#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cla n ASN 7 N 0.00 1.68 -4.01 7.83 2.04 -1.26 -4.83 115.26 116.70 2cla n ASN 7 Ca 0.00 -2.08 -0.10 0.00 -0.44 0.00 0.00 54.58 51.96 2cla n ASN 7 Cb 0.00 -0.52 -0.08 0.00 -2.53 0.00 0.00 39.78 36.65 2cla n ASN 7 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 2cla s TYR 8 N -0.97 0.53 -0.08 -2.53 -0.85 -1.26 0.59 117.35 112.78 2cla s TYR 8 Ca 0.04 -0.90 0.05 0.00 -0.52 0.00 0.00 57.07 55.74 2cla s TYR 8 Cb 0.03 -0.18 -0.01 0.00 0.38 0.00 0.00 41.96 42.18 2cla s TYR 8 CO 0.01 -0.66 -0.24 0.95 -1.52 0.00 0.00 175.55 174.09 2cla s THR 9 N -3.99 2.09 -0.05 -3.49 -4.23 -0.23 -4.89 115.64 100.84 2cla s THR 9 Ca 0.19 -1.03 -0.30 0.00 -1.18 0.00 0.00 61.69 59.37 2cla s THR 9 Cb 0.05 -1.77 -0.04 0.00 1.34 0.00 0.00 72.50 72.07 2cla s THR 9 CO 0.00 0.56 1.31 -0.54 -0.54 0.00 0.00 174.62 175.42 2cla s LYS 10 N 0.08 4.29 -0.01 3.99 -0.14 -1.26 -2.24 119.74 124.45 2cla s LYS 10 Ca -0.11 1.81 -0.29 0.00 -1.36 0.00 0.00 55.97 56.02 2cla s LYS 10 Cb -0.16 -3.63 -0.03 0.00 -1.68 0.00 0.00 37.83 32.34 2cla s LYS 10 CO 0.06 -0.57 0.96 0.12 -0.76 0.00 0.00 175.35 175.16 2cla s PHE 11 N 2.62 3.64 -0.98 3.18 5.36 -0.10 -4.95 117.98 126.75 2cla s PHE 11 Ca 0.60 1.66 -0.24 0.00 -0.96 0.00 0.00 56.93 57.98 2cla s PHE 11 Cb -0.27 -3.10 -0.06 0.00 -0.34 0.00 0.00 43.02 39.25 2cla s PHE 11 CO 0.23 -0.02 1.96 -0.51 -1.46 0.00 0.00 175.22 175.43 2cla s ASP 12 N 1.00 5.04 0.10 6.13 1.01 -1.26 -4.72 116.67 123.97 2cla s ASP 12 Ca 0.51 -0.92 0.23 0.00 0.71 0.00 0.00 52.55 53.07 2cla s ASP 12 Cb -0.21 -2.57 0.08 0.00 1.01 0.00 0.00 42.92 41.24 2cla s ASP 12 CO 0.27 -2.91 1.07 0.55 0.21 0.00 0.00 175.17 174.35 2cla n VAL 13 N 7.91 0.32 -0.18 -1.27 3.14 -1.26 -2.32 118.33 124.67 2cla n VAL 13 Ca 0.42 -0.35 -0.08 0.00 -2.96 0.00 0.00 64.34 61.37 2cla n VAL 13 Cb 0.47 -0.03 0.02 0.00 -1.06 0.00 0.00 33.84 33.23 2cla n VAL 13 CO 0.00 0.00 0.00 0.07 -6.46 0.00 0.00 176.83 170.44 2cla h LYS 14 N 0.00 0.77 -0.02 1.45 2.10 -2.03 -3.00 116.57 115.85 2cla h LYS 14 Ca 0.00 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2cla h LYS 14 Cb 0.82 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 2cla h LYS 14 CO 0.00 0.66 -0.28 0.27 -2.00 0.00 0.00 179.45 178.10 2cla n ASN 15 N -4.55 2.37 -4.74 7.07 0.23 -1.25 -5.02 115.26 109.36 2cla n ASN 15 Ca 0.02 -1.69 -0.41 0.00 -0.53 0.00 0.00 54.58 51.98 2cla n ASN 15 Cb 0.14 0.28 -0.04 0.00 -2.08 0.00 0.00 39.78 38.09 2cla n ASN 15 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 2cla s TRP 16 N -2.29 3.47 0.38 -2.53 -0.00 -0.98 -4.93 118.94 112.07 2cla s TRP 16 Ca 0.23 1.52 0.20 0.00 -0.00 0.00 0.00 56.10 58.05 2cla s TRP 16 Cb 0.19 -3.38 1.10 0.00 -0.00 0.00 0.00 33.47 31.38 2cla s TRP 16 CO 0.46 -0.98 1.96 -0.39 -0.00 0.00 0.00 176.95 178.01 2cla h VAL 17 N 3.56 0.88 -0.50 5.86 -1.51 -1.91 -2.64 116.25 119.99 2cla h VAL 17 Ca -0.45 -0.84 -0.01 0.00 -1.23 0.00 0.00 66.70 64.17 2cla h VAL 17 Cb 1.21 1.49 -0.01 0.00 -2.13 0.00 0.00 31.29 31.86 2cla h VAL 17 CO 0.72 0.21 0.02 0.54 -1.23 0.00 0.00 177.57 177.83 2cla n ARG 18 N -3.87 4.22 -0.04 5.19 1.74 -1.26 -4.62 116.66 118.02 2cla n ARG 18 Ca -0.02 -2.65 -0.08 0.00 -0.77 0.00 0.00 57.85 54.33 2cla n ARG 18 Cb 0.31 -2.15 -0.03 0.00 -1.02 0.00 0.00 32.46 29.58 2cla n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cla h ARG 19 N 3.28 0.01 -0.53 5.56 2.47 -1.77 -0.68 114.38 122.73 2cla h ARG 19 Ca 0.02 -0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.69 2cla h ARG 19 Cb 1.78 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 30.07 2cla h ARG 19 CO 0.43 0.01 0.14 1.49 0.56 0.00 0.00 179.97 182.60 2cla h GLU 20 N 0.02 0.84 -0.18 0.04 4.81 -1.85 -2.71 114.58 115.55 2cla h GLU 20 Ca 0.10 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2cla h GLU 20 Cb 0.15 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2cla h GLU 20 CO -0.20 0.79 0.10 0.45 -0.73 0.00 0.00 179.01 179.42 2cla h HIS 21 N 0.74 0.19 0.03 0.92 3.86 -1.83 -1.46 115.15 117.59 2cla h HIS 21 Ca 0.17 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.40 2cla h HIS 21 Cb 0.32 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.72 2cla h HIS 21 CO 0.02 0.11 -0.09 0.35 0.86 0.00 0.00 177.93 179.18 2cla h PHE 22 N 0.21 -0.23 -0.15 2.45 3.04 -1.09 -1.65 116.94 119.52 2cla h PHE 22 Ca 0.07 0.01 -0.11 0.00 3.98 0.00 0.00 57.97 61.92 2cla h PHE 22 Cb -0.00 0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.60 2cla h PHE 22 CO -0.08 -0.14 -0.38 1.49 -2.02 0.00 0.00 178.31 177.18 2cla h GLU 23 N -0.17 0.33 0.36 1.11 4.57 -1.41 -1.20 114.58 118.17 2cla h GLU 23 Ca 0.03 -0.15 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2cla h GLU 23 Cb 0.20 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 2cla h GLU 23 CO -0.07 0.67 -0.17 0.35 -1.18 0.00 0.00 179.01 178.60 2cla h PHE 24 N 0.28 -0.45 0.00 0.92 3.04 -0.93 0.72 116.94 120.52 2cla h PHE 24 Ca 0.03 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2cla h PHE 24 Cb 0.80 0.15 0.00 0.00 2.56 0.00 0.00 35.95 39.46 2cla h PHE 24 CO 0.02 -0.20 0.00 0.66 -2.02 0.00 0.00 178.31 176.76 2cla n TYR 25 N -5.25 0.00 -0.04 0.41 4.01 -0.65 -0.37 117.16 115.27 2cla n TYR 25 Ca -0.10 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.44 2cla n TYR 25 Cb 0.24 -0.44 -0.13 0.00 -0.31 0.00 0.00 39.34 38.70 2cla n TYR 25 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2cla n ARG 26 N -1.44 0.72 0.00 -0.72 0.63 -0.46 -2.48 116.66 112.91 2cla n ARG 26 Ca 0.08 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 2cla n ARG 26 Cb 0.27 -1.65 0.00 0.00 0.45 0.00 0.00 32.46 31.53 2cla n ARG 26 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2cla n HIS 27 N -3.36 0.00 0.18 -0.14 8.25 0.24 -4.55 115.22 115.84 2cla n HIS 27 Ca -0.35 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 56.99 2cla n HIS 27 Cb 1.03 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 32.08 2cla n HIS 27 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cla h ARG 28 N 0.00 -0.49 -2.49 -0.41 -0.00 -0.66 -3.39 114.38 106.93 2cla h ARG 28 Ca 0.00 0.03 -0.60 0.00 -0.50 0.00 0.00 59.98 58.92 2cla h ARG 28 Cb 0.68 0.11 -0.39 0.00 0.00 0.00 0.00 29.97 30.37 2cla h ARG 28 CO 0.00 -0.20 -0.90 -0.11 0.00 0.00 0.00 179.97 178.75 2cla n LEU 29 N -5.13 0.20 -4.66 3.04 7.94 0.50 -5.02 117.00 113.86 2cla n LEU 29 Ca -0.09 -4.54 -0.49 0.00 -1.11 0.00 0.00 56.01 49.78 2cla n LEU 29 Cb 0.27 0.30 -0.05 0.00 0.53 0.00 0.00 43.42 44.46 2cla n LEU 29 CO 0.24 1.84 1.24 -2.65 -1.11 0.00 0.00 177.39 176.96 2cla n PRO 30 N 2.64 1.84 -3.62 1.96 -0.02 -1.25 -4.33 135.00 132.23 2cla n PRO 30 Ca 0.28 0.67 -0.15 0.00 -2.02 0.00 0.00 63.50 62.27 2cla n PRO 30 Cb 0.46 -2.42 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 2cla n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2cla s GLY 32 N -1.46 1.31 0.22 0.00 0.00 -1.26 -0.49 107.32 105.64 2cla s GLY 32 Ca -0.10 -1.45 -0.15 0.00 0.00 0.00 0.00 44.72 43.01 2cla s GLY 32 CO 0.05 -1.05 0.50 -0.11 0.00 0.00 0.00 173.10 172.49 2cla s PHE 33 N -3.65 0.08 0.11 1.90 -0.12 -0.74 -4.89 117.98 110.67 2cla s PHE 33 Ca 0.32 -0.45 0.06 0.00 -0.05 0.00 0.00 56.93 56.81 2cla s PHE 33 Cb 0.02 0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.68 2cla s PHE 33 CO 0.16 -0.95 -0.15 -1.54 -0.05 0.00 0.00 175.22 172.69 2cla s SER 34 N -2.93 2.00 -0.17 1.98 1.04 -1.26 -1.88 113.70 112.47 2cla s SER 34 Ca 0.14 -0.75 -0.16 0.00 0.48 0.00 0.00 55.95 55.65 2cla s SER 34 Cb -0.01 -0.07 0.05 0.00 0.10 0.00 0.00 66.02 66.08 2cla s SER 34 CO 0.02 -0.11 0.47 -1.48 0.98 0.00 0.00 173.24 173.12 2cla s LEU 35 N -2.24 0.22 -0.07 2.42 0.05 0.26 -4.98 118.68 114.33 2cla s LEU 35 Ca 0.06 0.91 0.05 0.00 0.05 0.00 0.00 54.13 55.21 2cla s LEU 35 Cb -0.07 1.61 -0.01 0.00 -2.05 0.00 0.00 46.19 45.68 2cla s LEU 35 CO 0.03 -0.18 -0.24 -0.89 -0.55 0.00 0.00 176.35 174.52 2cla s THR 36 N 0.18 2.03 0.08 5.48 2.01 -1.26 -0.45 115.64 123.70 2cla s THR 36 Ca -0.01 -1.03 0.01 0.00 0.31 0.00 0.00 61.69 60.98 2cla s THR 36 Cb -0.03 -1.73 -0.04 0.00 0.01 0.00 0.00 72.50 70.71 2cla s THR 36 CO 0.01 0.56 -0.06 -0.55 -0.69 0.00 0.00 174.62 173.89 2cla s SER 37 N 0.06 0.99 -0.19 3.53 0.15 -0.72 -4.97 113.70 112.54 2cla s SER 37 Ca -0.10 -0.91 -0.03 0.00 0.70 0.00 0.00 55.95 55.60 2cla s SER 37 Cb -0.15 0.10 -0.02 0.00 -1.71 0.00 0.00 66.02 64.24 2cla s SER 37 CO 0.06 -0.43 -0.05 -0.54 1.20 0.00 0.00 173.24 173.48 2cla s LYS 38 N -3.40 3.47 -0.17 5.44 1.02 -1.26 -1.15 119.74 123.69 2cla s LYS 38 Ca 0.07 -0.60 -0.17 0.00 0.02 0.00 0.00 55.97 55.29 2cla s LYS 38 Cb 0.03 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 2cla s LYS 38 CO -0.04 -0.02 0.43 0.42 -0.92 0.00 0.00 175.35 175.22 2cla s ILE 39 N 1.01 5.19 -0.25 2.17 -1.09 -0.15 -4.80 121.20 123.28 2cla s ILE 39 Ca 0.00 0.80 -0.29 0.00 -2.23 0.00 0.00 60.65 58.93 2cla s ILE 39 Cb -0.15 -3.76 -0.01 0.00 -1.58 0.00 0.00 42.46 36.97 2cla s ILE 39 CO 0.00 0.27 1.30 -0.62 -1.23 0.00 0.00 174.94 174.67 2cla s ASP 40 N 0.88 6.75 -0.25 3.58 3.68 -1.26 -0.12 116.67 129.93 2cla s ASP 40 Ca 0.22 1.39 0.11 0.00 2.13 0.00 0.00 52.55 56.40 2cla s ASP 40 Cb -0.15 -2.54 0.49 0.00 -1.45 0.00 0.00 42.92 39.27 2cla s ASP 40 CO 0.08 -0.98 1.41 2.30 0.13 0.00 0.00 175.17 178.12 2cla n ILE 41 N 5.93 2.43 0.19 4.11 -5.35 0.14 -4.62 119.36 122.18 2cla n ILE 41 Ca 0.15 -2.62 -0.14 0.00 -0.27 0.00 0.00 62.75 59.86 2cla n ILE 41 Cb 0.46 -0.30 -0.07 0.00 -1.74 0.00 0.00 39.64 37.99 2cla n ILE 41 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2cla h THR 42 N 1.06 0.45 -0.66 7.28 2.02 -1.87 -1.61 112.91 119.59 2cla h THR 42 Ca 0.15 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.35 2cla h THR 42 Cb 1.51 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 2cla h THR 42 CO 0.29 0.00 0.42 0.74 0.37 0.00 0.00 175.52 177.34 2cla h THR 43 N -0.56 1.12 -0.97 3.16 2.02 -1.83 -2.38 112.91 113.47 2cla h THR 43 Ca -0.01 -0.29 0.10 0.00 0.77 0.00 0.00 66.41 66.98 2cla h THR 43 Cb 0.51 0.21 -0.07 0.00 -1.74 0.00 0.00 68.15 67.06 2cla h THR 43 CO -0.04 0.15 0.62 0.25 0.37 0.00 0.00 175.52 176.87 2cla h LEU 44 N 0.84 0.91 -1.29 2.58 5.85 -1.37 -1.57 115.31 121.26 2cla h LEU 44 Ca 0.26 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 2cla h LEU 44 Cb -0.03 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 2cla h LEU 44 CO -0.08 0.53 -0.14 0.50 -0.34 0.00 0.00 178.44 178.90 2cla h LYS 45 N 1.00 0.31 -0.08 1.25 1.63 -0.76 -0.43 116.57 119.49 2cla h LYS 45 Ca 0.45 -0.08 -0.05 0.00 -0.85 0.00 0.00 60.65 60.13 2cla h LYS 45 Cb 0.38 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.98 2cla h LYS 45 CO -0.21 0.46 -0.13 -0.22 -3.45 0.00 0.00 179.45 175.90 2cla h LYS 46 N 0.29 0.22 -0.94 1.90 1.63 -1.26 -1.80 116.57 116.62 2cla h LYS 46 Ca 0.06 -0.14 0.06 0.00 -0.85 0.00 0.00 60.65 59.78 2cla h LYS 46 Cb 0.43 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.01 2cla h LYS 46 CO 0.03 0.71 0.60 0.77 -3.45 0.00 0.00 179.45 178.10 2cla h SER 47 N -0.24 0.97 0.13 4.20 0.02 -1.10 -1.85 113.55 115.68 2cla h SER 47 Ca 0.01 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2cla h SER 47 Cb 0.69 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.03 2cla h SER 47 CO 0.03 0.63 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.22 2cla h LEU 48 N 1.11 -0.15 -0.94 5.07 3.38 -0.99 -2.96 115.31 119.83 2cla h LEU 48 Ca 0.40 -0.25 0.29 0.00 0.09 0.00 0.00 57.88 58.40 2cla h LEU 48 Cb 0.12 0.04 -0.16 0.00 0.09 0.00 0.00 40.66 40.75 2cla h LEU 48 CO -0.16 0.18 0.29 0.44 0.09 0.00 0.00 178.44 179.28 2cla h ASP 49 N -0.49 0.02 -0.54 -0.43 3.45 -1.02 0.52 116.42 117.94 2cla h ASP 49 Ca -0.02 0.23 -0.29 0.00 0.43 0.00 0.00 57.03 57.38 2cla h ASP 49 Cb 0.39 0.30 -0.16 0.00 -0.56 0.00 0.00 39.33 39.29 2cla h ASP 49 CO 0.03 -0.25 0.37 0.47 -1.57 0.00 0.00 179.24 178.29 2cla n ASP 50 N -5.27 3.86 -1.27 6.45 9.92 -0.72 -4.90 116.55 124.63 2cla n ASP 50 Ca 0.26 -2.90 -0.02 0.00 -0.53 0.00 0.00 54.79 51.60 2cla n ASP 50 Cb 0.85 -0.73 -0.00 0.00 -0.64 0.00 0.00 41.12 40.59 2cla n ASP 50 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2cla n SER 51 N -0.30 -0.22 -0.07 -2.24 3.41 0.18 -5.02 113.62 109.37 2cla n SER 51 Ca 0.32 -1.26 0.01 0.00 -0.26 0.00 0.00 58.87 57.69 2cla n SER 51 Cb 1.05 0.39 0.03 0.00 -0.26 0.00 0.00 64.21 65.42 2cla n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cla n ALA 52 N -2.67 2.05 -1.78 7.33 0.00 -1.26 -4.98 120.51 119.19 2cla n ALA 52 Ca -0.02 -1.16 -0.36 0.00 0.00 0.00 0.00 53.44 51.90 2cla n ALA 52 Cb 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2cla n ALA 52 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2cla s TYR 53 N -1.17 3.12 0.20 0.00 4.12 -1.26 -5.06 117.35 117.30 2cla s TYR 53 Ca 0.05 1.60 0.02 0.00 0.02 0.00 0.00 57.07 58.77 2cla s TYR 53 Cb 0.04 -3.17 -0.04 0.00 -1.52 0.00 0.00 41.96 37.28 2cla s TYR 53 CO 0.02 -0.87 0.36 -1.59 0.02 0.00 0.00 175.55 173.49 2cla s LYS 54 N -2.72 3.47 0.05 -0.62 0.00 -1.26 -4.90 119.74 113.76 2cla s LYS 54 Ca 0.61 -0.55 -0.21 0.00 0.00 0.00 0.00 55.97 55.83 2cla s LYS 54 Cb -0.22 -2.89 -0.10 0.00 0.00 0.00 0.00 37.83 34.63 2cla s LYS 54 CO 0.27 0.43 1.32 0.35 0.00 0.00 0.00 175.35 177.72 2cla h PHE 55 N 1.74 -0.82 -0.05 1.78 3.57 -1.99 -1.21 116.94 119.95 2cla h PHE 55 Ca -0.49 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.05 2cla h PHE 55 Cb 1.20 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 40.21 2cla h PHE 55 CO 0.51 -0.39 -0.34 -0.92 -2.23 0.00 0.00 178.31 174.95 2cla h TYR 56 N -0.58 -0.93 -0.52 0.41 3.20 -2.00 -1.79 116.97 114.77 2cla h TYR 56 Ca -0.04 0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.97 2cla h TYR 56 Cb 0.50 0.42 -0.09 0.00 1.54 0.00 0.00 36.73 39.10 2cla h TYR 56 CO -0.19 -0.42 -0.01 -1.00 -1.64 0.00 0.00 178.16 174.91 2cla h PRO 57 N -0.46 0.11 -0.54 1.82 0.13 -2.00 -1.60 132.00 129.47 2cla h PRO 57 Ca 0.07 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.15 2cla h PRO 57 Cb 0.57 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.65 2cla h PRO 57 CO -0.31 0.07 0.14 0.28 -0.23 0.00 0.00 178.00 177.95 2cla h VAL 58 N 0.11 1.22 -0.24 1.56 2.07 -0.64 -2.71 116.25 117.63 2cla h VAL 58 Ca 0.27 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 2cla h VAL 58 Cb 0.41 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2cla h VAL 58 CO -0.44 0.30 0.06 0.24 0.02 0.00 0.00 177.57 177.74 2cla h MET 59 N 0.80 0.39 -0.26 1.57 2.86 -0.71 -0.69 114.93 118.89 2cla h MET 59 Ca 0.18 -0.09 0.06 0.00 -2.06 0.00 0.00 59.70 57.78 2cla h MET 59 Cb 0.28 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 31.82 2cla h MET 59 CO -0.00 0.50 -0.34 0.82 1.06 0.00 0.00 176.91 178.95 2cla h ILE 60 N 0.21 0.24 -0.38 -1.22 2.04 -1.31 0.32 117.51 117.41 2cla h ILE 60 Ca 0.08 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.98 2cla h ILE 60 Cb 0.28 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 2cla h ILE 60 CO 0.00 0.00 0.14 0.22 0.00 0.00 0.00 178.15 178.52 2cla h TYR 61 N -0.34 0.26 -0.37 1.37 3.20 -1.34 0.10 116.97 119.86 2cla h TYR 61 Ca 0.13 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.92 2cla h TYR 61 Cb 0.55 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2cla h TYR 61 CO -0.48 0.11 -0.13 -0.07 -1.64 0.00 0.00 178.16 175.95 2cla h LEU 62 N 0.31 0.75 -0.01 2.82 3.38 -0.62 0.03 115.31 121.97 2cla h LEU 62 Ca 0.17 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2cla h LEU 62 Cb 0.14 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 2cla h LEU 62 CO -0.17 0.97 0.00 0.40 0.09 0.00 0.00 178.44 179.74 2cla h ILE 63 N 0.53 1.17 -0.60 1.22 2.04 -0.88 -2.44 117.51 118.54 2cla h ILE 63 Ca 0.09 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 2cla h ILE 63 Cb 0.66 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 2cla h ILE 63 CO 0.05 0.13 0.36 0.00 0.00 0.00 0.00 178.15 178.68 2cla h ALA 64 N 0.80 1.50 -0.31 1.87 0.00 -0.76 -0.05 119.26 122.31 2cla h ALA 64 Ca 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2cla h ALA 64 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2cla h ALA 64 CO -0.00 0.43 0.19 0.37 0.00 0.00 0.00 179.25 180.24 2cla h GLN 65 N 0.82 0.43 -0.14 0.00 4.15 -0.91 -1.82 115.11 117.65 2cla h GLN 65 Ca 0.22 -0.04 -0.19 0.00 0.77 0.00 0.00 58.65 59.41 2cla h GLN 65 Cb -0.03 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 27.58 2cla h GLN 65 CO -0.04 0.34 -0.64 0.00 -1.93 0.00 0.00 178.83 176.55 2cla h ALA 66 N 1.07 0.26 -0.66 3.38 0.00 -1.15 -3.03 119.26 119.14 2cla h ALA 66 Ca 0.11 -0.55 0.06 0.00 0.00 0.00 0.00 54.91 54.52 2cla h ALA 66 Cb 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2cla h ALA 66 CO -0.02 0.54 0.43 0.28 0.00 0.00 0.00 179.25 180.49 2cla h VAL 67 N 0.36 1.03 0.00 0.00 2.07 -0.96 -2.42 116.25 116.33 2cla h VAL 67 Ca -0.04 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2cla h VAL 67 Cb 1.28 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2cla h VAL 67 CO 0.13 0.13 0.00 0.59 0.02 0.00 0.00 177.57 178.44 2cla n ASN 68 N -4.47 0.00 -0.01 0.57 3.02 -0.69 -2.75 115.26 110.93 2cla n ASN 68 Ca 0.09 -0.85 0.10 0.00 -0.03 0.00 0.00 54.58 53.89 2cla n ASN 68 Cb 0.21 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.23 2cla n ASN 68 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cla n GLN 69 N -0.96 0.60 -4.62 3.52 3.00 -0.91 -4.93 117.38 113.08 2cla n GLN 69 Ca 0.18 -0.16 -0.33 0.00 -0.01 0.00 0.00 57.00 56.68 2cla n GLN 69 Cb 0.08 -1.47 -0.15 0.00 0.00 0.00 0.00 30.24 28.70 2cla n GLN 69 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2cla s PHE 70 N -3.32 2.79 0.16 1.08 0.40 -1.11 -5.03 117.98 112.95 2cla s PHE 70 Ca -0.06 -0.91 -0.11 0.00 -0.60 0.00 0.00 56.93 55.25 2cla s PHE 70 Cb 0.13 -1.87 0.03 0.00 0.51 0.00 0.00 43.02 41.82 2cla s PHE 70 CO 0.83 -0.39 1.61 -0.44 0.70 0.00 0.00 175.22 177.52 2cla h ASP 71 N 7.12 0.91 0.05 1.36 5.19 -1.92 -3.21 116.42 125.92 2cla h ASP 71 Ca -0.30 -0.31 0.00 0.00 -0.62 0.00 0.00 57.03 55.80 2cla h ASP 71 Cb 1.20 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.46 2cla h ASP 71 CO 0.56 1.00 0.00 1.05 -3.12 0.00 0.00 179.24 178.73 2cla h GLU 72 N 0.80 0.00 -0.01 3.56 9.09 -1.93 -0.48 114.58 125.61 2cla h GLU 72 Ca 0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.56 2cla h GLU 72 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.64 2cla h GLU 72 CO 0.03 0.00 -0.35 1.28 0.05 0.00 0.00 179.01 180.02 2cla n LEU 73 N -2.81 1.58 -0.15 3.06 4.77 -1.21 -4.14 117.00 118.11 2cla n LEU 73 Ca -0.02 -0.53 0.10 0.00 -0.03 0.00 0.00 56.01 55.52 2cla n LEU 73 Cb 0.07 -0.06 0.15 0.00 -2.33 0.00 0.00 43.42 41.26 2cla n LEU 73 CO 0.17 0.29 0.56 0.54 -1.33 0.00 0.00 177.39 177.63 2cla n ARG 74 N -0.26 1.38 -2.79 3.23 1.74 -0.20 -4.50 116.66 115.26 2cla n ARG 74 Ca 0.11 -2.64 -0.30 0.00 -0.77 0.00 0.00 57.85 54.25 2cla n ARG 74 Cb 0.41 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.30 2cla n ARG 74 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2cla s MET 75 N -2.90 3.78 0.17 5.56 -1.94 -1.18 -1.23 119.30 121.56 2cla s MET 75 Ca 0.33 0.51 -0.24 0.00 -1.71 0.00 0.00 55.69 54.57 2cla s MET 75 Cb 0.29 -2.36 0.06 0.00 2.01 0.00 0.00 34.83 34.83 2cla s MET 75 CO 0.03 -0.07 0.95 0.00 -0.01 0.00 0.00 175.02 175.91 2cla s ALA 76 N -2.42 -1.59 -0.20 3.03 0.00 -0.59 -4.42 121.76 115.57 2cla s ALA 76 Ca 0.52 0.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.45 2cla s ALA 76 Cb -0.10 0.67 -0.02 0.00 0.00 0.00 0.00 23.12 23.66 2cla s ALA 76 CO 0.32 -1.05 0.00 0.42 0.00 0.00 0.00 175.76 175.46 2cla s ILE 77 N -3.20 3.98 -0.13 0.00 -1.09 -1.26 0.93 121.20 120.44 2cla s ILE 77 Ca 0.13 -0.31 -0.04 0.00 -2.23 0.00 0.00 60.65 58.20 2cla s ILE 77 Cb -0.02 -2.80 0.06 0.00 -1.58 0.00 0.00 42.46 38.13 2cla s ILE 77 CO 0.03 0.43 0.23 -0.75 -1.23 0.00 0.00 174.94 173.65 2cla s LYS 78 N 1.00 0.12 -0.16 2.79 2.20 0.15 -4.74 119.74 121.10 2cla s LYS 78 Ca 0.02 0.64 -0.00 0.00 -0.36 0.00 0.00 55.97 56.27 2cla s LYS 78 Cb -0.14 -0.23 0.00 0.00 -1.51 0.00 0.00 37.83 35.95 2cla s LYS 78 CO 0.02 -0.33 0.01 -3.47 -0.36 0.00 0.00 175.35 171.21 2cla n ASP 80 N 5.34 -1.55 0.00 1.43 2.03 -1.26 -1.15 116.55 121.39 2cla n ASP 80 Ca -0.06 -0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.25 2cla n ASP 80 Cb 0.50 -0.91 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 2cla n ASP 80 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2cla n ASP 81 N 1.58 -4.45 -4.93 1.67 9.92 -1.26 -4.95 116.55 114.12 2cla n ASP 81 Ca -0.02 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.96 2cla n ASP 81 Cb 0.52 -2.96 -0.03 0.00 -0.64 0.00 0.00 41.12 38.01 2cla n ASP 81 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2cla s GLU 82 N -1.58 3.46 -0.32 -1.24 8.01 -0.30 -5.07 118.70 121.65 2cla s GLU 82 Ca 0.00 -0.49 -0.21 0.00 0.01 0.00 0.00 54.97 54.28 2cla s GLU 82 Cb 0.00 -2.97 -0.00 0.00 -4.31 0.00 0.00 34.13 26.84 2cla s GLU 82 CO 0.00 0.54 0.67 -1.17 0.01 0.00 0.00 175.26 175.31 2cla s LEU 83 N -2.95 4.16 0.41 1.80 2.96 -1.26 0.34 118.68 124.15 2cla s LEU 83 Ca 0.35 0.38 0.07 0.00 -0.22 0.00 0.00 54.13 54.72 2cla s LEU 83 Cb -0.12 -2.87 -0.07 0.00 0.50 0.00 0.00 46.19 43.63 2cla s LEU 83 CO 0.28 -0.56 0.07 0.27 -1.32 0.00 0.00 176.35 175.09 2cla s ILE 84 N 2.74 2.08 -0.07 6.68 -4.36 0.27 -0.93 121.20 127.61 2cla s ILE 84 Ca 0.27 -1.90 0.01 0.00 -0.26 0.00 0.00 60.65 58.77 2cla s ILE 84 Cb -0.14 -2.98 0.02 0.00 1.25 0.00 0.00 42.46 40.60 2cla s ILE 84 CO 0.13 0.00 -0.08 -0.69 0.24 0.00 0.00 174.94 174.54 2cla s VAL 85 N -2.68 0.85 0.10 8.37 1.01 -0.95 -1.55 120.40 125.55 2cla s VAL 85 Ca 0.36 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 2cla s VAL 85 Cb 0.08 -0.83 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 2cla s VAL 85 CO 0.19 0.30 0.96 0.26 0.00 0.00 0.00 175.10 176.81 2cla s TRP 86 N 1.01 3.80 0.24 5.22 0.52 -0.36 -1.07 118.94 128.29 2cla s TRP 86 Ca -0.09 1.78 -0.07 0.00 0.02 0.00 0.00 56.10 57.75 2cla s TRP 86 Cb -0.14 -3.05 0.27 0.00 -1.15 0.00 0.00 33.47 29.39 2cla s TRP 86 CO -0.00 0.19 1.89 -0.44 0.02 0.00 0.00 176.95 178.61 2cla h ASP 87 N 5.67 0.98 -5.08 2.95 3.45 -0.20 -3.45 116.42 120.75 2cla h ASP 87 Ca -0.43 -0.01 -0.09 0.00 0.43 0.00 0.00 57.03 56.93 2cla h ASP 87 Cb 1.21 -0.23 -0.16 0.00 -0.56 0.00 0.00 39.33 39.59 2cla h ASP 87 CO 0.72 0.68 -0.28 -0.55 -1.57 0.00 0.00 179.24 178.24 2cla s SER 88 N -5.94 -0.06 0.10 6.45 0.15 -1.26 -5.05 113.70 108.09 2cla s SER 88 Ca -0.13 -0.31 0.07 0.00 0.70 0.00 0.00 55.95 56.29 2cla s SER 88 Cb 0.17 0.35 -0.03 0.00 -1.71 0.00 0.00 66.02 64.80 2cla s SER 88 CO 0.80 -0.64 -0.19 0.68 1.20 0.00 0.00 173.24 175.09 2cla s VAL 89 N -2.87 1.55 -0.04 4.45 -7.23 -1.26 -4.87 120.40 110.13 2cla s VAL 89 Ca -0.03 -1.50 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 2cla s VAL 89 Cb 0.00 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.47 2cla s VAL 89 CO -0.05 -0.12 -0.12 -1.81 -0.31 0.00 0.00 175.10 172.69 2cla s ASP 90 N -1.91 4.25 0.33 4.85 1.01 -0.30 -4.62 116.67 120.28 2cla s ASP 90 Ca 0.05 -0.16 -0.26 0.00 0.71 0.00 0.00 52.55 52.89 2cla s ASP 90 Cb -0.10 -0.94 -0.10 0.00 1.01 0.00 0.00 42.92 42.79 2cla s ASP 90 CO 0.04 0.33 0.94 -2.16 0.21 0.00 0.00 175.17 174.53 2cla s PRO 91 N -0.92 4.56 -0.24 8.23 0.04 -1.25 -2.53 135.00 142.89 2cla s PRO 91 Ca 0.13 1.31 0.01 0.00 0.04 0.00 0.00 61.00 62.49 2cla s PRO 91 Cb -0.11 -2.77 0.04 0.00 0.04 0.00 0.00 34.50 31.71 2cla s PRO 91 CO 0.02 0.26 -0.12 -1.14 0.04 0.00 0.00 177.00 176.07 2cla s GLN 92 N -2.12 2.56 0.36 4.56 0.74 -0.50 -3.32 119.66 121.94 2cla s GLN 92 Ca 0.51 -1.14 0.08 0.00 0.05 0.00 0.00 55.36 54.86 2cla s GLN 92 Cb -0.18 -2.83 -0.05 0.00 1.10 0.00 0.00 33.01 31.04 2cla s GLN 92 CO 0.23 -0.44 0.09 -0.59 -0.55 0.00 0.00 175.29 174.02 2cla s PHE 93 N 1.20 2.60 0.08 1.67 -0.12 0.46 -0.99 117.98 122.87 2cla s PHE 93 Ca -0.03 -0.46 -0.00 0.00 -0.05 0.00 0.00 56.93 56.38 2cla s PHE 93 Cb -0.17 -1.65 -0.04 0.00 -0.63 0.00 0.00 43.02 40.53 2cla s PHE 93 CO -0.07 0.37 0.23 0.95 -0.05 0.00 0.00 175.22 176.65 2cla s THR 94 N -2.52 5.37 -0.09 -4.49 -4.23 -0.83 -0.12 115.64 108.72 2cla s THR 94 Ca 0.37 -0.38 0.01 0.00 -1.18 0.00 0.00 61.69 60.51 2cla s THR 94 Cb 0.01 -3.64 0.02 0.00 1.34 0.00 0.00 72.50 70.22 2cla s THR 94 CO 0.21 0.11 -0.11 0.68 -0.54 0.00 0.00 174.62 174.96 2cla s VAL 95 N -1.55 1.19 -0.02 2.29 -7.23 0.20 -4.80 120.40 110.49 2cla s VAL 95 Ca 0.35 -0.46 -0.23 0.00 -1.81 0.00 0.00 61.98 59.84 2cla s VAL 95 Cb -0.13 -1.12 -0.05 0.00 0.56 0.00 0.00 36.38 35.65 2cla s VAL 95 CO 0.28 0.38 0.69 0.12 -0.31 0.00 0.00 175.10 176.26 2cla s PHE 96 N 1.08 3.65 -0.31 2.82 5.36 -1.26 -0.91 117.98 128.42 2cla s PHE 96 Ca -0.06 1.30 -0.06 0.00 -0.96 0.00 0.00 56.93 57.15 2cla s PHE 96 Cb -0.14 -2.76 0.02 0.00 -0.34 0.00 0.00 43.02 39.80 2cla s PHE 96 CO -0.02 0.21 0.07 -1.01 -1.46 0.00 0.00 175.22 173.02 2cla s HIS 97 N 0.28 3.18 0.25 10.12 3.76 -0.70 -4.95 115.29 127.22 2cla s HIS 97 Ca 0.36 -1.25 0.01 0.00 -0.15 0.00 0.00 55.06 54.03 2cla s HIS 97 Cb -0.19 -2.23 0.30 0.00 1.11 0.00 0.00 32.58 31.57 2cla s HIS 97 CO 0.19 -0.66 1.64 1.96 -0.85 0.00 0.00 174.74 177.02 2cla h GLN 98 N 8.19 0.49 0.00 1.40 7.50 -1.96 -0.96 115.11 129.77 2cla h GLN 98 Ca -0.28 -0.23 0.00 0.00 0.50 0.00 0.00 58.65 58.64 2cla h GLN 98 Cb 1.10 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.63 2cla h GLN 98 CO 0.60 0.79 0.00 -0.85 -1.50 0.00 0.00 178.83 177.86 2cla n GLU 99 N -4.05 0.25 0.00 1.46 0.00 -1.26 -3.88 120.64 113.17 2cla n GLU 99 Ca -0.01 0.30 0.00 0.00 0.00 0.00 0.00 57.16 57.45 2cla n GLU 99 Cb 0.48 -1.85 0.00 0.00 0.00 0.00 0.00 31.44 30.08 2cla n GLU 99 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 2cla n THR 100 N -2.30 0.00 -1.64 3.84 5.66 -1.10 -5.00 114.28 113.73 2cla n THR 100 Ca 0.04 -0.41 -0.17 0.00 -3.05 0.00 0.00 64.05 60.45 2cla n THR 100 Cb 0.36 1.01 -0.06 0.00 -1.55 0.00 0.00 70.33 70.08 2cla n THR 100 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2cla n GLU 101 N -0.80 -1.23 -4.06 1.09 1.02 -0.38 -5.01 120.64 111.28 2cla n GLU 101 Ca 0.00 1.06 -0.24 0.00 -0.02 0.00 0.00 57.16 57.96 2cla n GLU 101 Cb 0.00 -5.33 -0.07 0.00 -0.02 0.00 0.00 31.44 26.02 2cla n GLU 101 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2cla s THR 102 N -2.68 2.37 0.05 2.62 -4.23 -1.21 -4.96 115.64 107.60 2cla s THR 102 Ca 0.00 -1.65 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 2cla s THR 102 Cb 0.00 -3.00 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 2cla s THR 102 CO 0.00 -0.01 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.50 2cla s PHE 103 N -2.58 2.47 0.15 3.99 0.40 -1.26 -1.73 117.98 119.42 2cla s PHE 103 Ca 0.42 -0.31 0.09 0.00 -0.60 0.00 0.00 56.93 56.52 2cla s PHE 103 Cb 0.03 -1.42 -0.04 0.00 0.51 0.00 0.00 43.02 42.10 2cla s PHE 103 CO 0.23 0.22 -0.12 -1.12 0.70 0.00 0.00 175.22 175.14 2cla s SER 104 N -1.45 4.18 -0.21 1.36 0.01 -0.09 -4.76 113.70 112.74 2cla s SER 104 Ca 0.14 -0.55 -0.06 0.00 1.31 0.00 0.00 55.95 56.79 2cla s SER 104 Cb -0.10 -0.69 -0.02 0.00 0.21 0.00 0.00 66.02 65.41 2cla s SER 104 CO 0.04 0.13 0.02 0.00 0.41 0.00 0.00 173.24 173.84 2cla s ALA 105 N -1.51 3.06 0.27 1.44 0.00 -0.51 -0.62 121.76 123.89 2cla s ALA 105 Ca 0.23 -1.03 0.11 0.00 0.00 0.00 0.00 51.96 51.27 2cla s ALA 105 Cb -0.09 -1.85 -0.05 0.00 0.00 0.00 0.00 23.12 21.13 2cla s ALA 105 CO 0.14 -0.24 -0.18 -0.51 0.00 0.00 0.00 175.76 174.96 2cla s LEU 106 N 1.16 2.59 0.17 0.00 1.43 0.82 -4.33 118.68 120.52 2cla s LEU 106 Ca 0.03 -1.04 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 2cla s LEU 106 Cb -0.14 -1.01 -0.04 0.00 0.03 0.00 0.00 46.19 45.03 2cla s LEU 106 CO 0.02 -0.02 0.13 -0.94 0.23 0.00 0.00 176.35 175.77 2cla s SER 107 N -3.48 0.20 0.08 2.29 1.04 -1.26 0.17 113.70 112.74 2cla s SER 107 Ca 0.29 -1.23 -0.26 0.00 0.48 0.00 0.00 55.95 55.23 2cla s SER 107 Cb -0.04 0.36 0.08 0.00 0.10 0.00 0.00 66.02 66.53 2cla s SER 107 CO 0.13 -0.81 0.73 0.00 0.98 0.00 0.00 173.24 174.28 2cla s PRO 109 N -3.33 4.38 0.55 0.00 0.02 -1.26 -3.94 135.00 131.42 2cla s PRO 109 Ca 0.02 2.10 -0.18 0.00 0.02 0.00 0.00 61.00 62.96 2cla s PRO 109 Cb -0.01 -3.16 -0.06 0.00 0.02 0.00 0.00 34.50 31.29 2cla s PRO 109 CO -0.10 -0.25 1.07 -0.47 -0.33 0.00 0.00 177.00 176.93 2cla s TYR 110 N -0.16 2.87 -0.19 6.54 5.04 -1.26 -4.84 117.35 125.36 2cla s TYR 110 Ca 0.55 1.55 -0.21 0.00 -2.44 0.00 0.00 57.07 56.52 2cla s TYR 110 Cb -0.38 -3.12 0.06 0.00 0.35 0.00 0.00 41.96 38.88 2cla s TYR 110 CO 0.41 -1.19 0.58 0.45 -1.34 0.00 0.00 175.55 174.47 2cla s SER 111 N -2.22 -0.59 0.51 4.32 0.15 -1.26 -5.00 113.70 109.60 2cla s SER 111 Ca 0.68 1.06 0.31 0.00 0.70 0.00 0.00 55.95 58.69 2cla s SER 111 Cb -0.19 1.06 1.14 0.00 -1.71 0.00 0.00 66.02 66.32 2cla s SER 111 CO 0.29 -0.27 1.89 0.77 1.20 0.00 0.00 173.24 177.12 2cla h SER 112 N 4.84 0.00 -3.59 5.45 4.64 -2.00 -3.40 113.55 119.48 2cla h SER 112 Ca -0.28 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.40 2cla h SER 112 Cb 1.17 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.12 2cla h SER 112 CO 0.18 0.00 0.21 -0.62 -0.87 0.00 0.00 176.83 175.73 2cla s ASP 113 N -5.68 6.39 0.36 4.97 2.15 -1.26 -4.89 116.67 118.71 2cla s ASP 113 Ca 0.03 -0.08 0.05 0.00 0.43 0.00 0.00 52.55 52.98 2cla s ASP 113 Cb 0.08 -2.34 0.72 0.00 -0.30 0.00 0.00 42.92 41.08 2cla s ASP 113 CO 0.56 -0.75 1.96 -0.29 -0.17 0.00 0.00 175.17 176.47 2cla h ILE 114 N 5.83 1.03 -0.18 4.11 2.10 -1.90 -0.23 117.51 128.27 2cla h ILE 114 Ca -0.25 -0.27 -0.12 0.00 1.08 0.00 0.00 64.86 65.30 2cla h ILE 114 Cb 1.10 0.18 -0.01 0.00 -1.09 0.00 0.00 36.82 37.00 2cla h ILE 114 CO 0.89 0.14 -0.40 0.44 -1.08 0.00 0.00 178.15 178.15 2cla h ASP 115 N 0.78 0.42 0.14 2.19 3.45 -1.95 -0.15 116.42 121.31 2cla h ASP 115 Ca 0.31 -0.18 -0.12 0.00 0.43 0.00 0.00 57.03 57.47 2cla h ASP 115 Cb 0.23 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 2cla h ASP 115 CO -0.10 0.78 -0.44 -0.61 -1.57 0.00 0.00 179.24 177.29 2cla h GLN 116 N 0.34 0.37 0.22 3.56 5.75 -1.70 -2.48 115.11 121.17 2cla h GLN 116 Ca 0.03 -0.19 -0.00 0.00 -0.15 0.00 0.00 58.65 58.34 2cla h GLN 116 Cb 0.85 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.39 2cla h GLN 116 CO 0.07 0.75 -0.18 0.35 -2.65 0.00 0.00 178.83 177.16 2cla h PHE 117 N 0.30 -0.48 -0.99 3.99 3.57 -0.46 -0.21 116.94 122.65 2cla h PHE 117 Ca 0.02 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.61 2cla h PHE 117 Cb 0.90 0.18 -0.07 0.00 2.79 0.00 0.00 35.95 39.76 2cla h PHE 117 CO 0.02 -0.28 0.64 0.52 -2.23 0.00 0.00 178.31 176.98 2cla h MET 118 N -0.42 1.06 -0.21 1.11 2.86 -0.87 0.27 114.93 118.72 2cla h MET 118 Ca -0.01 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 2cla h MET 118 Cb 0.38 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2cla h MET 118 CO -0.02 0.70 -0.06 0.28 1.06 0.00 0.00 176.91 178.87 2cla h VAL 119 N 1.09 1.29 -0.46 -2.22 2.07 -1.30 -1.41 116.25 115.30 2cla h VAL 119 Ca 0.45 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.97 2cla h VAL 119 Cb 0.29 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2cla h VAL 119 CO -0.20 0.32 0.21 0.78 0.02 0.00 0.00 177.57 178.70 2cla h ASN 120 N 0.14 0.27 0.34 0.57 2.35 0.86 -2.14 115.58 117.97 2cla h ASN 120 Ca 0.05 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2cla h ASN 120 Cb 0.51 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 2cla h ASN 120 CO 0.02 0.20 -0.28 0.22 -1.65 0.00 0.00 177.43 175.94 2cla h TYR 121 N 0.41 -0.74 -0.92 1.19 3.20 -1.04 -2.42 116.97 116.65 2cla h TYR 121 Ca 0.21 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.12 2cla h TYR 121 Cb 0.15 0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.64 2cla h TYR 121 CO -0.12 -0.41 0.60 -0.07 -1.64 0.00 0.00 178.16 176.51 2cla h LEU 122 N -0.62 0.98 -0.45 2.82 3.38 -1.25 -0.86 115.31 119.31 2cla h LEU 122 Ca -0.02 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2cla h LEU 122 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2cla h LEU 122 CO -0.02 0.66 -0.27 0.77 0.09 0.00 0.00 178.44 179.67 2cla h SER 123 N 1.14 1.02 -0.33 -0.43 4.64 -1.32 0.63 113.55 118.89 2cla h SER 123 Ca 0.37 -0.42 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 2cla h SER 123 Cb 0.04 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.83 2cla h SER 123 CO -0.13 1.22 0.03 0.58 -0.87 0.00 0.00 176.83 177.65 2cla h VAL 124 N 0.82 1.22 -0.28 0.95 2.07 -1.22 -1.05 116.25 118.75 2cla h VAL 124 Ca 0.09 -0.85 -0.07 0.00 0.82 0.00 0.00 66.70 66.69 2cla h VAL 124 Cb 0.86 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2cla h VAL 124 CO 0.08 0.30 -0.09 0.24 0.02 0.00 0.00 177.57 178.11 2cla h MET 125 N 0.63 0.56 0.34 1.57 2.07 -0.43 -1.69 114.93 117.99 2cla h MET 125 Ca 0.13 -0.23 -0.02 0.00 -2.07 0.00 0.00 59.70 57.52 2cla h MET 125 Cb 0.35 -0.03 0.00 0.00 -1.87 0.00 0.00 31.60 30.06 2cla h MET 125 CO 0.01 0.78 -0.16 0.93 1.07 0.00 0.00 176.91 179.54 2cla h GLU 126 N 0.32 -0.44 -0.60 1.72 5.08 0.54 -0.99 114.58 120.20 2cla h GLU 126 Ca 0.07 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.58 2cla h GLU 126 Cb 0.59 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.85 2cla h GLU 126 CO 0.03 -0.22 0.10 -0.09 -1.00 0.00 0.00 179.01 177.84 2cla h ARG 127 N -0.59 0.22 -0.33 2.33 2.43 -1.22 -3.22 114.38 113.99 2cla h ARG 127 Ca -0.05 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2cla h ARG 127 Cb 0.43 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 2cla h ARG 127 CO 0.08 0.14 0.00 0.66 -1.51 0.00 0.00 179.97 179.34 2cla n TYR 128 N -5.16 0.87 -0.28 2.20 4.01 -0.64 -4.75 117.16 113.41 2cla n TYR 128 Ca 0.09 -0.72 0.13 0.00 -0.16 0.00 0.00 57.90 57.24 2cla n TYR 128 Cb 0.33 -0.22 0.39 0.00 -0.31 0.00 0.00 39.34 39.53 2cla n TYR 128 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 2cla h LYS 129 N 2.14 0.65 -0.32 -0.72 2.10 -1.19 -1.93 116.57 117.29 2cla h LYS 129 Ca 0.00 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 2cla h LYS 129 Cb 1.22 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 2cla h LYS 129 CO 0.16 0.43 0.00 0.43 -2.00 0.00 0.00 179.45 178.47 2cla n SER 130 N -4.59 3.17 -4.47 7.07 7.64 -1.26 -4.85 113.62 116.33 2cla n SER 130 Ca 0.19 -1.92 -0.43 0.00 1.01 0.00 0.00 58.87 57.72 2cla n SER 130 Cb 0.52 -0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.47 2cla n SER 130 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2cla s ASP 131 N -1.34 6.24 -0.01 6.43 -1.08 -0.73 -4.86 116.67 121.33 2cla s ASP 131 Ca 0.33 -0.78 0.07 0.00 -0.52 0.00 0.00 52.55 51.64 2cla s ASP 131 Cb 0.19 -2.40 0.20 0.00 -1.46 0.00 0.00 42.92 39.46 2cla s ASP 131 CO 0.27 -1.27 1.14 0.35 0.52 0.00 0.00 175.17 176.18 2cla n THR 132 N 5.95 0.34 -0.78 1.71 -2.24 -1.26 -4.86 114.28 113.15 2cla n THR 132 Ca -0.03 -0.31 -0.29 0.00 -2.27 0.00 0.00 64.05 61.15 2cla n THR 132 Cb 0.46 0.11 0.20 0.00 -2.10 0.00 0.00 70.33 69.00 2cla n THR 132 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cla s LYS 133 N -1.69 0.04 0.12 -0.78 3.01 -1.26 -4.89 119.74 114.31 2cla s LYS 133 Ca 0.15 0.94 -0.09 0.00 -1.01 0.00 0.00 55.97 55.96 2cla s LYS 133 Cb 0.08 -1.66 -0.09 0.00 -1.01 0.00 0.00 37.83 35.15 2cla s LYS 133 CO 0.10 -3.10 1.34 1.25 0.51 0.00 0.00 175.35 175.44 2cla h LEU 134 N -2.18 0.79 -6.62 3.17 5.85 -1.91 -3.37 115.31 111.05 2cla h LEU 134 Ca -0.55 -0.53 -0.60 0.00 0.84 0.00 0.00 57.88 57.04 2cla h LEU 134 Cb 1.31 -0.24 -0.40 0.00 0.37 0.00 0.00 40.66 41.70 2cla h LEU 134 CO 0.50 1.32 -0.77 0.49 -0.34 0.00 0.00 178.44 179.64 2cla n PHE 135 N -3.89 1.48 0.21 1.25 3.01 -1.26 -1.43 117.46 116.83 2cla n PHE 135 Ca -0.07 -3.87 0.17 0.00 1.01 0.00 0.00 57.45 54.70 2cla n PHE 135 Cb 0.75 -0.28 0.83 0.00 -0.01 0.00 0.00 39.48 40.77 2cla n PHE 135 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2cla h PRO 136 N 5.20 0.00 -0.02 -1.08 0.11 -1.76 -1.12 132.00 133.33 2cla h PRO 136 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2cla h PRO 136 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2cla h PRO 136 CO 0.59 0.00 -0.29 1.04 -0.21 0.00 0.00 178.00 179.13 2cla n GLN 137 N -3.80 1.48 0.00 1.05 6.02 -1.26 -5.05 117.38 115.82 2cla n GLN 137 Ca 0.01 -1.16 0.00 0.00 -0.01 0.00 0.00 57.00 55.84 2cla n GLN 137 Cb 0.32 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.11 2cla n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cla n GLY 138 N 1.37 1.04 3.70 1.08 0.00 -0.43 -4.95 105.19 107.01 2cla n GLY 138 Ca 0.12 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2cla n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cla s VAL 139 N 0.00 2.77 0.21 1.61 1.01 -1.26 -4.80 120.40 119.93 2cla s VAL 139 Ca 0.00 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.00 2cla s VAL 139 Cb 0.00 -3.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.09 2cla s VAL 139 CO 0.00 0.00 1.27 0.42 0.00 0.00 0.00 175.10 176.79 2cla s THR 140 N 2.37 3.29 0.40 3.92 -4.23 -1.26 -4.95 115.64 115.18 2cla s THR 140 Ca 0.75 1.10 -0.27 0.00 -1.18 0.00 0.00 61.69 62.09 2cla s THR 140 Cb -0.43 -3.70 -0.10 0.00 1.34 0.00 0.00 72.50 69.61 2cla s THR 140 CO 0.33 0.18 1.48 -2.65 -0.54 0.00 0.00 174.62 173.42 2cla n PRO 141 N 2.38 2.58 0.05 3.99 -0.02 -1.26 -4.89 135.00 137.83 2cla n PRO 141 Ca 0.05 0.91 -0.03 0.00 -2.02 0.00 0.00 63.50 62.40 2cla n PRO 141 Cb 0.43 -2.67 0.19 0.00 -0.02 0.00 0.00 33.50 31.44 2cla n PRO 141 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2cla h GLU 142 N 2.80 0.38 -4.65 -0.52 5.08 -1.99 -3.34 114.58 112.33 2cla h GLU 142 Ca -0.51 -0.17 -0.74 0.00 -1.00 0.00 0.00 59.36 56.94 2cla h GLU 142 Cb 1.25 -0.01 -0.17 0.00 0.50 0.00 0.00 28.75 30.32 2cla h GLU 142 CO 0.63 0.69 1.42 0.27 -1.00 0.00 0.00 179.01 181.03 2cla n ASN 143 N -4.06 5.21 -3.94 1.42 6.94 -1.26 -4.95 115.26 114.63 2cla n ASN 143 Ca -0.01 -2.99 -0.20 0.00 -0.02 0.00 0.00 54.58 51.35 2cla n ASN 143 Cb 0.46 -1.56 -0.09 0.00 -2.36 0.00 0.00 39.78 36.23 2cla n ASN 143 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 2cla s HIS 144 N 1.48 1.67 0.02 -2.53 -3.43 -1.26 -1.15 115.29 110.09 2cla s HIS 144 Ca 0.43 -1.38 0.01 0.00 -0.80 0.00 0.00 55.06 53.31 2cla s HIS 144 Cb -0.02 -0.91 -0.01 0.00 -1.43 0.00 0.00 32.58 30.21 2cla s HIS 144 CO 0.00 -0.51 -0.04 -0.48 -2.00 0.00 0.00 174.74 171.71 2cla s LEU 145 N -3.43 2.14 -0.13 5.38 2.34 -1.05 -4.75 118.68 119.18 2cla s LEU 145 Ca 0.34 -0.31 -0.07 0.00 0.06 0.00 0.00 54.13 54.15 2cla s LEU 145 Cb 0.04 -0.06 -0.04 0.00 -0.56 0.00 0.00 46.19 45.57 2cla s LEU 145 CO 0.18 -0.13 0.11 0.20 -1.06 0.00 0.00 176.35 175.65 2cla s ASN 146 N -0.87 6.11 -0.01 1.48 -0.87 -0.61 -1.41 114.94 118.76 2cla s ASN 146 Ca -0.07 0.35 0.04 0.00 -1.57 0.00 0.00 52.86 51.61 2cla s ASN 146 Cb -0.06 -1.96 -0.01 0.00 -0.02 0.00 0.00 41.25 39.20 2cla s ASN 146 CO -0.00 0.36 -0.12 -0.63 -2.57 0.00 0.00 177.10 174.13 2cla s ILE 147 N -0.72 0.99 0.14 0.60 1.01 -0.16 -1.21 121.20 121.85 2cla s ILE 147 Ca 0.13 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 60.09 2cla s ILE 147 Cb -0.12 -0.83 0.03 0.00 0.01 0.00 0.00 42.46 41.55 2cla s ILE 147 CO 0.03 0.28 0.41 -0.55 0.00 0.00 0.00 174.94 175.11 2cla s SER 148 N -0.23 -0.22 -0.06 3.58 0.15 -0.62 -1.96 113.70 114.34 2cla s SER 148 Ca 0.04 -0.37 -0.04 0.00 0.70 0.00 0.00 55.95 56.28 2cla s SER 148 Cb -0.06 0.49 0.02 0.00 -1.71 0.00 0.00 66.02 64.77 2cla s SER 148 CO -0.00 -0.88 0.14 0.00 1.20 0.00 0.00 173.24 173.70 2cla s ALA 149 N -3.82 -0.31 -0.69 5.45 0.00 -1.26 -0.94 121.76 120.19 2cla s ALA 149 Ca 0.04 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.54 2cla s ALA 149 Cb 0.02 -0.32 0.17 0.00 0.00 0.00 0.00 23.12 22.98 2cla s ALA 149 CO -0.10 -0.10 0.49 -0.51 0.00 0.00 0.00 175.76 175.54 2cla s LEU 150 N 0.53 4.93 0.43 0.00 1.02 0.68 -4.92 118.68 121.35 2cla s LEU 150 Ca -0.04 -3.49 0.30 0.00 0.02 0.00 0.00 54.13 50.92 2cla s LEU 150 Cb -0.05 -1.73 1.22 0.00 0.02 0.00 0.00 46.19 45.65 2cla s LEU 150 CO -0.02 -0.18 1.88 -0.65 0.02 0.00 0.00 176.35 177.39 2cla h PRO 151 N 6.02 0.00 0.00 1.29 0.11 -1.86 -3.00 132.00 134.55 2cla h PRO 151 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2cla h PRO 151 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2cla h PRO 151 CO 0.74 0.00 -0.29 0.91 -0.21 0.00 0.00 178.00 179.15 2cla n TRP 152 N -2.74 0.26 -3.75 0.65 8.01 -1.26 -4.46 117.44 114.15 2cla n TRP 152 Ca 0.01 0.08 -0.13 0.00 -1.31 0.00 0.00 57.50 56.15 2cla n TRP 152 Cb 0.27 -0.52 -0.10 0.00 -2.01 0.00 0.00 31.31 28.95 2cla n TRP 152 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 2cla s VAL 153 N -3.05 0.02 0.10 -0.99 0.11 -1.24 -5.01 120.40 110.33 2cla s VAL 153 Ca 0.11 -0.13 -0.17 0.00 -2.93 0.00 0.00 61.98 58.85 2cla s VAL 153 Cb 0.16 -0.55 -0.07 0.00 -1.53 0.00 0.00 36.38 34.40 2cla s VAL 153 CO 0.63 -0.07 0.55 0.21 -3.33 0.00 0.00 175.10 173.09 2cla s ASN 154 N -0.26 6.95 0.03 3.54 3.84 -1.26 -1.76 114.94 126.02 2cla s ASN 154 Ca -0.04 1.17 -0.00 0.00 0.21 0.00 0.00 52.86 54.19 2cla s ASN 154 Cb -0.03 -2.32 -0.02 0.00 -0.55 0.00 0.00 41.25 38.32 2cla s ASN 154 CO 0.02 0.21 -0.03 0.72 -2.79 0.00 0.00 177.10 175.23 2cla s PHE 155 N -1.25 0.31 -0.13 0.43 -0.12 -1.26 -4.93 117.98 111.03 2cla s PHE 155 Ca 0.32 -0.63 0.15 0.00 -0.05 0.00 0.00 56.93 56.72 2cla s PHE 155 Cb -0.17 -0.23 -0.23 0.00 -0.63 0.00 0.00 43.02 41.76 2cla s PHE 155 CO 0.18 -0.22 0.39 -0.25 -0.05 0.00 0.00 175.22 175.27 2cla n ASP 156 N 1.32 1.35 -3.80 1.98 8.00 -1.26 -4.73 116.55 119.40 2cla n ASP 156 Ca -0.22 -0.14 -0.12 0.00 0.71 0.00 0.00 54.79 55.02 2cla n ASP 156 Cb 0.56 1.59 -0.09 0.00 -0.02 0.00 0.00 41.12 43.17 2cla n ASP 156 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2cla s SER 157 N -3.56 -0.08 -0.14 -2.24 0.15 -1.26 -4.75 113.70 101.82 2cla s SER 157 Ca -0.04 -0.12 -0.17 0.00 0.70 0.00 0.00 55.95 56.33 2cla s SER 157 Cb 0.10 0.29 0.04 0.00 -1.71 0.00 0.00 66.02 64.74 2cla s SER 157 CO 0.64 -0.48 0.45 0.12 1.20 0.00 0.00 173.24 175.17 2cla s PHE 158 N -1.77 -0.46 -0.24 3.44 5.36 -1.26 -5.13 117.98 117.92 2cla s PHE 158 Ca -0.11 1.06 -0.18 0.00 -0.96 0.00 0.00 56.93 56.73 2cla s PHE 158 Cb -0.04 0.18 0.07 0.00 -0.34 0.00 0.00 43.02 42.88 2cla s PHE 158 CO 0.01 -0.30 0.63 1.21 -1.46 0.00 0.00 175.22 175.31 2cla s ASN 159 N -0.14 -0.74 -0.02 6.13 3.84 -1.26 -4.80 114.94 117.95 2cla s ASN 159 Ca -0.03 1.31 -0.20 0.00 0.21 0.00 0.00 52.86 54.16 2cla s ASN 159 Cb -0.03 1.26 -0.05 0.00 -0.55 0.00 0.00 41.25 41.88 2cla s ASN 159 CO 0.02 -0.22 0.57 -0.76 -2.79 0.00 0.00 177.10 173.91 2cla s LEU 160 N 0.93 4.40 -0.40 3.21 1.43 -1.26 -5.01 118.68 121.99 2cla s LEU 160 Ca -0.05 1.10 -0.04 0.00 -1.03 0.00 0.00 54.13 54.11 2cla s LEU 160 Cb -0.05 -2.87 0.10 0.00 0.03 0.00 0.00 46.19 43.40 2cla s LEU 160 CO -0.08 0.11 0.19 0.20 0.23 0.00 0.00 176.35 177.00 2cla s ASN 161 N -0.17 5.30 -0.23 2.29 0.02 -1.26 -5.05 114.94 115.84 2cla s ASN 161 Ca 0.30 -1.81 -0.04 0.00 -1.02 0.00 0.00 52.86 50.28 2cla s ASN 161 Cb -0.18 -1.85 -0.01 0.00 0.02 0.00 0.00 41.25 39.23 2cla s ASN 161 CO 0.16 -0.51 -0.02 -0.69 0.02 0.00 0.00 177.10 176.06 2cla s VAL 162 N 1.22 3.52 0.03 1.60 1.01 -1.26 -5.05 120.40 121.48 2cla s VAL 162 Ca 0.05 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 2cla s VAL 162 Cb -0.23 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 2cla s VAL 162 CO -0.02 0.36 1.09 0.00 0.00 0.00 0.00 175.10 176.52 2cla n ALA 163 N 4.81 -0.14 -2.56 5.51 0.00 -1.26 -4.53 120.51 122.34 2cla n ALA 163 Ca -0.17 0.19 -0.31 0.00 0.00 0.00 0.00 53.44 53.14 2cla n ALA 163 Cb 0.50 0.34 -0.16 0.00 0.00 0.00 0.00 19.45 20.14 2cla n ALA 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2cla s ASN 164 N -3.56 3.17 -0.02 0.00 4.22 -1.26 -5.03 114.94 112.46 2cla s ASN 164 Ca -0.03 -0.46 0.04 0.00 -2.14 0.00 0.00 52.86 50.27 2cla s ASN 164 Cb 0.02 -0.68 0.05 0.00 1.28 0.00 0.00 41.25 41.93 2cla s ASN 164 CO 0.14 0.28 0.87 0.33 -2.04 0.00 0.00 177.10 176.67 2cla n PHE 165 N 2.72 0.00 -1.45 1.54 -0.00 -1.26 -5.10 117.46 113.90 2cla n PHE 165 Ca -0.17 -0.32 -0.57 0.00 -0.00 0.00 0.00 57.45 56.39 2cla n PHE 165 Cb 0.52 -0.05 -0.08 0.00 -0.00 0.00 0.00 39.48 39.87 2cla n PHE 165 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 2cla n THR 166 N -0.40 0.00 -3.12 -2.13 -1.04 -1.26 -2.42 114.28 103.91 2cla n THR 166 Ca 0.03 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.90 2cla n THR 166 Cb 0.50 -0.08 -0.02 0.00 -1.82 0.00 0.00 70.33 68.91 2cla n THR 166 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2cla n ASP 167 N 1.83 -1.56 -4.26 8.00 10.43 -1.26 -4.89 116.55 124.84 2cla n ASP 167 Ca 0.21 -0.05 -0.40 0.00 2.57 0.00 0.00 54.79 57.11 2cla n ASP 167 Cb 0.05 -1.42 -0.10 0.00 1.84 0.00 0.00 41.12 41.49 2cla n ASP 167 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 2cla s TYR 168 N -2.44 3.35 -1.90 1.24 6.14 -1.02 -4.56 117.35 118.17 2cla s TYR 168 Ca 0.26 -1.59 0.16 0.00 0.64 0.00 0.00 57.07 56.53 2cla s TYR 168 Cb -0.15 -3.00 0.19 0.00 0.42 0.00 0.00 41.96 39.42 2cla s TYR 168 CO 0.32 -0.86 1.08 1.19 0.64 0.00 0.00 175.55 177.91 2cla n PHE 169 N 4.90 0.13 -2.68 4.97 3.72 -1.26 -4.62 117.46 122.62 2cla n PHE 169 Ca -0.10 -0.10 -0.42 0.00 -0.05 0.00 0.00 57.45 56.79 2cla n PHE 169 Cb 0.43 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.93 2cla n PHE 169 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2cla s ALA 170 N -1.29 3.22 0.41 4.37 0.00 -1.26 -4.72 121.76 122.50 2cla s ALA 170 Ca 0.22 0.60 -0.26 0.00 0.00 0.00 0.00 51.96 52.51 2cla s ALA 170 Cb 0.14 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 2cla s ALA 170 CO 0.21 -0.17 1.41 -1.25 0.00 0.00 0.00 175.76 175.96 2cla s PRO 171 N 0.54 3.91 -0.20 0.00 0.04 -1.26 -4.84 135.00 133.19 2cla s PRO 171 Ca 0.50 2.39 -0.02 0.00 0.04 0.00 0.00 61.00 63.91 2cla s PRO 171 Cb -0.23 -2.79 -0.00 0.00 0.04 0.00 0.00 34.50 31.51 2cla s PRO 171 CO 0.29 -0.63 -0.08 0.42 0.04 0.00 0.00 177.00 177.04 2cla s ILE 172 N -1.19 3.06 -0.11 0.56 1.01 -1.05 -1.57 121.20 121.91 2cla s ILE 172 Ca 0.57 -0.60 0.03 0.00 0.00 0.00 0.00 60.65 60.64 2cla s ILE 172 Cb -0.43 -2.37 -0.00 0.00 0.01 0.00 0.00 42.46 39.67 2cla s ILE 172 CO 0.56 0.46 -0.21 -0.63 0.00 0.00 0.00 174.94 175.12 2cla s ILE 173 N 1.34 2.29 -0.06 2.92 1.01 -0.35 -1.87 121.20 126.49 2cla s ILE 173 Ca 0.04 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.80 2cla s ILE 173 Cb -0.14 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.43 2cla s ILE 173 CO -0.05 0.55 -0.16 -0.89 0.00 0.00 0.00 174.94 174.40 2cla s THR 174 N 0.43 1.36 0.19 2.92 2.01 -0.59 -1.59 115.64 120.37 2cla s THR 174 Ca -0.15 -0.65 0.09 0.00 0.31 0.00 0.00 61.69 61.29 2cla s THR 174 Cb -0.17 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.10 2cla s THR 174 CO 0.06 0.40 -0.06 -0.04 -0.69 0.00 0.00 174.62 174.29 2cla s MET 175 N 0.31 2.18 0.22 4.92 -1.94 -0.11 -1.05 119.30 123.84 2cla s MET 175 Ca -0.10 -1.24 0.01 0.00 -1.71 0.00 0.00 55.69 52.65 2cla s MET 175 Cb -0.14 -2.21 0.01 0.00 2.01 0.00 0.00 34.83 34.50 2cla s MET 175 CO 0.03 0.43 0.09 0.00 -0.01 0.00 0.00 175.02 175.57 2cla n ALA 176 N -0.11 0.28 -2.14 3.03 0.00 -0.94 -0.23 120.51 120.40 2cla n ALA 176 Ca -0.10 -0.94 -0.41 0.00 0.00 0.00 0.00 53.44 51.99 2cla n ALA 176 Cb 0.56 0.45 -0.04 0.00 0.00 0.00 0.00 19.45 20.41 2cla n ALA 176 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2cla s LYS 177 N -2.87 4.59 1.14 0.00 2.20 -0.72 -4.72 119.74 119.37 2cla s LYS 177 Ca 0.07 1.68 -0.17 0.00 -0.36 0.00 0.00 55.97 57.19 2cla s LYS 177 Cb -0.01 -3.30 0.26 0.00 -1.51 0.00 0.00 37.83 33.27 2cla s LYS 177 CO 0.05 0.06 1.11 1.52 -0.36 0.00 0.00 175.35 177.73 2cla s TYR 178 N -0.06 0.93 0.11 4.03 -0.85 -1.26 -4.41 117.35 115.84 2cla s TYR 178 Ca 0.50 0.60 -0.25 0.00 -0.52 0.00 0.00 57.07 57.40 2cla s TYR 178 Cb -0.28 -3.44 0.07 0.00 0.38 0.00 0.00 41.96 38.69 2cla s TYR 178 CO 0.34 -3.59 0.62 1.14 -1.52 0.00 0.00 175.55 172.53 2cla s GLN 179 N -5.32 1.22 -0.40 -3.49 -2.07 -0.95 -4.94 119.66 103.72 2cla s GLN 179 Ca 0.70 -0.29 -0.27 0.00 -1.82 0.00 0.00 55.36 53.67 2cla s GLN 179 Cb -0.12 0.57 0.02 0.00 -1.09 0.00 0.00 33.01 32.39 2cla s GLN 179 CO 0.56 -0.50 0.99 -1.14 -1.32 0.00 0.00 175.29 173.88 2cla s GLN 180 N -3.12 3.81 -0.71 9.60 2.00 -1.26 -1.61 119.66 128.36 2cla s GLN 180 Ca -0.02 0.59 0.04 0.00 -2.00 0.00 0.00 55.36 53.97 2cla s GLN 180 Cb -0.01 -3.83 0.17 0.00 0.80 0.00 0.00 33.01 30.14 2cla s GLN 180 CO -0.07 -1.07 0.51 -1.21 -0.50 0.00 0.00 175.29 172.95 2cla s GLU 181 N 3.74 2.54 4.91 1.67 8.01 0.14 -4.95 118.70 134.77 2cla s GLU 181 Ca 0.41 -3.22 0.00 0.00 0.01 0.00 0.00 54.97 52.17 2cla s GLU 181 Cb -0.11 -3.51 0.00 0.00 -4.31 0.00 0.00 34.13 26.20 2cla s GLU 181 CO 0.22 -1.26 0.00 0.41 0.01 0.00 0.00 175.26 174.64 2cla n GLY 182 N 2.22 1.74 0.22 -1.39 0.00 -1.26 -2.05 105.19 104.67 2cla n GLY 182 Ca 0.18 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.21 2cla n GLY 182 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cla n ASP 183 N 8.59 1.36 -4.75 1.61 2.03 -1.26 -4.97 116.55 119.16 2cla n ASP 183 Ca 0.00 -1.18 -0.29 0.00 0.52 0.00 0.00 54.79 53.84 2cla n ASP 183 Cb 0.00 0.73 -0.07 0.00 -0.72 0.00 0.00 41.12 41.06 2cla n ASP 183 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2cla s ARG 184 N -2.44 2.77 -0.23 -0.67 0.52 -0.87 -5.03 118.95 113.01 2cla s ARG 184 Ca 0.11 -0.79 -0.06 0.00 -0.52 0.00 0.00 55.73 54.48 2cla s ARG 184 Cb 0.15 -2.64 -0.02 0.00 0.52 0.00 0.00 34.95 32.96 2cla s ARG 184 CO 0.61 0.53 0.01 -1.17 0.02 0.00 0.00 175.30 175.31 2cla s LEU 185 N -2.56 3.21 0.10 2.53 2.96 -1.26 0.25 118.68 123.91 2cla s LEU 185 Ca 0.29 -0.26 0.10 0.00 -0.22 0.00 0.00 54.13 54.03 2cla s LEU 185 Cb -0.11 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2cla s LEU 185 CO 0.21 -0.00 -0.24 -0.76 -1.32 0.00 0.00 176.35 174.24 2cla s LEU 186 N 1.39 2.40 -0.18 -0.68 1.43 -0.64 0.25 118.68 122.65 2cla s LEU 186 Ca 0.05 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 2cla s LEU 186 Cb -0.15 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.77 2cla s LEU 186 CO 0.01 0.20 -0.13 -0.22 0.23 0.00 0.00 176.35 176.45 2cla s LEU 187 N -1.84 2.04 0.04 1.79 2.96 0.82 -2.23 118.68 122.26 2cla s LEU 187 Ca 0.14 -0.71 -0.31 0.00 -0.22 0.00 0.00 54.13 53.04 2cla s LEU 187 Cb -0.10 -1.24 -0.06 0.00 0.50 0.00 0.00 46.19 45.29 2cla s LEU 187 CO 0.06 -0.10 1.42 -2.84 -1.32 0.00 0.00 176.35 173.57 2cla s PRO 188 N 1.42 4.29 -0.10 0.98 0.02 -1.26 -0.98 135.00 139.37 2cla s PRO 188 Ca 0.02 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.06 2cla s PRO 188 Cb -0.15 -3.48 0.02 0.00 0.02 0.00 0.00 34.50 30.92 2cla s PRO 188 CO -0.10 -0.54 -0.08 -1.17 -0.33 0.00 0.00 177.00 174.78 2cla s LEU 189 N 2.02 1.25 -0.19 -5.54 0.20 -0.30 -2.22 118.68 113.89 2cla s LEU 189 Ca 0.65 -0.27 -0.11 0.00 0.69 0.00 0.00 54.13 55.09 2cla s LEU 189 Cb -0.34 -0.78 -0.05 0.00 -0.43 0.00 0.00 46.19 44.59 2cla s LEU 189 CO 0.28 -0.09 0.16 -0.55 -0.29 0.00 0.00 176.35 175.87 2cla s SER 190 N 1.45 6.26 -0.12 3.68 0.15 -0.21 -1.76 113.70 123.15 2cla s SER 190 Ca -0.00 0.29 0.03 0.00 0.70 0.00 0.00 55.95 56.96 2cla s SER 190 Cb -0.13 -2.11 0.01 0.00 -1.71 0.00 0.00 66.02 62.08 2cla s SER 190 CO -0.05 0.17 -0.20 -0.69 1.20 0.00 0.00 173.24 173.67 2cla s VAL 191 N 0.33 1.86 -0.16 4.45 1.01 0.40 -1.54 120.40 126.75 2cla s VAL 191 Ca 0.10 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2cla s VAL 191 Cb -0.11 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.64 2cla s VAL 191 CO -0.01 0.51 -0.16 -1.58 0.00 0.00 0.00 175.10 173.86 2cla s GLN 192 N 0.71 2.55 0.24 2.72 0.74 -0.78 -0.58 119.66 125.26 2cla s GLN 192 Ca -0.11 -0.66 0.01 0.00 0.05 0.00 0.00 55.36 54.66 2cla s GLN 192 Cb -0.16 -2.27 -0.04 0.00 1.10 0.00 0.00 33.01 31.65 2cla s GLN 192 CO 0.02 -0.22 0.18 0.14 -0.55 0.00 0.00 175.29 174.86 2cla s VAL 193 N 1.40 0.00 0.05 1.34 -7.23 -0.79 -2.53 120.40 112.64 2cla s VAL 193 Ca 0.05 -1.99 -0.13 0.00 -1.81 0.00 0.00 61.98 58.09 2cla s VAL 193 Cb -0.13 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.25 2cla s VAL 193 CO -0.11 0.00 0.43 -2.28 -0.31 0.00 0.00 175.10 172.83 2cla s HIS 194 N -3.93 3.67 -0.85 2.82 2.46 -1.26 -1.79 115.29 116.40 2cla s HIS 194 Ca 0.39 0.96 0.27 0.00 0.47 0.00 0.00 55.06 57.15 2cla s HIS 194 Cb 0.05 -2.27 0.96 0.00 -0.13 0.00 0.00 32.58 31.19 2cla s HIS 194 CO 0.17 0.57 1.80 1.58 -2.47 0.00 0.00 174.74 176.40 2cla n HIS 195 N 1.39 0.48 -0.06 3.88 -0.00 0.36 -2.18 115.22 119.08 2cla n HIS 195 Ca -0.11 0.14 -0.02 0.00 0.46 0.00 0.00 57.72 58.19 2cla n HIS 195 Cb 0.52 -0.71 0.23 0.00 -0.12 0.00 0.00 29.99 29.91 2cla n HIS 195 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2cla h ALA 196 N 2.75 1.25 0.00 1.57 0.00 -1.76 -3.34 119.26 119.72 2cla h ALA 196 Ca 0.00 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 2cla h ALA 196 Cb 0.63 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2cla h ALA 196 CO 0.00 0.51 -1.35 1.33 0.00 0.00 0.00 179.25 179.74 2cla n VAL 197 N -4.25 0.27 -4.40 0.00 0.24 -1.23 -4.04 118.33 104.92 2cla n VAL 197 Ca 0.02 -0.21 -0.21 0.00 -2.04 0.00 0.00 64.34 61.91 2cla n VAL 197 Cb 0.26 -0.50 -0.16 0.00 -1.47 0.00 0.00 33.84 31.97 2cla n VAL 197 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cla n ASN 199 N 3.32 3.09 -0.09 0.00 0.23 -1.26 -3.94 115.26 116.60 2cla n ASN 199 Ca -0.18 -3.04 0.09 0.00 -0.53 0.00 0.00 54.58 50.91 2cla n ASN 199 Cb 0.54 0.18 0.44 0.00 -2.08 0.00 0.00 39.78 38.86 2cla n ASN 199 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2cla h GLY 200 N 0.95 0.69 0.84 4.83 0.00 -1.99 -1.02 103.07 107.37 2cla h GLY 200 Ca -0.38 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 2cla h GLY 200 CO 0.62 0.16 -0.03 -2.75 0.00 0.00 0.00 176.54 174.54 2cla h PHE 201 N 0.54 -0.08 -0.59 5.60 3.04 -1.99 -1.90 116.94 121.56 2cla h PHE 201 Ca 0.26 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 62.16 2cla h PHE 201 Cb 0.34 0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.85 2cla h PHE 201 CO -0.00 0.10 0.17 0.45 -2.02 0.00 0.00 178.31 177.01 2cla h HIS 202 N -0.24 0.92 -0.18 0.41 -0.00 -1.86 0.28 115.15 114.46 2cla h HIS 202 Ca -0.01 -0.08 -0.05 0.00 -0.00 0.00 0.00 60.37 60.23 2cla h HIS 202 Cb 0.21 -0.27 -0.00 0.00 -0.00 0.00 0.00 27.41 27.35 2cla h HIS 202 CO -0.02 0.75 -0.09 0.28 -0.00 0.00 0.00 177.93 178.84 2cla h VAL 203 N 0.86 1.31 -0.94 2.45 2.07 -1.12 -2.14 116.25 118.75 2cla h VAL 203 Ca 0.19 -1.15 0.04 0.00 0.82 0.00 0.00 66.70 66.60 2cla h VAL 203 Cb 0.27 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 2cla h VAL 203 CO -0.01 0.35 0.61 0.00 0.02 0.00 0.00 177.57 178.54 2cla h ALA 204 N 0.69 1.25 -0.28 1.67 0.00 -1.04 -1.29 119.26 120.25 2cla h ALA 204 Ca 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2cla h ALA 204 Cb 0.58 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2cla h ALA 204 CO 0.03 0.46 -0.10 -0.09 0.00 0.00 0.00 179.25 179.55 2cla h ARG 205 N 1.17 0.47 -0.42 0.00 2.43 -0.34 0.15 114.38 117.84 2cla h ARG 205 Ca 0.38 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.35 2cla h ARG 205 Cb 0.03 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2cla h ARG 205 CO -0.13 0.57 -0.04 0.35 -1.51 0.00 0.00 179.97 179.21 2cla h PHE 206 N 0.44 0.84 -0.15 2.20 3.57 -0.58 -1.78 116.94 121.48 2cla h PHE 206 Ca 0.08 -0.16 -0.08 0.00 3.53 0.00 0.00 57.97 61.34 2cla h PHE 206 Cb 0.45 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.97 2cla h PHE 206 CO 0.01 0.85 -0.22 0.82 -2.23 0.00 0.00 178.31 177.54 2cla h ILE 207 N 0.59 1.36 -0.87 1.41 2.04 -1.05 0.34 117.51 121.33 2cla h ILE 207 Ca 0.11 -1.45 0.01 0.00 1.00 0.00 0.00 64.86 64.53 2cla h ILE 207 Cb 0.54 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.53 2cla h ILE 207 CO 0.03 0.43 0.57 0.78 0.00 0.00 0.00 178.15 179.96 2cla h ASN 208 N 0.03 1.00 -0.51 1.72 2.35 -0.71 -1.27 115.58 118.19 2cla h ASN 208 Ca 0.01 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 2cla h ASN 208 Cb 0.79 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 2cla h ASN 208 CO 0.05 0.73 0.02 -0.09 -1.65 0.00 0.00 177.43 176.49 2cla h ARG 209 N 1.18 0.88 -0.68 0.81 9.65 -1.20 -2.40 114.38 122.63 2cla h ARG 209 Ca 0.32 -0.27 -0.05 0.00 -1.10 0.00 0.00 59.98 58.87 2cla h ARG 209 Cb -0.13 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.34 2cla h ARG 209 CO -0.07 0.91 0.22 1.25 2.80 0.00 0.00 179.97 185.08 2cla h LEU 210 N 0.75 0.99 -0.79 3.80 5.85 -0.58 -1.84 115.31 123.48 2cla h LEU 210 Ca 0.15 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.69 2cla h LEU 210 Cb 0.50 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 2cla h LEU 210 CO 0.02 0.93 0.51 -0.61 -0.34 0.00 0.00 178.44 178.95 2cla h GLN 211 N 0.99 0.97 0.18 1.25 5.75 -1.14 0.11 115.11 123.21 2cla h GLN 211 Ca 0.22 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.67 2cla h GLN 211 Cb 0.29 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 2cla h GLN 211 CO -0.01 0.64 -0.18 1.49 -2.65 0.00 0.00 178.83 178.12 2cla h GLU 212 N 1.00 -0.38 -0.68 1.69 4.57 -1.19 -2.52 114.58 117.07 2cla h GLU 212 Ca 0.31 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2cla h GLU 212 Cb -0.01 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 2cla h GLU 212 CO -0.11 -0.25 0.37 -0.07 -1.18 0.00 0.00 179.01 177.77 2cla h LEU 213 N -0.40 0.84 -1.92 1.64 3.38 -1.11 -1.77 115.31 115.97 2cla h LEU 213 Ca 0.00 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2cla h LEU 213 Cb 0.38 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2cla h LEU 213 CO -0.05 0.68 -0.12 0.00 0.09 0.00 0.00 178.44 179.04 2cla n ASN 215 N -3.84 2.23 -4.65 0.00 3.02 -0.69 -2.94 115.26 108.39 2cla n ASN 215 Ca -0.02 -1.85 -0.27 0.00 -0.03 0.00 0.00 54.58 52.41 2cla n ASN 215 Cb 0.22 -0.19 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 2cla n ASN 215 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2cla s SER 216 N -1.38 4.06 0.59 6.41 0.01 -0.89 -5.01 113.70 117.48 2cla s SER 216 Ca 0.33 -1.25 -0.18 0.00 1.31 0.00 0.00 55.95 56.15 2cla s SER 216 Cb 0.18 -0.43 -0.03 0.00 0.21 0.00 0.00 66.02 65.94 2cla s SER 216 CO 0.25 -0.45 1.19 -0.54 0.41 0.00 0.00 173.24 174.10 2cla s LYS 217 N -3.76 2.99 0.01 12.44 3.01 -1.26 -4.96 119.74 128.20 2cla s LYS 217 Ca 0.37 1.76 -0.20 0.00 -1.01 0.00 0.00 55.97 56.88 2cla s LYS 217 Cb 0.07 -1.94 -0.22 0.00 -1.01 0.00 0.00 37.83 34.73 2cla s LYS 217 CO 0.19 -1.17 1.13 -0.07 0.51 0.00 0.00 175.35 175.94 2cla h LEU 218 N 0.84 0.50 0.00 3.17 3.38 -1.96 -3.51 115.31 117.72 2cla h LEU 218 Ca -0.50 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 56.75 2cla h LEU 218 Cb 1.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2cla h LEU 218 CO 0.55 1.15 0.00 2.29 0.09 0.00 0.00 178.44 182.52