#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qvx s GLN 2 N 0.00 1.40 0.83 3.17 0.74 -1.26 -5.13 119.66 119.41 2qvx s GLN 2 Ca 0.00 -1.06 -0.12 0.00 0.05 0.00 0.00 55.36 54.23 2qvx s GLN 2 Cb 0.00 -2.54 0.10 0.00 1.10 0.00 0.00 33.01 31.67 2qvx s GLN 2 CO 0.00 -0.70 1.19 0.95 -0.55 0.00 0.00 175.29 176.18 2qvx s THR 3 N 1.41 2.00 0.11 -0.34 -4.23 -1.26 -4.22 115.64 109.10 2qvx s THR 3 Ca -0.01 0.00 -0.22 0.00 -1.18 0.00 0.00 61.69 60.28 2qvx s THR 3 Cb -0.18 -2.98 -0.08 0.00 1.34 0.00 0.00 72.50 70.59 2qvx s THR 3 CO -0.09 0.00 1.71 0.58 -0.54 0.00 0.00 174.62 176.28 2qvx h VAL 4 N -1.15 0.83 -0.81 2.29 2.07 -1.95 0.18 116.25 117.72 2qvx h VAL 4 Ca -0.46 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.14 2qvx h VAL 4 Cb 1.32 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 2qvx h VAL 4 CO 0.63 0.00 0.47 -1.13 0.02 0.00 0.00 177.57 177.56 2qvx h ASN 5 N -0.06 0.69 -0.14 0.57 -1.24 -1.93 -1.34 115.58 112.13 2qvx h ASN 5 Ca 0.05 0.04 -0.17 0.00 0.71 0.00 0.00 56.30 56.93 2qvx h ASN 5 Cb 0.13 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.08 2qvx h ASN 5 CO -0.12 0.41 -0.51 -0.08 -1.29 0.00 0.00 177.43 175.84 2qvx h GLU 6 N 0.81 0.72 -0.88 6.67 4.57 -1.78 0.15 114.58 124.83 2qvx h GLU 6 Ca 0.38 -0.43 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2qvx h GLU 6 Cb 0.31 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.90 2qvx h GLU 6 CO -0.23 1.06 0.55 0.52 -1.18 0.00 0.00 179.01 179.73 2qvx h MET 7 N 0.56 1.18 0.01 1.92 2.86 0.26 -1.55 114.93 120.17 2qvx h MET 7 Ca 0.02 -0.09 -0.19 0.00 -2.06 0.00 0.00 59.70 57.38 2qvx h MET 7 Cb 1.08 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 2qvx h MET 7 CO 0.11 0.81 -0.87 -0.07 1.06 0.00 0.00 176.91 177.94 2qvx h LEU 8 N 1.20 0.09 -0.19 1.22 3.38 -0.86 -2.80 115.31 117.35 2qvx h LEU 8 Ca 0.32 -0.08 -0.22 0.00 0.09 0.00 0.00 57.88 57.99 2qvx h LEU 8 Cb -0.08 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2qvx h LEU 8 CO -0.06 0.92 -0.90 -0.09 0.09 0.00 0.00 178.44 178.39 2qvx h ARG 9 N 0.03 0.47 -0.20 1.13 2.43 -0.81 -1.46 114.38 115.98 2qvx h ARG 9 Ca -0.02 -0.48 -0.07 0.00 -0.81 0.00 0.00 59.98 58.60 2qvx h ARG 9 Cb 1.52 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 31.20 2qvx h ARG 9 CO 0.12 1.12 -0.16 0.00 -1.51 0.00 0.00 179.97 179.54 2qvx h ARG 10 N 0.28 0.45 -0.04 0.20 3.08 -1.23 -2.40 114.38 114.73 2qvx h ARG 10 Ca -0.07 -0.23 0.01 0.00 0.07 0.00 0.00 59.98 59.76 2qvx h ARG 10 Cb 1.53 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.55 2qvx h ARG 10 CO 0.16 0.79 -0.29 0.00 -1.07 0.00 0.00 179.97 179.56 2qvx h ALA 11 N 0.66 -0.71 -1.48 0.04 0.00 -1.52 0.17 119.26 116.42 2qvx h ALA 11 Ca 0.04 -0.04 0.48 0.00 0.00 0.00 0.00 54.91 55.39 2qvx h ALA 11 Cb 0.69 0.78 -0.12 0.00 0.00 0.00 0.00 17.79 19.14 2qvx h ALA 11 CO 0.04 -0.81 0.98 0.00 0.00 0.00 0.00 179.25 179.46 2qvx h ALA 12 N -0.87 3.01 0.08 0.00 0.00 -1.14 0.44 119.26 120.79 2qvx h ALA 12 Ca 0.01 0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.75 2qvx h ALA 12 Cb 0.38 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2qvx h ALA 12 CO -0.22 -1.66 -1.12 1.79 0.00 0.00 0.00 179.25 178.05 2qvx h THR 13 N 0.03 1.45 -0.25 0.00 1.35 -0.22 -2.47 112.91 112.80 2qvx h THR 13 Ca 0.87 -2.77 -0.10 0.00 -0.55 0.00 0.00 66.41 63.85 2qvx h THR 13 Cb 2.93 2.71 -0.00 0.00 -1.73 0.00 0.00 68.15 72.06 2qvx h THR 13 CO -0.36 0.82 -0.25 0.03 -0.25 0.00 0.00 175.52 175.51 2qvx h ARG 14 N 0.14 0.61 -1.51 4.72 3.08 0.15 -3.38 114.38 118.19 2qvx h ARG 14 Ca -0.11 -0.32 -0.55 0.00 0.07 0.00 0.00 59.98 59.07 2qvx h ARG 14 Cb 1.80 0.01 -0.42 0.00 0.08 0.00 0.00 29.97 31.45 2qvx h ARG 14 CO 0.19 0.92 -0.82 0.00 -1.07 0.00 0.00 179.97 179.19 2qvx n ALA 15 N -2.47 4.68 -0.09 0.04 0.00 0.44 -4.95 120.51 118.16 2qvx n ALA 15 Ca -0.04 -4.13 0.11 0.00 0.00 0.00 0.00 53.44 49.38 2qvx n ALA 15 Cb 0.44 -0.64 0.49 0.00 0.00 0.00 0.00 19.45 19.74 2qvx n ALA 15 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qvx h PRO 16 N 2.70 0.43 -0.48 0.00 0.13 -1.63 0.49 132.00 133.64 2qvx h PRO 16 Ca 0.21 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2qvx h PRO 16 Cb 0.93 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.96 2qvx h PRO 16 CO 0.78 0.28 0.00 -0.25 -0.23 0.00 0.00 178.00 178.58 2qvx n ASP 17 N -4.47 4.69 -4.87 1.44 8.00 -1.26 0.33 116.55 120.40 2qvx n ASP 17 Ca 0.10 -2.76 -0.33 0.00 0.71 0.00 0.00 54.79 52.51 2qvx n ASP 17 Cb 0.35 -0.58 -0.05 0.00 -0.02 0.00 0.00 41.12 40.82 2qvx n ASP 17 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2qvx s HIS 18 N -2.40 3.49 -0.06 1.24 2.46 0.16 -4.86 115.29 115.33 2qvx s HIS 18 Ca 0.47 0.80 -0.29 0.00 0.47 0.00 0.00 55.06 56.51 2qvx s HIS 18 Cb 0.35 -2.19 -0.07 0.00 -0.13 0.00 0.00 32.58 30.54 2qvx s HIS 18 CO 0.16 0.38 1.99 0.00 -2.47 0.00 0.00 174.74 174.80 2qvx n ALA 20 N 8.69 0.73 -2.64 0.00 0.00 0.21 -3.89 120.51 123.62 2qvx n ALA 20 Ca 0.22 -0.61 -0.32 0.00 0.00 0.00 0.00 53.44 52.73 2qvx n ALA 20 Cb 0.43 -0.13 -0.15 0.00 0.00 0.00 0.00 19.45 19.59 2qvx n ALA 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qvx s LEU 21 N -7.96 2.32 0.02 0.00 1.43 -0.94 0.35 118.68 113.90 2qvx s LEU 21 Ca -0.25 -0.40 0.06 0.00 -1.03 0.00 0.00 54.13 52.51 2qvx s LEU 21 Cb 0.05 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 2qvx s LEU 21 CO 0.40 0.27 -0.17 0.00 0.23 0.00 0.00 176.35 177.09 2qvx s ALA 22 N -0.32 1.42 -0.53 4.21 0.00 -0.60 -1.03 121.76 124.91 2qvx s ALA 22 Ca 0.02 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 51.15 2qvx s ALA 22 Cb -0.13 -0.28 0.15 0.00 0.00 0.00 0.00 23.12 22.86 2qvx s ALA 22 CO 0.02 0.31 0.32 0.14 0.00 0.00 0.00 175.76 176.56 2qvx s VAL 23 N -0.69 1.95 0.25 0.00 -7.23 0.25 -0.68 120.40 114.26 2qvx s VAL 23 Ca 0.05 -3.20 -0.05 0.00 -1.81 0.00 0.00 61.98 56.97 2qvx s VAL 23 Cb -0.08 -2.33 0.27 0.00 0.56 0.00 0.00 36.38 34.80 2qvx s VAL 23 CO 0.01 -0.94 1.65 1.55 -0.31 0.00 0.00 175.10 177.06 2qvx h PRO 24 N 6.20 0.16 -6.62 4.82 0.13 -1.84 -2.03 132.00 132.82 2qvx h PRO 24 Ca 0.05 -0.01 -0.51 0.00 -0.87 0.00 0.00 66.00 64.66 2qvx h PRO 24 Cb 0.87 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 2qvx h PRO 24 CO 0.58 0.11 0.36 0.00 -0.23 0.00 0.00 178.00 178.82 2qvx s ALA 25 N -6.06 3.27 0.00 -0.56 0.00 -1.26 -3.05 121.76 114.11 2qvx s ALA 25 Ca -0.13 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.42 2qvx s ALA 25 Cb 0.23 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 20.09 2qvx s ALA 25 CO 0.76 0.05 0.00 0.54 0.00 0.00 0.00 175.76 177.10 2qvx n ARG 26 N 2.38 0.00 -3.50 0.00 5.12 -1.25 -4.67 116.66 114.73 2qvx n ARG 26 Ca 0.01 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.74 2qvx n ARG 26 Cb 0.48 -0.34 0.02 0.00 -1.16 0.00 0.00 32.46 31.47 2qvx n ARG 26 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qvx n GLY 27 N -2.00 -1.16 2.85 -0.13 0.00 -0.79 -5.01 105.19 98.95 2qvx n GLY 27 Ca 0.00 0.51 -0.18 0.00 0.00 0.00 0.00 46.02 46.35 2qvx n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qvx s LEU 28 N -5.27 1.28 -0.03 0.99 2.96 -1.07 -5.02 118.68 112.53 2qvx s LEU 28 Ca 0.20 -0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 2qvx s LEU 28 Cb -0.07 -0.31 0.01 0.00 0.50 0.00 0.00 46.19 46.33 2qvx s LEU 28 CO 0.83 -0.07 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.62 2qvx s ARG 29 N 0.90 0.59 -0.06 1.98 0.52 -1.26 -0.58 118.95 121.04 2qvx s ARG 29 Ca -0.10 -0.10 0.05 0.00 -0.52 0.00 0.00 55.73 55.05 2qvx s ARG 29 Cb -0.13 -0.62 -0.00 0.00 0.52 0.00 0.00 34.95 34.71 2qvx s ARG 29 CO -0.01 -0.02 -0.20 -0.51 0.02 0.00 0.00 175.30 174.58 2qvx s LEU 30 N 0.55 1.97 1.00 2.53 1.43 -0.19 -5.01 118.68 120.96 2qvx s LEU 30 Ca -0.07 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 2qvx s LEU 30 Cb -0.10 -1.17 0.19 0.00 0.03 0.00 0.00 46.19 45.14 2qvx s LEU 30 CO -0.00 0.17 1.09 0.42 0.23 0.00 0.00 176.35 178.26 2qvx s THR 31 N 0.08 2.16 0.32 5.49 -4.23 -1.26 0.68 115.64 118.88 2qvx s THR 31 Ca -0.07 0.05 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2qvx s THR 31 Cb -0.14 -2.51 0.27 0.00 1.34 0.00 0.00 72.50 71.47 2qvx s THR 31 CO 0.04 -0.07 1.97 0.45 -0.54 0.00 0.00 174.62 176.47 2qvx h HIS 32 N -1.90 0.94 -0.13 3.99 -0.00 -0.71 -2.17 115.15 115.17 2qvx h HIS 32 Ca -0.54 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 59.84 2qvx h HIS 32 Cb 1.32 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 28.41 2qvx h HIS 32 CO 0.31 0.56 0.03 0.00 -0.00 0.00 0.00 177.93 178.83 2qvx h ALA 33 N 1.54 0.17 -0.16 2.45 0.00 -0.38 -1.84 119.26 121.04 2qvx h ALA 33 Ca 0.31 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2qvx h ALA 33 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2qvx h ALA 33 CO -0.09 -0.20 -0.17 0.93 0.00 0.00 0.00 179.25 179.72 2qvx h GLU 34 N 0.01 0.27 -0.10 0.00 5.08 -1.73 -1.89 114.58 116.22 2qvx h GLU 34 Ca 0.04 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.16 2qvx h GLU 34 Cb 0.25 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2qvx h GLU 34 CO 0.00 0.44 -0.65 1.25 -1.00 0.00 0.00 179.01 179.05 2qvx h LEU 35 N 0.25 0.44 0.14 1.33 5.85 -1.22 -1.82 115.31 120.29 2qvx h LEU 35 Ca 0.05 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.52 2qvx h LEU 35 Cb 0.46 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2qvx h LEU 35 CO 0.03 0.98 -0.38 0.03 -0.34 0.00 0.00 178.44 178.76 2qvx h ARG 36 N 0.28 -0.60 -0.86 1.25 2.47 -0.57 -0.42 114.38 115.93 2qvx h ARG 36 Ca -0.01 0.04 0.07 0.00 -1.26 0.00 0.00 59.98 58.81 2qvx h ARG 36 Cb 1.20 0.14 -0.06 0.00 -1.65 0.00 0.00 29.97 29.59 2qvx h ARG 36 CO 0.11 -0.40 0.53 0.00 0.56 0.00 0.00 179.97 180.77 2qvx h ALA 37 N -0.08 1.19 -0.22 0.04 0.00 -1.03 0.40 119.26 119.55 2qvx h ALA 37 Ca 0.02 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 2qvx h ALA 37 Cb 0.64 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2qvx h ALA 37 CO -0.21 0.26 -0.26 0.00 0.00 0.00 0.00 179.25 179.03 2qvx h ARG 38 N 0.95 0.57 -0.75 0.00 3.08 -1.35 -1.96 114.38 114.92 2qvx h ARG 38 Ca 0.38 -0.32 0.05 0.00 0.07 0.00 0.00 59.98 60.16 2qvx h ARG 38 Cb 0.20 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 2qvx h ARG 38 CO -0.18 0.92 0.45 0.28 -1.07 0.00 0.00 179.97 180.36 2qvx h VAL 39 N 0.27 1.02 -0.26 2.04 2.07 0.65 -2.57 116.25 119.48 2qvx h VAL 39 Ca 0.03 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2qvx h VAL 39 Cb 0.83 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2qvx h VAL 39 CO 0.06 0.15 0.17 -0.33 0.02 0.00 0.00 177.57 177.65 2qvx h GLU 40 N 0.83 0.35 -0.07 1.57 4.39 -0.18 -1.38 114.58 120.09 2qvx h GLU 40 Ca 0.33 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.97 2qvx h GLU 40 Cb 0.15 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2qvx h GLU 40 CO -0.16 0.24 -0.08 0.00 -1.16 0.00 0.00 179.01 177.84 2qvx h ALA 41 N 1.09 0.10 0.12 3.43 0.00 -1.16 -2.35 119.26 120.48 2qvx h ALA 41 Ca 0.10 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2qvx h ALA 41 Cb -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2qvx h ALA 41 CO -0.02 -0.07 -0.34 0.28 0.00 0.00 0.00 179.25 179.10 2qvx h VAL 42 N -0.27 0.00 -0.76 0.00 2.07 -1.51 -1.70 116.25 114.09 2qvx h VAL 42 Ca 0.01 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.74 2qvx h VAL 42 Cb 0.61 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.24 2qvx h VAL 42 CO 0.02 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.63 2qvx n ALA 43 N -2.74 0.39 0.19 1.67 0.00 -0.52 0.16 120.51 119.66 2qvx n ALA 43 Ca -0.06 0.81 0.09 0.00 0.00 0.00 0.00 53.44 54.29 2qvx n ALA 43 Cb 0.27 -0.60 0.12 0.00 0.00 0.00 0.00 19.45 19.25 2qvx n ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qvx h ALA 44 N 1.52 0.88 0.01 0.00 0.00 -1.25 -1.68 119.26 118.75 2qvx h ALA 44 Ca 0.46 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 2qvx h ALA 44 Cb 0.96 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.74 2qvx h ALA 44 CO -0.71 0.19 -0.34 -0.09 0.00 0.00 0.00 179.25 178.30 2qvx h ARG 45 N 0.00 0.21 -0.88 0.00 1.12 0.25 0.15 114.38 115.23 2qvx h ARG 45 Ca -0.00 -0.24 0.02 0.00 -1.11 0.00 0.00 59.98 58.65 2qvx h ARG 45 Cb 1.12 0.07 -0.05 0.00 -0.01 0.00 0.00 29.97 31.10 2qvx h ARG 45 CO 0.02 0.99 0.57 -0.07 -3.11 0.00 0.00 179.97 178.37 2qvx h LEU 46 N -0.47 0.97 -0.76 3.80 3.38 -1.26 -2.55 115.31 118.42 2qvx h LEU 46 Ca -0.05 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2qvx h LEU 46 Cb 1.12 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.60 2qvx h LEU 46 CO 0.07 0.68 0.49 -0.74 0.09 0.00 0.00 178.44 179.03 2qvx h HIS 47 N 1.13 0.93 0.00 1.13 2.76 -1.19 -1.81 115.15 118.11 2qvx h HIS 47 Ca 0.34 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 2qvx h HIS 47 Cb -0.05 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 28.60 2qvx h HIS 47 CO -0.02 0.57 0.00 0.00 -1.30 0.00 0.00 177.93 177.18 2qvx n ALA 48 N -2.31 1.55 0.47 5.26 0.00 0.52 -2.16 120.51 123.84 2qvx n ALA 48 Ca 0.08 0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.70 2qvx n ALA 48 Cb 0.04 -1.34 0.26 0.00 0.00 0.00 0.00 19.45 18.41 2qvx n ALA 48 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qvx n ASP 49 N -2.08 3.07 0.00 0.00 8.00 -0.69 -4.97 116.55 119.88 2qvx n ASP 49 Ca 0.02 -1.94 0.00 0.00 0.71 0.00 0.00 54.79 53.58 2qvx n ASP 49 Cb 0.18 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 2qvx n ASP 49 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qvx n GLY 50 N 1.43 1.36 3.68 0.44 0.00 -0.92 -5.08 105.19 106.10 2qvx n GLY 50 Ca 0.19 -0.27 -0.47 0.00 0.00 0.00 0.00 46.02 45.47 2qvx n GLY 50 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qvx n LEU 51 N 0.00 3.60 -4.81 0.99 7.94 -1.19 -5.00 117.00 118.53 2qvx n LEU 51 Ca 0.00 0.95 -0.27 0.00 -1.11 0.00 0.00 56.01 55.59 2qvx n LEU 51 Cb 0.00 -1.40 -0.05 0.00 0.53 0.00 0.00 43.42 42.50 2qvx n LEU 51 CO 0.00 -0.00 -0.10 -0.13 -1.11 0.00 0.00 177.39 176.05 2qvx s ARG 52 N 4.21 2.24 0.85 1.96 1.81 -1.26 -4.29 118.95 124.47 2qvx s ARG 52 Ca 0.92 -1.99 -0.10 0.00 -1.72 0.00 0.00 55.73 52.84 2qvx s ARG 52 Cb -0.64 -1.96 0.11 0.00 -0.45 0.00 0.00 34.95 32.01 2qvx s ARG 52 CO 0.50 -0.34 1.12 -2.14 -0.68 0.00 0.00 175.30 173.76 2qvx s PRO 53 N -4.04 1.57 0.00 3.54 0.02 -1.26 -3.70 135.00 131.12 2qvx s PRO 53 Ca 0.33 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.69 2qvx s PRO 53 Cb 0.01 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.73 2qvx s PRO 53 CO 0.19 -2.18 0.00 1.04 -0.33 0.00 0.00 177.00 175.72 2qvx n GLN 54 N -3.91 0.00 -3.10 5.54 1.13 -0.55 -4.85 117.38 111.65 2qvx n GLN 54 Ca 0.10 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.77 2qvx n GLN 54 Cb 0.53 -3.68 -0.05 0.00 0.11 0.00 0.00 30.24 27.14 2qvx n GLN 54 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2qvx s GLN 55 N -0.57 4.37 0.12 -1.09 -0.21 -1.24 -4.71 119.66 116.32 2qvx s GLN 55 Ca 0.00 0.76 -0.30 0.00 0.02 0.00 0.00 55.36 55.84 2qvx s GLN 55 Cb 0.00 -3.48 -0.06 0.00 1.00 0.00 0.00 33.01 30.47 2qvx s GLN 55 CO 0.00 -0.00 1.04 1.03 -2.12 0.00 0.00 175.29 175.24 2qvx s ARG 56 N 1.06 4.62 -0.06 2.91 0.52 -1.26 -2.02 118.95 124.71 2qvx s ARG 56 Ca 0.34 1.58 0.01 0.00 -0.52 0.00 0.00 55.73 57.14 2qvx s ARG 56 Cb -0.17 -3.35 0.02 0.00 0.52 0.00 0.00 34.95 31.98 2qvx s ARG 56 CO 0.15 0.08 -0.07 0.08 0.02 0.00 0.00 175.30 175.56 2qvx s VAL 57 N 0.14 0.74 0.38 3.52 1.01 -0.49 -0.28 120.40 125.42 2qvx s VAL 57 Ca 0.50 -0.23 -0.25 0.00 0.00 0.00 0.00 61.98 62.00 2qvx s VAL 57 Cb -0.26 -0.74 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 2qvx s VAL 57 CO 0.31 0.28 1.05 0.00 0.00 0.00 0.00 175.10 176.74 2qvx s ALA 58 N 0.96 3.14 -0.19 5.51 0.00 0.88 0.20 121.76 132.27 2qvx s ALA 58 Ca -0.10 0.73 -0.02 0.00 0.00 0.00 0.00 51.96 52.57 2qvx s ALA 58 Cb -0.14 -3.28 0.06 0.00 0.00 0.00 0.00 23.12 19.75 2qvx s ALA 58 CO 0.00 -0.19 0.02 0.08 0.00 0.00 0.00 175.76 175.67 2qvx s VAL 59 N -1.57 0.65 -0.35 0.00 1.01 -0.23 0.13 120.40 120.05 2qvx s VAL 59 Ca 0.55 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2qvx s VAL 59 Cb -0.24 -1.09 0.09 0.00 0.00 0.00 0.00 36.38 35.15 2qvx s VAL 59 CO 0.30 -0.14 0.08 -0.69 0.00 0.00 0.00 175.10 174.64 2qvx s VAL 60 N 1.80 2.63 -0.22 2.92 1.01 -0.15 -1.73 120.40 126.66 2qvx s VAL 60 Ca -0.01 -2.11 -0.27 0.00 0.00 0.00 0.00 61.98 59.59 2qvx s VAL 60 Cb -0.17 -2.82 0.11 0.00 0.00 0.00 0.00 36.38 33.50 2qvx s VAL 60 CO -0.08 -0.53 0.93 0.00 0.00 0.00 0.00 175.10 175.42 2qvx s ALA 61 N 1.02 -1.90 0.73 5.51 0.00 -1.26 -1.44 121.76 124.42 2qvx s ALA 61 Ca 0.07 1.76 -0.13 0.00 0.00 0.00 0.00 51.96 53.66 2qvx s ALA 61 Cb -0.20 -1.03 0.04 0.00 0.00 0.00 0.00 23.12 21.92 2qvx s ALA 61 CO -0.06 -0.29 1.12 -1.25 0.00 0.00 0.00 175.76 175.28 2qvx s PRO 62 N -0.26 2.39 0.16 0.00 0.04 -1.26 -4.76 135.00 131.30 2qvx s PRO 62 Ca -0.00 1.38 -0.34 0.00 0.04 0.00 0.00 61.00 62.08 2qvx s PRO 62 Cb -0.03 -1.90 -0.15 0.00 0.04 0.00 0.00 34.50 32.46 2qvx s PRO 62 CO -0.01 -1.57 1.34 0.09 0.04 0.00 0.00 177.00 176.88 2qvx n ASN 63 N -2.96 2.00 -3.60 6.66 4.13 -1.26 -4.88 115.26 115.35 2qvx n ASN 63 Ca 0.10 1.12 -0.06 0.00 1.68 0.00 0.00 54.58 57.43 2qvx n ASN 63 Cb 0.52 -1.28 -0.02 0.00 -1.54 0.00 0.00 39.78 37.46 2qvx n ASN 63 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2qvx s SER 64 N 0.36 -0.26 0.27 6.41 1.04 -1.26 -4.28 113.70 115.97 2qvx s SER 64 Ca 0.77 -0.14 -0.04 0.00 0.48 0.00 0.00 55.95 57.02 2qvx s SER 64 Cb -0.82 0.38 0.34 0.00 0.10 0.00 0.00 66.02 66.02 2qvx s SER 64 CO 0.48 -0.65 1.93 0.00 0.98 0.00 0.00 173.24 175.97 2qvx h ALA 65 N 2.00 1.34 0.00 5.32 0.00 -1.96 -2.74 119.26 123.22 2qvx h ALA 65 Ca -0.22 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2qvx h ALA 65 Cb 1.23 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2qvx h ALA 65 CO 0.28 0.59 -0.33 -0.44 0.00 0.00 0.00 179.25 179.36 2qvx h ASP 66 N 1.27 0.00 0.77 0.00 3.32 -1.95 -0.97 116.42 118.86 2qvx h ASP 66 Ca 0.37 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.17 2qvx h ASP 66 Cb -0.09 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2qvx h ASP 66 CO -0.09 0.33 -1.22 1.62 -1.72 0.00 0.00 179.24 178.16 2qvx h VAL 67 N 0.00 1.49 -0.37 -1.35 3.04 -1.83 -2.02 116.25 115.20 2qvx h VAL 67 Ca -0.00 -3.17 0.00 0.00 -1.01 0.00 0.00 66.70 62.52 2qvx h VAL 67 Cb 0.65 2.81 -0.02 0.00 -2.01 0.00 0.00 31.29 32.72 2qvx h VAL 67 CO 0.04 0.88 0.24 0.58 -1.01 0.00 0.00 177.57 178.30 2qvx h VAL 68 N 0.03 1.10 -0.90 1.51 2.07 -1.14 0.49 116.25 119.41 2qvx h VAL 68 Ca -0.11 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 2qvx h VAL 68 Cb 1.88 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2qvx h VAL 68 CO 0.15 0.10 0.56 0.40 0.02 0.00 0.00 177.57 178.80 2qvx h ILE 69 N 0.49 1.24 0.00 4.57 2.04 -1.15 -2.10 117.51 122.60 2qvx h ILE 69 Ca 0.13 -0.50 -0.17 0.00 1.00 0.00 0.00 64.86 65.32 2qvx h ILE 69 Cb -0.04 -0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.01 2qvx h ILE 69 CO -0.03 0.25 -0.66 0.00 0.00 0.00 0.00 178.15 177.71 2qvx h ALA 70 N 1.38 0.08 -0.42 1.87 0.00 -0.92 -0.23 119.26 121.02 2qvx h ALA 70 Ca 0.33 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2qvx h ALA 70 Cb -0.08 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2qvx h ALA 70 CO -0.06 0.40 0.25 0.82 0.00 0.00 0.00 179.25 180.65 2qvx h ILE 71 N -0.04 1.14 -0.03 0.00 2.04 -0.85 -1.27 117.51 118.49 2qvx h ILE 71 Ca -0.08 -0.32 -0.11 0.00 1.00 0.00 0.00 64.86 65.35 2qvx h ILE 71 Cb 1.37 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 2qvx h ILE 71 CO 0.13 0.14 -0.50 -0.07 0.00 0.00 0.00 178.15 177.85 2qvx h LEU 72 N 0.56 0.08 -0.73 1.44 3.38 -1.37 -1.86 115.31 116.80 2qvx h LEU 72 Ca 0.15 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2qvx h LEU 72 Cb 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2qvx h LEU 72 CO -0.03 0.57 -0.37 0.00 0.09 0.00 0.00 178.44 178.70 2qvx h ALA 73 N 1.43 0.91 -0.55 1.53 0.00 -0.58 -0.74 119.26 121.25 2qvx h ALA 73 Ca -0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 2qvx h ALA 73 Cb 0.91 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2qvx h ALA 73 CO 0.07 0.63 -0.10 -0.07 0.00 0.00 0.00 179.25 179.77 2qvx h LEU 74 N 0.45 1.05 -0.88 0.00 3.38 -0.98 -0.74 115.31 117.59 2qvx h LEU 74 Ca 0.04 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.57 2qvx h LEU 74 Cb 0.85 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2qvx h LEU 74 CO 0.07 1.15 -0.21 -0.74 0.09 0.00 0.00 178.44 178.80 2qvx h HIS 75 N 0.93 0.65 -0.13 1.13 2.76 -1.05 -0.02 115.15 119.42 2qvx h HIS 75 Ca 0.14 -0.13 -0.17 0.00 -2.20 0.00 0.00 60.37 58.01 2qvx h HIS 75 Cb 0.68 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 2qvx h HIS 75 CO 0.05 0.75 -0.63 -0.09 -1.30 0.00 0.00 177.93 176.71 2qvx h ARG 76 N 0.52 0.48 -0.61 5.26 9.65 -0.92 -2.32 114.38 126.43 2qvx h ARG 76 Ca 0.08 -0.34 -0.07 0.00 -1.10 0.00 0.00 59.98 58.55 2qvx h ARG 76 Cb 0.65 0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.26 2qvx h ARG 76 CO 0.05 0.95 0.09 1.25 2.80 0.00 0.00 179.97 185.12 2qvx h LEU 77 N 0.35 0.94 0.00 3.80 6.46 -1.04 -3.42 115.31 122.40 2qvx h LEU 77 Ca -0.01 -0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.54 2qvx h LEU 77 Cb 1.18 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.86 2qvx h LEU 77 CO 0.11 0.94 0.00 0.61 -0.62 0.00 0.00 178.44 179.49 2qvx n GLY 78 N -0.66 1.28 3.72 3.75 0.00 -0.86 -4.55 105.19 107.88 2qvx n GLY 78 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 2qvx n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qvx s ALA 79 N -1.77 1.89 -0.44 4.61 0.00 -0.08 -1.49 121.76 124.49 2qvx s ALA 79 Ca 0.00 0.42 -0.08 0.00 0.00 0.00 0.00 51.96 52.30 2qvx s ALA 79 Cb 0.00 -3.36 0.10 0.00 0.00 0.00 0.00 23.12 19.87 2qvx s ALA 79 CO 0.00 -2.23 0.28 0.08 0.00 0.00 0.00 175.76 173.89 2qvx s VAL 80 N -2.79 4.02 0.09 0.00 1.01 -0.86 -4.17 120.40 117.71 2qvx s VAL 80 Ca 0.64 -1.68 -0.31 0.00 0.00 0.00 0.00 61.98 60.62 2qvx s VAL 80 Cb -0.20 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 2qvx s VAL 80 CO 0.57 -0.65 1.32 -2.84 0.00 0.00 0.00 175.10 173.50 2qvx s PRO 81 N 1.34 4.36 -0.43 2.72 0.02 -1.26 -1.40 135.00 140.36 2qvx s PRO 81 Ca 0.05 1.96 -0.07 0.00 0.02 0.00 0.00 61.00 62.96 2qvx s PRO 81 Cb -0.24 -3.29 0.10 0.00 0.02 0.00 0.00 34.50 31.09 2qvx s PRO 81 CO -0.00 -0.37 0.26 0.00 -0.33 0.00 0.00 177.00 176.55 2qvx s ALA 82 N 1.10 3.26 -0.13 -1.55 0.00 0.13 -0.71 121.76 123.87 2qvx s ALA 82 Ca 0.62 -2.36 -0.20 0.00 0.00 0.00 0.00 51.96 50.03 2qvx s ALA 82 Cb -0.34 -2.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 2qvx s ALA 82 CO 0.30 -1.75 0.54 -0.51 0.00 0.00 0.00 175.76 174.34 2qvx s LEU 83 N 1.32 4.25 -0.04 0.00 1.43 -0.01 -1.06 118.68 124.56 2qvx s LEU 83 Ca 0.05 0.87 0.03 0.00 -1.03 0.00 0.00 54.13 54.05 2qvx s LEU 83 Cb -0.24 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.19 2qvx s LEU 83 CO -0.01 -0.08 -0.11 -0.76 0.23 0.00 0.00 176.35 175.62 2qvx s LEU 84 N 0.95 1.77 -0.01 1.79 1.43 -0.71 -4.12 118.68 119.77 2qvx s LEU 84 Ca 0.28 -0.24 -0.30 0.00 -1.03 0.00 0.00 54.13 52.85 2qvx s LEU 84 Cb -0.16 -0.68 -0.08 0.00 0.03 0.00 0.00 46.19 45.30 2qvx s LEU 84 CO 0.12 0.07 1.98 0.21 0.23 0.00 0.00 176.35 178.96 2qvx s ASN 85 N 0.27 6.32 0.08 2.29 3.84 -1.26 -4.33 114.94 122.15 2qvx s ASN 85 Ca -0.05 2.51 0.11 0.00 0.21 0.00 0.00 52.86 55.63 2qvx s ASN 85 Cb -0.11 -2.53 0.50 0.00 -0.55 0.00 0.00 41.25 38.56 2qvx s ASN 85 CO 0.01 -1.18 1.33 -0.81 -2.79 0.00 0.00 177.10 173.66 2qvx n PRO 86 N 7.70 0.05 0.00 0.43 -0.04 -1.26 -2.02 135.00 139.86 2qvx n PRO 86 Ca 0.21 0.43 0.13 0.00 -0.04 0.00 0.00 63.50 64.24 2qvx n PRO 86 Cb 0.42 -1.62 0.46 0.00 -0.04 0.00 0.00 33.50 32.72 2qvx n PRO 86 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qvx n ARG 87 N -1.71 1.03 -1.00 0.54 1.74 -1.26 -4.91 116.66 111.09 2qvx n ARG 87 Ca 0.01 -0.57 -0.33 0.00 -0.77 0.00 0.00 57.85 56.19 2qvx n ARG 87 Cb 0.09 -1.49 0.13 0.00 -1.02 0.00 0.00 32.46 30.17 2qvx n ARG 87 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2qvx n LEU 88 N -0.49 3.45 -4.76 0.55 4.77 -0.85 -4.67 117.00 115.01 2qvx n LEU 88 Ca 0.14 0.53 -0.41 0.00 -0.03 0.00 0.00 56.01 56.25 2qvx n LEU 88 Cb 0.34 -1.45 -0.04 0.00 -2.33 0.00 0.00 43.42 39.94 2qvx n LEU 88 CO 0.23 -2.10 0.85 -0.54 -1.33 0.00 0.00 177.39 174.51 2qvx s LYS 89 N -4.06 4.55 0.08 3.23 -0.14 -1.26 -4.87 119.74 117.27 2qvx s LYS 89 Ca 0.70 1.91 -0.16 0.00 -1.36 0.00 0.00 55.97 57.05 2qvx s LYS 89 Cb -0.28 -3.18 -0.04 0.00 -1.68 0.00 0.00 37.83 32.66 2qvx s LYS 89 CO 0.54 0.06 0.95 0.43 -0.76 0.00 0.00 175.35 176.57 2qvx n SER 90 N 1.45 -0.56 -0.30 2.83 7.64 -1.26 -0.21 113.62 123.21 2qvx n SER 90 Ca 0.01 1.07 0.12 0.00 1.01 0.00 0.00 58.87 61.08 2qvx n SER 90 Cb 0.44 -0.19 0.27 0.00 -1.01 0.00 0.00 64.21 63.73 2qvx n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qvx h ALA 91 N 0.13 1.19 -0.49 -0.43 0.00 -1.96 -2.07 119.26 115.63 2qvx h ALA 91 Ca 0.08 0.25 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 2qvx h ALA 91 Cb 0.22 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2qvx h ALA 91 CO -0.50 -0.49 -0.15 0.93 0.00 0.00 0.00 179.25 179.04 2qvx h GLU 92 N 0.15 0.95 -0.41 0.00 5.08 -0.95 -1.52 114.58 117.88 2qvx h GLU 92 Ca 0.54 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 2qvx h GLU 92 Cb 1.09 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2qvx h GLU 92 CO -0.70 1.03 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.08 2qvx h LEU 93 N 0.84 0.86 -0.27 1.33 3.38 -0.73 -1.88 115.31 118.84 2qvx h LEU 93 Ca 0.12 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2qvx h LEU 93 Cb 0.71 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2qvx h LEU 93 CO 0.05 1.07 0.13 0.00 0.09 0.00 0.00 178.44 179.78 2qvx h ALA 94 N 0.82 0.34 -0.81 1.53 0.00 -1.26 -1.91 119.26 117.98 2qvx h ALA 94 Ca 0.09 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2qvx h ALA 94 Cb 0.74 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2qvx h ALA 94 CO 0.06 -0.10 0.53 0.93 0.00 0.00 0.00 179.25 180.67 2qvx h GLU 95 N 0.30 0.83 0.00 0.00 4.39 -1.06 -0.10 114.58 118.94 2qvx h GLU 95 Ca 0.09 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2qvx h GLU 95 Cb 0.11 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2qvx h GLU 95 CO -0.01 0.55 -0.27 -0.07 -1.16 0.00 0.00 179.01 178.05 2qvx h LEU 96 N 0.85 0.00 0.20 1.33 3.38 -1.00 -0.79 115.31 119.28 2qvx h LEU 96 Ca 0.35 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 58.03 2qvx h LEU 96 Cb 0.28 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.06 2qvx h LEU 96 CO -0.13 0.27 -1.34 0.40 0.09 0.00 0.00 178.44 177.73 2qvx h ILE 97 N 0.00 1.26 0.79 1.22 2.04 -0.61 -1.83 117.51 120.37 2qvx h ILE 97 Ca -0.00 -2.59 -0.04 0.00 1.00 0.00 0.00 64.86 63.23 2qvx h ILE 97 Cb 1.03 3.01 0.01 0.00 -0.74 0.00 0.00 36.82 40.13 2qvx h ILE 97 CO 0.03 0.78 -0.38 0.11 0.00 0.00 0.00 178.15 178.70 2qvx h LYS 98 N -0.06 -1.02 -1.30 2.37 1.57 -0.99 -2.06 116.57 115.08 2qvx h LYS 98 Ca -0.25 0.07 0.40 0.00 -1.87 0.00 0.00 60.65 59.00 2qvx h LYS 98 Cb 1.97 0.23 -0.11 0.00 0.08 0.00 0.00 32.23 34.40 2qvx h LYS 98 CO 0.20 -0.68 0.86 0.07 -0.57 0.00 0.00 179.45 179.33 2qvx h ARG 99 N -1.06 0.13 0.00 3.15 0.11 -1.30 -0.71 114.38 114.70 2qvx h ARG 99 Ca -0.11 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.96 2qvx h ARG 99 Cb 0.81 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.86 2qvx h ARG 99 CO 0.18 0.09 0.00 0.41 0.10 0.00 0.00 179.97 180.75 2qvx n GLY 100 N -1.57 -1.09 3.86 0.08 0.00 -0.69 -4.93 105.19 100.85 2qvx n GLY 100 Ca 0.34 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 2qvx n GLY 100 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qvx n GLU 101 N -1.44 -0.62 -3.85 1.61 1.02 -0.28 -4.92 120.64 112.16 2qvx n GLU 101 Ca 0.06 0.10 -0.36 0.00 -0.02 0.00 0.00 57.16 56.94 2qvx n GLU 101 Cb 0.20 -1.65 -0.06 0.00 -0.02 0.00 0.00 31.44 29.92 2qvx n GLU 101 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2qvx s MET 102 N -6.16 3.48 0.03 3.49 -1.94 -1.23 -4.71 119.30 112.26 2qvx s MET 102 Ca 0.27 -0.13 -0.06 0.00 -1.71 0.00 0.00 55.69 54.06 2qvx s MET 102 Cb -0.15 -3.16 -0.30 0.00 2.01 0.00 0.00 34.83 33.23 2qvx s MET 102 CO 0.73 0.74 0.96 1.15 -0.01 0.00 0.00 175.02 178.59 2qvx h THR 103 N 3.64 1.27 -4.27 2.05 2.02 -0.96 -3.40 112.91 113.27 2qvx h THR 103 Ca -0.53 -2.84 -0.18 0.00 0.77 0.00 0.00 66.41 63.62 2qvx h THR 103 Cb 1.22 2.87 -0.13 0.00 -1.74 0.00 0.00 68.15 70.37 2qvx h THR 103 CO 0.61 0.84 -0.43 0.00 0.37 0.00 0.00 175.52 176.91 2qvx s ALA 104 N -2.62 0.70 -0.07 6.16 0.00 -1.24 -1.92 121.76 122.77 2qvx s ALA 104 Ca -0.08 -1.42 -0.01 0.00 0.00 0.00 0.00 51.96 50.45 2qvx s ALA 104 Cb 0.06 1.28 0.03 0.00 0.00 0.00 0.00 23.12 24.49 2qvx s ALA 104 CO 0.88 -0.69 -0.01 0.00 0.00 0.00 0.00 175.76 175.94 2qvx s ALA 105 N -4.06 0.76 -0.29 0.00 0.00 0.50 -0.09 121.76 118.57 2qvx s ALA 105 Ca 0.33 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 51.96 2qvx s ALA 105 Cb 0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 2qvx s ALA 105 CO 0.12 -0.39 0.48 0.08 0.00 0.00 0.00 175.76 176.05 2qvx s VAL 106 N 1.78 5.08 -0.04 0.00 1.01 0.34 -0.67 120.40 127.90 2qvx s VAL 106 Ca 0.03 0.63 0.05 0.00 0.00 0.00 0.00 61.98 62.69 2qvx s VAL 106 Cb -0.13 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2qvx s VAL 106 CO -0.05 0.01 -0.20 -0.63 0.00 0.00 0.00 175.10 174.23 2qvx s ILE 107 N 2.28 1.64 -0.01 2.22 1.01 0.07 -0.98 121.20 127.42 2qvx s ILE 107 Ca 0.19 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.01 2qvx s ILE 107 Cb -0.16 -1.39 0.03 0.00 0.01 0.00 0.00 42.46 40.96 2qvx s ILE 107 CO 0.11 0.46 0.81 0.00 0.00 0.00 0.00 174.94 176.32 2qvx n ALA 108 N 2.91 1.61 -1.30 9.38 0.00 -0.52 -0.61 120.51 131.99 2qvx n ALA 108 Ca -0.17 -0.97 -0.30 0.00 0.00 0.00 0.00 53.44 52.00 2qvx n ALA 108 Cb 0.53 -0.11 0.23 0.00 0.00 0.00 0.00 19.45 20.10 2qvx n ALA 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qvx s VAL 109 N -0.66 1.70 0.94 0.00 0.11 -1.24 -4.84 120.40 116.41 2qvx s VAL 109 Ca 0.03 0.00 -0.15 0.00 -2.93 0.00 0.00 61.98 58.93 2qvx s VAL 109 Cb 0.03 -2.62 0.19 0.00 -1.53 0.00 0.00 36.38 32.45 2qvx s VAL 109 CO 0.00 0.00 1.30 -0.83 -3.33 0.00 0.00 175.10 172.24 2qvx s GLY 110 N -4.16 1.76 0.56 6.54 0.00 -1.26 -4.89 107.32 105.88 2qvx s GLY 110 Ca 0.72 -1.17 0.26 0.00 0.00 0.00 0.00 44.72 44.53 2qvx s GLY 110 CO 0.55 -0.43 2.06 3.21 0.00 0.00 0.00 173.10 178.49 2qvx h ARG 111 N -1.55 0.00 0.00 2.90 2.47 -2.00 -2.52 114.38 113.68 2qvx h ARG 111 Ca -0.44 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.27 2qvx h ARG 111 Cb 1.24 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.56 2qvx h ARG 111 CO 0.41 0.00 -0.10 -0.56 0.56 0.00 0.00 179.97 180.28 2qvx h GLN 112 N 0.00 0.00 0.00 0.04 -0.00 -2.00 -2.32 115.11 110.83 2qvx h GLN 112 Ca 0.14 0.00 -0.21 0.00 -0.00 0.00 0.00 58.65 58.57 2qvx h GLN 112 Cb 0.64 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.08 2qvx h GLN 112 CO -0.00 0.03 -1.49 -0.39 -0.00 0.00 0.00 178.83 176.98 2qvx h VAL 113 N 0.00 0.67 -0.52 1.86 -1.51 -1.82 -2.96 116.25 111.98 2qvx h VAL 113 Ca -0.00 -2.31 -0.07 0.00 -1.23 0.00 0.00 66.70 63.09 2qvx h VAL 113 Cb 1.02 2.21 -0.02 0.00 -2.13 0.00 0.00 31.29 32.37 2qvx h VAL 113 CO 0.00 0.38 0.04 0.00 -1.23 0.00 0.00 177.57 176.76 2qvx h ALA 114 N 1.25 1.09 -0.04 5.19 0.00 -1.46 -2.72 119.26 122.58 2qvx h ALA 114 Ca -0.20 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.46 2qvx h ALA 114 Cb 1.75 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 2qvx h ALA 114 CO 0.06 0.58 -0.03 -0.44 0.00 0.00 0.00 179.25 179.43 2qvx h ASP 115 N 0.80 -0.09 -0.58 0.00 5.19 -1.48 0.41 116.42 120.68 2qvx h ASP 115 Ca 0.16 0.02 0.10 0.00 -0.62 0.00 0.00 57.03 56.69 2qvx h ASP 115 Cb 0.42 0.05 -0.11 0.00 0.18 0.00 0.00 39.33 39.87 2qvx h ASP 115 CO 0.02 -0.04 -0.33 0.00 -3.12 0.00 0.00 179.24 175.77 2qvx h ALA 116 N 1.01 -0.04 -0.42 3.45 0.00 -1.33 0.63 119.26 122.56 2qvx h ALA 116 Ca 0.03 0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2qvx h ALA 116 Cb 0.07 0.77 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2qvx h ALA 116 CO -0.06 -0.67 0.20 0.82 0.00 0.00 0.00 179.25 179.54 2qvx h ILE 117 N -0.16 0.96 -0.84 0.00 2.04 -1.33 -3.00 117.51 115.19 2qvx h ILE 117 Ca 0.23 -0.14 0.20 0.00 1.00 0.00 0.00 64.86 66.15 2qvx h ILE 117 Cb 0.55 0.52 -0.15 0.00 -0.74 0.00 0.00 36.82 36.99 2qvx h ILE 117 CO -0.67 0.07 0.00 -0.26 0.00 0.00 0.00 178.15 177.30 2qvx h PHE 118 N 0.41 -0.06 0.00 1.37 0.04 0.14 -3.35 116.94 115.49 2qvx h PHE 118 Ca 0.18 0.06 0.00 0.00 2.80 0.00 0.00 57.97 61.01 2qvx h PHE 118 Cb 0.10 0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.41 2qvx h PHE 118 CO -0.11 -0.30 0.00 0.00 -0.60 0.00 0.00 178.31 177.30 2qvx n GLN 119 N -5.40 0.00 0.00 1.51 0.00 -0.84 -4.75 117.38 107.90 2qvx n GLN 119 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.16 2qvx n GLN 119 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.80 2qvx n GLN 119 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2qvx n SER 120 N 0.00 0.00 0.00 2.61 3.41 -1.14 -4.56 113.62 113.94 2qvx n SER 120 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2qvx n SER 120 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2qvx n SER 120 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qvx n GLY 121 N 0.00 2.03 3.69 5.00 0.00 -1.26 -5.01 105.19 109.64 2qvx n GLY 121 Ca 0.00 -0.57 -0.52 0.00 0.00 0.00 0.00 46.02 44.93 2qvx n GLY 121 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qvx n SER 122 N 0.00 2.98 -4.56 1.61 3.41 -1.26 -4.84 113.62 110.96 2qvx n SER 122 Ca 0.00 1.02 -0.21 0.00 -0.26 0.00 0.00 58.87 59.41 2qvx n SER 122 Cb 0.00 -1.27 -0.06 0.00 -0.26 0.00 0.00 64.21 62.61 2qvx n SER 122 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qvx s GLY 123 N 3.78 -0.27 -0.19 5.00 0.00 -1.26 -4.90 107.32 109.48 2qvx s GLY 123 Ca 0.95 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 44.32 2qvx s GLY 123 CO 0.57 3.81 -0.11 0.00 0.00 0.00 0.00 173.10 177.37 2qvx s ALA 124 N 12.37 1.97 -0.11 3.20 0.00 -1.26 -4.84 121.76 133.09 2qvx s ALA 124 Ca 0.78 -1.13 -0.36 0.00 0.00 0.00 0.00 51.96 51.25 2qvx s ALA 124 Cb -0.08 -1.23 -0.13 0.00 0.00 0.00 0.00 23.12 21.68 2qvx s ALA 124 CO 0.05 -0.71 1.78 0.54 0.00 0.00 0.00 175.76 177.42 2qvx n ARG 125 N 4.70 1.82 -2.73 0.00 1.74 -0.81 -4.64 116.66 116.75 2qvx n ARG 125 Ca -0.15 0.67 -0.42 0.00 -0.77 0.00 0.00 57.85 57.17 2qvx n ARG 125 Cb 0.47 -2.45 -0.03 0.00 -1.02 0.00 0.00 32.46 29.43 2qvx n ARG 125 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2qvx s ILE 126 N 3.37 4.08 -0.25 0.55 -5.25 -1.26 -0.37 121.20 122.06 2qvx s ILE 126 Ca 0.92 -0.01 -0.14 0.00 -0.99 0.00 0.00 60.65 60.43 2qvx s ILE 126 Cb -0.81 -4.78 -0.04 0.00 2.95 0.00 0.00 42.46 39.78 2qvx s ILE 126 CO 0.54 -1.61 0.31 -0.63 -1.79 0.00 0.00 174.94 171.75 2qvx s ILE 127 N 4.75 5.24 0.08 8.37 1.01 0.15 -4.98 121.20 135.82 2qvx s ILE 127 Ca 0.28 0.46 -0.31 0.00 0.00 0.00 0.00 60.65 61.08 2qvx s ILE 127 Cb -0.13 -3.64 -0.06 0.00 0.01 0.00 0.00 42.46 38.64 2qvx s ILE 127 CO 0.13 0.23 1.26 -0.36 0.00 0.00 0.00 174.94 176.20 2qvx s PHE 128 N 1.65 3.37 0.27 3.97 2.99 -1.26 -0.75 117.98 128.22 2qvx s PHE 128 Ca 0.13 1.18 0.00 0.00 0.00 0.00 0.00 56.93 58.25 2qvx s PHE 128 Cb -0.15 -3.51 0.58 0.00 0.00 0.00 0.00 43.02 39.94 2qvx s PHE 128 CO 0.09 -1.65 1.76 1.25 -0.00 0.00 0.00 175.22 176.66 2qvx h LEU 129 N 6.78 0.54 0.00 -0.37 5.85 -1.21 -0.06 115.31 126.84 2qvx h LEU 129 Ca -0.42 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2qvx h LEU 129 Cb 1.21 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2qvx h LEU 129 CO 0.83 0.21 0.00 0.61 -0.34 0.00 0.00 178.44 179.75 2qvx n GLY 130 N -1.33 -0.77 0.12 3.75 0.00 -1.26 -1.46 105.19 104.24 2qvx n GLY 130 Ca 0.18 -0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2qvx n GLY 130 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qvx n ASP 131 N -1.07 0.73 -0.04 1.61 8.00 -0.04 -4.41 116.55 121.33 2qvx n ASP 131 Ca 0.15 -0.55 -0.09 0.00 0.71 0.00 0.00 54.79 55.02 2qvx n ASP 131 Cb 0.10 0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 2qvx n ASP 131 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qvx n LEU 132 N -1.07 0.90 -3.70 0.64 4.77 -0.54 -4.80 117.00 113.20 2qvx n LEU 132 Ca 0.09 0.15 -0.14 0.00 -0.03 0.00 0.00 56.01 56.08 2qvx n LEU 132 Cb 0.34 -0.35 -0.14 0.00 -2.33 0.00 0.00 43.42 40.94 2qvx n LEU 132 CO 0.30 0.00 -0.19 -0.69 -1.33 0.00 0.00 177.39 175.48 2qvx s VAL 133 N -2.22 -0.19 -0.12 4.08 1.01 -0.61 -2.82 120.40 119.52 2qvx s VAL 133 Ca -0.13 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.10 2qvx s VAL 133 Cb 0.04 -0.33 0.02 0.00 0.00 0.00 0.00 36.38 36.12 2qvx s VAL 133 CO 0.17 0.10 -0.10 -0.60 0.00 0.00 0.00 175.10 174.68 2qvx s ARG 134 N 1.80 1.76 -1.37 2.72 3.52 -0.99 -4.19 118.95 122.20 2qvx s ARG 134 Ca -0.03 -0.35 -0.06 0.00 -0.13 0.00 0.00 55.73 55.16 2qvx s ARG 134 Cb -0.12 -1.73 0.03 0.00 -1.56 0.00 0.00 34.95 31.57 2qvx s ARG 134 CO -0.07 -0.24 0.92 -0.25 -0.81 0.00 0.00 175.30 174.84 2qvx n ASP 135 N 4.84 -3.32 0.00 -2.12 10.43 -1.26 -1.04 116.55 124.08 2qvx n ASP 135 Ca -0.14 -0.73 0.00 0.00 2.57 0.00 0.00 54.79 56.49 2qvx n ASP 135 Cb 0.50 -4.32 0.00 0.00 1.84 0.00 0.00 41.12 39.14 2qvx n ASP 135 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qvx n GLY 136 N -1.62 0.49 3.33 0.44 0.00 -1.26 -4.99 105.19 101.58 2qvx n GLY 136 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 2qvx n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qvx s GLU 137 N -0.55 2.83 0.60 1.61 0.41 -0.21 -4.97 118.70 118.42 2qvx s GLU 137 Ca 0.00 -1.06 -0.12 0.00 -0.41 0.00 0.00 54.97 53.38 2qvx s GLU 137 Cb 0.00 -3.55 -0.05 0.00 -1.78 0.00 0.00 34.13 28.75 2qvx s GLU 137 CO 0.00 -0.62 1.02 -1.25 -0.49 0.00 0.00 175.26 173.92 2qvx s PRO 138 N 1.49 3.66 -0.37 0.39 0.04 -1.26 -2.35 135.00 136.59 2qvx s PRO 138 Ca 0.01 0.78 -0.07 0.00 0.04 0.00 0.00 61.00 61.76 2qvx s PRO 138 Cb -0.19 -2.09 0.06 0.00 0.04 0.00 0.00 34.50 32.32 2qvx s PRO 138 CO 0.04 -0.51 0.17 0.71 0.04 0.00 0.00 177.00 177.45 2qvx s TYR 139 N -3.08 3.32 -0.03 0.56 4.12 -1.13 -4.99 117.35 116.12 2qvx s TYR 139 Ca 0.56 -1.58 0.07 0.00 0.02 0.00 0.00 57.07 56.13 2qvx s TYR 139 Cb -0.11 -2.63 -0.02 0.00 -1.52 0.00 0.00 41.96 37.68 2qvx s TYR 139 CO 0.50 -0.80 -0.25 -1.54 0.02 0.00 0.00 175.55 173.48 2qvx s SER 140 N 1.71 3.12 0.06 2.29 1.04 -1.26 -4.93 113.70 115.73 2qvx s SER 140 Ca 0.01 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 55.97 2qvx s SER 140 Cb -0.21 -0.51 -0.04 0.00 0.10 0.00 0.00 66.02 65.36 2qvx s SER 140 CO 0.02 0.30 -0.04 -0.72 0.98 0.00 0.00 173.24 173.78 2qvx s TYR 141 N -0.49 0.56 0.00 5.02 1.13 -1.26 -5.07 117.35 117.24 2qvx s TYR 141 Ca 0.06 -1.03 0.00 0.00 -1.41 0.00 0.00 57.07 54.69 2qvx s TYR 141 Cb -0.11 -0.40 0.00 0.00 -1.10 0.00 0.00 41.96 40.35 2qvx s TYR 141 CO 0.00 -0.34 0.00 0.41 -2.51 0.00 0.00 175.55 173.11 2qvx n GLY 142 N 0.14 -0.21 3.75 5.49 0.00 -1.26 -3.96 105.19 109.13 2qvx n GLY 142 Ca -0.14 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 43.92 2qvx n GLY 142 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qvx s PRO 143 N -3.25 2.26 0.99 1.61 0.04 -1.26 -4.94 135.00 130.45 2qvx s PRO 143 Ca 0.00 1.36 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 2qvx s PRO 143 Cb 0.00 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.75 2qvx s PRO 143 CO 0.00 -1.66 0.57 -0.35 0.04 0.00 0.00 177.00 175.60 2qvx n PRO 144 N -3.15 -0.73 -4.39 0.56 -0.04 -1.26 -4.87 135.00 121.12 2qvx n PRO 144 Ca 0.10 -0.17 -0.24 0.00 -0.04 0.00 0.00 63.50 63.15 2qvx n PRO 144 Cb 0.52 -1.98 -0.09 0.00 -0.04 0.00 0.00 33.50 31.91 2qvx n PRO 144 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 2qvx s ILE 145 N -2.43 2.86 0.48 0.52 1.10 -1.26 -5.05 121.20 117.42 2qvx s ILE 145 Ca 0.60 -2.15 -0.20 0.00 -0.51 0.00 0.00 60.65 58.38 2qvx s ILE 145 Cb -0.20 -2.49 -0.09 0.00 0.15 0.00 0.00 42.46 39.82 2qvx s ILE 145 CO 0.65 -0.35 1.03 -1.83 -2.11 0.00 0.00 174.94 172.33 2qvx s GLU 146 N -3.45 3.85 -0.41 3.50 -1.05 -1.26 -5.00 118.70 114.87 2qvx s GLU 146 Ca 0.29 1.36 -0.25 0.00 -0.15 0.00 0.00 54.97 56.22 2qvx s GLU 146 Cb -0.06 -2.12 0.02 0.00 -0.44 0.00 0.00 34.13 31.53 2qvx s GLU 146 CO 0.16 -0.39 0.91 0.34 0.95 0.00 0.00 175.26 177.23 2qvx s ASP 147 N -1.97 6.58 0.68 0.83 2.15 -1.26 -4.93 116.67 118.76 2qvx s ASP 147 Ca 0.66 0.34 -0.16 0.00 0.43 0.00 0.00 52.55 53.83 2qvx s ASP 147 Cb -0.16 -2.45 0.01 0.00 -0.30 0.00 0.00 42.92 40.02 2qvx s ASP 147 CO 0.20 -0.93 1.21 -2.16 -0.17 0.00 0.00 175.17 173.31 2qvx s PRO 148 N 3.56 2.44 0.27 4.34 0.04 -1.26 -4.97 135.00 139.42 2qvx s PRO 148 Ca 0.37 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.88 2qvx s PRO 148 Cb -0.11 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.46 2qvx s PRO 148 CO 0.22 -1.61 1.29 -1.14 0.04 0.00 0.00 177.00 175.80 2qvx s GLN 149 N -3.74 4.40 -0.02 4.56 2.00 -1.26 -5.03 119.66 120.57 2qvx s GLN 149 Ca 0.75 2.11 0.07 0.00 -2.00 0.00 0.00 55.36 56.29 2qvx s GLN 149 Cb -0.29 -3.13 -0.02 0.00 0.80 0.00 0.00 33.01 30.36 2qvx s GLN 149 CO 0.41 -0.18 -0.23 1.03 -0.50 0.00 0.00 175.29 175.82 2qvx s ARG 150 N -1.03 2.18 -0.08 1.67 0.52 -1.26 -5.12 118.95 115.83 2qvx s ARG 150 Ca 0.52 -0.89 0.03 0.00 -0.52 0.00 0.00 55.73 54.87 2qvx s ARG 150 Cb -0.38 -2.11 -0.02 0.00 0.52 0.00 0.00 34.95 32.96 2qvx s ARG 150 CO 0.45 0.57 -0.18 -1.21 0.02 0.00 0.00 175.30 174.96 2qvx s GLU 151 N -0.68 2.79 0.30 3.54 0.41 -1.26 -5.05 118.70 118.75 2qvx s GLU 151 Ca 0.10 -0.77 0.02 0.00 -0.41 0.00 0.00 54.97 53.92 2qvx s GLU 151 Cb -0.10 -2.38 0.73 0.00 -1.78 0.00 0.00 34.13 30.60 2qvx s GLU 151 CO -0.00 0.41 1.60 -1.00 -0.49 0.00 0.00 175.26 175.78 2qvx h PRO 152 N 6.01 0.07 -0.00 0.39 0.13 -1.99 0.18 132.00 136.79 2qvx h PRO 152 Ca -0.35 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2qvx h PRO 152 Cb 1.18 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2qvx h PRO 152 CO 0.51 0.04 -0.32 0.00 -0.23 0.00 0.00 178.00 178.00 2qvx n ALA 153 N -2.96 3.17 -1.77 -0.56 0.00 -1.26 0.08 120.51 117.21 2qvx n ALA 153 Ca 0.22 -0.33 -0.41 0.00 0.00 0.00 0.00 53.44 52.92 2qvx n ALA 153 Cb 0.73 -1.19 0.01 0.00 0.00 0.00 0.00 19.45 19.00 2qvx n ALA 153 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2qvx s GLN 154 N -2.76 3.93 0.40 0.00 0.74 0.64 -4.66 119.66 117.93 2qvx s GLN 154 Ca 0.18 2.54 -0.27 0.00 0.05 0.00 0.00 55.36 57.87 2qvx s GLN 154 Cb 0.19 -2.84 -0.10 0.00 1.10 0.00 0.00 33.01 31.35 2qvx s GLN 154 CO 0.59 -0.67 1.38 -2.30 -0.55 0.00 0.00 175.29 173.75 2qvx n PRO 155 N 0.18 2.29 0.00 1.67 -0.02 -1.26 -0.03 135.00 137.82 2qvx n PRO 155 Ca 0.03 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2qvx n PRO 155 Cb 0.40 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 2qvx n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qvx n ALA 156 N 0.11 2.49 -2.88 3.55 0.00 0.24 -4.57 120.51 119.46 2qvx n ALA 156 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 2qvx n ALA 156 Cb 0.39 0.49 -0.07 0.00 0.00 0.00 0.00 19.45 20.26 2qvx n ALA 156 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2qvx s PHE 157 N -1.99 -0.05 -0.13 0.00 0.08 -0.97 -4.04 117.98 110.88 2qvx s PHE 157 Ca 0.00 -0.19 -0.00 0.00 0.12 0.00 0.00 56.93 56.85 2qvx s PHE 157 Cb 0.00 0.08 0.02 0.00 -0.57 0.00 0.00 43.02 42.56 2qvx s PHE 157 CO 0.00 -0.55 -0.10 0.42 -0.10 0.00 0.00 175.22 174.89 2qvx s ILE 158 N -3.11 1.26 0.17 0.64 1.01 0.12 -0.54 121.20 120.75 2qvx s ILE 158 Ca -0.01 -0.45 0.10 0.00 0.00 0.00 0.00 60.65 60.29 2qvx s ILE 158 Cb 0.01 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.20 2qvx s ILE 158 CO -0.07 0.39 -0.17 -0.36 0.00 0.00 0.00 174.94 174.73 2qvx s PHE 159 N 1.61 2.48 -0.10 3.97 0.08 -1.06 -0.83 117.98 124.13 2qvx s PHE 159 Ca 0.05 -0.29 -0.01 0.00 0.12 0.00 0.00 56.93 56.80 2qvx s PHE 159 Cb -0.13 -1.24 -0.03 0.00 -0.57 0.00 0.00 43.02 41.06 2qvx s PHE 159 CO -0.09 0.48 -0.05 0.71 -0.10 0.00 0.00 175.22 176.17 2qvx s TYR 160 N -1.59 3.00 0.00 0.36 1.51 -1.26 -0.80 117.35 118.57 2qvx s TYR 160 Ca 0.22 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.23 2qvx s TYR 160 Cb -0.09 -1.80 0.00 0.00 -0.11 0.00 0.00 41.96 39.97 2qvx s TYR 160 CO 0.12 0.24 0.00 0.25 -1.11 0.00 0.00 175.55 175.05 2qvx n THR 161 N 2.60 0.00 -3.76 -0.71 -2.24 -0.66 -4.94 114.28 104.57 2qvx n THR 161 Ca -0.18 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.58 2qvx n THR 161 Cb 0.53 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.77 2qvx n THR 161 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qvx n SER 162 N 0.00 -1.24 0.00 3.42 3.41 -1.26 -4.73 113.62 113.22 2qvx n SER 162 Ca 0.00 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 56.96 2qvx n SER 162 Cb 0.00 2.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.96 2qvx n SER 162 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2qvx n THR 165 N -0.51 0.00 -4.47 6.66 -2.24 -1.26 -4.80 114.28 107.67 2qvx n THR 165 Ca -0.02 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.43 2qvx n THR 165 Cb 0.41 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.52 2qvx n THR 165 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2qvx s GLY 166 N 0.00 1.70 0.00 3.38 0.00 -1.26 -4.95 107.32 106.20 2qvx s GLY 166 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.89 2qvx s GLY 166 CO 0.00 -0.16 0.00 -0.10 0.00 0.00 0.00 173.10 172.84 2qvx n LEU 167 N 3.34 -1.21 -4.76 0.66 7.94 -1.26 -5.02 117.00 116.69 2qvx n LEU 167 Ca -0.18 0.00 -0.39 0.00 -1.11 0.00 0.00 56.01 54.34 2qvx n LEU 167 Cb 0.53 -0.60 0.03 0.00 0.53 0.00 0.00 43.42 43.90 2qvx n LEU 167 CO 0.32 0.00 1.02 -2.84 -1.11 0.00 0.00 177.39 174.78 2qvx s PRO 168 N -2.39 3.39 -0.01 1.96 0.02 -1.26 -4.91 135.00 131.79 2qvx s PRO 168 Ca 0.00 2.31 -0.07 0.00 0.02 0.00 0.00 61.00 63.26 2qvx s PRO 168 Cb 0.00 -2.43 -0.05 0.00 0.02 0.00 0.00 34.50 32.04 2qvx s PRO 168 CO 0.00 -1.02 0.26 0.15 -0.33 0.00 0.00 177.00 176.06 2qvx s LYS 169 N -2.70 3.58 -0.61 5.54 1.02 -1.26 -4.85 119.74 120.45 2qvx s LYS 169 Ca 0.67 -0.06 -0.20 0.00 0.02 0.00 0.00 55.97 56.40 2qvx s LYS 169 Cb -0.42 -3.10 0.09 0.00 -0.52 0.00 0.00 37.83 33.88 2qvx s LYS 169 CO 0.51 0.67 0.80 0.00 -0.92 0.00 0.00 175.35 176.40 2qvx s ALA 170 N -1.26 3.30 -0.16 5.17 0.00 -1.26 -1.66 121.76 125.89 2qvx s ALA 170 Ca 0.26 -2.03 -0.27 0.00 0.00 0.00 0.00 51.96 49.93 2qvx s ALA 170 Cb -0.13 -3.64 -0.01 0.00 0.00 0.00 0.00 23.12 19.34 2qvx s ALA 170 CO 0.15 -2.47 0.89 0.00 0.00 0.00 0.00 175.76 174.33 2qvx s ALA 171 N 3.20 3.51 -0.24 0.00 0.00 0.01 0.13 121.76 128.37 2qvx s ALA 171 Ca 0.16 0.13 -0.20 0.00 0.00 0.00 0.00 51.96 52.04 2qvx s ALA 171 Cb -0.21 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.58 2qvx s ALA 171 CO 0.08 -0.68 0.62 0.42 0.00 0.00 0.00 175.76 176.20 2qvx s ILE 172 N 2.23 5.00 -0.45 0.00 1.01 -0.11 -2.56 121.20 126.32 2qvx s ILE 172 Ca 0.41 1.11 -0.16 0.00 0.00 0.00 0.00 60.65 62.01 2qvx s ILE 172 Cb -0.17 -3.92 0.05 0.00 0.01 0.00 0.00 42.46 38.43 2qvx s ILE 172 CO 0.13 0.05 0.42 -0.63 0.00 0.00 0.00 174.94 174.91 2qvx s ILE 173 N 2.34 5.15 0.67 2.92 -1.09 0.30 -0.76 121.20 130.74 2qvx s ILE 173 Ca 0.26 -0.73 -0.13 0.00 -2.23 0.00 0.00 60.65 57.82 2qvx s ILE 173 Cb -0.16 -4.09 0.00 0.00 -1.58 0.00 0.00 42.46 36.64 2qvx s ILE 173 CO 0.09 -0.52 1.07 -2.16 -1.23 0.00 0.00 174.94 172.19 2qvx s PRO 174 N 1.91 2.91 0.28 2.79 0.04 -1.26 -0.59 135.00 141.07 2qvx s PRO 174 Ca 0.08 1.15 -0.08 0.00 0.04 0.00 0.00 61.00 62.19 2qvx s PRO 174 Cb -0.21 -1.98 0.46 0.00 0.04 0.00 0.00 34.50 32.81 2qvx s PRO 174 CO 0.10 -1.13 1.53 1.04 0.04 0.00 0.00 177.00 178.58 2qvx n GLN 175 N -2.72 -0.09 0.00 4.56 1.13 0.95 -1.24 117.38 119.97 2qvx n GLN 175 Ca 0.09 1.53 0.07 0.00 -1.94 0.00 0.00 57.00 56.74 2qvx n GLN 175 Cb 0.53 -2.29 0.39 0.00 0.11 0.00 0.00 30.24 28.98 2qvx n GLN 175 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2qvx n ARG 176 N -5.60 0.41 0.02 -1.09 1.85 0.11 -3.00 116.66 109.36 2qvx n ARG 176 Ca 0.16 0.01 0.11 0.00 -1.00 0.00 0.00 57.85 57.12 2qvx n ARG 176 Cb 0.50 -1.50 -0.09 0.00 -1.05 0.00 0.00 32.46 30.32 2qvx n ARG 176 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qvx n ALA 177 N -1.01 3.04 -0.33 2.89 0.00 -0.37 -4.39 120.51 120.34 2qvx n ALA 177 Ca 0.10 -0.44 0.03 0.00 0.00 0.00 0.00 53.44 53.13 2qvx n ALA 177 Cb 0.05 -0.88 0.18 0.00 0.00 0.00 0.00 19.45 18.80 2qvx n ALA 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qvx h ALA 178 N 2.20 1.31 -0.08 0.00 0.00 -1.70 -2.84 119.26 118.14 2qvx h ALA 178 Ca 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2qvx h ALA 178 Cb 0.90 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2qvx h ALA 178 CO 0.00 0.25 -0.02 1.49 0.00 0.00 0.00 179.25 180.97 2qvx h GLU 179 N 0.97 0.16 0.00 0.00 4.81 -1.77 -1.04 114.58 117.72 2qvx h GLU 179 Ca 0.43 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 2qvx h GLU 179 Cb 0.31 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2qvx h GLU 179 CO -0.22 0.48 -0.14 0.66 -0.73 0.00 0.00 179.01 179.05 2qvx h SER 180 N -0.17 0.00 1.09 1.04 4.64 -1.86 0.36 113.55 118.66 2qvx h SER 180 Ca 0.02 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2qvx h SER 180 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2qvx h SER 180 CO 0.01 0.02 0.00 0.03 -0.87 0.00 0.00 176.83 176.02 2qvx h ARG 181 N 0.00 0.00 0.00 4.77 3.08 -1.12 -3.01 114.38 118.10 2qvx h ARG 181 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 59.98 59.64 2qvx h ARG 181 Cb 0.78 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.77 2qvx h ARG 181 CO 0.00 0.00 -2.26 0.28 -1.07 0.00 0.00 179.97 176.92 2qvx n VAL 182 N -2.57 1.53 0.35 2.04 0.31 -0.41 -3.85 118.33 115.73 2qvx n VAL 182 Ca 0.03 -0.30 0.13 0.00 -0.01 0.00 0.00 64.34 64.18 2qvx n VAL 182 Cb 0.32 -1.92 0.56 0.00 -0.91 0.00 0.00 33.84 31.88 2qvx n VAL 182 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2qvx h LEU 183 N -1.00 0.00 -1.71 7.52 3.38 -0.44 -0.49 115.31 122.57 2qvx h LEU 183 Ca -0.62 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 2qvx h LEU 183 Cb 1.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.29 2qvx h LEU 183 CO -0.38 0.00 -0.05 2.19 0.09 0.00 0.00 178.44 180.30 2qvx h PHE 184 N 0.00 0.00 0.00 1.13 -5.15 -1.77 0.11 116.94 111.26 2qvx h PHE 184 Ca 0.00 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.76 2qvx h PHE 184 Cb 0.34 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.51 2qvx h PHE 184 CO 0.00 0.05 -0.03 0.52 -2.00 0.00 0.00 178.31 176.84 2qvx h MET 185 N 0.00 0.00 0.00 6.09 2.86 -1.38 0.58 114.93 123.08 2qvx h MET 185 Ca -0.00 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 2qvx h MET 185 Cb 0.44 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 2qvx h MET 185 CO 0.01 0.03 -1.50 0.45 1.06 0.00 0.00 176.91 176.96 2qvx n SER 186 N -3.19 1.90 -0.28 1.22 2.88 0.21 -1.52 113.62 114.84 2qvx n SER 186 Ca -0.01 0.42 -0.05 0.00 -1.33 0.00 0.00 58.87 57.90 2qvx n SER 186 Cb 0.25 -0.86 0.06 0.00 -0.75 0.00 0.00 64.21 62.91 2qvx n SER 186 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2qvx h THR 187 N -1.00 1.24 0.02 2.46 1.35 -1.13 -2.05 112.91 113.79 2qvx h THR 187 Ca -0.34 -0.60 -0.29 0.00 -0.55 0.00 0.00 66.41 64.63 2qvx h THR 187 Cb 1.21 0.22 -0.04 0.00 -1.73 0.00 0.00 68.15 67.81 2qvx h THR 187 CO -0.21 0.26 -1.57 0.00 -0.25 0.00 0.00 175.52 173.76 2qvx n GLN 188 N -4.42 0.60 0.01 4.72 3.00 0.19 -4.62 117.38 116.86 2qvx n GLN 188 Ca 0.07 0.48 -0.04 0.00 -0.01 0.00 0.00 57.00 57.50 2qvx n GLN 188 Cb 0.10 -1.71 -0.11 0.00 0.00 0.00 0.00 30.24 28.53 2qvx n GLN 188 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2qvx n VAL 189 N -4.22 1.36 0.00 5.09 0.31 -1.16 -4.95 118.33 114.76 2qvx n VAL 189 Ca -0.35 -0.74 0.00 0.00 -0.01 0.00 0.00 64.34 63.24 2qvx n VAL 189 Cb 0.78 -0.86 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 2qvx n VAL 189 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qvx n GLY 190 N 1.47 1.13 3.77 2.92 0.00 -0.70 -4.97 105.19 108.80 2qvx n GLY 190 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 2qvx n GLY 190 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qvx s LEU 191 N 0.00 4.27 0.32 0.99 1.43 -0.57 -4.95 118.68 120.16 2qvx s LEU 191 Ca 0.00 2.18 0.10 0.00 -1.03 0.00 0.00 54.13 55.38 2qvx s LEU 191 Cb 0.00 -3.99 -0.06 0.00 0.03 0.00 0.00 46.19 42.17 2qvx s LEU 191 CO 0.00 -0.45 -0.11 0.00 0.23 0.00 0.00 176.35 176.03 2qvx s ARG 192 N -2.15 1.84 0.44 1.70 1.70 -1.26 -4.27 118.95 116.95 2qvx s ARG 192 Ca 0.54 -1.83 -0.25 0.00 -0.47 0.00 0.00 55.73 53.71 2qvx s ARG 192 Cb -0.27 -1.78 -0.08 0.00 -0.57 0.00 0.00 34.95 32.25 2qvx s ARG 192 CO 0.34 0.21 1.40 -1.58 -1.08 0.00 0.00 175.30 174.59 2qvx s HIS 193 N -2.55 2.52 0.00 5.89 5.65 -1.26 -4.94 115.29 120.60 2qvx s HIS 193 Ca 0.32 1.29 0.00 0.00 0.25 0.00 0.00 55.06 56.92 2qvx s HIS 193 Cb -0.01 -3.87 0.00 0.00 -1.18 0.00 0.00 32.58 27.52 2qvx s HIS 193 CO 0.17 -2.78 0.00 0.41 -0.65 0.00 0.00 174.74 171.89 2qvx n GLY 194 N 0.59 4.40 0.00 1.59 0.00 -0.56 -4.95 105.19 106.26 2qvx n GLY 194 Ca 0.05 -0.79 0.07 0.00 0.00 0.00 0.00 46.02 45.35 2qvx n GLY 194 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qvx n ARG 195 N -1.58 0.23 0.13 1.61 1.74 -1.25 -1.17 116.66 116.37 2qvx n ARG 195 Ca 0.00 0.13 0.12 0.00 -0.77 0.00 0.00 57.85 57.33 2qvx n ARG 195 Cb 0.00 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.42 2qvx n ARG 195 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2qvx n HIS 196 N -1.25 0.83 -2.02 -1.55 1.44 -1.26 -4.82 115.22 106.59 2qvx n HIS 196 Ca 0.07 0.31 -0.43 0.00 -2.01 0.00 0.00 57.72 55.67 2qvx n HIS 196 Cb 0.11 -1.00 -0.03 0.00 0.12 0.00 0.00 29.99 29.19 2qvx n HIS 196 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 2qvx s ASN 197 N -4.29 6.45 -0.21 4.39 0.01 -0.31 -4.80 114.94 116.18 2qvx s ASN 197 Ca 0.05 1.94 -0.02 0.00 -0.71 0.00 0.00 52.86 54.13 2qvx s ASN 197 Cb 0.10 -2.53 0.06 0.00 0.41 0.00 0.00 41.25 39.29 2qvx s ASN 197 CO 0.42 -1.15 0.02 -0.69 -1.51 0.00 0.00 177.10 174.19 2qvx s VAL 198 N 4.86 0.78 -0.22 1.60 1.01 -1.26 -0.60 120.40 126.56 2qvx s VAL 198 Ca 0.75 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 2qvx s VAL 198 Cb -0.30 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 34.83 2qvx s VAL 198 CO 0.30 -0.21 -0.04 -0.69 0.00 0.00 0.00 175.10 174.46 2qvx s VAL 199 N 1.74 3.33 -0.27 2.92 1.01 0.75 0.03 120.40 129.90 2qvx s VAL 199 Ca -0.02 -0.55 -0.24 0.00 0.00 0.00 0.00 61.98 61.17 2qvx s VAL 199 Cb -0.18 -2.53 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 2qvx s VAL 199 CO -0.08 0.40 0.82 -0.22 0.00 0.00 0.00 175.10 176.02 2qvx s LEU 200 N 1.47 4.07 -1.25 3.92 2.96 -1.06 -0.31 118.68 128.47 2qvx s LEU 200 Ca 0.05 0.88 -0.16 0.00 -0.22 0.00 0.00 54.13 54.69 2qvx s LEU 200 Cb -0.14 -3.16 0.13 0.00 0.50 0.00 0.00 46.19 43.51 2qvx s LEU 200 CO -0.03 -0.58 1.57 -0.83 -1.32 0.00 0.00 176.35 175.16 2qvx s GLY 201 N 1.48 2.07 0.07 7.98 0.00 0.90 -4.47 107.32 115.36 2qvx s GLY 201 Ca 0.34 -3.17 0.21 0.00 0.00 0.00 0.00 44.72 42.10 2qvx s GLY 201 CO 0.10 2.35 0.75 1.04 0.00 0.00 0.00 173.10 177.34 2qvx n LEU 202 N 6.85 0.52 -4.73 0.66 4.77 -1.26 -3.21 117.00 120.60 2qvx n LEU 202 Ca 0.42 0.21 -0.41 0.00 -0.03 0.00 0.00 56.01 56.20 2qvx n LEU 202 Cb 0.44 0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 2qvx n LEU 202 CO 0.69 -0.02 0.72 -0.04 -1.33 0.00 0.00 177.39 177.41 2qvx s MET 203 N -3.28 4.63 0.53 3.23 -1.94 -1.26 -4.97 119.30 116.24 2qvx s MET 203 Ca -0.04 1.56 -0.22 0.00 -1.71 0.00 0.00 55.69 55.28 2qvx s MET 203 Cb 0.11 -3.35 -0.05 0.00 2.01 0.00 0.00 34.83 33.54 2qvx s MET 203 CO 0.84 0.10 1.33 -1.25 -0.01 0.00 0.00 175.02 176.03 2qvx s PRO 204 N 0.08 3.26 0.22 2.03 0.04 -1.26 -4.68 135.00 134.69 2qvx s PRO 204 Ca 0.49 2.18 0.24 0.00 0.04 0.00 0.00 61.00 63.95 2qvx s PRO 204 Cb -0.25 -2.30 0.93 0.00 0.04 0.00 0.00 34.50 32.91 2qvx s PRO 204 CO 0.31 -1.08 1.71 1.28 0.04 0.00 0.00 177.00 179.27 2qvx n LEU 205 N -0.90 0.63 -0.19 -3.56 4.77 -1.26 -2.32 117.00 114.17 2qvx n LEU 205 Ca 0.10 0.63 0.15 0.00 -0.03 0.00 0.00 56.01 56.86 2qvx n LEU 205 Cb 0.45 -0.52 0.75 0.00 -2.33 0.00 0.00 43.42 41.78 2qvx n LEU 205 CO 0.52 -0.45 0.99 0.00 -1.33 0.00 0.00 177.39 177.13 2qvx n TYR 206 N -2.17 0.00 -4.08 -1.77 4.11 -1.26 -4.23 117.16 107.77 2qvx n TYR 206 Ca 0.03 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 57.58 2qvx n TYR 206 Cb 0.27 -0.02 -0.09 0.00 -0.00 0.00 0.00 39.34 39.49 2qvx n TYR 206 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.86 175.28 2qvx s HIS 207 N -2.06 3.28 0.47 -3.48 2.46 -0.98 -4.61 115.29 110.36 2qvx s HIS 207 Ca 0.42 0.15 0.25 0.00 0.47 0.00 0.00 55.06 56.36 2qvx s HIS 207 Cb 0.21 -1.99 1.29 0.00 -0.13 0.00 0.00 32.58 31.96 2qvx s HIS 207 CO 0.37 0.30 1.83 -0.39 -2.47 0.00 0.00 174.74 174.38 2qvx h VAL 208 N 4.60 0.54 -0.07 0.89 -1.51 -1.86 0.34 116.25 119.18 2qvx h VAL 208 Ca -0.42 -0.07 -0.06 0.00 -1.23 0.00 0.00 66.70 64.92 2qvx h VAL 208 Cb 1.18 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 30.65 2qvx h VAL 208 CO 0.65 0.04 -0.17 0.58 -1.23 0.00 0.00 177.57 177.44 2qvx h VAL 209 N 0.22 1.42 -0.39 7.19 2.07 -1.94 0.19 116.25 125.01 2qvx h VAL 209 Ca 0.52 -1.52 0.09 0.00 0.82 0.00 0.00 66.70 66.61 2qvx h VAL 209 Cb 1.64 2.25 -0.02 0.00 -1.52 0.00 0.00 31.29 33.64 2qvx h VAL 209 CO -0.14 0.43 0.27 1.23 0.02 0.00 0.00 177.57 179.38 2qvx h GLY 210 N -0.26 0.18 0.00 2.17 0.00 -0.73 0.15 103.07 104.59 2qvx h GLY 210 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2qvx h GLY 210 CO 0.04 0.04 -0.53 0.33 0.00 0.00 0.00 176.54 176.41 2qvx n PHE 211 N -4.45 0.64 -0.03 5.60 7.35 0.87 -2.35 117.46 125.09 2qvx n PHE 211 Ca 0.06 0.28 -0.12 0.00 -0.76 0.00 0.00 57.45 56.91 2qvx n PHE 211 Cb 0.38 -0.65 -0.10 0.00 0.35 0.00 0.00 39.48 39.46 2qvx n PHE 211 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2qvx h PHE 212 N -0.87 -0.04 0.00 -5.13 -1.00 -0.74 0.12 116.94 109.28 2qvx h PHE 212 Ca 0.00 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.77 2qvx h PHE 212 Cb 0.53 0.01 -0.00 0.00 3.61 0.00 0.00 35.95 40.10 2qvx h PHE 212 CO -0.23 0.63 -0.04 0.00 -1.61 0.00 0.00 178.31 177.06 2qvx h ALA 213 N -0.01 0.98 0.00 2.45 0.00 -1.42 -0.61 119.26 120.65 2qvx h ALA 213 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qvx h ALA 213 Cb 0.70 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2qvx h ALA 213 CO 0.01 0.06 -0.18 0.28 0.00 0.00 0.00 179.25 179.42 2qvx n VAL 214 N -3.12 0.70 0.44 0.00 0.31 -0.00 -4.55 118.33 112.11 2qvx n VAL 214 Ca 0.03 0.25 -0.17 0.00 -0.01 0.00 0.00 64.34 64.43 2qvx n VAL 214 Cb 0.48 -1.52 -0.08 0.00 -0.91 0.00 0.00 33.84 31.80 2qvx n VAL 214 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2qvx h LEU 215 N -0.18 -0.95 -0.39 7.52 5.85 -1.19 -1.76 115.31 124.20 2qvx h LEU 215 Ca 0.00 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.70 2qvx h LEU 215 Cb 0.18 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2qvx h LEU 215 CO 0.00 -0.68 0.04 0.58 -0.34 0.00 0.00 178.44 178.05 2qvx h VAL 216 N -1.13 1.25 -0.15 1.05 2.07 -0.78 -2.35 116.25 116.21 2qvx h VAL 216 Ca -0.11 -0.91 0.05 0.00 0.82 0.00 0.00 66.70 66.54 2qvx h VAL 216 Cb 0.86 1.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.65 2qvx h VAL 216 CO 0.19 0.31 -0.41 0.00 0.02 0.00 0.00 177.57 177.68 2qvx h ALA 217 N 0.91 -0.55 -0.56 1.67 0.00 -1.19 0.24 119.26 119.77 2qvx h ALA 217 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.14 2qvx h ALA 217 Cb 0.40 0.77 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 2qvx h ALA 217 CO 0.01 -0.90 -0.04 0.00 0.00 0.00 0.00 179.25 178.32 2qvx h ALA 218 N 0.18 0.50 -0.13 0.00 0.00 -0.89 -1.00 119.26 117.92 2qvx h ALA 218 Ca 0.08 0.19 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 2qvx h ALA 218 Cb 0.61 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.75 2qvx h ALA 218 CO -0.40 -0.41 -0.60 -0.07 0.00 0.00 0.00 179.25 177.77 2qvx h LEU 219 N 0.08 0.75 -1.70 0.00 3.38 -0.90 0.56 115.31 117.48 2qvx h LEU 219 Ca 0.29 -0.63 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 2qvx h LEU 219 Cb 0.45 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qvx h LEU 219 CO -0.51 1.26 -0.10 0.00 0.09 0.00 0.00 178.44 179.17 2qvx h ALA 220 N 0.51 1.10 -0.32 1.53 0.00 0.13 0.62 119.26 122.83 2qvx h ALA 220 Ca -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2qvx h ALA 220 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2qvx h ALA 220 CO 0.12 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.78 2qvx n LEU 221 N -3.36 3.49 -3.59 0.00 4.77 -0.44 -4.78 117.00 113.08 2qvx n LEU 221 Ca -0.01 -1.77 -0.25 0.00 -0.03 0.00 0.00 56.01 53.95 2qvx n LEU 221 Cb 0.29 -0.58 0.06 0.00 -2.33 0.00 0.00 43.42 40.87 2qvx n LEU 221 CO 0.29 0.46 0.19 0.47 -1.33 0.00 0.00 177.39 177.48 2qvx n ASP 222 N 0.37 -6.05 0.00 -1.43 10.43 0.21 -1.49 116.55 118.59 2qvx n ASP 222 Ca 0.15 -0.55 0.00 0.00 2.57 0.00 0.00 54.79 56.96 2qvx n ASP 222 Cb 0.74 -4.78 0.00 0.00 1.84 0.00 0.00 41.12 38.91 2qvx n ASP 222 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qvx n GLY 223 N -1.89 5.13 3.12 0.44 0.00 0.19 -3.84 105.19 108.33 2qvx n GLY 223 Ca 0.00 -2.01 -0.28 0.00 0.00 0.00 0.00 46.02 43.72 2qvx n GLY 223 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qvx s THR 224 N 1.54 1.61 -0.27 2.61 2.01 0.23 -4.32 115.64 119.06 2qvx s THR 224 Ca 0.00 -0.75 -0.17 0.00 0.31 0.00 0.00 61.69 61.08 2qvx s THR 224 Cb 0.00 -1.42 -0.03 0.00 0.01 0.00 0.00 72.50 71.06 2qvx s THR 224 CO 0.00 0.46 0.45 -0.47 -0.69 0.00 0.00 174.62 174.37 2qvx s TYR 225 N 0.52 3.25 -0.38 4.92 5.04 0.15 -0.18 117.35 130.68 2qvx s TYR 225 Ca -0.16 0.52 -0.20 0.00 -2.44 0.00 0.00 57.07 54.79 2qvx s TYR 225 Cb -0.17 -2.66 0.01 0.00 0.35 0.00 0.00 41.96 39.49 2qvx s TYR 225 CO 0.06 -0.27 0.61 0.08 -1.34 0.00 0.00 175.55 174.69 2qvx s VAL 226 N 2.21 4.90 0.06 3.14 1.01 0.57 -1.56 120.40 130.73 2qvx s VAL 226 Ca 0.18 0.37 -0.31 0.00 0.00 0.00 0.00 61.98 62.23 2qvx s VAL 226 Cb -0.16 -4.10 -0.07 0.00 0.00 0.00 0.00 36.38 32.05 2qvx s VAL 226 CO 0.10 -0.39 1.48 -0.69 0.00 0.00 0.00 175.10 175.59 2qvx s VAL 227 N 2.68 3.33 -0.33 2.92 1.01 0.14 -0.07 120.40 130.08 2qvx s VAL 227 Ca 0.23 0.84 0.03 0.00 0.00 0.00 0.00 61.98 63.08 2qvx s VAL 227 Cb -0.15 -3.54 0.09 0.00 0.00 0.00 0.00 36.38 32.79 2qvx s VAL 227 CO 0.16 0.02 0.02 -0.69 0.00 0.00 0.00 175.10 174.62 2qvx s VAL 228 N 1.98 2.32 0.34 2.92 1.01 -1.20 -4.72 120.40 123.06 2qvx s VAL 228 Ca 0.67 -2.18 0.07 0.00 0.00 0.00 0.00 61.98 60.54 2qvx s VAL 228 Cb -0.36 -2.63 0.12 0.00 0.00 0.00 0.00 36.38 33.51 2qvx s VAL 228 CO 0.29 -0.48 1.84 -0.33 0.00 0.00 0.00 175.10 176.42 2qvx h GLU 229 N 7.67 0.34 -2.42 2.72 5.08 -1.89 -3.44 114.58 122.64 2qvx h GLU 229 Ca -0.08 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 2qvx h GLU 229 Cb 1.03 -0.04 -0.26 0.00 0.50 0.00 0.00 28.75 29.98 2qvx h GLU 229 CO 0.52 0.51 -0.32 -2.00 -1.00 0.00 0.00 179.01 176.71 2qvx s GLU 230 N -4.65 0.37 0.12 2.33 2.12 -1.26 -4.66 118.70 113.06 2qvx s GLU 230 Ca -0.06 1.11 -0.30 0.00 0.36 0.00 0.00 54.97 56.07 2qvx s GLU 230 Cb 0.15 0.42 -0.06 0.00 0.26 0.00 0.00 34.13 34.89 2qvx s GLU 230 CO 0.75 -0.24 1.10 0.12 -0.54 0.00 0.00 175.26 176.46 2qvx s PHE 231 N 2.62 3.57 -0.18 5.30 5.36 -1.26 -5.03 117.98 128.36 2qvx s PHE 231 Ca -0.03 1.54 -0.06 0.00 -0.96 0.00 0.00 56.93 57.42 2qvx s PHE 231 Cb -0.12 -3.28 0.08 0.00 -0.34 0.00 0.00 43.02 39.36 2qvx s PHE 231 CO -0.14 -0.67 0.37 1.03 -1.46 0.00 0.00 175.22 174.36 2qvx s ARG 232 N 0.24 0.27 0.07 10.12 0.52 -1.26 -5.09 118.95 123.82 2qvx s ARG 232 Ca 0.52 0.96 -0.30 0.00 -0.52 0.00 0.00 55.73 56.39 2qvx s ARG 232 Cb -0.28 0.23 -0.15 0.00 0.52 0.00 0.00 34.95 35.27 2qvx s ARG 232 CO 0.32 -0.26 1.46 -1.00 0.02 0.00 0.00 175.30 175.84 2qvx h PRO 233 N 8.20 -0.84 -0.58 3.54 0.13 -1.96 0.15 132.00 140.64 2qvx h PRO 233 Ca -0.15 0.06 0.10 0.00 -0.87 0.00 0.00 66.00 65.14 2qvx h PRO 233 Cb 1.11 0.19 -0.08 0.00 0.13 0.00 0.00 31.00 32.35 2qvx h PRO 233 CO 0.12 -0.56 0.15 0.28 -0.23 0.00 0.00 178.00 177.76 2qvx h VAL 234 N -0.88 0.69 -0.91 1.56 2.07 -1.94 -1.90 116.25 114.94 2qvx h VAL 234 Ca -0.06 -0.10 0.11 0.00 0.82 0.00 0.00 66.70 67.47 2qvx h VAL 234 Cb 0.75 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.81 2qvx h VAL 234 CO -0.02 0.05 0.55 -0.78 0.02 0.00 0.00 177.57 177.39 2qvx h ASP 235 N 0.29 0.79 0.20 0.57 3.58 -1.83 -1.35 116.42 118.67 2qvx h ASP 235 Ca 0.30 0.05 -0.11 0.00 0.42 0.00 0.00 57.03 57.69 2qvx h ASP 235 Cb 0.41 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2qvx h ASP 235 CO -0.36 0.43 -0.39 0.00 -2.88 0.00 0.00 179.24 176.04 2qvx h ALA 236 N 1.50 1.11 -0.04 -0.78 0.00 -0.08 -2.19 119.26 118.78 2qvx h ALA 236 Ca 0.45 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2qvx h ALA 236 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2qvx h ALA 236 CO -0.26 0.58 -0.74 -0.07 0.00 0.00 0.00 179.25 178.76 2qvx h LEU 237 N 0.22 0.28 -1.02 0.00 3.38 -0.53 -2.54 115.31 115.10 2qvx h LEU 237 Ca 0.02 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 2qvx h LEU 237 Cb 0.80 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2qvx h LEU 237 CO 0.06 0.92 0.35 1.56 0.09 0.00 0.00 178.44 181.42 2qvx h GLN 238 N 0.15 1.05 -0.32 1.13 1.08 -0.89 -2.65 115.11 114.66 2qvx h GLN 238 Ca -0.03 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 2qvx h GLN 238 Cb 1.30 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 28.52 2qvx h GLN 238 CO 0.11 0.81 0.21 -0.07 -0.95 0.00 0.00 178.83 178.95 2qvx h LEU 239 N 1.04 0.37 -0.32 1.46 3.38 -1.10 0.37 115.31 120.51 2qvx h LEU 239 Ca 0.25 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.28 2qvx h LEU 239 Cb 0.11 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 2qvx h LEU 239 CO -0.03 0.27 -0.35 0.58 0.09 0.00 0.00 178.44 178.99 2qvx h VAL 240 N 0.44 0.21 0.66 1.22 2.07 -1.20 0.67 116.25 120.32 2qvx h VAL 240 Ca 0.12 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.61 2qvx h VAL 240 Cb -0.05 0.21 0.01 0.00 -1.52 0.00 0.00 31.29 29.94 2qvx h VAL 240 CO -0.03 0.00 -0.32 -0.61 0.02 0.00 0.00 177.57 176.64 2qvx h GLN 241 N -0.32 -0.85 -0.46 1.57 4.15 -1.21 -1.44 115.11 116.55 2qvx h GLN 241 Ca 0.14 0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.56 2qvx h GLN 241 Cb 0.56 0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.42 2qvx h GLN 241 CO -0.49 -0.56 0.03 0.37 -1.93 0.00 0.00 178.83 176.25 2qvx h GLN 242 N -0.93 0.74 0.00 1.69 4.15 -0.07 -3.16 115.11 117.53 2qvx h GLN 242 Ca -0.09 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.15 2qvx h GLN 242 Cb 0.69 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.29 2qvx h GLN 242 CO 0.15 0.73 -0.77 0.39 -1.93 0.00 0.00 178.83 177.39 2qvx n GLU 243 N -4.24 0.02 -3.36 1.69 -0.58 0.23 -4.97 120.64 109.42 2qvx n GLU 243 Ca 0.03 -0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.60 2qvx n GLU 243 Cb 0.27 -1.50 0.08 0.00 -0.57 0.00 0.00 31.44 29.71 2qvx n GLU 243 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2qvx n GLN 244 N -1.53 -4.63 -2.05 3.49 1.13 -0.65 -4.95 117.38 108.21 2qvx n GLN 244 Ca 0.05 0.85 -0.42 0.00 -1.94 0.00 0.00 57.00 55.53 2qvx n GLN 244 Cb 0.34 -5.82 -0.03 0.00 0.11 0.00 0.00 30.24 24.84 2qvx n GLN 244 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2qvx s VAL 245 N -3.38 2.91 -0.18 5.09 1.01 -0.64 -4.54 120.40 120.67 2qvx s VAL 245 Ca 0.20 0.67 0.15 0.00 0.00 0.00 0.00 61.98 63.01 2qvx s VAL 245 Cb -0.03 -3.43 -0.22 0.00 0.00 0.00 0.00 36.38 32.70 2qvx s VAL 245 CO 0.74 0.06 0.05 0.35 0.00 0.00 0.00 175.10 176.30 2qvx n THR 246 N 3.66 1.25 -3.99 3.92 -2.24 0.10 -2.48 114.28 114.50 2qvx n THR 246 Ca 0.12 -0.76 -0.09 0.00 -2.27 0.00 0.00 64.05 61.05 2qvx n THR 246 Cb 0.40 -0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 67.96 2qvx n THR 246 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qvx s SER 247 N -5.30 0.27 -0.10 3.42 1.04 -1.10 -0.37 113.70 111.57 2qvx s SER 247 Ca -0.10 -0.58 -0.04 0.00 0.48 0.00 0.00 55.95 55.70 2qvx s SER 247 Cb 0.06 0.13 0.05 0.00 0.10 0.00 0.00 66.02 66.36 2qvx s SER 247 CO 0.73 -0.38 0.22 -0.22 0.98 0.00 0.00 173.24 174.57 2qvx s LEU 248 N -1.78 0.37 -0.20 2.42 2.96 0.13 -2.58 118.68 119.99 2qvx s LEU 248 Ca -0.11 0.46 0.00 0.00 -0.22 0.00 0.00 54.13 54.27 2qvx s LEU 248 Cb -0.06 0.60 0.02 0.00 0.50 0.00 0.00 46.19 47.25 2qvx s LEU 248 CO -0.03 -0.18 -0.15 0.12 -1.32 0.00 0.00 176.35 174.80 2qvx s PHE 249 N 1.45 2.90 0.12 5.38 2.19 -1.26 -0.38 117.98 128.38 2qvx s PHE 249 Ca -0.07 -1.62 0.03 0.00 0.33 0.00 0.00 56.93 55.61 2qvx s PHE 249 Cb -0.11 -1.96 -0.04 0.00 -1.31 0.00 0.00 43.02 39.59 2qvx s PHE 249 CO -0.08 -0.77 -0.09 0.00 1.83 0.00 0.00 175.22 176.11 2qvx s ALA 250 N 1.30 1.22 0.64 11.12 0.00 -0.38 -4.14 121.76 131.52 2qvx s ALA 250 Ca 0.03 -1.39 -0.10 0.00 0.00 0.00 0.00 51.96 50.51 2qvx s ALA 250 Cb -0.14 0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.06 2qvx s ALA 250 CO -0.10 -0.14 1.01 0.95 0.00 0.00 0.00 175.76 177.49 2qvx s THR 251 N -3.29 3.95 0.45 0.00 -4.23 -1.26 -4.37 115.64 106.89 2qvx s THR 251 Ca 0.13 0.46 0.19 0.00 -1.18 0.00 0.00 61.69 61.29 2qvx s THR 251 Cb 0.03 -3.60 0.38 0.00 1.34 0.00 0.00 72.50 70.65 2qvx s THR 251 CO -0.02 -0.74 1.91 -0.65 -0.54 0.00 0.00 174.62 174.58 2qvx h PRO 252 N -0.40 0.30 -0.13 3.99 0.11 -1.97 -0.95 132.00 132.96 2qvx h PRO 252 Ca -0.45 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.51 2qvx h PRO 252 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2qvx h PRO 252 CO 0.63 0.20 -0.42 1.15 -0.21 0.00 0.00 178.00 179.34 2qvx h THR 253 N 0.31 1.36 -0.33 -1.15 2.02 -1.98 -2.28 112.91 110.85 2qvx h THR 253 Ca 0.39 -1.72 0.03 0.00 0.77 0.00 0.00 66.41 65.88 2qvx h THR 253 Cb 1.06 2.10 -0.03 0.00 -1.74 0.00 0.00 68.15 69.54 2qvx h THR 253 CO -0.11 0.52 0.13 0.45 0.37 0.00 0.00 175.52 176.88 2qvx h HIS 254 N 0.12 0.23 -0.57 3.16 3.86 -1.82 -2.18 115.15 117.96 2qvx h HIS 254 Ca -0.02 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2qvx h HIS 254 Cb 1.05 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.44 2qvx h HIS 254 CO 0.11 0.11 0.27 -0.07 0.86 0.00 0.00 177.93 179.21 2qvx h LEU 255 N 0.28 0.72 -0.51 2.43 3.38 -1.11 0.38 115.31 120.88 2qvx h LEU 255 Ca 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qvx h LEU 255 Cb 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2qvx h LEU 255 CO -0.14 0.61 0.34 -0.78 0.09 0.00 0.00 178.44 178.56 2qvx h ASP 256 N 0.80 0.59 -0.17 -0.43 3.58 -1.21 0.83 116.42 120.41 2qvx h ASP 256 Ca 0.20 -0.02 -0.04 0.00 0.42 0.00 0.00 57.03 57.59 2qvx h ASP 256 Cb 0.08 -0.15 -0.00 0.00 1.72 0.00 0.00 39.33 40.98 2qvx h ASP 256 CO -0.03 0.43 -0.06 0.00 -2.88 0.00 0.00 179.24 176.70 2qvx h ALA 257 N 1.19 0.23 -0.28 -0.78 0.00 -0.32 -2.25 119.26 117.05 2qvx h ALA 257 Ca 0.19 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2qvx h ALA 257 Cb -0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2qvx h ALA 257 CO -0.04 0.02 0.03 -0.07 0.00 0.00 0.00 179.25 179.19 2qvx h LEU 258 N 0.02 0.45 -0.80 0.00 3.38 -0.20 -0.97 115.31 117.21 2qvx h LEU 258 Ca 0.04 -0.28 0.07 0.00 0.09 0.00 0.00 57.88 57.80 2qvx h LEU 258 Cb 0.52 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 2qvx h LEU 258 CO 0.02 0.62 0.47 0.00 0.09 0.00 0.00 178.44 179.65 2qvx h ALA 259 N 0.85 1.10 -0.60 1.53 0.00 -0.84 0.22 119.26 121.53 2qvx h ALA 259 Ca 0.08 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2qvx h ALA 259 Cb 0.37 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2qvx h ALA 259 CO 0.01 0.17 0.01 0.00 0.00 0.00 0.00 179.25 179.44 2qvx h ALA 260 N 1.40 0.89 0.03 0.00 0.00 -1.00 0.18 119.26 120.77 2qvx h ALA 260 Ca 0.36 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qvx h ALA 260 Cb 0.22 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qvx h ALA 260 CO -0.19 0.66 -0.02 0.00 0.00 0.00 0.00 179.25 179.70 2qvx h ALA 261 N 1.05 -0.04 -1.00 0.00 0.00 -0.50 -2.44 119.26 116.33 2qvx h ALA 261 Ca 0.17 -0.18 0.23 0.00 0.00 0.00 0.00 54.91 55.14 2qvx h ALA 261 Cb 0.53 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.24 2qvx h ALA 261 CO 0.03 -0.35 0.63 0.00 0.00 0.00 0.00 179.25 179.56 2qvx h ALA 262 N 0.56 2.01 0.00 0.00 0.00 -0.36 0.47 119.26 121.95 2qvx h ALA 262 Ca -0.00 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2qvx h ALA 262 Cb 0.37 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2qvx h ALA 262 CO 0.01 -0.40 -0.45 0.00 0.00 0.00 0.00 179.25 178.40 2qvx h ALA 263 N 1.64 0.96 -0.28 0.00 0.00 -0.87 -1.68 119.26 119.03 2qvx h ALA 263 Ca 0.58 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2qvx h ALA 263 Cb 1.25 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2qvx h ALA 263 CO -0.33 0.57 0.00 0.72 0.00 0.00 0.00 179.25 180.21 2qvx n HIS 264 N -3.58 0.98 -0.05 0.00 8.25 0.85 -4.30 115.22 117.37 2qvx n HIS 264 Ca -0.00 -1.00 -0.05 0.00 -0.26 0.00 0.00 57.72 56.41 2qvx n HIS 264 Cb 0.56 -0.35 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 2qvx n HIS 264 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qvx n ALA 265 N -0.63 0.88 0.00 -1.41 0.00 0.13 -5.01 120.51 114.47 2qvx n ALA 265 Ca 0.24 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2qvx n ALA 265 Cb 0.92 0.04 0.00 0.00 0.00 0.00 0.00 19.45 20.41 2qvx n ALA 265 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qvx n GLY 266 N 1.73 -1.91 0.04 0.00 0.00 -0.64 -4.04 105.19 100.36 2qvx n GLY 266 Ca -0.08 -1.59 0.01 0.00 0.00 0.00 0.00 46.02 44.37 2qvx n GLY 266 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qvx n SER 267 N 0.58 0.07 -0.31 1.61 3.41 -1.26 -1.58 113.62 116.13 2qvx n SER 267 Ca 0.00 0.31 -0.02 0.00 -0.26 0.00 0.00 58.87 58.89 2qvx n SER 267 Cb 0.00 -0.28 0.01 0.00 -0.26 0.00 0.00 64.21 63.68 2qvx n SER 267 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2qvx n SER 268 N -1.43 -0.58 -4.71 4.04 2.88 -1.26 -4.27 113.62 108.29 2qvx n SER 268 Ca -0.00 1.38 -0.37 0.00 -1.33 0.00 0.00 58.87 58.55 2qvx n SER 268 Cb 0.30 -0.29 -0.07 0.00 -0.75 0.00 0.00 64.21 63.40 2qvx n SER 268 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2qvx s LEU 269 N -10.25 4.23 -0.55 2.46 1.43 -0.62 -5.06 118.68 110.34 2qvx s LEU 269 Ca -0.11 0.60 -0.22 0.00 -1.03 0.00 0.00 54.13 53.37 2qvx s LEU 269 Cb 0.15 -2.50 0.05 0.00 0.03 0.00 0.00 46.19 43.91 2qvx s LEU 269 CO 0.55 0.03 0.85 -1.59 0.23 0.00 0.00 176.35 176.41 2qvx s LYS 270 N 0.70 3.25 -0.27 1.70 0.00 -1.26 -4.89 119.74 118.97 2qvx s LYS 270 Ca 0.20 -0.50 0.12 0.00 0.00 0.00 0.00 55.97 55.79 2qvx s LYS 270 Cb -0.14 -4.08 0.68 0.00 0.00 0.00 0.00 37.83 34.28 2qvx s LYS 270 CO 0.07 -1.43 1.66 1.28 0.00 0.00 0.00 175.35 176.93 2qvx n LEU 271 N 7.08 5.24 0.17 2.77 4.77 -1.26 -3.99 117.00 131.78 2qvx n LEU 271 Ca -0.01 -3.19 0.02 0.00 -0.03 0.00 0.00 56.01 52.79 2qvx n LEU 271 Cb 0.47 -0.67 0.32 0.00 -2.33 0.00 0.00 43.42 41.21 2qvx n LEU 271 CO 0.61 0.80 0.69 0.44 -1.33 0.00 0.00 177.39 178.59 2qvx h ASP 272 N 2.44 0.01 0.44 -1.43 3.32 -1.94 -2.23 116.42 117.03 2qvx h ASP 272 Ca 0.15 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2qvx h ASP 272 Cb 1.97 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.52 2qvx h ASP 272 CO 0.53 0.42 0.00 -1.54 -1.72 0.00 0.00 179.24 176.93 2qvx n SER 273 N -4.05 0.00 -4.54 6.45 3.41 -1.26 -4.68 113.62 108.95 2qvx n SER 273 Ca -0.02 0.50 -0.42 0.00 -0.26 0.00 0.00 58.87 58.67 2qvx n SER 273 Cb 0.44 -0.50 -0.07 0.00 -0.26 0.00 0.00 64.21 63.81 2qvx n SER 273 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2qvx s LEU 274 N -3.01 4.44 -0.01 1.04 2.96 -0.84 -3.90 118.68 119.36 2qvx s LEU 274 Ca 0.06 -0.17 0.14 0.00 -0.22 0.00 0.00 54.13 53.95 2qvx s LEU 274 Cb 0.08 -2.63 -0.21 0.00 0.50 0.00 0.00 46.19 43.93 2qvx s LEU 274 CO 0.23 -0.60 0.40 0.54 -1.32 0.00 0.00 176.35 175.60 2qvx n ARG 275 N 5.93 0.98 -3.76 1.98 5.12 0.50 -3.03 116.66 124.38 2qvx n ARG 275 Ca -0.04 -0.10 -0.25 0.00 -1.93 0.00 0.00 57.85 55.53 2qvx n ARG 275 Cb 0.48 -1.30 -0.17 0.00 -1.16 0.00 0.00 32.46 30.32 2qvx n ARG 275 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 2qvx s HIS 276 N -2.82 0.90 -0.35 -1.55 3.76 -1.05 0.29 115.29 114.48 2qvx s HIS 276 Ca -0.02 -0.54 -0.03 0.00 -0.15 0.00 0.00 55.06 54.32 2qvx s HIS 276 Cb 0.10 -0.94 0.07 0.00 1.11 0.00 0.00 32.58 32.92 2qvx s HIS 276 CO 0.60 -0.48 0.10 0.08 -0.85 0.00 0.00 174.74 174.19 2qvx s VAL 277 N 1.90 3.23 0.15 -0.90 1.01 0.04 -0.70 120.40 125.13 2qvx s VAL 277 Ca 0.02 -1.62 0.06 0.00 0.00 0.00 0.00 61.98 60.44 2qvx s VAL 277 Cb -0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 2qvx s VAL 277 CO -0.07 -0.35 0.02 -0.89 0.00 0.00 0.00 175.10 173.81 2qvx s THR 278 N 1.23 3.93 -0.04 3.92 2.01 0.49 -1.21 115.64 125.97 2qvx s THR 278 Ca 0.01 -1.23 -0.30 0.00 0.31 0.00 0.00 61.69 60.48 2qvx s THR 278 Cb -0.21 -2.95 0.11 0.00 0.01 0.00 0.00 72.50 69.46 2qvx s THR 278 CO -0.02 -0.04 0.93 0.72 -0.69 0.00 0.00 174.62 175.53 2qvx s PHE 279 N -1.60 -0.33 -0.63 4.92 -0.12 -0.92 -1.25 117.98 118.05 2qvx s PHE 279 Ca 0.27 0.26 -0.16 0.00 -0.05 0.00 0.00 56.93 57.25 2qvx s PHE 279 Cb -0.10 0.52 0.15 0.00 -0.63 0.00 0.00 43.02 42.96 2qvx s PHE 279 CO 0.19 -0.49 0.61 0.00 -0.05 0.00 0.00 175.22 175.48 2qvx s ALA 280 N -2.78 3.72 -0.28 1.99 0.00 -1.26 -0.48 121.76 122.67 2qvx s ALA 280 Ca 0.04 -2.69 0.16 0.00 0.00 0.00 0.00 51.96 49.47 2qvx s ALA 280 Cb -0.01 -3.38 0.58 0.00 0.00 0.00 0.00 23.12 20.31 2qvx s ALA 280 CO -0.07 -2.15 1.48 0.41 0.00 0.00 0.00 175.76 175.43 2qvx n GLY 281 N 4.95 3.71 0.28 0.00 0.00 -1.25 -4.65 105.19 108.23 2qvx n GLY 281 Ca -0.06 -0.97 0.06 0.00 0.00 0.00 0.00 46.02 45.05 2qvx n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qvx h ALA 282 N 2.33 0.92 -0.13 4.61 0.00 -1.79 0.15 119.26 125.35 2qvx h ALA 282 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2qvx h ALA 282 Cb 1.51 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.62 2qvx h ALA 282 CO 0.26 -0.40 0.00 0.25 0.00 0.00 0.00 179.25 179.36 2qvx n THR 283 N -5.25 0.16 -2.28 0.00 -2.24 -1.26 -4.31 114.28 99.09 2qvx n THR 283 Ca 0.15 -0.30 -0.43 0.00 -2.27 0.00 0.00 64.05 61.20 2qvx n THR 283 Cb 0.49 0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 2qvx n THR 283 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2qvx s MET 284 N -1.84 4.23 0.80 -0.78 0.00 0.53 -4.99 119.30 117.25 2qvx s MET 284 Ca 0.33 1.85 -0.13 0.00 0.00 0.00 0.00 55.69 57.74 2qvx s MET 284 Cb 0.18 -3.80 0.08 0.00 0.00 0.00 0.00 34.83 31.28 2qvx s MET 284 CO 0.27 -0.72 1.18 -2.14 0.00 0.00 0.00 175.02 173.61 2qvx s PRO 285 N 3.50 1.71 0.26 4.11 0.02 -1.26 -4.55 135.00 138.78 2qvx s PRO 285 Ca 0.61 1.66 -0.04 0.00 0.02 0.00 0.00 61.00 63.26 2qvx s PRO 285 Cb -0.26 -1.79 0.32 0.00 0.02 0.00 0.00 34.50 32.78 2qvx s PRO 285 CO 0.20 -2.14 1.83 -0.44 -0.33 0.00 0.00 177.00 176.13 2qvx h ASP 286 N -0.93 0.93 -0.17 2.53 3.32 -1.97 -2.70 116.42 117.43 2qvx h ASP 286 Ca -0.46 -0.13 0.05 0.00 0.02 0.00 0.00 57.03 56.51 2qvx h ASP 286 Cb 1.28 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.54 2qvx h ASP 286 CO 0.47 0.83 -0.15 0.00 -1.72 0.00 0.00 179.24 178.66 2qvx h ALA 287 N 1.30 -0.04 -0.31 3.45 0.00 -2.00 -1.46 119.26 120.20 2qvx h ALA 287 Ca 0.23 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2qvx h ALA 287 Cb 0.20 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2qvx h ALA 287 CO -0.02 -0.59 0.12 0.28 0.00 0.00 0.00 179.25 179.04 2qvx h VAL 288 N -0.17 1.19 -0.47 0.00 2.07 -1.87 -2.40 116.25 114.59 2qvx h VAL 288 Ca 0.11 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.12 2qvx h VAL 288 Cb 0.33 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 2qvx h VAL 288 CO -0.27 0.20 0.14 0.25 0.02 0.00 0.00 177.57 177.91 2qvx h LEU 289 N 0.35 0.11 -0.50 2.57 5.85 -1.34 -1.11 115.31 121.24 2qvx h LEU 289 Ca 0.10 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.93 2qvx h LEU 289 Cb 0.19 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2qvx h LEU 289 CO -0.01 0.09 0.25 -0.08 -0.34 0.00 0.00 178.44 178.36 2qvx h GLU 290 N 0.30 0.47 -0.50 1.25 4.81 -0.92 -0.12 114.58 119.88 2qvx h GLU 290 Ca 0.23 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2qvx h GLU 290 Cb 0.26 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 2qvx h GLU 290 CO -0.26 0.31 0.27 1.79 -0.73 0.00 0.00 179.01 180.39 2qvx h THR 291 N 0.49 1.16 -0.41 0.32 1.35 -0.84 -0.82 112.91 114.16 2qvx h THR 291 Ca 0.22 -0.41 0.07 0.00 -0.55 0.00 0.00 66.41 65.74 2qvx h THR 291 Cb 0.14 0.49 -0.06 0.00 -1.73 0.00 0.00 68.15 66.99 2qvx h THR 291 CO -0.16 0.18 0.06 0.58 -0.25 0.00 0.00 175.52 175.93 2qvx h VAL 292 N 0.70 0.76 -0.45 6.82 2.07 0.17 0.27 116.25 126.59 2qvx h VAL 292 Ca 0.18 -0.06 -0.11 0.00 0.82 0.00 0.00 66.70 67.53 2qvx h VAL 292 Cb 0.03 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2qvx h VAL 292 CO -0.03 0.03 -0.14 0.45 0.02 0.00 0.00 177.57 177.90 2qvx h HIS 293 N 0.19 1.01 -0.53 1.57 -0.00 -0.81 -1.98 115.15 114.61 2qvx h HIS 293 Ca 0.20 -0.23 -0.01 0.00 -0.00 0.00 0.00 60.37 60.33 2qvx h HIS 293 Cb 0.26 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 27.40 2qvx h HIS 293 CO -0.22 1.00 0.29 1.96 -0.00 0.00 0.00 177.93 180.97 2qvx h GLN 294 N 0.73 0.73 0.00 2.45 1.08 -0.66 -3.39 115.11 116.05 2qvx h GLN 294 Ca 0.11 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 2qvx h GLN 294 Cb 0.70 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 2qvx h GLN 294 CO 0.05 0.56 -0.63 0.72 -0.95 0.00 0.00 178.83 178.58 2qvx n HIS 295 N -4.64 0.00 -4.24 2.96 8.25 0.90 -4.99 115.22 113.46 2qvx n HIS 295 Ca 0.03 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.19 2qvx n HIS 295 Cb 0.08 -0.05 -0.10 0.00 1.12 0.00 0.00 29.99 31.04 2qvx n HIS 295 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2qvx s LEU 296 N -2.68 2.97 0.00 2.41 1.43 -0.75 -4.64 118.68 117.42 2qvx s LEU 296 Ca 0.00 -0.44 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2qvx s LEU 296 Cb 0.03 -1.77 0.06 0.00 0.03 0.00 0.00 46.19 44.55 2qvx s LEU 296 CO 0.20 0.17 0.42 -0.81 0.23 0.00 0.00 176.35 176.56 2qvx n PRO 297 N 0.67 0.29 -0.16 1.29 -0.04 -1.26 -4.72 135.00 131.06 2qvx n PRO 297 Ca -0.14 -1.14 0.02 0.00 -0.04 0.00 0.00 63.50 62.21 2qvx n PRO 297 Cb 0.53 -0.29 -0.01 0.00 -0.04 0.00 0.00 33.50 33.69 2qvx n PRO 297 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qvx n GLY 298 N 1.76 -2.53 3.73 0.55 0.00 -1.17 -4.63 105.19 102.90 2qvx n GLY 298 Ca 0.07 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 2qvx n GLY 298 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qvx s GLU 299 N -2.89 4.40 -0.23 1.61 2.12 0.15 -4.67 118.70 119.17 2qvx s GLU 299 Ca 0.00 2.01 -0.10 0.00 0.36 0.00 0.00 54.97 57.24 2qvx s GLU 299 Cb 0.00 -3.22 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 2qvx s GLU 299 CO 0.00 -0.25 0.15 0.15 -0.54 0.00 0.00 175.26 174.77 2qvx s LYS 300 N 0.11 4.08 -0.08 4.30 -0.14 -1.26 -0.78 119.74 125.98 2qvx s LYS 300 Ca 0.57 -0.27 0.03 0.00 -1.36 0.00 0.00 55.97 54.95 2qvx s LYS 300 Cb -0.35 -3.50 0.00 0.00 -1.68 0.00 0.00 37.83 32.30 2qvx s LYS 300 CO 0.36 0.11 -0.20 0.08 -0.76 0.00 0.00 175.35 174.94 2qvx s VAL 301 N 0.92 1.70 -0.15 3.17 1.01 -0.35 -0.86 120.40 125.84 2qvx s VAL 301 Ca 0.07 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 2qvx s VAL 301 Cb -0.13 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2qvx s VAL 301 CO 0.03 0.48 0.13 0.21 0.00 0.00 0.00 175.10 175.96 2qvx s ASN 302 N 0.43 6.30 0.05 3.32 2.47 -0.15 -2.17 114.94 125.18 2qvx s ASN 302 Ca -0.16 0.38 0.04 0.00 0.42 0.00 0.00 52.86 53.53 2qvx s ASN 302 Cb -0.17 -2.07 -0.02 0.00 -1.45 0.00 0.00 41.25 37.54 2qvx s ASN 302 CO 0.07 0.33 -0.11 -0.83 -3.72 0.00 0.00 177.10 172.83 2qvx s GLY 303 N -0.52 0.68 -0.09 1.21 0.00 0.36 -0.80 107.32 108.17 2qvx s GLY 303 Ca 0.12 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 44.06 2qvx s GLY 303 CO 0.02 -0.85 -0.24 -0.47 0.00 0.00 0.00 173.10 171.56 2qvx s TYR 304 N -1.14 2.49 0.37 1.90 5.04 -0.15 -3.82 117.35 122.03 2qvx s TYR 304 Ca -0.04 -0.95 -0.11 0.00 -2.44 0.00 0.00 57.07 53.53 2qvx s TYR 304 Cb -0.09 -1.66 0.03 0.00 0.35 0.00 0.00 41.96 40.60 2qvx s TYR 304 CO 0.01 -0.37 0.66 0.20 -1.34 0.00 0.00 175.55 174.72 2qvx s GLY 305 N 0.23 0.80 0.03 8.97 0.00 -1.26 -0.29 107.32 115.80 2qvx s GLY 305 Ca -0.15 -1.04 -0.09 0.00 0.00 0.00 0.00 44.72 43.43 2qvx s GLY 305 CO 0.08 -0.57 0.19 -0.51 0.00 0.00 0.00 173.10 172.28 2qvx s THR 306 N -2.65 0.10 0.27 0.90 -4.23 0.59 -4.95 115.64 105.66 2qvx s THR 306 Ca 0.21 -0.83 -0.00 0.00 -1.18 0.00 0.00 61.69 59.89 2qvx s THR 306 Cb -0.03 -0.81 0.25 0.00 1.34 0.00 0.00 72.50 73.25 2qvx s THR 306 CO 0.15 -0.46 1.75 0.74 -0.54 0.00 0.00 174.62 176.26 2qvx h THR 307 N 3.62 0.68 -0.49 3.99 2.02 -1.98 0.38 112.91 121.14 2qvx h THR 307 Ca -0.32 -0.20 -0.13 0.00 0.77 0.00 0.00 66.41 66.54 2qvx h THR 307 Cb 1.19 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2qvx h THR 307 CO 0.46 0.11 -0.19 -0.33 0.37 0.00 0.00 175.52 175.94 2qvx h GLU 308 N 0.58 0.97 0.00 6.66 3.07 -1.95 -3.35 114.58 120.56 2qvx h GLU 308 Ca 0.48 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 2qvx h GLU 308 Cb 0.73 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 2qvx h GLU 308 CO -0.39 1.07 0.00 0.00 -1.40 0.00 0.00 179.01 178.28 2qvx n ALA 309 N -2.51 1.86 -0.76 3.43 0.00 -1.14 -0.38 120.51 121.02 2qvx n ALA 309 Ca 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.69 2qvx n ALA 309 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2qvx n ALA 309 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2qvx n MET 310 N -0.28 0.00 -3.30 0.00 1.56 0.13 -4.67 117.12 110.56 2qvx n MET 310 Ca 0.00 0.00 -0.38 0.00 -0.27 0.00 0.00 57.70 57.05 2qvx n MET 310 Cb 0.23 0.00 -0.06 0.00 2.15 0.00 0.00 33.22 35.54 2qvx n MET 310 CO 0.00 0.00 0.00 1.21 -0.73 0.00 0.00 175.97 176.45 2qvx s ASN 311 N -4.00 6.80 0.00 6.12 2.47 -1.26 -0.30 114.94 124.77 2qvx s ASN 311 Ca 0.00 0.95 0.00 0.00 0.42 0.00 0.00 52.86 54.23 2qvx s ASN 311 Cb 0.00 -2.31 0.00 0.00 -1.45 0.00 0.00 41.25 37.49 2qvx s ASN 311 CO 0.00 0.07 0.00 -1.20 -3.72 0.00 0.00 177.10 172.25 2qvx n SER 312 N 3.12 2.59 -3.72 -4.21 7.64 0.60 -4.76 113.62 114.87 2qvx n SER 312 Ca -0.08 -0.02 -0.11 0.00 1.01 0.00 0.00 58.87 59.68 2qvx n SER 312 Cb 0.52 0.55 -0.06 0.00 -1.01 0.00 0.00 64.21 64.20 2qvx n SER 312 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2qvx s LEU 313 N -1.61 0.74 0.29 -3.43 1.43 -0.99 -4.18 118.68 110.92 2qvx s LEU 313 Ca 0.00 -0.29 -0.20 0.00 -1.03 0.00 0.00 54.13 52.61 2qvx s LEU 313 Cb 0.00 1.52 0.02 0.00 0.03 0.00 0.00 46.19 47.76 2qvx s LEU 313 CO 0.00 -0.73 0.71 -0.72 0.23 0.00 0.00 176.35 175.85 2qvx s TYR 314 N -3.22 -0.11 -0.23 0.29 1.13 0.18 -0.98 117.35 114.40 2qvx s TYR 314 Ca -0.00 -0.37 -0.07 0.00 -1.41 0.00 0.00 57.07 55.22 2qvx s TYR 314 Cb 0.01 0.69 0.11 0.00 -1.10 0.00 0.00 41.96 41.67 2qvx s TYR 314 CO -0.08 -1.27 0.47 -1.64 -2.51 0.00 0.00 175.55 170.53 2qvx s MET 315 N -3.72 0.39 0.14 -3.49 -1.94 0.02 -1.33 119.30 109.38 2qvx s MET 315 Ca 0.12 1.08 -0.31 0.00 -1.71 0.00 0.00 55.69 54.87 2qvx s MET 315 Cb -0.06 0.38 -0.08 0.00 2.01 0.00 0.00 34.83 37.09 2qvx s MET 315 CO 0.08 -0.30 1.35 1.03 -0.01 0.00 0.00 175.02 177.17 2qvx s ARG 316 N 2.68 4.35 -1.19 2.03 0.52 -1.26 -0.97 118.95 125.11 2qvx s ARG 316 Ca -0.00 2.05 -0.05 0.00 -0.52 0.00 0.00 55.73 57.21 2qvx s ARG 316 Cb -0.12 -3.23 -0.02 0.00 0.52 0.00 0.00 34.95 32.09 2qvx s ARG 316 CO -0.15 -0.36 0.84 1.04 0.02 0.00 0.00 175.30 176.69 2qvx n GLN 317 N 3.46 -3.92 -1.79 3.54 1.13 -0.04 -4.88 117.38 114.87 2qvx n GLN 317 Ca 0.09 0.71 -0.41 0.00 -1.94 0.00 0.00 57.00 55.45 2qvx n GLN 317 Cb 0.43 -5.32 -0.01 0.00 0.11 0.00 0.00 30.24 25.45 2qvx n GLN 317 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2qvx s PRO 318 N -5.42 4.11 -0.07 -1.09 0.04 -1.26 -4.95 135.00 126.37 2qvx s PRO 318 Ca 0.20 2.58 -0.13 0.00 0.04 0.00 0.00 61.00 63.70 2qvx s PRO 318 Cb -0.04 -3.00 -0.30 0.00 0.04 0.00 0.00 34.50 31.20 2qvx s PRO 318 CO 0.78 -0.59 0.63 0.87 0.04 0.00 0.00 177.00 178.74 2qvx h LYS 319 N 4.00 0.35 -4.36 4.56 1.79 -1.93 -3.47 116.57 117.52 2qvx h LYS 319 Ca -0.49 -0.60 -0.21 0.00 -2.18 0.00 0.00 60.65 57.17 2qvx h LYS 319 Cb 1.23 0.22 -0.19 0.00 -1.58 0.00 0.00 32.23 31.91 2qvx h LYS 319 CO 0.72 1.29 -0.71 0.95 -1.08 0.00 0.00 179.45 180.62 2qvx s THR 320 N -2.55 0.39 -1.76 -0.16 -4.23 -1.26 -4.98 115.64 101.10 2qvx s THR 320 Ca -0.17 -1.29 0.31 0.00 -1.18 0.00 0.00 61.69 59.35 2qvx s THR 320 Cb 0.05 -0.83 0.71 0.00 1.34 0.00 0.00 72.50 73.77 2qvx s THR 320 CO 0.83 -0.60 2.12 0.61 -0.54 0.00 0.00 174.62 177.04 2qvx n GLY 321 N 1.03 -1.08 0.02 3.99 0.00 -1.26 -3.70 105.19 104.19 2qvx n GLY 321 Ca -0.20 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 45.74 2qvx n GLY 321 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qvx n THR 322 N -1.08 0.10 -3.53 2.61 -2.24 -1.26 -2.71 114.28 106.17 2qvx n THR 322 Ca 0.19 -0.41 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 2qvx n THR 322 Cb 0.18 0.11 -0.10 0.00 -2.10 0.00 0.00 70.33 68.42 2qvx n THR 322 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2qvx s GLU 323 N -3.39 2.85 0.32 -0.78 2.12 -1.24 -1.54 118.70 117.02 2qvx s GLU 323 Ca -0.04 -1.16 0.07 0.00 0.36 0.00 0.00 54.97 54.20 2qvx s GLU 323 Cb 0.14 -3.86 -0.03 0.00 0.26 0.00 0.00 34.13 30.64 2qvx s GLU 323 CO 0.88 -0.80 0.25 -1.33 -0.54 0.00 0.00 175.26 173.71 2qvx n MET 324 N 5.06 0.40 -3.71 4.30 2.81 0.71 -4.79 117.12 121.91 2qvx n MET 324 Ca -0.11 -3.10 -0.14 0.00 -1.81 0.00 0.00 57.70 52.54 2qvx n MET 324 Cb 0.45 2.44 -0.09 0.00 -0.71 0.00 0.00 33.22 35.31 2qvx n MET 324 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qvx s ALA 325 N -3.23 -1.09 0.41 3.04 0.00 -0.44 0.75 121.76 121.20 2qvx s ALA 325 Ca 0.35 1.03 -0.24 0.00 0.00 0.00 0.00 51.96 53.09 2qvx s ALA 325 Cb 0.02 -0.45 -0.08 0.00 0.00 0.00 0.00 23.12 22.60 2qvx s ALA 325 CO 0.25 -0.24 1.14 -1.25 0.00 0.00 0.00 175.76 175.66 2qvx s PRO 326 N -0.31 4.01 0.00 0.00 0.04 -1.26 0.47 135.00 137.95 2qvx s PRO 326 Ca -0.05 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2qvx s PRO 326 Cb -0.03 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.92 2qvx s PRO 326 CO 0.03 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.14 2qvx n GLY 327 N 0.54 5.74 3.75 0.56 0.00 -1.26 -4.85 105.19 109.67 2qvx n GLY 327 Ca 0.05 -1.96 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 2qvx n GLY 327 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2qvx s PHE 328 N 1.59 2.33 0.00 1.61 5.36 -1.26 -1.96 117.98 125.64 2qvx s PHE 328 Ca 0.00 1.35 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 2qvx s PHE 328 Cb 0.00 -3.83 0.00 0.00 -0.34 0.00 0.00 43.02 38.85 2qvx s PHE 328 CO 0.00 -2.91 0.00 1.19 -1.46 0.00 0.00 175.22 172.04 2qvx n PHE 329 N -0.82 0.00 -3.68 10.12 3.72 -1.26 -4.99 117.46 120.55 2qvx n PHE 329 Ca 0.09 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.19 2qvx n PHE 329 Cb 0.44 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.94 2qvx n PHE 329 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2qvx s SER 330 N -0.92 6.46 -0.02 4.37 0.01 -0.83 -4.91 113.70 117.86 2qvx s SER 330 Ca 0.00 0.53 0.00 0.00 1.31 0.00 0.00 55.95 57.79 2qvx s SER 330 Cb 0.00 -2.07 0.03 0.00 0.21 0.00 0.00 66.02 64.19 2qvx s SER 330 CO 0.00 0.03 0.02 -0.70 0.41 0.00 0.00 173.24 173.01 2qvx s GLU 331 N -2.82 -0.01 0.05 12.44 2.12 -1.26 -4.84 118.70 124.39 2qvx s GLU 331 Ca 0.40 0.16 -0.00 0.00 0.36 0.00 0.00 54.97 55.89 2qvx s GLU 331 Cb -0.12 -0.24 -0.04 0.00 0.26 0.00 0.00 34.13 34.00 2qvx s GLU 331 CO 0.26 -0.15 -0.04 0.14 -0.54 0.00 0.00 175.26 174.94 2qvx s VAL 332 N 0.95 0.28 0.03 3.70 -7.23 -1.26 0.08 120.40 116.94 2qvx s VAL 332 Ca -0.08 -1.66 -0.17 0.00 -1.81 0.00 0.00 61.98 58.26 2qvx s VAL 332 Cb -0.12 -1.31 0.03 0.00 0.56 0.00 0.00 36.38 35.55 2qvx s VAL 332 CO -0.03 -0.88 0.39 -0.13 -0.31 0.00 0.00 175.10 174.14 2qvx s ARG 333 N -3.44 0.86 -0.26 4.82 0.52 -0.24 -5.00 118.95 116.21 2qvx s ARG 333 Ca 0.03 -0.34 0.02 0.00 -0.52 0.00 0.00 55.73 54.93 2qvx s ARG 333 Cb 0.04 0.38 0.05 0.00 0.52 0.00 0.00 34.95 35.95 2qvx s ARG 333 CO -0.08 -0.28 -0.10 0.42 0.02 0.00 0.00 175.30 175.28 2qvx s ILE 334 N -2.25 2.34 0.47 1.52 1.01 -1.26 -0.79 121.20 122.23 2qvx s ILE 334 Ca -0.07 -1.49 0.07 0.00 0.00 0.00 0.00 60.65 59.17 2qvx s ILE 334 Cb -0.01 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 40.14 2qvx s ILE 334 CO -0.01 0.03 0.45 0.68 0.00 0.00 0.00 174.94 176.09 2qvx s VAL 335 N 1.16 2.38 0.32 2.92 -7.23 -0.79 -0.36 120.40 118.80 2qvx s VAL 335 Ca -0.06 -1.31 -0.29 0.00 -1.81 0.00 0.00 61.98 58.51 2qvx s VAL 335 Cb -0.19 -2.69 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 2qvx s VAL 335 CO -0.05 0.00 1.29 -0.60 -0.31 0.00 0.00 175.10 175.43 2qvx s ARG 336 N -4.25 4.38 0.12 4.82 3.52 -0.78 -0.99 118.95 125.77 2qvx s ARG 336 Ca 0.47 2.18 -0.31 0.00 -0.13 0.00 0.00 55.73 57.93 2qvx s ARG 336 Cb -0.04 -3.08 -0.11 0.00 -1.56 0.00 0.00 34.95 30.16 2qvx s ARG 336 CO 0.28 -0.16 1.83 -0.89 -0.81 0.00 0.00 175.30 175.55 2qvx n ILE 337 N 0.90 0.34 -0.95 4.11 5.41 -1.26 -1.93 119.36 125.98 2qvx n ILE 337 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.69 2qvx n ILE 337 Cb 0.42 -2.09 0.00 0.00 -0.71 0.00 0.00 39.64 37.26 2qvx n ILE 337 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2qvx n GLY 338 N 4.20 0.61 3.98 7.39 0.00 -1.26 -5.02 105.19 115.09 2qvx n GLY 338 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 2qvx n GLY 338 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qvx s GLY 339 N -2.00 2.02 0.69 -0.02 0.00 -0.81 -5.11 107.32 102.09 2qvx s GLY 339 Ca 0.00 -1.72 -0.14 0.00 0.00 0.00 0.00 44.72 42.86 2qvx s GLY 339 CO 0.00 -1.82 1.11 -0.32 0.00 0.00 0.00 173.10 172.07 2qvx s GLY 340 N -4.51 2.07 0.00 0.20 0.00 -1.26 -4.86 107.32 98.96 2qvx s GLY 340 Ca 0.49 0.51 0.12 0.00 0.00 0.00 0.00 44.72 45.83 2qvx s GLY 340 CO 0.31 0.87 1.16 3.33 0.00 0.00 0.00 173.10 178.77 2qvx n VAL 341 N -2.67 0.18 0.62 1.40 0.24 -1.26 -1.02 118.33 115.82 2qvx n VAL 341 Ca 0.10 0.04 0.07 0.00 -2.04 0.00 0.00 64.34 62.52 2qvx n VAL 341 Cb 0.52 -0.86 -0.08 0.00 -1.47 0.00 0.00 33.84 31.95 2qvx n VAL 341 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2qvx n ASP 342 N -1.07 0.75 -3.46 -1.34 8.00 -1.26 -4.71 116.55 113.46 2qvx n ASP 342 Ca 0.08 -0.77 -0.40 0.00 0.71 0.00 0.00 54.79 54.41 2qvx n ASP 342 Cb 0.05 1.06 -0.02 0.00 -0.02 0.00 0.00 41.12 42.19 2qvx n ASP 342 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qvx n GLU 343 N -1.39 3.54 -1.03 -1.24 1.02 -0.19 -4.99 120.64 116.35 2qvx n GLU 343 Ca 0.02 -2.46 -0.35 0.00 -0.02 0.00 0.00 57.16 54.36 2qvx n GLU 343 Cb 0.24 -2.93 0.08 0.00 -0.02 0.00 0.00 31.44 28.81 2qvx n GLU 343 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2qvx n ILE 344 N 3.85 0.74 -2.79 -3.67 2.08 -1.26 -1.87 119.36 116.44 2qvx n ILE 344 Ca 0.69 -0.33 -0.26 0.00 0.56 0.00 0.00 62.75 63.41 2qvx n ILE 344 Cb 0.28 -0.57 0.00 0.00 -0.75 0.00 0.00 39.64 38.61 2qvx n ILE 344 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 2qvx s VAL 345 N -2.13 4.68 0.61 1.39 -7.23 0.51 -4.62 120.40 113.63 2qvx s VAL 345 Ca 0.58 -0.03 -0.19 0.00 -1.81 0.00 0.00 61.98 60.53 2qvx s VAL 345 Cb -0.28 -3.77 -0.02 0.00 0.56 0.00 0.00 36.38 32.87 2qvx s VAL 345 CO 0.65 -0.69 1.31 0.00 -0.31 0.00 0.00 175.10 176.07 2qvx s ALA 346 N -2.67 2.51 -0.03 1.32 0.00 -1.26 -4.90 121.76 116.73 2qvx s ALA 346 Ca 0.47 1.24 -0.30 0.00 0.00 0.00 0.00 51.96 53.37 2qvx s ALA 346 Cb -0.10 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 2qvx s ALA 346 CO 0.42 -1.51 1.24 1.21 0.00 0.00 0.00 175.76 177.13 2qvx s ASN 347 N -1.28 7.01 0.00 0.00 3.84 -1.26 -2.25 114.94 121.00 2qvx s ASN 347 Ca 0.79 1.89 0.00 0.00 0.21 0.00 0.00 52.86 55.75 2qvx s ASN 347 Cb -0.38 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 37.76 2qvx s ASN 347 CO 0.41 -0.60 0.00 0.61 -2.79 0.00 0.00 177.10 174.73 2qvx n GLY 348 N 3.41 1.66 3.83 1.21 0.00 -1.26 -5.06 105.19 108.98 2qvx n GLY 348 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2qvx n GLY 348 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qvx s GLU 349 N -1.00 4.18 0.46 1.61 0.41 -0.95 -4.89 118.70 118.51 2qvx s GLU 349 Ca 0.00 0.84 -0.19 0.00 -0.41 0.00 0.00 54.97 55.21 2qvx s GLU 349 Cb 0.00 -2.64 -0.10 0.00 -1.78 0.00 0.00 34.13 29.61 2qvx s GLU 349 CO 0.00 0.26 0.96 -1.21 -0.49 0.00 0.00 175.26 174.78 2qvx s GLU 350 N -2.47 4.14 0.00 1.61 2.02 -1.26 -4.63 118.70 118.11 2qvx s GLU 350 Ca 0.49 1.06 0.00 0.00 0.02 0.00 0.00 54.97 56.55 2qvx s GLU 350 Cb -0.14 -2.17 0.00 0.00 0.10 0.00 0.00 34.13 31.92 2qvx s GLU 350 CO 0.19 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.78 2qvx n GLY 351 N -0.94 1.50 3.75 -1.39 0.00 -0.42 -4.75 105.19 102.95 2qvx n GLY 351 Ca 0.07 -0.94 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 2qvx n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qvx s GLU 352 N -1.94 4.21 -0.31 1.61 2.12 -0.17 -0.43 118.70 123.79 2qvx s GLU 352 Ca 0.00 0.37 -0.29 0.00 0.36 0.00 0.00 54.97 55.41 2qvx s GLU 352 Cb 0.00 -3.37 0.01 0.00 0.26 0.00 0.00 34.13 31.03 2qvx s GLU 352 CO 0.00 0.32 1.11 -1.17 -0.54 0.00 0.00 175.26 174.98 2qvx s LEU 353 N 0.12 3.93 0.04 2.70 2.96 -0.58 -1.88 118.68 125.96 2qvx s LEU 353 Ca 0.23 1.08 0.06 0.00 -0.22 0.00 0.00 54.13 55.29 2qvx s LEU 353 Cb -0.15 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 2qvx s LEU 353 CO 0.10 -0.90 -0.15 0.27 -1.32 0.00 0.00 176.35 174.34 2qvx s ILE 354 N 3.74 3.01 0.09 6.68 -4.36 0.03 -1.96 121.20 128.43 2qvx s ILE 354 Ca 0.47 -1.11 0.08 0.00 -0.26 0.00 0.00 60.65 59.83 2qvx s ILE 354 Cb -0.13 -2.29 -0.03 0.00 1.25 0.00 0.00 42.46 41.26 2qvx s ILE 354 CO 0.16 0.33 -0.22 0.68 0.24 0.00 0.00 174.94 176.14 2qvx s VAL 355 N -0.96 1.77 0.39 8.37 -7.23 -0.65 -1.08 120.40 121.00 2qvx s VAL 355 Ca 0.16 -1.49 -0.26 0.00 -1.81 0.00 0.00 61.98 58.58 2qvx s VAL 355 Cb -0.11 -1.59 -0.09 0.00 0.56 0.00 0.00 36.38 35.16 2qvx s VAL 355 CO 0.06 0.03 1.27 0.00 -0.31 0.00 0.00 175.10 176.15 2qvx s ALA 356 N -1.06 3.28 -1.23 1.32 0.00 0.11 0.07 121.76 124.25 2qvx s ALA 356 Ca 0.08 1.17 -0.05 0.00 0.00 0.00 0.00 51.96 53.16 2qvx s ALA 356 Cb -0.10 -3.46 0.19 0.00 0.00 0.00 0.00 23.12 19.75 2qvx s ALA 356 CO 0.04 -0.71 2.11 0.00 0.00 0.00 0.00 175.76 177.20 2qvx n ALA 357 N 0.26 6.30 -1.00 0.00 0.00 0.26 -4.66 120.51 121.68 2qvx n ALA 357 Ca 0.03 -4.30 0.00 0.00 0.00 0.00 0.00 53.44 49.17 2qvx n ALA 357 Cb 0.44 -2.63 0.00 0.00 0.00 0.00 0.00 19.45 17.25 2qvx n ALA 357 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qvx n SER 358 N 1.59 0.00 -0.17 0.00 7.64 -1.26 -4.76 113.62 116.66 2qvx n SER 358 Ca 0.53 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.43 2qvx n SER 358 Cb 0.27 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 63.78 2qvx n SER 358 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2qvx h ASP 359 N 0.00 0.74 1.05 6.43 5.19 -1.92 -2.72 116.42 125.20 2qvx h ASP 359 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 2qvx h ASP 359 Cb 0.00 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.33 2qvx h ASP 359 CO 0.00 0.53 0.00 -1.54 -3.12 0.00 0.00 179.24 175.11 2qvx n SER 360 N -4.45 0.41 -4.75 6.45 3.41 -1.26 -3.87 113.62 109.56 2qvx n SER 360 Ca 0.08 0.56 -0.35 0.00 -0.26 0.00 0.00 58.87 58.89 2qvx n SER 360 Cb 0.08 -0.66 0.04 0.00 -0.26 0.00 0.00 64.21 63.41 2qvx n SER 360 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qvx s ALA 361 N -3.09 2.48 0.78 7.33 0.00 -1.03 -4.59 121.76 123.65 2qvx s ALA 361 Ca 0.10 0.91 -0.12 0.00 0.00 0.00 0.00 51.96 52.86 2qvx s ALA 361 Cb 0.14 -3.43 0.06 0.00 0.00 0.00 0.00 23.12 19.89 2qvx s ALA 361 CO 0.49 -1.25 1.13 -0.59 0.00 0.00 0.00 175.76 175.54 2qvx s PHE 362 N -1.77 3.00 -1.04 0.00 -0.00 0.49 -4.47 117.98 114.20 2qvx s PHE 362 Ca 0.75 0.93 0.11 0.00 -0.00 0.00 0.00 56.93 58.72 2qvx s PHE 362 Cb -0.28 -3.27 0.27 0.00 -0.00 0.00 0.00 43.02 39.73 2qvx s PHE 362 CO 0.35 -1.65 1.19 1.33 -0.00 0.00 0.00 175.22 176.44 2qvx n VAL 363 N -3.29 0.81 0.00 -2.49 0.24 0.07 -4.97 118.33 108.70 2qvx n VAL 363 Ca 0.07 -0.91 0.00 0.00 -2.04 0.00 0.00 64.34 61.47 2qvx n VAL 363 Cb 0.59 0.64 0.00 0.00 -1.47 0.00 0.00 33.84 33.60 2qvx n VAL 363 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qvx n GLY 364 N 0.56 3.36 3.72 7.63 0.00 -1.26 -4.99 105.19 114.21 2qvx n GLY 364 Ca 0.11 -1.64 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 2qvx n GLY 364 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qvx s TYR 365 N -2.00 3.50 -0.27 1.61 2.02 -1.26 -0.94 117.35 120.01 2qvx s TYR 365 Ca 0.00 0.85 -0.35 0.00 -0.37 0.00 0.00 57.07 57.20 2qvx s TYR 365 Cb 0.00 -2.53 -0.11 0.00 -0.40 0.00 0.00 41.96 38.92 2qvx s TYR 365 CO 0.00 0.17 2.08 -0.11 -1.57 0.00 0.00 175.55 176.12 2qvx n LEU 366 N 3.69 2.58 -1.66 -1.29 7.94 0.12 -1.81 117.00 126.57 2qvx n LEU 366 Ca -0.08 0.57 -0.20 0.00 -1.11 0.00 0.00 56.01 55.19 2qvx n LEU 366 Cb 0.52 -1.31 -0.08 0.00 0.53 0.00 0.00 43.42 43.08 2qvx n LEU 366 CO 0.43 -0.55 -0.20 0.59 -1.11 0.00 0.00 177.39 176.54 2qvx n ASN 367 N 8.94 -5.50 -3.45 1.96 5.03 -1.26 -4.78 115.26 116.21 2qvx n ASN 367 Ca 0.34 0.44 -0.26 0.00 0.87 0.00 0.00 54.58 55.97 2qvx n ASN 367 Cb 0.26 -4.75 -0.09 0.00 -1.02 0.00 0.00 39.78 34.18 2qvx n ASN 367 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2qvx n GLN 368 N -2.48 1.61 0.16 3.52 6.02 -0.75 -4.96 117.38 120.50 2qvx n GLN 368 Ca -0.21 -4.06 0.13 0.00 -0.01 0.00 0.00 57.00 52.86 2qvx n GLN 368 Cb 0.67 -1.91 0.49 0.00 1.02 0.00 0.00 30.24 30.51 2qvx n GLN 368 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 2qvx h PRO 369 N 4.55 0.00 -0.04 -1.09 0.13 -1.92 -1.37 132.00 132.25 2qvx h PRO 369 Ca 0.16 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.22 2qvx h PRO 369 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2qvx h PRO 369 CO 0.65 0.00 -0.25 -0.56 -0.23 0.00 0.00 178.00 177.61 2qvx h GLN 370 N 0.00 0.25 -0.43 0.86 -0.00 -1.96 -2.19 115.11 111.64 2qvx h GLN 370 Ca 0.00 -0.21 0.03 0.00 -0.00 0.00 0.00 58.65 58.47 2qvx h GLN 370 Cb 0.53 0.05 -0.03 0.00 -0.00 0.00 0.00 27.48 28.02 2qvx h GLN 370 CO 0.00 0.87 0.23 0.00 -0.00 0.00 0.00 178.83 179.93 2qvx h ALA 371 N 0.38 0.54 -0.36 0.06 0.00 -1.87 -0.99 119.26 117.02 2qvx h ALA 371 Ca -0.02 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2qvx h ALA 371 Cb 0.93 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 2qvx h ALA 371 CO 0.05 -0.12 -0.10 1.15 0.00 0.00 0.00 179.25 180.24 2qvx h THR 372 N 0.46 0.63 0.00 0.00 2.02 -1.33 -1.32 112.91 113.37 2qvx h THR 372 Ca 0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2qvx h THR 372 Cb 0.06 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2qvx h THR 372 CO -0.11 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.78 2qvx n ALA 373 N -2.66 1.78 0.13 6.16 0.00 -0.71 -0.75 120.51 124.47 2qvx n ALA 373 Ca 0.01 0.05 -0.00 0.00 0.00 0.00 0.00 53.44 53.50 2qvx n ALA 373 Cb 0.21 -1.39 0.12 0.00 0.00 0.00 0.00 19.45 18.39 2qvx n ALA 373 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qvx h GLU 374 N 0.00 0.00 0.00 0.00 5.08 -0.06 -3.40 114.58 116.20 2qvx h GLU 374 Ca 0.00 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 2qvx h GLU 374 Cb 0.42 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 2qvx h GLU 374 CO 0.00 0.62 -2.08 1.63 -1.00 0.00 0.00 179.01 178.19 2qvx n LYS 375 N -3.53 0.92 -3.74 2.33 4.76 -0.26 -4.84 118.16 113.79 2qvx n LYS 375 Ca -0.00 0.06 -0.38 0.00 -2.87 0.00 0.00 58.31 55.12 2qvx n LYS 375 Cb 0.68 -1.39 -0.12 0.00 -1.84 0.00 0.00 35.03 32.36 2qvx n LYS 375 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2qvx s LEU 376 N -5.71 4.46 -0.06 -0.35 1.43 0.07 -0.27 118.68 118.25 2qvx s LEU 376 Ca -0.18 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 51.67 2qvx s LEU 376 Cb 0.06 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.43 2qvx s LEU 376 CO 0.52 -0.36 -0.04 -1.10 0.23 0.00 0.00 176.35 175.59 2qvx s GLN 377 N 1.38 0.90 -1.62 1.70 -0.21 -0.37 -4.69 119.66 116.76 2qvx s GLN 377 Ca -0.01 -0.09 -0.13 0.00 0.02 0.00 0.00 55.36 55.15 2qvx s GLN 377 Cb -0.20 -0.97 0.11 0.00 1.00 0.00 0.00 33.01 32.94 2qvx s GLN 377 CO 0.02 -0.14 0.66 -0.25 -2.12 0.00 0.00 175.29 173.46 2qvx n ASP 378 N 4.34 -2.36 0.00 5.90 9.92 -1.26 0.24 116.55 133.33 2qvx n ASP 378 Ca -0.20 -1.02 0.00 0.00 -0.53 0.00 0.00 54.79 53.05 2qvx n ASP 378 Cb 0.51 -2.81 0.00 0.00 -0.64 0.00 0.00 41.12 38.17 2qvx n ASP 378 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qvx n GLY 379 N -1.61 1.21 3.80 0.44 0.00 -1.26 -5.06 105.19 102.70 2qvx n GLY 379 Ca -0.05 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 2qvx n GLY 379 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qvx s TRP 380 N -2.31 3.10 -0.21 1.61 0.52 0.14 -0.58 118.94 121.22 2qvx s TRP 380 Ca 0.00 -0.07 -0.06 0.00 0.02 0.00 0.00 56.10 55.98 2qvx s TRP 380 Cb 0.00 -1.44 -0.03 0.00 -1.15 0.00 0.00 33.47 30.85 2qvx s TRP 380 CO 0.00 0.52 0.04 -0.47 0.02 0.00 0.00 176.95 177.06 2qvx s TYR 381 N -1.95 3.10 -0.36 -1.98 5.04 0.11 -1.24 117.35 120.08 2qvx s TYR 381 Ca 0.32 -0.29 -0.21 0.00 -2.44 0.00 0.00 57.07 54.45 2qvx s TYR 381 Cb -0.09 -2.12 0.00 0.00 0.35 0.00 0.00 41.96 40.11 2qvx s TYR 381 CO 0.24 -0.15 0.68 1.03 -1.34 0.00 0.00 175.55 176.00 2qvx s ARG 382 N 0.97 3.70 0.34 4.97 0.52 0.63 -1.64 118.95 128.44 2qvx s ARG 382 Ca 0.03 0.13 0.09 0.00 -0.52 0.00 0.00 55.73 55.46 2qvx s ARG 382 Cb -0.14 -3.81 0.61 0.00 0.52 0.00 0.00 34.95 32.13 2qvx s ARG 382 CO 0.02 -0.77 1.79 1.79 0.02 0.00 0.00 175.30 178.15 2qvx h THR 383 N 5.70 1.27 -0.05 0.02 1.35 -1.73 -3.47 112.91 116.00 2qvx h THR 383 Ca -0.26 -1.27 -0.02 0.00 -0.55 0.00 0.00 66.41 64.31 2qvx h THR 383 Cb 1.11 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 2qvx h THR 383 CO 0.86 0.38 -0.02 -1.20 -0.25 0.00 0.00 175.52 175.29 2qvx n SER 384 N -4.11 -4.08 -4.82 5.36 7.64 -1.26 -5.01 113.62 107.34 2qvx n SER 384 Ca -0.01 0.03 -0.34 0.00 1.01 0.00 0.00 58.87 59.56 2qvx n SER 384 Cb 0.41 -1.67 -0.06 0.00 -1.01 0.00 0.00 64.21 61.87 2qvx n SER 384 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2qvx s ASP 385 N -2.13 5.95 0.01 6.43 1.01 -1.26 0.35 116.67 127.03 2qvx s ASP 385 Ca 0.00 0.24 -0.21 0.00 0.71 0.00 0.00 52.55 53.30 2qvx s ASP 385 Cb 0.00 -1.78 -0.06 0.00 1.01 0.00 0.00 42.92 42.09 2qvx s ASP 385 CO 0.00 0.29 0.60 -0.69 0.21 0.00 0.00 175.17 175.58 2qvx s VAL 386 N -1.20 4.87 0.18 -1.27 1.01 0.16 -1.53 120.40 122.62 2qvx s VAL 386 Ca 0.23 1.26 0.01 0.00 0.00 0.00 0.00 61.98 63.48 2qvx s VAL 386 Cb -0.12 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2qvx s VAL 386 CO 0.14 0.44 0.05 0.00 0.00 0.00 0.00 175.10 175.73 2qvx s ALA 387 N -0.35 1.27 -0.00 5.51 0.00 0.43 0.33 121.76 128.95 2qvx s ALA 387 Ca 0.31 -1.63 -0.02 0.00 0.00 0.00 0.00 51.96 50.62 2qvx s ALA 387 Cb -0.19 0.85 -0.00 0.00 0.00 0.00 0.00 23.12 23.78 2qvx s ALA 387 CO 0.18 -0.43 0.04 0.54 0.00 0.00 0.00 175.76 176.09 2qvx s VAL 388 N -3.85 0.05 -0.17 0.00 0.11 -0.38 -1.30 120.40 114.85 2qvx s VAL 388 Ca 0.29 -0.45 -0.28 0.00 -2.93 0.00 0.00 61.98 58.61 2qvx s VAL 388 Cb 0.07 -0.21 -0.00 0.00 -1.53 0.00 0.00 36.38 34.70 2qvx s VAL 388 CO 0.06 -0.24 0.97 0.26 -3.33 0.00 0.00 175.10 172.82 2qvx s TRP 389 N -0.75 3.42 0.37 1.54 0.52 -1.26 -0.25 118.94 122.53 2qvx s TRP 389 Ca -0.08 1.45 -0.25 0.00 0.02 0.00 0.00 56.10 57.24 2qvx s TRP 389 Cb -0.05 -3.17 -0.09 0.00 -1.15 0.00 0.00 33.47 29.01 2qvx s TRP 389 CO -0.00 -0.33 1.03 0.95 0.02 0.00 0.00 176.95 178.63 2qvx s THR 390 N 2.50 3.79 0.51 2.01 -4.23 0.69 -4.10 115.64 116.81 2qvx s THR 390 Ca 0.44 1.43 0.37 0.00 -1.18 0.00 0.00 61.69 62.75 2qvx s THR 390 Cb -0.17 -3.76 0.58 0.00 1.34 0.00 0.00 72.50 70.49 2qvx s THR 390 CO 0.12 0.06 1.69 -0.65 -0.54 0.00 0.00 174.62 175.30 2qvx h PRO 391 N 2.74 0.06 0.00 3.99 0.11 -1.96 0.67 132.00 137.61 2qvx h PRO 391 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2qvx h PRO 391 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2qvx h PRO 391 CO 0.63 0.04 0.00 0.39 -0.21 0.00 0.00 178.00 178.85 2qvx n GLU 392 N -4.28 0.46 -0.99 1.05 4.71 -1.26 -4.84 120.64 115.49 2qvx n GLU 392 Ca 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.49 2qvx n GLU 392 Cb 1.48 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 2qvx n GLU 392 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qvx n GLY 393 N -0.08 0.49 3.73 0.62 0.00 0.23 -5.06 105.19 105.12 2qvx n GLY 393 Ca 0.11 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2qvx n GLY 393 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qvx s THR 394 N -2.00 3.61 -0.19 2.61 -4.23 -1.25 -4.92 115.64 109.28 2qvx s THR 394 Ca 0.00 -1.69 -0.14 0.00 -1.18 0.00 0.00 61.69 58.68 2qvx s THR 394 Cb 0.00 -3.05 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 2qvx s THR 394 CO 0.00 -0.31 0.31 -0.69 -0.54 0.00 0.00 174.62 173.39 2qvx s VAL 395 N -2.30 5.27 -0.40 2.29 1.01 0.23 -0.22 120.40 126.28 2qvx s VAL 395 Ca 0.34 0.56 -0.11 0.00 0.00 0.00 0.00 61.98 62.77 2qvx s VAL 395 Cb -0.06 -3.65 0.05 0.00 0.00 0.00 0.00 36.38 32.72 2qvx s VAL 395 CO 0.22 0.33 0.24 -0.60 0.00 0.00 0.00 175.10 175.30 2qvx s ARG 396 N 0.85 2.75 -0.08 2.72 3.52 0.65 -0.21 118.95 129.16 2qvx s ARG 396 Ca 0.16 -1.26 -0.30 0.00 -0.13 0.00 0.00 55.73 54.21 2qvx s ARG 396 Cb -0.14 -3.79 -0.05 0.00 -1.56 0.00 0.00 34.95 29.42 2qvx s ARG 396 CO 0.05 -0.83 1.62 0.42 -0.81 0.00 0.00 175.30 175.75 2qvx s ILE 397 N 1.51 3.65 -0.13 4.11 -1.09 -0.59 -1.26 121.20 127.39 2qvx s ILE 397 Ca 0.02 0.77 0.18 0.00 -2.23 0.00 0.00 60.65 59.40 2qvx s ILE 397 Cb -0.21 -3.52 -0.25 0.00 -1.58 0.00 0.00 42.46 36.90 2qvx s ILE 397 CO 0.05 -0.09 0.35 0.18 -1.23 0.00 0.00 174.94 174.20 2qvx n LEU 398 N 7.25 0.22 0.00 2.97 4.77 0.15 -4.89 117.00 127.47 2qvx n LEU 398 Ca 0.17 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 2qvx n LEU 398 Cb 0.43 0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 2qvx n LEU 398 CO 0.62 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2qvx n GLY 399 N 1.55 2.57 3.77 -0.72 0.00 -1.21 -4.67 105.19 106.48 2qvx n GLY 399 Ca -0.21 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 43.97 2qvx n GLY 399 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qvx s ARG 400 N -1.97 4.10 0.26 1.61 0.52 -1.26 0.39 118.95 122.60 2qvx s ARG 400 Ca 0.00 1.92 -0.04 0.00 -0.52 0.00 0.00 55.73 57.08 2qvx s ARG 400 Cb 0.00 -2.76 0.32 0.00 0.52 0.00 0.00 34.95 33.04 2qvx s ARG 400 CO 0.00 -0.30 1.93 0.28 0.02 0.00 0.00 175.30 177.23 2qvx h VAL 401 N 2.46 1.22 -0.11 3.52 2.07 -0.41 -2.38 116.25 122.61 2qvx h VAL 401 Ca -0.49 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 66.50 2qvx h VAL 401 Cb 1.23 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2qvx h VAL 401 CO 0.63 0.23 -0.36 -0.78 0.02 0.00 0.00 177.57 177.32 2qvx h ASP 402 N 1.29 0.24 0.75 0.57 3.58 -1.92 -2.67 116.42 118.25 2qvx h ASP 402 Ca 0.37 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.73 2qvx h ASP 402 Cb -0.09 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 40.90 2qvx h ASP 402 CO -0.09 0.58 -0.13 0.47 -2.88 0.00 0.00 179.24 177.18 2qvx n ASP 403 N -4.07 0.19 -4.73 2.28 8.00 -0.92 -4.94 116.55 112.35 2qvx n ASP 403 Ca -0.01 0.11 -0.42 0.00 0.71 0.00 0.00 54.79 55.17 2qvx n ASP 403 Cb 0.44 -0.24 -0.02 0.00 -0.02 0.00 0.00 41.12 41.27 2qvx n ASP 403 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2qvx n MET 404 N -1.40 2.76 -3.86 -1.24 1.56 -1.01 -4.56 117.12 109.37 2qvx n MET 404 Ca 0.08 0.99 -0.36 0.00 -0.27 0.00 0.00 57.70 58.14 2qvx n MET 404 Cb 0.32 -2.81 -0.11 0.00 2.15 0.00 0.00 33.22 32.77 2qvx n MET 404 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 2qvx s ILE 405 N 0.58 4.55 -0.42 1.12 1.01 0.11 -4.95 121.20 123.20 2qvx s ILE 405 Ca 0.69 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 61.13 2qvx s ILE 405 Cb -0.50 -3.10 0.06 0.00 0.01 0.00 0.00 42.46 38.93 2qvx s ILE 405 CO 0.40 0.38 0.28 -0.63 0.00 0.00 0.00 174.94 175.37 2qvx s ILE 406 N 1.15 4.62 -0.15 2.92 1.01 -1.26 0.39 121.20 129.88 2qvx s ILE 406 Ca 0.05 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.58 2qvx s ILE 406 Cb -0.14 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.63 2qvx s ILE 406 CO 0.03 -0.43 -0.14 -0.55 0.00 0.00 0.00 174.94 173.86 2qvx s SER 407 N 2.03 2.70 -0.99 3.58 0.15 -0.30 -3.10 113.70 117.76 2qvx s SER 407 Ca 0.03 -0.50 -0.14 0.00 0.70 0.00 0.00 55.95 56.04 2qvx s SER 407 Cb -0.22 -1.18 0.01 0.00 -1.71 0.00 0.00 66.02 62.92 2qvx s SER 407 CO 0.05 -0.06 0.66 0.61 1.20 0.00 0.00 173.24 175.70 2qvx n GLY 408 N 4.77 -1.11 2.51 9.45 0.00 -0.58 -2.40 105.19 117.83 2qvx n GLY 408 Ca -0.17 0.49 -0.15 0.00 0.00 0.00 0.00 46.02 46.19 2qvx n GLY 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qvx n GLY 409 N -1.81 -0.50 2.89 -0.02 0.00 -1.26 -4.98 105.19 99.51 2qvx n GLY 409 Ca -0.20 0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 2qvx n GLY 409 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qvx s GLU 410 N -5.11 0.36 -0.31 1.61 0.41 -1.01 -5.12 118.70 109.53 2qvx s GLU 410 Ca 0.03 -0.06 -0.27 0.00 -0.41 0.00 0.00 54.97 54.26 2qvx s GLU 410 Cb -0.02 -0.41 0.01 0.00 -1.78 0.00 0.00 34.13 31.93 2qvx s GLU 410 CO 0.04 -0.00 0.99 -0.80 -0.49 0.00 0.00 175.26 175.00 2qvx s ASN 411 N 0.37 6.86 -0.09 -0.19 0.01 -1.26 -1.15 114.94 119.50 2qvx s ASN 411 Ca -0.04 0.95 0.04 0.00 -0.71 0.00 0.00 52.86 53.11 2qvx s ASN 411 Cb -0.07 -2.50 -0.00 0.00 0.41 0.00 0.00 41.25 39.08 2qvx s ASN 411 CO -0.01 -0.79 -0.24 -0.63 -1.51 0.00 0.00 177.10 173.92 2qvx s ILE 412 N 3.43 2.02 -0.28 0.60 1.01 0.16 -4.99 121.20 123.15 2qvx s ILE 412 Ca 0.42 -1.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.01 2qvx s ILE 412 Cb -0.13 -1.73 0.02 0.00 0.01 0.00 0.00 42.46 40.62 2qvx s ILE 412 CO 0.14 0.55 0.03 -1.00 0.00 0.00 0.00 174.94 174.67 2qvx s HIS 413 N 0.22 3.13 0.30 3.97 3.76 -1.26 0.04 115.29 125.45 2qvx s HIS 413 Ca -0.15 -1.22 0.01 0.00 -0.15 0.00 0.00 55.06 53.55 2qvx s HIS 413 Cb -0.17 -2.19 0.53 0.00 1.11 0.00 0.00 32.58 31.86 2qvx s HIS 413 CO 0.07 -0.64 1.92 -1.35 -0.85 0.00 0.00 174.74 173.90 2qvx h PRO 414 N 8.15 1.00 -0.88 8.40 0.11 -1.85 -0.61 132.00 146.33 2qvx h PRO 414 Ca -0.31 -0.06 0.22 0.00 0.11 0.00 0.00 66.00 65.96 2qvx h PRO 414 Cb 1.12 -0.23 -0.13 0.00 0.11 0.00 0.00 31.00 31.87 2qvx h PRO 414 CO 0.59 0.66 0.34 0.66 -0.21 0.00 0.00 178.00 180.04 2qvx h SER 415 N 1.03 0.23 0.04 -2.05 4.64 -1.90 0.29 113.55 115.83 2qvx h SER 415 Ca 0.37 0.16 0.01 0.00 -0.47 0.00 0.00 61.79 61.87 2qvx h SER 415 Cb 0.15 0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 2qvx h SER 415 CO -0.13 -0.05 -0.11 -0.08 -0.87 0.00 0.00 176.83 175.59 2qvx h GLU 416 N 0.34 -0.21 -0.15 4.77 4.81 -1.37 -2.07 114.58 120.70 2qvx h GLU 416 Ca 0.55 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.67 2qvx h GLU 416 Cb 1.06 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 2qvx h GLU 416 CO -0.56 -0.14 -0.45 0.82 -0.73 0.00 0.00 179.01 177.96 2qvx h ILE 417 N -0.21 1.32 -0.50 2.32 2.04 -1.13 -2.31 117.51 119.04 2qvx h ILE 417 Ca 0.03 -1.63 -0.06 0.00 1.00 0.00 0.00 64.86 64.20 2qvx h ILE 417 Cb 0.24 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 2qvx h ILE 417 CO -0.08 0.49 0.06 -0.33 0.00 0.00 0.00 178.15 178.29 2qvx h GLU 418 N 0.29 0.79 -0.27 2.37 5.08 -0.38 -1.76 114.58 120.70 2qvx h GLU 418 Ca 0.02 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.11 2qvx h GLU 418 Cb 0.91 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2qvx h GLU 418 CO 0.08 0.76 -0.20 0.00 -1.00 0.00 0.00 179.01 178.64 2qvx h ARG 419 N 0.75 0.50 0.30 2.33 3.08 -0.80 -0.51 114.38 120.03 2qvx h ARG 419 Ca 0.16 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qvx h ARG 419 Cb 0.37 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2qvx h ARG 419 CO 0.01 0.68 -0.14 0.28 -1.07 0.00 0.00 179.97 179.73 2qvx h VAL 420 N 0.45 0.00 -1.00 2.04 2.07 -1.33 -3.28 116.25 115.20 2qvx h VAL 420 Ca 0.07 -0.59 0.29 0.00 0.82 0.00 0.00 66.70 67.29 2qvx h VAL 420 Cb 0.61 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 2qvx h VAL 420 CO 0.04 0.00 0.72 -0.07 0.02 0.00 0.00 177.57 178.28 2qvx h LEU 421 N -0.99 0.00 -0.54 2.57 3.38 -1.39 0.16 115.31 118.50 2qvx h LEU 421 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2qvx h LEU 421 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2qvx h LEU 421 CO 0.07 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.21 2qvx n GLY 422 N -1.73 -1.24 0.46 0.83 0.00 -0.20 -2.07 105.19 101.24 2qvx n GLY 422 Ca 0.21 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.40 2qvx n GLY 422 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qvx n THR 423 N -2.09 0.00 -2.04 2.61 -2.24 0.54 -4.84 114.28 106.23 2qvx n THR 423 Ca 0.03 -0.24 -0.41 0.00 -2.27 0.00 0.00 64.05 61.15 2qvx n THR 423 Cb 0.23 0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 69.35 2qvx n THR 423 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qvx s ALA 424 N -2.38 3.58 0.43 6.98 0.00 -0.88 -4.92 121.76 124.56 2qvx s ALA 424 Ca 0.24 1.32 -0.25 0.00 0.00 0.00 0.00 51.96 53.26 2qvx s ALA 424 Cb 0.19 -3.53 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 2qvx s ALA 424 CO 0.50 -0.73 1.26 -1.25 0.00 0.00 0.00 175.76 175.55 2qvx s PRO 425 N -0.90 3.87 0.00 0.00 0.04 -1.26 -2.41 135.00 134.33 2qvx s PRO 425 Ca 0.56 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.64 2qvx s PRO 425 Cb -0.41 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.49 2qvx s PRO 425 CO 0.47 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 177.39 2qvx n GLY 426 N 0.64 0.71 3.50 0.56 0.00 -1.26 -5.05 105.19 104.28 2qvx n GLY 426 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2qvx n GLY 426 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qvx s VAL 427 N -2.54 4.61 -0.12 1.61 1.01 -1.01 -1.81 120.40 122.14 2qvx s VAL 427 Ca 0.00 -0.07 0.17 0.00 0.00 0.00 0.00 61.98 62.08 2qvx s VAL 427 Cb 0.00 -3.16 -0.15 0.00 0.00 0.00 0.00 36.38 33.07 2qvx s VAL 427 CO 0.00 0.33 0.78 1.07 0.00 0.00 0.00 175.10 177.27 2qvx n THR 428 N 4.84 1.17 -3.64 3.92 5.66 0.11 -4.77 114.28 121.57 2qvx n THR 428 Ca -0.16 -0.69 -0.10 0.00 -3.05 0.00 0.00 64.05 60.05 2qvx n THR 428 Cb 0.52 -0.71 -0.07 0.00 -1.55 0.00 0.00 70.33 68.52 2qvx n THR 428 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2qvx s GLU 429 N -2.92 0.63 -0.04 1.09 2.12 -1.15 -5.01 118.70 113.41 2qvx s GLU 429 Ca -0.03 0.82 -0.04 0.00 0.36 0.00 0.00 54.97 56.07 2qvx s GLU 429 Cb 0.09 0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.75 2qvx s GLU 429 CO 0.82 -0.09 0.12 0.54 -0.54 0.00 0.00 175.26 176.11 2qvx s VAL 430 N 0.60 0.01 -0.03 3.70 0.11 -1.26 -0.67 120.40 122.86 2qvx s VAL 430 Ca -0.01 -0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.01 2qvx s VAL 430 Cb -0.05 -0.20 0.00 0.00 -1.53 0.00 0.00 36.38 34.60 2qvx s VAL 430 CO -0.07 -0.03 -0.10 -0.69 -3.33 0.00 0.00 175.10 170.89 2qvx s VAL 431 N -0.04 0.82 -0.16 2.04 1.01 -0.64 -4.93 120.40 118.49 2qvx s VAL 431 Ca -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 2qvx s VAL 431 Cb -0.01 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 2qvx s VAL 431 CO 0.00 0.25 -0.04 -0.69 0.00 0.00 0.00 175.10 174.62 2qvx s VAL 432 N 0.16 3.75 0.37 2.92 1.01 -1.26 -0.77 120.40 126.58 2qvx s VAL 432 Ca -0.03 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 61.59 2qvx s VAL 432 Cb -0.08 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 2qvx s VAL 432 CO 0.00 0.48 0.08 0.27 0.00 0.00 0.00 175.10 175.93 2qvx s ILE 433 N 0.55 1.00 -0.25 2.22 -4.36 -0.28 -4.73 121.20 115.37 2qvx s ILE 433 Ca -0.03 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.38 2qvx s ILE 433 Cb -0.14 -2.58 0.05 0.00 1.25 0.00 0.00 42.46 41.03 2qvx s ILE 433 CO 0.03 0.00 -0.12 -0.83 0.24 0.00 0.00 174.94 174.25 2qvx s GLY 434 N -3.57 1.60 0.50 6.27 0.00 -1.26 -1.32 107.32 109.53 2qvx s GLY 434 Ca 0.29 -1.66 -0.19 0.00 0.00 0.00 0.00 44.72 43.16 2qvx s GLY 434 CO 0.14 0.57 1.01 1.08 0.00 0.00 0.00 173.10 175.90 2qvx s LEU 435 N 1.14 3.76 -0.54 0.66 1.43 -0.22 -4.71 118.68 120.20 2qvx s LEU 435 Ca -0.07 1.78 -0.26 0.00 -1.03 0.00 0.00 54.13 54.56 2qvx s LEU 435 Cb -0.19 -4.54 0.03 0.00 0.03 0.00 0.00 46.19 41.53 2qvx s LEU 435 CO -0.06 -0.71 1.04 0.00 0.23 0.00 0.00 176.35 176.84 2qvx s ALA 436 N -2.24 3.12 0.00 4.21 0.00 -1.26 -1.87 121.76 123.72 2qvx s ALA 436 Ca 0.64 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2qvx s ALA 436 Cb -0.13 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.16 2qvx s ALA 436 CO 0.23 -2.41 0.00 -0.25 0.00 0.00 0.00 175.76 173.33 2qvx n ASP 437 N 7.77 0.00 -2.15 0.00 10.43 -1.26 -5.03 116.55 126.31 2qvx n ASP 437 Ca 0.06 0.00 -0.07 0.00 2.57 0.00 0.00 54.79 57.35 2qvx n ASP 437 Cb 0.48 0.00 0.01 0.00 1.84 0.00 0.00 41.12 43.45 2qvx n ASP 437 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2qvx n GLN 438 N 0.00 0.63 0.00 -1.24 0.00 -1.26 -3.29 117.38 112.22 2qvx n GLN 438 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 57.00 55.51 2qvx n GLN 438 Cb 0.00 1.72 0.00 0.00 0.00 0.00 0.00 30.24 31.96 2qvx n GLN 438 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2qvx n ARG 439 N -0.34 0.00 0.00 2.61 0.63 -1.26 -4.36 116.66 113.94 2qvx n ARG 439 Ca -0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 2qvx n ARG 439 Cb 0.37 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.28 2qvx n ARG 439 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2qvx n TRP 440 N 0.00 0.00 0.00 -0.14 7.02 -1.26 -4.87 117.44 118.18 2qvx n TRP 440 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2qvx n TRP 440 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2qvx n TRP 440 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2qvx n GLY 441 N -0.92 2.22 3.24 6.99 0.00 -1.21 -1.53 105.19 113.98 2qvx n GLY 441 Ca 0.00 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2qvx n GLY 441 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qvx s GLN 442 N 0.00 0.46 -0.20 1.61 -0.21 -1.18 -4.34 119.66 115.80 2qvx s GLN 442 Ca 0.00 0.35 -0.05 0.00 0.02 0.00 0.00 55.36 55.69 2qvx s GLN 442 Cb 0.00 0.22 -0.02 0.00 1.00 0.00 0.00 33.01 34.21 2qvx s GLN 442 CO 0.00 -0.07 -0.01 0.45 -2.12 0.00 0.00 175.29 173.53 2qvx s SER 443 N -0.11 4.67 -0.08 5.90 0.15 -0.78 -4.40 113.70 119.06 2qvx s SER 443 Ca -0.03 -0.25 -0.30 0.00 0.70 0.00 0.00 55.95 56.08 2qvx s SER 443 Cb -0.03 -1.80 -0.04 0.00 -1.71 0.00 0.00 66.02 62.44 2qvx s SER 443 CO 0.01 0.05 1.51 -0.69 1.20 0.00 0.00 173.24 175.32 2qvx s VAL 444 N 1.09 3.78 -0.04 4.45 1.01 -1.26 -1.06 120.40 128.37 2qvx s VAL 444 Ca 0.02 0.98 0.04 0.00 0.00 0.00 0.00 61.98 63.02 2qvx s VAL 444 Cb -0.14 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2qvx s VAL 444 CO 0.01 -0.07 -0.14 -0.89 0.00 0.00 0.00 175.10 174.00 2qvx s THR 445 N 3.65 1.21 -0.17 3.92 2.01 -0.44 0.14 115.64 125.97 2qvx s THR 445 Ca 0.67 -0.59 -0.07 0.00 0.31 0.00 0.00 61.69 62.00 2qvx s THR 445 Cb -0.30 -1.06 -0.04 0.00 0.01 0.00 0.00 72.50 71.11 2qvx s THR 445 CO 0.25 0.36 0.08 0.00 -0.69 0.00 0.00 174.62 174.62 2qvx s ALA 446 N 0.14 3.50 -0.30 7.40 0.00 -0.05 -1.12 121.76 131.33 2qvx s ALA 446 Ca -0.04 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.13 2qvx s ALA 446 Cb -0.11 -1.94 0.02 0.00 0.00 0.00 0.00 23.12 21.09 2qvx s ALA 446 CO 0.02 0.25 0.06 0.00 0.00 0.00 0.00 175.76 176.09 2qvx s VAL 448 N 1.45 1.68 -0.24 0.00 0.11 0.57 -1.62 120.40 122.34 2qvx s VAL 448 Ca 0.01 -1.04 -0.07 0.00 -2.93 0.00 0.00 61.98 57.95 2qvx s VAL 448 Cb -0.18 -1.42 -0.03 0.00 -1.53 0.00 0.00 36.38 33.22 2qvx s VAL 448 CO 0.01 0.35 0.07 -0.69 -3.33 0.00 0.00 175.10 171.51 2qvx s VAL 449 N -0.63 4.34 0.53 2.04 1.01 0.15 -0.43 120.40 127.41 2qvx s VAL 449 Ca 0.08 -0.17 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 2qvx s VAL 449 Cb -0.08 -3.02 -0.06 0.00 0.00 0.00 0.00 36.38 33.21 2qvx s VAL 449 CO 0.00 0.35 1.11 -2.16 0.00 0.00 0.00 175.10 174.41 2qvx s PRO 450 N 1.47 3.45 0.55 2.72 0.04 -1.26 0.05 135.00 142.02 2qvx s PRO 450 Ca 0.06 1.57 -0.21 0.00 0.04 0.00 0.00 61.00 62.46 2qvx s PRO 450 Cb -0.15 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 2qvx s PRO 450 CO 0.03 -0.77 1.25 0.54 0.04 0.00 0.00 177.00 178.10 2qvx n ARG 451 N -1.21 1.49 -1.58 4.56 1.74 -0.75 -4.48 116.66 116.42 2qvx n ARG 451 Ca 0.11 0.55 -0.63 0.00 -0.77 0.00 0.00 57.85 57.11 2qvx n ARG 451 Cb 0.51 -2.45 -0.10 0.00 -1.02 0.00 0.00 32.46 29.40 2qvx n ARG 451 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2qvx n LEU 452 N -0.85 1.27 0.00 0.55 7.94 -1.26 0.01 117.00 124.66 2qvx n LEU 452 Ca 0.11 0.98 0.00 0.00 -1.11 0.00 0.00 56.01 56.00 2qvx n LEU 452 Cb 0.45 -0.94 0.00 0.00 0.53 0.00 0.00 43.42 43.46 2qvx n LEU 452 CO 0.53 -0.76 0.00 0.61 -1.11 0.00 0.00 177.39 176.66 2qvx n GLY 453 N 5.20 2.32 3.86 -3.96 0.00 -1.26 -5.04 105.19 106.32 2qvx n GLY 453 Ca 0.38 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.09 2qvx n GLY 453 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qvx s GLU 454 N -0.39 3.80 0.02 1.61 0.41 0.10 -5.09 118.70 119.15 2qvx s GLU 454 Ca 0.00 0.69 -0.03 0.00 -0.41 0.00 0.00 54.97 55.23 2qvx s GLU 454 Cb 0.00 -2.23 -0.04 0.00 -1.78 0.00 0.00 34.13 30.08 2qvx s GLU 454 CO 0.00 -0.23 0.21 0.99 -0.49 0.00 0.00 175.26 175.73 2qvx s THR 455 N -2.64 5.40 0.24 3.63 2.01 -1.26 -4.70 115.64 118.32 2qvx s THR 455 Ca 0.55 -0.17 0.12 0.00 0.31 0.00 0.00 61.69 62.50 2qvx s THR 455 Cb -0.10 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 2qvx s THR 455 CO 0.36 0.27 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.60 2qvx s LEU 456 N -2.08 2.56 0.09 4.42 1.43 -1.26 -5.01 118.68 118.82 2qvx s LEU 456 Ca 0.30 -0.94 0.05 0.00 -1.03 0.00 0.00 54.13 52.50 2qvx s LEU 456 Cb -0.13 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 2qvx s LEU 456 CO 0.21 0.07 -0.13 -0.94 0.23 0.00 0.00 176.35 175.79 2qvx s SER 457 N -3.16 1.63 0.18 2.29 1.04 -1.26 -5.04 113.70 109.38 2qvx s SER 457 Ca 0.26 -0.71 -0.12 0.00 0.48 0.00 0.00 55.95 55.87 2qvx s SER 457 Cb -0.06 -0.03 0.08 0.00 0.10 0.00 0.00 66.02 66.11 2qvx s SER 457 CO 0.13 -0.15 1.75 0.00 0.98 0.00 0.00 173.24 175.95 2qvx h ALA 458 N 3.94 0.80 -0.47 5.32 0.00 -2.00 -1.84 119.26 125.02 2qvx h ALA 458 Ca -0.39 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.45 2qvx h ALA 458 Cb 1.19 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 2qvx h ALA 458 CO 0.46 0.39 -0.03 -0.44 0.00 0.00 0.00 179.25 179.63 2qvx h ASP 459 N 0.85 -0.26 -0.17 0.00 3.32 -1.99 -0.61 116.42 117.56 2qvx h ASP 459 Ca 0.21 0.12 -0.17 0.00 0.02 0.00 0.00 57.03 57.21 2qvx h ASP 459 Cb 0.17 0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 2qvx h ASP 459 CO -0.02 -0.09 -0.50 0.00 -1.72 0.00 0.00 179.24 176.91 2qvx h ALA 460 N 1.43 0.61 -0.60 3.45 0.00 -1.89 -1.10 119.26 121.17 2qvx h ALA 460 Ca 0.23 -0.49 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 2qvx h ALA 460 Cb 0.35 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2qvx h ALA 460 CO -0.41 0.68 0.04 -0.07 0.00 0.00 0.00 179.25 179.49 2qvx h LEU 461 N 0.58 0.99 0.12 0.00 3.38 -1.03 -0.33 115.31 119.03 2qvx h LEU 461 Ca 0.02 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.72 2qvx h LEU 461 Cb 1.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 2qvx h LEU 461 CO 0.11 1.04 -0.25 -0.78 0.09 0.00 0.00 178.44 178.64 2qvx h ASP 462 N 0.92 -0.71 -0.80 -0.43 3.58 -0.92 0.16 116.42 118.23 2qvx h ASP 462 Ca 0.17 0.08 0.12 0.00 0.42 0.00 0.00 57.03 57.83 2qvx h ASP 462 Cb 0.50 0.27 -0.08 0.00 1.72 0.00 0.00 39.33 41.74 2qvx h ASP 462 CO 0.02 -0.34 0.41 0.74 -2.88 0.00 0.00 179.24 177.19 2qvx h THR 463 N -0.45 0.78 0.37 2.25 2.02 -0.99 0.16 112.91 117.04 2qvx h THR 463 Ca 0.03 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2qvx h THR 463 Cb 0.48 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2qvx h THR 463 CO -0.14 0.12 -0.27 0.15 0.37 0.00 0.00 175.52 175.74 2qvx h PHE 464 N 0.63 -0.71 -0.95 3.16 3.57 -0.09 -2.14 116.94 120.40 2qvx h PHE 464 Ca 0.42 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 62.11 2qvx h PHE 464 Cb 0.53 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 39.45 2qvx h PHE 464 CO -0.10 -0.41 0.61 0.00 -2.23 0.00 0.00 178.31 176.19 2qvx h ARG 466 N 0.56 1.13 0.00 0.00 2.43 -0.11 -1.86 114.38 116.53 2qvx h ARG 466 Ca 0.52 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.56 2qvx h ARG 466 Cb 1.06 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 2qvx h ARG 466 CO -0.26 0.83 0.00 0.77 -1.51 0.00 0.00 179.97 179.80 2qvx h SER 467 N 1.13 0.00 -3.65 -3.80 0.02 -0.61 -3.46 113.55 103.18 2qvx h SER 467 Ca 0.29 0.00 -0.43 0.00 -0.84 0.00 0.00 61.79 60.81 2qvx h SER 467 Cb 0.03 0.00 0.18 0.00 0.14 0.00 0.00 62.40 62.75 2qvx h SER 467 CO -0.05 0.00 0.17 -0.94 -1.14 0.00 0.00 176.83 174.88 2qvx s SER 468 N -5.97 1.52 0.00 3.07 1.04 -0.70 -4.95 113.70 107.72 2qvx s SER 468 Ca 0.05 0.73 0.26 0.00 0.48 0.00 0.00 55.95 57.47 2qvx s SER 468 Cb 0.07 -1.07 1.11 0.00 0.10 0.00 0.00 66.02 66.23 2qvx s SER 468 CO 0.62 -3.76 1.83 -0.62 0.98 0.00 0.00 173.24 172.29 2qvx n GLU 469 N -4.53 0.01 -1.68 4.02 -0.58 -1.26 -4.90 120.64 111.73 2qvx n GLU 469 Ca 0.11 0.05 -0.45 0.00 -0.42 0.00 0.00 57.16 56.46 2qvx n GLU 469 Cb 0.59 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.93 2qvx n GLU 469 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2qvx n LEU 470 N -1.49 3.20 -4.68 -4.62 4.77 -1.26 -4.95 117.00 107.96 2qvx n LEU 470 Ca 0.06 1.13 -0.34 0.00 -0.03 0.00 0.00 56.01 56.83 2qvx n LEU 470 Cb 0.30 -1.44 0.11 0.00 -2.33 0.00 0.00 43.42 40.06 2qvx n LEU 470 CO 0.24 -0.41 0.74 0.00 -1.33 0.00 0.00 177.39 176.63 2qvx n ALA 471 N 2.13 0.11 -0.21 -1.18 0.00 -1.26 -4.91 120.51 115.18 2qvx n ALA 471 Ca 0.12 -0.26 -0.06 0.00 0.00 0.00 0.00 53.44 53.25 2qvx n ALA 471 Cb 0.31 -2.23 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 2qvx n ALA 471 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2qvx h ASP 472 N -0.56 -1.10 0.04 0.00 3.45 -2.00 -2.17 116.42 114.08 2qvx h ASP 472 Ca -0.47 0.17 -0.00 0.00 0.43 0.00 0.00 57.03 57.15 2qvx h ASP 472 Cb 1.31 0.49 -0.00 0.00 -0.56 0.00 0.00 39.33 40.57 2qvx h ASP 472 CO 0.47 -0.12 -0.01 2.19 -1.57 0.00 0.00 179.24 180.21 2qvx h PHE 473 N -0.00 0.00 0.00 4.55 -5.15 -2.02 -1.28 116.94 113.04 2qvx h PHE 473 Ca 0.08 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.83 2qvx h PHE 473 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.38 2qvx h PHE 473 CO -0.98 0.01 -0.08 0.87 -2.00 0.00 0.00 178.31 176.12 2qvx h LYS 474 N 0.00 0.00 -6.74 6.09 1.57 -1.75 -3.46 116.57 112.28 2qvx h LYS 474 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2qvx h LYS 474 Cb 0.03 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.41 2qvx h LYS 474 CO 0.00 0.08 0.90 1.03 -0.57 0.00 0.00 179.45 180.89 2qvx s ARG 475 N -3.47 4.15 0.37 3.15 0.52 -0.48 -4.91 118.95 118.28 2qvx s ARG 475 Ca 0.03 2.53 -0.25 0.00 -0.52 0.00 0.00 55.73 57.51 2qvx s ARG 475 Cb 0.08 -3.06 -0.12 0.00 0.52 0.00 0.00 34.95 32.37 2qvx s ARG 475 CO 0.62 -0.63 0.97 -2.30 0.02 0.00 0.00 175.30 173.97 2qvx n PRO 476 N 2.83 1.29 0.00 3.54 -0.02 -1.26 -4.84 135.00 136.54 2qvx n PRO 476 Ca 0.10 0.46 0.12 0.00 -2.02 0.00 0.00 63.50 62.17 2qvx n PRO 476 Cb 0.37 -1.93 0.23 0.00 -0.02 0.00 0.00 33.50 32.16 2qvx n PRO 476 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2qvx n LYS 477 N 0.40 1.06 -3.49 -0.52 4.76 0.37 -4.98 118.16 115.77 2qvx n LYS 477 Ca 0.10 -0.75 -0.15 0.00 -2.87 0.00 0.00 58.31 54.63 2qvx n LYS 477 Cb 0.37 -1.48 -0.05 0.00 -1.84 0.00 0.00 35.03 32.03 2qvx n LYS 477 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2qvx s ARG 478 N -2.45 1.07 -0.01 1.97 3.52 -1.20 -5.01 118.95 116.84 2qvx s ARG 478 Ca 0.23 0.01 0.03 0.00 -0.13 0.00 0.00 55.73 55.87 2qvx s ARG 478 Cb 0.19 0.50 -0.01 0.00 -1.56 0.00 0.00 34.95 34.07 2qvx s ARG 478 CO 0.52 -0.39 -0.11 0.71 -0.81 0.00 0.00 175.30 175.23 2qvx s TYR 479 N -2.03 1.01 -0.18 5.12 1.51 -1.26 -0.87 117.35 120.64 2qvx s TYR 479 Ca -0.06 -0.20 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 2qvx s TYR 479 Cb -0.00 -0.66 0.04 0.00 -0.11 0.00 0.00 41.96 41.23 2qvx s TYR 479 CO 0.02 -0.03 -0.11 -0.06 -1.11 0.00 0.00 175.55 174.26 2qvx s PHE 480 N -0.21 2.32 -0.20 2.71 0.40 0.28 -4.97 117.98 118.31 2qvx s PHE 480 Ca 0.03 -1.48 -0.26 0.00 -0.60 0.00 0.00 56.93 54.63 2qvx s PHE 480 Cb -0.05 -1.61 -0.01 0.00 0.51 0.00 0.00 43.02 41.86 2qvx s PHE 480 CO -0.00 -0.72 0.89 0.42 0.70 0.00 0.00 175.22 176.51 2qvx s ILE 481 N 1.43 4.81 0.18 0.64 -1.09 -1.26 -0.32 121.20 125.59 2qvx s ILE 481 Ca 0.00 1.73 0.10 0.00 -2.23 0.00 0.00 60.65 60.25 2qvx s ILE 481 Cb -0.15 -4.18 -0.04 0.00 -1.58 0.00 0.00 42.46 36.50 2qvx s ILE 481 CO -0.09 -0.05 -0.21 -0.76 -1.23 0.00 0.00 174.94 172.60 2qvx s LEU 482 N 2.59 2.43 0.24 2.97 1.43 0.43 -4.93 118.68 123.85 2qvx s LEU 482 Ca 0.39 -0.86 0.25 0.00 -1.03 0.00 0.00 54.13 52.88 2qvx s LEU 482 Cb -0.16 -0.97 0.51 0.00 0.03 0.00 0.00 46.19 45.59 2qvx s LEU 482 CO 0.10 0.03 1.56 -2.24 0.23 0.00 0.00 176.35 176.03 2qvx h ASP 483 N 3.25 0.00 -5.01 2.29 3.04 -1.97 -3.36 116.42 114.66 2qvx h ASP 483 Ca -0.44 -0.05 0.19 0.00 -3.24 0.00 0.00 57.03 53.49 2qvx h ASP 483 Cb 1.21 0.00 -0.13 0.00 -1.04 0.00 0.00 39.33 39.37 2qvx h ASP 483 CO 0.49 0.03 0.60 0.00 -2.04 0.00 0.00 179.24 178.32 2qvx s GLN 484 N -3.17 0.79 -0.11 4.15 0.00 -1.26 -4.92 119.66 115.15 2qvx s GLN 484 Ca 0.08 -0.38 -0.06 0.00 -0.00 0.00 0.00 55.36 55.00 2qvx s GLN 484 Cb 0.11 0.31 -0.04 0.00 0.00 0.00 0.00 33.01 33.39 2qvx s GLN 484 CO 0.66 -0.36 0.10 -0.51 0.00 0.00 0.00 175.29 175.18 2qvx s LEU 485 N -2.68 4.14 0.02 2.60 1.43 -1.26 -5.04 118.68 117.89 2qvx s LEU 485 Ca 0.10 0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 53.25 2qvx s LEU 485 Cb -0.00 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 2qvx s LEU 485 CO -0.04 0.39 1.29 -2.16 0.23 0.00 0.00 176.35 176.06 2qvx s PRO 486 N -0.92 4.35 0.13 1.29 0.04 -1.26 -5.01 135.00 133.62 2qvx s PRO 486 Ca 0.14 1.85 0.07 0.00 0.04 0.00 0.00 61.00 63.10 2qvx s PRO 486 Cb -0.12 -3.45 -0.04 0.00 0.04 0.00 0.00 34.50 30.93 2qvx s PRO 486 CO 0.03 -0.43 -0.17 0.15 0.04 0.00 0.00 177.00 176.63 2qvx s LYS 487 N 1.76 1.13 0.00 4.56 3.01 -1.26 -2.37 119.74 126.56 2qvx s LYS 487 Ca 0.60 -1.28 0.00 0.00 -1.01 0.00 0.00 55.97 54.29 2qvx s LYS 487 Cb -0.30 -1.15 0.00 0.00 -1.01 0.00 0.00 37.83 35.37 2qvx s LYS 487 CO 0.27 0.24 0.00 0.27 0.51 0.00 0.00 175.35 176.63 2qvx n ASN 488 N 0.56 -0.48 -0.08 2.83 0.23 -0.58 -4.87 115.26 112.87 2qvx n ASN 488 Ca -0.15 -0.50 -0.07 0.00 -0.53 0.00 0.00 54.58 53.33 2qvx n ASN 488 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 2qvx n ASN 488 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2qvx h ALA 489 N -2.00 0.27 -0.62 -2.53 0.00 -1.90 -3.17 119.26 109.31 2qvx h ALA 489 Ca 0.00 0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.69 2qvx h ALA 489 Cb 0.00 0.14 -0.18 0.00 0.00 0.00 0.00 17.79 17.75 2qvx h ALA 489 CO 0.00 -0.41 0.39 1.28 0.00 0.00 0.00 179.25 180.51 2qvx n LEU 490 N -5.16 5.30 0.00 0.00 4.77 -1.26 -4.86 117.00 115.79 2qvx n LEU 490 Ca 0.00 -2.79 0.00 0.00 -0.03 0.00 0.00 56.01 53.19 2qvx n LEU 490 Cb 0.16 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 2qvx n LEU 490 CO 0.23 0.82 0.00 0.59 -1.33 0.00 0.00 177.39 177.70 2qvx n ASN 491 N -0.48 -0.76 -4.77 -1.43 3.02 -1.20 -4.98 115.26 104.67 2qvx n ASN 491 Ca 0.37 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.54 2qvx n ASN 491 Cb 1.23 -1.90 -0.02 0.00 -0.61 0.00 0.00 39.78 38.48 2qvx n ASN 491 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2qvx s LYS 492 N -0.81 4.05 0.12 3.52 3.01 -1.26 -4.73 119.74 123.64 2qvx s LYS 492 Ca 0.00 1.85 -0.30 0.00 -1.01 0.00 0.00 55.97 56.50 2qvx s LYS 492 Cb 0.00 -2.68 -0.07 0.00 -1.01 0.00 0.00 37.83 34.08 2qvx s LYS 492 CO 0.00 -0.32 1.19 0.14 0.51 0.00 0.00 175.35 176.87 2qvx s VAL 493 N -1.41 3.84 -1.31 3.17 -7.23 -1.26 -1.52 120.40 114.67 2qvx s VAL 493 Ca 0.57 1.42 -0.11 0.00 -1.81 0.00 0.00 61.98 62.05 2qvx s VAL 493 Cb -0.31 -3.91 0.13 0.00 0.56 0.00 0.00 36.38 32.86 2qvx s VAL 493 CO 0.39 0.17 1.89 0.18 -0.31 0.00 0.00 175.10 177.42 2qvx n LEU 494 N 3.23 6.42 -0.06 1.32 4.77 -1.00 -4.85 117.00 126.84 2qvx n LEU 494 Ca 0.07 -4.47 -0.13 0.00 -0.03 0.00 0.00 56.01 51.45 2qvx n LEU 494 Cb 0.46 -1.55 -0.07 0.00 -2.33 0.00 0.00 43.42 39.92 2qvx n LEU 494 CO 0.55 1.17 0.54 0.03 -1.33 0.00 0.00 177.39 178.36 2qvx h ARG 495 N 6.08 -0.44 -0.98 3.23 3.08 -1.93 0.41 114.38 123.82 2qvx h ARG 495 Ca 0.43 0.03 0.19 0.00 0.07 0.00 0.00 59.98 60.70 2qvx h ARG 495 Cb 0.68 0.10 -0.18 0.00 0.08 0.00 0.00 29.97 30.64 2qvx h ARG 495 CO 1.63 -0.29 -0.27 0.00 -1.07 0.00 0.00 179.97 179.97 2qvx h ARG 496 N -0.46 -0.00 -0.07 0.04 3.08 -2.01 -2.69 114.38 112.27 2qvx h ARG 496 Ca 0.08 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.89 2qvx h ARG 496 Cb 0.63 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.69 2qvx h ARG 496 CO -0.50 -0.00 -0.90 0.37 -1.07 0.00 0.00 179.97 177.87 2qvx h GLN 497 N -0.00 0.71 -0.05 0.04 4.15 -1.42 -3.20 115.11 115.34 2qvx h GLN 497 Ca 0.45 -0.66 0.03 0.00 0.77 0.00 0.00 58.65 59.23 2qvx h GLN 497 Cb 0.70 0.17 -0.03 0.00 0.21 0.00 0.00 27.48 28.52 2qvx h GLN 497 CO -1.01 1.26 -0.11 1.25 -1.93 0.00 0.00 178.83 178.29 2qvx h LEU 498 N 0.44 -0.34 -0.98 -2.39 5.85 -0.75 -2.03 115.31 115.11 2qvx h LEU 498 Ca -0.09 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.81 2qvx h LEU 498 Cb 1.54 0.16 -0.14 0.00 0.37 0.00 0.00 40.66 42.59 2qvx h LEU 498 CO 0.18 -0.16 -0.47 0.52 -0.34 0.00 0.00 178.44 178.17 2qvx n VAL 499 N -5.25 -0.58 -0.07 1.05 0.31 -1.04 -1.47 118.33 111.28 2qvx n VAL 499 Ca -0.05 2.32 -0.09 0.00 -0.01 0.00 0.00 64.34 66.52 2qvx n VAL 499 Cb 0.17 -2.98 -0.03 0.00 -0.91 0.00 0.00 33.84 30.10 2qvx n VAL 499 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2qvx h GLN 500 N 0.00 -0.31 0.00 5.55 7.50 -1.38 -1.29 115.11 125.18 2qvx h GLN 500 Ca 0.25 0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.43 2qvx h GLN 500 Cb 0.50 0.07 0.00 0.00 0.05 0.00 0.00 27.48 28.10 2qvx h GLN 500 CO -0.95 -0.21 0.11 0.37 -1.50 0.00 0.00 178.83 176.66 2qvx h GLN 501 N -0.32 0.00 -0.02 1.46 4.15 -0.83 -3.52 115.11 116.02 2qvx h GLN 501 Ca 0.13 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.55 2qvx h GLN 501 Cb 0.55 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.24 2qvx h GLN 501 CO -0.46 0.00 0.00 1.33 -1.93 0.00 0.00 178.83 177.77