#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cla n ASN 7 N 0.00 3.65 -3.66 3.17 2.04 -1.26 -4.88 115.26 114.32 1cla n ASN 7 Ca 0.00 -2.91 -0.10 0.00 -0.44 0.00 0.00 54.58 51.13 1cla n ASN 7 Cb 0.00 -0.71 -0.03 0.00 -2.53 0.00 0.00 39.78 36.51 1cla n ASN 7 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 1cla s TYR 8 N -1.83 -0.24 -0.02 -2.53 -0.85 -1.26 -1.56 117.35 109.04 1cla s TYR 8 Ca 0.32 -0.08 0.04 0.00 -0.52 0.00 0.00 57.07 56.83 1cla s TYR 8 Cb 0.26 0.46 -0.01 0.00 0.38 0.00 0.00 41.96 43.06 1cla s TYR 8 CO 0.06 -0.91 -0.15 0.95 -1.52 0.00 0.00 175.55 173.97 1cla s THR 9 N -3.84 1.24 -0.11 -3.49 -4.23 -0.31 -4.88 115.64 100.02 1cla s THR 9 Ca 0.07 -0.64 -0.29 0.00 -1.18 0.00 0.00 61.69 59.64 1cla s THR 9 Cb -0.01 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.74 1cla s THR 9 CO -0.05 0.36 1.58 -0.54 -0.54 0.00 0.00 174.62 175.42 1cla s LYS 10 N -0.16 4.11 0.21 3.99 1.02 -1.26 -1.63 119.74 126.02 1cla s LYS 10 Ca 0.02 1.98 -0.30 0.00 0.02 0.00 0.00 55.97 57.69 1cla s LYS 10 Cb -0.08 -3.96 -0.08 0.00 -0.52 0.00 0.00 37.83 33.19 1cla s LYS 10 CO 0.00 -0.92 1.05 0.12 -0.92 0.00 0.00 175.35 174.68 1cla s PHE 11 N 4.20 3.71 -0.96 3.18 5.36 0.44 -4.96 117.98 128.95 1cla s PHE 11 Ca 0.70 1.72 -0.24 0.00 -0.96 0.00 0.00 56.93 58.15 1cla s PHE 11 Cb -0.29 -3.18 0.00 0.00 -0.34 0.00 0.00 43.02 39.20 1cla s PHE 11 CO 0.27 -0.25 1.70 0.34 -1.46 0.00 0.00 175.22 175.82 1cla s ASP 12 N -0.56 5.81 0.12 6.13 3.68 -1.26 -4.84 116.67 125.74 1cla s ASP 12 Ca 0.46 -1.05 -0.08 0.00 2.13 0.00 0.00 52.55 54.01 1cla s ASP 12 Cb -0.29 -2.56 -0.12 0.00 -1.45 0.00 0.00 42.92 38.50 1cla s ASP 12 CO 0.35 -2.14 1.29 0.58 0.13 0.00 0.00 175.17 175.38 1cla h VAL 13 N 7.03 1.34 0.00 1.11 2.07 -1.93 -3.09 116.25 122.78 1cla h VAL 13 Ca 0.15 -2.27 -0.07 0.00 0.82 0.00 0.00 66.70 65.33 1cla h VAL 13 Cb 1.01 2.30 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 1cla h VAL 13 CO 1.32 0.69 -0.33 0.11 0.02 0.00 0.00 177.57 179.38 1cla h LYS 14 N 0.33 0.00 -0.53 1.57 6.56 -2.00 -3.16 116.57 119.35 1cla h LYS 14 Ca -0.08 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.51 1cla h LYS 14 Cb 1.55 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.21 1cla h LYS 14 CO 0.17 0.33 0.00 0.09 -2.06 0.00 0.00 179.45 177.98 1cla n ASN 15 N -3.84 3.42 -4.78 0.86 3.02 -1.24 -4.95 115.26 107.74 1cla n ASN 15 Ca -0.01 -1.99 -0.39 0.00 -0.03 0.00 0.00 54.58 52.15 1cla n ASN 15 Cb 0.40 -0.35 -0.06 0.00 -0.61 0.00 0.00 39.78 39.16 1cla n ASN 15 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1cla s TRP 16 N -1.01 3.89 0.33 3.10 -0.00 -1.17 -5.00 118.94 119.08 1cla s TRP 16 Ca 0.36 1.58 0.23 0.00 -0.00 0.00 0.00 56.10 58.26 1cla s TRP 16 Cb 0.19 -2.72 1.13 0.00 -0.00 0.00 0.00 33.47 32.06 1cla s TRP 16 CO 0.24 0.52 1.95 -0.39 -0.00 0.00 0.00 176.95 179.27 1cla h VAL 17 N 3.34 0.74 -0.60 5.86 -1.51 -1.92 -3.11 116.25 119.05 1cla h VAL 17 Ca -0.47 -0.88 -0.05 0.00 -1.23 0.00 0.00 66.70 64.07 1cla h VAL 17 Cb 1.21 1.54 -0.03 0.00 -2.13 0.00 0.00 31.29 31.88 1cla h VAL 17 CO 0.66 0.21 0.06 0.54 -1.23 0.00 0.00 177.57 177.80 1cla n ARG 18 N -3.69 4.61 0.06 5.19 1.74 -1.26 -4.64 116.66 118.67 1cla n ARG 18 Ca -0.01 -3.15 -0.03 0.00 -0.77 0.00 0.00 57.85 53.89 1cla n ARG 18 Cb 0.33 -2.25 0.20 0.00 -1.02 0.00 0.00 32.46 29.72 1cla n ARG 18 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 1cla h ARG 19 N 3.65 0.35 -0.20 5.56 0.11 -1.82 0.43 114.38 122.46 1cla h ARG 19 Ca 0.06 -0.16 -0.17 0.00 0.10 0.00 0.00 59.98 59.82 1cla h ARG 19 Cb 2.05 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 33.13 1cla h ARG 19 CO 0.54 0.67 -0.53 1.49 0.10 0.00 0.00 179.97 182.25 1cla h GLU 20 N 0.30 0.71 -0.48 0.08 4.81 -1.87 -3.08 114.58 115.06 1cla h GLU 20 Ca 0.03 -0.50 0.06 0.00 -0.13 0.00 0.00 59.36 58.82 1cla h GLU 20 Cb 0.78 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.19 1cla h GLU 20 CO 0.06 1.12 0.19 0.45 -0.73 0.00 0.00 179.01 180.10 1cla h HIS 21 N 0.42 0.33 0.23 0.92 3.86 -1.80 -0.26 115.15 118.85 1cla h HIS 21 Ca -0.01 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1cla h HIS 21 Cb 1.14 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 29.50 1cla h HIS 21 CO 0.09 0.13 -0.33 0.35 0.86 0.00 0.00 177.93 179.03 1cla h PHE 22 N 0.37 -0.89 -0.53 2.45 3.04 -0.96 -0.47 116.94 119.96 1cla h PHE 22 Ca 0.22 0.01 -0.11 0.00 3.98 0.00 0.00 57.97 62.08 1cla h PHE 22 Cb 0.21 0.36 -0.02 0.00 2.56 0.00 0.00 35.95 39.06 1cla h PHE 22 CO -0.14 -0.45 -0.09 1.49 -2.02 0.00 0.00 178.31 177.10 1cla h GLU 23 N -0.62 0.97 0.23 1.11 4.57 -1.44 -0.49 114.58 118.91 1cla h GLU 23 Ca 0.00 -0.34 0.01 0.00 -1.18 0.00 0.00 59.36 57.85 1cla h GLU 23 Cb 0.60 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 1cla h GLU 23 CO -0.12 1.01 -0.32 0.35 -1.18 0.00 0.00 179.01 178.75 1cla h PHE 24 N 0.87 -0.86 -0.01 0.92 3.04 -0.65 -1.62 116.94 118.63 1cla h PHE 24 Ca 0.14 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.10 1cla h PHE 24 Cb 0.63 0.35 0.00 0.00 2.56 0.00 0.00 35.95 39.49 1cla h PHE 24 CO 0.04 -0.44 -0.03 0.66 -2.02 0.00 0.00 178.31 176.52 1cla n TYR 25 N -5.43 0.00 -0.10 0.41 4.01 -0.22 0.77 117.16 116.61 1cla n TYR 25 Ca -0.08 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.56 1cla n TYR 25 Cb 0.33 -0.04 -0.15 0.00 -0.31 0.00 0.00 39.34 39.17 1cla n TYR 25 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1cla n ARG 26 N -0.53 0.75 0.00 -0.72 0.63 -0.20 -3.36 116.66 113.24 1cla n ARG 26 Ca 0.20 -0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.13 1cla n ARG 26 Cb 0.25 -1.51 0.00 0.00 0.45 0.00 0.00 32.46 31.65 1cla n ARG 26 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1cla n HIS 27 N -2.76 0.00 -0.04 -0.14 8.25 -0.63 -4.63 115.22 115.28 1cla n HIS 27 Ca -0.33 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.00 1cla n HIS 27 Cb 1.14 0.15 -0.09 0.00 1.12 0.00 0.00 29.99 32.31 1cla n HIS 27 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1cla h ARG 28 N 0.00 0.19 -2.47 -0.41 2.43 -1.08 -3.38 114.38 109.66 1cla h ARG 28 Ca 0.00 -0.11 -0.59 0.00 -0.81 0.00 0.00 59.98 58.47 1cla h ARG 28 Cb 0.56 0.01 -0.40 0.00 -0.42 0.00 0.00 29.97 29.72 1cla h ARG 28 CO 0.00 0.66 -0.85 -0.11 -1.51 0.00 0.00 179.97 178.15 1cla n LEU 29 N -4.67 1.02 -4.68 3.80 7.94 0.23 -5.02 117.00 115.62 1cla n LEU 29 Ca -0.07 -4.77 -0.42 0.00 -1.11 0.00 0.00 56.01 49.64 1cla n LEU 29 Cb 0.33 0.09 -0.03 0.00 0.53 0.00 0.00 43.42 44.34 1cla n LEU 29 CO 0.37 1.89 1.28 -2.84 -1.11 0.00 0.00 177.39 176.98 1cla s PRO 30 N -0.85 4.22 0.05 1.96 0.02 -1.25 -4.13 135.00 135.01 1cla s PRO 30 Ca 0.32 2.16 -0.28 0.00 0.02 0.00 0.00 61.00 63.23 1cla s PRO 30 Cb 0.05 -3.73 0.09 0.00 0.02 0.00 0.00 34.50 30.94 1cla s PRO 30 CO -0.16 -0.73 0.92 0.00 -0.33 0.00 0.00 177.00 176.70 1cla n GLY 32 N -0.32 3.64 3.35 0.00 0.00 -1.26 0.87 105.19 111.47 1cla n GLY 32 Ca -0.08 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.00 1cla n GLY 32 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1cla s PHE 33 N -2.42 -0.32 0.11 1.61 -0.12 0.31 -4.83 117.98 112.33 1cla s PHE 33 Ca 0.14 0.09 0.06 0.00 -0.05 0.00 0.00 56.93 57.17 1cla s PHE 33 Cb 0.01 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.70 1cla s PHE 33 CO 0.10 -0.72 -0.16 -1.54 -0.05 0.00 0.00 175.22 172.84 1cla s SER 34 N -2.64 2.10 -0.16 1.98 1.04 -1.26 -1.00 113.70 113.76 1cla s SER 34 Ca 0.01 -0.75 -0.14 0.00 0.48 0.00 0.00 55.95 55.56 1cla s SER 34 Cb 0.01 -0.09 0.04 0.00 0.10 0.00 0.00 66.02 66.08 1cla s SER 34 CO -0.10 -0.08 0.42 -1.48 0.98 0.00 0.00 173.24 172.97 1cla s LEU 35 N -2.20 0.34 -0.10 2.42 0.05 -0.74 -5.00 118.68 113.45 1cla s LEU 35 Ca 0.07 0.85 0.02 0.00 0.05 0.00 0.00 54.13 55.11 1cla s LEU 35 Cb -0.07 1.42 -0.01 0.00 -2.05 0.00 0.00 46.19 45.47 1cla s LEU 35 CO 0.03 -0.15 -0.16 -0.89 -0.55 0.00 0.00 176.35 174.63 1cla s THR 36 N 0.40 2.80 0.16 5.48 2.01 -1.26 -1.24 115.64 123.99 1cla s THR 36 Ca -0.01 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.27 1cla s THR 36 Cb -0.04 -2.13 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 1cla s THR 36 CO -0.01 0.55 -0.11 -0.55 -0.69 0.00 0.00 174.62 173.80 1cla s SER 37 N 0.05 1.98 -0.23 3.53 0.15 0.29 -4.93 113.70 114.54 1cla s SER 37 Ca -0.06 -1.01 -0.10 0.00 0.70 0.00 0.00 55.95 55.47 1cla s SER 37 Cb -0.15 -0.04 -0.05 0.00 -1.71 0.00 0.00 66.02 64.07 1cla s SER 37 CO 0.05 -0.29 0.15 -0.54 1.20 0.00 0.00 173.24 173.80 1cla s LYS 38 N -3.71 4.05 -0.16 5.44 1.02 -1.26 -0.95 119.74 124.18 1cla s LYS 38 Ca 0.18 -0.28 -0.15 0.00 0.02 0.00 0.00 55.97 55.74 1cla s LYS 38 Cb 0.02 -3.49 -0.04 0.00 -0.52 0.00 0.00 37.83 33.79 1cla s LYS 38 CO 0.02 0.09 0.34 0.42 -0.92 0.00 0.00 175.35 175.29 1cla s ILE 39 N 0.97 5.28 -0.51 2.17 -1.09 0.54 -4.90 121.20 123.66 1cla s ILE 39 Ca 0.07 0.64 -0.29 0.00 -2.23 0.00 0.00 60.65 58.84 1cla s ILE 39 Cb -0.13 -3.67 0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1cla s ILE 39 CO 0.04 0.36 1.18 -0.62 -1.23 0.00 0.00 174.94 174.67 1cla s ASP 40 N 0.56 6.54 -0.28 3.58 3.68 -1.26 -0.16 116.67 129.33 1cla s ASP 40 Ca 0.18 0.37 0.12 0.00 2.13 0.00 0.00 52.55 55.35 1cla s ASP 40 Cb -0.13 -2.55 0.64 0.00 -1.45 0.00 0.00 42.92 39.42 1cla s ASP 40 CO 0.05 -1.35 1.63 2.30 0.13 0.00 0.00 175.17 177.93 1cla n ILE 41 N 6.82 2.68 0.12 4.11 -5.35 0.11 -4.64 119.36 123.21 1cla n ILE 41 Ca 0.11 -1.94 -0.13 0.00 -0.27 0.00 0.00 62.75 60.52 1cla n ILE 41 Cb 0.49 -0.32 -0.07 0.00 -1.74 0.00 0.00 39.64 37.99 1cla n ILE 41 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1cla h THR 42 N 2.06 0.84 -0.40 7.28 2.02 -1.88 -2.31 112.91 120.52 1cla h THR 42 Ca 0.18 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 1cla h THR 42 Cb 1.95 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 69.18 1cla h THR 42 CO 0.52 0.00 0.15 0.74 0.37 0.00 0.00 175.52 177.31 1cla h THR 43 N -0.22 1.20 -0.92 3.16 2.02 -1.86 -3.13 112.91 113.16 1cla h THR 43 Ca -0.02 -0.62 0.03 0.00 0.77 0.00 0.00 66.41 66.57 1cla h THR 43 Cb 0.17 0.86 -0.05 0.00 -1.74 0.00 0.00 68.15 67.39 1cla h THR 43 CO 0.03 0.22 0.60 0.25 0.37 0.00 0.00 175.52 177.00 1cla h LEU 44 N 0.50 1.00 -0.32 2.58 5.85 -1.48 -2.08 115.31 121.36 1cla h LEU 44 Ca 0.13 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1cla h LEU 44 Cb 0.20 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1cla h LEU 44 CO -0.01 0.69 0.19 0.50 -0.34 0.00 0.00 178.44 179.48 1cla h LYS 45 N 1.17 0.39 0.47 1.25 1.63 -1.39 0.18 116.57 120.27 1cla h LYS 45 Ca 0.36 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.13 1cla h LYS 45 Cb -0.01 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.52 1cla h LYS 45 CO -0.11 0.26 -0.37 0.87 -3.45 0.00 0.00 179.45 176.65 1cla h LYS 46 N 0.40 -0.80 -0.89 1.90 6.56 -1.42 -0.78 116.57 121.53 1cla h LYS 46 Ca 0.12 0.05 0.10 0.00 -1.06 0.00 0.00 60.65 59.87 1cla h LYS 46 Cb -0.01 0.18 -0.07 0.00 -0.57 0.00 0.00 32.23 31.76 1cla h LYS 46 CO -0.05 -0.54 0.57 0.77 -2.06 0.00 0.00 179.45 178.15 1cla h SER 47 N -0.83 0.78 -0.27 0.86 0.02 -1.17 -1.38 113.55 111.56 1cla h SER 47 Ca -0.05 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1cla h SER 47 Cb 0.72 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1cla h SER 47 CO -0.01 0.45 0.06 -0.07 -1.14 0.00 0.00 176.83 176.11 1cla h LEU 48 N 0.85 0.42 -0.65 5.07 3.38 -0.37 -3.02 115.31 120.98 1cla h LEU 48 Ca 0.42 -0.24 0.13 0.00 0.09 0.00 0.00 57.88 58.27 1cla h LEU 48 Cb 0.46 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 40.97 1cla h LEU 48 CO -0.18 0.55 -0.17 0.44 0.09 0.00 0.00 178.44 179.17 1cla h ASP 49 N 0.26 -0.64 -0.10 -0.43 3.45 -0.11 0.11 116.42 118.96 1cla h ASP 49 Ca 0.08 0.20 -0.03 0.00 0.43 0.00 0.00 57.03 57.72 1cla h ASP 49 Cb 0.31 0.41 -0.02 0.00 -0.56 0.00 0.00 39.33 39.48 1cla h ASP 49 CO 0.00 -0.22 0.03 0.47 -1.57 0.00 0.00 179.24 177.95 1cla n ASP 50 N -5.45 2.18 -1.73 6.45 9.92 -0.67 -4.85 116.55 122.41 1cla n ASP 50 Ca 0.08 -2.16 -0.06 0.00 -0.53 0.00 0.00 54.79 52.12 1cla n ASP 50 Cb 0.34 -0.53 -0.02 0.00 -0.64 0.00 0.00 41.12 40.27 1cla n ASP 50 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1cla n SER 51 N 0.16 -0.42 -0.54 -2.24 3.41 0.37 -5.04 113.62 109.32 1cla n SER 51 Ca 0.05 -1.70 0.07 0.00 -0.26 0.00 0.00 58.87 57.03 1cla n SER 51 Cb 0.48 0.82 0.06 0.00 -0.26 0.00 0.00 64.21 65.32 1cla n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1cla n ALA 52 N -2.19 2.46 -1.57 7.33 0.00 -1.26 -4.95 120.51 120.33 1cla n ALA 52 Ca -0.05 -0.64 -0.32 0.00 0.00 0.00 0.00 53.44 52.43 1cla n ALA 52 Cb 0.21 -0.44 0.04 0.00 0.00 0.00 0.00 19.45 19.25 1cla n ALA 52 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1cla s TYR 53 N -1.08 2.89 0.15 0.00 1.51 -1.26 -5.06 117.35 114.49 1cla s TYR 53 Ca 0.16 1.51 0.07 0.00 -1.01 0.00 0.00 57.07 57.79 1cla s TYR 53 Cb 0.11 -3.02 -0.04 0.00 -0.11 0.00 0.00 41.96 38.90 1cla s TYR 53 CO 0.16 -1.34 -0.00 -1.59 -1.11 0.00 0.00 175.55 171.67 1cla s LYS 54 N -4.36 2.44 0.11 -0.62 0.00 -1.26 -4.89 119.74 111.15 1cla s LYS 54 Ca 0.63 -1.02 -0.34 0.00 0.00 0.00 0.00 55.97 55.24 1cla s LYS 54 Cb -0.17 -2.41 -0.14 0.00 0.00 0.00 0.00 37.83 35.11 1cla s LYS 54 CO 0.44 0.48 1.56 0.35 0.00 0.00 0.00 175.35 178.18 1cla h PHE 55 N 2.96 -1.55 0.27 1.78 3.57 -1.99 -2.77 116.94 119.21 1cla h PHE 55 Ca -0.47 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1cla h PHE 55 Cb 1.19 0.67 -0.03 0.00 2.79 0.00 0.00 35.95 40.57 1cla h PHE 55 CO 0.61 -0.59 -0.33 -0.92 -2.23 0.00 0.00 178.31 174.86 1cla h TYR 56 N -0.72 -0.88 -0.86 0.41 3.20 -1.99 -1.10 116.97 115.03 1cla h TYR 56 Ca 0.00 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.04 1cla h TYR 56 Cb 0.74 0.35 -0.10 0.00 1.54 0.00 0.00 36.73 39.27 1cla h TYR 56 CO -0.48 -0.46 0.43 -1.00 -1.64 0.00 0.00 178.16 175.01 1cla h PRO 57 N -0.65 0.57 -0.39 1.82 0.13 -2.00 -0.05 132.00 131.44 1cla h PRO 57 Ca -0.01 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 1cla h PRO 57 Cb 0.61 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.59 1cla h PRO 57 CO -0.10 0.38 0.19 0.28 -0.23 0.00 0.00 178.00 178.53 1cla h VAL 58 N 0.59 1.16 -0.54 1.56 2.07 -1.17 -0.29 116.25 119.63 1cla h VAL 58 Ca 0.48 -0.46 -0.09 0.00 0.82 0.00 0.00 66.70 67.46 1cla h VAL 58 Cb 0.72 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1cla h VAL 58 CO -0.39 0.17 0.00 0.24 0.02 0.00 0.00 177.57 177.62 1cla h MET 59 N 0.49 0.96 0.28 1.57 2.86 -0.08 0.26 114.93 121.26 1cla h MET 59 Ca 0.13 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 1cla h MET 59 Cb 0.10 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1cla h MET 59 CO -0.02 0.97 -0.28 0.82 1.06 0.00 0.00 176.91 179.46 1cla h ILE 60 N 0.84 0.41 -0.25 -1.22 2.04 -0.90 0.24 117.51 118.66 1cla h ILE 60 Ca 0.15 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 1cla h ILE 60 Cb 0.53 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 1cla h ILE 60 CO 0.03 0.00 -0.10 0.22 0.00 0.00 0.00 178.15 178.30 1cla h TYR 61 N -0.59 -0.23 -0.66 1.37 3.20 -0.77 -0.79 116.97 118.50 1cla h TYR 61 Ca -0.01 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1cla h TYR 61 Cb 0.54 0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 1cla h TYR 61 CO -0.18 -0.16 0.26 -0.07 -1.64 0.00 0.00 178.16 176.37 1cla h LEU 62 N -0.06 0.91 0.06 2.82 3.38 -0.84 0.06 115.31 121.65 1cla h LEU 62 Ca 0.13 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1cla h LEU 62 Cb 0.25 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1cla h LEU 62 CO -0.29 0.84 -0.03 0.40 0.09 0.00 0.00 178.44 179.45 1cla h ILE 63 N 0.93 0.98 -0.63 1.22 2.04 -0.80 -1.72 117.51 119.53 1cla h ILE 63 Ca 0.22 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 1cla h ILE 63 Cb 0.22 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1cla h ILE 63 CO -0.02 0.04 0.23 0.00 0.00 0.00 0.00 178.15 178.40 1cla h ALA 64 N 0.79 1.21 0.11 1.87 0.00 -1.10 -0.60 119.26 121.54 1cla h ALA 64 Ca -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1cla h ALA 64 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1cla h ALA 64 CO 0.01 0.57 -0.05 0.37 0.00 0.00 0.00 179.25 180.15 1cla h GLN 65 N 0.92 -0.15 -0.21 0.00 4.15 -0.83 -1.38 115.11 117.60 1cla h GLN 65 Ca 0.21 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.65 1cla h GLN 65 Cb 0.22 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 1cla h GLN 65 CO -0.01 -0.01 0.13 0.00 -1.93 0.00 0.00 178.83 177.01 1cla h ALA 66 N 0.62 0.27 -0.88 3.38 0.00 -0.79 -2.64 119.26 119.21 1cla h ALA 66 Ca -0.02 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.01 1cla h ALA 66 Cb 0.21 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.84 1cla h ALA 66 CO 0.03 -0.27 0.50 0.28 0.00 0.00 0.00 179.25 179.79 1cla h VAL 67 N 0.27 0.84 0.00 0.00 2.07 -1.07 -1.58 116.25 116.79 1cla h VAL 67 Ca 0.08 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1cla h VAL 67 Cb -0.02 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 1cla h VAL 67 CO -0.03 0.14 0.00 0.59 0.02 0.00 0.00 177.57 178.29 1cla n ASN 68 N -4.76 0.00 -0.01 0.57 3.02 -0.53 -2.74 115.26 110.81 1cla n ASN 68 Ca 0.16 -0.72 0.11 0.00 -0.03 0.00 0.00 54.58 54.11 1cla n ASN 68 Cb 0.36 -0.02 -0.16 0.00 -0.61 0.00 0.00 39.78 39.35 1cla n ASN 68 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1cla n GLN 69 N -1.02 0.58 -4.06 3.52 7.27 -0.60 -4.92 117.38 118.16 1cla n GLN 69 Ca 0.18 -0.17 -0.31 0.00 0.07 0.00 0.00 57.00 56.76 1cla n GLN 69 Cb 0.09 -1.52 -0.16 0.00 2.41 0.00 0.00 30.24 31.06 1cla n GLN 69 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1cla s PHE 70 N -3.46 2.47 0.26 3.69 0.40 -1.11 -5.05 117.98 115.18 1cla s PHE 70 Ca -0.06 -1.46 -0.02 0.00 -0.60 0.00 0.00 56.93 54.79 1cla s PHE 70 Cb 0.14 -1.74 0.49 0.00 0.51 0.00 0.00 43.02 42.42 1cla s PHE 70 CO 0.90 -0.74 1.77 -0.44 0.70 0.00 0.00 175.22 177.41 1cla h ASP 71 N 7.99 0.52 0.40 1.36 3.32 -1.91 -3.14 116.42 124.96 1cla h ASP 71 Ca -0.40 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 1cla h ASP 71 Cb 1.13 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.68 1cla h ASP 71 CO 0.57 0.24 -0.05 1.05 -1.72 0.00 0.00 179.24 179.33 1cla h GLU 72 N 0.63 0.00 -0.21 3.56 9.09 -1.94 -1.76 114.58 123.96 1cla h GLU 72 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.85 1cla h GLU 72 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 1cla h GLU 72 CO -0.34 0.05 0.00 1.28 0.05 0.00 0.00 179.01 180.04 1cla n LEU 73 N -3.33 2.02 -1.24 3.06 4.77 -1.19 -3.96 117.00 117.14 1cla n LEU 73 Ca -0.02 -0.85 0.02 0.00 -0.03 0.00 0.00 56.01 55.13 1cla n LEU 73 Cb 0.20 -0.13 0.11 0.00 -2.33 0.00 0.00 43.42 41.26 1cla n LEU 73 CO 0.26 0.42 0.20 0.54 -1.33 0.00 0.00 177.39 177.49 1cla n ARG 74 N 0.56 1.23 -3.56 3.23 1.74 -0.66 -4.52 116.66 114.68 1cla n ARG 74 Ca 0.17 -2.94 -0.27 0.00 -0.77 0.00 0.00 57.85 54.04 1cla n ARG 74 Cb 0.38 -1.10 -0.03 0.00 -1.02 0.00 0.00 32.46 30.70 1cla n ARG 74 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1cla s MET 75 N -2.15 3.54 0.16 5.56 -1.94 -1.23 -0.77 119.30 122.48 1cla s MET 75 Ca 0.37 -0.26 -0.24 0.00 -1.71 0.00 0.00 55.69 53.85 1cla s MET 75 Cb 0.38 -2.76 0.06 0.00 2.01 0.00 0.00 34.83 34.51 1cla s MET 75 CO -0.09 0.31 0.80 0.00 -0.01 0.00 0.00 175.02 176.03 1cla s ALA 76 N -1.99 -1.55 -0.21 3.03 0.00 -0.86 -4.44 121.76 115.74 1cla s ALA 76 Ca 0.40 0.24 -0.08 0.00 0.00 0.00 0.00 51.96 52.52 1cla s ALA 76 Cb -0.11 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 1cla s ALA 76 CO 0.30 -0.92 0.08 0.42 0.00 0.00 0.00 175.76 175.64 1cla s ILE 77 N -3.54 4.68 -0.15 0.00 -1.09 -1.25 -0.06 121.20 119.78 1cla s ILE 77 Ca 0.08 -0.06 -0.04 0.00 -2.23 0.00 0.00 60.65 58.40 1cla s ILE 77 Cb -0.03 -3.14 0.07 0.00 -1.58 0.00 0.00 42.46 37.78 1cla s ILE 77 CO -0.02 0.40 0.22 -0.75 -1.23 0.00 0.00 174.94 173.56 1cla s LYS 78 N 0.91 0.13 -1.14 2.79 2.20 0.83 -4.82 119.74 120.63 1cla s LYS 78 Ca 0.04 0.46 -0.07 0.00 -0.36 0.00 0.00 55.97 56.04 1cla s LYS 78 Cb -0.14 -0.61 0.01 0.00 -1.51 0.00 0.00 37.83 35.59 1cla s LYS 78 CO 0.03 -0.45 1.00 -0.25 -0.36 0.00 0.00 175.35 175.32 1cla n ASP 80 N 5.33 -5.66 -1.79 1.43 10.43 -1.26 -2.47 116.55 122.57 1cla n ASP 80 Ca -0.05 -0.46 -0.16 0.00 2.57 0.00 0.00 54.79 56.69 1cla n ASP 80 Cb 0.50 -4.33 -0.01 0.00 1.84 0.00 0.00 41.12 39.12 1cla n ASP 80 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1cla n ASP 81 N -2.32 -4.75 -4.16 -2.24 8.00 -1.26 -5.01 116.55 104.80 1cla n ASP 81 Ca 0.00 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.35 1cla n ASP 81 Cb 0.55 -3.87 -0.11 0.00 -0.02 0.00 0.00 41.12 37.67 1cla n ASP 81 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1cla s GLU 82 N -4.73 0.80 -0.36 -1.24 8.01 -1.03 -5.11 118.70 115.04 1cla s GLU 82 Ca 0.00 -1.02 -0.25 0.00 0.01 0.00 0.00 54.97 53.72 1cla s GLU 82 Cb 0.00 -0.65 0.01 0.00 -4.31 0.00 0.00 34.13 29.18 1cla s GLU 82 CO 0.00 0.13 0.85 -1.17 0.01 0.00 0.00 175.26 175.08 1cla s LEU 83 N -2.01 4.06 0.31 1.80 2.96 -1.26 -0.12 118.68 124.42 1cla s LEU 83 Ca 0.00 0.50 0.09 0.00 -0.22 0.00 0.00 54.13 54.51 1cla s LEU 83 Cb -0.07 -3.15 -0.05 0.00 0.50 0.00 0.00 46.19 43.42 1cla s LEU 83 CO 0.01 -0.78 -0.01 0.27 -1.32 0.00 0.00 176.35 174.52 1cla s ILE 84 N 3.27 2.82 -0.13 6.68 -4.36 0.91 -0.42 121.20 129.97 1cla s ILE 84 Ca 0.35 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.75 1cla s ILE 84 Cb -0.13 -2.75 0.02 0.00 1.25 0.00 0.00 42.46 40.85 1cla s ILE 84 CO 0.17 -0.27 -0.17 -0.69 0.24 0.00 0.00 174.94 174.23 1cla s VAL 85 N -2.47 1.66 0.19 8.37 1.01 -0.65 -2.03 120.40 126.49 1cla s VAL 85 Ca 0.33 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 1cla s VAL 85 Cb -0.02 -1.52 -0.08 0.00 0.00 0.00 0.00 36.38 34.76 1cla s VAL 85 CO 0.19 0.47 1.27 0.26 0.00 0.00 0.00 175.10 177.30 1cla s TRP 86 N 1.11 3.31 0.12 5.22 0.52 0.05 -1.16 118.94 128.12 1cla s TRP 86 Ca -0.03 1.28 -0.21 0.00 0.02 0.00 0.00 56.10 57.16 1cla s TRP 86 Cb -0.14 -3.55 -0.04 0.00 -1.15 0.00 0.00 33.47 28.59 1cla s TRP 86 CO -0.05 -1.67 1.70 -0.44 0.02 0.00 0.00 176.95 176.51 1cla h ASP 87 N 5.42 -0.24 -5.06 2.95 3.45 -1.63 -3.45 116.42 117.87 1cla h ASP 87 Ca -0.44 0.06 -0.10 0.00 0.43 0.00 0.00 57.03 56.97 1cla h ASP 87 Cb 1.21 0.13 -0.17 0.00 -0.56 0.00 0.00 39.33 39.95 1cla h ASP 87 CO 0.77 -0.10 -0.33 -0.55 -1.57 0.00 0.00 179.24 177.47 1cla s SER 88 N -5.16 -0.04 0.05 6.45 0.15 -1.26 -5.06 113.70 108.84 1cla s SER 88 Ca -0.14 -0.29 0.09 0.00 0.70 0.00 0.00 55.95 56.31 1cla s SER 88 Cb 0.10 0.32 -0.03 0.00 -1.71 0.00 0.00 66.02 64.70 1cla s SER 88 CO 0.68 -0.59 -0.24 0.68 1.20 0.00 0.00 173.24 174.97 1cla s VAL 89 N -2.59 1.96 -0.10 4.45 -7.23 -1.26 -4.87 120.40 110.76 1cla s VAL 89 Ca -0.05 -1.36 -0.03 0.00 -1.81 0.00 0.00 61.98 58.73 1cla s VAL 89 Cb -0.01 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.20 1cla s VAL 89 CO -0.04 0.26 0.02 -1.81 -0.31 0.00 0.00 175.10 173.23 1cla s ASP 90 N -1.32 5.38 0.28 4.85 1.01 -0.50 -4.61 116.67 121.76 1cla s ASP 90 Ca 0.10 0.17 -0.29 0.00 0.71 0.00 0.00 52.55 53.24 1cla s ASP 90 Cb -0.10 -1.59 -0.10 0.00 1.01 0.00 0.00 42.92 42.15 1cla s ASP 90 CO 0.02 0.36 1.19 -2.16 0.21 0.00 0.00 175.17 174.80 1cla s PRO 91 N -0.78 4.52 -0.19 8.23 0.04 -1.25 -2.55 135.00 143.01 1cla s PRO 91 Ca 0.12 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.13 1cla s PRO 91 Cb -0.12 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.29 1cla s PRO 91 CO 0.02 0.02 -0.19 -1.14 0.04 0.00 0.00 177.00 175.75 1cla s GLN 92 N -1.28 2.94 0.20 4.56 0.74 -0.16 -2.92 119.66 123.74 1cla s GLN 92 Ca 0.48 -0.86 0.08 0.00 0.05 0.00 0.00 55.36 55.11 1cla s GLN 92 Cb -0.35 -2.59 -0.05 0.00 1.10 0.00 0.00 33.01 31.13 1cla s GLN 92 CO 0.44 -0.23 -0.16 -0.59 -0.55 0.00 0.00 175.29 174.19 1cla s PHE 93 N 1.28 1.80 0.21 1.67 -0.12 0.32 -0.97 117.98 122.17 1cla s PHE 93 Ca 0.04 -0.52 -0.13 0.00 -0.05 0.00 0.00 56.93 56.28 1cla s PHE 93 Cb -0.13 -0.85 -0.07 0.00 -0.63 0.00 0.00 43.02 41.34 1cla s PHE 93 CO -0.12 0.39 0.59 0.95 -0.05 0.00 0.00 175.22 176.98 1cla s THR 94 N -2.66 4.84 -0.10 -4.49 -4.23 -0.97 -0.85 115.64 107.17 1cla s THR 94 Ca 0.21 0.75 0.00 0.00 -1.18 0.00 0.00 61.69 61.47 1cla s THR 94 Cb -0.03 -3.68 0.02 0.00 1.34 0.00 0.00 72.50 70.15 1cla s THR 94 CO 0.08 0.06 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.44 1cla s VAL 95 N -1.68 1.02 0.08 2.29 1.01 0.02 -4.81 120.40 118.33 1cla s VAL 95 Ca 0.44 -0.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.87 1cla s VAL 95 Cb -0.13 -1.02 -0.06 0.00 0.00 0.00 0.00 36.38 35.16 1cla s VAL 95 CO 0.20 0.36 0.71 0.12 0.00 0.00 0.00 175.10 176.49 1cla s PHE 96 N 1.48 3.79 -0.39 5.22 5.36 -1.26 -0.81 117.98 131.37 1cla s PHE 96 Ca 0.01 1.44 -0.06 0.00 -0.96 0.00 0.00 56.93 57.36 1cla s PHE 96 Cb -0.13 -2.72 0.08 0.00 -0.34 0.00 0.00 43.02 39.91 1cla s PHE 96 CO -0.06 0.41 0.19 -1.01 -1.46 0.00 0.00 175.22 173.29 1cla s HIS 97 N -0.56 3.39 0.46 10.12 3.76 -0.06 -4.97 115.29 127.43 1cla s HIS 97 Ca 0.35 -1.82 0.26 0.00 -0.15 0.00 0.00 55.06 53.70 1cla s HIS 97 Cb -0.21 -2.82 1.49 0.00 1.11 0.00 0.00 32.58 32.15 1cla s HIS 97 CO 0.22 -0.86 2.11 0.37 -0.85 0.00 0.00 174.74 175.73 1cla h GLN 98 N 8.22 0.00 -0.05 1.40 5.75 -1.97 0.18 115.11 128.64 1cla h GLN 98 Ca -0.20 0.00 -0.24 0.00 -0.15 0.00 0.00 58.65 58.06 1cla h GLN 98 Cb 1.07 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.63 1cla h GLN 98 CO 0.69 0.10 -0.93 0.93 -2.65 0.00 0.00 178.83 176.96 1cla h GLU 99 N 0.00 0.68 0.00 1.69 3.07 -1.95 -3.34 114.58 114.73 1cla h GLU 99 Ca -0.00 -0.66 -0.06 0.00 -0.50 0.00 0.00 59.36 58.14 1cla h GLU 99 Cb 0.25 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1cla h GLU 99 CO 0.01 1.26 -2.03 0.25 -1.40 0.00 0.00 179.01 177.10 1cla n THR 100 N -3.86 0.23 -2.39 1.13 -2.24 -1.12 -5.00 114.28 101.02 1cla n THR 100 Ca -0.09 -0.54 -0.12 0.00 -2.27 0.00 0.00 64.05 61.03 1cla n THR 100 Cb 0.83 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1cla n THR 100 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1cla n GLU 101 N -2.32 -1.59 -4.52 -0.78 1.02 0.63 -5.03 120.64 108.06 1cla n GLU 101 Ca -0.09 0.54 -0.25 0.00 -0.02 0.00 0.00 57.16 57.35 1cla n GLU 101 Cb 0.65 -4.65 -0.11 0.00 -0.02 0.00 0.00 31.44 27.32 1cla n GLU 101 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1cla s THR 102 N -2.69 1.96 0.29 2.62 -4.23 -1.21 -4.94 115.64 107.44 1cla s THR 102 Ca 0.06 -2.14 0.11 0.00 -1.18 0.00 0.00 61.69 58.55 1cla s THR 102 Cb -0.03 -2.66 -0.05 0.00 1.34 0.00 0.00 72.50 71.10 1cla s THR 102 CO 0.08 -0.18 -0.15 0.72 -0.54 0.00 0.00 174.62 174.54 1cla s PHE 103 N -2.79 2.36 0.25 3.99 -0.12 -1.26 -0.88 117.98 119.53 1cla s PHE 103 Ca 0.32 -0.36 0.04 0.00 -0.05 0.00 0.00 56.93 56.89 1cla s PHE 103 Cb 0.04 -1.10 -0.05 0.00 -0.63 0.00 0.00 43.02 41.28 1cla s PHE 103 CO 0.15 0.68 -0.01 -1.12 -0.05 0.00 0.00 175.22 174.87 1cla s SER 104 N -3.55 2.03 -0.15 1.98 0.01 0.01 -4.68 113.70 109.35 1cla s SER 104 Ca 0.31 -1.23 0.01 0.00 1.31 0.00 0.00 55.95 56.35 1cla s SER 104 Cb -0.03 -0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.19 1cla s SER 104 CO 0.16 -0.49 -0.17 0.00 0.41 0.00 0.00 173.24 173.14 1cla s ALA 105 N -3.34 2.02 0.31 1.44 0.00 -0.52 -0.80 121.76 120.87 1cla s ALA 105 Ca 0.29 -0.99 0.11 0.00 0.00 0.00 0.00 51.96 51.37 1cla s ALA 105 Cb 0.06 -1.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.08 1cla s ALA 105 CO 0.10 -0.26 -0.12 -0.51 0.00 0.00 0.00 175.76 174.97 1cla s LEU 106 N 1.23 2.74 0.03 0.00 1.43 -0.03 -4.39 118.68 119.68 1cla s LEU 106 Ca 0.01 -1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 52.04 1cla s LEU 106 Cb -0.14 -1.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 1cla s LEU 106 CO -0.08 -0.08 0.02 -0.94 0.23 0.00 0.00 176.35 175.50 1cla s SER 107 N -3.58 0.25 0.04 2.29 1.04 -1.26 -0.52 113.70 111.95 1cla s SER 107 Ca 0.32 -0.57 -0.14 0.00 0.48 0.00 0.00 55.95 56.03 1cla s SER 107 Cb -0.02 0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.28 1cla s SER 107 CO 0.16 -0.42 0.31 0.00 0.98 0.00 0.00 173.24 174.28 1cla s PRO 109 N -2.40 4.13 0.37 0.00 0.02 -1.26 -3.88 135.00 131.99 1cla s PRO 109 Ca -0.06 2.54 -0.23 0.00 0.02 0.00 0.00 61.00 63.27 1cla s PRO 109 Cb -0.01 -2.99 -0.10 0.00 0.02 0.00 0.00 34.50 31.41 1cla s PRO 109 CO -0.02 -0.53 0.93 -0.47 -0.33 0.00 0.00 177.00 176.57 1cla s TYR 110 N -0.83 3.47 -0.01 6.54 5.04 -1.26 -4.87 117.35 125.43 1cla s TYR 110 Ca 0.55 1.65 -0.05 0.00 -2.44 0.00 0.00 57.07 56.78 1cla s TYR 110 Cb -0.46 -2.85 -0.00 0.00 0.35 0.00 0.00 41.96 39.00 1cla s TYR 110 CO 0.58 0.04 0.09 0.45 -1.34 0.00 0.00 175.55 175.38 1cla s SER 111 N -1.95 0.03 0.22 4.32 0.15 -1.26 -5.03 113.70 110.18 1cla s SER 111 Ca 0.56 -0.13 0.04 0.00 0.70 0.00 0.00 55.95 57.12 1cla s SER 111 Cb -0.13 0.19 0.21 0.00 -1.71 0.00 0.00 66.02 64.58 1cla s SER 111 CO 0.18 -0.25 1.53 0.77 1.20 0.00 0.00 173.24 176.66 1cla h SER 112 N 4.88 0.28 -3.12 5.45 4.64 -2.00 -3.41 113.55 120.28 1cla h SER 112 Ca -0.29 -0.17 -0.57 0.00 -0.47 0.00 0.00 61.79 60.29 1cla h SER 112 Cb 1.20 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 63.16 1cla h SER 112 CO 0.42 0.85 0.98 -0.62 -0.87 0.00 0.00 176.83 177.58 1cla s ASP 113 N -6.90 6.66 0.23 4.97 2.15 -1.26 -4.94 116.67 117.58 1cla s ASP 113 Ca -0.04 1.24 -0.08 0.00 0.43 0.00 0.00 52.55 54.10 1cla s ASP 113 Cb 0.12 -2.54 0.21 0.00 -0.30 0.00 0.00 42.92 40.41 1cla s ASP 113 CO 0.80 -1.08 1.90 -0.29 -0.17 0.00 0.00 175.17 176.33 1cla h ILE 114 N 5.96 1.23 -0.78 4.11 2.10 -1.89 -1.87 117.51 126.37 1cla h ILE 114 Ca -0.26 -0.45 -0.04 0.00 1.08 0.00 0.00 64.86 65.18 1cla h ILE 114 Cb 1.10 -0.06 -0.04 0.00 -1.09 0.00 0.00 36.82 36.74 1cla h ILE 114 CO 1.03 0.23 0.33 0.44 -1.08 0.00 0.00 178.15 179.10 1cla h ASP 115 N 1.21 1.06 -0.36 2.19 3.45 -1.94 -1.41 116.42 120.61 1cla h ASP 115 Ca 0.32 -0.15 -0.12 0.00 0.43 0.00 0.00 57.03 57.52 1cla h ASP 115 Cb -0.11 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.37 1cla h ASP 115 CO -0.07 0.93 -0.20 -0.61 -1.57 0.00 0.00 179.24 177.72 1cla h GLN 116 N 1.13 0.84 0.04 3.56 5.75 -1.81 -2.56 115.11 122.07 1cla h GLN 116 Ca 0.26 -0.33 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 1cla h GLN 116 Cb 0.19 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.67 1cla h GLN 116 CO -0.02 0.97 -0.16 0.35 -2.65 0.00 0.00 178.83 177.31 1cla h PHE 117 N 0.74 -0.42 -0.88 3.99 3.57 -0.86 -1.62 116.94 121.46 1cla h PHE 117 Ca 0.10 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.73 1cla h PHE 117 Cb 0.72 0.18 -0.08 0.00 2.79 0.00 0.00 35.95 39.56 1cla h PHE 117 CO 0.04 -0.24 0.51 0.52 -2.23 0.00 0.00 178.31 176.91 1cla h MET 118 N -0.29 0.78 -0.44 1.11 2.86 -1.14 -0.45 114.93 117.37 1cla h MET 118 Ca 0.04 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1cla h MET 118 Cb 0.33 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1cla h MET 118 CO -0.12 0.51 0.28 0.28 1.06 0.00 0.00 176.91 178.92 1cla h VAL 119 N 0.80 1.10 0.46 -2.22 2.07 -1.21 -1.72 116.25 115.52 1cla h VAL 119 Ca 0.44 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.74 1cla h VAL 119 Cb 0.47 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1cla h VAL 119 CO -0.28 0.11 -0.22 0.78 0.02 0.00 0.00 177.57 177.97 1cla h ASN 120 N 0.58 -0.52 -0.12 0.57 2.35 -0.50 -2.33 115.58 115.61 1cla h ASN 120 Ca 0.16 0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 1cla h ASN 120 Cb -0.05 0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.42 1cla h ASN 120 CO -0.04 -0.36 -0.05 0.22 -1.65 0.00 0.00 177.43 175.54 1cla h TYR 121 N -0.62 -0.11 -0.69 1.19 3.20 -1.07 -0.91 116.97 117.95 1cla h TYR 121 Ca -0.06 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.76 1cla h TYR 121 Cb 0.47 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 1cla h TYR 121 CO -0.04 -0.08 0.21 -0.07 -1.64 0.00 0.00 178.16 176.54 1cla h LEU 122 N -0.03 1.01 0.54 2.82 3.38 -1.36 -0.71 115.31 120.96 1cla h LEU 122 Ca 0.07 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1cla h LEU 122 Cb 0.13 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.62 1cla h LEU 122 CO -0.15 0.95 -0.26 -1.28 0.09 0.00 0.00 178.44 177.80 1cla h SER 123 N 1.02 -0.61 -0.31 -0.43 0.87 -1.22 0.12 113.55 112.98 1cla h SER 123 Ca 0.22 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.72 1cla h SER 123 Cb 0.31 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 1cla h SER 123 CO -0.01 -0.39 0.04 0.58 -0.53 0.00 0.00 176.83 176.53 1cla h VAL 124 N -0.80 1.21 -0.23 2.23 2.07 -1.04 -1.53 116.25 118.16 1cla h VAL 124 Ca -0.07 -0.79 -0.07 0.00 0.82 0.00 0.00 66.70 66.59 1cla h VAL 124 Cb 0.59 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1cla h VAL 124 CO 0.12 0.28 -0.14 0.24 0.02 0.00 0.00 177.57 178.09 1cla h MET 125 N 0.60 0.38 0.38 1.57 2.07 -1.06 -2.43 114.93 116.44 1cla h MET 125 Ca 0.13 -0.10 -0.02 0.00 -2.07 0.00 0.00 59.70 57.64 1cla h MET 125 Cb 0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 30.01 1cla h MET 125 CO 0.01 0.53 -0.18 0.93 1.07 0.00 0.00 176.91 179.26 1cla h GLU 126 N 0.35 -0.49 0.00 1.72 5.08 0.06 -3.02 114.58 118.29 1cla h GLU 126 Ca 0.07 0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.38 1cla h GLU 126 Cb 0.47 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1cla h GLU 126 CO 0.03 -0.19 -0.40 -0.09 -1.00 0.00 0.00 179.01 177.36 1cla h ARG 127 N -0.79 0.00 0.00 2.33 2.43 -1.19 -3.37 114.38 113.79 1cla h ARG 127 Ca -0.05 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1cla h ARG 127 Cb 0.52 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.99 1cla h ARG 127 CO 0.08 0.40 -0.50 0.66 -1.51 0.00 0.00 179.97 179.10 1cla n TYR 128 N -3.88 0.00 -0.20 2.20 4.01 -0.93 -4.84 117.16 113.52 1cla n TYR 128 Ca -0.01 -0.54 0.01 0.00 -0.16 0.00 0.00 57.90 57.19 1cla n TYR 128 Cb 0.45 -0.12 0.11 0.00 -0.31 0.00 0.00 39.34 39.47 1cla n TYR 128 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 1cla h LYS 129 N 0.36 0.20 -0.44 -0.72 -0.00 -1.69 -1.65 116.57 112.63 1cla h LYS 129 Ca -0.05 -0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.59 1cla h LYS 129 Cb 1.37 -0.05 0.00 0.00 -0.00 0.00 0.00 32.23 33.55 1cla h LYS 129 CO 0.02 0.13 0.00 0.45 -0.00 0.00 0.00 179.45 180.06 1cla n SER 130 N -5.18 3.56 -4.53 7.07 2.88 -1.26 -4.94 113.62 111.22 1cla n SER 130 Ca 0.09 -2.26 -0.43 0.00 -1.33 0.00 0.00 58.87 54.94 1cla n SER 130 Cb 0.35 -0.38 -0.04 0.00 -0.75 0.00 0.00 64.21 63.38 1cla n SER 130 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1cla s ASP 131 N -1.15 6.38 0.00 -3.46 -1.08 -0.62 -4.91 116.67 111.83 1cla s ASP 131 Ca 0.35 -0.22 0.12 0.00 -0.52 0.00 0.00 52.55 52.27 1cla s ASP 131 Cb 0.21 -2.44 0.50 0.00 -1.46 0.00 0.00 42.92 39.74 1cla s ASP 131 CO 0.18 -1.17 1.35 0.35 0.52 0.00 0.00 175.17 176.41 1cla n THR 132 N 6.25 0.18 -1.37 1.71 -2.24 -1.26 -4.83 114.28 112.71 1cla n THR 132 Ca 0.03 -0.21 -0.32 0.00 -2.27 0.00 0.00 64.05 61.27 1cla n THR 132 Cb 0.48 0.08 0.09 0.00 -2.10 0.00 0.00 70.33 68.88 1cla n THR 132 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1cla s LYS 133 N -1.82 2.21 0.18 -0.78 1.02 -1.26 -4.91 119.74 114.37 1cla s LYS 133 Ca 0.20 1.44 -0.11 0.00 0.02 0.00 0.00 55.97 57.52 1cla s LYS 133 Cb 0.10 -1.87 0.07 0.00 -0.52 0.00 0.00 37.83 35.61 1cla s LYS 133 CO 0.15 -1.72 1.68 1.25 -0.92 0.00 0.00 175.35 175.80 1cla h LEU 134 N -0.68 0.94 -6.77 3.17 5.85 -1.89 -3.35 115.31 112.57 1cla h LEU 134 Ca -0.45 -0.24 -0.61 0.00 0.84 0.00 0.00 57.88 57.42 1cla h LEU 134 Cb 1.26 -0.25 -0.40 0.00 0.37 0.00 0.00 40.66 41.64 1cla h LEU 134 CO 0.50 0.93 -0.75 -0.36 -0.34 0.00 0.00 178.44 178.42 1cla s PHE 135 N -5.29 2.46 0.22 1.25 0.40 -1.26 -1.44 117.98 114.33 1cla s PHE 135 Ca -0.12 -2.88 -0.08 0.00 -0.60 0.00 0.00 56.93 53.25 1cla s PHE 135 Cb 0.13 -1.92 0.35 0.00 0.51 0.00 0.00 43.02 42.09 1cla s PHE 135 CO 0.82 -0.67 1.73 -1.35 0.70 0.00 0.00 175.22 176.45 1cla h PRO 136 N 5.53 0.38 0.00 0.24 0.11 -1.77 -1.92 132.00 134.57 1cla h PRO 136 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1cla h PRO 136 Cb 0.82 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1cla h PRO 136 CO 0.56 0.25 0.00 1.96 -0.21 0.00 0.00 178.00 180.56 1cla h GLN 137 N 0.39 0.00 0.00 1.05 4.20 -1.95 -3.50 115.11 115.30 1cla h GLN 137 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 1cla h GLN 137 Cb 0.49 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.27 1cla h GLN 137 CO -0.36 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.21 1cla n GLY 138 N 0.24 0.23 3.74 3.46 0.00 -0.73 -5.01 105.19 107.11 1cla n GLY 138 Ca 0.02 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.75 1cla n GLY 138 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cla s VAL 139 N 0.00 2.29 -0.01 1.61 1.01 -1.26 -4.85 120.40 119.19 1cla s VAL 139 Ca 0.00 0.18 -0.27 0.00 0.00 0.00 0.00 61.98 61.89 1cla s VAL 139 Cb 0.00 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 1cla s VAL 139 CO 0.00 -0.03 0.86 -0.89 0.00 0.00 0.00 175.10 175.04 1cla s THR 140 N -1.46 4.89 0.45 3.92 2.01 -1.26 -5.00 115.64 119.19 1cla s THR 140 Ca 0.79 1.81 -0.23 0.00 0.31 0.00 0.00 61.69 64.37 1cla s THR 140 Cb -0.35 -4.21 -0.09 0.00 0.01 0.00 0.00 72.50 67.86 1cla s THR 140 CO 0.38 0.22 1.04 -2.65 -0.69 0.00 0.00 174.62 172.92 1cla n PRO 141 N 3.67 1.37 -0.23 4.92 -0.01 -1.26 -4.89 135.00 138.57 1cla n PRO 141 Ca 0.03 0.49 -0.08 0.00 -0.01 0.00 0.00 63.50 63.93 1cla n PRO 141 Cb 0.51 -2.12 0.04 0.00 -0.01 0.00 0.00 33.50 31.91 1cla n PRO 141 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 175.50 176.42 1cla h GLU 142 N 1.44 1.07 -5.26 -0.52 5.08 -2.00 -3.34 114.58 111.06 1cla h GLU 142 Ca -0.46 -0.27 -0.69 0.00 -1.00 0.00 0.00 59.36 56.93 1cla h GLU 142 Cb 1.33 -0.13 -0.14 0.00 0.50 0.00 0.00 28.75 30.31 1cla h GLU 142 CO 0.56 0.97 1.43 0.54 -1.00 0.00 0.00 179.01 181.52 1cla s ASN 143 N -6.42 6.83 0.22 1.42 4.22 -1.26 -4.96 114.94 114.99 1cla s ASN 143 Ca -0.12 -2.41 0.00 0.00 -2.14 0.00 0.00 52.86 48.19 1cla s ASN 143 Cb 0.14 -2.46 -0.05 0.00 1.28 0.00 0.00 41.25 40.16 1cla s ASN 143 CO 0.84 -1.03 0.10 -1.38 -2.04 0.00 0.00 177.10 173.59 1cla s HIS 144 N 2.93 1.33 0.03 1.54 -3.43 -1.25 -1.41 115.29 115.03 1cla s HIS 144 Ca 0.43 -1.26 0.03 0.00 -0.80 0.00 0.00 55.06 53.47 1cla s HIS 144 Cb -0.01 -0.73 -0.02 0.00 -1.43 0.00 0.00 32.58 30.39 1cla s HIS 144 CO -0.02 -0.46 -0.10 -0.48 -2.00 0.00 0.00 174.74 171.68 1cla s LEU 145 N -3.23 2.16 -0.15 5.38 2.34 -1.06 -4.81 118.68 119.30 1cla s LEU 145 Ca 0.37 -0.39 -0.05 0.00 0.06 0.00 0.00 54.13 54.11 1cla s LEU 145 Cb 0.07 -0.37 -0.04 0.00 -0.56 0.00 0.00 46.19 45.30 1cla s LEU 145 CO 0.12 -0.04 0.03 0.20 -1.06 0.00 0.00 176.35 175.60 1cla s ASN 146 N -1.02 5.40 -0.07 1.48 -0.87 -1.07 -0.99 114.94 117.80 1cla s ASN 146 Ca -0.02 0.07 0.02 0.00 -1.57 0.00 0.00 52.86 51.36 1cla s ASN 146 Cb -0.07 -1.82 0.01 0.00 -0.02 0.00 0.00 41.25 39.35 1cla s ASN 146 CO 0.01 0.23 -0.11 -0.63 -2.57 0.00 0.00 177.10 174.02 1cla s ILE 147 N 0.01 1.10 0.14 0.60 1.01 -0.14 -0.36 121.20 123.55 1cla s ILE 147 Ca 0.04 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.28 1cla s ILE 147 Cb -0.12 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 1cla s ILE 147 CO 0.01 0.35 -0.06 0.00 0.00 0.00 0.00 174.94 175.24 1cla s ALA 148 N 0.79 1.29 -0.03 9.38 0.00 -0.67 -2.29 121.76 130.22 1cla s ALA 148 Ca -0.12 -1.48 -0.02 0.00 0.00 0.00 0.00 51.96 50.34 1cla s ALA 148 Cb -0.15 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.20 1cla s ALA 148 CO 0.02 -0.20 0.07 0.00 0.00 0.00 0.00 175.76 175.65 1cla s ALA 149 N -3.51 -0.14 -0.71 0.00 0.00 -1.26 -1.65 121.76 114.50 1cla s ALA 149 Ca 0.17 0.27 0.05 0.00 0.00 0.00 0.00 51.96 52.45 1cla s ALA 149 Cb 0.04 -0.17 0.18 0.00 0.00 0.00 0.00 23.12 23.17 1cla s ALA 149 CO -0.00 -0.06 0.54 1.28 0.00 0.00 0.00 175.76 177.52 1cla n LEU 150 N 3.37 3.16 0.04 0.00 4.32 0.15 -4.96 117.00 123.09 1cla n LEU 150 Ca -0.16 -5.24 0.10 0.00 -0.02 0.00 0.00 56.01 50.68 1cla n LEU 150 Cb 0.57 -0.76 0.43 0.00 -1.62 0.00 0.00 43.42 42.05 1cla n LEU 150 CO 0.23 1.79 0.83 -0.81 -1.22 0.00 0.00 177.39 178.21 1cla n PRO 151 N 1.82 0.07 0.00 3.23 -0.04 -1.26 -1.92 135.00 136.90 1cla n PRO 151 Ca 0.21 0.22 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 1cla n PRO 151 Cb 0.36 -1.61 0.46 0.00 -0.04 0.00 0.00 33.50 32.67 1cla n PRO 151 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1cla n TRP 152 N -1.74 0.00 -3.54 0.54 8.01 -1.26 -4.39 117.44 115.06 1cla n TRP 152 Ca 0.04 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.06 1cla n TRP 152 Cb 0.25 -0.21 -0.06 0.00 -2.01 0.00 0.00 31.31 29.28 1cla n TRP 152 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 1cla s VAL 153 N -2.65 0.00 0.05 -0.99 0.11 -1.25 -5.00 120.40 110.67 1cla s VAL 153 Ca 0.22 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.20 1cla s VAL 153 Cb 0.19 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.99 1cla s VAL 153 CO 0.54 0.00 0.32 0.21 -3.33 0.00 0.00 175.10 172.85 1cla s ASN 154 N -1.00 6.54 0.04 3.54 3.84 -1.26 -1.74 114.94 124.89 1cla s ASN 154 Ca -0.09 0.63 -0.06 0.00 0.21 0.00 0.00 52.86 53.55 1cla s ASN 154 Cb -0.01 -2.11 -0.01 0.00 -0.55 0.00 0.00 41.25 38.57 1cla s ASN 154 CO 0.08 0.20 0.12 0.72 -2.79 0.00 0.00 177.10 175.43 1cla s PHE 155 N -1.38 0.16 -0.04 0.43 -0.12 -1.26 -4.94 117.98 110.82 1cla s PHE 155 Ca 0.31 -0.43 0.21 0.00 -0.05 0.00 0.00 56.93 56.97 1cla s PHE 155 Cb -0.13 -0.11 -0.32 0.00 -0.63 0.00 0.00 43.02 41.82 1cla s PHE 155 CO 0.18 -0.37 0.46 -0.25 -0.05 0.00 0.00 175.22 175.19 1cla n ASP 156 N 0.81 0.28 -3.71 1.98 8.00 -1.26 -4.75 116.55 117.91 1cla n ASP 156 Ca -0.19 -0.02 -0.14 0.00 0.71 0.00 0.00 54.79 55.15 1cla n ASP 156 Cb 0.58 1.93 -0.08 0.00 -0.02 0.00 0.00 41.12 43.54 1cla n ASP 156 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1cla s SER 157 N -4.36 -0.28 -0.05 -2.24 1.04 -1.26 -4.77 113.70 101.77 1cla s SER 157 Ca -0.07 0.19 -0.04 0.00 0.48 0.00 0.00 55.95 56.50 1cla s SER 157 Cb 0.13 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.64 1cla s SER 157 CO 0.86 -0.50 0.13 0.12 0.98 0.00 0.00 173.24 174.82 1cla s PHE 158 N -1.45 -0.14 -0.09 5.02 5.36 -1.26 -5.11 117.98 120.32 1cla s PHE 158 Ca -0.12 0.36 -0.06 0.00 -0.96 0.00 0.00 56.93 56.15 1cla s PHE 158 Cb -0.04 0.01 0.04 0.00 -0.34 0.00 0.00 43.02 42.69 1cla s PHE 158 CO 0.04 -0.09 0.22 1.21 -1.46 0.00 0.00 175.22 175.14 1cla s ASN 159 N 0.36 -0.22 -0.23 6.13 3.84 -1.26 -4.82 114.94 118.75 1cla s ASN 159 Ca -0.02 0.45 -0.21 0.00 0.21 0.00 0.00 52.86 53.29 1cla s ASN 159 Cb -0.04 0.38 -0.02 0.00 -0.55 0.00 0.00 41.25 41.02 1cla s ASN 159 CO -0.01 -0.13 0.64 -0.76 -2.79 0.00 0.00 177.10 174.04 1cla s LEU 160 N 0.86 4.10 -0.43 3.21 1.43 -1.26 -5.05 118.68 121.54 1cla s LEU 160 Ca -0.06 0.78 -0.13 0.00 -1.03 0.00 0.00 54.13 53.69 1cla s LEU 160 Cb -0.08 -2.89 0.06 0.00 0.03 0.00 0.00 46.19 43.31 1cla s LEU 160 CO -0.05 -0.33 0.32 0.20 0.23 0.00 0.00 176.35 176.72 1cla s ASN 161 N 1.34 5.98 -0.20 2.29 -0.87 -1.26 -5.06 114.94 117.15 1cla s ASN 161 Ca 0.28 -1.22 -0.06 0.00 -1.57 0.00 0.00 52.86 50.29 1cla s ASN 161 Cb -0.16 -2.12 -0.03 0.00 -0.02 0.00 0.00 41.25 38.93 1cla s ASN 161 CO 0.09 -0.54 0.02 -0.69 -2.57 0.00 0.00 177.10 173.41 1cla s VAL 162 N 1.59 4.14 0.42 1.60 1.01 -1.26 -5.03 120.40 122.88 1cla s VAL 162 Ca 0.04 -0.25 0.11 0.00 0.00 0.00 0.00 61.98 61.87 1cla s VAL 162 Cb -0.22 -2.88 0.30 0.00 0.00 0.00 0.00 36.38 33.58 1cla s VAL 162 CO 0.06 0.42 2.02 0.00 0.00 0.00 0.00 175.10 177.61 1cla h ALA 163 N 7.41 1.87 -2.33 5.51 0.00 -2.08 -3.40 119.26 126.23 1cla h ALA 163 Ca -0.36 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.27 1cla h ALA 163 Cb 1.18 -0.12 -0.34 0.00 0.00 0.00 0.00 17.79 18.51 1cla h ALA 163 CO 0.62 0.06 -0.57 -0.80 0.00 0.00 0.00 179.25 178.56 1cla s ASN 164 N -6.48 0.96 -0.02 0.00 0.02 -1.26 -5.01 114.94 103.14 1cla s ASN 164 Ca -0.08 -0.04 0.04 0.00 -1.02 0.00 0.00 52.86 51.76 1cla s ASN 164 Cb 0.18 0.64 0.05 0.00 0.02 0.00 0.00 41.25 42.15 1cla s ASN 164 CO 0.74 -0.31 1.01 2.22 0.02 0.00 0.00 177.10 180.78 1cla n PHE 165 N 5.34 0.00 -1.50 2.20 1.16 -1.26 -5.06 117.46 118.33 1cla n PHE 165 Ca -0.05 -0.57 -0.52 0.00 -1.87 0.00 0.00 57.45 54.43 1cla n PHE 165 Cb 0.50 -0.07 -0.05 0.00 -1.61 0.00 0.00 39.48 38.25 1cla n PHE 165 CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 1cla n THR 166 N -0.65 0.85 -1.62 1.97 -1.04 -1.26 -2.55 114.28 109.99 1cla n THR 166 Ca 0.03 -0.21 -0.13 0.00 -2.04 0.00 0.00 64.05 61.69 1cla n THR 166 Cb 0.33 -0.30 -0.05 0.00 -1.82 0.00 0.00 70.33 68.50 1cla n THR 166 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1cla n ASP 167 N 1.83 -3.61 -4.44 8.00 10.43 -1.26 -4.95 116.55 122.55 1cla n ASP 167 Ca 0.18 0.29 -0.41 0.00 2.57 0.00 0.00 54.79 57.42 1cla n ASP 167 Cb 0.18 -3.30 -0.11 0.00 1.84 0.00 0.00 41.12 39.74 1cla n ASP 167 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1cla s TYR 168 N -2.24 3.23 -2.05 1.24 5.04 -1.06 -4.61 117.35 116.91 1cla s TYR 168 Ca 0.00 -0.64 0.17 0.00 -2.44 0.00 0.00 57.07 54.15 1cla s TYR 168 Cb 0.00 -2.49 0.14 0.00 0.35 0.00 0.00 41.96 39.96 1cla s TYR 168 CO 0.00 -0.55 1.04 1.19 -1.34 0.00 0.00 175.55 175.88 1cla n PHE 169 N 5.07 0.02 -2.44 4.97 3.72 -1.26 -4.72 117.46 122.83 1cla n PHE 169 Ca -0.12 -0.02 -0.41 0.00 -0.05 0.00 0.00 57.45 56.85 1cla n PHE 169 Cb 0.47 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.98 1cla n PHE 169 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1cla s ALA 170 N -1.37 3.40 0.44 4.37 0.00 -1.26 -4.67 121.76 122.68 1cla s ALA 170 Ca 0.20 0.88 -0.25 0.00 0.00 0.00 0.00 51.96 52.79 1cla s ALA 170 Cb 0.14 -3.39 -0.08 0.00 0.00 0.00 0.00 23.12 19.79 1cla s ALA 170 CO 0.21 -0.32 1.30 -1.25 0.00 0.00 0.00 175.76 175.70 1cla s PRO 171 N -0.10 3.79 -0.24 0.00 0.04 -1.26 -4.88 135.00 132.35 1cla s PRO 171 Ca 0.52 2.12 -0.06 0.00 0.04 0.00 0.00 61.00 63.63 1cla s PRO 171 Cb -0.31 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.60 1cla s PRO 171 CO 0.35 -0.63 0.01 0.42 0.04 0.00 0.00 177.00 177.19 1cla s ILE 172 N -1.31 3.83 -0.05 0.56 1.01 -0.40 -2.60 121.20 122.23 1cla s ILE 172 Ca 0.60 -0.35 0.06 0.00 0.00 0.00 0.00 60.65 60.97 1cla s ILE 172 Cb -0.37 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 1cla s ILE 172 CO 0.47 0.37 -0.23 -0.63 0.00 0.00 0.00 174.94 174.92 1cla s ILE 173 N 1.54 2.23 -0.04 2.92 1.01 0.51 -1.04 121.20 128.34 1cla s ILE 173 Ca 0.06 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.71 1cla s ILE 173 Cb -0.15 -1.82 0.02 0.00 0.01 0.00 0.00 42.46 40.53 1cla s ILE 173 CO 0.00 0.57 -0.04 -0.89 0.00 0.00 0.00 174.94 174.58 1cla s THR 174 N -0.27 0.50 0.07 2.92 2.01 0.24 -1.67 115.64 119.44 1cla s THR 174 Ca -0.00 -0.13 0.05 0.00 0.31 0.00 0.00 61.69 61.92 1cla s THR 174 Cb -0.13 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 1cla s THR 174 CO 0.03 0.21 -0.06 -0.04 -0.69 0.00 0.00 174.62 174.07 1cla s MET 175 N 0.75 2.39 0.54 4.92 -1.94 -0.66 -0.62 119.30 124.68 1cla s MET 175 Ca -0.10 -0.88 0.04 0.00 -1.71 0.00 0.00 55.69 53.05 1cla s MET 175 Cb -0.13 -2.44 0.03 0.00 2.01 0.00 0.00 34.83 34.30 1cla s MET 175 CO 0.00 0.54 0.30 0.00 -0.01 0.00 0.00 175.02 175.85 1cla s ALA 176 N -1.19 4.37 0.22 3.03 0.00 -0.96 0.31 121.76 127.55 1cla s ALA 176 Ca 0.22 -0.98 -0.31 0.00 0.00 0.00 0.00 51.96 50.89 1cla s ALA 176 Cb -0.11 -0.53 -0.10 0.00 0.00 0.00 0.00 23.12 22.38 1cla s ALA 176 CO 0.14 -0.33 1.52 0.21 0.00 0.00 0.00 175.76 177.29 1cla s LYS 177 N -4.18 4.22 0.79 0.00 2.20 -0.71 -4.63 119.74 117.43 1cla s LYS 177 Ca 0.26 2.37 -0.12 0.00 -0.36 0.00 0.00 55.97 58.12 1cla s LYS 177 Cb -0.01 -3.11 0.06 0.00 -1.51 0.00 0.00 37.83 33.26 1cla s LYS 177 CO 0.16 -0.53 1.12 1.52 -0.36 0.00 0.00 175.35 177.26 1cla s TYR 178 N 0.44 2.96 -0.10 4.03 -0.85 -1.26 -4.40 117.35 118.17 1cla s TYR 178 Ca 0.64 1.01 -0.30 0.00 -0.52 0.00 0.00 57.07 57.90 1cla s TYR 178 Cb -0.44 -3.20 0.08 0.00 0.38 0.00 0.00 41.96 38.78 1cla s TYR 178 CO 0.39 -1.67 0.76 1.14 -1.52 0.00 0.00 175.55 174.65 1cla s GLN 179 N -5.31 0.92 -0.15 -3.49 -2.07 0.19 -4.94 119.66 104.82 1cla s GLN 179 Ca 0.61 0.34 -0.29 0.00 -1.82 0.00 0.00 55.36 54.19 1cla s GLN 179 Cb -0.13 0.44 -0.02 0.00 -1.09 0.00 0.00 33.01 32.21 1cla s GLN 179 CO 0.52 -0.27 1.38 -1.14 -1.32 0.00 0.00 175.29 174.47 1cla s GLN 180 N -0.94 4.19 -0.62 9.60 2.00 -1.26 -0.69 119.66 131.94 1cla s GLN 180 Ca -0.07 1.78 0.05 0.00 -2.00 0.00 0.00 55.36 55.11 1cla s GLN 180 Cb -0.01 -3.84 0.17 0.00 0.80 0.00 0.00 33.01 30.14 1cla s GLN 180 CO 0.07 -0.78 0.47 -0.85 -0.50 0.00 0.00 175.29 173.69 1cla n GLU 181 N 6.81 1.40 0.00 1.67 0.00 0.29 -4.98 120.64 125.84 1cla n GLU 181 Ca 0.15 -4.12 0.00 0.00 0.00 0.00 0.00 57.16 53.19 1cla n GLU 181 Cb 0.44 -2.10 0.00 0.00 0.00 0.00 0.00 31.44 29.78 1cla n GLU 181 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1cla n GLY 182 N 2.14 2.23 0.14 -1.84 0.00 -1.26 -2.89 105.19 103.71 1cla n GLY 182 Ca 0.23 -0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1cla n GLY 182 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1cla h ASP 183 N 0.00 0.00 -3.35 1.61 5.19 -2.01 -3.46 116.42 114.40 1cla h ASP 183 Ca 0.00 -0.03 -0.65 0.00 -0.62 0.00 0.00 57.03 55.73 1cla h ASP 183 Cb 0.00 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 39.37 1cla h ASP 183 CO 0.00 0.02 -0.71 -0.13 -3.12 0.00 0.00 179.24 175.30 1cla s ARG 184 N -3.17 2.25 -0.40 3.56 0.52 -1.14 -4.99 118.95 115.59 1cla s ARG 184 Ca 0.08 -1.02 -0.13 0.00 -0.52 0.00 0.00 55.73 54.13 1cla s ARG 184 Cb 0.10 -2.35 0.02 0.00 0.52 0.00 0.00 34.95 33.24 1cla s ARG 184 CO 0.65 0.50 0.26 -1.17 0.02 0.00 0.00 175.30 175.56 1cla s LEU 185 N -2.42 4.95 -0.11 2.53 2.96 -1.26 -0.55 118.68 124.79 1cla s LEU 185 Ca 0.24 -0.96 -0.01 0.00 -0.22 0.00 0.00 54.13 53.18 1cla s LEU 185 Cb -0.11 -2.10 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 1cla s LEU 185 CO 0.16 -0.43 -0.04 -0.76 -1.32 0.00 0.00 176.35 173.96 1cla s LEU 186 N 1.62 3.27 -0.28 -0.68 1.43 0.13 0.10 118.68 124.27 1cla s LEU 186 Ca 0.04 -0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1cla s LEU 186 Cb -0.19 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.29 1cla s LEU 186 CO 0.08 0.29 0.06 -0.22 0.23 0.00 0.00 176.35 176.79 1cla s LEU 187 N -0.37 3.71 0.17 1.79 2.96 0.77 -0.63 118.68 127.08 1cla s LEU 187 Ca 0.06 -0.67 -0.31 0.00 -0.22 0.00 0.00 54.13 52.99 1cla s LEU 187 Cb -0.12 -1.86 -0.10 0.00 0.50 0.00 0.00 46.19 44.61 1cla s LEU 187 CO 0.02 -0.17 1.52 -2.84 -1.32 0.00 0.00 176.35 173.56 1cla s PRO 188 N 1.49 4.24 -0.12 0.98 0.02 -1.26 -0.34 135.00 140.01 1cla s PRO 188 Ca 0.03 2.30 -0.04 0.00 0.02 0.00 0.00 61.00 63.31 1cla s PRO 188 Cb -0.17 -3.16 0.05 0.00 0.02 0.00 0.00 34.50 31.24 1cla s PRO 188 CO 0.02 -0.55 0.10 -1.17 -0.33 0.00 0.00 177.00 175.07 1cla s LEU 189 N 0.88 0.19 -0.11 -5.54 2.96 -0.12 -2.25 118.68 114.69 1cla s LEU 189 Ca 0.67 -0.25 -0.13 0.00 -0.22 0.00 0.00 54.13 54.20 1cla s LEU 189 Cb -0.42 -0.10 -0.05 0.00 0.50 0.00 0.00 46.19 46.12 1cla s LEU 189 CO 0.33 -0.30 0.30 -0.55 -1.32 0.00 0.00 176.35 174.80 1cla s SER 190 N 2.18 6.53 -0.12 3.68 0.15 0.21 -0.55 113.70 125.78 1cla s SER 190 Ca 0.04 0.63 0.02 0.00 0.70 0.00 0.00 55.95 57.33 1cla s SER 190 Cb -0.14 -2.18 0.01 0.00 -1.71 0.00 0.00 66.02 62.00 1cla s SER 190 CO -0.07 0.22 -0.18 -0.69 1.20 0.00 0.00 173.24 173.72 1cla s VAL 191 N -0.23 1.74 -0.11 4.45 1.01 -0.37 -0.59 120.40 126.30 1cla s VAL 191 Ca 0.18 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1cla s VAL 191 Cb -0.14 -1.56 0.02 0.00 0.00 0.00 0.00 36.38 34.70 1cla s VAL 191 CO 0.06 0.49 -0.12 -1.58 0.00 0.00 0.00 175.10 173.95 1cla s GLN 192 N 0.89 1.95 0.06 2.72 0.74 -0.20 -1.79 119.66 124.02 1cla s GLN 192 Ca -0.07 -0.45 -0.03 0.00 0.05 0.00 0.00 55.36 54.86 1cla s GLN 192 Cb -0.15 -1.75 -0.03 0.00 1.10 0.00 0.00 33.01 32.17 1cla s GLN 192 CO -0.01 -0.13 0.02 0.14 -0.55 0.00 0.00 175.29 174.76 1cla s VAL 193 N 1.20 0.20 -0.04 1.34 -7.23 -0.17 -1.28 120.40 114.41 1cla s VAL 193 Ca -0.03 -1.63 -0.19 0.00 -1.81 0.00 0.00 61.98 58.32 1cla s VAL 193 Cb -0.14 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 1cla s VAL 193 CO -0.04 -0.90 0.53 -2.28 -0.31 0.00 0.00 175.10 172.10 1cla s HIS 194 N -3.83 3.63 0.30 2.82 2.46 -1.26 -0.53 115.29 118.88 1cla s HIS 194 Ca 0.06 1.07 0.28 0.00 0.47 0.00 0.00 55.06 56.94 1cla s HIS 194 Cb 0.07 -2.55 1.34 0.00 -0.13 0.00 0.00 32.58 31.31 1cla s HIS 194 CO -0.10 0.33 2.00 1.25 -2.47 0.00 0.00 174.74 175.75 1cla h HIS 195 N 5.87 0.00 -0.87 3.88 2.76 0.28 -2.85 115.15 124.21 1cla h HIS 195 Ca -0.45 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 57.77 1cla h HIS 195 Cb 1.20 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 30.10 1cla h HIS 195 CO 0.65 0.13 0.55 0.00 -1.30 0.00 0.00 177.93 177.96 1cla h ALA 196 N 1.87 1.18 0.00 5.26 0.00 -1.74 -3.29 119.26 122.55 1cla h ALA 196 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1cla h ALA 196 Cb 0.47 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1cla h ALA 196 CO 0.02 0.34 -1.96 1.33 0.00 0.00 0.00 179.25 178.98 1cla n VAL 197 N -4.58 0.31 -4.84 0.00 0.24 -1.21 -4.02 118.33 104.22 1cla n VAL 197 Ca 0.12 -0.51 -0.26 0.00 -2.04 0.00 0.00 64.34 61.65 1cla n VAL 197 Cb 0.15 -0.09 -0.16 0.00 -1.47 0.00 0.00 33.84 32.27 1cla n VAL 197 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cla s ASP 199 N -0.08 4.87 0.28 0.00 -0.00 -1.26 -4.38 116.67 116.10 1cla s ASP 199 Ca -0.01 -1.02 0.00 0.00 -0.00 0.00 0.00 52.55 51.52 1cla s ASP 199 Cb -0.10 0.23 0.40 0.00 -0.00 0.00 0.00 42.92 43.45 1cla s ASP 199 CO 0.01 -1.13 1.77 1.23 -0.00 0.00 0.00 175.17 177.06 1cla h GLY 200 N 0.58 0.73 0.84 0.21 0.00 -1.99 -2.63 103.07 100.80 1cla h GLY 200 Ca -0.35 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 46.51 1cla h GLY 200 CO 0.51 0.46 0.15 -2.75 0.00 0.00 0.00 176.54 174.91 1cla h PHE 201 N 0.63 0.29 -0.45 5.60 3.04 -1.99 -0.53 116.94 123.52 1cla h PHE 201 Ca 0.12 0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.03 1cla h PHE 201 Cb 0.47 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.88 1cla h PHE 201 CO 0.02 0.15 0.07 0.45 -2.02 0.00 0.00 178.31 176.98 1cla h HIS 202 N 0.32 0.71 -0.12 0.41 3.86 -1.86 -0.64 115.15 117.84 1cla h HIS 202 Ca 0.13 -0.07 -0.11 0.00 -1.16 0.00 0.00 60.37 59.17 1cla h HIS 202 Cb 0.05 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.32 1cla h HIS 202 CO -0.10 0.63 -0.36 0.28 0.86 0.00 0.00 177.93 179.24 1cla h VAL 203 N 0.66 1.38 -0.31 2.45 2.07 -1.33 -2.89 116.25 118.28 1cla h VAL 203 Ca 0.14 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.99 1cla h VAL 203 Cb 0.31 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 1cla h VAL 203 CO 0.00 0.50 0.20 0.00 0.02 0.00 0.00 177.57 178.29 1cla h ALA 204 N 0.50 0.39 -0.57 1.67 0.00 -0.79 -2.05 119.26 118.42 1cla h ALA 204 Ca -0.01 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.95 1cla h ALA 204 Cb 0.98 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 1cla h ALA 204 CO 0.08 -0.12 0.18 -0.09 0.00 0.00 0.00 179.25 179.30 1cla h ARG 205 N 0.41 0.34 0.00 0.00 2.43 -1.15 0.88 114.38 117.29 1cla h ARG 205 Ca 0.11 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1cla h ARG 205 Cb -0.01 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1cla h ARG 205 CO -0.02 0.22 -0.00 0.35 -1.51 0.00 0.00 179.97 179.01 1cla h PHE 206 N 0.35 -0.00 -0.20 2.20 3.57 -1.32 0.51 116.94 122.04 1cla h PHE 206 Ca 0.28 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 1cla h PHE 206 Cb 0.36 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 1cla h PHE 206 CO -0.19 0.12 0.07 0.82 -2.23 0.00 0.00 178.31 176.91 1cla h ILE 207 N -0.13 1.18 -0.33 1.41 2.04 -0.81 0.39 117.51 121.25 1cla h ILE 207 Ca -0.00 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1cla h ILE 207 Cb 0.13 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1cla h ILE 207 CO 0.00 0.17 0.22 0.78 0.00 0.00 0.00 178.15 179.32 1cla h ASN 208 N 0.17 0.38 -0.46 1.72 2.35 -0.79 0.22 115.58 119.18 1cla h ASN 208 Ca 0.07 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1cla h ASN 208 Cb 0.20 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1cla h ASN 208 CO -0.00 0.29 0.30 -0.09 -1.65 0.00 0.00 177.43 176.27 1cla h ARG 209 N 0.45 0.60 -0.59 0.81 9.65 -0.86 -1.75 114.38 122.69 1cla h ARG 209 Ca 0.12 -0.04 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 1cla h ARG 209 Cb -0.04 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 28.37 1cla h ARG 209 CO -0.03 0.40 0.39 1.25 2.80 0.00 0.00 179.97 184.78 1cla h LEU 210 N 0.62 0.68 -0.77 3.80 5.85 -0.10 -2.41 115.31 122.98 1cla h LEU 210 Ca 0.17 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.95 1cla h LEU 210 Cb -0.07 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.72 1cla h LEU 210 CO -0.04 0.50 0.43 -0.61 -0.34 0.00 0.00 178.44 178.38 1cla h GLN 211 N 0.80 0.71 -0.64 1.25 5.75 -0.44 -1.24 115.11 121.31 1cla h GLN 211 Ca 0.22 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1cla h GLN 211 Cb -0.09 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.27 1cla h GLN 211 CO -0.05 0.47 0.42 0.93 -2.65 0.00 0.00 178.83 177.96 1cla h GLU 212 N 0.73 0.84 -0.31 1.69 5.08 -0.98 -2.54 114.58 119.09 1cla h GLU 212 Ca 0.37 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.56 1cla h GLU 212 Cb 0.32 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1cla h GLU 212 CO -0.24 0.55 -0.30 -0.07 -1.00 0.00 0.00 179.01 177.95 1cla h LEU 213 N 0.86 0.68 -0.87 1.33 3.38 -0.95 -2.56 115.31 117.18 1cla h LEU 213 Ca 0.24 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1cla h LEU 213 Cb -0.09 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1cla h LEU 213 CO -0.06 0.94 0.16 0.00 0.09 0.00 0.00 178.44 179.57 1cla n ASN 215 N -4.25 0.00 -4.56 0.00 3.02 -0.98 -3.13 115.26 105.36 1cla n ASN 215 Ca 0.05 -1.13 -0.26 0.00 -0.03 0.00 0.00 54.58 53.21 1cla n ASN 215 Cb 0.24 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.31 1cla n ASN 215 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1cla s SER 216 N -1.68 3.73 0.55 6.41 0.01 -1.05 -5.01 113.70 116.65 1cla s SER 216 Ca 0.24 -1.25 -0.21 0.00 1.31 0.00 0.00 55.95 56.04 1cla s SER 216 Cb 0.11 -0.36 -0.05 0.00 0.21 0.00 0.00 66.02 65.94 1cla s SER 216 CO 0.18 -0.29 1.28 -0.54 0.41 0.00 0.00 173.24 174.28 1cla s LYS 217 N -3.65 3.18 0.08 12.44 3.01 -1.26 -4.91 119.74 128.64 1cla s LYS 217 Ca 0.33 2.03 -0.10 0.00 -1.01 0.00 0.00 55.97 57.23 1cla s LYS 217 Cb 0.05 -2.18 -0.22 0.00 -1.01 0.00 0.00 37.83 34.47 1cla s LYS 217 CO 0.17 -1.09 1.18 -0.07 0.51 0.00 0.00 175.35 176.05 1cla h LEU 218 N 1.37 0.70 0.00 3.17 3.38 -1.97 -3.51 115.31 118.45 1cla h LEU 218 Ca -0.50 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 56.84 1cla h LEU 218 Cb 1.29 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1cla h LEU 218 CO 0.57 1.44 0.00 2.29 0.09 0.00 0.00 178.44 182.83