#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qap n SER 2 N 0.00 2.21 -4.55 6.12 7.64 -1.26 -4.97 113.62 118.81 2qap n SER 2 Ca 0.00 1.09 -0.26 0.00 1.01 0.00 0.00 58.87 60.71 2qap n SER 2 Cb 0.00 -1.25 -0.10 0.00 -1.01 0.00 0.00 64.21 61.86 2qap n SER 2 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2qap s ARG 3 N 1.35 1.99 -0.16 1.43 0.52 -1.26 -5.14 118.95 117.68 2qap s ARG 3 Ca 0.86 -1.33 -0.13 0.00 -0.52 0.00 0.00 55.73 54.61 2qap s ARG 3 Cb -0.90 -2.10 0.05 0.00 0.52 0.00 0.00 34.95 32.52 2qap s ARG 3 CO 0.48 0.42 0.42 0.54 0.02 0.00 0.00 175.30 177.18 2qap s VAL 4 N -1.77 -0.01 -0.19 3.52 0.11 -1.26 -5.14 120.40 115.66 2qap s VAL 4 Ca 0.25 0.02 -0.21 0.00 -2.93 0.00 0.00 61.98 59.12 2qap s VAL 4 Cb -0.08 -0.60 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 2qap s VAL 4 CO 0.15 0.01 0.62 -0.89 -3.33 0.00 0.00 175.10 171.65 2qap s THR 5 N 0.53 5.03 0.37 5.04 2.01 -1.26 -5.05 115.64 122.31 2qap s THR 5 Ca -0.03 1.16 0.04 0.00 0.31 0.00 0.00 61.69 63.17 2qap s THR 5 Cb -0.04 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 2qap s THR 5 CO -0.03 0.12 0.08 0.68 -0.69 0.00 0.00 174.62 174.79 2qap s VAL 6 N 1.85 0.93 0.31 3.82 -7.23 -1.26 -5.13 120.40 113.70 2qap s VAL 6 Ca 0.28 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.18 2qap s VAL 6 Cb -0.16 -2.58 -0.09 0.00 0.56 0.00 0.00 36.38 34.11 2qap s VAL 6 CO 0.10 0.00 0.98 -0.76 -0.31 0.00 0.00 175.10 175.12 2qap s LEU 7 N -3.55 4.43 0.36 1.32 1.43 -1.26 -4.92 118.68 116.49 2qap s LEU 7 Ca 0.30 1.97 0.04 0.00 -1.03 0.00 0.00 54.13 55.40 2qap s LEU 7 Cb 0.06 -3.87 0.68 0.00 0.03 0.00 0.00 46.19 43.09 2qap s LEU 7 CO 0.14 -0.08 2.01 -0.61 0.23 0.00 0.00 176.35 178.04 2qap h GLN 8 N 3.43 0.78 0.00 1.70 4.15 -1.97 -0.66 115.11 122.54 2qap h GLN 8 Ca -0.46 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.91 2qap h GLN 8 Cb 1.20 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.71 2qap h GLN 8 CO 0.66 0.52 0.00 -1.13 -1.93 0.00 0.00 178.83 176.94 2qap n SER 9 N -4.45 0.36 -0.45 -0.69 3.41 -1.26 -1.42 113.62 109.11 2qap n SER 9 Ca 0.07 0.64 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 2qap n SER 9 Cb 0.08 -0.70 0.42 0.00 -0.26 0.00 0.00 64.21 63.75 2qap n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qap n GLN 10 N -1.95 1.45 -3.60 4.33 6.02 -0.26 -4.87 117.38 118.51 2qap n GLN 10 Ca 0.00 -0.91 -0.37 0.00 -0.01 0.00 0.00 57.00 55.71 2qap n GLN 10 Cb 0.08 -1.48 -0.07 0.00 1.02 0.00 0.00 30.24 29.79 2qap n GLN 10 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qap s LEU 11 N -2.17 4.34 0.38 1.08 1.43 -0.51 -5.00 118.68 118.23 2qap s LEU 11 Ca 0.32 0.63 0.14 0.00 -1.03 0.00 0.00 54.13 54.19 2qap s LEU 11 Cb 0.20 -2.37 0.98 0.00 0.03 0.00 0.00 46.19 45.03 2qap s LEU 11 CO 0.40 0.23 1.83 -0.65 0.23 0.00 0.00 176.35 178.39 2qap h PRO 12 N 5.75 0.51 0.00 1.29 0.11 -1.89 -1.60 132.00 136.17 2qap h PRO 12 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2qap h PRO 12 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qap h PRO 12 CO 0.68 0.33 0.00 0.00 -0.21 0.00 0.00 178.00 178.80 2qap n ALA 13 N -2.46 1.94 -2.31 -0.75 0.00 -1.26 -3.57 120.51 112.09 2qap n ALA 13 Ca 0.21 -0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.32 2qap n ALA 13 Cb 0.67 -1.37 0.01 0.00 0.00 0.00 0.00 19.45 18.76 2qap n ALA 13 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2qap n TYR 14 N -1.81 3.29 0.44 0.00 4.02 -0.60 -4.74 117.16 117.76 2qap n TYR 14 Ca 0.04 -2.89 0.12 0.00 -0.01 0.00 0.00 57.90 55.17 2qap n TYR 14 Cb 0.27 -0.40 0.19 0.00 -0.02 0.00 0.00 39.34 39.38 2qap n TYR 14 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2qap n ASN 15 N -0.50 3.38 -4.75 7.72 6.94 -1.23 -4.63 115.26 122.18 2qap n ASN 15 Ca 0.43 -1.99 -0.41 0.00 -0.02 0.00 0.00 54.58 52.59 2qap n ASN 15 Cb 0.55 -0.20 -0.02 0.00 -2.36 0.00 0.00 39.78 37.75 2qap n ASN 15 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2qap s ARG 16 N -1.58 4.13 0.30 -3.83 3.52 -1.26 -4.35 118.95 115.88 2qap s ARG 16 Ca 0.36 2.55 -0.29 0.00 -0.13 0.00 0.00 55.73 58.22 2qap s ARG 16 Cb 0.22 -3.03 -0.13 0.00 -1.56 0.00 0.00 34.95 30.46 2qap s ARG 16 CO 0.31 -0.61 1.39 -0.11 -0.81 0.00 0.00 175.30 175.47 2qap n LEU 17 N 2.17 3.55 -4.22 -0.88 7.94 0.20 -4.98 117.00 120.79 2qap n LEU 17 Ca 0.08 1.18 -0.35 0.00 -1.11 0.00 0.00 56.01 55.81 2qap n LEU 17 Cb 0.38 -1.48 -0.14 0.00 0.53 0.00 0.00 43.42 42.70 2qap n LEU 17 CO 0.63 -0.37 -0.38 -0.54 -1.11 0.00 0.00 177.39 175.63 2qap s LYS 18 N -1.15 2.79 -0.03 1.96 1.02 -1.26 -4.90 119.74 118.17 2qap s LYS 18 Ca 0.61 -1.02 -0.02 0.00 0.02 0.00 0.00 55.97 55.56 2qap s LYS 18 Cb -0.58 -3.08 0.01 0.00 -0.52 0.00 0.00 37.83 33.65 2qap s LYS 18 CO 0.56 -0.45 0.07 -0.08 -0.92 0.00 0.00 175.35 174.52 2qap s THR 19 N 1.34 -0.00 -0.42 2.17 -1.32 -1.26 -5.01 115.64 111.13 2qap s THR 19 Ca -0.01 0.01 0.24 0.00 -1.21 0.00 0.00 61.69 60.72 2qap s THR 19 Cb -0.17 -0.10 0.25 0.00 -1.51 0.00 0.00 72.50 70.96 2qap s THR 19 CO -0.03 0.00 1.71 -0.81 -2.21 0.00 0.00 174.62 173.29 2qap n PRO 20 N 3.10 0.19 -0.00 7.08 -0.04 -1.26 -2.30 135.00 141.77 2qap n PRO 20 Ca -0.13 0.46 0.15 0.00 -0.04 0.00 0.00 63.50 63.94 2qap n PRO 20 Cb 0.59 -1.90 0.75 0.00 -0.04 0.00 0.00 33.50 32.90 2qap n PRO 20 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2qap n TYR 21 N -2.27 0.00 -0.18 0.54 4.01 -1.26 -4.45 117.16 113.54 2qap n TYR 21 Ca 0.01 -0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.71 2qap n TYR 21 Cb 0.20 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.25 2qap n TYR 21 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2qap h GLU 22 N 1.12 -0.13 -0.77 -0.72 4.81 -1.80 0.59 114.58 117.68 2qap h GLU 22 Ca 0.00 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2qap h GLU 22 Cb 0.24 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 2qap h GLU 22 CO 0.00 -0.08 0.49 0.77 -0.73 0.00 0.00 179.01 179.45 2qap h SER 23 N -0.13 0.80 -0.34 1.04 0.02 -1.87 -1.69 113.55 111.38 2qap h SER 23 Ca 0.24 -0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.09 2qap h SER 23 Cb 0.52 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 2qap h SER 23 CO -0.63 0.55 -0.16 -0.08 -1.14 0.00 0.00 176.83 175.38 2qap h GLU 24 N 0.95 0.80 -0.45 3.45 4.81 -1.59 -1.12 114.58 121.43 2qap h GLU 24 Ca 0.31 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2qap h GLU 24 Cb 0.02 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 2qap h GLU 24 CO -0.11 0.90 0.22 -0.07 -0.73 0.00 0.00 179.01 179.22 2qap h LEU 25 N 0.71 0.59 -0.90 1.64 3.38 -0.42 -0.09 115.31 120.23 2qap h LEU 25 Ca 0.11 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 2qap h LEU 25 Cb 0.66 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2qap h LEU 25 CO 0.05 0.55 0.09 0.40 0.09 0.00 0.00 178.44 179.62 2qap h ILE 26 N 0.59 1.24 -0.66 1.22 2.04 -1.13 -0.33 117.51 120.47 2qap h ILE 26 Ca 0.16 -0.94 -0.06 0.00 1.00 0.00 0.00 64.86 65.02 2qap h ILE 26 Cb 0.12 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 2qap h ILE 26 CO -0.02 0.34 0.19 0.00 0.00 0.00 0.00 178.15 178.66 2qap h ALA 27 N 1.24 0.87 -0.56 1.87 0.00 -0.76 -1.45 119.26 120.46 2qap h ALA 27 Ca 0.18 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2qap h ALA 27 Cb 0.38 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2qap h ALA 27 CO 0.01 0.57 -0.00 1.15 0.00 0.00 0.00 179.25 180.97 2qap h THR 28 N 0.98 1.26 -0.93 0.00 2.02 -0.59 -2.49 112.91 113.17 2qap h THR 28 Ca 0.21 -1.13 0.01 0.00 0.77 0.00 0.00 66.41 66.27 2qap h THR 28 Cb 0.33 0.87 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 2qap h THR 28 CO -0.00 0.41 0.61 0.58 0.37 0.00 0.00 175.52 177.49 2qap h VAL 29 N 0.89 1.23 -0.83 3.16 2.07 -0.73 -0.97 116.25 121.07 2qap h VAL 29 Ca 0.16 -0.43 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2qap h VAL 29 Cb 0.55 -0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 2qap h VAL 29 CO 0.03 0.23 0.53 0.50 0.02 0.00 0.00 177.57 178.87 2qap h LYS 30 N 1.25 0.98 -0.52 1.57 3.64 -0.90 -1.26 116.57 121.32 2qap h LYS 30 Ca 0.34 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.58 2qap h LYS 30 Cb -0.14 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.45 2qap h LYS 30 CO -0.08 0.65 -0.01 0.87 -2.27 0.00 0.00 179.45 178.61 2qap h LYS 31 N 1.01 0.93 0.00 1.90 1.57 -0.91 -2.91 116.57 118.15 2qap h LYS 31 Ca 0.34 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2qap h LYS 31 Cb 0.05 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2qap h LYS 31 CO -0.13 0.96 0.00 1.28 -0.57 0.00 0.00 179.45 180.99 2qap n LEU 32 N -4.28 0.00 -2.09 2.94 4.77 -0.45 -3.08 117.00 114.81 2qap n LEU 32 Ca 0.01 0.33 -0.25 0.00 -0.03 0.00 0.00 56.01 56.08 2qap n LEU 32 Cb 0.33 -0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2qap n LEU 32 CO 0.43 -0.08 0.23 0.35 -1.33 0.00 0.00 177.39 176.99 2qap n THR 33 N -1.33 2.56 -2.74 -5.08 -2.24 -0.54 -4.90 114.28 100.00 2qap n THR 33 Ca 0.10 -4.26 -0.42 0.00 -2.27 0.00 0.00 64.05 57.19 2qap n THR 33 Cb 0.20 -1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 67.24 2qap n THR 33 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2qap s THR 34 N -4.72 4.83 0.14 4.28 2.01 -1.18 -4.98 115.64 116.02 2qap s THR 34 Ca 0.51 1.95 -0.34 0.00 0.31 0.00 0.00 61.69 64.12 2qap s THR 34 Cb 0.41 -4.27 -0.16 0.00 0.01 0.00 0.00 72.50 68.49 2qap s THR 34 CO 0.01 0.05 1.21 -2.65 -0.69 0.00 0.00 174.62 172.54 2qap n PRO 35 N 4.80 1.12 -1.00 4.92 -0.02 -1.26 -1.56 135.00 142.00 2qap n PRO 35 Ca 0.07 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2qap n PRO 35 Cb 0.49 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 2qap n PRO 35 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qap n GLY 36 N 2.16 0.73 3.33 -1.23 0.00 -1.26 -5.03 105.19 103.89 2qap n GLY 36 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2qap n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qap s LYS 37 N -0.03 1.26 0.04 1.61 1.02 -0.60 -4.47 119.74 118.57 2qap s LYS 37 Ca 0.00 -1.37 0.01 0.00 0.02 0.00 0.00 55.97 54.63 2qap s LYS 37 Cb 0.00 -1.38 -0.00 0.00 -0.52 0.00 0.00 37.83 35.93 2qap s LYS 37 CO 0.00 0.29 0.03 0.41 -0.92 0.00 0.00 175.35 175.16 2qap n GLY 38 N 0.44 3.91 3.69 -3.33 0.00 -0.42 -4.72 105.19 104.75 2qap n GLY 38 Ca -0.14 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.85 2qap n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qap s LEU 39 N 0.00 3.48 -0.22 0.99 1.43 0.12 -1.03 118.68 123.44 2qap s LEU 39 Ca 0.05 -0.12 -0.08 0.00 -1.03 0.00 0.00 54.13 52.94 2qap s LEU 39 Cb 0.00 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 2qap s LEU 39 CO 0.03 0.21 0.09 -0.22 0.23 0.00 0.00 176.35 176.69 2qap s LEU 40 N -2.09 3.78 -0.45 1.79 2.96 -0.68 -2.75 118.68 121.24 2qap s LEU 40 Ca 0.24 -0.01 -0.17 0.00 -0.22 0.00 0.00 54.13 53.98 2qap s LEU 40 Cb -0.12 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.62 2qap s LEU 40 CO 0.16 0.07 0.42 0.00 -1.32 0.00 0.00 176.35 175.68 2qap s ALA 41 N 1.00 3.47 -0.22 5.97 0.00 -0.25 -0.64 121.76 131.09 2qap s ALA 41 Ca 0.05 -1.76 0.11 0.00 0.00 0.00 0.00 51.96 50.36 2qap s ALA 41 Cb -0.14 -3.07 0.44 0.00 0.00 0.00 0.00 23.12 20.35 2qap s ALA 41 CO 0.03 -1.66 1.20 0.00 0.00 0.00 0.00 175.76 175.33 2qap n ALA 42 N 5.48 3.96 -0.92 0.00 0.00 -0.25 -4.26 120.51 124.52 2qap n ALA 42 Ca -0.09 -3.37 -0.21 0.00 0.00 0.00 0.00 53.44 49.77 2qap n ALA 42 Cb 0.46 -0.39 0.15 0.00 0.00 0.00 0.00 19.45 19.67 2qap n ALA 42 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qap n ASP 43 N -0.86 3.80 -4.76 0.00 5.75 -1.05 -3.82 116.55 115.60 2qap n ASP 43 Ca 0.25 -3.38 -0.39 0.00 -0.01 0.00 0.00 54.79 51.26 2qap n ASP 43 Cb 0.81 -0.80 0.02 0.00 -1.03 0.00 0.00 41.12 40.12 2qap n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2qap s GLU 44 N -2.83 3.53 0.76 0.11 8.01 -1.26 -4.76 118.70 122.25 2qap s GLU 44 Ca 0.49 2.19 -0.12 0.00 0.01 0.00 0.00 54.97 57.54 2qap s GLU 44 Cb 0.41 -2.47 0.05 0.00 -4.31 0.00 0.00 34.13 27.81 2qap s GLU 44 CO 0.09 -0.86 1.12 -1.54 0.01 0.00 0.00 175.26 174.07 2qap s SER 45 N -0.87 4.37 0.18 -0.19 1.04 -1.26 -4.91 113.70 112.05 2qap s SER 45 Ca 0.65 1.99 -0.13 0.00 0.48 0.00 0.00 55.95 58.94 2qap s SER 45 Cb -0.39 -2.54 0.09 0.00 0.10 0.00 0.00 66.02 63.28 2qap s SER 45 CO 0.48 -2.13 1.83 0.40 0.98 0.00 0.00 173.24 174.80 2qap h ILE 46 N -0.85 1.17 -0.77 -1.02 2.04 -2.02 -2.86 117.51 113.20 2qap h ILE 46 Ca -0.45 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.03 2qap h ILE 46 Cb 1.25 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2qap h ILE 46 CO 0.50 0.17 0.33 1.23 0.00 0.00 0.00 178.15 180.38 2qap h GLY 47 N 0.80 1.21 2.00 5.37 0.00 -2.01 -2.84 103.07 107.61 2qap h GLY 47 Ca 0.21 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 2qap h GLY 47 CO -0.04 0.59 -0.01 1.48 0.00 0.00 0.00 176.54 178.56 2qap h SER 48 N 1.11 0.00 1.03 0.19 4.64 -1.88 -2.18 113.55 116.47 2qap h SER 48 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2qap h SER 48 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2qap h SER 48 CO -0.03 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 2qap h THR 50 N 0.00 0.85 -0.03 0.00 2.02 -1.55 0.74 112.91 114.93 2qap h THR 50 Ca 0.00 -0.09 -0.20 0.00 0.77 0.00 0.00 66.41 66.89 2qap h THR 50 Cb 0.52 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2qap h THR 50 CO 0.00 0.02 -0.84 0.07 0.37 0.00 0.00 175.52 175.14 2qap h LYS 51 N -0.28 0.34 -0.80 6.66 2.10 -1.75 -2.68 116.57 120.16 2qap h LYS 51 Ca -0.02 -0.33 -0.05 0.00 -2.00 0.00 0.00 60.65 58.25 2qap h LYS 51 Cb 0.22 0.09 -0.04 0.00 -0.90 0.00 0.00 32.23 31.60 2qap h LYS 51 CO 0.04 1.00 0.31 -0.09 -2.00 0.00 0.00 179.45 178.72 2qap h ARG 52 N 0.21 1.20 0.00 0.07 2.43 -1.35 -2.48 114.38 114.46 2qap h ARG 52 Ca -0.05 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 2qap h ARG 52 Cb 1.44 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 2qap h ARG 52 CO 0.14 0.97 -0.05 0.74 -1.51 0.00 0.00 179.97 180.26 2qap h PHE 53 N 1.17 0.00 -0.35 2.20 0.04 -0.87 -3.37 116.94 115.76 2qap h PHE 53 Ca 0.27 0.00 0.07 0.00 2.80 0.00 0.00 57.97 61.11 2qap h PHE 53 Cb 0.23 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.29 2qap h PHE 53 CO 0.02 0.00 -0.33 0.37 -0.60 0.00 0.00 178.31 177.77 2qap h GLN 54 N 0.00 -0.27 -0.34 1.51 5.75 -1.08 -1.44 115.11 119.23 2qap h GLN 54 Ca 0.00 0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.62 2qap h GLN 54 Cb 0.78 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.37 2qap h GLN 54 CO 0.00 -0.18 0.26 -1.35 -2.65 0.00 0.00 178.83 174.91 2qap h PRO 55 N -0.28 0.00 -0.51 -2.39 0.11 -1.72 -1.47 132.00 125.73 2qap h PRO 55 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2qap h PRO 55 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2qap h PRO 55 CO -0.51 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 177.72 2qap n ILE 56 N -4.33 0.72 -3.76 4.15 -5.35 -0.73 -4.97 119.36 105.09 2qap n ILE 56 Ca 0.05 -0.86 -0.26 0.00 -0.27 0.00 0.00 62.75 61.41 2qap n ILE 56 Cb 0.43 0.77 0.05 0.00 -1.74 0.00 0.00 39.64 39.15 2qap n ILE 56 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qap n GLY 57 N 1.45 -0.47 3.40 3.28 0.00 -0.55 -4.78 105.19 107.52 2qap n GLY 57 Ca 0.20 0.19 -0.35 0.00 0.00 0.00 0.00 46.02 46.07 2qap n GLY 57 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qap s LEU 58 N -7.13 3.12 0.33 0.99 2.96 -0.92 -5.05 118.68 112.98 2qap s LEU 58 Ca 0.49 -0.27 -0.29 0.00 -0.22 0.00 0.00 54.13 53.84 2qap s LEU 58 Cb -0.23 -1.79 -0.10 0.00 0.50 0.00 0.00 46.19 44.56 2qap s LEU 58 CO 0.79 0.04 1.35 -0.94 -1.32 0.00 0.00 176.35 176.27 2qap s SER 59 N 1.14 6.69 -0.98 3.68 1.04 -1.26 -4.54 113.70 119.47 2qap s SER 59 Ca 0.02 2.75 -0.20 0.00 0.48 0.00 0.00 55.95 59.00 2qap s SER 59 Cb -0.14 -2.65 0.10 0.00 0.10 0.00 0.00 66.02 63.42 2qap s SER 59 CO 0.01 -0.60 1.28 0.21 0.98 0.00 0.00 173.24 175.11 2qap s ASN 60 N -0.37 6.58 0.37 7.02 2.47 -1.26 -4.78 114.94 124.97 2qap s ASN 60 Ca 0.50 -1.81 0.07 0.00 0.42 0.00 0.00 52.86 52.04 2qap s ASN 60 Cb -0.41 -2.48 -0.07 0.00 -1.45 0.00 0.00 41.25 36.84 2qap s ASN 60 CO 0.54 -1.25 -0.01 0.42 -3.72 0.00 0.00 177.10 173.07 2qap s THR 61 N 3.69 1.89 0.14 -5.21 -4.23 -1.26 -5.00 115.64 105.66 2qap s THR 61 Ca 0.39 -2.06 -0.18 0.00 -1.18 0.00 0.00 61.69 58.66 2qap s THR 61 Cb -0.03 -2.83 -0.03 0.00 1.34 0.00 0.00 72.50 70.96 2qap s THR 61 CO -0.09 -0.08 1.79 -0.08 -0.54 0.00 0.00 174.62 175.62 2qap h GLU 62 N 1.94 0.41 -0.62 3.99 4.81 -1.99 -0.92 114.58 122.20 2qap h GLU 62 Ca -0.43 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.75 2qap h GLU 62 Cb 1.24 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.50 2qap h GLU 62 CO 0.75 0.28 0.27 1.49 -0.73 0.00 0.00 179.01 181.07 2qap h GLU 63 N 0.41 0.89 -0.02 1.92 4.57 -1.97 -0.60 114.58 119.79 2qap h GLU 63 Ca 0.11 -0.13 -0.14 0.00 -1.18 0.00 0.00 59.36 58.03 2qap h GLU 63 Cb -0.04 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.38 2qap h GLU 63 CO -0.02 0.72 -0.61 0.45 -1.18 0.00 0.00 179.01 178.36 2qap h HIS 64 N 0.89 0.11 -0.06 0.92 3.86 -1.79 -1.60 115.15 117.48 2qap h HIS 64 Ca 0.21 -0.04 -0.14 0.00 -1.16 0.00 0.00 60.37 59.24 2qap h HIS 64 Cb 0.14 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.58 2qap h HIS 64 CO 0.01 0.68 -0.60 0.00 0.86 0.00 0.00 177.93 178.88 2qap h ARG 65 N 0.06 0.20 -0.39 2.45 3.08 -0.57 -0.75 114.38 118.46 2qap h ARG 65 Ca -0.01 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.84 2qap h ARG 65 Cb 1.10 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2qap h ARG 65 CO 0.09 0.74 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.62 2qap h ARG 66 N 0.15 0.70 -0.35 0.04 2.43 -0.77 -2.08 114.38 114.50 2qap h ARG 66 Ca -0.01 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 58.85 2qap h ARG 66 Cb 1.09 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.57 2qap h ARG 66 CO 0.09 0.81 -0.11 1.96 -1.51 0.00 0.00 179.97 181.21 2qap h GLN 67 N 0.53 0.61 -0.33 0.20 4.20 -1.10 0.01 115.11 119.23 2qap h GLN 67 Ca 0.11 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2qap h GLN 67 Cb 0.50 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 2qap h GLN 67 CO 0.02 0.71 0.21 -0.92 -0.67 0.00 0.00 178.83 178.19 2qap h TYR 68 N 0.56 0.43 -0.38 2.96 3.20 -0.87 -1.18 116.97 121.69 2qap h TYR 68 Ca 0.10 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.82 2qap h TYR 68 Cb 0.52 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2qap h TYR 68 CO 0.02 0.29 -0.39 0.00 -1.64 0.00 0.00 178.16 176.45 2qap h ARG 69 N 0.44 0.92 0.00 1.82 -0.00 -1.06 -3.00 114.38 113.50 2qap h ARG 69 Ca 0.12 -0.49 -0.01 0.00 -0.50 0.00 0.00 59.98 59.10 2qap h ARG 69 Cb -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 29.97 29.97 2qap h ARG 69 CO -0.02 1.14 -0.06 0.00 0.00 0.00 0.00 179.97 181.02 2qap h ALA 70 N 0.79 1.76 -0.88 0.04 0.00 -0.74 0.51 119.26 120.73 2qap h ALA 70 Ca 0.06 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.05 2qap h ALA 70 Cb 0.98 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.67 2qap h ALA 70 CO 0.10 0.08 0.48 1.25 0.00 0.00 0.00 179.25 181.16 2qap h LEU 71 N 0.00 0.62 0.01 0.00 5.85 -1.07 -1.03 115.31 119.70 2qap h LEU 71 Ca -0.00 0.08 -0.36 0.00 0.84 0.00 0.00 57.88 58.44 2qap h LEU 71 Cb 0.13 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 2qap h LEU 71 CO 0.01 0.27 -1.99 0.23 -0.34 0.00 0.00 178.44 176.62 2qap n MET 72 N -4.82 0.60 0.12 1.25 0.00 -0.73 -3.99 117.12 109.56 2qap n MET 72 Ca 0.18 0.37 0.08 0.00 0.00 0.00 0.00 57.70 58.33 2qap n MET 72 Cb 0.43 -1.62 0.56 0.00 0.00 0.00 0.00 33.22 32.59 2qap n MET 72 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 2qap h LEU 73 N -0.79 0.19 -3.10 4.03 3.38 -0.93 -1.91 115.31 116.19 2qap h LEU 73 Ca -0.53 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2qap h LEU 73 Cb 1.57 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.27 2qap h LEU 73 CO -0.26 0.13 0.00 -0.62 0.09 0.00 0.00 178.44 177.79 2qap n GLU 74 N -4.50 3.60 -2.51 1.13 1.02 -0.39 -4.88 120.64 114.12 2qap n GLU 74 Ca 0.01 -2.85 -0.42 0.00 -0.02 0.00 0.00 57.16 53.88 2qap n GLU 74 Cb 0.14 -1.84 -0.03 0.00 -0.02 0.00 0.00 31.44 29.69 2qap n GLU 74 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qap s ALA 75 N -1.75 2.89 0.23 0.62 0.00 -0.72 -4.96 121.76 118.07 2qap s ALA 75 Ca 0.50 -0.84 -0.31 0.00 0.00 0.00 0.00 51.96 51.30 2qap s ALA 75 Cb 0.32 -4.09 -0.14 0.00 0.00 0.00 0.00 23.12 19.21 2qap s ALA 75 CO 0.25 -2.85 1.37 0.39 0.00 0.00 0.00 175.76 174.92 2qap n GLU 76 N 8.65 1.90 -0.02 0.00 -0.58 -1.26 -2.33 120.64 127.00 2qap n GLU 76 Ca 0.09 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.51 2qap n GLU 76 Cb 0.49 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.05 2qap n GLU 76 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qap n GLY 77 N 2.14 1.28 0.30 0.62 0.00 -1.26 -4.91 105.19 103.35 2qap n GLY 77 Ca 0.12 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.33 2qap n GLY 77 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2qap h PHE 78 N 0.00 0.00 0.00 1.61 -0.00 -1.83 -2.35 116.94 114.37 2qap h PHE 78 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2qap h PHE 78 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 35.95 2qap h PHE 78 CO 0.00 0.01 0.00 -0.85 -0.00 0.00 0.00 178.31 177.47 2qap n GLU 79 N -3.12 0.00 0.20 6.09 0.00 -1.26 -1.33 120.64 121.23 2qap n GLU 79 Ca -0.01 0.35 0.09 0.00 0.00 0.00 0.00 57.16 57.60 2qap n GLU 79 Cb 0.22 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.43 2qap n GLU 79 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.13 177.50 2qap h GLN 80 N 0.00 0.00 0.00 3.44 4.15 -1.83 -3.33 115.11 117.54 2qap h GLN 80 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2qap h GLN 80 Cb 0.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.84 2qap h GLN 80 CO 0.00 0.21 -0.50 0.66 -1.93 0.00 0.00 178.83 177.27 2qap n TYR 81 N -3.22 0.00 -4.30 3.99 4.01 -0.44 -4.75 117.16 112.46 2qap n TYR 81 Ca 0.02 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.43 2qap n TYR 81 Cb 0.53 -0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.39 2qap n TYR 81 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2qap s ILE 82 N -1.57 2.13 -0.19 -0.72 -1.09 -0.44 -1.30 121.20 118.02 2qap s ILE 82 Ca 0.00 -0.93 0.22 0.00 -2.23 0.00 0.00 60.65 57.71 2qap s ILE 82 Cb 0.01 -1.88 -0.11 0.00 -1.58 0.00 0.00 42.46 38.91 2qap s ILE 82 CO 0.08 0.54 0.88 -1.54 -1.23 0.00 0.00 174.94 173.66 2qap n SER 83 N 4.44 0.59 -3.45 3.58 3.41 -0.20 -4.53 113.62 117.45 2qap n SER 83 Ca -0.21 0.21 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2qap n SER 83 Cb 0.51 0.92 -0.03 0.00 -0.26 0.00 0.00 64.21 65.35 2qap n SER 83 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qap s GLY 84 N -4.39 -0.59 -0.07 5.00 0.00 -1.25 -1.40 107.32 104.62 2qap s GLY 84 Ca -0.03 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.41 2qap s GLY 84 CO 0.83 0.31 -0.11 0.14 0.00 0.00 0.00 173.10 174.27 2qap s VAL 85 N -3.26 1.07 -0.51 1.40 1.01 -0.55 -1.69 120.40 117.87 2qap s VAL 85 Ca -0.00 -0.41 -0.24 0.00 0.00 0.00 0.00 61.98 61.33 2qap s VAL 85 Cb -0.01 -1.01 0.04 0.00 0.00 0.00 0.00 36.38 35.40 2qap s VAL 85 CO -0.09 0.35 0.90 -0.63 0.00 0.00 0.00 175.10 175.62 2qap s ILE 86 N 0.91 4.47 0.40 2.22 1.01 0.19 0.06 121.20 130.46 2qap s ILE 86 Ca -0.10 0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.87 2qap s ILE 86 Cb -0.15 -4.47 -0.04 0.00 0.01 0.00 0.00 42.46 37.81 2qap s ILE 86 CO 0.01 -0.98 0.66 -0.76 0.00 0.00 0.00 174.94 173.87 2qap s LEU 87 N 3.73 3.85 0.25 2.97 1.43 0.34 -1.09 118.68 130.16 2qap s LEU 87 Ca 0.31 0.73 -0.08 0.00 -1.03 0.00 0.00 54.13 54.07 2qap s LEU 87 Cb -0.12 -3.63 -0.06 0.00 0.03 0.00 0.00 46.19 42.40 2qap s LEU 87 CO 0.21 -0.41 0.55 -2.28 0.23 0.00 0.00 176.35 174.65 2qap s HIS 88 N -2.46 3.45 0.25 0.29 5.65 -1.25 -1.66 115.29 119.56 2qap s HIS 88 Ca 0.44 0.77 -0.07 0.00 0.25 0.00 0.00 55.06 56.45 2qap s HIS 88 Cb -0.10 -2.19 0.45 0.00 -1.18 0.00 0.00 32.58 29.56 2qap s HIS 88 CO 0.39 0.23 1.61 0.22 -0.65 0.00 0.00 174.74 176.54 2qap h ASP 89 N 2.20 -0.48 -0.35 9.88 3.58 -1.93 -1.43 116.42 127.88 2qap h ASP 89 Ca -0.47 0.22 0.02 0.00 0.42 0.00 0.00 57.03 57.22 2qap h ASP 89 Cb 1.18 0.41 -0.02 0.00 1.72 0.00 0.00 39.33 42.61 2qap h ASP 89 CO 0.68 -0.23 0.20 -0.08 -2.88 0.00 0.00 179.24 176.93 2qap h GLU 90 N 0.06 0.40 0.00 0.28 4.81 -1.98 -2.84 114.58 115.31 2qap h GLU 90 Ca 0.43 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.62 2qap h GLU 90 Cb 0.76 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 2qap h GLU 90 CO -0.75 0.26 -0.10 1.15 -0.73 0.00 0.00 179.01 178.84 2qap h THR 91 N 0.41 0.81 -0.48 0.32 2.02 -1.66 -2.38 112.91 111.95 2qap h THR 91 Ca 0.14 -0.40 0.03 0.00 0.77 0.00 0.00 66.41 66.96 2qap h THR 91 Cb 0.01 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 2qap h THR 91 CO -0.07 0.10 0.32 0.58 0.37 0.00 0.00 175.52 176.82 2qap h VAL 92 N 0.00 1.04 -0.15 3.16 2.07 -1.22 -1.70 116.25 119.45 2qap h VAL 92 Ca -0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2qap h VAL 92 Cb 0.22 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2qap h VAL 92 CO 0.01 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.31 2qap n GLY 93 N -1.49 0.87 3.93 2.17 0.00 -0.90 -4.51 105.19 105.26 2qap n GLY 93 Ca 0.05 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 2qap n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qap s GLN 94 N -1.83 3.24 0.13 1.61 -0.21 -0.64 -4.96 119.66 117.00 2qap s GLN 94 Ca 0.34 -0.15 0.08 0.00 0.02 0.00 0.00 55.36 55.64 2qap s GLN 94 Cb 0.21 -2.46 -0.04 0.00 1.00 0.00 0.00 33.01 31.72 2qap s GLN 94 CO 0.31 -0.27 -0.10 0.15 -2.12 0.00 0.00 175.29 173.25 2qap s LYS 95 N -4.67 2.10 0.87 2.91 1.02 -1.26 -1.56 119.74 119.15 2qap s LYS 95 Ca 0.48 -1.10 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 2qap s LYS 95 Cb -0.10 -2.26 0.15 0.00 -0.52 0.00 0.00 37.83 35.11 2qap s LYS 95 CO 0.41 0.48 1.21 0.00 -0.92 0.00 0.00 175.35 176.53 2qap s ALA 96 N -1.36 2.68 0.45 5.17 0.00 0.75 -4.84 121.76 124.61 2qap s ALA 96 Ca 0.22 -1.20 0.16 0.00 0.00 0.00 0.00 51.96 51.14 2qap s ALA 96 Cb -0.10 -2.63 1.11 0.00 0.00 0.00 0.00 23.12 21.50 2qap s ALA 96 CO 0.14 -2.02 1.98 0.77 0.00 0.00 0.00 175.76 176.63 2qap h SER 97 N -1.23 0.29 -0.09 0.00 0.02 -2.00 -1.94 113.55 108.59 2qap h SER 97 Ca -0.43 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2qap h SER 97 Cb 1.26 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2qap h SER 97 CO 0.44 0.17 0.00 -0.46 -1.14 0.00 0.00 176.83 175.84 2qap n ASN 98 N -4.46 0.61 0.00 3.07 6.94 -1.26 -4.91 115.26 115.26 2qap n ASN 98 Ca 0.10 -1.75 0.00 0.00 -0.02 0.00 0.00 54.58 52.91 2qap n ASN 98 Cb 0.42 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.78 2qap n ASN 98 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2qap n GLY 99 N 0.81 3.28 3.79 4.83 0.00 -0.73 -5.05 105.19 112.12 2qap n GLY 99 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2qap n GLY 99 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qap s GLN 100 N -0.61 3.52 0.62 1.61 -0.21 -1.26 -4.71 119.66 118.62 2qap s GLN 100 Ca 0.00 1.36 -0.16 0.00 0.02 0.00 0.00 55.36 56.58 2qap s GLN 100 Cb 0.00 -2.05 -0.02 0.00 1.00 0.00 0.00 33.01 31.94 2qap s GLN 100 CO 0.00 -0.67 1.10 0.95 -2.12 0.00 0.00 175.29 174.55 2qap s THR 101 N -2.10 3.36 0.32 -0.19 -4.23 -1.26 -0.18 115.64 111.36 2qap s THR 101 Ca 0.67 0.68 0.06 0.00 -1.18 0.00 0.00 61.69 61.92 2qap s THR 101 Cb -0.18 -3.20 0.31 0.00 1.34 0.00 0.00 72.50 70.77 2qap s THR 101 CO 0.28 -0.35 1.84 -0.26 -0.54 0.00 0.00 174.62 175.58 2qap h PHE 102 N 0.37 0.96 -0.77 3.99 0.04 -1.51 0.14 116.94 120.16 2qap h PHE 102 Ca -0.47 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.28 2qap h PHE 102 Cb 1.24 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 39.06 2qap h PHE 102 CO 0.55 0.32 0.30 -1.35 -0.60 0.00 0.00 178.31 177.53 2qap h PRO 103 N 0.79 1.15 -0.40 1.51 0.11 -1.86 0.80 132.00 134.09 2qap h PRO 103 Ca 0.50 -0.21 -0.08 0.00 0.11 0.00 0.00 66.00 66.31 2qap h PRO 103 Cb 0.72 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2qap h PRO 103 CO -0.26 0.94 -0.08 0.93 -0.21 0.00 0.00 178.00 179.32 2qap h GLU 104 N 1.11 0.77 0.09 1.05 5.08 -1.39 -1.74 114.58 119.55 2qap h GLU 104 Ca 0.26 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2qap h GLU 104 Cb 0.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2qap h GLU 104 CO -0.02 0.89 -0.07 -0.92 -1.00 0.00 0.00 179.01 177.89 2qap h TYR 105 N 0.58 -0.18 -0.34 4.33 3.20 -0.48 -1.95 116.97 122.12 2qap h TYR 105 Ca 0.10 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 2qap h TYR 105 Cb 0.60 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.92 2qap h TYR 105 CO 0.05 -0.11 0.20 -0.07 -1.64 0.00 0.00 178.16 176.59 2qap h LEU 106 N -0.17 0.41 -0.89 2.82 3.38 -0.81 -2.84 115.31 117.22 2qap h LEU 106 Ca -0.00 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2qap h LEU 106 Cb 0.16 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 2qap h LEU 106 CO -0.01 0.35 0.56 0.74 0.09 0.00 0.00 178.44 180.17 2qap h THR 107 N 0.44 1.07 0.00 0.22 2.02 -1.17 -0.32 112.91 115.17 2qap h THR 107 Ca 0.12 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2qap h THR 107 Cb 0.02 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.37 2qap h THR 107 CO -0.02 0.19 -0.07 0.00 0.37 0.00 0.00 175.52 175.99 2qap h ALA 108 N 1.40 1.24 -0.61 6.16 0.00 -1.12 -1.89 119.26 124.45 2qap h ALA 108 Ca 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2qap h ALA 108 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2qap h ALA 108 CO -0.16 0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.71 2qap n ARG 109 N -3.52 3.86 -1.05 0.00 1.74 -0.28 -4.94 116.66 112.48 2qap n ARG 109 Ca -0.02 -2.91 -0.02 0.00 -0.77 0.00 0.00 57.85 54.13 2qap n ARG 109 Cb 0.19 -1.93 -0.01 0.00 -1.02 0.00 0.00 32.46 29.69 2qap n ARG 109 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qap n GLY 110 N 0.93 0.51 3.59 -0.13 0.00 -0.71 -4.93 105.19 104.45 2qap n GLY 110 Ca 0.25 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2qap n GLY 110 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qap s VAL 111 N -1.90 4.65 -0.03 1.61 1.01 -0.33 -4.93 120.40 120.47 2qap s VAL 111 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 2qap s VAL 111 Cb 0.00 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 2qap s VAL 111 CO 0.00 0.43 1.15 -0.69 0.00 0.00 0.00 175.10 176.00 2qap s VAL 112 N 0.66 4.33 0.04 2.92 1.01 -0.49 -2.89 120.40 125.97 2qap s VAL 112 Ca 0.03 1.65 -0.24 0.00 0.00 0.00 0.00 61.98 63.42 2qap s VAL 112 Cb -0.13 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 2qap s VAL 112 CO 0.02 0.04 0.74 -2.16 0.00 0.00 0.00 175.10 173.74 2qap s PRO 113 N 1.79 4.47 0.37 2.72 0.04 -1.26 -1.48 135.00 141.66 2qap s PRO 113 Ca 0.55 1.02 0.05 0.00 0.04 0.00 0.00 61.00 62.66 2qap s PRO 113 Cb -0.25 -3.36 -0.07 0.00 0.04 0.00 0.00 34.50 30.87 2qap s PRO 113 CO 0.24 0.30 0.04 0.20 0.04 0.00 0.00 177.00 177.81 2qap s GLY 114 N -0.08 2.33 -0.07 0.56 0.00 0.11 -1.63 107.32 108.54 2qap s GLY 114 Ca 0.37 -2.04 -0.05 0.00 0.00 0.00 0.00 44.72 43.00 2qap s GLY 114 CO 0.22 -1.95 0.18 -1.50 0.00 0.00 0.00 173.10 170.04 2qap s ILE 115 N -3.03 -0.02 -0.26 0.90 1.10 -0.55 -0.51 121.20 118.85 2qap s ILE 115 Ca 0.34 0.07 -0.29 0.00 -0.51 0.00 0.00 60.65 60.27 2qap s ILE 115 Cb 0.09 -0.26 0.01 0.00 0.15 0.00 0.00 42.46 42.44 2qap s ILE 115 CO 0.16 0.03 1.03 -0.75 -2.11 0.00 0.00 174.94 173.30 2qap s LYS 116 N 0.57 4.20 0.00 3.50 2.36 -0.67 -1.67 119.74 128.04 2qap s LYS 116 Ca -0.04 1.24 0.18 0.00 -2.55 0.00 0.00 55.97 54.80 2qap s LYS 116 Cb -0.05 -3.67 -0.08 0.00 -1.05 0.00 0.00 37.83 32.98 2qap s LYS 116 CO -0.03 -0.70 0.85 0.25 1.55 0.00 0.00 175.35 177.28 2qap n THR 117 N 5.46 0.00 -1.62 3.43 -2.24 -0.45 -4.64 114.28 114.22 2qap n THR 117 Ca 0.11 -0.22 -0.31 0.00 -2.27 0.00 0.00 64.05 61.36 2qap n THR 117 Cb 0.46 1.13 0.05 0.00 -2.10 0.00 0.00 70.33 69.87 2qap n THR 117 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2qap s ASP 118 N -2.31 5.42 -0.35 3.42 1.47 -1.25 -4.92 116.67 118.16 2qap s ASP 118 Ca 0.12 1.54 0.07 0.00 1.18 0.00 0.00 52.55 55.46 2qap s ASP 118 Cb 0.14 -2.43 0.54 0.00 -0.34 0.00 0.00 42.92 40.83 2qap s ASP 118 CO 0.56 -1.41 1.59 0.23 0.68 0.00 0.00 175.17 176.82 2qap n MET 119 N -3.10 2.05 0.00 2.11 2.81 0.71 -4.98 117.12 116.72 2qap n MET 119 Ca 0.07 -3.21 0.00 0.00 -1.81 0.00 0.00 57.70 52.75 2qap n MET 119 Cb 0.54 -1.95 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 2qap n MET 119 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qap n GLY 120 N -1.10 0.05 3.85 3.03 0.00 -1.26 -4.65 105.19 105.10 2qap n GLY 120 Ca 0.42 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.32 2qap n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qap s LEU 121 N -1.96 4.24 0.09 0.99 1.43 -1.26 -1.51 118.68 120.70 2qap s LEU 121 Ca 0.00 1.15 -0.05 0.00 -1.03 0.00 0.00 54.13 54.20 2qap s LEU 121 Cb 0.00 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.60 2qap s LEU 121 CO 0.00 -0.02 0.10 0.00 0.23 0.00 0.00 176.35 176.67 2qap s PRO 123 N -3.91 4.12 0.24 0.00 0.02 -1.26 -0.57 135.00 133.64 2qap s PRO 123 Ca 0.09 2.57 -0.03 0.00 0.02 0.00 0.00 61.00 63.65 2qap s PRO 123 Cb 0.06 -3.01 0.28 0.00 0.02 0.00 0.00 34.50 31.86 2qap s PRO 123 CO -0.08 -0.59 1.72 1.25 -0.33 0.00 0.00 177.00 178.97 2qap h LEU 124 N 4.20 0.79 0.43 -5.54 5.85 -1.61 -3.41 115.31 116.02 2qap h LEU 124 Ca -0.48 -0.21 -0.18 0.00 0.84 0.00 0.00 57.88 57.84 2qap h LEU 124 Cb 1.23 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.97 2qap h LEU 124 CO 0.74 0.88 -0.17 0.18 -0.34 0.00 0.00 178.44 179.73 2qap n LEU 125 N -4.19 -0.45 -3.92 2.25 4.77 -1.26 -4.90 117.00 109.30 2qap n LEU 125 Ca 0.02 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.13 2qap n LEU 125 Cb 0.33 -1.94 -0.07 0.00 -2.33 0.00 0.00 43.42 39.41 2qap n LEU 125 CO 0.42 -0.68 -0.03 -1.61 -1.33 0.00 0.00 177.39 174.16 2qap s GLU 126 N -2.53 1.07 3.90 3.23 2.02 -1.26 -5.11 118.70 120.03 2qap s GLU 126 Ca 0.00 -1.09 0.00 0.00 0.02 0.00 0.00 54.97 53.90 2qap s GLU 126 Cb 0.00 0.37 0.00 0.00 0.10 0.00 0.00 34.13 34.60 2qap s GLU 126 CO 0.00 -0.38 0.00 0.41 0.02 0.00 0.00 175.26 175.31 2qap n GLY 127 N -0.18 0.62 3.89 -1.39 0.00 -1.26 -4.85 105.19 102.02 2qap n GLY 127 Ca -0.10 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 44.78 2qap n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qap s ALA 128 N -1.62 3.59 0.37 4.61 0.00 -1.26 -5.04 121.76 122.41 2qap s ALA 128 Ca 0.00 -0.38 -0.28 0.00 0.00 0.00 0.00 51.96 51.30 2qap s ALA 128 Cb 0.00 -2.38 -0.11 0.00 0.00 0.00 0.00 23.12 20.62 2qap s ALA 128 CO 0.00 0.41 1.42 -1.91 0.00 0.00 0.00 175.76 175.68 2qap n GLU 129 N -0.43 2.49 0.00 0.00 4.07 -1.26 -2.11 120.64 123.39 2qap n GLU 129 Ca -0.00 0.87 0.00 0.00 -0.06 0.00 0.00 57.16 57.97 2qap n GLU 129 Cb 0.53 -2.56 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 2qap n GLU 129 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qap n GLY 130 N 0.55 2.33 3.80 8.31 0.00 -1.26 -5.05 105.19 113.87 2qap n GLY 130 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2qap n GLY 130 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qap s GLU 131 N -0.78 4.33 0.07 1.61 2.02 -0.90 -4.91 118.70 120.15 2qap s GLU 131 Ca 0.00 1.26 0.04 0.00 0.02 0.00 0.00 54.97 56.29 2qap s GLU 131 Cb 0.00 -2.45 -0.03 0.00 0.10 0.00 0.00 34.13 31.75 2qap s GLU 131 CO 0.00 0.05 -0.12 -0.65 0.02 0.00 0.00 175.26 174.56 2qap s GLN 132 N -2.68 0.79 0.48 1.61 -0.21 -1.26 -1.67 119.66 116.71 2qap s GLN 132 Ca 0.57 -0.98 0.06 0.00 0.02 0.00 0.00 55.36 55.04 2qap s GLN 132 Cb -0.15 -0.69 -0.01 0.00 1.00 0.00 0.00 33.01 33.17 2qap s GLN 132 CO 0.19 0.14 0.29 0.00 -2.12 0.00 0.00 175.29 173.80 2qap s MET 133 N -1.98 2.29 -0.09 2.91 0.23 0.27 -4.61 119.30 118.32 2qap s MET 133 Ca -0.01 -1.90 0.04 0.00 -1.03 0.00 0.00 55.69 52.78 2qap s MET 133 Cb -0.08 -2.07 0.00 0.00 -1.53 0.00 0.00 34.83 31.15 2qap s MET 133 CO 0.02 -0.36 -0.21 0.99 -2.03 0.00 0.00 175.02 173.43 2qap s THR 134 N -2.67 1.78 0.42 3.16 2.01 -1.26 -1.16 115.64 117.92 2qap s THR 134 Ca 0.37 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.52 2qap s THR 134 Cb -0.00 -1.55 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 2qap s THR 134 CO 0.21 0.50 0.63 -1.61 -0.69 0.00 0.00 174.62 173.66 2qap s GLU 135 N 0.40 3.11 0.00 4.92 2.02 -0.57 -4.85 118.70 123.73 2qap s GLU 135 Ca -0.17 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2qap s GLU 135 Cb -0.17 -2.61 0.00 0.00 0.10 0.00 0.00 34.13 31.45 2qap s GLU 135 CO 0.07 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.58 2qap n GLY 136 N -1.98 0.53 0.18 -1.39 0.00 -1.26 -0.21 105.19 101.06 2qap n GLY 136 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 2qap n GLY 136 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qap h LEU 137 N 0.00 0.00 -9.60 0.99 3.38 -1.93 -3.38 115.31 104.77 2qap h LEU 137 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2qap h LEU 137 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 2qap h LEU 137 CO 0.00 0.43 0.76 -1.81 0.09 0.00 0.00 178.44 177.91 2qap s ASP 138 N -6.81 6.75 -0.79 -0.43 1.01 -1.26 -2.10 116.67 113.04 2qap s ASP 138 Ca -0.02 2.46 0.00 0.00 0.71 0.00 0.00 52.55 55.70 2qap s ASP 138 Cb 0.13 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.47 2qap s ASP 138 CO 0.72 -0.69 0.00 0.61 0.21 0.00 0.00 175.17 176.02 2qap n GLY 139 N 3.26 0.85 0.15 0.21 0.00 -1.26 -4.92 105.19 103.48 2qap n GLY 139 Ca 0.11 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 2qap n GLY 139 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2qap h TYR 140 N 0.00 -0.26 -0.71 1.61 5.03 -1.61 -2.40 116.97 118.62 2qap h TYR 140 Ca -0.15 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.20 2qap h TYR 140 Cb 0.79 0.11 -0.04 0.00 1.55 0.00 0.00 36.73 39.14 2qap h TYR 140 CO 0.40 -0.16 0.47 0.28 -1.32 0.00 0.00 178.16 177.83 2qap h VAL 141 N -0.19 1.11 -0.43 1.81 2.07 -1.89 0.21 116.25 118.94 2qap h VAL 141 Ca 0.03 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 2qap h VAL 141 Cb 0.22 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 2qap h VAL 141 CO -0.09 0.16 0.11 0.50 0.02 0.00 0.00 177.57 178.27 2qap h LYS 142 N 0.86 0.68 -0.23 1.57 3.64 -1.91 -0.11 116.57 121.07 2qap h LYS 142 Ca 0.28 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2qap h LYS 142 Cb 0.06 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2qap h LYS 142 CO -0.08 0.68 -0.02 0.00 -2.27 0.00 0.00 179.45 177.76 2qap h ARG 143 N 0.55 0.42 -0.68 1.90 3.08 -0.82 -2.77 114.38 116.06 2qap h ARG 143 Ca 0.13 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 2qap h ARG 143 Cb 0.30 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 2qap h ARG 143 CO 0.00 0.63 0.26 0.00 -1.07 0.00 0.00 179.97 179.79 2qap h ALA 144 N 0.78 1.17 -0.41 0.04 0.00 -0.53 -1.81 119.26 118.50 2qap h ALA 144 Ca 0.06 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2qap h ALA 144 Cb 0.45 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qap h ALA 144 CO 0.02 0.59 -0.01 0.77 0.00 0.00 0.00 179.25 180.62 2qap h SER 145 N 0.99 0.64 -0.35 0.00 0.02 -0.99 -0.45 113.55 113.41 2qap h SER 145 Ca 0.23 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.93 2qap h SER 145 Cb 0.21 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 2qap h SER 145 CO -0.02 0.71 -0.22 0.00 -1.14 0.00 0.00 176.83 176.17 2qap h ALA 146 N 1.36 0.50 -0.61 3.77 0.00 -1.14 -1.94 119.26 121.19 2qap h ALA 146 Ca 0.13 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2qap h ALA 146 Cb 0.41 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2qap h ALA 146 CO 0.02 0.47 0.12 1.88 0.00 0.00 0.00 179.25 181.74 2qap h TYR 147 N 0.56 1.02 -0.36 0.00 0.05 -1.03 -2.39 116.97 114.82 2qap h TYR 147 Ca 0.07 -0.12 0.01 0.00 0.05 0.00 0.00 58.73 58.74 2qap h TYR 147 Cb 0.77 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.20 2qap h TYR 147 CO 0.06 0.85 0.23 -0.92 -1.05 0.00 0.00 178.16 177.33 2qap h TYR 148 N 0.92 0.43 0.00 4.88 3.20 -0.88 -1.56 116.97 123.96 2qap h TYR 148 Ca 0.19 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 2qap h TYR 148 Cb 0.37 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 2qap h TYR 148 CO 0.02 0.27 -0.09 0.87 -1.64 0.00 0.00 178.16 177.60 2qap h LYS 149 N 0.47 0.00 -0.00 1.82 1.57 -1.08 -0.71 116.57 118.64 2qap h LYS 149 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2qap h LYS 149 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2qap h LYS 149 CO -0.04 0.09 -0.10 1.63 -0.57 0.00 0.00 179.45 180.46 2qap n LYS 150 N -3.73 0.41 0.00 3.15 5.02 -0.68 -4.91 118.16 117.41 2qap n LYS 150 Ca -0.02 -0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2qap n LYS 150 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2qap n LYS 150 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qap n GLY 151 N 1.35 1.30 3.77 0.72 0.00 -0.27 -4.61 105.19 107.45 2qap n GLY 151 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 2qap n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qap n ARG 153 N 0.75 -0.11 -3.69 0.00 5.12 -0.65 -4.25 116.66 113.84 2qap n ARG 153 Ca 0.01 -0.33 -0.10 0.00 -1.93 0.00 0.00 57.85 55.50 2qap n ARG 153 Cb 0.43 -0.81 -0.05 0.00 -1.16 0.00 0.00 32.46 30.88 2qap n ARG 153 CO 0.00 0.00 0.00 -0.59 -1.93 0.00 0.00 177.63 175.11 2qap s PHE 154 N -0.08 -0.13 0.28 -1.55 -0.12 -1.24 -1.69 117.98 113.46 2qap s PHE 154 Ca 0.00 -0.20 0.03 0.00 -0.05 0.00 0.00 56.93 56.71 2qap s PHE 154 Cb 0.00 0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 42.61 2qap s PHE 154 CO 0.00 -0.74 0.25 0.00 -0.05 0.00 0.00 175.22 174.67 2qap s LYS 156 N -3.68 0.10 -0.03 0.00 2.20 -0.67 -0.79 119.74 116.88 2qap s LYS 156 Ca 0.39 0.11 -0.01 0.00 -0.36 0.00 0.00 55.97 56.10 2qap s LYS 156 Cb 0.04 0.05 0.03 0.00 -1.51 0.00 0.00 37.83 36.43 2qap s LYS 156 CO 0.21 -0.01 0.03 -0.46 -0.36 0.00 0.00 175.35 174.77 2qap s TRP 157 N 0.03 0.11 -0.15 4.03 -0.11 -1.09 -1.34 118.94 120.41 2qap s TRP 157 Ca -0.00 0.14 -0.02 0.00 1.22 0.00 0.00 56.10 57.44 2qap s TRP 157 Cb -0.01 -0.37 -0.02 0.00 -1.50 0.00 0.00 33.47 31.58 2qap s TRP 157 CO 0.00 -0.14 -0.09 0.50 -4.62 0.00 0.00 176.95 172.61 2qap s ARG 158 N 1.47 3.50 0.08 5.86 3.52 -1.26 -1.96 118.95 130.16 2qap s ARG 158 Ca -0.04 -0.61 0.10 0.00 -0.13 0.00 0.00 55.73 55.04 2qap s ARG 158 Cb -0.13 -2.77 -0.03 0.00 -1.56 0.00 0.00 34.95 30.46 2qap s ARG 158 CO -0.03 0.20 -0.26 -0.80 -0.81 0.00 0.00 175.30 173.60 2qap s ASN 159 N 0.43 3.11 0.17 -2.12 -0.87 -0.20 -4.81 114.94 110.66 2qap s ASN 159 Ca -0.07 -0.65 0.10 0.00 -1.57 0.00 0.00 52.86 50.67 2qap s ASN 159 Cb -0.15 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.25 40.79 2qap s ASN 159 CO 0.04 0.21 -0.21 0.68 -2.57 0.00 0.00 177.10 175.25 2qap s VAL 160 N -0.92 2.06 -0.07 1.60 -7.23 -1.26 -1.12 120.40 113.47 2qap s VAL 160 Ca 0.12 -1.93 0.01 0.00 -1.81 0.00 0.00 61.98 58.37 2qap s VAL 160 Cb -0.10 -1.95 0.02 0.00 0.56 0.00 0.00 36.38 34.92 2qap s VAL 160 CO 0.04 -0.19 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.25 2qap s TYR 161 N -1.77 1.12 -0.26 2.82 1.51 0.08 -4.63 117.35 116.22 2qap s TYR 161 Ca 0.17 -0.42 -0.08 0.00 -1.01 0.00 0.00 57.07 55.73 2qap s TYR 161 Cb -0.07 -0.93 -0.03 0.00 -0.11 0.00 0.00 41.96 40.82 2qap s TYR 161 CO 0.08 -0.30 0.10 0.21 -1.11 0.00 0.00 175.55 174.53 2qap s LYS 162 N 1.11 3.67 -0.22 -0.62 2.20 -1.26 -1.39 119.74 123.23 2qap s LYS 162 Ca -0.07 -0.48 -0.29 0.00 -0.36 0.00 0.00 55.97 54.77 2qap s LYS 162 Cb -0.14 -3.40 0.01 0.00 -1.51 0.00 0.00 37.83 32.78 2qap s LYS 162 CO -0.01 -0.21 1.07 0.42 -0.36 0.00 0.00 175.35 176.26 2qap s ILE 163 N 1.64 4.62 -0.06 5.43 1.01 -1.26 -4.66 121.20 127.92 2qap s ILE 163 Ca 0.06 1.96 0.01 0.00 0.00 0.00 0.00 60.65 62.68 2qap s ILE 163 Cb -0.15 -4.27 0.02 0.00 0.01 0.00 0.00 42.46 38.07 2qap s ILE 163 CO 0.05 -0.18 -0.05 -1.10 0.00 0.00 0.00 174.94 173.67 2qap s GLN 164 N 3.25 0.93 -1.65 2.79 -0.21 -0.57 -4.75 119.66 119.45 2qap s GLN 164 Ca 0.46 -0.11 -0.02 0.00 0.02 0.00 0.00 55.36 55.70 2qap s GLN 164 Cb -0.16 -0.97 0.00 0.00 1.00 0.00 0.00 33.01 32.88 2qap s GLN 164 CO 0.07 -0.12 0.29 0.09 -2.12 0.00 0.00 175.29 173.51 2qap n ASN 165 N 4.26 -5.97 -0.58 5.90 5.03 -1.26 -1.99 115.26 120.64 2qap n ASN 165 Ca -0.21 -0.15 -0.08 0.00 0.87 0.00 0.00 54.58 55.02 2qap n ASN 165 Cb 0.51 -4.89 -0.03 0.00 -1.02 0.00 0.00 39.78 34.35 2qap n ASN 165 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qap n GLY 166 N -1.26 0.94 3.71 7.41 0.00 -1.26 -4.98 105.19 109.75 2qap n GLY 166 Ca -0.18 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 2qap n GLY 166 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qap s THR 167 N -2.19 0.00 0.04 2.61 -1.32 -0.84 -4.92 115.64 109.02 2qap s THR 167 Ca 0.00 -1.18 0.00 0.00 -1.21 0.00 0.00 61.69 59.30 2qap s THR 167 Cb 0.00 -2.79 -0.03 0.00 -1.51 0.00 0.00 72.50 68.17 2qap s THR 167 CO 0.00 0.00 -0.04 0.68 -2.21 0.00 0.00 174.62 173.05 2qap s VAL 168 N -2.56 0.28 0.51 5.08 -7.23 -1.26 -1.51 120.40 113.70 2qap s VAL 168 Ca 0.20 -1.39 -0.19 0.00 -1.81 0.00 0.00 61.98 58.79 2qap s VAL 168 Cb -0.04 -0.94 -0.08 0.00 0.56 0.00 0.00 36.38 35.89 2qap s VAL 168 CO 0.14 -0.71 1.04 -0.94 -0.31 0.00 0.00 175.10 174.32 2qap s SER 169 N -2.20 6.26 0.42 4.85 1.04 -1.26 -4.93 113.70 117.89 2qap s SER 169 Ca -0.03 1.89 0.19 0.00 0.48 0.00 0.00 55.95 58.47 2qap s SER 169 Cb -0.02 -2.55 0.96 0.00 0.10 0.00 0.00 66.02 64.51 2qap s SER 169 CO -0.05 -0.84 1.90 -0.33 0.98 0.00 0.00 173.24 174.90 2qap h GLU 170 N 1.34 0.00 -0.49 4.02 4.39 -2.01 -2.10 114.58 119.73 2qap h GLU 170 Ca -0.49 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.22 2qap h GLU 170 Cb 1.22 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 2qap h GLU 170 CO 0.59 0.28 0.32 0.77 -1.16 0.00 0.00 179.01 179.81 2qap h SER 171 N 0.00 0.56 -0.25 1.42 0.02 -1.95 -0.21 113.55 113.13 2qap h SER 171 Ca -0.00 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 2qap h SER 171 Cb 0.58 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.98 2qap h SER 171 CO 0.04 0.40 -0.24 0.00 -1.14 0.00 0.00 176.83 175.89 2qap h ALA 172 N 1.18 0.36 -0.39 3.77 0.00 -1.79 -1.21 119.26 121.18 2qap h ALA 172 Ca 0.18 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.74 2qap h ALA 172 Cb -0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2qap h ALA 172 CO -0.04 0.34 0.20 0.28 0.00 0.00 0.00 179.25 180.02 2qap h VAL 173 N 0.31 0.98 0.07 0.00 2.07 -1.12 -1.03 116.25 117.53 2qap h VAL 173 Ca 0.04 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2qap h VAL 173 Cb 0.80 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2qap h VAL 173 CO 0.06 0.07 -0.04 0.03 0.02 0.00 0.00 177.57 177.72 2qap h ARG 174 N 0.40 -0.10 -0.37 1.57 3.08 -1.06 -3.03 114.38 114.87 2qap h ARG 174 Ca 0.17 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.21 2qap h ARG 174 Cb 0.07 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2qap h ARG 174 CO -0.11 0.41 0.19 0.35 -1.07 0.00 0.00 179.97 179.74 2qap h PHE 175 N -0.66 0.52 -0.05 3.04 3.57 -1.19 -1.62 116.94 120.55 2qap h PHE 175 Ca -0.01 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.37 2qap h PHE 175 Cb 0.55 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2qap h PHE 175 CO 0.10 0.42 -0.43 -0.91 -2.23 0.00 0.00 178.31 175.26 2qap h ASN 176 N 0.47 0.11 -0.41 0.41 2.35 -1.33 -1.50 115.58 115.69 2qap h ASN 176 Ca 0.13 -0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.77 2qap h ASN 176 Cb 0.08 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 2qap h ASN 176 CO -0.02 0.53 0.00 0.00 -1.65 0.00 0.00 177.43 176.30 2qap h ALA 177 N 1.47 0.56 -0.53 -0.83 0.00 -1.37 -1.18 119.26 117.38 2qap h ALA 177 Ca 0.01 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2qap h ALA 177 Cb 0.80 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2qap h ALA 177 CO 0.06 0.34 0.05 0.93 0.00 0.00 0.00 179.25 180.63 2qap h GLU 178 N 0.56 0.86 -0.10 0.00 4.39 -1.01 -0.85 114.58 118.43 2qap h GLU 178 Ca 0.12 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 2qap h GLU 178 Cb 0.48 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.02 2qap h GLU 178 CO 0.02 0.82 0.03 1.15 -1.16 0.00 0.00 179.01 179.87 2qap h THR 179 N 0.81 1.19 -0.94 1.13 2.02 -1.05 -1.39 112.91 114.68 2qap h THR 179 Ca 0.16 -0.58 0.02 0.00 0.77 0.00 0.00 66.41 66.78 2qap h THR 179 Cb 0.41 1.39 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 2qap h THR 179 CO 0.01 0.17 0.62 -0.07 0.37 0.00 0.00 175.52 176.62 2qap h LEU 180 N -0.04 1.05 -0.42 2.58 3.38 -0.98 -1.09 115.31 119.79 2qap h LEU 180 Ca 0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 2qap h LEU 180 Cb 0.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qap h LEU 180 CO -0.00 0.75 0.00 0.00 0.09 0.00 0.00 178.44 179.28 2qap h ALA 181 N 1.36 0.56 -0.67 1.53 0.00 -0.98 -1.43 119.26 119.63 2qap h ALA 181 Ca 0.35 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2qap h ALA 181 Cb -0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2qap h ALA 181 CO -0.09 0.35 0.14 -0.09 0.00 0.00 0.00 179.25 179.55 2qap h ARG 182 N 0.57 1.09 -0.67 0.00 9.65 -1.02 -2.56 114.38 121.43 2qap h ARG 182 Ca 0.12 -0.28 0.04 0.00 -1.10 0.00 0.00 59.98 58.76 2qap h ARG 182 Cb 0.48 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 28.88 2qap h ARG 182 CO 0.02 0.98 0.41 -0.92 2.80 0.00 0.00 179.97 183.26 2qap h TYR 183 N 1.01 0.76 -0.51 2.20 3.20 -0.99 -1.70 116.97 120.95 2qap h TYR 183 Ca 0.21 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 2qap h TYR 183 Cb 0.40 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 2qap h TYR 183 CO 0.03 0.42 0.30 0.00 -1.64 0.00 0.00 178.16 177.27 2qap h ALA 184 N 1.30 0.65 -0.24 1.82 0.00 -0.92 -1.41 119.26 120.46 2qap h ALA 184 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2qap h ALA 184 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2qap h ALA 184 CO -0.12 0.14 0.11 0.82 0.00 0.00 0.00 179.25 180.19 2qap h ILE 185 N 0.68 1.16 -0.37 0.00 5.03 -1.15 -1.45 117.51 121.40 2qap h ILE 185 Ca 0.18 -0.47 -0.05 0.00 -0.12 0.00 0.00 64.86 64.40 2qap h ILE 185 Cb 0.00 1.02 -0.02 0.00 -3.03 0.00 0.00 36.82 34.79 2qap h ILE 185 CO -0.03 0.16 -0.00 -0.07 -0.68 0.00 0.00 178.15 177.52 2qap h LEU 186 N 0.25 0.55 -0.09 1.44 3.38 -1.19 -1.36 115.31 118.28 2qap h LEU 186 Ca 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2qap h LEU 186 Cb 0.15 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qap h LEU 186 CO -0.01 0.62 0.00 0.28 0.09 0.00 0.00 178.44 179.42 2qap h SER 187 N 0.55 0.16 -0.29 -0.43 0.02 -1.05 -2.29 113.55 110.23 2qap h SER 187 Ca 0.12 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.72 2qap h SER 187 Cb 0.36 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 2qap h SER 187 CO 0.01 0.42 0.06 1.56 -1.14 0.00 0.00 176.83 177.74 2qap h GLN 188 N -0.11 0.57 0.00 3.45 4.20 -1.00 -0.38 115.11 121.83 2qap h GLN 188 Ca 0.03 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2qap h GLN 188 Cb 0.34 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 2qap h GLN 188 CO 0.00 0.55 -0.11 0.52 -0.67 0.00 0.00 178.83 179.13 2qap h MET 189 N 0.55 0.00 -0.02 1.46 2.86 -1.13 -2.64 114.93 116.01 2qap h MET 189 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 2qap h MET 189 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2qap h MET 189 CO 0.00 0.11 -0.05 0.43 1.06 0.00 0.00 176.91 178.46 2qap n SER 190 N -3.33 2.33 0.00 1.22 7.64 -0.29 -4.95 113.62 116.23 2qap n SER 190 Ca -0.00 -1.74 0.00 0.00 1.01 0.00 0.00 58.87 58.14 2qap n SER 190 Cb 0.31 0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2qap n SER 190 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qap n GLY 191 N 1.30 0.69 3.31 0.23 0.00 -0.81 -4.65 105.19 105.26 2qap n GLY 191 Ca 0.15 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2qap n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qap s LEU 192 N 0.00 2.65 -0.04 0.99 1.43 -0.40 -4.71 118.68 118.59 2qap s LEU 192 Ca 0.00 -0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 2qap s LEU 192 Cb 0.00 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.55 2qap s LEU 192 CO 0.00 0.10 1.63 -0.69 0.23 0.00 0.00 176.35 177.61 2qap s VAL 193 N 0.76 3.55 -0.00 -1.59 1.01 -0.68 -3.30 120.40 120.15 2qap s VAL 193 Ca -0.05 0.73 -0.25 0.00 0.00 0.00 0.00 61.98 62.41 2qap s VAL 193 Cb -0.15 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2qap s VAL 193 CO 0.01 -0.05 0.77 -2.16 0.00 0.00 0.00 175.10 173.67 2qap s PRO 194 N 3.77 4.48 -0.34 2.72 0.04 -1.26 -0.81 135.00 143.61 2qap s PRO 194 Ca 0.72 1.05 -0.13 0.00 0.04 0.00 0.00 61.00 62.68 2qap s PRO 194 Cb -0.34 -3.41 -0.02 0.00 0.04 0.00 0.00 34.50 30.78 2qap s PRO 194 CO 0.29 0.15 0.24 0.42 0.04 0.00 0.00 177.00 178.14 2qap s ILE 195 N 0.44 5.28 -0.34 0.56 1.01 0.03 -1.46 121.20 126.72 2qap s ILE 195 Ca 0.40 -0.21 -0.19 0.00 0.00 0.00 0.00 60.65 60.65 2qap s ILE 195 Cb -0.20 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 2qap s ILE 195 CO 0.22 -0.02 0.55 -0.69 0.00 0.00 0.00 174.94 175.01 2qap s VAL 196 N 1.73 4.98 -0.45 2.92 1.01 0.17 -2.69 120.40 128.08 2qap s VAL 196 Ca 0.06 0.51 -0.03 0.00 0.00 0.00 0.00 61.98 62.53 2qap s VAL 196 Cb -0.17 -3.98 0.12 0.00 0.00 0.00 0.00 36.38 32.35 2qap s VAL 196 CO 0.11 -0.20 0.24 -0.70 0.00 0.00 0.00 175.10 174.55 2qap s GLU 197 N 2.48 2.09 -0.84 2.72 2.12 -0.83 -0.66 118.70 125.79 2qap s GLU 197 Ca 0.21 -1.96 -0.11 0.00 0.36 0.00 0.00 54.97 53.47 2qap s GLU 197 Cb -0.15 -3.60 0.22 0.00 0.26 0.00 0.00 34.13 30.86 2qap s GLU 197 CO 0.13 -1.09 0.76 -1.25 -0.54 0.00 0.00 175.26 173.27 2qap s PRO 198 N 0.91 3.50 -0.35 4.30 0.04 -1.25 -1.03 135.00 141.11 2qap s PRO 198 Ca 0.10 -2.63 -0.23 0.00 0.04 0.00 0.00 61.00 58.28 2qap s PRO 198 Cb -0.22 -4.31 0.01 0.00 0.04 0.00 0.00 34.50 30.02 2qap s PRO 198 CO -0.04 -1.26 0.79 -2.00 0.04 0.00 0.00 177.00 174.53 2qap s GLU 199 N -0.16 3.79 -0.42 4.56 2.12 -0.27 -4.39 118.70 123.93 2qap s GLU 199 Ca 0.20 0.37 -0.23 0.00 0.36 0.00 0.00 54.97 55.67 2qap s GLU 199 Cb -0.12 -3.79 0.02 0.00 0.26 0.00 0.00 34.13 30.50 2qap s GLU 199 CO -0.08 -0.82 0.80 0.08 -0.54 0.00 0.00 175.26 174.70 2qap s VAL 200 N 3.09 4.65 0.46 3.70 1.01 -1.26 -0.74 120.40 131.31 2qap s VAL 200 Ca 0.32 0.61 -0.24 0.00 0.00 0.00 0.00 61.98 62.67 2qap s VAL 200 Cb -0.13 -4.30 -0.07 0.00 0.00 0.00 0.00 36.38 31.87 2qap s VAL 200 CO 0.16 -0.65 1.30 -0.04 0.00 0.00 0.00 175.10 175.88 2qap s MET 201 N 3.29 3.66 0.31 2.72 1.00 -0.48 -4.84 119.30 124.97 2qap s MET 201 Ca 0.31 2.13 0.26 0.00 0.00 0.00 0.00 55.69 58.39 2qap s MET 201 Cb -0.12 -2.53 0.89 0.00 0.00 0.00 0.00 34.83 33.06 2qap s MET 201 CO 0.21 -0.74 1.76 0.97 0.00 0.00 0.00 175.02 177.23 2qap h ILE 202 N 2.04 0.00 -2.85 2.53 2.10 -1.91 -3.43 117.51 115.99 2qap h ILE 202 Ca -0.50 -0.47 -0.54 0.00 1.08 0.00 0.00 64.86 64.43 2qap h ILE 202 Cb 1.26 1.38 0.07 0.00 -1.09 0.00 0.00 36.82 38.44 2qap h ILE 202 CO 0.60 0.00 0.88 0.47 -1.08 0.00 0.00 178.15 179.02 2qap n ASP 203 N -2.50 3.66 0.00 2.19 9.92 -1.26 -0.44 116.55 128.12 2qap n ASP 203 Ca 0.03 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 2qap n ASP 203 Cb 0.36 -1.54 0.00 0.00 -0.64 0.00 0.00 41.12 39.29 2qap n ASP 203 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qap n GLY 204 N 2.94 2.20 1.05 0.44 0.00 -1.26 -4.65 105.19 105.91 2qap n GLY 204 Ca 0.13 -2.00 0.10 0.00 0.00 0.00 0.00 46.02 44.24 2qap n GLY 204 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qap n LYS 205 N -1.53 2.54 -1.62 1.61 5.02 -1.26 -0.56 118.16 122.35 2qap n LYS 205 Ca 0.00 -2.29 -0.35 0.00 -2.02 0.00 0.00 58.31 53.65 2qap n LYS 205 Cb 0.00 -1.45 0.07 0.00 -0.02 0.00 0.00 35.03 33.63 2qap n LYS 205 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2qap s HIS 206 N -1.14 2.21 0.78 2.13 -3.43 -1.26 -4.29 115.29 110.28 2qap s HIS 206 Ca 0.37 1.57 -0.04 0.00 -0.80 0.00 0.00 55.06 56.16 2qap s HIS 206 Cb 0.20 -3.44 0.14 0.00 -1.43 0.00 0.00 32.58 28.06 2qap s HIS 206 CO 0.27 -2.40 1.07 0.16 -2.00 0.00 0.00 174.74 171.84 2qap s ASP 207 N -1.99 4.07 0.38 7.38 1.47 -1.26 0.14 116.67 126.86 2qap s ASP 207 Ca 0.74 -0.24 0.08 0.00 1.18 0.00 0.00 52.55 54.32 2qap s ASP 207 Cb -0.29 -0.06 0.76 0.00 -0.34 0.00 0.00 42.92 43.00 2qap s ASP 207 CO 0.42 -2.06 1.92 -0.29 0.68 0.00 0.00 175.17 175.84 2qap h ILE 208 N -0.78 1.17 -0.39 2.11 2.10 -1.91 -2.51 117.51 117.30 2qap h ILE 208 Ca -0.38 -0.70 -0.10 0.00 1.08 0.00 0.00 64.86 64.76 2qap h ILE 208 Cb 1.26 1.08 -0.02 0.00 -1.09 0.00 0.00 36.82 38.05 2qap h ILE 208 CO 0.39 0.23 -0.15 -0.78 -1.08 0.00 0.00 178.15 176.77 2qap h ASP 209 N 0.32 0.72 -0.54 2.19 3.58 -1.94 -0.30 116.42 120.44 2qap h ASP 209 Ca 0.07 -0.22 -0.12 0.00 0.42 0.00 0.00 57.03 57.18 2qap h ASP 209 Cb 0.31 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 2qap h ASP 209 CO 0.01 0.88 -0.12 0.74 -2.88 0.00 0.00 179.24 177.87 2qap h THR 210 N 0.65 1.27 -0.60 2.25 2.02 -1.85 -0.83 112.91 115.82 2qap h THR 210 Ca 0.11 -1.28 -0.05 0.00 0.77 0.00 0.00 66.41 65.95 2qap h THR 210 Cb 0.62 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.98 2qap h THR 210 CO 0.04 0.45 0.16 0.00 0.37 0.00 0.00 175.52 176.55 2qap h GLN 212 N 0.89 -0.17 -0.55 0.00 -0.00 -0.59 0.38 115.11 115.08 2qap h GLN 212 Ca 0.20 0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.84 2qap h GLN 212 Cb 0.30 0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.79 2qap h GLN 212 CO -0.00 -0.02 0.26 0.00 0.00 0.00 0.00 178.83 179.07 2qap h ARG 213 N -0.30 0.80 -0.26 1.69 2.47 -0.97 -0.56 114.38 117.25 2qap h ARG 213 Ca -0.02 -0.12 -0.13 0.00 -1.26 0.00 0.00 59.98 58.45 2qap h ARG 213 Cb 0.24 -0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 2qap h ARG 213 CO 0.03 0.66 -0.34 0.28 0.56 0.00 0.00 179.97 181.16 2qap h VAL 214 N 0.74 1.31 -0.49 2.04 2.07 -1.16 -2.28 116.25 118.48 2qap h VAL 214 Ca 0.19 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.18 2qap h VAL 214 Cb 0.13 1.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2qap h VAL 214 CO -0.02 0.48 0.30 0.28 0.02 0.00 0.00 177.57 178.63 2qap h SER 215 N 0.42 0.59 -0.63 0.57 0.02 -0.80 0.13 113.55 113.85 2qap h SER 215 Ca 0.03 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2qap h SER 215 Cb 0.92 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.28 2qap h SER 215 CO 0.08 0.47 0.39 -0.08 -1.14 0.00 0.00 176.83 176.55 2qap h GLU 216 N 0.66 0.86 -0.15 3.45 4.81 -1.08 0.21 114.58 123.33 2qap h GLU 216 Ca 0.18 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2qap h GLU 216 Cb -0.01 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 2qap h GLU 216 CO -0.03 0.60 0.05 1.25 -0.73 0.00 0.00 179.01 180.15 2qap h HIS 217 N 0.86 0.25 0.04 0.92 2.76 -0.97 -1.00 115.15 118.01 2qap h HIS 217 Ca 0.23 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2qap h HIS 217 Cb -0.04 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 28.85 2qap h HIS 217 CO -0.02 0.36 -0.02 0.28 -1.30 0.00 0.00 177.93 177.23 2qap h VAL 218 N 0.07 1.07 -0.42 5.26 2.07 -0.56 -2.98 116.25 120.75 2qap h VAL 218 Ca 0.05 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 2qap h VAL 218 Cb 0.23 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 2qap h VAL 218 CO -0.00 0.08 0.02 -0.50 0.02 0.00 0.00 177.57 177.19 2qap h TRP 219 N -0.20 0.69 -0.87 1.57 6.55 -0.95 -2.28 115.95 120.46 2qap h TRP 219 Ca -0.01 -0.08 -0.01 0.00 0.95 0.00 0.00 58.89 59.75 2qap h TRP 219 Cb 0.18 -0.20 -0.04 0.00 -0.86 0.00 0.00 29.16 28.24 2qap h TRP 219 CO -0.03 0.65 0.51 -0.09 -1.05 0.00 0.00 178.44 178.44 2qap h ARG 220 N 0.63 1.19 -0.02 0.49 1.12 -1.14 -1.00 114.38 115.65 2qap h ARG 220 Ca 0.13 -0.11 -0.16 0.00 -1.11 0.00 0.00 59.98 58.73 2qap h ARG 220 Cb 0.37 -0.25 -0.02 0.00 -0.01 0.00 0.00 29.97 30.07 2qap h ARG 220 CO 0.01 0.84 -0.71 1.49 -3.11 0.00 0.00 179.97 178.50 2qap h GLU 221 N 1.21 0.12 -0.41 0.20 4.57 -1.33 -1.27 114.58 117.67 2qap h GLU 221 Ca 0.31 -0.10 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2qap h GLU 221 Cb -0.03 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2qap h GLU 221 CO -0.06 0.77 0.15 0.28 -1.18 0.00 0.00 179.01 178.97 2qap h VAL 222 N 0.08 1.21 -0.72 0.32 2.07 -0.82 -0.79 116.25 117.59 2qap h VAL 222 Ca -0.02 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.81 2qap h VAL 222 Cb 1.25 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 2qap h VAL 222 CO 0.10 0.24 0.30 0.58 0.02 0.00 0.00 177.57 178.81 2qap h VAL 223 N 0.51 1.25 -0.69 2.57 2.07 -1.04 -0.83 116.25 120.09 2qap h VAL 223 Ca 0.13 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2qap h VAL 223 Cb 0.22 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2qap h VAL 223 CO -0.01 0.31 0.43 0.00 0.02 0.00 0.00 177.57 178.33 2qap h ALA 224 N 1.14 0.87 -0.54 1.67 0.00 -0.85 -0.84 119.26 120.72 2qap h ALA 224 Ca 0.24 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2qap h ALA 224 Cb 0.19 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2qap h ALA 224 CO -0.02 0.32 -0.10 0.00 0.00 0.00 0.00 179.25 179.45 2qap h ALA 225 N 1.23 0.73 -0.76 0.00 0.00 -0.84 -1.60 119.26 118.03 2qap h ALA 225 Ca 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2qap h ALA 225 Cb -0.07 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 2qap h ALA 225 CO -0.05 0.65 0.40 -0.07 0.00 0.00 0.00 179.25 180.17 2qap h LEU 226 N 0.89 0.95 -0.37 0.00 3.38 -0.74 -0.77 115.31 118.65 2qap h LEU 226 Ca 0.14 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2qap h LEU 226 Cb 0.67 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2qap h LEU 226 CO 0.05 0.78 -0.03 1.56 0.09 0.00 0.00 178.44 180.89 2qap h GLN 227 N 1.06 0.67 -0.62 1.13 1.08 -0.92 -2.12 115.11 115.40 2qap h GLN 227 Ca 0.27 -0.23 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 2qap h GLN 227 Cb 0.05 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.40 2qap h GLN 227 CO -0.04 0.79 0.26 0.00 -0.95 0.00 0.00 178.83 178.89 2qap h ARG 228 N 0.48 0.89 -0.00 1.46 3.08 -0.80 -2.21 114.38 117.28 2qap h ARG 228 Ca 0.10 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2qap h ARG 228 Cb 0.50 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2qap h ARG 228 CO 0.02 0.71 -0.04 0.72 -1.07 0.00 0.00 179.97 180.31 2qap n HIS 229 N -4.33 0.00 -3.01 3.04 8.25 -0.34 -4.95 115.22 113.89 2qap n HIS 229 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 2qap n HIS 229 Cb 0.16 -0.24 0.04 0.00 1.12 0.00 0.00 29.99 31.06 2qap n HIS 229 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qap n GLY 230 N 1.28 0.23 3.74 -1.41 0.00 -0.83 -4.68 105.19 103.51 2qap n GLY 230 Ca 0.15 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 2qap n GLY 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qap s VAL 231 N -3.14 2.34 -0.60 1.61 0.11 -0.95 -0.63 120.40 119.14 2qap s VAL 231 Ca 0.27 0.19 -0.23 0.00 -2.93 0.00 0.00 61.98 59.28 2qap s VAL 231 Cb -0.12 -2.95 0.05 0.00 -1.53 0.00 0.00 36.38 31.84 2qap s VAL 231 CO 0.34 -0.06 0.95 -0.63 -3.33 0.00 0.00 175.10 172.36 2qap s ILE 232 N -1.69 4.36 0.34 7.04 1.01 -1.26 -4.76 121.20 126.24 2qap s ILE 232 Ca 0.78 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 61.42 2qap s ILE 232 Cb -0.32 -4.60 0.27 0.00 0.01 0.00 0.00 42.46 37.82 2qap s ILE 232 CO 0.40 -1.27 1.98 -0.50 0.00 0.00 0.00 174.94 175.54 2qap h TRP 233 N 9.43 0.87 0.00 3.97 4.06 -1.95 -1.40 115.95 130.93 2qap h TRP 233 Ca -0.27 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.70 2qap h TRP 233 Cb 1.07 -0.29 0.00 0.00 -1.00 0.00 0.00 29.16 28.94 2qap h TRP 233 CO 0.94 0.52 0.00 0.39 -3.56 0.00 0.00 178.44 176.72 2qap n GLU 234 N -4.45 0.06 -1.62 0.49 4.71 -1.26 -3.13 120.64 115.44 2qap n GLU 234 Ca 0.09 0.42 -0.09 0.00 -0.01 0.00 0.00 57.16 57.57 2qap n GLU 234 Cb 0.10 -1.65 0.08 0.00 -1.01 0.00 0.00 31.44 28.97 2qap n GLU 234 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qap n GLY 235 N -0.64 5.03 3.29 0.62 0.00 -0.53 -4.58 105.19 108.37 2qap n GLY 235 Ca 0.01 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 2qap n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qap s LEU 237 N -3.10 2.44 -0.00 0.00 1.43 -0.54 -4.32 118.68 114.59 2qap s LEU 237 Ca 0.32 -0.89 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 2qap s LEU 237 Cb 0.05 0.18 -0.03 0.00 0.03 0.00 0.00 46.19 46.42 2qap s LEU 237 CO 0.09 -0.53 -0.12 -0.22 0.23 0.00 0.00 176.35 175.80 2qap s LEU 238 N -2.61 2.90 -0.53 1.79 2.96 -0.73 -0.65 118.68 121.80 2qap s LEU 238 Ca 0.02 -0.23 0.04 0.00 -0.22 0.00 0.00 54.13 53.74 2qap s LEU 238 Cb 0.04 -1.66 0.16 0.00 0.50 0.00 0.00 46.19 45.23 2qap s LEU 238 CO -0.08 0.29 0.38 -0.75 -1.32 0.00 0.00 176.35 174.87 2qap s LYS 239 N -1.22 1.60 0.47 1.98 2.20 0.17 -0.34 119.74 124.59 2qap s LYS 239 Ca 0.15 -2.57 0.05 0.00 -0.36 0.00 0.00 55.97 53.24 2qap s LYS 239 Cb -0.11 -2.41 0.02 0.00 -1.51 0.00 0.00 37.83 33.82 2qap s LYS 239 CO 0.05 -1.30 0.65 -1.25 -0.36 0.00 0.00 175.35 173.14 2qap s PRO 240 N -0.47 2.71 0.53 4.03 0.04 -1.26 -3.79 135.00 136.80 2qap s PRO 240 Ca 0.26 -1.05 -0.11 0.00 0.04 0.00 0.00 61.00 60.15 2qap s PRO 240 Cb -0.06 -2.65 -0.05 0.00 0.04 0.00 0.00 34.50 31.78 2qap s PRO 240 CO -0.14 -0.45 0.92 0.54 0.04 0.00 0.00 177.00 177.91 2qap s ASN 241 N -4.38 6.37 0.52 6.66 4.22 -1.26 -2.29 114.94 124.78 2qap s ASN 241 Ca 0.56 1.29 -0.07 0.00 -2.14 0.00 0.00 52.86 52.51 2qap s ASN 241 Cb -0.10 -2.40 -0.04 0.00 1.28 0.00 0.00 41.25 39.99 2qap s ASN 241 CO 0.35 -0.67 0.84 -0.04 -2.04 0.00 0.00 177.10 175.55 2qap s MET 242 N -4.63 3.54 -0.46 3.55 -1.94 -1.26 -4.95 119.30 113.16 2qap s MET 242 Ca 0.53 0.32 -0.22 0.00 -1.71 0.00 0.00 55.69 54.62 2qap s MET 242 Cb -0.10 -2.31 0.03 0.00 2.01 0.00 0.00 34.83 34.46 2qap s MET 242 CO 0.43 -0.30 0.71 0.08 -0.01 0.00 0.00 175.02 175.94 2qap s VAL 243 N -2.85 4.74 0.16 -6.03 1.01 -1.26 -5.01 120.40 111.16 2qap s VAL 243 Ca 0.49 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.60 2qap s VAL 243 Cb -0.10 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 2qap s VAL 243 CO 0.47 -0.70 0.16 0.68 0.00 0.00 0.00 175.10 175.72 2qap s VAL 244 N 3.05 0.07 0.71 2.92 -7.23 -1.26 -4.58 120.40 114.07 2qap s VAL 244 Ca 0.25 -1.71 -0.12 0.00 -1.81 0.00 0.00 61.98 58.59 2qap s VAL 244 Cb -0.14 -2.03 0.02 0.00 0.56 0.00 0.00 36.38 34.79 2qap s VAL 244 CO 0.20 -0.33 1.08 -2.16 -0.31 0.00 0.00 175.10 173.57 2qap s PRO 245 N -4.03 2.69 0.70 4.82 0.04 -1.26 -4.47 135.00 133.49 2qap s PRO 245 Ca 0.23 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.25 2qap s PRO 245 Cb 0.06 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.66 2qap s PRO 245 CO 0.03 -1.30 1.20 0.41 0.04 0.00 0.00 177.00 177.37 2qap n GLY 246 N -1.32 0.20 0.28 0.56 0.00 0.12 -4.90 105.19 100.14 2qap n GLY 246 Ca 0.09 -0.27 0.14 0.00 0.00 0.00 0.00 46.02 45.98 2qap n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qap h ALA 247 N 0.02 1.46 -0.21 4.61 0.00 -0.55 -2.13 119.26 122.46 2qap h ALA 247 Ca -0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2qap h ALA 247 Cb 1.33 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2qap h ALA 247 CO 0.50 0.05 -0.00 0.39 0.00 0.00 0.00 179.25 180.19 2qap n GLU 248 N -3.81 2.54 0.21 0.00 4.71 0.27 -4.57 120.64 120.00 2qap n GLU 248 Ca -0.03 -2.80 0.11 0.00 -0.01 0.00 0.00 57.16 54.43 2qap n GLU 248 Cb 0.13 -1.78 0.15 0.00 -1.01 0.00 0.00 31.44 28.93 2qap n GLU 248 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2qap h SER 249 N 1.40 0.00 0.00 1.62 4.64 -1.34 -3.40 113.55 116.47 2qap h SER 249 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2qap h SER 249 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2qap h SER 249 CO 0.18 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 2qap n GLY 250 N 1.12 0.60 3.35 -0.77 0.00 -1.26 -5.00 105.19 103.23 2qap n GLY 250 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 2qap n GLY 250 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qap s LYS 251 N -0.16 1.31 -0.12 1.61 1.02 -1.26 -5.13 119.74 117.01 2qap s LYS 251 Ca 0.00 -1.33 -0.01 0.00 0.02 0.00 0.00 55.97 54.65 2qap s LYS 251 Cb 0.00 -1.65 0.04 0.00 -0.52 0.00 0.00 37.83 35.70 2qap s LYS 251 CO 0.00 0.38 -0.02 0.99 -0.92 0.00 0.00 175.35 175.77 2qap s THR 252 N -1.33 0.71 0.39 2.17 2.01 -1.26 -4.82 115.64 113.52 2qap s THR 252 Ca 0.13 -0.26 -0.24 0.00 0.31 0.00 0.00 61.69 61.63 2qap s THR 252 Cb -0.09 -0.90 -0.09 0.00 0.01 0.00 0.00 72.50 71.43 2qap s THR 252 CO 0.06 0.17 1.04 0.00 -0.69 0.00 0.00 174.62 175.20 2qap s ALA 253 N 1.82 3.09 0.47 7.40 0.00 -1.26 -5.04 121.76 128.24 2qap s ALA 253 Ca 0.03 0.67 -0.20 0.00 0.00 0.00 0.00 51.96 52.46 2qap s ALA 253 Cb -0.14 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.63 2qap s ALA 253 CO -0.07 -0.16 1.00 0.00 0.00 0.00 0.00 175.76 176.52 2qap s ALA 254 N -1.68 2.96 0.24 0.00 0.00 -1.26 -4.86 121.76 117.15 2qap s ALA 254 Ca 0.57 0.47 -0.07 0.00 0.00 0.00 0.00 51.96 52.93 2qap s ALA 254 Cb -0.21 -3.20 0.43 0.00 0.00 0.00 0.00 23.12 20.14 2qap s ALA 254 CO 0.26 -0.13 1.63 -1.35 0.00 0.00 0.00 175.76 176.17 2qap h PRO 255 N 1.62 0.09 -0.40 0.00 0.11 -1.96 -0.57 132.00 130.88 2qap h PRO 255 Ca -0.49 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 2qap h PRO 255 Cb 1.20 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2qap h PRO 255 CO 0.60 0.06 0.17 0.93 -0.21 0.00 0.00 178.00 179.55 2qap h GLU 256 N 0.09 0.56 -0.22 1.05 5.08 -1.92 -0.63 114.58 118.58 2qap h GLU 256 Ca 0.41 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.54 2qap h GLU 256 Cb 0.71 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2qap h GLU 256 CO -0.68 0.46 -0.49 0.37 -1.00 0.00 0.00 179.01 177.67 2qap h GLN 257 N 0.56 0.72 -0.73 2.33 4.15 -1.50 -1.34 115.11 119.29 2qap h GLN 257 Ca 0.14 -0.48 -0.04 0.00 0.77 0.00 0.00 58.65 59.04 2qap h GLN 257 Cb 0.10 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 2qap h GLN 257 CO -0.02 1.10 0.29 0.28 -1.93 0.00 0.00 178.83 178.55 2qap h VAL 258 N 0.43 1.25 -0.19 2.39 2.07 -1.00 -1.06 116.25 120.13 2qap h VAL 258 Ca 0.00 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 2qap h VAL 258 Cb 1.10 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2qap h VAL 258 CO 0.11 0.32 0.04 0.00 0.02 0.00 0.00 177.57 178.06 2qap h ALA 259 N 1.25 0.25 0.40 1.67 0.00 -1.02 -0.23 119.26 121.58 2qap h ALA 259 Ca 0.24 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2qap h ALA 259 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2qap h ALA 259 CO -0.02 -0.11 -0.29 1.25 0.00 0.00 0.00 179.25 180.09 2qap h HIS 260 N 0.11 -0.76 -0.90 0.00 6.17 -0.96 -0.67 115.15 118.15 2qap h HIS 260 Ca 0.06 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.12 2qap h HIS 260 Cb 0.27 0.28 -0.04 0.00 2.52 0.00 0.00 27.41 30.44 2qap h HIS 260 CO 0.01 -0.43 0.48 1.88 0.71 0.00 0.00 177.93 180.58 2qap h TYR 261 N -0.68 1.25 -0.05 5.26 -1.99 -1.19 -1.55 116.97 118.01 2qap h TYR 261 Ca -0.04 -0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.63 2qap h TYR 261 Cb 0.57 -0.40 -0.00 0.00 2.00 0.00 0.00 36.73 38.91 2qap h TYR 261 CO -0.13 0.87 -0.06 1.15 -0.00 0.00 0.00 178.16 179.99 2qap h THR 262 N 1.26 1.38 -0.32 -2.88 2.02 -0.92 -2.19 112.91 111.28 2qap h THR 262 Ca 0.32 -1.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.14 2qap h THR 262 Cb 0.04 2.09 -0.01 0.00 -1.74 0.00 0.00 68.15 68.53 2qap h THR 262 CO -0.05 0.34 -0.26 0.58 0.37 0.00 0.00 175.52 176.50 2qap h VAL 263 N -0.32 1.27 -0.34 3.16 2.07 -1.13 -1.64 116.25 119.32 2qap h VAL 263 Ca 0.01 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 2qap h VAL 263 Cb 0.58 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2qap h VAL 263 CO 0.01 0.44 0.12 -0.03 0.02 0.00 0.00 177.57 178.13 2qap h MET 264 N 0.56 0.53 -0.53 1.57 -1.53 -1.33 -0.74 114.93 113.45 2qap h MET 264 Ca 0.07 -0.11 -0.05 0.00 -3.44 0.00 0.00 59.70 56.17 2qap h MET 264 Cb 0.74 -0.08 -0.02 0.00 -0.55 0.00 0.00 31.60 31.69 2qap h MET 264 CO 0.06 0.54 0.13 1.15 0.14 0.00 0.00 176.91 178.93 2qap h THR 265 N 0.40 1.24 -0.39 -0.77 2.02 -1.20 -1.62 112.91 112.58 2qap h THR 265 Ca 0.11 -0.86 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 2qap h THR 265 Cb 0.23 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2qap h THR 265 CO -0.01 0.32 0.17 -0.07 0.37 0.00 0.00 175.52 176.30 2qap h LEU 266 N 0.74 0.53 -1.50 2.58 3.38 -1.21 -2.94 115.31 116.90 2qap h LEU 266 Ca 0.17 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2qap h LEU 266 Cb 0.34 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2qap h LEU 266 CO 0.00 0.53 0.03 0.00 0.09 0.00 0.00 178.44 179.09 2qap h ALA 267 N 1.02 1.60 0.00 1.53 0.00 -0.89 0.16 119.26 122.69 2qap h ALA 267 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qap h ALA 267 Cb 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2qap h ALA 267 CO -0.01 0.30 0.00 0.54 0.00 0.00 0.00 179.25 180.08 2qap n ARG 268 N -4.37 0.13 0.00 0.00 1.74 -0.63 -4.32 116.66 109.21 2qap n ARG 268 Ca 0.01 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 2qap n ARG 268 Cb 0.18 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2qap n ARG 268 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2qap n THR 269 N -1.89 0.00 -2.97 0.55 -2.24 -0.85 -5.04 114.28 101.83 2qap n THR 269 Ca 0.05 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.43 2qap n THR 269 Cb 0.35 -0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 2qap n THR 269 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2qap s MET 270 N -1.94 4.49 0.50 -0.78 -1.94 0.51 -4.85 119.30 115.28 2qap s MET 270 Ca 0.00 1.05 -0.23 0.00 -1.71 0.00 0.00 55.69 54.80 2qap s MET 270 Cb 0.00 -3.39 -0.06 0.00 2.01 0.00 0.00 34.83 33.39 2qap s MET 270 CO 0.00 0.21 1.32 -2.14 -0.01 0.00 0.00 175.02 174.40 2qap s PRO 271 N 0.21 3.45 0.61 2.03 0.02 -1.26 -4.83 135.00 135.22 2qap s PRO 271 Ca 0.39 2.15 0.41 0.00 0.02 0.00 0.00 61.00 63.98 2qap s PRO 271 Cb -0.20 -2.41 2.22 0.00 0.02 0.00 0.00 34.50 34.14 2qap s PRO 271 CO 0.22 -0.92 2.25 0.00 -0.33 0.00 0.00 177.00 178.23 2qap h ALA 272 N 1.85 1.00 0.00 -1.55 0.00 -1.96 -1.99 119.26 116.62 2qap h ALA 272 Ca -0.50 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2qap h ALA 272 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2qap h ALA 272 CO 0.59 0.00 -0.14 1.98 0.00 0.00 0.00 179.25 181.68 2qap h MET 273 N 0.00 0.00 -6.09 0.00 1.85 -1.96 -3.43 114.93 105.30 2qap h MET 273 Ca 0.00 0.00 -0.71 0.00 -0.61 0.00 0.00 59.70 58.38 2qap h MET 273 Cb 0.00 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.03 2qap h MET 273 CO 0.00 0.14 1.14 -0.11 -0.40 0.00 0.00 176.91 177.68 2qap n LEU 274 N -3.19 2.26 0.02 3.39 7.94 -0.75 -4.65 117.00 122.01 2qap n LEU 274 Ca 0.02 0.80 -0.03 0.00 -1.11 0.00 0.00 56.01 55.69 2qap n LEU 274 Cb 0.48 -1.18 0.22 0.00 0.53 0.00 0.00 43.42 43.47 2qap n LEU 274 CO 0.33 -0.53 0.76 1.55 -1.11 0.00 0.00 177.39 178.40 2qap h PRO 275 N 9.40 0.47 -2.83 1.96 0.13 -1.75 -3.38 132.00 135.99 2qap h PRO 275 Ca -0.37 -0.16 -0.05 0.00 -0.87 0.00 0.00 66.00 64.55 2qap h PRO 275 Cb 1.32 -0.03 -0.15 0.00 0.13 0.00 0.00 31.00 32.27 2qap h PRO 275 CO 0.99 0.66 0.10 0.20 -0.23 0.00 0.00 178.00 179.73 2qap s GLY 276 N -4.00 -0.49 -0.18 1.56 0.00 -1.26 -1.52 107.32 101.43 2qap s GLY 276 Ca -0.07 0.57 -0.01 0.00 0.00 0.00 0.00 44.72 45.20 2qap s GLY 276 CO 0.78 0.25 -0.01 0.14 0.00 0.00 0.00 173.10 174.27 2qap s VAL 277 N -2.91 0.82 -0.45 1.40 1.01 1.00 -1.77 120.40 119.50 2qap s VAL 277 Ca -0.03 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 2qap s VAL 277 Cb -0.00 -1.16 0.12 0.00 0.00 0.00 0.00 36.38 35.33 2qap s VAL 277 CO -0.05 -0.05 0.29 -0.04 0.00 0.00 0.00 175.10 175.25 2qap s MET 278 N 1.74 2.28 0.47 2.72 -1.94 0.53 -0.85 119.30 124.25 2qap s MET 278 Ca -0.01 -1.82 -0.24 0.00 -1.71 0.00 0.00 55.69 51.91 2qap s MET 278 Cb -0.16 -3.78 -0.07 0.00 2.01 0.00 0.00 34.83 32.83 2qap s MET 278 CO -0.07 -1.14 1.36 -0.06 -0.01 0.00 0.00 175.02 175.09 2qap s PHE 279 N 1.21 2.52 0.35 -0.03 0.08 -0.58 -4.13 117.98 117.40 2qap s PHE 279 Ca 0.07 1.35 -0.03 0.00 0.12 0.00 0.00 56.93 58.44 2qap s PHE 279 Cb -0.24 -3.79 -0.04 0.00 -0.57 0.00 0.00 43.02 38.37 2qap s PHE 279 CO -0.02 -2.63 0.60 -0.48 -0.10 0.00 0.00 175.22 172.59 2qap s LEU 280 N -2.92 3.95 -0.13 -0.37 0.05 -0.97 -1.19 118.68 117.11 2qap s LEU 280 Ca 0.63 0.67 0.15 0.00 0.05 0.00 0.00 54.13 55.64 2qap s LEU 280 Cb -0.40 -3.54 0.30 0.00 -2.05 0.00 0.00 46.19 40.50 2qap s LEU 280 CO 0.50 -0.31 1.15 -1.54 -0.55 0.00 0.00 176.35 175.60 2qap n SER 281 N -1.51 1.78 -4.68 1.48 3.41 -1.26 -4.53 113.62 108.31 2qap n SER 281 Ca -0.02 -3.09 -0.47 0.00 -0.26 0.00 0.00 58.87 55.02 2qap n SER 281 Cb 0.55 -0.42 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 2qap n SER 281 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qap n GLY 282 N -1.03 1.53 0.77 5.00 0.00 -1.26 -1.34 105.19 108.85 2qap n GLY 282 Ca 0.14 0.86 0.00 0.00 0.00 0.00 0.00 46.02 47.02 2qap n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qap n GLY 283 N 4.46 0.81 3.93 -0.02 0.00 -1.26 -4.80 105.19 108.32 2qap n GLY 283 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 2qap n GLY 283 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qap s LEU 284 N 0.00 4.29 0.77 0.99 1.43 -0.45 -5.07 118.68 120.64 2qap s LEU 284 Ca 0.00 0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 53.30 2qap s LEU 284 Cb 0.00 -3.06 0.06 0.00 0.03 0.00 0.00 46.19 43.22 2qap s LEU 284 CO 0.00 0.02 1.11 -0.94 0.23 0.00 0.00 176.35 176.77 2qap s SER 285 N -3.07 4.76 0.23 2.29 1.04 -1.26 -4.83 113.70 112.87 2qap s SER 285 Ca 0.37 1.15 -0.07 0.00 0.48 0.00 0.00 55.95 57.88 2qap s SER 285 Cb -0.11 -1.87 0.28 0.00 0.10 0.00 0.00 66.02 64.42 2qap s SER 285 CO 0.28 -1.78 1.87 -0.33 0.98 0.00 0.00 173.24 174.26 2qap h GLU 286 N -0.96 1.01 -0.27 4.02 5.08 -1.91 -1.83 114.58 119.72 2qap h GLU 286 Ca -0.46 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 57.67 2qap h GLU 286 Cb 1.28 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 2qap h GLU 286 CO 0.62 0.67 -0.47 0.28 -1.00 0.00 0.00 179.01 179.11 2qap h VAL 287 N 1.04 1.29 -0.73 3.13 2.07 -1.92 -3.10 116.25 118.03 2qap h VAL 287 Ca 0.35 -1.66 0.04 0.00 0.82 0.00 0.00 66.70 66.25 2qap h VAL 287 Cb 0.05 1.68 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 2qap h VAL 287 CO -0.13 0.54 0.45 1.56 0.02 0.00 0.00 177.57 180.00 2qap h GLN 288 N 0.55 0.83 -0.69 1.57 4.20 -1.85 0.13 115.11 119.84 2qap h GLN 288 Ca 0.02 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.73 2qap h GLN 288 Cb 1.07 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 28.63 2qap h GLN 288 CO 0.11 0.55 0.45 0.00 -0.67 0.00 0.00 178.83 179.27 2qap h ALA 289 N 1.33 1.67 0.06 3.87 0.00 -1.32 0.17 119.26 125.04 2qap h ALA 289 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 2qap h ALA 289 Cb 0.07 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2qap h ALA 289 CO -0.13 0.24 -0.55 0.77 0.00 0.00 0.00 179.25 179.58 2qap h SER 290 N 0.77 0.38 -0.56 0.00 0.02 -1.23 -2.88 113.55 110.04 2qap h SER 290 Ca 0.28 -0.88 0.03 0.00 -0.84 0.00 0.00 61.79 60.39 2qap h SER 290 Cb 0.16 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.54 2qap h SER 290 CO -0.09 1.22 0.32 -0.33 -1.14 0.00 0.00 176.83 176.81 2qap h GLU 291 N -0.41 0.61 -0.34 3.45 5.08 -0.37 -1.21 114.58 121.39 2qap h GLU 291 Ca -0.09 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 2qap h GLU 291 Cb 1.36 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2qap h GLU 291 CO 0.11 0.40 -0.01 1.88 -1.00 0.00 0.00 179.01 180.39 2qap h TYR 292 N 0.63 0.66 -0.50 4.33 0.05 -0.78 -2.08 116.97 119.27 2qap h TYR 292 Ca 0.23 -0.12 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 2qap h TYR 292 Cb 0.07 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 2qap h TYR 292 CO -0.07 0.72 0.12 1.25 -1.05 0.00 0.00 178.16 179.13 2qap h LEU 293 N 0.40 0.71 -0.33 3.88 5.85 -1.32 -0.90 115.31 123.61 2qap h LEU 293 Ca 0.09 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2qap h LEU 293 Cb 0.46 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2qap h LEU 293 CO 0.02 0.70 0.09 -1.13 -0.34 0.00 0.00 178.44 177.77 2qap h ASN 294 N 0.74 0.49 -0.84 1.25 -1.24 -1.06 -1.71 115.58 113.21 2qap h ASN 294 Ca 0.16 -0.22 -0.03 0.00 0.71 0.00 0.00 56.30 56.92 2qap h ASN 294 Cb 0.27 -0.13 -0.04 0.00 0.73 0.00 0.00 38.32 39.16 2qap h ASN 294 CO -0.00 0.58 0.39 0.00 -1.29 0.00 0.00 177.43 177.11 2qap h ALA 295 N 0.92 1.11 -0.92 1.57 0.00 -1.02 -2.22 119.26 118.69 2qap h ALA 295 Ca 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qap h ALA 295 Cb 0.28 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2qap h ALA 295 CO -0.00 0.66 0.57 0.82 0.00 0.00 0.00 179.25 181.31 2qap h ILE 296 N 1.20 1.25 -0.12 0.00 2.04 -0.93 -1.01 117.51 119.94 2qap h ILE 296 Ca 0.29 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2qap h ILE 296 Cb 0.14 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.15 2qap h ILE 296 CO -0.03 0.26 0.00 0.59 0.00 0.00 0.00 178.15 178.96 2qap n ASN 297 N -4.37 1.51 0.00 1.72 3.02 -0.66 -2.51 115.26 113.98 2qap n ASN 297 Ca 0.10 -2.12 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 2qap n ASN 297 Cb 0.05 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 2qap n ASN 297 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2qap n ASN 298 N 0.05 0.96 -4.75 6.41 3.02 -0.42 -4.54 115.26 115.99 2qap n ASN 298 Ca 0.05 -1.45 -0.41 0.00 -0.03 0.00 0.00 54.58 52.74 2qap n ASN 298 Cb 0.33 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.46 2qap n ASN 298 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2qap s SER 299 N -0.45 7.23 0.00 6.41 0.15 -1.00 -4.94 113.70 121.10 2qap s SER 299 Ca 0.00 2.18 0.29 0.00 0.70 0.00 0.00 55.95 59.13 2qap s SER 299 Cb 0.00 -2.61 1.36 0.00 -1.71 0.00 0.00 66.02 63.06 2qap s SER 299 CO 0.00 -0.22 1.94 -0.81 1.20 0.00 0.00 173.24 175.35 2qap n PRO 300 N 1.96 0.63 -1.58 5.44 -0.04 -1.26 -4.89 135.00 135.26 2qap n PRO 300 Ca 0.02 -0.15 -0.31 0.00 -0.04 0.00 0.00 63.50 63.02 2qap n PRO 300 Cb 0.45 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.48 2qap n PRO 300 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qap s LEU 301 N -2.47 2.97 0.29 1.53 1.43 -1.26 -4.98 118.68 116.18 2qap s LEU 301 Ca 0.30 1.51 -0.30 0.00 -1.03 0.00 0.00 54.13 54.60 2qap s LEU 301 Cb 0.20 -4.31 -0.12 0.00 0.03 0.00 0.00 46.19 42.00 2qap s LEU 301 CO 0.46 -1.58 1.59 -2.65 0.23 0.00 0.00 176.35 174.40 2qap n PRO 302 N -3.21 2.66 -2.73 1.29 -0.02 -1.26 -4.96 135.00 126.78 2qap n PRO 302 Ca 0.07 0.95 -0.05 0.00 -2.02 0.00 0.00 63.50 62.45 2qap n PRO 302 Cb 0.54 -2.72 0.03 0.00 -0.02 0.00 0.00 33.50 31.33 2qap n PRO 302 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2qap n ARG 303 N 2.23 0.46 0.20 -0.52 1.85 -1.26 -4.71 116.66 114.91 2qap n ARG 303 Ca 0.09 -1.53 0.06 0.00 -1.00 0.00 0.00 57.85 55.47 2qap n ARG 303 Cb 0.36 -0.99 0.43 0.00 -1.05 0.00 0.00 32.46 31.21 2qap n ARG 303 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2qap h PRO 304 N 4.33 0.00 -7.21 2.89 0.13 -1.93 -3.45 132.00 126.76 2qap h PRO 304 Ca -0.05 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.60 2qap h PRO 304 Cb 1.11 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.28 2qap h PRO 304 CO 0.05 0.32 0.38 1.52 -0.23 0.00 0.00 178.00 180.04 2qap s TYR 305 N -4.00 3.34 -0.02 1.56 -0.85 -1.26 -5.00 117.35 111.12 2qap s TYR 305 Ca -0.02 1.46 -0.30 0.00 -0.52 0.00 0.00 57.07 57.69 2qap s TYR 305 Cb 0.13 -2.84 -0.05 0.00 0.38 0.00 0.00 41.96 39.57 2qap s TYR 305 CO 0.68 -0.61 1.47 0.12 -1.52 0.00 0.00 175.55 175.70 2qap s PHE 306 N -2.64 2.63 -0.30 -3.49 5.36 -0.57 -4.87 117.98 114.09 2qap s PHE 306 Ca 0.60 0.65 -0.06 0.00 -0.96 0.00 0.00 56.93 57.15 2qap s PHE 306 Cb -0.12 -3.74 0.02 0.00 -0.34 0.00 0.00 43.02 38.84 2qap s PHE 306 CO 0.35 -2.84 0.07 -0.51 -1.46 0.00 0.00 175.22 170.83 2qap s LEU 307 N 2.84 3.84 0.00 6.12 1.43 -1.26 -0.00 118.68 131.66 2qap s LEU 307 Ca 0.66 -0.79 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 2qap s LEU 307 Cb -0.32 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.04 2qap s LEU 307 CO 0.27 -0.20 0.00 -0.24 0.23 0.00 0.00 176.35 176.40 2qap n SER 308 N 4.84 0.00 -4.38 2.29 2.88 -0.03 -4.81 113.62 114.41 2qap n SER 308 Ca -0.14 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.16 2qap n SER 308 Cb 0.47 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.82 2qap n SER 308 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2qap s PHE 309 N -0.50 2.01 -0.43 0.66 -0.71 -1.26 -1.52 117.98 116.23 2qap s PHE 309 Ca 0.00 -0.43 0.06 0.00 -1.04 0.00 0.00 56.93 55.53 2qap s PHE 309 Cb 0.00 -0.98 0.22 0.00 -1.21 0.00 0.00 43.02 41.05 2qap s PHE 309 CO 0.00 0.43 0.54 0.45 -1.34 0.00 0.00 175.22 175.29 2qap n SER 310 N 0.13 -0.89 -4.90 1.98 2.88 -0.33 0.10 113.62 112.60 2qap n SER 310 Ca -0.12 -2.70 -0.33 0.00 -1.33 0.00 0.00 58.87 54.40 2qap n SER 310 Cb 0.57 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.99 2qap n SER 310 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2qap s TYR 311 N -0.28 3.55 0.00 0.66 2.02 -1.11 -4.35 117.35 117.84 2qap s TYR 311 Ca 0.33 0.44 0.00 0.00 -0.37 0.00 0.00 57.07 57.47 2qap s TYR 311 Cb 0.12 -1.89 0.00 0.00 -0.40 0.00 0.00 41.96 39.78 2qap s TYR 311 CO -0.15 0.61 0.00 0.00 -1.57 0.00 0.00 175.55 174.43 2qap n ALA 312 N 0.82 0.55 -0.18 3.71 0.00 -1.26 -1.09 120.51 123.06 2qap n ALA 312 Ca -0.09 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.38 2qap n ALA 312 Cb 0.52 0.00 0.30 0.00 0.00 0.00 0.00 19.45 20.28 2qap n ALA 312 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2qap h ARG 313 N 0.00 0.85 0.00 0.00 2.43 -1.94 -1.46 114.38 114.26 2qap h ARG 313 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2qap h ARG 313 Cb 0.00 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 2qap h ARG 313 CO 0.00 0.56 0.00 0.00 -1.51 0.00 0.00 179.97 179.02 2qap n ALA 314 N -2.43 1.14 -0.01 2.80 0.00 -1.26 -0.81 120.51 119.94 2qap n ALA 314 Ca 0.09 0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.64 2qap n ALA 314 Cb 0.11 -1.21 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 2qap n ALA 314 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qap n LEU 315 N -1.93 0.00 -0.06 0.00 4.77 -0.67 -4.73 117.00 114.38 2qap n LEU 315 Ca -0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 2qap n LEU 315 Cb 0.05 0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.03 2qap n LEU 315 CO 0.08 0.02 -0.96 0.00 -1.33 0.00 0.00 177.39 175.20 2qap n GLN 316 N -1.79 1.07 -0.13 3.23 6.02 -0.64 -4.63 117.38 120.50 2qap n GLN 316 Ca -0.02 -0.05 -0.05 0.00 -0.01 0.00 0.00 57.00 56.87 2qap n GLN 316 Cb 0.25 -1.43 -0.04 0.00 1.02 0.00 0.00 30.24 30.04 2qap n GLN 316 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2qap h SER 317 N 0.00 -0.86 -0.87 1.08 0.87 -1.22 0.15 113.55 112.70 2qap h SER 317 Ca -0.34 0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.34 2qap h SER 317 Cb 1.72 0.37 -0.04 0.00 -0.44 0.00 0.00 62.40 64.01 2qap h SER 317 CO 0.02 -0.12 0.52 0.28 -0.53 0.00 0.00 176.83 177.00 2qap h SER 318 N -0.06 1.05 -0.66 6.23 0.02 -1.86 -2.79 113.55 115.48 2qap h SER 318 Ca 0.05 -0.07 0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2qap h SER 318 Cb 0.20 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 2qap h SER 318 CO -0.34 0.82 0.43 0.00 -1.14 0.00 0.00 176.83 176.59 2qap h ALA 319 N 1.28 0.85 -0.34 3.77 0.00 -1.62 -1.75 119.26 121.45 2qap h ALA 319 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2qap h ALA 319 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2qap h ALA 319 CO -0.06 0.22 0.22 1.25 0.00 0.00 0.00 179.25 180.88 2qap h LEU 320 N 0.85 0.40 -0.67 0.00 5.85 -0.46 -0.18 115.31 121.11 2qap h LEU 320 Ca 0.26 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 2qap h LEU 320 Cb -0.04 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 2qap h LEU 320 CO -0.08 0.32 0.25 0.11 -0.34 0.00 0.00 178.44 178.70 2qap h LYS 321 N 0.45 1.02 -0.44 1.25 1.57 -1.27 -0.62 116.57 118.54 2qap h LYS 321 Ca 0.12 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.58 2qap h LYS 321 Cb -0.02 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 2qap h LYS 321 CO -0.02 0.87 -0.22 0.00 -0.57 0.00 0.00 179.45 179.50 2qap h ALA 322 N 1.11 0.79 -0.34 3.86 0.00 -1.14 -3.04 119.26 120.49 2qap h ALA 322 Ca 0.22 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2qap h ALA 322 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2qap h ALA 322 CO -0.01 0.65 0.11 2.35 0.00 0.00 0.00 179.25 182.35 2qap h TRP 323 N 0.77 0.54 -0.08 0.00 7.01 -0.78 -3.39 115.95 120.02 2qap h TRP 323 Ca 0.10 -0.05 -0.03 0.00 2.11 0.00 0.00 58.89 61.02 2qap h TRP 323 Cb 0.76 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.65 2qap h TRP 323 CO 0.04 0.53 -0.03 0.41 -2.79 0.00 0.00 178.44 176.60 2qap n GLY 324 N -0.66 0.25 2.21 2.65 0.00 -0.26 -2.40 105.19 106.98 2qap n GLY 324 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 2qap n GLY 324 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qap n GLY 325 N 0.11 0.59 3.45 -0.02 0.00 -1.26 -4.88 105.19 103.17 2qap n GLY 325 Ca -0.02 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 2qap n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qap s LYS 326 N -1.49 1.86 0.37 1.61 -0.14 -1.01 -5.02 119.74 115.92 2qap s LYS 326 Ca 0.00 -1.11 0.05 0.00 -1.36 0.00 0.00 55.97 53.55 2qap s LYS 326 Cb 0.00 -2.10 0.72 0.00 -1.68 0.00 0.00 37.83 34.76 2qap s LYS 326 CO 0.00 0.51 1.98 1.49 -0.76 0.00 0.00 175.35 178.57 2qap h GLU 327 N 4.21 0.60 0.00 1.68 4.81 -1.96 -0.65 114.58 123.28 2qap h GLU 327 Ca -0.49 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 2qap h GLU 327 Cb 1.16 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2qap h GLU 327 CO 0.46 0.47 0.00 0.66 -0.73 0.00 0.00 179.01 179.87 2qap h SER 328 N 0.60 0.00 -0.20 1.04 4.64 -1.95 -2.32 113.55 115.36 2qap h SER 328 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2qap h SER 328 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2qap h SER 328 CO -0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.55 2qap n GLY 329 N -0.34 0.84 0.34 -0.77 0.00 -0.25 -4.38 105.19 100.63 2qap n GLY 329 Ca 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 46.02 45.40 2qap n GLY 329 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qap h LEU 330 N 3.37 1.08 0.16 0.99 3.38 -1.43 -0.09 115.31 122.78 2qap h LEU 330 Ca 0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2qap h LEU 330 Cb 0.73 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2qap h LEU 330 CO 0.00 0.95 -0.08 0.00 0.09 0.00 0.00 178.44 179.40 2qap h ALA 331 N 1.18 -0.22 -0.42 1.53 0.00 -1.81 0.07 119.26 119.60 2qap h ALA 331 Ca 0.27 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 2qap h ALA 331 Cb 0.18 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2qap h ALA 331 CO -0.03 -0.61 0.06 0.00 0.00 0.00 0.00 179.25 178.68 2qap h ALA 332 N 0.60 0.56 -0.53 0.00 0.00 -1.82 -1.67 119.26 116.39 2qap h ALA 332 Ca -0.02 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2qap h ALA 332 Cb 0.19 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2qap h ALA 332 CO 0.04 0.28 0.32 0.78 0.00 0.00 0.00 179.25 180.66 2qap h GLY 333 N 0.55 0.75 1.74 0.00 0.00 -0.90 -2.09 103.07 103.12 2qap h GLY 333 Ca 0.13 -0.24 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 2qap h GLY 333 CO 0.01 0.20 -0.43 3.21 0.00 0.00 0.00 176.54 179.53 2qap h ARG 334 N 0.63 0.28 -0.59 4.80 3.08 -0.87 -1.37 114.38 120.34 2qap h ARG 334 Ca 0.21 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 2qap h ARG 334 Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 2qap h ARG 334 CO -0.10 0.67 0.10 -0.09 -1.07 0.00 0.00 179.97 179.48 2qap h ARG 335 N 0.23 0.95 -0.43 0.04 2.43 -0.89 0.11 114.38 116.81 2qap h ARG 335 Ca 0.02 -0.23 -0.13 0.00 -0.81 0.00 0.00 59.98 58.82 2qap h ARG 335 Cb 0.86 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 2qap h ARG 335 CO 0.07 0.87 -0.25 0.00 -1.51 0.00 0.00 179.97 179.15 2qap h ALA 336 N 1.21 0.61 -0.14 2.80 0.00 -1.10 -1.62 119.26 121.03 2qap h ALA 336 Ca 0.18 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2qap h ALA 336 Cb 0.39 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2qap h ALA 336 CO 0.01 0.63 0.00 0.35 0.00 0.00 0.00 179.25 180.24 2qap h PHE 337 N 0.77 0.27 -0.23 0.00 3.57 -0.92 -2.39 116.94 118.01 2qap h PHE 337 Ca 0.09 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2qap h PHE 337 Cb 0.83 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2qap h PHE 337 CO 0.06 0.47 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.51 2qap h LEU 338 N -0.02 0.31 0.07 0.59 3.38 -0.78 -0.43 115.31 118.44 2qap h LEU 338 Ca 0.04 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qap h LEU 338 Cb 0.36 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2qap h LEU 338 CO 0.01 0.40 -0.03 -0.74 0.09 0.00 0.00 178.44 178.16 2qap h HIS 339 N 0.33 -0.09 -0.60 1.13 2.76 -1.14 0.56 115.15 118.10 2qap h HIS 339 Ca 0.07 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 2qap h HIS 339 Cb 0.27 0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.23 2qap h HIS 339 CO 0.01 0.14 0.24 0.00 -1.30 0.00 0.00 177.93 177.01 2qap h ARG 340 N -0.30 0.88 -0.62 5.26 2.47 -1.15 0.41 114.38 121.33 2qap h ARG 340 Ca -0.01 -0.14 -0.10 0.00 -1.26 0.00 0.00 59.98 58.47 2qap h ARG 340 Cb 0.26 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 2qap h ARG 340 CO 0.02 0.73 0.02 0.00 0.56 0.00 0.00 179.97 181.29 2qap h ALA 341 N 1.39 0.85 -0.43 0.04 0.00 -0.91 -1.91 119.26 118.29 2qap h ALA 341 Ca 0.21 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2qap h ALA 341 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2qap h ALA 341 CO -0.02 0.67 -0.19 -0.09 0.00 0.00 0.00 179.25 179.62 2qap h ARG 342 N 1.00 0.89 -0.91 0.00 2.43 -0.28 -1.03 114.38 116.48 2qap h ARG 342 Ca 0.18 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 2qap h ARG 342 Cb 0.54 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2qap h ARG 342 CO 0.03 1.03 0.58 0.52 -1.51 0.00 0.00 179.97 180.62 2qap h MET 343 N 0.72 1.21 0.00 0.20 2.86 -0.74 -1.03 114.93 118.14 2qap h MET 343 Ca 0.10 -0.09 -0.09 0.00 -2.06 0.00 0.00 59.70 57.56 2qap h MET 343 Cb 0.76 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 2qap h MET 343 CO 0.06 0.82 -0.42 -0.91 1.06 0.00 0.00 176.91 177.53 2qap h ASN 344 N 1.24 0.00 -0.30 1.22 2.35 -1.22 -1.11 115.58 117.76 2qap h ASN 344 Ca 0.33 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.02 2qap h ASN 344 Cb -0.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 2qap h ASN 344 CO -0.07 0.42 -0.05 -1.28 -1.65 0.00 0.00 177.43 174.80 2qap h SER 345 N 0.00 0.55 0.04 5.81 0.87 -0.58 -0.51 113.55 119.73 2qap h SER 345 Ca -0.00 -0.35 -0.10 0.00 -1.23 0.00 0.00 61.79 60.11 2qap h SER 345 Cb 1.19 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2qap h SER 345 CO 0.05 0.77 -0.32 0.24 -0.53 0.00 0.00 176.83 177.05 2qap h MET 346 N 0.33 0.41 -0.34 2.24 2.86 -1.10 -2.56 114.93 116.76 2qap h MET 346 Ca 0.08 -0.17 -0.08 0.00 -2.06 0.00 0.00 59.70 57.47 2qap h MET 346 Cb 0.51 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 2qap h MET 346 CO 0.02 0.69 -0.12 0.00 1.06 0.00 0.00 176.91 178.56 2qap h ALA 347 N 1.31 1.16 -0.83 6.32 0.00 -0.89 0.23 119.26 126.56 2qap h ALA 347 Ca 0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2qap h ALA 347 Cb 0.74 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2qap h ALA 347 CO 0.06 0.53 0.39 0.37 0.00 0.00 0.00 179.25 180.60 2qap h GLN 348 N 0.54 1.19 -0.00 0.00 -0.00 -0.70 -1.32 115.11 114.82 2qap h GLN 348 Ca 0.10 -0.18 0.00 0.00 -0.00 0.00 0.00 58.65 58.57 2qap h GLN 348 Cb 0.53 -0.21 0.00 0.00 0.00 0.00 0.00 27.48 27.79 2qap h GLN 348 CO 0.03 0.92 -0.01 1.28 0.00 0.00 0.00 178.83 181.06 2qap n LEU 349 N -4.32 0.02 -0.34 -2.39 4.77 -0.86 -4.86 117.00 109.01 2qap n LEU 349 Ca 0.08 0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 56.32 2qap n LEU 349 Cb 0.14 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2qap n LEU 349 CO 0.40 0.00 -0.04 0.61 -1.33 0.00 0.00 177.39 177.03 2qap n GLY 350 N 1.31 0.62 0.50 -0.72 0.00 -0.31 -4.93 105.19 101.67 2qap n GLY 350 Ca 0.13 -0.86 0.07 0.00 0.00 0.00 0.00 46.02 45.37 2qap n GLY 350 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qap n LYS 351 N -2.64 1.77 -2.19 1.61 5.02 0.67 -4.93 118.16 117.47 2qap n LYS 351 Ca -0.04 -2.86 -0.41 0.00 -2.02 0.00 0.00 58.31 52.97 2qap n LYS 351 Cb 0.20 -1.64 -0.03 0.00 -0.02 0.00 0.00 35.03 33.54 2qap n LYS 351 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2qap s TYR 352 N -2.99 3.18 -0.20 2.13 5.04 -1.14 -4.82 117.35 118.54 2qap s TYR 352 Ca 0.37 1.38 0.01 0.00 -2.44 0.00 0.00 57.07 56.39 2qap s TYR 352 Cb 0.33 -3.61 0.04 0.00 0.35 0.00 0.00 41.96 39.07 2qap s TYR 352 CO 0.02 -1.72 -0.12 0.15 -1.34 0.00 0.00 175.55 172.53 2qap s LYS 353 N -1.20 2.23 0.39 4.97 1.02 -1.26 -4.99 119.74 120.89 2qap s LYS 353 Ca 0.51 -0.91 0.13 0.00 0.02 0.00 0.00 55.97 55.72 2qap s LYS 353 Cb -0.38 -2.50 0.94 0.00 -0.52 0.00 0.00 37.83 35.37 2qap s LYS 353 CO 0.47 -0.41 1.87 -0.09 -0.92 0.00 0.00 175.35 176.27 2qap h ARG 354 N 7.94 0.54 0.00 1.68 9.65 -1.95 -0.90 114.38 131.33 2qap h ARG 354 Ca -0.30 -0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 58.52 2qap h ARG 354 Cb 1.10 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 29.55 2qap h ARG 354 CO 0.50 0.36 -0.14 0.66 2.80 0.00 0.00 179.97 184.15 2qap h SER 355 N 0.55 0.00 0.57 -3.80 4.64 -1.94 -0.78 113.55 112.79 2qap h SER 355 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2qap h SER 355 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2qap h SER 355 CO -0.19 0.14 0.00 0.47 -0.87 0.00 0.00 176.83 176.38 2qap n ASP 356 N -4.37 0.00 -4.83 4.97 10.43 -0.35 -4.77 116.55 117.65 2qap n ASP 356 Ca -0.03 0.19 -0.24 0.00 2.57 0.00 0.00 54.79 57.29 2qap n ASP 356 Cb 0.21 -0.38 -0.05 0.00 1.84 0.00 0.00 41.12 42.74 2qap n ASP 356 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2qap s ASP 357 N -2.76 5.60 0.00 -2.24 3.68 -0.30 -5.08 116.67 115.57 2qap s ASP 357 Ca 0.17 -0.16 0.09 0.00 2.13 0.00 0.00 52.55 54.77 2qap s ASP 357 Cb 0.15 -1.47 0.51 0.00 -1.45 0.00 0.00 42.92 40.66 2qap s ASP 357 CO 0.37 0.01 0.96 -0.90 0.13 0.00 0.00 175.17 175.75