#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qtg n LEU 23 N 0.00 0.00 -4.68 9.51 4.32 -1.26 -2.15 117.00 122.73 2qtg n LEU 23 Ca 0.00 -0.43 -0.45 0.00 -0.02 0.00 0.00 56.01 55.11 2qtg n LEU 23 Cb 0.00 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 41.76 2qtg n LEU 23 CO 0.00 0.00 1.20 0.54 -1.22 0.00 0.00 177.39 177.91 2qtg n ARG 24 N -0.99 2.26 -2.15 3.23 1.74 -1.26 -4.70 116.66 114.79 2qtg n ARG 24 Ca 0.00 0.81 -0.40 0.00 -0.77 0.00 0.00 57.85 57.50 2qtg n ARG 24 Cb 0.00 -2.58 -0.02 0.00 -1.02 0.00 0.00 32.46 28.84 2qtg n ARG 24 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2qtg s PRO 25 N 0.72 4.20 0.12 5.56 0.02 -1.26 -4.25 135.00 140.10 2qtg s PRO 25 Ca 0.76 2.11 -0.31 0.00 0.02 0.00 0.00 61.00 63.58 2qtg s PRO 25 Cb -0.64 -2.91 -0.10 0.00 0.02 0.00 0.00 34.50 30.87 2qtg s PRO 25 CO 0.39 -0.28 1.77 0.42 -0.33 0.00 0.00 177.00 178.97 2qtg s ILE 26 N -1.22 2.61 -0.02 2.83 1.01 0.10 -4.89 121.20 121.62 2qtg s ILE 26 Ca 0.52 0.16 0.10 0.00 0.00 0.00 0.00 60.65 61.44 2qtg s ILE 26 Cb -0.37 -3.10 -0.15 0.00 0.01 0.00 0.00 42.46 38.84 2qtg s ILE 26 CO 0.49 0.00 0.20 -1.54 0.00 0.00 0.00 174.94 174.09 2qtg n SER 27 N 5.46 2.74 -3.72 3.58 3.41 -1.26 -4.69 113.62 119.14 2qtg n SER 27 Ca 0.17 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.62 2qtg n SER 27 Cb 0.38 1.38 -0.16 0.00 -0.26 0.00 0.00 64.21 65.56 2qtg n SER 27 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2qtg s SER 28 N -3.24 0.33 -0.12 4.04 0.15 -1.26 0.16 113.70 113.76 2qtg s SER 28 Ca -0.04 0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.86 2qtg s SER 28 Cb 0.06 0.10 0.01 0.00 -1.71 0.00 0.00 66.02 64.48 2qtg s SER 28 CO 0.41 -0.18 -0.21 -0.69 1.20 0.00 0.00 173.24 173.76 2qtg s VAL 29 N 1.58 1.96 -0.24 4.45 1.01 -0.17 -0.97 120.40 128.01 2qtg s VAL 29 Ca -0.04 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.92 2qtg s VAL 29 Cb -0.12 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2qtg s VAL 29 CO -0.05 0.53 0.11 -0.69 0.00 0.00 0.00 175.10 175.00 2qtg s VAL 30 N 0.70 4.81 -0.20 2.92 1.01 -0.88 -1.06 120.40 127.70 2qtg s VAL 30 Ca -0.10 -0.01 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 2qtg s VAL 30 Cb -0.16 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 2qtg s VAL 30 CO 0.01 0.35 0.55 -0.36 0.00 0.00 0.00 175.10 175.65 2qtg s PHE 31 N 1.27 3.37 -0.38 5.22 0.40 0.15 -0.19 117.98 127.81 2qtg s PHE 31 Ca 0.06 0.81 -0.12 0.00 -0.60 0.00 0.00 56.93 57.08 2qtg s PHE 31 Cb -0.14 -2.71 0.02 0.00 0.51 0.00 0.00 43.02 40.70 2qtg s PHE 31 CO 0.05 -0.13 0.24 0.08 0.70 0.00 0.00 175.22 176.15 2qtg s VAL 32 N 1.75 4.80 -0.11 -0.44 1.01 0.40 -0.37 120.40 127.44 2qtg s VAL 32 Ca 0.25 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.46 2qtg s VAL 32 Cb -0.16 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.57 2qtg s VAL 32 CO 0.10 -0.25 -0.15 -0.63 0.00 0.00 0.00 175.10 174.17 2qtg s ILE 33 N 1.60 1.48 0.10 2.22 1.01 0.02 -2.78 121.20 124.85 2qtg s ILE 33 Ca 0.03 -0.62 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 2qtg s ILE 33 Cb -0.19 -1.36 -0.16 0.00 0.01 0.00 0.00 42.46 40.75 2qtg s ILE 33 CO 0.08 0.44 1.30 0.00 0.00 0.00 0.00 174.94 176.76 2qtg h ALA 34 N 7.54 0.30 -3.67 9.38 0.00 -1.84 -3.37 119.26 127.60 2qtg h ALA 34 Ca -0.32 -0.61 -0.67 0.00 0.00 0.00 0.00 54.91 53.30 2qtg h ALA 34 Cb 1.17 -0.01 -0.24 0.00 0.00 0.00 0.00 17.79 18.71 2qtg h ALA 34 CO 0.49 0.69 -0.75 -1.64 0.00 0.00 0.00 179.25 178.04 2qtg s MET 35 N -3.69 2.94 0.57 0.00 -1.94 -1.26 -4.41 119.30 111.51 2qtg s MET 35 Ca -0.10 -0.66 0.31 0.00 -1.71 0.00 0.00 55.69 53.53 2qtg s MET 35 Cb 0.08 -2.53 1.76 0.00 2.01 0.00 0.00 34.83 36.15 2qtg s MET 35 CO 0.90 0.45 2.20 1.96 -0.01 0.00 0.00 175.02 180.52 2qtg h GLN 36 N 5.94 0.00 -0.03 2.03 4.20 -1.95 -0.03 115.11 125.26 2qtg h GLN 36 Ca -0.38 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.25 2qtg h GLN 36 Cb 1.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.95 2qtg h GLN 36 CO 0.53 0.04 -0.37 0.00 -0.67 0.00 0.00 178.83 178.37 2qtg h ALA 37 N 1.96 1.34 0.00 3.87 0.00 -1.98 0.11 119.26 124.56 2qtg h ALA 37 Ca -0.00 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 2qtg h ALA 37 Cb 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2qtg h ALA 37 CO 0.01 0.48 -0.49 0.93 0.00 0.00 0.00 179.25 180.18 2qtg h GLU 38 N 0.05 0.00 0.10 0.00 5.08 -1.43 -3.38 114.58 115.00 2qtg h GLU 38 Ca 0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.02 2qtg h GLU 38 Cb 0.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2qtg h GLU 38 CO 0.05 0.49 -1.86 0.00 -1.00 0.00 0.00 179.01 176.70 2qtg n ALA 39 N -2.30 0.87 -0.32 3.43 0.00 -0.84 -4.56 120.51 116.80 2qtg n ALA 39 Ca 0.00 -0.58 0.04 0.00 0.00 0.00 0.00 53.44 52.91 2qtg n ALA 39 Cb 0.62 -0.64 0.23 0.00 0.00 0.00 0.00 19.45 19.67 2qtg n ALA 39 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2qtg h LEU 40 N -0.18 0.92 -0.78 0.00 -0.00 -0.97 -2.21 115.31 112.10 2qtg h LEU 40 Ca -0.42 0.01 0.03 0.00 -0.00 0.00 0.00 57.88 57.51 2qtg h LEU 40 Cb 1.87 -0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 42.30 2qtg h LEU 40 CO 0.01 0.58 0.49 -0.65 -0.00 0.00 0.00 178.44 178.88 2qtg h PRO 41 N 1.04 0.93 -0.50 1.13 0.11 -1.80 -0.62 132.00 132.29 2qtg h PRO 41 Ca 0.41 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 66.34 2qtg h PRO 41 Cb 0.23 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.12 2qtg h PRO 41 CO -0.16 0.61 -0.16 1.25 -0.21 0.00 0.00 178.00 179.33 2qtg h LEU 42 N 0.96 0.99 -0.36 2.35 5.85 -1.68 -0.43 115.31 122.98 2qtg h LEU 42 Ca 0.31 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.72 2qtg h LEU 42 Cb 0.03 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 2qtg h LEU 42 CO -0.12 1.13 0.18 0.58 -0.34 0.00 0.00 178.44 179.86 2qtg h VAL 43 N 0.86 0.97 -0.42 1.05 2.07 -1.18 -1.69 116.25 117.90 2qtg h VAL 43 Ca 0.12 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2qtg h VAL 43 Cb 0.72 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2qtg h VAL 43 CO 0.06 0.07 -0.04 0.78 0.02 0.00 0.00 177.57 178.45 2qtg h ASN 44 N 0.36 0.77 -0.94 0.57 2.35 -0.89 -0.64 115.58 117.15 2qtg h ASN 44 Ca 0.16 -0.33 0.13 0.00 -0.55 0.00 0.00 56.30 55.71 2qtg h ASN 44 Cb 0.07 -0.21 -0.09 0.00 0.05 0.00 0.00 38.32 38.15 2qtg h ASN 44 CO -0.11 0.92 0.56 0.50 -1.65 0.00 0.00 177.43 177.65 2qtg h LYS 45 N 0.60 0.82 -0.16 0.81 1.63 -0.72 -2.09 116.57 117.47 2qtg h LYS 45 Ca 0.11 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2qtg h LYS 45 Cb 0.55 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2qtg h LYS 45 CO 0.03 0.54 0.00 1.19 -3.45 0.00 0.00 179.45 177.76 2qtg n PHE 46 N -4.72 0.19 -3.77 1.91 3.01 -0.67 -4.97 117.46 108.44 2qtg n PHE 46 Ca 0.18 -0.09 -0.24 0.00 1.01 0.00 0.00 57.45 58.31 2qtg n PHE 46 Cb 0.40 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.89 2qtg n PHE 46 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qtg n GLY 47 N 1.40 -0.33 3.79 1.37 0.00 -0.47 -4.90 105.19 106.04 2qtg n GLY 47 Ca 0.16 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2qtg n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qtg s LEU 48 N -6.85 4.13 -0.08 0.99 1.43 -0.37 -4.90 118.68 113.03 2qtg s LEU 48 Ca 0.17 1.85 -0.02 0.00 -1.03 0.00 0.00 54.13 55.10 2qtg s LEU 48 Cb -0.08 -4.26 -0.03 0.00 0.03 0.00 0.00 46.19 41.85 2qtg s LEU 48 CO 0.82 -0.32 0.00 -0.94 0.23 0.00 0.00 176.35 176.15 2qtg s SER 49 N -1.80 5.23 0.18 2.29 1.04 0.58 -4.81 113.70 116.41 2qtg s SER 49 Ca 0.57 0.14 -0.32 0.00 0.48 0.00 0.00 55.95 56.82 2qtg s SER 49 Cb -0.16 -1.46 -0.11 0.00 0.10 0.00 0.00 66.02 64.38 2qtg s SER 49 CO 0.21 0.37 1.70 -0.70 0.98 0.00 0.00 173.24 175.80 2qtg s GLU 50 N -0.92 4.15 0.38 4.02 2.12 -1.26 -0.90 118.70 126.29 2qtg s GLU 50 Ca 0.14 2.53 -0.25 0.00 0.36 0.00 0.00 54.97 57.75 2qtg s GLU 50 Cb -0.11 -3.20 -0.09 0.00 0.26 0.00 0.00 34.13 30.99 2qtg s GLU 50 CO 0.03 -0.73 1.03 0.95 -0.54 0.00 0.00 175.26 176.00 2qtg s THR 51 N 1.48 3.82 -0.18 -1.70 -4.23 -0.25 -4.92 115.64 109.65 2qtg s THR 51 Ca 0.75 1.43 0.19 0.00 -1.18 0.00 0.00 61.69 62.87 2qtg s THR 51 Cb -0.47 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 69.57 2qtg s THR 51 CO 0.32 0.05 1.02 0.71 -0.54 0.00 0.00 174.62 176.18 2qtg h THR 52 N 2.33 0.35 -0.82 3.99 1.35 -1.92 -3.42 112.91 114.76 2qtg h THR 52 Ca -0.48 -1.63 -0.57 0.00 -0.55 0.00 0.00 66.41 63.17 2qtg h THR 52 Cb 1.21 1.90 -0.41 0.00 -1.73 0.00 0.00 68.15 69.13 2qtg h THR 52 CO 0.63 0.20 -0.53 -0.90 -0.25 0.00 0.00 175.52 174.67 2qtg n ASP 53 N -2.87 5.40 -4.09 5.36 5.68 -1.26 -5.02 116.55 119.74 2qtg n ASP 53 Ca -0.04 -3.76 -0.45 0.00 -0.50 0.00 0.00 54.79 50.05 2qtg n ASP 53 Cb 0.71 -0.45 0.01 0.00 -1.14 0.00 0.00 41.12 40.25 2qtg n ASP 53 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2qtg n SER 54 N -0.74 -3.58 0.32 -1.12 7.64 -1.26 -4.85 113.62 110.03 2qtg n SER 54 Ca 0.47 -1.25 0.21 0.00 1.01 0.00 0.00 58.87 59.31 2qtg n SER 54 Cb 0.91 -1.50 1.07 0.00 -1.01 0.00 0.00 64.21 63.67 2qtg n SER 54 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2qtg h PRO 55 N -2.36 0.00 -0.63 1.43 0.11 -1.95 -2.54 132.00 126.06 2qtg h PRO 55 Ca -0.68 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.43 2qtg h PRO 55 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2qtg h PRO 55 CO 0.51 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 179.58 2qtg n LEU 56 N -3.13 3.88 0.00 2.35 4.77 -1.26 -4.90 117.00 118.71 2qtg n LEU 56 Ca -0.02 -2.10 0.00 0.00 -0.03 0.00 0.00 56.01 53.86 2qtg n LEU 56 Cb 0.13 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 2qtg n LEU 56 CO 0.22 0.90 0.00 0.61 -1.33 0.00 0.00 177.39 177.80 2qtg n GLY 57 N 1.28 3.18 3.85 -0.72 0.00 -0.95 -5.02 105.19 106.81 2qtg n GLY 57 Ca 0.22 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 2qtg n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qtg s LYS 58 N -4.77 3.22 -1.29 1.61 1.02 -1.26 -4.31 119.74 113.96 2qtg s LYS 58 Ca 0.00 0.81 0.00 0.00 0.02 0.00 0.00 55.97 56.80 2qtg s LYS 58 Cb 0.00 -2.03 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 2qtg s LYS 58 CO 0.00 -0.86 0.00 0.41 -0.92 0.00 0.00 175.35 173.98 2qtg n GLY 59 N -2.43 -0.08 3.51 -3.33 0.00 -1.26 -5.02 105.19 96.58 2qtg n GLY 59 Ca 0.07 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 2qtg n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qtg s LEU 60 N -4.15 2.75 0.00 0.99 1.43 -1.26 -5.03 118.68 113.41 2qtg s LEU 60 Ca 0.00 -0.69 0.27 0.00 -1.03 0.00 0.00 54.13 52.68 2qtg s LEU 60 Cb 0.00 -1.47 1.18 0.00 0.03 0.00 0.00 46.19 45.93 2qtg s LEU 60 CO 0.00 0.11 1.87 -0.81 0.23 0.00 0.00 176.35 177.76 2qtg n PRO 61 N 0.17 0.04 -1.71 1.29 -0.04 -1.26 -4.89 135.00 128.59 2qtg n PRO 61 Ca -0.12 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 2qtg n PRO 61 Cb 0.55 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.52 2qtg n PRO 61 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2qtg n TRP 62 N -1.48 2.30 -4.91 0.54 8.01 -1.24 -4.20 117.44 116.46 2qtg n TRP 62 Ca 0.07 0.50 -0.33 0.00 -1.31 0.00 0.00 57.50 56.44 2qtg n TRP 62 Cb 0.31 -2.41 -0.15 0.00 -2.01 0.00 0.00 31.31 27.05 2qtg n TRP 62 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 2qtg s VAL 63 N -1.17 2.76 -0.16 -0.99 1.01 0.25 -4.95 120.40 117.17 2qtg s VAL 63 Ca 0.59 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2qtg s VAL 63 Cb -0.51 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 33.75 2qtg s VAL 63 CO 0.60 0.54 -0.20 -0.22 0.00 0.00 0.00 175.10 175.81 2qtg s LEU 64 N 0.32 2.05 -0.18 3.92 0.20 -1.26 -1.04 118.68 122.69 2qtg s LEU 64 Ca -0.13 -0.60 -0.06 0.00 0.69 0.00 0.00 54.13 54.03 2qtg s LEU 64 Cb -0.16 -1.41 -0.04 0.00 -0.43 0.00 0.00 46.19 44.15 2qtg s LEU 64 CO 0.07 0.02 0.03 -0.31 -0.29 0.00 0.00 176.35 175.87 2qtg s TYR 65 N 1.12 3.17 0.04 5.38 2.02 0.92 -1.08 117.35 128.92 2qtg s TYR 65 Ca -0.00 -0.08 0.08 0.00 -0.37 0.00 0.00 57.07 56.71 2qtg s TYR 65 Cb -0.14 -2.05 -0.03 0.00 -0.40 0.00 0.00 41.96 39.34 2qtg s TYR 65 CO -0.08 0.06 -0.23 -1.58 -1.57 0.00 0.00 175.55 172.15 2qtg s HIS 66 N 0.46 2.01 0.30 2.71 5.65 -0.07 -0.02 115.29 126.32 2qtg s HIS 66 Ca 0.01 -0.39 -0.18 0.00 0.25 0.00 0.00 55.06 54.75 2qtg s HIS 66 Cb -0.13 -1.20 0.07 0.00 -1.18 0.00 0.00 32.58 30.13 2qtg s HIS 66 CO 0.01 0.10 0.90 0.20 -0.65 0.00 0.00 174.74 175.31 2qtg s GLY 67 N -1.20 0.26 -0.03 1.59 0.00 -0.36 -0.31 107.32 107.28 2qtg s GLY 67 Ca 0.09 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.26 2qtg s GLY 67 CO 0.02 0.94 -0.10 0.14 0.00 0.00 0.00 173.10 174.10 2qtg s VAL 68 N -2.22 0.88 -0.39 1.40 1.01 -1.26 -0.54 120.40 119.28 2qtg s VAL 68 Ca 0.18 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2qtg s VAL 68 Cb -0.04 -0.78 0.12 0.00 0.00 0.00 0.00 36.38 35.68 2qtg s VAL 68 CO 0.09 0.27 0.19 -2.28 0.00 0.00 0.00 175.10 173.37 2qtg s HIS 69 N 0.19 1.84 0.00 5.22 5.04 0.18 -4.97 115.29 122.79 2qtg s HIS 69 Ca -0.04 -2.18 0.00 0.00 -1.54 0.00 0.00 55.06 51.30 2qtg s HIS 69 Cb -0.09 -1.78 0.00 0.00 0.04 0.00 0.00 32.58 30.74 2qtg s HIS 69 CO 0.01 -0.82 0.00 1.63 -2.34 0.00 0.00 174.74 173.22 2qtg n LYS 70 N 3.97 0.00 0.00 2.88 5.02 -1.26 -2.66 118.16 126.11 2qtg n LYS 70 Ca 0.06 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.44 2qtg n LYS 70 Cb 0.37 0.00 0.50 0.00 -0.02 0.00 0.00 35.03 35.87 2qtg n LYS 70 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2qtg n ASP 71 N 7.75 0.00 -4.26 4.39 8.00 -1.26 -4.81 116.55 126.36 2qtg n ASP 71 Ca 0.00 -0.32 -0.33 0.00 0.71 0.00 0.00 54.79 54.85 2qtg n ASP 71 Cb 0.00 -0.11 -0.15 0.00 -0.02 0.00 0.00 41.12 40.83 2qtg n ASP 71 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qtg s LEU 72 N -2.23 2.47 -0.07 0.64 1.43 -1.09 -4.72 118.68 115.12 2qtg s LEU 72 Ca 0.23 -0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 52.56 2qtg s LEU 72 Cb 0.12 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.76 2qtg s LEU 72 CO 0.23 0.08 0.97 -0.13 0.23 0.00 0.00 176.35 177.74 2qtg s ARG 73 N 0.83 4.46 -0.21 1.70 0.52 0.12 -0.65 118.95 125.73 2qtg s ARG 73 Ca -0.05 1.36 -0.01 0.00 -0.52 0.00 0.00 55.73 56.50 2qtg s ARG 73 Cb -0.15 -3.51 0.01 0.00 0.52 0.00 0.00 34.95 31.82 2qtg s ARG 73 CO -0.00 -0.21 -0.12 0.42 0.02 0.00 0.00 175.30 175.42 2qtg s ILE 74 N 1.61 2.71 -0.14 1.52 1.01 0.30 -1.00 121.20 127.21 2qtg s ILE 74 Ca 0.48 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 60.35 2qtg s ILE 74 Cb -0.19 -2.22 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 2qtg s ILE 74 CO 0.21 0.44 -0.12 0.20 0.00 0.00 0.00 174.94 175.67 2qtg s ASN 75 N 1.37 4.04 -0.19 3.58 0.01 -0.23 -1.22 114.94 122.30 2qtg s ASN 75 Ca 0.04 -0.33 -0.02 0.00 -0.71 0.00 0.00 52.86 51.84 2qtg s ASN 75 Cb -0.14 -1.62 -0.00 0.00 0.41 0.00 0.00 41.25 39.89 2qtg s ASN 75 CO -0.08 0.15 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.87 2qtg s VAL 76 N 0.47 3.01 -0.07 1.60 1.01 0.97 0.33 120.40 127.71 2qtg s VAL 76 Ca -0.09 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2qtg s VAL 76 Cb -0.16 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2qtg s VAL 76 CO 0.04 0.48 -0.22 -0.69 0.00 0.00 0.00 175.10 174.71 2qtg s VAL 77 N 1.13 2.35 -0.02 2.92 1.01 0.51 -0.05 120.40 128.25 2qtg s VAL 77 Ca 0.01 -0.95 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2qtg s VAL 77 Cb -0.14 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2qtg s VAL 77 CO -0.03 0.57 -0.07 0.00 0.00 0.00 0.00 175.10 175.57 2qtg n PRO 79 N 3.19 0.19 0.00 0.00 -0.04 -1.26 -0.58 135.00 136.50 2qtg n PRO 79 Ca -0.16 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2qtg n PRO 79 Cb 0.56 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2qtg n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qtg n GLY 80 N -0.13 0.04 3.74 0.55 0.00 -1.26 -3.62 105.19 104.51 2qtg n GLY 80 Ca 0.02 -0.96 -0.40 0.00 0.00 0.00 0.00 46.02 44.68 2qtg n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qtg s ARG 81 N 0.00 4.54 0.25 1.61 0.52 -1.26 -0.93 118.95 123.68 2qtg s ARG 81 Ca 0.00 1.17 -0.30 0.00 -0.52 0.00 0.00 55.73 56.08 2qtg s ARG 81 Cb 0.00 -3.38 -0.10 0.00 0.52 0.00 0.00 34.95 31.99 2qtg s ARG 81 CO 0.00 0.23 1.39 0.34 0.02 0.00 0.00 175.30 177.28 2qtg s ASP 82 N 0.08 6.73 0.23 0.23 2.15 0.51 -4.82 116.67 121.78 2qtg s ASP 82 Ca 0.41 2.60 0.04 0.00 0.43 0.00 0.00 52.55 56.04 2qtg s ASP 82 Cb -0.21 -2.62 0.21 0.00 -0.30 0.00 0.00 42.92 40.00 2qtg s ASP 82 CO 0.25 -0.63 1.53 0.00 -0.17 0.00 0.00 175.17 176.14 2qtg h ALA 83 N 4.88 0.80 0.12 3.66 0.00 -1.95 -0.40 119.26 126.37 2qtg h ALA 83 Ca -0.46 -0.58 -0.28 0.00 0.00 0.00 0.00 54.91 53.59 2qtg h ALA 83 Cb 1.22 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.94 2qtg h ALA 83 CO 0.76 0.76 -1.22 0.00 0.00 0.00 0.00 179.25 179.55 2qtg h ALA 84 N 1.16 0.09 0.00 0.00 0.00 -1.99 -3.41 119.26 115.11 2qtg h ALA 84 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2qtg h ALA 84 Cb 1.18 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2qtg h ALA 84 CO 0.10 0.84 -0.22 1.28 0.00 0.00 0.00 179.25 181.25 2qtg n LEU 85 N -3.66 0.13 0.00 0.00 7.99 -1.23 -5.03 117.00 115.20 2qtg n LEU 85 Ca -0.10 -0.46 0.00 0.00 -0.01 0.00 0.00 56.01 55.43 2qtg n LEU 85 Cb 0.99 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.30 2qtg n LEU 85 CO 0.55 0.03 0.00 0.61 -1.51 0.00 0.00 177.39 177.08 2qtg n GLY 86 N 1.17 0.51 4.00 -0.72 0.00 -0.16 -4.97 105.19 105.03 2qtg n GLY 86 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2qtg n GLY 86 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qtg s ILE 87 N -2.41 2.73 0.20 -0.61 -5.25 -1.26 -4.60 121.20 110.00 2qtg s ILE 87 Ca 0.00 -1.04 -0.31 0.00 -0.99 0.00 0.00 60.65 58.31 2qtg s ILE 87 Cb 0.00 -2.78 -0.10 0.00 2.95 0.00 0.00 42.46 42.53 2qtg s ILE 87 CO 0.00 0.00 1.54 -1.81 -1.79 0.00 0.00 174.94 172.88 2qtg s ASP 88 N -4.40 6.58 -1.18 4.36 1.01 -1.26 -0.36 116.67 121.41 2qtg s ASP 88 Ca 0.55 2.67 -0.11 0.00 0.71 0.00 0.00 52.55 56.37 2qtg s ASP 88 Cb -0.08 -2.61 -0.07 0.00 1.01 0.00 0.00 42.92 41.18 2qtg s ASP 88 CO 0.34 -0.80 2.34 -1.20 0.21 0.00 0.00 175.17 176.06 2qtg n SER 89 N 3.33 5.47 -4.69 0.27 7.64 -0.11 -4.83 113.62 120.70 2qtg n SER 89 Ca 0.11 -2.53 -0.30 0.00 1.01 0.00 0.00 58.87 57.16 2qtg n SER 89 Cb 0.39 -1.32 0.15 0.00 -1.01 0.00 0.00 64.21 62.42 2qtg n SER 89 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2qtg s VAL 90 N 3.29 2.55 0.00 0.44 -7.23 -1.26 -4.60 120.40 113.59 2qtg s VAL 90 Ca 0.52 0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.87 2qtg s VAL 90 Cb 0.14 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.49 2qtg s VAL 90 CO -0.02 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 2qtg n GLY 91 N -0.82 1.21 0.18 2.32 0.00 -1.26 -4.72 105.19 102.10 2qtg n GLY 91 Ca 0.07 -2.04 -0.07 0.00 0.00 0.00 0.00 46.02 43.98 2qtg n GLY 91 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2qtg h THR 92 N 0.00 1.36 0.52 2.61 1.35 -1.76 -3.04 112.91 113.95 2qtg h THR 92 Ca 0.00 -1.92 -0.03 0.00 -0.55 0.00 0.00 66.41 63.92 2qtg h THR 92 Cb 0.00 1.93 0.01 0.00 -1.73 0.00 0.00 68.15 68.36 2qtg h THR 92 CO 0.00 0.58 -0.25 0.58 -0.25 0.00 0.00 175.52 176.18 2qtg h VAL 93 N 0.26 0.31 -0.61 6.82 2.07 -1.89 -0.50 116.25 122.71 2qtg h VAL 93 Ca -0.00 -0.43 0.03 0.00 0.82 0.00 0.00 66.70 67.12 2qtg h VAL 93 Cb 1.11 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 2qtg h VAL 93 CO 0.10 0.05 0.37 -0.65 0.02 0.00 0.00 177.57 177.45 2qtg h PRO 94 N -1.02 0.70 -0.36 1.57 0.11 -1.82 -1.71 132.00 129.47 2qtg h PRO 94 Ca -0.07 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 66.07 2qtg h PRO 94 Cb 0.62 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 31.50 2qtg h PRO 94 CO 0.12 0.46 -0.12 0.00 -0.21 0.00 0.00 178.00 178.25 2qtg h ALA 95 N 1.27 0.19 -0.87 -0.75 0.00 -1.54 0.15 119.26 117.71 2qtg h ALA 95 Ca 0.25 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.30 2qtg h ALA 95 Cb 0.04 0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2qtg h ALA 95 CO -0.11 -0.49 0.57 0.66 0.00 0.00 0.00 179.25 179.87 2qtg h SER 96 N -0.04 1.00 -0.13 0.00 4.64 -0.80 -1.39 113.55 116.83 2qtg h SER 96 Ca 0.18 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 2qtg h SER 96 Cb 0.31 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2qtg h SER 96 CO -0.39 0.73 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.18 2qtg h LEU 97 N 1.18 0.27 -1.32 5.97 3.38 -0.72 -1.13 115.31 122.94 2qtg h LEU 97 Ca 0.32 -0.40 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 2qtg h LEU 97 Cb -0.12 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2qtg h LEU 97 CO -0.07 0.60 -0.14 0.16 0.09 0.00 0.00 178.44 179.08 2qtg h ILE 98 N -0.07 1.20 -0.01 1.22 3.07 -0.65 -1.86 117.51 120.40 2qtg h ILE 98 Ca 0.03 -0.87 -0.00 0.00 1.55 0.00 0.00 64.86 65.57 2qtg h ILE 98 Cb 0.50 1.23 -0.00 0.00 -0.27 0.00 0.00 36.82 38.27 2qtg h ILE 98 CO 0.02 0.27 -0.00 0.74 -1.05 0.00 0.00 178.15 178.12 2qtg h THR 99 N 0.27 1.31 -0.21 0.16 2.02 -1.11 -0.55 112.91 114.79 2qtg h THR 99 Ca 0.05 -0.93 0.05 0.00 0.77 0.00 0.00 66.41 66.35 2qtg h THR 99 Cb 0.42 1.92 -0.05 0.00 -1.74 0.00 0.00 68.15 68.70 2qtg h THR 99 CO 0.03 0.25 -0.13 0.15 0.37 0.00 0.00 175.52 176.18 2qtg h PHE 100 N -0.36 -0.32 -0.11 3.16 3.57 -1.10 -0.56 116.94 121.23 2qtg h PHE 100 Ca 0.00 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.41 2qtg h PHE 100 Cb 0.40 0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2qtg h PHE 100 CO 0.06 -0.20 -0.47 0.00 -2.23 0.00 0.00 178.31 175.47 2qtg h ALA 101 N 1.04 1.01 -0.28 2.41 0.00 -1.30 -1.98 119.26 120.15 2qtg h ALA 101 Ca 0.12 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 2qtg h ALA 101 Cb 0.30 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2qtg h ALA 101 CO -0.28 0.64 -0.13 0.77 0.00 0.00 0.00 179.25 180.24 2qtg h SER 102 N 0.21 0.60 -0.32 0.00 0.02 -0.85 -1.47 113.55 111.75 2qtg h SER 102 Ca 0.01 -0.40 0.03 0.00 -0.84 0.00 0.00 61.79 60.59 2qtg h SER 102 Cb 0.92 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.26 2qtg h SER 102 CO 0.07 0.87 0.14 0.40 -1.14 0.00 0.00 176.83 177.17 2qtg h ILE 103 N 0.33 0.95 -0.55 3.27 2.04 -0.89 0.00 117.51 122.67 2qtg h ILE 103 Ca 0.06 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.75 2qtg h ILE 103 Cb 0.64 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2qtg h ILE 103 CO 0.04 0.05 0.06 1.56 0.00 0.00 0.00 178.15 179.87 2qtg h GLN 104 N 0.29 0.93 0.12 2.37 4.20 -1.31 -1.90 115.11 119.81 2qtg h GLN 104 Ca 0.14 -0.27 -0.23 0.00 0.06 0.00 0.00 58.65 58.35 2qtg h GLN 104 Cb 0.08 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 27.76 2qtg h GLN 104 CO -0.12 0.91 -1.10 0.00 -0.67 0.00 0.00 178.83 177.85 2qtg h ALA 105 N 0.98 0.06 0.00 3.87 0.00 -1.26 -3.40 119.26 119.51 2qtg h ALA 105 Ca 0.16 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2qtg h ALA 105 Cb 0.45 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2qtg h ALA 105 CO 0.02 0.60 -1.38 1.28 0.00 0.00 0.00 179.25 179.77 2qtg n LEU 106 N -4.05 0.62 -3.93 0.00 4.77 -0.02 -5.02 117.00 109.37 2qtg n LEU 106 Ca -0.20 -0.31 -0.38 0.00 -0.03 0.00 0.00 56.01 55.09 2qtg n LEU 106 Cb 0.85 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.95 2qtg n LEU 106 CO 0.43 0.15 -0.16 0.29 -1.33 0.00 0.00 177.39 176.78 2qtg n LYS 107 N -1.79 -0.93 -1.85 3.23 4.76 -0.71 -4.94 118.16 115.93 2qtg n LYS 107 Ca 0.01 0.25 -0.32 0.00 -2.87 0.00 0.00 58.31 55.38 2qtg n LYS 107 Cb 0.42 -3.38 0.03 0.00 -1.84 0.00 0.00 35.03 30.26 2qtg n LYS 107 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2qtg s PRO 108 N -6.81 3.18 0.38 1.97 0.04 -1.26 -4.94 135.00 127.56 2qtg s PRO 108 Ca 0.41 1.08 0.20 0.00 0.04 0.00 0.00 61.00 62.74 2qtg s PRO 108 Cb -0.19 -2.02 0.35 0.00 0.04 0.00 0.00 34.50 32.68 2qtg s PRO 108 CO 0.93 -0.92 1.59 -0.44 0.04 0.00 0.00 177.00 178.20 2qtg h ASP 109 N -0.06 0.00 -4.34 6.66 3.32 -1.42 -3.47 116.42 117.11 2qtg h ASP 109 Ca -0.45 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 2qtg h ASP 109 Cb 1.21 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.56 2qtg h ASP 109 CO 0.57 0.23 0.10 -0.51 -1.72 0.00 0.00 179.24 177.92 2qtg s ILE 110 N -3.18 0.00 -0.09 0.35 2.07 -1.20 -4.20 121.20 114.94 2qtg s ILE 110 Ca 0.05 -0.02 -0.01 0.00 -1.41 0.00 0.00 60.65 59.26 2qtg s ILE 110 Cb 0.07 -0.95 -0.03 0.00 0.13 0.00 0.00 42.46 41.68 2qtg s ILE 110 CO 0.69 -0.01 -0.03 -0.63 -1.91 0.00 0.00 174.94 173.05 2qtg s ILE 111 N -0.18 4.01 -0.24 2.00 -1.09 -0.09 -2.07 121.20 123.54 2qtg s ILE 111 Ca -0.04 -0.35 0.02 0.00 -2.23 0.00 0.00 60.65 58.05 2qtg s ILE 111 Cb -0.03 -2.68 0.05 0.00 -1.58 0.00 0.00 42.46 38.22 2qtg s ILE 111 CO 0.04 0.58 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.58 2qtg s ILE 112 N -0.61 2.01 -0.50 2.92 1.01 0.74 -1.17 121.20 125.60 2qtg s ILE 112 Ca 0.10 -1.39 -0.24 0.00 0.00 0.00 0.00 60.65 59.12 2qtg s ILE 112 Cb -0.12 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.31 2qtg s ILE 112 CO 0.02 0.09 0.88 0.21 0.00 0.00 0.00 174.94 176.14 2qtg s ASN 113 N 1.20 6.40 -0.07 3.58 3.04 -0.23 -0.45 114.94 128.41 2qtg s ASN 113 Ca -0.05 -0.18 0.04 0.00 0.04 0.00 0.00 52.86 52.72 2qtg s ASN 113 Cb -0.18 -2.42 -0.02 0.00 -1.54 0.00 0.00 41.25 37.09 2qtg s ASN 113 CO -0.07 -1.08 -0.20 0.00 -3.04 0.00 0.00 177.10 172.71 2qtg s ALA 114 N 3.66 2.36 0.00 1.71 0.00 -1.12 -1.61 121.76 126.76 2qtg s ALA 114 Ca 0.31 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.27 2qtg s ALA 114 Cb -0.12 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.17 2qtg s ALA 114 CO 0.22 0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.81 2qtg n GLY 115 N 2.90 -1.44 3.89 0.00 0.00 -0.56 -4.44 105.19 105.54 2qtg n GLY 115 Ca -0.17 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 2qtg n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qtg s THR 116 N -2.44 4.72 0.25 2.61 -4.23 -1.26 -0.56 115.64 114.73 2qtg s THR 116 Ca 0.00 0.47 -0.19 0.00 -1.18 0.00 0.00 61.69 60.79 2qtg s THR 116 Cb 0.00 -3.83 0.02 0.00 1.34 0.00 0.00 72.50 70.03 2qtg s THR 116 CO 0.00 -0.94 0.64 0.00 -0.54 0.00 0.00 174.62 173.78 2qtg s GLY 118 N -2.92 2.22 0.05 0.00 0.00 0.36 -0.97 107.32 106.07 2qtg s GLY 118 Ca 0.12 0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.13 2qtg s GLY 118 CO 0.05 0.57 -0.05 -0.32 0.00 0.00 0.00 173.10 173.34 2qtg s GLY 119 N -2.64 0.50 -0.33 0.20 0.00 -0.25 -1.27 107.32 103.52 2qtg s GLY 119 Ca 0.60 -1.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.17 2qtg s GLY 119 CO 0.23 -1.13 0.21 -1.36 0.00 0.00 0.00 173.10 171.04 2qtg s PHE 120 N -2.90 3.21 0.52 1.90 0.08 -0.54 -0.54 117.98 119.71 2qtg s PHE 120 Ca 0.00 -0.37 0.21 0.00 0.12 0.00 0.00 56.93 56.89 2qtg s PHE 120 Cb 0.00 -2.43 1.32 0.00 -0.57 0.00 0.00 43.02 41.34 2qtg s PHE 120 CO -0.05 -0.41 2.05 1.57 -0.10 0.00 0.00 175.22 178.28 2qtg h LYS 121 N 8.44 0.04 0.00 0.44 2.10 -1.89 -0.14 116.57 125.55 2qtg h LYS 121 Ca -0.31 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 2qtg h LYS 121 Cb 1.15 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 2qtg h LYS 121 CO 0.63 0.02 0.00 1.33 -2.00 0.00 0.00 179.45 179.43 2qtg n VAL 122 N -4.44 0.71 0.23 0.07 0.24 -1.26 -1.63 118.33 112.25 2qtg n VAL 122 Ca 0.05 0.12 0.12 0.00 -2.04 0.00 0.00 64.34 62.59 2qtg n VAL 122 Cb 0.40 -0.90 0.22 0.00 -1.47 0.00 0.00 33.84 32.09 2qtg n VAL 122 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2qtg n LYS 123 N -1.86 2.51 -0.22 7.34 4.76 -0.14 -4.96 118.16 125.60 2qtg n LYS 123 Ca 0.04 -2.31 0.00 0.00 -2.87 0.00 0.00 58.31 53.17 2qtg n LYS 123 Cb 0.26 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 2qtg n LYS 123 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qtg n GLY 124 N 1.49 0.88 3.74 0.72 0.00 -0.65 -5.00 105.19 106.37 2qtg n GLY 124 Ca 0.20 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2qtg n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qtg s ALA 125 N -2.00 3.31 0.14 4.61 0.00 -0.78 -4.98 121.76 122.06 2qtg s ALA 125 Ca 0.00 0.55 0.10 0.00 0.00 0.00 0.00 51.96 52.61 2qtg s ALA 125 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2qtg s ALA 125 CO 0.00 0.09 -0.24 -0.80 0.00 0.00 0.00 175.76 174.81 2qtg s ASN 126 N -0.54 3.12 0.31 0.00 0.01 -1.26 -4.06 114.94 112.53 2qtg s ASN 126 Ca 0.43 -0.77 -0.29 0.00 -0.71 0.00 0.00 52.86 51.51 2qtg s ASN 126 Cb -0.24 -0.20 -0.11 0.00 0.41 0.00 0.00 41.25 41.10 2qtg s ASN 126 CO 0.30 0.12 1.57 -0.63 -1.51 0.00 0.00 177.10 176.95 2qtg s ILE 127 N -1.31 2.04 0.00 0.60 -1.09 -1.26 -1.81 121.20 118.37 2qtg s ILE 127 Ca 0.14 0.03 0.00 0.00 -2.23 0.00 0.00 60.65 58.60 2qtg s ILE 127 Cb -0.09 -3.02 0.00 0.00 -1.58 0.00 0.00 42.46 37.77 2qtg s ILE 127 CO 0.07 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.39 2qtg n GLY 128 N 1.76 3.27 3.68 6.18 0.00 -0.09 -5.01 105.19 114.98 2qtg n GLY 128 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 2qtg n GLY 128 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qtg n ASP 129 N 0.04 3.09 -4.35 1.61 8.00 -0.75 -4.77 116.55 119.42 2qtg n ASP 129 Ca 0.00 1.12 -0.38 0.00 0.71 0.00 0.00 54.79 56.24 2qtg n ASP 129 Cb 0.00 -1.46 -0.12 0.00 -0.02 0.00 0.00 41.12 39.52 2qtg n ASP 129 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qtg s VAL 130 N 0.33 4.15 0.14 2.53 1.01 -1.26 -1.05 120.40 126.24 2qtg s VAL 130 Ca 0.71 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.75 2qtg s VAL 130 Cb -0.63 -3.22 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 2qtg s VAL 130 CO 0.45 -0.05 0.54 -0.36 0.00 0.00 0.00 175.10 175.68 2qtg s PHE 131 N 1.50 3.62 0.01 5.22 0.40 0.76 -4.12 117.98 125.38 2qtg s PHE 131 Ca 0.02 1.07 -0.18 0.00 -0.60 0.00 0.00 56.93 57.24 2qtg s PHE 131 Cb -0.18 -2.37 -0.06 0.00 0.51 0.00 0.00 43.02 40.92 2qtg s PHE 131 CO 0.04 0.45 0.50 -1.17 0.70 0.00 0.00 175.22 175.73 2qtg s LEU 132 N -1.88 4.46 -0.14 -0.37 2.96 0.04 -1.06 118.68 122.69 2qtg s LEU 132 Ca 0.37 1.07 -0.12 0.00 -0.22 0.00 0.00 54.13 55.23 2qtg s LEU 132 Cb -0.15 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.74 2qtg s LEU 132 CO 0.19 0.23 0.24 -0.69 -1.32 0.00 0.00 176.35 175.00 2qtg s VAL 133 N -0.71 5.33 -0.09 1.68 1.01 -1.06 -3.36 120.40 123.21 2qtg s VAL 133 Ca 0.27 0.45 -0.27 0.00 0.00 0.00 0.00 61.98 62.43 2qtg s VAL 133 Cb -0.18 -3.56 -0.24 0.00 0.00 0.00 0.00 36.38 32.40 2qtg s VAL 133 CO 0.15 0.47 0.95 0.77 0.00 0.00 0.00 175.10 177.44 2qtg h SER 134 N 6.05 0.08 -5.10 3.32 4.64 -1.67 -3.42 113.55 117.45 2qtg h SER 134 Ca -0.45 -0.83 -0.00 0.00 -0.47 0.00 0.00 61.79 60.03 2qtg h SER 134 Cb 1.18 -0.02 -0.08 0.00 -0.31 0.00 0.00 62.40 63.17 2qtg h SER 134 CO 0.70 0.90 0.06 1.51 -0.87 0.00 0.00 176.83 179.13 2qtg s ASP 135 N -6.16 -0.23 0.10 4.97 1.47 -1.26 -1.52 116.67 114.05 2qtg s ASP 135 Ca -0.17 -0.62 0.06 0.00 1.18 0.00 0.00 52.55 53.00 2qtg s ASP 135 Cb -0.01 0.63 -0.03 0.00 -0.34 0.00 0.00 42.92 43.16 2qtg s ASP 135 CO 0.71 -1.16 -0.15 -0.69 0.68 0.00 0.00 175.17 174.56 2qtg s VAL 136 N -3.92 1.27 0.16 2.11 1.01 0.78 -1.53 120.40 120.28 2qtg s VAL 136 Ca 0.13 -1.55 -0.02 0.00 0.00 0.00 0.00 61.98 60.54 2qtg s VAL 136 Cb -0.02 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2qtg s VAL 136 CO 0.03 -0.32 0.11 0.68 0.00 0.00 0.00 175.10 175.60 2qtg s VAL 137 N -1.75 0.06 0.13 2.92 -7.23 -0.49 -1.53 120.40 112.51 2qtg s VAL 137 Ca 0.05 -1.87 -0.02 0.00 -1.81 0.00 0.00 61.98 58.33 2qtg s VAL 137 Cb -0.07 -2.16 -0.05 0.00 0.56 0.00 0.00 36.38 34.66 2qtg s VAL 137 CO 0.03 -0.29 0.32 -0.36 -0.31 0.00 0.00 175.10 174.49 2qtg s PHE 138 N -4.07 3.49 -0.76 2.82 0.08 0.23 -0.13 117.98 119.64 2qtg s PHE 138 Ca 0.28 0.40 0.09 0.00 0.12 0.00 0.00 56.93 57.81 2qtg s PHE 138 Cb 0.07 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.62 2qtg s PHE 138 CO 0.05 0.47 0.57 -2.39 -0.10 0.00 0.00 175.22 173.82 2qtg n HIS 139 N -0.03 0.00 -1.58 0.36 1.44 0.28 -4.74 115.22 110.94 2qtg n HIS 139 Ca -0.04 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.74 2qtg n HIS 139 Cb 0.52 0.00 0.13 0.00 0.12 0.00 0.00 29.99 30.76 2qtg n HIS 139 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 2qtg n ASP 140 N -0.34 1.63 -3.61 4.39 5.75 -1.26 -4.76 116.55 118.36 2qtg n ASP 140 Ca 0.03 -3.12 -0.32 0.00 -0.01 0.00 0.00 54.79 51.38 2qtg n ASP 140 Cb 0.18 -0.42 -0.06 0.00 -1.03 0.00 0.00 41.12 39.79 2qtg n ASP 140 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2qtg n ARG 141 N -0.88 3.04 -2.99 0.11 3.00 -1.26 -5.00 116.66 112.67 2qtg n ARG 141 Ca 0.14 -4.64 -0.42 0.00 -0.01 0.00 0.00 57.85 52.92 2qtg n ARG 141 Cb 0.73 -2.33 -0.06 0.00 0.00 0.00 0.00 32.46 30.81 2qtg n ARG 141 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2qtg s ARG 142 N -2.51 3.58 -0.50 5.56 0.52 -1.26 -4.32 118.95 120.02 2qtg s ARG 142 Ca 0.37 0.07 0.03 0.00 -0.52 0.00 0.00 55.73 55.68 2qtg s ARG 142 Cb 0.11 -3.87 0.15 0.00 0.52 0.00 0.00 34.95 31.87 2qtg s ARG 142 CO 0.01 -0.95 0.33 0.42 0.02 0.00 0.00 175.30 175.14 2qtg s ILE 143 N 3.11 1.43 -1.55 1.52 1.01 -1.26 -5.04 121.20 120.42 2qtg s ILE 143 Ca 0.29 -2.99 -0.11 0.00 0.00 0.00 0.00 60.65 57.84 2qtg s ILE 143 Cb -0.13 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2qtg s ILE 143 CO 0.19 -1.03 2.68 -0.81 0.00 0.00 0.00 174.94 175.98 2qtg n PRO 144 N 2.95 3.50 -4.10 2.79 -0.04 -1.26 -2.19 135.00 136.66 2qtg n PRO 144 Ca 0.18 -2.43 -0.09 0.00 -0.04 0.00 0.00 63.50 61.12 2qtg n PRO 144 Cb 0.39 -2.94 -0.10 0.00 -0.04 0.00 0.00 33.50 30.80 2qtg n PRO 144 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2qtg s ILE 145 N 2.23 0.37 0.40 0.52 -4.36 -1.26 -5.01 121.20 114.08 2qtg s ILE 145 Ca 0.61 -1.67 -0.27 0.00 -0.26 0.00 0.00 60.65 59.06 2qtg s ILE 145 Cb 0.17 -1.33 -0.10 0.00 1.25 0.00 0.00 42.46 42.44 2qtg s ILE 145 CO -0.07 -0.85 1.40 -2.65 0.24 0.00 0.00 174.94 173.01 2qtg n PRO 146 N 0.36 2.33 0.00 0.37 -0.02 -1.26 -1.95 135.00 134.84 2qtg n PRO 146 Ca -0.15 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2qtg n PRO 146 Cb 0.60 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2qtg n PRO 146 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2qtg n MET 147 N 0.22 0.00 0.03 -0.52 2.81 -1.26 -4.48 117.12 113.92 2qtg n MET 147 Ca 0.04 0.00 -0.08 0.00 -1.81 0.00 0.00 57.70 55.85 2qtg n MET 147 Cb 0.39 -3.57 -0.13 0.00 -0.71 0.00 0.00 33.22 29.20 2qtg n MET 147 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 2qtg h PHE 148 N 0.00 0.02 -0.42 2.03 -1.00 -1.77 -3.16 116.94 112.64 2qtg h PHE 148 Ca 0.00 -0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.80 2qtg h PHE 148 Cb 0.00 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.52 2qtg h PHE 148 CO 0.00 1.02 0.21 0.38 -1.61 0.00 0.00 178.31 178.30 2qtg h ASP 149 N 0.00 0.30 -0.51 2.17 2.03 -0.89 -0.05 116.42 119.47 2qtg h ASP 149 Ca -0.11 0.02 -0.11 0.00 -0.73 0.00 0.00 57.03 56.10 2qtg h ASP 149 Cb 1.86 -0.03 -0.02 0.00 -0.83 0.00 0.00 39.33 40.32 2qtg h ASP 149 CO 0.11 0.21 -0.12 -0.07 -1.03 0.00 0.00 179.24 178.35 2qtg h LEU 150 N 0.42 1.00 -0.38 0.15 3.38 -1.87 -2.45 115.31 115.56 2qtg h LEU 150 Ca 0.18 -0.33 0.06 0.00 0.09 0.00 0.00 57.88 57.88 2qtg h LEU 150 Cb 0.10 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 2qtg h LEU 150 CO -0.13 1.12 0.07 0.22 0.09 0.00 0.00 178.44 179.80 2qtg h TYR 151 N 0.88 0.11 -0.63 1.13 3.20 -1.46 -2.05 116.97 118.15 2qtg h TYR 151 Ca 0.14 0.02 0.09 0.00 3.14 0.00 0.00 58.73 62.12 2qtg h TYR 151 Cb 0.68 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.92 2qtg h TYR 151 CO 0.04 0.01 0.42 0.78 -1.64 0.00 0.00 178.16 177.77 2qtg h GLY 152 N 0.19 0.68 1.43 1.82 0.00 -0.74 -1.93 103.07 104.52 2qtg h GLY 152 Ca 0.18 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.32 2qtg h GLY 152 CO -0.24 0.13 0.37 -2.08 0.00 0.00 0.00 176.54 174.71 2qtg h VAL 153 N 0.50 1.12 -5.21 4.60 2.07 -0.90 -3.40 116.25 115.02 2qtg h VAL 153 Ca 0.29 -0.25 -0.41 0.00 0.82 0.00 0.00 66.70 67.15 2qtg h VAL 153 Cb 0.46 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2qtg h VAL 153 CO -0.09 0.13 -0.62 0.61 0.02 0.00 0.00 177.57 177.63 2qtg n GLY 154 N -1.46 -0.51 3.65 2.17 0.00 -0.73 -0.60 105.19 107.72 2qtg n GLY 154 Ca 0.06 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2qtg n GLY 154 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qtg s LEU 155 N -6.76 4.15 0.04 0.99 2.96 -1.26 -4.38 118.68 114.43 2qtg s LEU 155 Ca 0.42 2.06 0.03 0.00 -0.22 0.00 0.00 54.13 56.41 2qtg s LEU 155 Cb -0.20 -3.53 -0.02 0.00 0.50 0.00 0.00 46.19 42.93 2qtg s LEU 155 CO 0.51 -1.10 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.23 2qtg s ARG 156 N 4.39 0.56 -0.05 1.98 0.52 -0.58 -4.99 118.95 120.78 2qtg s ARG 156 Ca 0.75 -0.76 -0.18 0.00 -0.52 0.00 0.00 55.73 55.03 2qtg s ARG 156 Cb -0.31 -0.36 -0.05 0.00 0.52 0.00 0.00 34.95 34.75 2qtg s ARG 156 CO 0.30 0.07 0.48 -0.65 0.02 0.00 0.00 175.30 175.52 2qtg s GLN 157 N -1.54 4.21 0.69 3.54 -1.52 -1.26 -0.16 119.66 123.62 2qtg s GLN 157 Ca -0.09 0.50 -0.15 0.00 -1.95 0.00 0.00 55.36 53.67 2qtg s GLN 157 Cb -0.10 -3.35 0.02 0.00 -0.22 0.00 0.00 33.01 29.36 2qtg s GLN 157 CO 0.01 0.38 1.16 0.00 -0.25 0.00 0.00 175.29 176.58 2qtg s ALA 158 N -0.11 2.31 0.23 6.09 0.00 -0.57 -4.93 121.76 124.77 2qtg s ALA 158 Ca 0.26 0.73 -0.32 0.00 0.00 0.00 0.00 51.96 52.63 2qtg s ALA 158 Cb -0.16 -3.39 -0.14 0.00 0.00 0.00 0.00 23.12 19.43 2qtg s ALA 158 CO 0.13 -1.54 1.40 0.34 0.00 0.00 0.00 175.76 176.08 2qtg n PHE 159 N -2.50 2.10 -2.07 0.00 7.35 0.91 -4.89 117.46 118.36 2qtg n PHE 159 Ca 0.12 0.44 -0.43 0.00 -0.76 0.00 0.00 57.45 56.83 2qtg n PHE 159 Cb 0.51 -2.45 -0.03 0.00 0.35 0.00 0.00 39.48 37.86 2qtg n PHE 159 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2qtg s SER 160 N 0.31 6.59 -0.50 -2.13 0.15 -1.26 -4.88 113.70 111.97 2qtg s SER 160 Ca 0.69 2.00 0.08 0.00 0.70 0.00 0.00 55.95 59.42 2qtg s SER 160 Cb -0.67 -2.53 0.33 0.00 -1.71 0.00 0.00 66.02 61.44 2qtg s SER 160 CO 0.49 -1.02 0.83 0.35 1.20 0.00 0.00 173.24 175.08 2qtg n THR 161 N 5.77 1.69 -0.06 6.45 -2.24 -1.26 -4.83 114.28 119.80 2qtg n THR 161 Ca 0.18 -5.12 -0.02 0.00 -2.27 0.00 0.00 64.05 56.82 2qtg n THR 161 Cb 0.44 -1.14 0.22 0.00 -2.10 0.00 0.00 70.33 67.75 2qtg n THR 161 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2qtg h PRO 162 N 3.18 0.66 -0.52 -0.78 0.13 -1.92 -2.30 132.00 130.45 2qtg h PRO 162 Ca 0.12 -0.16 -0.09 0.00 -0.87 0.00 0.00 66.00 65.00 2qtg h PRO 162 Cb 0.70 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.72 2qtg h PRO 162 CO 0.69 0.68 -0.03 -0.91 -0.23 0.00 0.00 178.00 178.20 2qtg h ASN 163 N 0.63 0.93 -0.67 1.44 2.35 -1.94 -1.27 115.58 117.05 2qtg h ASN 163 Ca 0.13 -0.32 -0.04 0.00 -0.55 0.00 0.00 56.30 55.51 2qtg h ASN 163 Cb 0.40 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 2qtg h ASN 163 CO 0.02 1.03 0.25 0.25 -1.65 0.00 0.00 177.43 177.32 2qtg h LEU 164 N 0.81 0.94 0.15 1.61 6.46 -1.82 0.51 115.31 123.96 2qtg h LEU 164 Ca 0.14 -0.18 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2qtg h LEU 164 Cb 0.57 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 40.26 2qtg h LEU 164 CO 0.03 0.87 -0.07 0.25 -0.62 0.00 0.00 178.44 178.90 2qtg h LEU 165 N 0.95 -0.17 -0.83 2.25 6.46 -1.31 0.99 115.31 123.65 2qtg h LEU 165 Ca 0.22 -0.07 0.11 0.00 -0.12 0.00 0.00 57.88 58.01 2qtg h LEU 165 Cb 0.23 0.04 -0.08 0.00 -0.73 0.00 0.00 40.66 40.13 2qtg h LEU 165 CO -0.01 -0.03 0.46 0.11 -0.62 0.00 0.00 178.44 178.34 2qtg h LYS 166 N -0.30 0.72 0.06 1.25 1.57 -1.10 0.15 116.57 118.92 2qtg h LYS 166 Ca -0.02 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qtg h LYS 166 Cb 0.23 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2qtg h LYS 166 CO 0.03 0.48 -0.03 1.49 -0.57 0.00 0.00 179.45 180.85 2qtg h GLU 167 N 0.74 -0.08 0.00 3.15 4.57 -0.68 -3.35 114.58 118.94 2qtg h GLU 167 Ca 0.41 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.60 2qtg h GLU 167 Cb 0.44 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 2qtg h GLU 167 CO -0.28 0.38 -0.68 -0.07 -1.18 0.00 0.00 179.01 177.18 2qtg h LEU 168 N -0.57 0.00 -1.71 1.64 4.07 -0.77 -3.48 115.31 114.49 2qtg h LEU 168 Ca -0.01 -0.02 -0.47 0.00 0.08 0.00 0.00 57.88 57.46 2qtg h LEU 168 Cb 0.50 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.21 2qtg h LEU 168 CO 0.01 0.01 -0.85 -3.20 -1.08 0.00 0.00 178.44 173.33 2qtg n ASN 169 N -2.73 -1.28 -4.75 -0.43 5.15 0.53 -4.96 115.26 106.79 2qtg n ASN 169 Ca 0.01 -0.91 -0.40 0.00 -0.60 0.00 0.00 54.58 52.68 2qtg n ASN 169 Cb 0.53 -3.49 -0.06 0.00 -0.53 0.00 0.00 39.78 36.23 2qtg n ASN 169 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2qtg s LEU 170 N -6.91 4.64 0.69 1.20 1.43 -1.26 -5.05 118.68 113.42 2qtg s LEU 170 Ca 0.12 1.93 -0.17 0.00 -1.03 0.00 0.00 54.13 54.99 2qtg s LEU 170 Cb -0.06 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.54 2qtg s LEU 170 CO 0.86 0.15 0.87 0.29 0.23 0.00 0.00 176.35 178.74 2qtg n LYS 171 N 1.58 0.56 -4.14 1.70 5.02 -1.26 -4.73 118.16 116.89 2qtg n LYS 171 Ca -0.02 0.24 -0.15 0.00 -2.02 0.00 0.00 58.31 56.37 2qtg n LYS 171 Cb 0.47 -2.12 -0.11 0.00 -0.02 0.00 0.00 35.03 33.25 2qtg n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qtg s ILE 172 N -1.76 0.85 0.00 -0.18 1.01 -1.26 -0.78 121.20 119.09 2qtg s ILE 172 Ca 0.73 -1.42 0.00 0.00 0.00 0.00 0.00 60.65 59.95 2qtg s ILE 172 Cb -0.37 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.00 2qtg s ILE 172 CO 0.51 -0.45 0.00 0.61 0.00 0.00 0.00 174.94 175.61 2qtg n GLY 173 N 0.94 -0.16 3.82 6.18 0.00 -1.21 -4.95 105.19 109.81 2qtg n GLY 173 Ca -0.19 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 2qtg n GLY 173 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qtg s ARG 174 N -2.00 4.11 -0.17 1.61 3.52 -1.26 -1.62 118.95 123.14 2qtg s ARG 174 Ca 0.00 0.64 -0.07 0.00 -0.13 0.00 0.00 55.73 56.17 2qtg s ARG 174 Cb 0.00 -3.13 -0.04 0.00 -1.56 0.00 0.00 34.95 30.22 2qtg s ARG 174 CO 0.00 0.59 0.06 -1.17 -0.81 0.00 0.00 175.30 173.97 2qtg s LEU 175 N -1.41 3.85 -0.16 -0.88 2.96 -0.58 -0.78 118.68 121.68 2qtg s LEU 175 Ca 0.32 0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.34 2qtg s LEU 175 Cb -0.18 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 2qtg s LEU 175 CO 0.19 0.22 -0.12 -0.55 -1.32 0.00 0.00 176.35 174.77 2qtg s SER 176 N 0.10 3.95 -0.09 3.68 0.15 0.60 -1.40 113.70 120.70 2qtg s SER 176 Ca 0.05 -0.40 -0.01 0.00 0.70 0.00 0.00 55.95 56.29 2qtg s SER 176 Cb -0.12 -1.63 -0.03 0.00 -1.71 0.00 0.00 66.02 62.53 2qtg s SER 176 CO 0.01 0.08 -0.02 -0.89 1.20 0.00 0.00 173.24 173.62 2qtg s THR 177 N 0.83 4.16 0.25 6.45 2.01 0.81 -1.65 115.64 128.50 2qtg s THR 177 Ca -0.04 -0.30 -0.18 0.00 0.31 0.00 0.00 61.69 61.48 2qtg s THR 177 Cb -0.15 -2.74 0.02 0.00 0.01 0.00 0.00 72.50 69.64 2qtg s THR 177 CO 0.00 0.59 0.61 -0.83 -0.69 0.00 0.00 174.62 174.31 2qtg s GLY 178 N -0.77 0.03 -0.02 4.40 0.00 -0.54 -0.56 107.32 109.87 2qtg s GLY 178 Ca 0.12 -0.38 0.05 0.00 0.00 0.00 0.00 44.72 44.50 2qtg s GLY 178 CO 0.02 -0.24 1.04 1.22 0.00 0.00 0.00 173.10 175.14 2qtg n ASP 179 N -0.41 1.26 -4.31 1.64 8.00 -1.26 -3.89 116.55 117.57 2qtg n ASP 179 Ca -0.05 -2.06 -0.32 0.00 0.71 0.00 0.00 54.79 53.07 2qtg n ASP 179 Cb 0.61 -0.23 -0.16 0.00 -0.02 0.00 0.00 41.12 41.32 2qtg n ASP 179 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2qtg s SER 180 N -0.78 3.22 0.20 -2.24 0.01 -1.26 -4.98 113.70 107.87 2qtg s SER 180 Ca 0.12 -0.45 0.03 0.00 1.31 0.00 0.00 55.95 56.95 2qtg s SER 180 Cb 0.07 -0.73 0.11 0.00 0.21 0.00 0.00 66.02 65.68 2qtg s SER 180 CO 0.07 0.28 1.46 0.25 0.41 0.00 0.00 173.24 175.71 2qtg h LEU 181 N 5.84 0.29 0.00 2.44 5.85 -1.96 -3.46 115.31 124.32 2qtg h LEU 181 Ca -0.36 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.13 2qtg h LEU 181 Cb 1.16 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 42.11 2qtg h LEU 181 CO 0.48 0.93 0.02 -0.90 -0.34 0.00 0.00 178.44 178.63 2qtg n ASP 182 N -3.77 0.03 -3.58 1.25 5.68 -1.26 -5.08 116.55 109.81 2qtg n ASP 182 Ca -0.03 -1.04 -0.25 0.00 -0.50 0.00 0.00 54.79 52.97 2qtg n ASP 182 Cb 0.71 -0.05 -0.16 0.00 -1.14 0.00 0.00 41.12 40.48 2qtg n ASP 182 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 2qtg s MET 183 N -2.96 0.10 0.97 0.11 1.75 -1.26 -5.10 119.30 112.90 2qtg s MET 183 Ca 0.04 -0.11 -0.12 0.00 -1.25 0.00 0.00 55.69 54.25 2qtg s MET 183 Cb -0.00 -1.64 0.17 0.00 2.84 0.00 0.00 34.83 36.20 2qtg s MET 183 CO 0.03 -0.72 1.10 -1.54 -0.65 0.00 0.00 175.02 173.23 2qtg s SER 184 N 2.16 2.91 0.12 1.11 1.04 -1.26 -4.86 113.70 114.93 2qtg s SER 184 Ca 0.04 1.20 -0.12 0.00 0.48 0.00 0.00 55.95 57.54 2qtg s SER 184 Cb -0.16 -1.85 -0.07 0.00 0.10 0.00 0.00 66.02 64.03 2qtg s SER 184 CO -0.14 -2.95 1.43 0.71 0.98 0.00 0.00 173.24 173.27 2qtg h THR 185 N -1.77 1.28 -0.74 2.02 1.35 -2.00 -1.55 112.91 111.50 2qtg h THR 185 Ca -0.53 -1.61 0.13 0.00 -0.55 0.00 0.00 66.41 63.85 2qtg h THR 185 Cb 1.32 1.54 -0.09 0.00 -1.73 0.00 0.00 68.15 69.19 2qtg h THR 185 CO 0.58 0.53 0.31 -0.61 -0.25 0.00 0.00 175.52 176.08 2qtg h GLN 186 N 0.64 0.46 -0.02 4.72 5.75 -2.00 -1.09 115.11 123.58 2qtg h GLN 186 Ca 0.04 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2qtg h GLN 186 Cb 1.03 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 29.47 2qtg h GLN 186 CO 0.10 0.31 0.01 -0.44 -2.65 0.00 0.00 178.83 176.16 2qtg h ASP 187 N 0.48 0.02 -0.86 -0.69 3.32 -1.81 -2.69 116.42 114.20 2qtg h ASP 187 Ca 0.39 -0.11 0.09 0.00 0.02 0.00 0.00 57.03 57.42 2qtg h ASP 187 Cb 0.55 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.03 2qtg h ASP 187 CO -0.37 0.13 0.51 -0.08 -1.72 0.00 0.00 179.24 177.71 2qtg h GLU 188 N -0.08 0.84 -0.55 3.56 4.81 -0.90 0.88 114.58 123.13 2qtg h GLU 188 Ca 0.01 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2qtg h GLU 188 Cb 0.11 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 2qtg h GLU 188 CO -0.00 0.56 0.36 1.15 -0.73 0.00 0.00 179.01 180.35 2qtg h THR 189 N 0.87 1.13 0.07 0.32 2.02 -1.06 -0.01 112.91 116.25 2qtg h THR 189 Ca 0.40 -0.25 -0.27 0.00 0.77 0.00 0.00 66.41 67.07 2qtg h THR 189 Cb 0.33 0.33 0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2qtg h THR 189 CO -0.23 0.13 -1.12 -0.07 0.37 0.00 0.00 175.52 174.60 2qtg h LEU 190 N 0.74 0.65 -0.62 2.58 3.38 -1.00 -0.81 115.31 120.23 2qtg h LEU 190 Ca 0.21 -0.58 0.05 0.00 0.09 0.00 0.00 57.88 57.64 2qtg h LEU 190 Cb -0.07 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 2qtg h LEU 190 CO -0.05 1.41 0.34 0.40 0.09 0.00 0.00 178.44 180.62 2qtg h ILE 191 N 0.22 0.98 -0.17 1.22 2.04 -0.63 0.25 117.51 121.42 2qtg h ILE 191 Ca -0.13 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2qtg h ILE 191 Cb 1.79 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 2qtg h ILE 191 CO 0.20 0.12 -0.02 0.40 0.00 0.00 0.00 178.15 178.85 2qtg h ILE 192 N 0.64 1.27 -0.91 -0.67 2.04 -0.96 -2.18 117.51 116.75 2qtg h ILE 192 Ca 0.27 -0.93 0.01 0.00 1.00 0.00 0.00 64.86 65.22 2qtg h ILE 192 Cb 0.15 1.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 2qtg h ILE 192 CO -0.17 0.28 0.60 0.00 0.00 0.00 0.00 178.15 178.86 2qtg h ALA 193 N 0.74 1.16 -0.00 1.87 0.00 -0.74 -1.29 119.26 121.00 2qtg h ALA 193 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qtg h ALA 193 Cb 0.43 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qtg h ALA 193 CO 0.01 0.54 -0.00 0.09 0.00 0.00 0.00 179.25 179.89 2qtg n ASN 194 N -4.46 0.01 -3.55 0.00 3.02 0.84 -4.95 115.26 106.18 2qtg n ASN 194 Ca 0.10 -0.75 -0.20 0.00 -0.03 0.00 0.00 54.58 53.70 2qtg n ASN 194 Cb 0.02 -0.08 0.07 0.00 -0.61 0.00 0.00 39.78 39.18 2qtg n ASN 194 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2qtg n ASP 195 N -1.07 -2.61 -4.79 6.41 2.03 -0.49 -4.98 116.55 111.05 2qtg n ASP 195 Ca 0.21 -0.67 -0.38 0.00 0.52 0.00 0.00 54.79 54.48 2qtg n ASP 195 Cb 0.15 -4.78 -0.06 0.00 -0.72 0.00 0.00 41.12 35.71 2qtg n ASP 195 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qtg s ALA 196 N -3.43 3.38 -0.08 -1.67 0.00 -0.94 -4.63 121.76 114.39 2qtg s ALA 196 Ca 0.12 0.34 0.12 0.00 0.00 0.00 0.00 51.96 52.54 2qtg s ALA 196 Cb -0.06 -2.97 -0.24 0.00 0.00 0.00 0.00 23.12 19.86 2qtg s ALA 196 CO 0.76 0.28 0.50 2.41 0.00 0.00 0.00 175.76 179.71 2qtg n THR 197 N 1.09 1.58 -4.30 0.00 -1.04 0.04 -4.87 114.28 106.77 2qtg n THR 197 Ca -0.03 -0.79 -0.19 0.00 -2.04 0.00 0.00 64.05 61.00 2qtg n THR 197 Cb 0.50 -0.99 -0.11 0.00 -1.82 0.00 0.00 70.33 67.91 2qtg n THR 197 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2qtg s LEU 198 N -6.06 2.45 -0.03 -4.42 1.43 -0.79 -1.47 118.68 109.79 2qtg s LEU 198 Ca -0.08 -0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 52.13 2qtg s LEU 198 Cb 0.07 -0.67 0.03 0.00 0.03 0.00 0.00 46.19 45.66 2qtg s LEU 198 CO 0.82 -0.12 0.04 -0.75 0.23 0.00 0.00 176.35 176.57 2qtg s LYS 199 N -2.96 -0.02 0.00 1.70 2.20 -0.40 -0.29 119.74 119.96 2qtg s LYS 199 Ca 0.14 0.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.00 2qtg s LYS 199 Cb -0.04 -0.37 0.00 0.00 -1.51 0.00 0.00 37.83 35.91 2qtg s LYS 199 CO 0.05 -0.23 0.00 -0.40 -0.36 0.00 0.00 175.35 174.41 2qtg n ASP 200 N 4.60 0.00 0.00 1.43 5.75 -0.66 -0.49 116.55 127.19 2qtg n ASP 200 Ca -0.19 -0.85 0.00 0.00 -0.01 0.00 0.00 54.79 53.74 2qtg n ASP 200 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 2qtg n ASP 200 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 2qtg n MET 201 N 0.00 -0.00 0.00 0.11 2.81 -1.25 -1.47 117.12 117.32 2qtg n MET 201 Ca 0.00 -0.64 0.00 0.00 -1.81 0.00 0.00 57.70 55.25 2qtg n MET 201 Cb 0.00 -0.91 0.00 0.00 -0.71 0.00 0.00 33.22 31.60 2qtg n MET 201 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2qtg n GLU 202 N -0.10 2.37 0.00 0.03 4.71 -1.26 -2.13 120.64 124.26 2qtg n GLU 202 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.04 2qtg n GLU 202 Cb 0.11 -0.80 -0.04 0.00 -1.01 0.00 0.00 31.44 29.70 2qtg n GLU 202 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2qtg h GLY 203 N 0.00 -0.48 2.00 0.62 0.00 -1.95 -1.74 103.07 101.51 2qtg h GLY 203 Ca 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.73 2qtg h GLY 203 CO 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 176.54 176.27 2qtg h ALA 204 N 0.37 1.16 0.00 3.60 0.00 -1.92 -1.34 119.26 121.14 2qtg h ALA 204 Ca 0.09 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2qtg h ALA 204 Cb 0.56 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.35 2qtg h ALA 204 CO -0.35 0.07 -0.52 0.00 0.00 0.00 0.00 179.25 178.44 2qtg h ALA 205 N 1.95 0.06 -0.54 0.00 0.00 -1.68 -1.62 119.26 117.43 2qtg h ALA 205 Ca -0.00 -0.55 0.07 0.00 0.00 0.00 0.00 54.91 54.43 2qtg h ALA 205 Cb 0.25 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2qtg h ALA 205 CO 0.01 0.29 0.21 0.28 0.00 0.00 0.00 179.25 180.03 2qtg h VAL 206 N -0.21 0.83 -0.46 0.00 2.07 -0.95 -2.77 116.25 114.76 2qtg h VAL 206 Ca -0.07 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2qtg h VAL 206 Cb 1.25 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 2qtg h VAL 206 CO 0.10 0.07 0.28 0.00 0.02 0.00 0.00 177.57 178.04 2qtg h ALA 207 N 1.35 0.59 -0.40 1.67 0.00 -1.26 -0.57 119.26 120.65 2qtg h ALA 207 Ca 0.26 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.18 2qtg h ALA 207 Cb 0.27 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 2qtg h ALA 207 CO -0.25 0.08 -0.08 -0.92 0.00 0.00 0.00 179.25 178.08 2qtg h TYR 208 N 0.62 -0.18 -0.26 0.00 3.20 -1.10 0.14 116.97 119.39 2qtg h TYR 208 Ca 0.17 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 2qtg h TYR 208 Cb -0.00 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2qtg h TYR 208 CO -0.03 -0.16 0.03 0.28 -1.64 0.00 0.00 178.16 176.65 2qtg h VAL 209 N 0.01 1.23 -0.72 1.81 2.07 -1.32 -1.05 116.25 118.30 2qtg h VAL 209 Ca 0.19 -0.80 0.13 0.00 0.82 0.00 0.00 66.70 67.04 2qtg h VAL 209 Cb 0.29 1.27 -0.09 0.00 -1.52 0.00 0.00 31.29 31.23 2qtg h VAL 209 CO -0.40 0.25 0.26 0.00 0.02 0.00 0.00 177.57 177.71 2qtg h ALA 210 N 0.85 0.98 -0.28 1.67 0.00 -0.79 -1.85 119.26 119.84 2qtg h ALA 210 Ca 0.08 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2qtg h ALA 210 Cb 0.35 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2qtg h ALA 210 CO 0.01 -0.23 0.05 0.22 0.00 0.00 0.00 179.25 179.30 2qtg h ASP 211 N 0.41 0.44 -0.67 0.00 3.58 -0.58 0.75 116.42 120.34 2qtg h ASP 211 Ca 0.39 -0.26 0.14 0.00 0.42 0.00 0.00 57.03 57.72 2qtg h ASP 211 Cb 0.58 -0.12 -0.10 0.00 1.72 0.00 0.00 39.33 41.41 2qtg h ASP 211 CO -0.40 0.59 0.13 0.25 -2.88 0.00 0.00 179.24 176.93 2qtg h LEU 212 N 0.28 -0.05 -2.56 2.28 5.85 -0.74 -2.61 115.31 117.76 2qtg h LEU 212 Ca 0.08 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2qtg h LEU 212 Cb 0.33 0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2qtg h LEU 212 CO 0.01 -0.04 0.00 0.18 -0.34 0.00 0.00 178.44 178.25 2qtg n LEU 213 N -5.17 3.66 -3.68 2.25 4.77 -0.74 -4.98 117.00 113.12 2qtg n LEU 213 Ca 0.12 -1.77 -0.22 0.00 -0.03 0.00 0.00 56.01 54.11 2qtg n LEU 213 Cb 0.40 -0.36 0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2qtg n LEU 213 CO 0.13 0.86 0.02 0.29 -1.33 0.00 0.00 177.39 177.37 2qtg n LYS 214 N 1.51 -5.62 -4.47 3.23 4.76 -0.16 -5.01 118.16 112.39 2qtg n LYS 214 Ca 0.21 0.68 -0.34 0.00 -2.87 0.00 0.00 58.31 56.00 2qtg n LYS 214 Cb 0.60 -5.43 -0.13 0.00 -1.84 0.00 0.00 35.03 28.23 2qtg n LYS 214 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2qtg s ILE 215 N -3.52 3.64 0.23 -0.18 -1.09 0.08 -5.03 121.20 115.33 2qtg s ILE 215 Ca 0.16 -0.45 -0.31 0.00 -2.23 0.00 0.00 60.65 57.82 2qtg s ILE 215 Cb -0.08 -2.58 -0.14 0.00 -1.58 0.00 0.00 42.46 38.08 2qtg s ILE 215 CO 0.79 0.50 1.39 -2.65 -1.23 0.00 0.00 174.94 173.74 2qtg n PRO 216 N 3.61 1.95 -4.39 2.79 -0.02 -1.26 -4.50 135.00 133.18 2qtg n PRO 216 Ca -0.18 0.70 -0.20 0.00 -2.02 0.00 0.00 63.50 61.80 2qtg n PRO 216 Cb 0.52 -2.34 -0.15 0.00 -0.02 0.00 0.00 33.50 31.51 2qtg n PRO 216 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qtg s VAL 217 N -0.05 0.76 0.18 -1.45 0.11 -1.26 -0.91 120.40 117.78 2qtg s VAL 217 Ca 0.69 -0.37 0.03 0.00 -2.93 0.00 0.00 61.98 59.40 2qtg s VAL 217 Cb -0.67 -0.66 -0.05 0.00 -1.53 0.00 0.00 36.38 33.47 2qtg s VAL 217 CO 0.50 0.23 -0.04 0.68 -3.33 0.00 0.00 175.10 173.13 2qtg s VAL 218 N 0.02 1.01 -0.06 2.04 -7.23 -0.31 -0.06 120.40 115.80 2qtg s VAL 218 Ca -0.00 -2.03 -0.00 0.00 -1.81 0.00 0.00 61.98 58.14 2qtg s VAL 218 Cb -0.06 -2.08 0.02 0.00 0.56 0.00 0.00 36.38 34.82 2qtg s VAL 218 CO 0.00 -0.54 -0.03 -0.36 -0.31 0.00 0.00 175.10 173.87 2qtg s PHE 219 N -3.44 0.74 -0.30 2.82 0.40 -1.26 -1.07 117.98 115.87 2qtg s PHE 219 Ca 0.22 -0.21 -0.05 0.00 -0.60 0.00 0.00 56.93 56.29 2qtg s PHE 219 Cb 0.04 -0.74 0.02 0.00 0.51 0.00 0.00 43.02 42.86 2qtg s PHE 219 CO 0.04 -0.26 0.06 -0.51 0.70 0.00 0.00 175.22 175.24 2qtg s LEU 220 N 1.40 3.86 -0.20 -0.37 1.43 -0.63 -2.55 118.68 121.62 2qtg s LEU 220 Ca -0.03 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.18 2qtg s LEU 220 Cb -0.13 -1.83 0.04 0.00 0.03 0.00 0.00 46.19 44.30 2qtg s LEU 220 CO -0.03 -0.22 -0.14 -0.54 0.23 0.00 0.00 176.35 175.65 2qtg s LYS 221 N 1.42 2.44 -0.30 1.70 -0.14 -0.22 -1.49 119.74 123.15 2qtg s LYS 221 Ca 0.00 -0.93 -0.14 0.00 -1.36 0.00 0.00 55.97 53.55 2qtg s LYS 221 Cb -0.18 -2.55 -0.03 0.00 -1.68 0.00 0.00 37.83 33.39 2qtg s LYS 221 CO 0.01 -0.37 0.30 0.00 -0.76 0.00 0.00 175.35 174.53 2qtg s ALA 222 N 1.30 3.53 -0.45 5.17 0.00 0.28 -0.17 121.76 131.42 2qtg s ALA 222 Ca -0.00 -1.07 -0.28 0.00 0.00 0.00 0.00 51.96 50.61 2qtg s ALA 222 Cb -0.16 -2.66 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 2qtg s ALA 222 CO -0.09 -0.77 1.70 0.08 0.00 0.00 0.00 175.76 176.68 2qtg s VAL 223 N 1.92 3.56 -0.14 0.00 1.01 -0.22 -0.93 120.40 125.61 2qtg s VAL 223 Ca 0.11 0.51 0.18 0.00 0.00 0.00 0.00 61.98 62.78 2qtg s VAL 223 Cb -0.16 -3.93 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 2qtg s VAL 223 CO 0.11 -0.71 0.76 0.35 0.00 0.00 0.00 175.10 175.60 2qtg n THR 224 N 7.23 1.00 -3.87 3.92 -2.24 -0.14 -0.91 114.28 119.27 2qtg n THR 224 Ca 0.20 -0.66 -0.11 0.00 -2.27 0.00 0.00 64.05 61.20 2qtg n THR 224 Cb 0.49 -0.58 -0.09 0.00 -2.10 0.00 0.00 70.33 68.04 2qtg n THR 224 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2qtg s ASP 225 N -5.57 0.04 -0.46 3.42 -4.77 -1.22 -4.95 116.67 103.15 2qtg s ASP 225 Ca -0.04 -0.29 -0.18 0.00 -3.30 0.00 0.00 52.55 48.74 2qtg s ASP 225 Cb 0.09 0.24 0.04 0.00 -1.09 0.00 0.00 42.92 42.21 2qtg s ASP 225 CO 0.82 -0.46 0.50 -0.76 0.70 0.00 0.00 175.17 175.98 2qtg s LEU 226 N -1.73 5.04 0.50 2.11 1.43 -1.26 -1.09 118.68 123.68 2qtg s LEU 226 Ca -0.10 -0.88 0.15 0.00 -1.03 0.00 0.00 54.13 52.28 2qtg s LEU 226 Cb -0.04 -2.38 1.21 0.00 0.03 0.00 0.00 46.19 45.01 2qtg s LEU 226 CO -0.01 -0.71 2.12 0.58 0.23 0.00 0.00 176.35 178.56 2qtg h VAL 227 N 5.79 1.02 -0.58 -1.59 2.07 -1.18 -1.72 116.25 120.06 2qtg h VAL 227 Ca -0.27 -0.11 -0.28 0.00 0.82 0.00 0.00 66.70 66.86 2qtg h VAL 227 Cb 1.10 1.03 -0.17 0.00 -1.52 0.00 0.00 31.29 31.74 2qtg h VAL 227 CO 0.88 0.03 0.18 -0.90 0.02 0.00 0.00 177.57 177.78 2qtg n ASP 228 N -4.50 3.07 -4.34 0.57 5.75 -1.26 -4.98 116.55 110.86 2qtg n ASP 228 Ca -0.03 -3.66 -0.29 0.00 -0.01 0.00 0.00 54.79 50.80 2qtg n ASP 228 Cb 0.11 -0.70 -0.08 0.00 -1.03 0.00 0.00 41.12 39.42 2qtg n ASP 228 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2qtg s GLY 229 N -2.03 2.84 0.73 6.12 0.00 -0.65 -4.85 107.32 109.48 2qtg s GLY 229 Ca 0.49 -0.79 -0.11 0.00 0.00 0.00 0.00 44.72 44.31 2qtg s GLY 229 CO 0.04 -1.98 1.10 0.51 0.00 0.00 0.00 173.10 172.77 2qtg s ASP 230 N -3.73 5.18 0.18 1.64 -4.77 -1.26 -4.91 116.67 108.99 2qtg s ASP 230 Ca 0.15 1.18 -0.32 0.00 -3.30 0.00 0.00 52.55 50.26 2qtg s ASP 230 Cb 0.01 -1.95 -0.12 0.00 -1.09 0.00 0.00 42.92 39.77 2qtg s ASP 230 CO 0.10 -1.52 1.75 2.29 0.70 0.00 0.00 175.17 178.49 2qtg n LYS 231 N -3.13 2.75 -1.83 2.11 0.00 -1.26 -4.90 118.16 111.91 2qtg n LYS 231 Ca 0.07 1.00 -0.33 0.00 -0.00 0.00 0.00 58.31 59.05 2qtg n LYS 231 Cb 0.57 -2.85 0.04 0.00 -0.00 0.00 0.00 35.03 32.78 2qtg n LYS 231 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2qtg s PRO 232 N 1.58 2.94 0.89 -1.58 0.04 -1.26 -5.06 135.00 132.56 2qtg s PRO 232 Ca 0.77 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 63.02 2qtg s PRO 232 Cb -0.51 -1.97 0.13 0.00 0.04 0.00 0.00 34.50 32.18 2qtg s PRO 232 CO 0.34 -1.13 1.11 0.95 0.04 0.00 0.00 177.00 178.31 2qtg s THR 233 N -2.39 2.42 0.21 1.26 -4.23 -1.26 -4.79 115.64 106.86 2qtg s THR 233 Ca 0.66 0.14 -0.09 0.00 -1.18 0.00 0.00 61.69 61.22 2qtg s THR 233 Cb -0.19 -2.80 0.15 0.00 1.34 0.00 0.00 72.50 71.00 2qtg s THR 233 CO 0.41 -0.18 1.78 0.00 -0.54 0.00 0.00 174.62 176.09 2qtg h ALA 234 N -1.46 0.88 -0.07 3.99 0.00 -1.99 -0.05 119.26 120.56 2qtg h ALA 234 Ca -0.50 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.47 2qtg h ALA 234 Cb 1.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2qtg h ALA 234 CO 0.59 -0.06 -0.02 1.05 0.00 0.00 0.00 179.25 180.81 2qtg h GLU 235 N 0.57 -0.01 -0.13 0.00 -0.00 -2.00 -1.83 114.58 111.18 2qtg h GLU 235 Ca 0.31 0.00 0.01 0.00 -0.00 0.00 0.00 59.36 59.68 2qtg h GLU 235 Cb 0.30 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.04 2qtg h GLU 235 CO -0.24 -0.00 0.06 0.93 -0.00 0.00 0.00 179.01 179.75 2qtg h GLU 236 N -0.01 0.13 -0.02 1.06 5.08 -1.78 -1.65 114.58 117.39 2qtg h GLU 236 Ca 0.04 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2qtg h GLU 236 Cb 0.06 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2qtg h GLU 236 CO -0.08 0.08 -0.13 0.35 -1.00 0.00 0.00 179.01 178.24 2qtg h PHE 237 N 0.13 -0.32 -0.50 4.33 3.04 -0.83 0.52 116.94 123.32 2qtg h PHE 237 Ca 0.05 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.03 2qtg h PHE 237 Cb 0.02 0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.64 2qtg h PHE 237 CO -0.10 -0.19 0.31 -0.07 -2.02 0.00 0.00 178.31 176.24 2qtg h LEU 238 N -0.20 0.50 -0.46 0.59 3.38 -1.31 -0.74 115.31 117.08 2qtg h LEU 238 Ca 0.05 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 2qtg h LEU 238 Cb 0.27 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2qtg h LEU 238 CO -0.14 0.36 -0.04 0.06 0.09 0.00 0.00 178.44 178.77 2qtg h GLN 239 N 0.61 0.83 -0.83 1.13 3.07 -0.91 -2.93 115.11 116.09 2qtg h GLN 239 Ca 0.20 -0.29 0.03 0.00 0.09 0.00 0.00 58.65 58.68 2qtg h GLN 239 Cb -0.01 -0.07 -0.05 0.00 0.08 0.00 0.00 27.48 27.44 2qtg h GLN 239 CO -0.08 0.91 0.55 -0.91 0.09 0.00 0.00 178.83 179.39 2qtg h ASN 240 N 0.68 0.89 -0.75 0.06 2.35 0.18 -2.79 115.58 116.21 2qtg h ASN 240 Ca 0.12 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 2qtg h ASN 240 Cb 0.56 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.68 2qtg h ASN 240 CO 0.03 0.62 0.45 0.25 -1.65 0.00 0.00 177.43 177.13 2qtg h LEU 241 N 1.04 0.91 -0.83 1.61 5.85 -0.96 0.27 115.31 123.20 2qtg h LEU 241 Ca 0.33 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.87 2qtg h LEU 241 Cb 0.01 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 2qtg h LEU 241 CO -0.09 0.71 -0.30 0.71 -0.34 0.00 0.00 178.44 179.12 2qtg h THR 242 N 1.03 1.28 0.01 1.05 1.35 -1.34 -0.79 112.91 115.50 2qtg h THR 242 Ca 0.27 -1.38 -0.00 0.00 -0.55 0.00 0.00 66.41 64.74 2qtg h THR 242 Cb -0.03 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2qtg h THR 242 CO -0.05 0.44 -0.01 0.58 -0.25 0.00 0.00 175.52 176.23 2qtg h VAL 243 N 0.45 1.18 -0.71 6.82 2.07 -1.17 -0.77 116.25 124.13 2qtg h VAL 243 Ca 0.06 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.00 2qtg h VAL 243 Cb 0.76 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.07 2qtg h VAL 243 CO 0.06 0.15 0.46 0.58 0.02 0.00 0.00 177.57 178.84 2qtg h VAL 244 N -0.28 1.14 -0.00 2.57 2.07 -0.39 -0.56 116.25 120.80 2qtg h VAL 244 Ca -0.00 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 2qtg h VAL 244 Cb 0.27 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 2qtg h VAL 244 CO 0.00 0.17 0.00 0.74 0.02 0.00 0.00 177.57 178.50 2qtg h THR 245 N 0.91 1.09 -0.51 2.57 2.02 -1.08 -0.57 112.91 117.33 2qtg h THR 245 Ca 0.27 -0.25 -0.05 0.00 0.77 0.00 0.00 66.41 67.15 2qtg h THR 245 Cb -0.05 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2qtg h THR 245 CO -0.08 0.07 0.12 0.00 0.37 0.00 0.00 175.52 175.99 2qtg h ALA 246 N 0.90 1.24 -0.30 6.16 0.00 -1.00 -2.42 119.26 123.84 2qtg h ALA 246 Ca 0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 2qtg h ALA 246 Cb 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2qtg h ALA 246 CO -0.00 0.52 -0.04 0.00 0.00 0.00 0.00 179.25 179.73 2qtg h ALA 247 N 1.37 0.41 0.16 0.00 0.00 -0.92 -0.85 119.26 119.43 2qtg h ALA 247 Ca 0.17 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2qtg h ALA 247 Cb 0.29 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2qtg h ALA 247 CO -0.00 0.20 -0.08 1.25 0.00 0.00 0.00 179.25 180.63 2qtg h LEU 248 N 0.34 -0.18 0.00 0.00 5.85 -1.06 -0.56 115.31 119.70 2qtg h LEU 248 Ca 0.08 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.66 2qtg h LEU 248 Cb 0.51 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2qtg h LEU 248 CO 0.02 0.06 -0.17 -0.08 -0.34 0.00 0.00 178.44 177.93 2qtg h GLU 249 N -0.43 -0.27 -0.78 1.25 4.81 -1.47 -0.27 114.58 117.41 2qtg h GLU 249 Ca -0.02 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2qtg h GLU 249 Cb 0.34 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 2qtg h GLU 249 CO 0.04 -0.18 0.46 0.78 -0.73 0.00 0.00 179.01 179.37 2qtg h GLY 250 N -0.29 1.14 0.90 1.92 0.00 -1.17 -0.47 103.07 105.11 2qtg h GLY 250 Ca 0.05 -0.48 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 2qtg h GLY 250 CO -0.16 0.47 -0.20 -0.84 0.00 0.00 0.00 176.54 175.81 2qtg h THR 251 N 1.07 1.31 -0.57 4.70 2.02 -0.86 -2.44 112.91 118.14 2qtg h THR 251 Ca 0.28 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 2qtg h THR 251 Cb -0.02 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 2qtg h THR 251 CO -0.05 0.42 0.31 0.00 0.37 0.00 0.00 175.52 176.56 2qtg h ALA 252 N 0.71 0.73 -0.41 6.16 0.00 -0.90 -0.92 119.26 124.63 2qtg h ALA 252 Ca 0.05 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.92 2qtg h ALA 252 Cb 0.74 -0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.21 2qtg h ALA 252 CO 0.05 0.25 -0.47 1.15 0.00 0.00 0.00 179.25 180.24 2qtg h THR 253 N 0.76 0.08 -0.34 0.00 2.02 -1.06 -1.67 112.91 112.70 2qtg h THR 253 Ca 0.20 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 2qtg h THR 253 Cb 0.05 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 2qtg h THR 253 CO -0.03 0.00 0.19 0.11 0.37 0.00 0.00 175.52 176.16 2qtg h LYS 254 N -0.35 0.45 0.06 6.66 1.57 -1.22 -1.86 116.57 121.88 2qtg h LYS 254 Ca 0.12 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2qtg h LYS 254 Cb 0.59 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2qtg h LYS 254 CO -0.58 0.33 -0.03 0.28 -0.57 0.00 0.00 179.45 178.88 2qtg h VAL 255 N 0.46 1.08 -0.38 0.50 2.07 -0.89 -0.99 116.25 118.11 2qtg h VAL 255 Ca 0.12 -0.48 0.07 0.00 0.82 0.00 0.00 66.70 67.23 2qtg h VAL 255 Cb -0.00 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 2qtg h VAL 255 CO -0.02 0.12 -0.03 0.40 0.02 0.00 0.00 177.57 178.06 2qtg h ILE 256 N -0.29 0.68 -0.94 4.57 2.04 -1.03 -0.93 117.51 121.60 2qtg h ILE 256 Ca -0.01 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.85 2qtg h ILE 256 Cb 0.26 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 2qtg h ILE 256 CO 0.01 0.01 0.62 0.78 0.00 0.00 0.00 178.15 179.57 2qtg h ASN 257 N 0.06 1.05 -0.32 1.72 2.35 -1.31 -2.08 115.58 117.05 2qtg h ASN 257 Ca 0.18 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.87 2qtg h ASN 257 Cb 0.27 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2qtg h ASN 257 CO -0.34 0.74 -0.00 0.15 -1.65 0.00 0.00 177.43 176.33 2qtg h PHE 258 N 1.23 0.61 -0.70 1.19 3.57 -0.83 -3.21 116.94 118.81 2qtg h PHE 258 Ca 0.36 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2qtg h PHE 258 Cb -0.06 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 2qtg h PHE 258 CO -0.01 0.68 0.43 0.82 -2.23 0.00 0.00 178.31 178.00 2qtg h ILE 259 N 0.36 1.19 -2.10 1.41 2.04 -0.94 -3.42 117.51 116.05 2qtg h ILE 259 Ca 0.09 -0.42 -0.59 0.00 1.00 0.00 0.00 64.86 64.94 2qtg h ILE 259 Cb 0.44 0.20 0.02 0.00 -0.74 0.00 0.00 36.82 36.74 2qtg h ILE 259 CO 0.02 0.20 1.14 -3.20 0.00 0.00 0.00 178.15 176.31 2qtg n ASN 260 N -4.40 3.63 0.00 1.72 5.15 -0.81 -1.05 115.26 119.50 2qtg n ASN 260 Ca 0.07 0.94 0.00 0.00 -0.60 0.00 0.00 54.58 54.99 2qtg n ASN 260 Cb 0.06 -1.41 0.00 0.00 -0.53 0.00 0.00 39.78 37.90 2qtg n ASN 260 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qtg n GLY 261 N 4.48 0.73 3.82 8.20 0.00 -1.26 -5.02 105.19 116.14 2qtg n GLY 261 Ca 0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.99 2qtg n GLY 261 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qtg s ARG 262 N -0.57 2.97 0.56 1.61 0.52 -0.21 -4.94 118.95 118.89 2qtg s ARG 262 Ca 0.00 -0.89 0.08 0.00 -0.52 0.00 0.00 55.73 54.39 2qtg s ARG 262 Cb 0.00 -2.66 0.07 0.00 0.52 0.00 0.00 34.95 32.88 2qtg s ARG 262 CO 0.00 0.46 0.76 0.54 0.02 0.00 0.00 175.30 177.09 2qtg s ASN 263 N -3.35 5.15 0.31 0.23 2.20 -1.26 0.03 114.94 118.25 2qtg s ASN 263 Ca 0.32 -0.65 0.06 0.00 -0.94 0.00 0.00 52.86 51.66 2qtg s ASN 263 Cb -0.09 -0.02 0.51 0.00 -2.00 0.00 0.00 41.25 39.64 2qtg s ASN 263 CO 0.24 -1.26 1.74 -0.07 -2.94 0.00 0.00 177.10 174.81 2qtg h LEU 264 N 0.19 0.28 -2.17 3.54 3.38 -1.72 -2.09 115.31 116.72 2qtg h LEU 264 Ca -0.34 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.53 2qtg h LEU 264 Cb 1.28 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2qtg h LEU 264 CO 0.42 0.61 -0.03 -1.28 0.09 0.00 0.00 178.44 178.24 2qtg h SER 265 N 0.24 0.00 0.37 -0.43 0.87 -1.81 -1.95 113.55 110.83 2qtg h SER 265 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2qtg h SER 265 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2qtg h SER 265 CO 0.05 0.03 -0.54 0.47 -0.53 0.00 0.00 176.83 176.32 2qtg n ASP 266 N -4.10 0.70 0.00 6.23 8.00 -0.80 -5.06 116.55 121.52 2qtg n ASP 266 Ca -0.03 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 54.97 2qtg n ASP 266 Cb 0.12 0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2qtg n ASP 266 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99