h PRO 38 Cb 0.58 -0.24 -0.02 0.00 0.13 0.00 0.00 31.00 31.45 3fca h PRO 38 CO 0.11 0.76 0.06 0.00 -0.23 0.00 0.00 178.00 178.70 3fca h ALA 39 N 1.44 0.18 -0.26 -0.56 0.00 -1.38 0.92 119.26 119.60 3fca h ALA 39 Ca 0.30 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.27 3fca h ALA 39 Cb -0.08 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3fca h ALA 39 CO -0.06 -0.38 -0.03 1.25 0.00 0.00 0.00 179.25 180.03 3fca h LEU 40 N 0.14 -0.17 -0.47 0.00 5.85 -1.02 -0.58 115.31 119.06 3fca h LEU 40 Ca 0.07 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 3fca h LEU 40 Cb 0.04 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3fca h LEU 40 CO -0.07 -0.05 0.11 -0.26 -0.34 0.00 0.00 178.44 177.82 3fca h PHE 41 N 0.04 0.80 -0.58 1.25 -1.00 -0.94 -0.21 116.94 116.30 3fca h PHE 41 Ca 0.13 -0.10 -0.07 0.00 2.81 0.00 0.00 57.97 60.74 3fca h PHE 41 Cb 0.18 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.49 3fca h PHE 41 CO -0.23 0.73 0.09 0.52 -1.61 0.00 0.00 178.31 177.81 3fca h MET 42 N 0.64 0.96 -0.27 1.51 2.86 -0.68 -1.68 114.93 118.27 3fca h MET 42 Ca 0.15 -0.26 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 3fca h MET 42 Cb 0.34 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3fca h MET 42 CO 0.00 0.91 -0.15 0.82 1.06 0.00 0.00 176.91 179.56 3fca h ILE 43 N 0.86 1.30 -0.69 -1.22 2.04 -0.93 -1.13 117.51 117.74 3fca h ILE 43 Ca 0.18 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 3fca h ILE 43 Cb 0.42 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 3fca h ILE 43 CO 0.01 0.40 0.39 -0.07 0.00 0.00 0.00 178.15 178.88 3fca h LEU 44 N 0.32 0.85 -0.09 1.44 3.38 -1.01 0.22 115.31 120.43 3fca h LEU 44 Ca 0.06 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3fca h LEU 44 Cb 0.67 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3fca h LEU 44 CO 0.04 0.68 0.06 -0.78 0.09 0.00 0.00 178.44 178.54 3fca h ASP 45 N 0.94 0.10 -0.72 -0.43 3.58 -1.26 -1.95 116.42 116.68 3fca h ASP 45 Ca 0.24 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.65 3fca h ASP 45 Cb 0.01 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 3fca h ASP 45 CO -0.04 0.08 0.32 0.00 -2.88 0.00 0.00 179.24 176.71 3fca h ALA 46 N 1.03 1.18 -0.31 -0.78 0.00 -0.91 -2.17 119.26 117.30 3fca h ALA 46 Ca 0.03 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3fca h ALA 46 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3fca h ALA 46 CO -0.01 0.61 0.19 0.93 0.00 0.00 0.00 179.25 180.97 3fca h GLU 47 N 1.05 0.37 -0.20 0.00 5.08 -0.87 -0.36 114.58 119.65 3fca h GLU 47 Ca 0.25 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 3fca h GLU 47 Cb 0.16 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3fca h GLU 47 CO -0.03 0.24 -0.03 -0.22 -1.00 0.00 0.00 179.01 177.98 3fca h LYS 48 N 0.38 0.30 -0.22 2.33 3.64 -1.05 -0.53 116.57 121.43 3fca h LYS 48 Ca 0.12 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3fca h LYS 48 Cb -0.01 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3fca h LYS 48 CO -0.05 0.36 0.00 0.54 -2.27 0.00 0.00 179.45 178.03 3fca n ARG 49 N -4.34 1.67 -2.49 1.90 1.74 -0.84 -4.93 116.66 109.37 3fca n ARG 49 Ca -0.00 -1.02 -0.19 0.00 -0.77 0.00 0.00 57.85 55.87 3fca n ARG 49 Cb 0.21 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 3fca n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fca n GLY 50 N 1.05 -0.38 0.53 -0.13 0.00 -0.21 -4.92 105.19 101.12 3fca n GLY 50 Ca 0.14 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.20 3fca n GLY 50 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fca n LEU 51 N -2.85 1.79 -1.22 0.99 4.77 -0.17 -4.41 117.00 115.90 3fca n LEU 51 Ca -0.19 -0.59 0.07 0.00 -0.03 0.00 0.00 56.01 55.27 3fca n LEU 51 Cb 0.65 -0.03 0.30 0.00 -2.33 0.00 0.00 43.42 42.00 3fca n LEU 51 CO 0.29 0.31 0.77 0.18 -1.33 0.00 0.00 177.39 177.61 3fca n LEU 52 N 0.18 4.50 0.20 2.23 4.77 -1.26 -4.49 117.00 123.13 3fca n LEU 52 Ca 0.14 -3.05 0.05 0.00 -0.03 0.00 0.00 56.01 53.12 3fca n LEU 52 Cb 0.43 -0.60 0.49 0.00 -2.33 0.00 0.00 43.42 41.41 3fca n LEU 52 CO 0.21 0.70 0.92 0.11 -1.33 0.00 0.00 177.39 178.00 3fca h LYS 53 N 2.34 0.06 -0.34 3.23 1.79 -1.92 -2.05 116.57 119.68 3fca h LYS 53 Ca 0.03 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3fca h LYS 53 Cb 1.65 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.29 3fca h LYS 53 CO 0.33 0.21 0.00 0.09 -1.08 0.00 0.00 179.45 179.00 3fca n ASN 54 N -4.34 3.76 0.00 0.86 3.02 -1.26 -5.08 115.26 112.22 3fca n ASN 54 Ca -0.02 -2.64 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 3fca n ASN 54 Cb 0.23 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 38.94 3fca n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fca n GLY 55 N 0.01 -1.76 3.24 7.41 0.00 -0.77 -3.99 105.19 109.33 3fca n GLY 55 Ca 0.19 -1.93 -0.31 0.00 0.00 0.00 0.00 46.02 43.97 3fca n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fca s ILE 56 N 0.00 1.97 -0.06 -0.61 1.01 0.41 -0.99 121.20 122.94 3fca s ILE 56 Ca 0.00 -1.01 0.05 0.00 0.00 0.00 0.00 60.65 59.68 3fca s ILE 56 Cb 0.00 -1.68 -0.00 0.00 0.01 0.00 0.00 42.46 40.79 3fca s ILE 56 CO 0.00 0.55 -0.20 0.54 0.00 0.00 0.00 174.94 175.83 3fca s VAL 57 N -0.06 1.67 -0.09 2.92 0.11 -0.71 -0.44 120.40 123.81 3fca s VAL 57 Ca -0.06 -0.84 -0.06 0.00 -2.93 0.00 0.00 61.98 58.10 3fca s VAL 57 Cb -0.14 -1.43 0.04 0.00 -1.53 0.00 0.00 36.38 33.31 3fca s VAL 57 CO 0.04 0.47 0.22 -0.70 -3.33 0.00 0.00 175.10 171.81 3fca s GLU 58 N 0.08 0.20 -0.23 1.54 2.56 -0.81 -3.72 118.70 118.32 3fca s GLU 58 Ca -0.07 0.43 -0.27 0.00 0.00 0.00 0.00 54.97 55.06 3fca s GLU 58 Cb -0.13 -0.05 0.00 0.00 2.00 0.00 0.00 34.13 35.95 3fca s GLU 58 CO 0.04 -0.12 0.95 -1.25 -0.56 0.00 0.00 175.26 174.32 3fca s PRO 59 N 0.86 4.23 -0.25 4.30 0.04 -1.26 -1.75 135.00 141.18 3fca s PRO 59 Ca -0.06 1.18 -0.16 0.00 0.04 0.00 0.00 61.00 62.00 3fca s PRO 59 Cb -0.08 -3.64 0.07 0.00 0.04 0.00 0.00 34.50 30.90 3fca s PRO 59 CO -0.05 -0.58 0.62 -0.08 0.04 0.00 0.00 177.00 176.95 3fca s THR 60 N 3.02 -0.01 -2.07 1.26 -1.32 -0.39 -4.93 115.64 111.21 3fca s THR 60 Ca 0.40 0.02 0.23 0.00 -1.21 0.00 0.00 61.69 61.13 3fca s THR 60 Cb -0.15 -0.89 -0.01 0.00 -1.51 0.00 0.00 72.50 69.94 3fca s THR 60 CO 0.07 0.01 1.09 -1.54 -2.21 0.00 0.00 174.62 172.04 3fca n SER 61 N 3.91 2.07 0.00 8.08 3.41 -1.26 -4.54 113.62 125.28 3fca n SER 61 Ca -0.19 -1.53 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 3fca n SER 61 Cb 0.57 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 3fca n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fca n GLY 62 N 1.42 5.31 0.23 5.00 0.00 -1.26 -5.02 105.19 110.87 3fca n GLY 62 Ca 0.09 -1.40 0.09 0.00 0.00 0.00 0.00 46.02 44.81 3fca n GLY 62 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fca h ASN 63 N 0.00 0.00 -0.98 1.61 2.35 -1.99 -2.64 115.58 113.94 3fca h ASN 63 Ca 0.00 0.00 0.11 0.00 -0.55 0.00 0.00 56.30 55.86 3fca h ASN 63 Cb 0.00 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.29 3fca h ASN 63 CO 0.00 0.23 0.62 -0.03 -1.65 0.00 0.00 177.43 176.60 3fca h MET 64 N 0.00 0.97 -0.57 0.81 4.05 -1.96 -1.57 114.93 116.65 3fca h MET 64 Ca -0.00 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.37 3fca h MET 64 Cb 0.58 -0.22 -0.03 0.00 -0.80 0.00 0.00 31.60 31.14 3fca h MET 64 CO 0.03 0.64 0.38 0.78 0.23 0.00 0.00 176.91 178.96 3fca h GLY 65 N 1.00 0.81 0.88 1.39 0.00 -1.78 -0.83 103.07 104.52 3fca h GLY 65 Ca 0.47 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 3fca h GLY 65 CO -0.23 0.29 0.02 -2.22 0.00 0.00 0.00 176.54 174.40 3fca h ILE 66 N 0.77 1.11 -0.30 2.60 2.04 -1.52 -0.57 117.51 121.65 3fca h ILE 66 Ca 0.21 -0.33 0.05 0.00 1.00 0.00 0.00 64.86 65.79 3fca h ILE 66 Cb -0.08 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 3fca h ILE 66 CO -0.05 0.09 0.02 0.00 0.00 0.00 0.00 178.15 178.21 3fca h ALA 67 N 0.89 0.29 -0.37 1.87 0.00 -1.13 0.76 119.26 121.56 3fca h ALA 67 Ca 0.01 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3fca h ALA 67 Cb 0.13 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3fca h ALA 67 CO -0.00 -0.38 0.19 0.82 0.00 0.00 0.00 179.25 179.88 3fca h ILE 68 N 0.12 1.16 -0.54 0.00 2.04 -1.08 -1.05 117.51 118.15 3fca h ILE 68 Ca 0.14 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.59 3fca h ILE 68 Cb 0.18 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3fca h ILE 68 CO -0.22 0.16 0.35 0.00 0.00 0.00 0.00 178.15 178.44 3fca h ALA 69 N 1.05 0.69 0.03 1.87 0.00 -0.71 0.23 119.26 122.42 3fca h ALA 69 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3fca h ALA 69 Cb 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3fca h ALA 69 CO -0.02 0.11 -0.01 1.98 0.00 0.00 0.00 179.25 181.31 3fca h MET 70 N 0.72 -0.04 -0.62 0.00 1.85 -0.65 0.16 114.93 116.35 3fca h MET 70 Ca 0.20 0.00 -0.05 0.00 -0.61 0.00 0.00 59.70 59.25 3fca h MET 70 Cb -0.06 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 31.95 3fca h MET 70 CO -0.06 0.22 0.20 0.82 -0.40 0.00 0.00 176.91 177.70 3fca h ILE 71 N -0.29 1.24 -0.70 1.77 2.04 -1.11 -2.58 117.51 117.88 3fca h ILE 71 Ca -0.00 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.06 3fca h ILE 71 Cb 0.27 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 3fca h ILE 71 CO 0.01 0.31 0.46 1.23 0.00 0.00 0.00 178.15 180.16 3fca h GLY 72 N 0.88 1.00 0.68 5.37 0.00 -0.44 -0.24 103.07 110.32 3fca h GLY 72 Ca 0.20 -0.36 0.03 0.00 0.00 0.00 0.00 47.33 47.20 3fca h GLY 72 CO -0.01 0.33 -0.08 0.00 0.00 0.00 0.00 176.54 176.78 3fca h ALA 73 N 1.28 -0.00 -0.24 3.60 0.00 -0.47 0.70 119.26 124.13 3fca h ALA 73 Ca 0.27 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 3fca h ALA 73 Cb -0.06 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3fca h ALA 73 CO -0.08 -0.54 -0.18 -0.22 0.00 0.00 0.00 179.25 178.23 3fca h LYS 74 N -0.09 0.55 0.00 0.00 1.63 -1.27 -3.25 116.57 114.14 3fca h LYS 74 Ca 0.06 -0.27 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 3fca h LYS 74 Cb 0.18 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 3fca h LYS 74 CO -0.15 0.84 0.00 0.00 -3.45 0.00 0.00 179.45 176.69 3fca h ARG 75 N 0.26 0.00 0.00 1.90 3.08 -1.00 -3.47 114.38 115.15 3fca h ARG 75 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3fca h ARG 75 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 3fca h ARG 75 CO 0.05 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.36 3fca n GLY 76 N 1.18 1.16 3.81 0.04 0.00 -0.08 -5.06 105.19 106.25 3fca n GLY 76 Ca 0.05 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 3fca n GLY 76 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fca s HIS 77 N -2.00 3.59 0.15 1.61 3.76 0.04 -5.04 115.29 117.41 3fca s HIS 77 Ca 0.00 0.69 -0.31 0.00 -0.15 0.00 0.00 55.06 55.29 3fca s HIS 77 Cb 0.00 -2.20 -0.10 0.00 1.11 0.00 0.00 32.58 31.40 3fca s HIS 77 CO 0.00 0.52 1.53 0.50 -0.85 0.00 0.00 174.74 176.44 3fca s ARG 78 N -0.48 4.24 -0.17 1.40 3.52 -1.26 -4.35 118.95 121.85 3fca s ARG 78 Ca 0.18 2.29 0.00 0.00 -0.13 0.00 0.00 55.73 58.08 3fca s ARG 78 Cb -0.14 -3.18 0.03 0.00 -1.56 0.00 0.00 34.95 30.11 3fca s ARG 78 CO 0.07 -0.57 -0.12 0.08 -0.81 0.00 0.00 175.30 173.95 3fca s VAL 79 N 1.14 1.56 -0.16 7.11 1.01 -1.26 -0.44 120.40 129.36 3fca s VAL 79 Ca 0.69 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 3fca s VAL 79 Cb -0.42 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 3fca s VAL 79 CO 0.31 0.33 -0.06 -0.63 0.00 0.00 0.00 175.10 175.05 3fca s ILE 80 N 1.46 3.65 -0.07 2.22 1.01 0.42 -0.83 121.20 129.06 3fca s ILE 80 Ca 0.02 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.29 3fca s ILE 80 Cb -0.14 -2.60 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 3fca s ILE 80 CO -0.10 0.49 -0.24 -0.76 0.00 0.00 0.00 174.94 174.33 3fca s LEU 81 N 0.54 2.06 -0.06 2.97 1.43 0.38 -1.92 118.68 124.08 3fca s LEU 81 Ca -0.04 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 3fca s LEU 81 Cb -0.15 -1.36 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 3fca s LEU 81 CO 0.03 0.21 -0.00 0.42 0.23 0.00 0.00 176.35 177.23 3fca s THR 82 N 0.04 4.22 -0.23 5.49 -4.23 -0.72 0.16 115.64 120.38 3fca s THR 82 Ca -0.09 -0.36 -0.19 0.00 -1.18 0.00 0.00 61.69 59.87 3fca s THR 82 Cb -0.15 -2.80 0.06 0.00 1.34 0.00 0.00 72.50 70.95 3fca s THR 82 CO 0.06 0.55 0.59 -0.32 -0.54 0.00 0.00 174.62 174.96 3fca s MET 83 N -1.05 0.67 0.57 3.99 0.00 -0.61 -1.26 119.30 121.61 3fca s MET 83 Ca 0.15 0.90 -0.20 0.00 0.00 0.00 0.00 55.69 56.54 3fca s MET 83 Cb -0.11 0.26 -0.04 0.00 0.00 0.00 0.00 34.83 34.94 3fca s MET 83 CO 0.04 -0.10 1.30 -2.14 0.00 0.00 0.00 175.02 174.12 3fca s PRO 84 N 0.69 3.02 0.00 4.11 0.02 -1.26 -0.93 135.00 140.65 3fca s PRO 84 Ca -0.03 2.08 0.20 0.00 0.02 0.00 0.00 61.00 63.28 3fca s PRO 84 Cb -0.05 -2.11 1.20 0.00 0.02 0.00 0.00 34.50 33.56 3fca s PRO 84 CO -0.05 -1.24 1.59 -0.85 -0.33 0.00 0.00 177.00 176.13 3fca n GLU 85 N -1.29 0.62 0.00 5.54 0.00 0.38 -2.47 120.64 123.41 3fca n GLU 85 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.40 3fca n GLU 85 Cb 0.47 -1.50 0.66 0.00 0.00 0.00 0.00 31.44 31.07 3fca n GLU 85 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 3fca n THR 86 N -1.01 0.02 -2.73 3.84 5.66 -1.26 -4.87 114.28 113.92 3fca n THR 86 Ca 0.15 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.78 3fca n THR 86 Cb 0.07 -0.65 -0.06 0.00 -1.55 0.00 0.00 70.33 68.14 3fca n THR 86 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 3fca s MET 87 N -2.03 4.58 0.68 1.09 -1.94 -1.03 -4.99 119.30 115.66 3fca s MET 87 Ca 0.33 1.40 -0.17 0.00 -1.71 0.00 0.00 55.69 55.54 3fca s MET 87 Cb 0.15 -2.86 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 3fca s MET 87 CO 0.26 0.26 0.93 -1.13 -0.01 0.00 0.00 175.02 175.33 3fca n SER 88 N 0.65 0.43 0.23 3.03 3.41 -1.26 -4.84 113.62 115.27 3fca n SER 88 Ca 0.02 0.70 0.07 0.00 -0.26 0.00 0.00 58.87 59.40 3fca n SER 88 Cb 0.49 -1.39 0.55 0.00 -0.26 0.00 0.00 64.21 63.61 3fca n SER 88 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 3fca h VAL 89 N -0.02 1.01 0.13 -3.33 -1.51 -1.97 -2.70 116.25 107.85 3fca h VAL 89 Ca -0.48 -0.65 0.01 0.00 -1.23 0.00 0.00 66.70 64.36 3fca h VAL 89 Cb 1.35 1.36 -0.02 0.00 -2.13 0.00 0.00 31.29 31.84 3fca h VAL 89 CO 0.48 0.18 -0.19 -0.33 -1.23 0.00 0.00 177.57 176.48 3fca h GLU 90 N 0.00 -0.37 -0.38 5.19 5.08 -1.94 -2.15 114.58 120.02 3fca h GLU 90 Ca -0.00 0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 3fca h GLU 90 Cb 0.35 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3fca h GLU 90 CO 0.02 -0.24 -0.20 0.00 -1.00 0.00 0.00 179.01 177.59 3fca h ARG 91 N -0.38 0.80 -0.67 2.33 3.08 -1.86 -2.72 114.38 114.95 3fca h ARG 91 Ca 0.02 -0.36 0.08 0.00 0.07 0.00 0.00 59.98 59.79 3fca h ARG 91 Cb 0.38 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.35 3fca h ARG 91 CO -0.08 0.98 0.34 0.00 -1.07 0.00 0.00 179.97 180.14 3fca h ARG 92 N 0.60 0.58 -0.09 0.04 3.08 -1.49 -1.67 114.38 115.42 3fca h ARG 92 Ca 0.08 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3fca h ARG 92 Cb 0.75 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 3fca h ARG 92 CO 0.06 0.39 0.06 -0.22 -1.07 0.00 0.00 179.97 179.18 3fca h LYS 93 N 0.60 0.12 -0.41 0.04 1.63 -1.17 -0.97 116.57 116.41 3fca h LYS 93 Ca 0.32 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.11 3fca h LYS 93 Cb 0.30 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.88 3fca h LYS 93 CO -0.24 0.09 0.25 0.28 -3.45 0.00 0.00 179.45 176.38 3fca h VAL 94 N 0.12 1.13 -1.01 2.00 2.07 -1.19 0.11 116.25 119.48 3fca h VAL 94 Ca 0.03 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.30 3fca h VAL 94 Cb -0.01 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 30.28 3fca h VAL 94 CO -0.01 0.13 0.66 -0.07 0.02 0.00 0.00 177.57 178.30 3fca h LEU 95 N 0.55 1.13 -0.42 2.57 3.38 -1.13 -2.09 115.31 119.30 3fca h LEU 95 Ca 0.15 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.94 3fca h LEU 95 Cb -0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 3fca h LEU 95 CO -0.03 0.80 -0.38 0.50 0.09 0.00 0.00 178.44 179.42 3fca h LYS 96 N 1.32 0.91 -0.96 1.13 1.63 -0.51 -2.05 116.57 118.05 3fca h LYS 96 Ca 0.38 -0.47 0.17 0.00 -0.85 0.00 0.00 60.65 59.88 3fca h LYS 96 Cb -0.08 0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 31.47 3fca h LYS 96 CO -0.10 1.13 0.61 0.52 -3.45 0.00 0.00 179.45 178.15 3fca h MET 97 N 0.75 0.71 -0.10 1.90 2.86 -0.33 -0.93 114.93 119.78 3fca h MET 97 Ca 0.06 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3fca h MET 97 Cb 0.96 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.46 3fca h MET 97 CO 0.09 0.47 0.00 1.28 1.06 0.00 0.00 176.91 179.81 3fca n LEU 98 N -4.64 0.95 -0.67 1.22 4.77 -0.83 -4.91 117.00 112.89 3fca n LEU 98 Ca 0.20 -0.40 -0.08 0.00 -0.03 0.00 0.00 56.01 55.70 3fca n LEU 98 Cb 0.53 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 3fca n LEU 98 CO 0.26 0.20 -0.08 0.61 -1.33 0.00 0.00 177.39 177.05 3fca n GLY 99 N 0.96 0.92 3.78 -0.72 0.00 -0.35 -4.56 105.19 105.22 3fca n GLY 99 Ca 0.14 -0.65 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 3fca n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fca s ALA 100 N -2.32 2.85 -0.23 4.61 0.00 -0.81 -4.77 121.76 121.09 3fca s ALA 100 Ca 0.00 0.73 -0.18 0.00 0.00 0.00 0.00 51.96 52.52 3fca s ALA 100 Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.78 3fca s ALA 100 CO 0.00 -0.50 0.49 -1.21 0.00 0.00 0.00 175.76 174.54 3fca s GLU 101 N -3.10 4.13 -0.25 0.00 2.02 -0.01 -4.56 118.70 116.94 3fca s GLU 101 Ca 0.68 0.33 -0.14 0.00 0.02 0.00 0.00 54.97 55.85 3fca s GLU 101 Cb -0.21 -3.59 -0.04 0.00 0.10 0.00 0.00 34.13 30.38 3fca s GLU 101 CO 0.25 -0.21 0.34 -0.51 0.02 0.00 0.00 175.26 175.15 3fca s LEU 102 N 1.84 4.08 -0.37 1.80 1.02 -1.26 -0.47 118.68 125.32 3fca s LEU 102 Ca 0.22 0.31 -0.06 0.00 0.02 0.00 0.00 54.13 54.62 3fca s LEU 102 Cb -0.15 -2.39 0.07 0.00 0.02 0.00 0.00 46.19 43.74 3fca s LEU 102 CO 0.09 -0.11 0.16 -0.69 0.02 0.00 0.00 176.35 175.81 3fca s VAL 103 N 1.70 3.66 -0.15 -1.59 1.01 0.12 -4.97 120.40 120.19 3fca s VAL 103 Ca 0.15 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.46 3fca s VAL 103 Cb -0.15 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 3fca s VAL 103 CO 0.09 -0.38 0.53 -0.76 0.00 0.00 0.00 175.10 174.58 3fca s LEU 104 N 1.32 4.22 0.25 3.92 1.43 -1.26 -1.57 118.68 126.99 3fca s LEU 104 Ca 0.01 0.81 0.08 0.00 -1.03 0.00 0.00 54.13 54.01 3fca s LEU 104 Cb -0.21 -2.76 -0.04 0.00 0.03 0.00 0.00 46.19 43.20 3fca s LEU 104 CO 0.00 -0.10 0.06 0.42 0.23 0.00 0.00 176.35 176.96 3fca s THR 105 N 1.13 3.82 0.19 5.49 -4.23 -0.10 -4.80 115.64 117.13 3fca s THR 105 Ca 0.27 -1.67 -0.33 0.00 -1.18 0.00 0.00 61.69 58.79 3fca s THR 105 Cb -0.16 -3.03 -0.15 0.00 1.34 0.00 0.00 72.50 70.51 3fca s THR 105 CO 0.11 -0.32 1.33 -2.65 -0.54 0.00 0.00 174.62 172.55 3fca n PRO 106 N -0.86 1.64 0.00 3.99 -0.02 -1.26 -0.47 135.00 138.02 3fca n PRO 106 Ca -0.07 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3fca n PRO 106 Cb 0.58 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3fca n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fca n GLY 107 N 2.30 -1.93 0.27 -1.23 0.00 -1.26 -3.78 105.19 99.56 3fca n GLY 107 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 3fca n GLY 107 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3fca n GLU 108 N 0.00 -0.07 0.00 1.61 -0.00 -1.26 0.11 120.64 121.04 3fca n GLU 108 Ca 0.00 1.19 0.00 0.00 -0.00 0.00 0.00 57.16 58.35 3fca n GLU 108 Cb 0.00 -1.83 0.00 0.00 -0.00 0.00 0.00 31.44 29.61 3fca n GLU 108 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 3fca n LEU 109 N -5.18 0.00 0.00 -1.84 0.00 -1.26 -4.95 117.00 103.77 3fca n LEU 109 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.16 3fca n LEU 109 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.91 3fca n LEU 109 CO -0.08 0.00 0.00 0.61 0.00 0.00 0.00 177.39 177.92 3fca n GLY 110 N 0.00 0.31 0.16 -3.96 0.00 0.31 -4.84 105.19 97.18 3fca n GLY 110 Ca 0.00 -1.66 -0.03 0.00 0.00 0.00 0.00 46.02 44.33 3fca n GLY 110 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3fca h MET 111 N 0.00 0.15 -0.50 1.61 2.86 -1.92 -2.95 114.93 114.18 3fca h MET 111 Ca 0.00 -0.10 0.08 0.00 -2.06 0.00 0.00 59.70 57.63 3fca h MET 111 Cb 0.00 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.60 3fca h MET 111 CO 0.00 0.68 0.11 -0.22 1.06 0.00 0.00 176.91 178.55 3fca h LYS 112 N 0.11 0.25 -0.93 1.72 1.63 -1.99 0.48 116.57 117.84 3fca h LYS 112 Ca -0.00 -0.01 0.11 0.00 -0.85 0.00 0.00 60.65 59.89 3fca h LYS 112 Cb 1.05 -0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 32.55 3fca h LYS 112 CO 0.08 0.16 0.60 0.78 -3.45 0.00 0.00 179.45 177.62 3fca h GLY 113 N 0.26 1.39 1.04 5.01 0.00 -1.87 -0.30 103.07 108.59 3fca h GLY 113 Ca 0.25 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 3fca h GLY 113 CO -0.32 0.18 -0.23 0.00 0.00 0.00 0.00 176.54 176.18 3fca h ALA 114 N 1.55 0.56 -0.10 3.60 0.00 -1.28 -1.51 119.26 122.08 3fca h ALA 114 Ca 0.44 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3fca h ALA 114 Cb 0.46 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3fca h ALA 114 CO -0.20 0.54 0.06 0.28 0.00 0.00 0.00 179.25 179.93 3fca h VAL 115 N 0.66 1.06 -0.76 0.00 2.07 -0.14 -1.36 116.25 117.78 3fca h VAL 115 Ca 0.08 -0.16 0.06 0.00 0.82 0.00 0.00 66.70 67.50 3fca h VAL 115 Cb 0.80 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 3fca h VAL 115 CO 0.07 0.05 0.46 -0.33 0.02 0.00 0.00 177.57 177.84 3fca h GLU 116 N 0.10 0.82 -0.43 1.57 3.07 -1.05 -1.25 114.58 117.42 3fca h GLU 116 Ca 0.04 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.73 3fca h GLU 116 Cb 0.04 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.75 3fca h GLU 116 CO -0.01 0.54 -0.21 -0.22 -1.40 0.00 0.00 179.01 177.71 3fca h LYS 117 N 0.85 0.85 -0.65 2.33 1.63 -1.16 -2.54 116.57 117.88 3fca h LYS 117 Ca 0.33 -0.35 -0.04 0.00 -0.85 0.00 0.00 60.65 59.75 3fca h LYS 117 Cb 0.15 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 3fca h LYS 117 CO -0.17 0.98 0.27 0.00 -3.45 0.00 0.00 179.45 177.08 3fca h ALA 118 N 1.01 0.84 -0.72 5.00 0.00 -0.76 -0.20 119.26 124.42 3fca h ALA 118 Ca 0.10 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3fca h ALA 118 Cb 0.75 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3fca h ALA 118 CO 0.06 0.45 0.48 -0.07 0.00 0.00 0.00 179.25 180.16 3fca h LEU 119 N 0.91 0.84 -0.48 0.00 3.38 -1.13 0.17 115.31 119.00 3fca h LEU 119 Ca 0.22 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.00 3fca h LEU 119 Cb 0.19 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3fca h LEU 119 CO -0.02 0.61 -0.43 1.05 0.09 0.00 0.00 178.44 179.74 3fca h GLU 120 N 0.98 0.77 -0.88 1.13 4.11 -1.22 -2.45 114.58 117.03 3fca h GLU 120 Ca 0.26 -0.42 0.00 0.00 0.07 0.00 0.00 59.36 59.27 3fca h GLU 120 Cb -0.10 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 3fca h GLU 120 CO -0.06 1.05 0.55 0.82 0.07 0.00 0.00 179.01 181.44 3fca h ILE 121 N 0.62 1.24 -0.43 -1.06 2.04 -0.71 0.36 117.51 119.57 3fca h ILE 121 Ca 0.04 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 3fca h ILE 121 Cb 1.00 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 3fca h ILE 121 CO 0.09 0.24 0.25 -1.28 0.00 0.00 0.00 178.15 177.45 3fca h SER 122 N 1.20 0.52 -0.35 1.72 0.87 -0.83 0.70 113.55 117.39 3fca h SER 122 Ca 0.32 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3fca h SER 122 Cb -0.09 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 3fca h SER 122 CO -0.06 0.44 0.20 0.03 -0.53 0.00 0.00 176.83 176.90 3fca h ARG 123 N 0.56 0.49 -0.01 2.24 3.08 -1.00 -0.42 114.38 119.33 3fca h ARG 123 Ca 0.15 -0.06 -0.18 0.00 0.07 0.00 0.00 59.98 59.97 3fca h ARG 123 Cb 0.02 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 3fca h ARG 123 CO -0.03 0.41 -0.81 0.93 -1.07 0.00 0.00 179.97 179.40 3fca h GLU 124 N 0.45 0.15 0.00 0.04 4.39 -0.53 -3.35 114.58 115.73 3fca h GLU 124 Ca 0.12 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.68 3fca h GLU 124 Cb 0.06 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3fca h GLU 124 CO -0.02 0.88 -1.23 0.25 -1.16 0.00 0.00 179.01 177.73 3fca n THR 125 N -3.68 0.00 -0.83 1.13 -2.24 0.20 -4.99 114.28 103.88 3fca n THR 125 Ca -0.03 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3fca n THR 125 Cb 0.76 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 3fca n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fca n GLY 126 N 1.66 0.90 3.76 3.38 0.00 -0.17 -4.88 105.19 109.83 3fca n GLY 126 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3fca n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fca n ALA 127 N 0.50 1.96 -2.72 4.61 0.00 -1.22 -4.54 120.51 119.09 3fca n ALA 127 Ca 0.00 0.25 -0.37 0.00 0.00 0.00 0.00 53.44 53.32 3fca n ALA 127 Cb 0.00 -2.38 -0.07 0.00 0.00 0.00 0.00 19.45 17.00 3fca n ALA 127 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3fca s HIS 128 N -1.19 3.45 -0.17 0.00 2.46 -0.16 -4.43 115.29 115.25 3fca s HIS 128 Ca 0.61 0.60 -0.25 0.00 0.47 0.00 0.00 55.06 56.50 3fca s HIS 128 Cb -0.45 -2.37 -0.02 0.00 -0.13 0.00 0.00 32.58 29.61 3fca s HIS 128 CO 0.57 0.20 0.80 1.41 -2.47 0.00 0.00 174.74 175.26 3fca s MET 129 N 0.59 4.29 0.28 2.88 1.75 -1.24 -1.74 119.30 126.11 3fca s MET 129 Ca 0.17 0.96 0.12 0.00 -1.25 0.00 0.00 55.69 55.69 3fca s MET 129 Cb -0.13 -3.57 0.37 0.00 2.84 0.00 0.00 34.83 34.34 3fca s MET 129 CO 0.05 -0.30 1.61 -0.07 -0.65 0.00 0.00 175.02 175.65 3fca h LEU 130 N 8.24 0.00 -3.39 4.11 3.38 -1.98 -3.49 115.31 122.17 3fca h LEU 130 Ca -0.30 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.38 3fca h LEU 130 Cb 1.14 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.90 3fca h LEU 130 CO 0.82 0.59 -1.12 -3.20 0.09 0.00 0.00 178.44 175.63 3fca n ASN 131 N -3.68 -5.94 0.30 -0.43 2.85 -1.26 -4.49 115.26 102.60 3fca n ASN 131 Ca -0.01 0.03 0.15 0.00 -0.11 0.00 0.00 54.58 54.64 3fca n ASN 131 Cb 0.62 -2.04 0.91 0.00 1.24 0.00 0.00 39.78 40.51 3fca n ASN 131 CO 0.00 0.00 0.00 0.06 -2.11 0.00 0.00 177.26 175.21 3fca h GLN 132 N 2.35 0.00 -0.00 1.20 3.07 -1.94 -1.03 115.11 118.77 3fca h GLN 132 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.32 3fca h GLN 132 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.84 3fca h GLN 132 CO 0.19 0.01 -0.11 1.19 0.09 0.00 0.00 178.83 180.20 3fca n PHE 133 N -3.84 0.00 0.00 0.06 3.72 -1.26 -4.13 117.46 112.02 3fca n PHE 133 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3fca n PHE 133 Cb 0.09 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.21 3fca n PHE 133 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3fca n GLU 134 N -1.46 3.53 -2.90 -1.08 1.02 -0.56 -2.66 120.64 116.52 3fca n GLU 134 Ca 0.07 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.79 3fca n GLU 134 Cb 0.33 -0.55 -0.04 0.00 -0.02 0.00 0.00 31.44 31.16 3fca n GLU 134 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3fca s ASN 135 N -0.96 6.73 0.57 1.62 3.84 -0.50 -4.79 114.94 121.45 3fca s ASN 135 Ca 0.00 0.79 0.34 0.00 0.21 0.00 0.00 52.86 54.19 3fca s ASN 135 Cb 0.00 -2.43 1.70 0.00 -0.55 0.00 0.00 41.25 39.97 3fca s ASN 135 CO 0.00 -0.62 2.13 1.55 -2.79 0.00 0.00 177.10 177.37 3fca h PRO 136 N 8.02 0.00 0.00 0.43 0.13 -1.93 -1.73 132.00 136.92 3fca h PRO 136 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 3fca h PRO 136 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3fca h PRO 136 CO 0.90 0.06 0.00 1.88 -0.23 0.00 0.00 178.00 180.60 3fca h TYR 137 N 0.00 0.00 -0.01 1.56 0.05 -1.93 -0.17 116.97 116.48 3fca h TYR 137 Ca -0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3fca h TYR 137 Cb 0.29 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 3fca h TYR 137 CO 0.00 0.00 0.00 -0.97 -1.05 0.00 0.00 178.16 176.14 3fca h ASN 138 N 0.00 0.01 -0.53 3.88 -0.73 -1.57 -2.21 115.58 114.42 3fca h ASN 138 Ca 0.00 -0.10 -0.03 0.00 1.87 0.00 0.00 56.30 58.04 3fca h ASN 138 Cb 0.29 -0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.85 3fca h ASN 138 CO 0.00 0.11 0.22 0.58 -0.37 0.00 0.00 177.43 177.97 3fca h VAL 139 N -0.09 1.22 -0.48 2.57 2.07 -1.24 -3.08 116.25 117.21 3fca h VAL 139 Ca 0.00 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 3fca h VAL 139 Cb 0.10 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 3fca h VAL 139 CO -0.00 0.25 0.18 1.88 0.02 0.00 0.00 177.57 179.91 3fca h TYR 140 N 0.72 0.69 -0.89 1.57 0.05 -1.18 -0.67 116.97 117.26 3fca h TYR 140 Ca 0.18 -0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.99 3fca h TYR 140 Cb 0.19 -0.21 -0.06 0.00 1.01 0.00 0.00 36.73 37.65 3fca h TYR 140 CO 0.01 0.55 0.56 0.66 -1.05 0.00 0.00 178.16 178.88 3fca h SER 141 N 0.68 0.88 0.55 3.88 4.64 -1.31 0.12 113.55 123.00 3fca h SER 141 Ca 0.17 0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.26 3fca h SER 141 Cb 0.15 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3fca h SER 141 CO -0.01 0.56 -1.06 0.45 -0.87 0.00 0.00 176.83 175.89 3fca h HIS 142 N 1.01 0.46 -0.12 4.77 3.86 -1.43 -1.75 115.15 121.95 3fca h HIS 142 Ca 0.39 -0.29 -0.05 0.00 -1.16 0.00 0.00 60.37 59.25 3fca h HIS 142 Cb 0.18 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3fca h HIS 142 CO -0.03 1.17 -0.17 0.37 0.86 0.00 0.00 177.93 180.13 3fca h GLN 143 N 0.12 0.20 0.00 2.45 4.15 -0.65 0.86 115.11 122.24 3fca h GLN 143 Ca -0.09 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.28 3fca h GLN 143 Cb 1.75 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.41 3fca h GLN 143 CO 0.17 0.37 -1.20 1.19 -1.93 0.00 0.00 178.83 177.43 3fca n PHE 144 N -4.25 0.00 0.03 3.99 3.72 0.38 -4.48 117.46 116.85 3fca n PHE 144 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3fca n PHE 144 Cb 0.29 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 3fca n PHE 144 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3fca n THR 145 N -1.69 0.34 -0.02 4.37 -2.24 -0.66 -4.81 114.28 109.57 3fca n THR 145 Ca 0.00 0.11 -0.11 0.00 -2.27 0.00 0.00 64.05 61.79 3fca n THR 145 Cb 0.33 -0.89 -0.05 0.00 -2.10 0.00 0.00 70.33 67.62 3fca n THR 145 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 3fca h THR 146 N 0.00 1.06 0.26 4.28 2.02 -1.56 -1.82 112.91 117.15 3fca h THR 146 Ca 0.00 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 3fca h THR 146 Cb 0.00 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3fca h THR 146 CO 0.00 0.05 -0.13 1.23 0.37 0.00 0.00 175.52 177.05 3fca h GLY 147 N 0.16 -0.37 0.14 2.16 0.00 -1.10 -1.36 103.07 102.70 3fca h GLY 147 Ca 0.05 0.14 0.18 0.00 0.00 0.00 0.00 47.33 47.70 3fca h GLY 147 CO -0.01 -0.13 0.59 -2.55 0.00 0.00 0.00 176.54 174.43 3fca h PRO 148 N -0.42 0.72 0.34 4.80 0.11 -1.78 -0.24 132.00 135.54 3fca h PRO 148 Ca -0.04 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 3fca h PRO 148 Cb 0.32 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3fca h PRO 148 CO 0.06 0.48 -0.16 0.93 -0.21 0.00 0.00 178.00 179.09 3fca h GLU 149 N 0.74 -0.44 -0.25 1.05 5.08 -1.05 -2.96 114.58 116.76 3fca h GLU 149 Ca 0.56 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.99 3fca h GLU 149 Cb 0.87 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 3fca h GLU 149 CO -0.38 -0.21 0.03 0.82 -1.00 0.00 0.00 179.01 178.26 3fca h ILE 150 N -0.59 0.86 -0.45 3.13 2.04 -0.91 0.19 117.51 121.79 3fca h ILE 150 Ca -0.05 -0.04 0.09 0.00 1.00 0.00 0.00 64.86 65.86 3fca h ILE 150 Cb 0.43 0.74 -0.10 0.00 -0.74 0.00 0.00 36.82 37.15 3fca h ILE 150 CO 0.08 0.02 -0.24 0.25 0.00 0.00 0.00 178.15 178.26 3fca h LEU 151 N 0.12 -0.83 -0.17 1.44 5.85 -1.08 -1.37 115.31 119.27 3fca h LEU 151 Ca 0.11 0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.90 3fca h LEU 151 Cb 0.13 0.43 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3fca h LEU 151 CO -0.17 -0.26 -0.31 0.50 -0.34 0.00 0.00 178.44 177.86 3fca h LYS 152 N -0.15 0.51 -0.10 1.25 3.64 -1.32 -0.01 116.57 120.39 3fca h LYS 152 Ca 0.21 -0.32 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 3fca h LYS 152 Cb 0.48 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3fca h LYS 152 CO -0.54 0.93 0.08 1.96 -2.27 0.00 0.00 179.45 179.61 3fca h GLN 153 N 0.15 0.00 -0.60 1.90 4.20 -0.74 0.12 115.11 120.14 3fca h GLN 153 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3fca h GLN 153 Cb 0.90 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.68 3fca h GLN 153 CO 0.07 0.00 0.00 -1.33 -0.67 0.00 0.00 178.83 176.90 3fca n MET 154 N -4.17 2.81 -4.05 1.46 2.81 -0.53 -4.93 117.12 110.52 3fca n MET 154 Ca -0.01 -2.08 -0.31 0.00 -1.81 0.00 0.00 57.70 53.50 3fca n MET 154 Cb 0.19 -1.64 -0.01 0.00 -0.71 0.00 0.00 33.22 31.05 3fca n MET 154 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3fca n ASP 155 N 0.88 -2.59 -2.22 7.83 8.00 0.40 -1.71 116.55 127.13 3fca n ASP 155 Ca 0.19 -0.95 -0.19 0.00 0.71 0.00 0.00 54.79 54.54 3fca n ASP 155 Cb 0.63 -3.16 -0.03 0.00 -0.02 0.00 0.00 41.12 38.54 3fca n ASP 155 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3fca n TYR 156 N -4.45 -0.86 -3.75 1.24 4.01 -0.02 -4.96 117.16 108.37 3fca n TYR 156 Ca -0.07 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.38 3fca n TYR 156 Cb 0.57 -3.68 -0.16 0.00 -0.31 0.00 0.00 39.34 35.76 3fca n TYR 156 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3fca s GLN 157 N -4.74 0.77 -0.06 -0.72 -0.21 -0.70 -5.10 119.66 108.90 3fca s GLN 157 Ca 0.00 -0.69 -0.03 0.00 0.02 0.00 0.00 55.36 54.67 3fca s GLN 157 Cb 0.00 -2.10 0.04 0.00 1.00 0.00 0.00 33.01 31.95 3fca s GLN 157 CO 0.00 -0.75 0.13 0.42 -2.12 0.00 0.00 175.29 172.97 3fca s ILE 158 N 1.74 -0.11 -0.08 1.08 1.01 -1.26 -4.89 121.20 118.68 3fca s ILE 158 Ca 0.02 0.25 0.14 0.00 0.00 0.00 0.00 60.65 61.05 3fca s ILE 158 Cb -0.17 -0.23 -0.24 0.00 0.01 0.00 0.00 42.46 41.83 3fca s ILE 158 CO -0.14 0.10 0.51 0.47 0.00 0.00 0.00 174.94 175.88 3fca n ASP 159 N 4.57 0.67 -3.74 3.58 8.00 0.37 -4.55 116.55 125.45 3fca n ASP 159 Ca -0.19 0.31 -0.13 0.00 0.71 0.00 0.00 54.79 55.48 3fca n ASP 159 Cb 0.51 0.20 -0.10 0.00 -0.02 0.00 0.00 41.12 41.71 3fca n ASP 159 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fca s ALA 160 N -2.57 -0.94 -0.10 2.24 0.00 -1.01 -0.83 121.76 118.55 3fca s ALA 160 Ca -0.06 0.93 0.03 0.00 0.00 0.00 0.00 51.96 52.87 3fca s ALA 160 Cb 0.07 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 3fca s ALA 160 CO 0.83 -0.21 -0.21 0.12 0.00 0.00 0.00 175.76 176.29 3fca s PHE 161 N -0.17 2.60 -0.08 0.00 5.36 -0.16 -1.55 117.98 123.97 3fca s PHE 161 Ca -0.03 -0.87 0.02 0.00 -0.96 0.00 0.00 56.93 55.10 3fca s PHE 161 Cb -0.03 -1.72 0.01 0.00 -0.34 0.00 0.00 43.02 40.94 3fca s PHE 161 CO 0.02 -0.31 -0.15 0.08 -1.46 0.00 0.00 175.22 173.40 3fca s VAL 162 N 0.21 1.35 -0.21 3.12 1.01 -0.58 -0.60 120.40 124.70 3fca s VAL 162 Ca -0.13 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 3fca s VAL 162 Cb -0.16 -1.22 0.06 0.00 0.00 0.00 0.00 36.38 35.06 3fca s VAL 162 CO 0.07 0.41 0.53 0.00 0.00 0.00 0.00 175.10 176.11 3fca s ALA 163 N 0.69 -1.38 0.45 5.51 0.00 -0.31 -4.07 121.76 122.65 3fca s ALA 163 Ca -0.14 1.79 -0.25 0.00 0.00 0.00 0.00 51.96 53.37 3fca s ALA 163 Cb -0.16 -1.06 -0.08 0.00 0.00 0.00 0.00 23.12 21.82 3fca s ALA 163 CO 0.03 -0.30 1.36 0.20 0.00 0.00 0.00 175.76 177.06 3fca s GLY 164 N 1.11 2.91 -0.32 0.00 0.00 -1.26 -0.83 107.32 108.92 3fca s GLY 164 Ca -0.07 1.34 -0.12 0.00 0.00 0.00 0.00 44.72 45.87 3fca s GLY 164 CO -0.10 1.91 0.22 0.14 0.00 0.00 0.00 173.10 175.27 3fca s VAL 165 N -1.26 5.23 0.00 1.40 1.01 -0.89 -4.76 120.40 121.13 3fca s VAL 165 Ca 0.62 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.45 3fca s VAL 165 Cb -0.40 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.34 3fca s VAL 165 CO 0.51 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.28 3fca n GLY 166 N 5.08 -0.27 0.20 4.51 0.00 -1.26 -1.74 105.19 111.72 3fca n GLY 166 Ca -0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.99 3fca n GLY 166 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3fca h THR 167 N 0.00 0.16 0.00 2.61 1.35 -1.93 -3.41 112.91 111.70 3fca h THR 167 Ca 0.00 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.63 3fca h THR 167 Cb 0.00 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 3fca h THR 167 CO 0.00 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.97 3fca n GLY 168 N 1.12 1.09 0.08 5.82 0.00 -1.26 -4.44 105.19 107.60 3fca n GLY 168 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 3fca n GLY 168 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3fca h GLY 169 N 0.00 -0.04 0.96 -0.02 0.00 -1.89 -2.31 103.07 99.77 3fca h GLY 169 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 3fca h GLY 169 CO 0.00 -0.04 -0.04 -0.84 0.00 0.00 0.00 176.54 175.62 3fca h THR 170 N -0.06 0.94 -0.42 4.70 2.02 -1.92 -1.98 112.91 116.19 3fca h THR 170 Ca 0.01 -0.09 -0.09 0.00 0.77 0.00 0.00 66.41 67.01 3fca h THR 170 Cb 0.08 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 3fca h THR 170 CO -0.03 0.02 -0.09 -0.29 0.37 0.00 0.00 175.52 175.50 3fca h ILE 171 N -0.16 1.25 -0.16 3.11 2.10 -1.85 -1.91 117.51 119.88 3fca h ILE 171 Ca -0.01 -1.12 -0.04 0.00 1.08 0.00 0.00 64.86 64.77 3fca h ILE 171 Cb 0.13 1.03 -0.00 0.00 -1.09 0.00 0.00 36.82 36.89 3fca h ILE 171 CO 0.02 0.38 -0.05 0.28 -1.08 0.00 0.00 178.15 177.70 3fca h SER 172 N 0.67 0.32 -0.06 2.19 0.02 -1.31 0.76 113.55 116.15 3fca h SER 172 Ca 0.12 -0.38 -0.07 0.00 -0.84 0.00 0.00 61.79 60.62 3fca h SER 172 Cb 0.55 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.01 3fca h SER 172 CO 0.03 0.63 -0.23 1.23 -1.14 0.00 0.00 176.83 177.35 3fca h GLY 173 N 0.01 0.29 0.92 -3.77 0.00 -1.33 -1.16 103.07 98.03 3fca h GLY 173 Ca 0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 3fca h GLY 173 CO 0.02 0.35 0.11 -2.08 0.00 0.00 0.00 176.54 174.94 3fca h VAL 174 N -0.26 1.14 -0.86 4.60 2.07 -1.46 -3.02 116.25 118.48 3fca h VAL 174 Ca -0.01 -0.41 0.09 0.00 0.82 0.00 0.00 66.70 67.18 3fca h VAL 174 Cb 0.87 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.56 3fca h VAL 174 CO 0.05 0.14 0.51 1.23 0.02 0.00 0.00 177.57 179.52 3fca h GLY 175 N 0.25 1.33 0.72 2.17 0.00 -0.84 -0.78 103.07 105.92 3fca h GLY 175 Ca 0.08 -0.35 0.04 0.00 0.00 0.00 0.00 47.33 47.11 3fca h GLY 175 CO -0.01 0.17 0.21 3.21 0.00 0.00 0.00 176.54 180.12 3fca h ARG 176 N 0.86 0.40 -0.04 4.80 3.08 -1.17 0.12 114.38 122.43 3fca h ARG 176 Ca 0.40 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.42 3fca h ARG 176 Cb 0.33 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 3fca h ARG 176 CO -0.23 0.27 0.00 0.28 -1.07 0.00 0.00 179.97 179.22 3fca h VAL 177 N 0.42 1.24 -0.43 2.04 2.07 -1.21 -0.96 116.25 119.41 3fca h VAL 177 Ca 0.20 -0.73 -0.14 0.00 0.82 0.00 0.00 66.70 66.85 3fca h VAL 177 Cb 0.13 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3fca h VAL 177 CO -0.16 0.20 -0.29 -0.07 0.02 0.00 0.00 177.57 177.26 3fca h LEU 178 N -0.20 0.98 -0.68 2.57 3.38 -1.06 -0.11 115.31 120.19 3fca h LEU 178 Ca 0.01 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 3fca h LEU 178 Cb 0.31 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3fca h LEU 178 CO 0.00 1.20 0.24 0.11 0.09 0.00 0.00 178.44 180.08 3fca h LYS 179 N 0.79 1.03 -0.78 1.13 1.79 -0.82 0.27 116.57 119.99 3fca h LYS 179 Ca 0.09 -0.20 0.06 0.00 -2.18 0.00 0.00 60.65 58.41 3fca h LYS 179 Cb 0.87 -0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 31.31 3fca h LYS 179 CO 0.08 0.88 0.46 0.78 -1.08 0.00 0.00 179.45 180.57 3fca h GLY 180 N 0.97 1.16 0.32 3.86 0.00 -0.60 0.22 103.07 108.99 3fca h GLY 180 Ca 0.22 -0.33 -0.14 0.00 0.00 0.00 0.00 47.33 47.08 3fca h GLY 180 CO -0.01 0.21 -0.70 -2.75 0.00 0.00 0.00 176.54 173.29 3fca h PHE 181 N 0.84 0.25 0.00 5.60 3.57 -0.86 -3.41 116.94 122.94 3fca h PHE 181 Ca 0.34 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3fca h PHE 181 Cb 0.19 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.92 3fca h PHE 181 CO -0.05 1.27 -1.55 1.19 -2.23 0.00 0.00 178.31 176.94 3fca n PHE 182 N -4.30 0.24 -0.26 0.41 3.72 0.94 -5.06 117.46 113.15 3fca n PHE 182 Ca -0.17 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 3fca n PHE 182 Cb 0.69 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3fca n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fca n GLY 183 N 1.28 3.46 0.09 1.37 0.00 0.75 -1.46 105.19 110.69 3fca n GLY 183 Ca -0.01 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.01 3fca n GLY 183 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fca n ASN 184 N 4.33 0.27 0.19 1.61 5.03 -1.26 -3.30 115.26 122.13 3fca n ASN 184 Ca 0.00 -1.36 0.14 0.00 0.87 0.00 0.00 54.58 54.23 3fca n ASN 184 Cb 0.00 -0.01 0.53 0.00 -1.02 0.00 0.00 39.78 39.28 3fca n ASN 184 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3fca h GLY 185 N 5.25 0.00 -4.84 7.41 0.00 -1.65 -3.44 103.07 105.80 3fca h GLY 185 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 3fca h GLY 185 CO 0.00 0.00 -0.81 0.54 0.00 0.00 0.00 176.54 176.27 3fca s VAL 186 N -3.42 2.71 -0.24 4.60 0.11 -1.21 -4.69 120.40 118.27 3fca s VAL 186 Ca 0.04 -0.85 -0.10 0.00 -2.93 0.00 0.00 61.98 58.14 3fca s VAL 186 Cb 0.09 -2.03 -0.05 0.00 -1.53 0.00 0.00 36.38 32.86 3fca s VAL 186 CO 0.50 0.59 0.15 -0.54 -3.33 0.00 0.00 175.10 172.46 3fca s LYS 187 N -0.64 4.04 -0.34 1.54 -0.14 -0.01 -4.95 119.74 119.23 3fca s LYS 187 Ca 0.10 -0.29 -0.13 0.00 -1.36 0.00 0.00 55.97 54.29 3fca s LYS 187 Cb -0.11 -3.50 -0.02 0.00 -1.68 0.00 0.00 37.83 32.53 3fca s LYS 187 CO 0.00 0.06 0.24 0.42 -0.76 0.00 0.00 175.35 175.31 3fca s ILE 188 N 1.03 5.26 -0.22 2.17 -1.09 -1.26 -0.99 121.20 126.09 3fca s ILE 188 Ca 0.07 -0.20 -0.02 0.00 -2.23 0.00 0.00 60.65 58.26 3fca s ILE 188 Cb -0.14 -3.69 0.01 0.00 -1.58 0.00 0.00 42.46 37.06 3fca s ILE 188 CO 0.04 0.01 -0.07 -0.69 -1.23 0.00 0.00 174.94 172.99 3fca s VAL 189 N 1.72 2.98 0.17 2.92 1.01 0.23 -0.64 120.40 128.80 3fca s VAL 189 Ca 0.06 -0.76 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 3fca s VAL 189 Cb -0.17 -2.40 -0.08 0.00 0.00 0.00 0.00 36.38 33.73 3fca s VAL 189 CO 0.10 0.36 0.72 0.00 0.00 0.00 0.00 175.10 176.28 3fca s ALA 190 N 1.39 3.46 -0.03 5.51 0.00 -0.25 -1.16 121.76 130.68 3fca s ALA 190 Ca 0.04 0.21 0.06 0.00 0.00 0.00 0.00 51.96 52.27 3fca s ALA 190 Cb -0.15 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 3fca s ALA 190 CO -0.05 0.33 -0.19 0.08 0.00 0.00 0.00 175.76 175.93 3fca s VAL 191 N -1.31 2.69 0.11 0.00 1.01 -0.01 -1.35 120.40 121.54 3fca s VAL 191 Ca 0.38 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 3fca s VAL 191 Cb -0.20 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.17 3fca s VAL 191 CO 0.23 0.55 0.27 -1.83 0.00 0.00 0.00 175.10 174.32 3fca s GLU 192 N -0.79 0.96 0.32 2.72 -1.05 -0.75 -2.10 118.70 118.01 3fca s GLU 192 Ca 0.11 -0.90 -0.29 0.00 -0.15 0.00 0.00 54.97 53.74 3fca s GLU 192 Cb -0.10 0.39 -0.10 0.00 -0.44 0.00 0.00 34.13 33.88 3fca s GLU 192 CO 0.01 -0.34 1.21 -2.14 0.95 0.00 0.00 175.26 174.95 3fca s PRO 193 N -3.86 4.44 0.43 -4.83 0.02 -1.26 -1.74 135.00 128.20 3fca s PRO 193 Ca 0.06 2.01 0.12 0.00 0.02 0.00 0.00 61.00 63.21 3fca s PRO 193 Cb 0.04 -3.08 1.00 0.00 0.02 0.00 0.00 34.50 32.48 3fca s PRO 193 CO -0.10 -0.04 2.01 0.00 -0.33 0.00 0.00 177.00 178.54 3fca h ALA 194 N 3.48 1.94 0.00 -1.55 0.00 -1.57 -1.66 119.26 119.90 3fca h ALA 194 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3fca h ALA 194 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3fca h ALA 194 CO 0.66 -0.04 0.00 0.87 0.00 0.00 0.00 179.25 180.73 3fca h LYS 195 N 0.43 0.00 -1.89 0.00 1.57 -1.89 -3.35 116.57 111.44 3fca h LYS 195 Ca 0.24 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.53 3fca h LYS 195 Cb 0.38 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.30 3fca h LYS 195 CO -0.06 0.00 -1.14 0.45 -0.57 0.00 0.00 179.45 178.13 3fca n SER 196 N -2.79 0.51 -3.61 0.86 2.88 -0.65 -2.99 113.62 107.84 3fca n SER 196 Ca 0.02 -2.98 -0.41 0.00 -1.33 0.00 0.00 58.87 54.17 3fca n SER 196 Cb 0.31 -0.48 -0.00 0.00 -0.75 0.00 0.00 64.21 63.28 3fca n SER 196 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3fca n PRO 197 N 0.53 4.14 0.06 -1.46 -0.04 -1.08 -4.44 135.00 132.72 3fca n PRO 197 Ca 0.23 -3.37 -0.06 0.00 -0.04 0.00 0.00 63.50 60.26 3fca n PRO 197 Cb 0.64 -2.76 0.10 0.00 -0.04 0.00 0.00 33.50 31.43 3fca n PRO 197 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3fca h VAL 198 N 3.07 1.36 0.00 0.52 -1.51 -1.82 0.33 116.25 118.21 3fca h VAL 198 Ca 0.60 -1.90 -0.02 0.00 -1.23 0.00 0.00 66.70 64.15 3fca h VAL 198 Cb 0.42 1.92 -0.00 0.00 -2.13 0.00 0.00 31.29 31.50 3fca h VAL 198 CO 1.57 0.57 -0.09 -0.07 -1.23 0.00 0.00 177.57 178.32 3fca h LEU 199 N 0.26 0.00 -0.73 4.19 3.38 -1.88 -2.32 115.31 118.20 3fca h LEU 199 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fca h LEU 199 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3fca h LEU 199 CO 0.10 0.09 -0.03 -1.20 0.09 0.00 0.00 178.44 177.49 3fca n SER 200 N -3.22 1.17 0.00 -0.43 7.64 -1.05 -4.91 113.62 112.81 3fca n SER 200 Ca 0.00 -1.32 0.00 0.00 1.01 0.00 0.00 58.87 58.57 3fca n SER 200 Cb 0.36 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 3fca n SER 200 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fca n GLY 201 N 1.17 0.88 0.00 0.23 0.00 -0.87 -5.09 105.19 101.51 3fca n GLY 201 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3fca n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fca n GLY 202 N -2.06 1.71 3.89 -0.02 0.00 0.08 -4.98 105.19 103.81 3fca n GLY 202 Ca 0.00 -2.07 -0.35 0.00 0.00 0.00 0.00 46.02 43.60 3fca n GLY 202 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fca s GLN 203 N -0.74 3.52 0.46 1.61 -1.52 -1.26 -4.18 119.66 117.54 3fca s GLN 203 Ca 0.00 -0.16 -0.25 0.00 -1.95 0.00 0.00 55.36 53.01 3fca s GLN 203 Cb 0.00 -3.10 -0.08 0.00 -0.22 0.00 0.00 33.01 29.61 3fca s GLN 203 CO 0.00 0.68 1.40 -1.25 -0.25 0.00 0.00 175.29 175.86 3fca s PRO 204 N -1.70 3.63 0.16 2.91 0.04 -1.26 -3.75 135.00 135.03 3fca s PRO 204 Ca 0.26 2.35 -0.13 0.00 0.04 0.00 0.00 61.00 63.51 3fca s PRO 204 Cb -0.13 -2.60 0.01 0.00 0.04 0.00 0.00 34.50 31.82 3fca s PRO 204 CO 0.15 -0.83 0.38 0.20 0.04 0.00 0.00 177.00 176.94 3fca s GLY 205 N -0.62 0.13 0.24 0.56 0.00 -1.16 -4.92 107.32 101.55 3fca s GLY 205 Ca 0.62 -0.51 -0.30 0.00 0.00 0.00 0.00 44.72 44.54 3fca s GLY 205 CO 0.54 -0.55 1.18 0.54 0.00 0.00 0.00 173.10 174.81 3fca s LYS 206 N -3.90 4.52 0.20 2.90 3.01 -1.26 -4.47 119.74 120.74 3fca s LYS 206 Ca 0.11 1.91 -0.10 0.00 -1.01 0.00 0.00 55.97 56.89 3fca s LYS 206 Cb 0.02 -3.19 -0.01 0.00 -1.01 0.00 0.00 37.83 33.63 3fca s LYS 206 CO -0.03 -0.00 0.35 -3.38 0.51 0.00 0.00 175.35 172.79 3fca s HIS 207 N -0.62 0.45 -1.03 3.18 -3.43 -1.26 -4.82 115.29 107.75 3fca s HIS 207 Ca 0.49 -0.79 0.13 0.00 -0.80 0.00 0.00 55.06 54.09 3fca s HIS 207 Cb -0.34 -0.01 0.37 0.00 -1.43 0.00 0.00 32.58 31.17 3fca s HIS 207 CO 0.41 -0.81 1.31 0.00 -2.00 0.00 0.00 174.74 173.64 3fca n ALA 208 N -0.29 2.25 -2.74 -1.38 0.00 -1.26 -4.89 120.51 112.21 3fca n ALA 208 Ca -0.04 -1.22 -0.42 0.00 0.00 0.00 0.00 53.44 51.75 3fca n ALA 208 Cb 0.63 -0.52 -0.03 0.00 0.00 0.00 0.00 19.45 19.53 3fca n ALA 208 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3fca s ILE 209 N -1.09 4.25 0.24 0.00 1.01 -1.26 -4.98 121.20 119.37 3fca s ILE 209 Ca 0.28 -0.85 -0.31 0.00 0.00 0.00 0.00 60.65 59.77 3fca s ILE 209 Cb 0.15 -4.88 -0.14 0.00 0.01 0.00 0.00 42.46 37.60 3fca s ILE 209 CO 0.18 -1.70 1.30 1.67 0.00 0.00 0.00 174.94 176.39 3fca n GLN 210 N 7.91 1.75 0.00 2.79 -0.06 -1.26 -2.96 117.38 125.56 3fca n GLN 210 Ca 0.20 0.62 0.00 0.00 -2.00 0.00 0.00 57.00 55.82 3fca n GLN 210 Cb 0.49 -2.21 0.00 0.00 -4.06 0.00 0.00 30.24 24.47 3fca n GLN 210 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3fca n GLY 211 N 1.92 2.16 3.36 1.69 0.00 -1.26 -3.63 105.19 109.43 3fca n GLY 211 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 3fca n GLY 211 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fca s ILE 212 N -2.30 1.30 -0.42 -0.61 -4.36 -1.16 -4.04 121.20 109.62 3fca s ILE 212 Ca 0.00 -2.08 -0.01 0.00 -0.26 0.00 0.00 60.65 58.30 3fca s ILE 212 Cb 0.00 -2.34 0.00 0.00 1.25 0.00 0.00 42.46 41.37 3fca s ILE 212 CO 0.00 -0.36 0.41 0.61 0.24 0.00 0.00 174.94 175.85 3fca n GLY 213 N -0.46 -0.90 0.17 6.27 0.00 -0.71 -4.86 105.19 104.69 3fca n GLY 213 Ca -0.06 0.28 0.13 0.00 0.00 0.00 0.00 46.02 46.38 3fca n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fca h ALA 214 N 0.41 1.00 0.00 4.61 0.00 -1.80 -3.47 119.26 120.02 3fca h ALA 214 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fca h ALA 214 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3fca h ALA 214 CO 0.17 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.83 3fca n GLY 215 N 0.06 0.52 3.51 0.00 0.00 -1.26 -5.04 105.19 102.97 3fca n GLY 215 Ca 0.02 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.24 3fca n GLY 215 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3fca s PHE 216 N -2.00 0.76 -0.36 1.61 -0.12 -1.26 -4.68 117.98 111.93 3fca s PHE 216 Ca 0.00 -1.06 -0.16 0.00 -0.05 0.00 0.00 56.93 55.66 3fca s PHE 216 Cb 0.00 0.00 -0.00 0.00 -0.63 0.00 0.00 43.02 42.39 3fca s PHE 216 CO 0.00 -1.03 0.40 0.08 -0.05 0.00 0.00 175.22 174.61 3fca s VAL 217 N -3.55 5.13 0.42 -2.49 1.01 -1.26 -4.93 120.40 114.73 3fca s VAL 217 Ca 0.28 -0.03 -0.26 0.00 0.00 0.00 0.00 61.98 61.97 3fca s VAL 217 Cb 0.00 -3.89 -0.09 0.00 0.00 0.00 0.00 36.38 32.40 3fca s VAL 217 CO 0.14 -0.19 1.37 -2.84 0.00 0.00 0.00 175.10 173.58 3fca s PRO 218 N 2.08 3.85 0.33 2.72 0.02 -1.26 -4.91 135.00 137.84 3fca s PRO 218 Ca 0.12 2.29 0.09 0.00 0.02 0.00 0.00 61.00 63.52 3fca s PRO 218 Cb -0.17 -2.72 0.82 0.00 0.02 0.00 0.00 34.50 32.45 3fca s PRO 218 CO 0.12 -0.64 1.81 -0.22 -0.33 0.00 0.00 177.00 177.74 3fca h LYS 219 N 2.53 0.67 -0.00 5.54 1.63 -1.85 -2.38 116.57 122.71 3fca h LYS 219 Ca -0.50 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 3fca h LYS 219 Cb 1.25 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 3fca h LYS 219 CO 0.62 0.45 -0.06 0.44 -3.45 0.00 0.00 179.45 177.45 3fca n ILE 220 N -4.67 0.00 -2.02 2.00 -5.35 -1.09 -4.83 119.36 103.40 3fca n ILE 220 Ca 0.22 -0.04 -0.43 0.00 -0.27 0.00 0.00 62.75 62.23 3fca n ILE 220 Cb 0.58 -0.24 -0.03 0.00 -1.74 0.00 0.00 39.64 38.22 3fca n ILE 220 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 3fca s LEU 221 N -2.38 3.99 -0.94 7.28 2.96 -0.90 -4.80 118.68 123.88 3fca s LEU 221 Ca 0.33 1.84 -0.23 0.00 -0.22 0.00 0.00 54.13 55.84 3fca s LEU 221 Cb 0.21 -3.53 0.05 0.00 0.50 0.00 0.00 46.19 43.42 3fca s LEU 221 CO 0.44 -1.23 1.37 -0.62 -1.32 0.00 0.00 176.35 174.99 3fca s ASP 222 N 4.37 6.43 0.52 3.68 -1.08 -1.26 -4.84 116.67 124.49 3fca s ASP 222 Ca 0.75 -1.28 0.29 0.00 -0.52 0.00 0.00 52.55 51.79 3fca s ASP 222 Cb -0.28 -2.55 1.38 0.00 -1.46 0.00 0.00 42.92 40.01 3fca s ASP 222 CO 0.30 -1.53 2.02 0.03 0.52 0.00 0.00 175.17 176.51 3fca h ARG 223 N 9.75 0.00 0.00 4.34 3.08 -1.96 -2.88 114.38 126.70 3fca h ARG 223 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3fca h ARG 223 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.07 3fca h ARG 223 CO 1.36 0.12 0.00 0.66 -1.07 0.00 0.00 179.97 181.04 3fca h SER 224 N 0.00 0.00 -0.02 7.04 4.64 -2.02 -2.76 113.55 120.43 3fca h SER 224 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fca h SER 224 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3fca h SER 224 CO 0.02 0.00 -0.35 1.33 -0.87 0.00 0.00 176.83 176.95 3fca n VAL 225 N -2.34 0.00 -3.64 0.95 0.24 -1.09 -4.95 118.33 107.50 3fca n VAL 225 Ca 0.01 -0.32 -0.36 0.00 -2.04 0.00 0.00 64.34 61.62 3fca n VAL 225 Cb 0.18 1.28 -0.09 0.00 -1.47 0.00 0.00 33.84 33.74 3fca n VAL 225 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3fca s ILE 226 N -2.21 5.35 -0.13 1.34 1.01 -1.04 -4.52 121.20 120.99 3fca s ILE 226 Ca 0.18 0.25 0.06 0.00 0.00 0.00 0.00 60.65 61.14 3fca s ILE 226 Cb 0.17 -3.52 -0.23 0.00 0.01 0.00 0.00 42.46 38.88 3fca s ILE 226 CO 0.48 0.35 0.32 0.47 0.00 0.00 0.00 174.94 176.55 3fca n ASP 227 N 4.17 1.24 -3.58 3.58 8.00 0.19 -4.99 116.55 125.17 3fca n ASP 227 Ca -0.14 0.19 -0.11 0.00 0.71 0.00 0.00 54.79 55.43 3fca n ASP 227 Cb 0.52 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 3fca n ASP 227 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3fca s GLU 228 N -2.55 1.24 -0.04 -1.24 -1.05 -1.12 -5.01 118.70 108.92 3fca s GLU 228 Ca -0.16 -0.65 0.06 0.00 -0.15 0.00 0.00 54.97 54.07 3fca s GLU 228 Cb 0.07 0.53 -0.02 0.00 -0.44 0.00 0.00 34.13 34.28 3fca s GLU 228 CO 0.77 -0.52 -0.21 0.08 0.95 0.00 0.00 175.26 176.33 3fca s VAL 229 N -3.80 2.42 0.02 1.83 1.01 -1.26 -1.09 120.40 119.53 3fca s VAL 229 Ca 0.04 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.12 3fca s VAL 229 Cb -0.00 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 3fca s VAL 229 CO -0.10 0.58 -0.16 -0.51 0.00 0.00 0.00 175.10 174.90 3fca s ILE 230 N -0.49 1.30 0.13 2.22 2.07 -0.46 -4.97 121.20 121.02 3fca s ILE 230 Ca 0.06 -0.94 0.04 0.00 -1.41 0.00 0.00 60.65 58.40 3fca s ILE 230 Cb -0.11 -1.13 -0.04 0.00 0.13 0.00 0.00 42.46 41.31 3fca s ILE 230 CO 0.01 0.17 0.14 0.42 -1.91 0.00 0.00 174.94 173.78 3fca s THR 231 N -0.67 4.65 -0.02 4.00 -4.23 -1.26 -1.81 115.64 116.29 3fca s THR 231 Ca 0.05 -0.91 0.02 0.00 -1.18 0.00 0.00 61.69 59.66 3fca s THR 231 Cb -0.07 -3.34 0.01 0.00 1.34 0.00 0.00 72.50 70.44 3fca s THR 231 CO 0.01 -0.03 -0.05 -0.69 -0.54 0.00 0.00 174.62 173.31 3fca s VAL 232 N -1.64 0.48 0.50 2.29 1.01 -0.71 -4.85 120.40 117.47 3fca s VAL 232 Ca 0.31 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 3fca s VAL 232 Cb -0.11 -0.45 -0.08 0.00 0.00 0.00 0.00 36.38 35.74 3fca s VAL 232 CO 0.24 0.17 1.00 -1.61 0.00 0.00 0.00 175.10 174.89 3fca s GLU 233 N 0.28 3.89 0.23 2.72 0.41 -1.26 -1.42 118.70 123.55 3fca s GLU 233 Ca -0.03 1.12 -0.06 0.00 -0.41 0.00 0.00 54.97 55.59 3fca s GLU 233 Cb -0.07 -2.12 0.39 0.00 -1.78 0.00 0.00 34.13 30.55 3fca s GLU 233 CO -0.00 -0.33 1.74 -0.44 -0.49 0.00 0.00 175.26 175.74 3fca h ASP 234 N 1.23 0.30 0.84 -0.19 5.19 -1.99 -1.77 116.42 120.02 3fca h ASP 234 Ca -0.48 0.09 -0.08 0.00 -0.62 0.00 0.00 57.03 55.95 3fca h ASP 234 Cb 1.20 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.76 3fca h ASP 234 CO 0.60 0.14 -0.36 -0.33 -3.12 0.00 0.00 179.24 176.17 3fca h GLU 235 N 0.46 0.00 -0.30 3.56 4.39 -1.99 -2.11 114.58 118.59 3fca h GLU 235 Ca 0.38 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 3fca h GLU 235 Cb 0.52 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 3fca h GLU 235 CO -0.36 0.36 0.18 0.93 -1.16 0.00 0.00 179.01 178.97 3fca h GLU 236 N 0.00 0.41 0.11 2.33 5.08 -1.71 -1.55 114.58 119.24 3fca h GLU 236 Ca -0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3fca h GLU 236 Cb 0.88 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3fca h GLU 236 CO 0.05 0.31 -0.05 0.00 -1.00 0.00 0.00 179.01 178.32 3fca h ALA 237 N 1.08 -0.14 -0.64 3.43 0.00 -1.14 -1.60 119.26 120.25 3fca h ALA 237 Ca 0.11 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3fca h ALA 237 Cb 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3fca h ALA 237 CO -0.02 -0.58 0.17 1.88 0.00 0.00 0.00 179.25 180.70 3fca h TYR 238 N -0.15 1.07 -0.59 0.00 -1.99 -1.40 -1.41 116.97 112.49 3fca h TYR 238 Ca -0.01 -0.12 -0.04 0.00 2.00 0.00 0.00 58.73 60.55 3fca h TYR 238 Cb 0.12 -0.30 -0.03 0.00 2.00 0.00 0.00 36.73 38.52 3fca h TYR 238 CO -0.07 0.88 0.20 1.49 -0.00 0.00 0.00 178.16 180.66 3fca h GLU 239 N 0.94 0.90 -0.30 4.88 4.81 -1.24 -1.81 114.58 122.77 3fca h GLU 239 Ca 0.20 -0.18 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 3fca h GLU 239 Cb 0.34 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 3fca h GLU 239 CO -0.00 0.79 -0.50 1.98 -0.73 0.00 0.00 179.01 180.56 3fca h MET 240 N 0.82 0.82 -0.89 1.92 4.05 -1.19 -1.10 114.93 119.36 3fca h MET 240 Ca 0.19 -0.49 0.05 0.00 -0.28 0.00 0.00 59.70 59.17 3fca h MET 240 Cb 0.25 0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.04 3fca h MET 240 CO -0.01 1.12 0.57 0.00 0.23 0.00 0.00 176.91 178.82 3fca h ALA 241 N 0.79 1.20 -0.45 0.39 0.00 -1.14 0.55 119.26 120.61 3fca h ALA 241 Ca 0.03 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3fca h ALA 241 Cb 1.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3fca h ALA 241 CO 0.11 0.38 -0.14 0.00 0.00 0.00 0.00 179.25 179.60 3fca h ARG 242 N 1.07 0.89 -0.63 0.00 3.08 -1.15 -2.84 114.38 114.80 3fca h ARG 242 Ca 0.37 -0.35 -0.08 0.00 0.07 0.00 0.00 59.98 59.99 3fca h ARG 242 Cb 0.08 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3fca h ARG 242 CO -0.14 1.00 0.09 -0.92 -1.07 0.00 0.00 179.97 178.93 3fca h TYR 243 N 0.72 1.12 -0.50 3.04 3.20 -0.76 -1.08 116.97 122.72 3fca h TYR 243 Ca 0.11 -0.16 0.04 0.00 3.14 0.00 0.00 58.73 61.86 3fca h TYR 243 Cb 0.69 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.61 3fca h TYR 243 CO 0.05 0.96 0.26 -0.07 -1.64 0.00 0.00 178.16 177.72 3fca h LEU 244 N 0.97 0.37 -0.16 2.82 3.38 -0.85 0.25 115.31 122.09 3fca h LEU 244 Ca 0.19 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3fca h LEU 244 Cb 0.45 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3fca h LEU 244 CO 0.01 0.26 0.10 0.00 0.09 0.00 0.00 178.44 178.91 3fca h ALA 245 N 1.27 0.20 -0.22 1.53 0.00 -1.25 -1.24 119.26 119.55 3fca h ALA 245 Ca 0.22 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 3fca h ALA 245 Cb 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3fca h ALA 245 CO -0.15 -0.32 -0.40 -0.22 0.00 0.00 0.00 179.25 178.16 3fca h LYS 246 N 0.21 0.66 0.00 0.00 3.11 -0.66 -2.45 116.57 117.44 3fca h LYS 246 Ca 0.06 -0.42 0.00 0.00 -2.81 0.00 0.00 60.65 57.48 3fca h LYS 246 Cb -0.02 0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.26 3fca h LYS 246 CO -0.02 1.03 -1.50 1.63 -2.81 0.00 0.00 179.45 177.79 3fca n LYS 247 N -4.22 0.81 -0.00 1.90 4.76 0.83 -4.51 118.16 117.73 3fca n LYS 247 Ca -0.05 -0.11 0.03 0.00 -2.87 0.00 0.00 58.31 55.31 3fca n LYS 247 Cb 0.54 -1.34 -0.04 0.00 -1.84 0.00 0.00 35.03 32.35 3fca n LYS 247 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3fca n GLU 248 N -1.89 3.10 -1.62 1.97 -0.58 -0.52 -4.80 120.64 116.30 3fca n GLU 248 Ca -0.02 -0.02 -0.09 0.00 -0.42 0.00 0.00 57.16 56.61 3fca n GLU 248 Cb 0.37 -0.94 -0.02 0.00 -0.57 0.00 0.00 31.44 30.28 3fca n GLU 248 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fca n GLY 249 N 1.52 0.62 3.37 0.62 0.00 -0.90 -4.99 105.19 105.44 3fca n GLY 249 Ca 0.00 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 3fca n GLY 249 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fca s LEU 250 N -2.18 4.87 -1.32 0.99 1.43 -0.94 -4.94 118.68 116.59 3fca s LEU 250 Ca 0.00 -1.06 -0.17 0.00 -1.03 0.00 0.00 54.13 51.87 3fca s LEU 250 Cb 0.00 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.22 3fca s LEU 250 CO 0.00 -0.43 1.88 0.18 0.23 0.00 0.00 176.35 178.22 3fca n LEU 251 N 5.02 5.32 -4.75 1.79 4.77 -1.26 -2.62 117.00 125.27 3fca n LEU 251 Ca -0.12 -3.92 -0.25 0.00 -0.03 0.00 0.00 56.01 51.69 3fca n LEU 251 Cb 0.46 -1.71 -0.06 0.00 -2.33 0.00 0.00 43.42 39.77 3fca n LEU 251 CO 0.38 0.28 -0.25 0.68 -1.33 0.00 0.00 177.39 177.15 3fca s VAL 252 N 4.34 4.19 0.16 4.08 -7.23 -1.26 -1.45 120.40 123.22 3fca s VAL 252 Ca 0.53 -1.28 -0.03 0.00 -1.81 0.00 0.00 61.98 59.39 3fca s VAL 252 Cb 0.07 -3.15 0.04 0.00 0.56 0.00 0.00 36.38 33.89 3fca s VAL 252 CO 0.04 -0.16 0.21 0.61 -0.31 0.00 0.00 175.10 175.49 3fca n GLY 253 N -0.43 -1.17 0.23 2.32 0.00 -0.39 -3.53 105.19 102.23 3fca n GLY 253 Ca -0.09 -1.68 -0.11 0.00 0.00 0.00 0.00 46.02 44.15 3fca n GLY 253 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3fca h ILE 254 N -1.11 1.27 0.00 -0.61 2.04 -1.89 -2.71 117.51 114.49 3fca h ILE 254 Ca -0.07 -1.17 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 3fca h ILE 254 Cb 0.19 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 3fca h ILE 254 CO 0.05 0.39 -0.16 0.77 0.00 0.00 0.00 178.15 179.20 3fca h SER 255 N 0.60 0.00 -0.40 1.72 4.64 -1.92 -2.06 113.55 116.12 3fca h SER 255 Ca 0.11 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.29 3fca h SER 255 Cb 0.60 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 3fca h SER 255 CO 0.04 0.16 -0.27 0.28 -0.87 0.00 0.00 176.83 176.16 3fca h SER 256 N 0.00 0.94 -0.79 4.97 0.02 -1.76 -0.16 113.55 116.78 3fca h SER 256 Ca -0.00 -0.43 -0.02 0.00 -0.84 0.00 0.00 61.79 60.50 3fca h SER 256 Cb 0.32 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.56 3fca h SER 256 CO 0.02 1.17 0.41 1.23 -1.14 0.00 0.00 176.83 178.52 3fca h GLY 257 N 0.72 1.19 0.96 -3.77 0.00 -1.25 -0.80 103.07 100.11 3fca h GLY 257 Ca 0.08 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.85 3fca h GLY 257 CO 0.07 0.54 0.01 0.00 0.00 0.00 0.00 176.54 177.16 3fca h ALA 258 N 1.21 0.04 -0.40 3.60 0.00 -1.22 0.16 119.26 122.66 3fca h ALA 258 Ca 0.27 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3fca h ALA 258 Cb 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3fca h ALA 258 CO -0.04 -0.47 0.25 -0.91 0.00 0.00 0.00 179.25 178.07 3fca h ASN 259 N 0.03 0.41 -0.05 0.00 2.35 -0.90 -1.18 115.58 116.25 3fca h ASN 259 Ca 0.02 -0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.59 3fca h ASN 259 Cb 0.01 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 3fca h ASN 259 CO -0.02 0.29 -0.57 0.58 -1.65 0.00 0.00 177.43 176.06 3fca h VAL 260 N 0.50 1.31 -0.30 2.81 2.07 -1.06 0.11 116.25 121.68 3fca h VAL 260 Ca 0.15 -1.81 0.04 0.00 0.82 0.00 0.00 66.70 65.90 3fca h VAL 260 Cb -0.02 1.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 3fca h VAL 260 CO -0.06 0.57 0.08 0.00 0.02 0.00 0.00 177.57 178.19 3fca h ALA 261 N 0.87 0.33 0.11 1.67 0.00 -0.53 0.71 119.26 122.43 3fca h ALA 261 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3fca h ALA 261 Cb 1.14 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3fca h ALA 261 CO 0.11 -0.32 -0.05 0.00 0.00 0.00 0.00 179.25 178.99 3fca h ALA 262 N 1.21 -0.15 -0.79 0.00 0.00 -1.05 -2.57 119.26 115.91 3fca h ALA 262 Ca 0.14 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.11 3fca h ALA 262 Cb 0.13 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3fca h ALA 262 CO -0.16 -0.58 0.51 0.00 0.00 0.00 0.00 179.25 179.03 3fca h ALA 263 N 0.73 1.80 -0.41 0.00 0.00 -0.52 -0.45 119.26 120.42 3fca h ALA 263 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3fca h ALA 263 Cb 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3fca h ALA 263 CO 0.02 0.03 0.22 1.25 0.00 0.00 0.00 179.25 180.77 3fca h LEU 264 N 0.69 0.52 -0.89 0.00 5.85 -0.66 0.14 115.31 120.96 3fca h LEU 264 Ca 0.37 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 3fca h LEU 264 Cb 0.49 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 3fca h LEU 264 CO -0.14 0.47 0.52 0.11 -0.34 0.00 0.00 178.44 179.06 3fca h LYS 265 N 0.53 1.23 0.22 1.25 1.57 -0.78 -2.04 116.57 118.55 3fca h LYS 265 Ca 0.14 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3fca h LYS 265 Cb 0.08 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.14 3fca h LYS 265 CO -0.02 0.88 -0.11 0.28 -0.57 0.00 0.00 179.45 179.91 3fca h VAL 266 N 1.24 0.83 -0.85 0.50 2.07 -0.92 -3.25 116.25 115.87 3fca h VAL 266 Ca 0.32 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.61 3fca h VAL 266 Cb -0.02 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 3fca h VAL 266 CO -0.06 0.07 0.55 0.00 0.02 0.00 0.00 177.57 178.15 3fca h ALA 267 N 0.30 1.55 0.00 1.67 0.00 -0.44 -2.05 119.26 120.28 3fca h ALA 267 Ca -0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3fca h ALA 267 Cb 0.34 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3fca h ALA 267 CO 0.05 0.33 -0.15 1.96 0.00 0.00 0.00 179.25 181.44 3fca h GLN 268 N 0.96 0.00 -0.01 0.00 4.20 -1.41 -1.23 115.11 117.62 3fca h GLN 268 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 3fca h GLN 268 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3fca h GLN 268 CO -0.13 0.15 -0.03 1.63 -0.67 0.00 0.00 178.83 179.79 3fca n LYS 269 N -3.62 1.21 -4.15 1.46 4.76 -0.77 -4.92 118.16 112.12 3fca n LYS 269 Ca -0.01 -0.46 -0.25 0.00 -2.87 0.00 0.00 58.31 54.72 3fca n LYS 269 Cb 0.28 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 31.91 3fca n LYS 269 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3fca s LEU 270 N -2.11 3.08 1.21 -0.35 1.43 -0.47 -5.14 118.68 116.33 3fca s LEU 270 Ca 0.39 -1.11 -0.15 0.00 -1.03 0.00 0.00 54.13 52.24 3fca s LEU 270 Cb 0.21 -1.39 0.30 0.00 0.03 0.00 0.00 46.19 45.33 3fca s LEU 270 CO 0.38 -0.57 1.01 -0.83 0.23 0.00 0.00 176.35 176.58 3fca s GLY 271 N -3.91 1.52 0.48 -3.19 0.00 -1.26 -4.91 107.32 96.04 3fca s GLY 271 Ca 0.40 -0.32 0.21 0.00 0.00 0.00 0.00 44.72 45.01 3fca s GLY 271 CO 0.22 0.46 2.01 -0.56 0.00 0.00 0.00 173.10 175.23 3fca h PRO 272 N -2.74 0.00 -0.60 2.90 0.13 -2.00 -2.95 132.00 126.74 3fca h PRO 272 Ca -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 3fca h PRO 272 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 3fca h PRO 272 CO 0.48 0.18 0.00 -0.25 -0.23 0.00 0.00 178.00 178.17 3fca n ASP 273 N -3.92 4.44 -4.74 1.44 8.00 -1.26 -4.91 116.55 115.61 3fca n ASP 273 Ca -0.02 -2.39 -0.37 0.00 0.71 0.00 0.00 54.79 52.71 3fca n ASP 273 Cb 0.27 -0.53 0.06 0.00 -0.02 0.00 0.00 41.12 40.90 3fca n ASP 273 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fca n ALA 274 N 1.02 1.31 -4.00 2.24 0.00 -1.12 -5.02 120.51 114.93 3fca n ALA 274 Ca 0.24 0.04 -0.31 0.00 0.00 0.00 0.00 53.44 53.41 3fca n ALA 274 Cb 0.82 -2.34 -0.16 0.00 0.00 0.00 0.00 19.45 17.77 3fca n ALA 274 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3fca s ARG 275 N -3.24 1.97 -0.09 0.00 0.52 -1.26 -4.68 118.95 112.17 3fca s ARG 275 Ca 0.80 -1.05 0.04 0.00 -0.52 0.00 0.00 55.73 55.00 3fca s ARG 275 Cb -0.39 -2.63 -0.01 0.00 0.52 0.00 0.00 34.95 32.44 3fca s ARG 275 CO 0.43 -0.53 -0.21 0.08 0.02 0.00 0.00 175.30 175.09 3fca s VAL 276 N 1.30 2.34 0.04 3.52 1.01 -0.50 -0.48 120.40 127.63 3fca s VAL 276 Ca -0.05 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.08 3fca s VAL 276 Cb -0.18 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 3fca s VAL 276 CO -0.07 0.56 -0.26 -0.69 0.00 0.00 0.00 175.10 174.64 3fca s VAL 277 N 0.08 2.08 0.31 2.92 1.01 -0.60 -4.25 120.40 121.96 3fca s VAL 277 Ca -0.09 -1.34 -0.02 0.00 0.00 0.00 0.00 61.98 60.52 3fca s VAL 277 Cb -0.15 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 3fca s VAL 277 CO 0.06 0.38 0.41 0.28 0.00 0.00 0.00 175.10 176.22 3fca s THR 278 N -0.78 0.00 -0.04 3.92 -1.32 -1.26 -1.52 115.64 114.64 3fca s THR 278 Ca 0.11 -1.68 0.05 0.00 -1.21 0.00 0.00 61.69 58.96 3fca s THR 278 Cb -0.10 -2.54 -0.03 0.00 -1.51 0.00 0.00 72.50 68.32 3fca s THR 278 CO 0.02 0.00 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.57 3fca s VAL 279 N -3.37 2.90 -0.65 5.08 1.01 -1.26 -0.79 120.40 123.31 3fca s VAL 279 Ca 0.32 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 3fca s VAL 279 Cb 0.01 -2.13 0.17 0.00 0.00 0.00 0.00 36.38 34.43 3fca s VAL 279 CO 0.19 0.57 0.55 0.00 0.00 0.00 0.00 175.10 176.40 3fca s ALA 280 N -0.73 3.73 0.35 5.51 0.00 0.89 -4.67 121.76 126.83 3fca s ALA 280 Ca 0.12 -3.01 0.04 0.00 0.00 0.00 0.00 51.96 49.11 3fca s ALA 280 Cb -0.10 -3.10 0.69 0.00 0.00 0.00 0.00 23.12 20.61 3fca s ALA 280 CO 0.01 -2.11 1.97 -1.35 0.00 0.00 0.00 175.76 174.28 3fca h PRO 281 N 7.90 0.78 0.00 0.00 0.11 -1.89 -1.85 132.00 137.05 3fca h PRO 281 Ca -0.05 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.95 3fca h PRO 281 Cb 1.03 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 3fca h PRO 281 CO 0.81 0.52 -0.00 -0.40 -0.21 0.00 0.00 178.00 178.71 3fca n ASP 282 N -4.47 -0.45 -4.68 -2.05 5.75 -1.26 -0.45 116.55 108.94 3fca n ASP 282 Ca 0.10 -1.49 -0.25 0.00 -0.01 0.00 0.00 54.79 53.14 3fca n ASP 282 Cb 0.17 0.80 -0.07 0.00 -1.03 0.00 0.00 41.12 40.99 3fca n ASP 282 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 3fca s HIS 283 N -5.30 2.85 0.40 2.11 -3.43 -1.25 -1.26 115.29 109.42 3fca s HIS 283 Ca 0.07 -0.14 0.09 0.00 -0.80 0.00 0.00 55.06 54.27 3fca s HIS 283 Cb -0.01 -1.35 0.85 0.00 -1.43 0.00 0.00 32.58 30.64 3fca s HIS 283 CO 0.05 0.54 1.98 0.00 -2.00 0.00 0.00 174.74 175.30 3fca h ALA 284 N 2.43 1.61 0.00 -1.38 0.00 -1.29 -3.09 119.26 117.54 3fca h ALA 284 Ca -0.47 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3fca h ALA 284 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3fca h ALA 284 CO 0.59 0.29 0.00 0.39 0.00 0.00 0.00 179.25 180.52 3fca n GLU 285 N -4.36 0.52 0.00 0.00 1.02 -1.26 -0.40 120.64 116.15 3fca n GLU 285 Ca 0.00 0.04 0.14 0.00 -0.02 0.00 0.00 57.16 57.32 3fca n GLU 285 Cb 0.19 -1.50 0.52 0.00 -0.02 0.00 0.00 31.44 30.63 3fca n GLU 285 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3fca n ARG 286 N -1.15 0.46 -1.42 3.49 0.63 -1.17 -4.28 116.66 113.22 3fca n ARG 286 Ca 0.14 -0.17 0.04 0.00 -0.92 0.00 0.00 57.85 56.93 3fca n ARG 286 Cb 0.13 -1.50 0.06 0.00 0.45 0.00 0.00 32.46 31.61 3fca n ARG 286 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3fca n TYR 287 N -1.12 0.15 0.28 -0.14 4.01 0.46 -4.88 117.16 115.93 3fca n TYR 287 Ca 0.11 -0.86 0.13 0.00 -0.16 0.00 0.00 57.90 57.12 3fca n TYR 287 Cb 0.30 -0.18 0.82 0.00 -0.31 0.00 0.00 39.34 39.97 3fca n TYR 287 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3fca h LEU 288 N 1.14 0.00 -0.63 7.72 3.38 -1.74 -0.38 115.31 124.79 3fca h LEU 288 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3fca h LEU 288 Cb 1.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.41 3fca h LEU 288 CO 0.10 0.01 -0.15 -1.54 0.09 0.00 0.00 178.44 176.94 3fca n SER 289 N -4.08 1.14 0.00 -0.43 3.41 -1.26 -4.38 113.62 108.01 3fca n SER 289 Ca -0.03 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 3fca n SER 289 Cb 0.09 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 3fca n SER 289 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3fca n ILE 290 N -0.39 0.00 1.61 -1.33 -5.35 -0.86 -5.26 119.36 107.78 3fca n ILE 290 Ca 0.15 0.00 0.14 0.00 -0.27 0.00 0.00 62.75 62.77 3fca n ILE 290 Cb 0.34 0.01 0.62 0.00 -1.74 0.00 0.00 39.64 38.87 3fca n ILE 290 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68