#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qcu n GLU 2 N 0.00 0.00 -3.73 2.12 2.13 -1.26 -5.03 120.64 114.87 2qcu n GLU 2 Ca 0.00 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 2qcu n GLU 2 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 2qcu n GLU 2 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2qcu s THR 3 N 0.00 3.54 0.45 6.31 2.01 -1.26 -2.64 115.64 124.06 2qcu s THR 3 Ca 0.00 -2.29 -0.23 0.00 0.31 0.00 0.00 61.69 59.48 2qcu s THR 3 Cb 0.00 -3.38 -0.08 0.00 0.01 0.00 0.00 72.50 69.05 2qcu s THR 3 CO 0.00 -0.76 1.15 -0.54 -0.69 0.00 0.00 174.62 173.78 2qcu s LYS 4 N 0.81 3.81 0.08 4.92 -0.14 0.02 -4.89 119.74 124.34 2qcu s LYS 4 Ca 0.11 1.75 -0.24 0.00 -1.36 0.00 0.00 55.97 56.22 2qcu s LYS 4 Cb -0.22 -2.43 -0.16 0.00 -1.68 0.00 0.00 37.83 33.34 2qcu s LYS 4 CO -0.04 -0.50 1.68 -0.44 -0.76 0.00 0.00 175.35 175.29 2qcu h ASP 5 N 2.11 -0.07 -3.57 2.83 3.32 -1.72 -0.90 116.42 118.41 2qcu h ASP 5 Ca -0.49 -0.04 -0.28 0.00 0.02 0.00 0.00 57.03 56.24 2qcu h ASP 5 Cb 1.24 0.02 -0.32 0.00 0.22 0.00 0.00 39.33 40.49 2qcu h ASP 5 CO 0.60 -0.01 -0.73 -0.22 -1.72 0.00 0.00 179.24 177.17 2qcu s LEU 6 N -10.09 1.31 -0.08 1.55 2.96 -0.65 -1.86 118.68 111.82 2qcu s LEU 6 Ca -0.14 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 2qcu s LEU 6 Cb 0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 46.19 46.68 2qcu s LEU 6 CO 0.66 -0.10 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.82 2qcu s ILE 7 N 0.80 3.04 -0.15 6.68 1.01 -0.83 -1.78 121.20 129.97 2qcu s ILE 7 Ca -0.07 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.89 2qcu s ILE 7 Cb -0.10 -2.21 0.01 0.00 0.01 0.00 0.00 42.46 40.16 2qcu s ILE 7 CO -0.02 0.57 -0.19 -0.69 0.00 0.00 0.00 174.94 174.60 2qcu s VAL 8 N -0.36 2.31 -0.34 2.92 1.01 0.43 -0.90 120.40 125.47 2qcu s VAL 8 Ca 0.04 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.04 2qcu s VAL 8 Cb -0.12 -1.95 0.02 0.00 0.00 0.00 0.00 36.38 34.33 2qcu s VAL 8 CO 0.02 0.53 0.14 -0.63 0.00 0.00 0.00 175.10 175.17 2qcu s ILE 9 N 0.82 4.22 0.00 2.22 1.01 -0.15 -0.97 121.20 128.34 2qcu s ILE 9 Ca -0.06 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 59.74 2qcu s ILE 9 Cb -0.15 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 39.01 2qcu s ILE 9 CO -0.01 -0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.42 2qcu n GLY 10 N 4.91 3.93 2.08 6.18 0.00 0.38 -1.08 105.19 121.59 2qcu n GLY 10 Ca -0.13 -1.09 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 2qcu n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcu n GLY 11 N 0.00 5.72 0.00 -0.02 0.00 -1.25 -4.11 105.19 105.53 2qcu n GLY 11 Ca 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 46.02 43.62 2qcu n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcu n GLY 12 N -0.70 -1.30 0.33 -0.02 0.00 -1.26 -1.29 105.19 100.95 2qcu n GLY 12 Ca 0.38 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.73 2qcu n GLY 12 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2qcu h ILE 13 N -0.71 1.26 -0.18 -0.61 6.09 -1.94 -1.44 117.51 119.99 2qcu h ILE 13 Ca 0.00 -0.97 -0.18 0.00 -1.37 0.00 0.00 64.86 62.35 2qcu h ILE 13 Cb 0.00 0.51 0.01 0.00 0.47 0.00 0.00 36.82 37.80 2qcu h ILE 13 CO 0.00 0.37 -0.58 0.78 -3.07 0.00 0.00 178.15 175.66 2qcu h ASN 14 N 1.09 0.81 -0.32 2.19 2.35 -1.92 -0.40 115.58 119.38 2qcu h ASN 14 Ca 0.23 -0.60 -0.09 0.00 -0.55 0.00 0.00 56.30 55.29 2qcu h ASN 14 Cb 0.36 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 2qcu h ASN 14 CO 0.00 1.27 -0.14 1.23 -1.65 0.00 0.00 177.43 178.14 2qcu h GLY 15 N 0.40 0.72 1.47 2.83 0.00 -1.71 -0.82 103.07 105.96 2qcu h GLY 15 Ca -0.02 -0.64 -0.12 0.00 0.00 0.00 0.00 47.33 46.55 2qcu h GLY 15 CO 0.12 0.58 -0.32 0.00 0.00 0.00 0.00 176.54 176.93 2qcu h ALA 16 N 0.78 0.92 -0.32 3.60 0.00 -1.21 -0.22 119.26 122.80 2qcu h ALA 16 Ca 0.07 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 2qcu h ALA 16 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2qcu h ALA 16 CO 0.04 0.62 -0.48 0.78 0.00 0.00 0.00 179.25 180.22 2qcu h GLY 17 N 1.02 0.96 0.79 0.00 0.00 -0.92 -0.65 103.07 104.27 2qcu h GLY 17 Ca 0.06 -1.05 -0.00 0.00 0.00 0.00 0.00 47.33 46.34 2qcu h GLY 17 CO 0.07 0.95 -0.00 -2.22 0.00 0.00 0.00 176.54 175.33 2qcu h ILE 18 N 0.69 1.17 -0.55 2.60 2.04 -0.94 -1.76 117.51 120.76 2qcu h ILE 18 Ca 0.03 -0.50 0.10 0.00 1.00 0.00 0.00 64.86 65.49 2qcu h ILE 18 Cb 1.07 1.51 -0.08 0.00 -0.74 0.00 0.00 36.82 38.58 2qcu h ILE 18 CO 0.11 0.13 0.12 0.00 0.00 0.00 0.00 178.15 178.51 2qcu h ALA 19 N 0.78 0.64 -0.29 1.87 0.00 -0.96 0.06 119.26 121.36 2qcu h ALA 19 Ca -0.00 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2qcu h ALA 19 Cb 0.22 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2qcu h ALA 19 CO 0.00 -0.30 0.10 0.00 0.00 0.00 0.00 179.25 179.05 2qcu h ALA 20 N 1.43 0.37 0.04 0.00 0.00 -1.03 -0.18 119.26 119.88 2qcu h ALA 20 Ca 0.28 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qcu h ALA 20 Cb 0.40 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2qcu h ALA 20 CO -0.36 -0.01 -0.02 0.22 0.00 0.00 0.00 179.25 179.08 2qcu h ASP 21 N 0.30 -0.04 -0.38 0.00 -0.00 -1.06 -1.60 116.42 113.65 2qcu h ASP 21 Ca 0.09 -0.10 0.07 0.00 -0.00 0.00 0.00 57.03 57.09 2qcu h ASP 21 Cb 0.21 0.01 -0.06 0.00 -0.00 0.00 0.00 39.33 39.49 2qcu h ASP 21 CO -0.01 0.07 -0.02 0.00 -0.00 0.00 0.00 179.24 179.29 2qcu h ALA 22 N 0.80 0.33 -0.32 -0.78 0.00 -0.85 -1.56 119.26 116.88 2qcu h ALA 22 Ca -0.01 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2qcu h ALA 22 Cb 0.14 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2qcu h ALA 22 CO 0.01 -0.41 0.10 0.00 0.00 0.00 0.00 179.25 178.95 2qcu h ALA 23 N 1.34 1.57 0.00 0.00 0.00 -0.76 -1.47 119.26 119.95 2qcu h ALA 23 Ca 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2qcu h ALA 23 Cb 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2qcu h ALA 23 CO -0.32 0.33 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2qcu n GLY 24 N -1.18 -1.36 0.94 0.00 0.00 -0.62 -2.01 105.19 100.95 2qcu n GLY 24 Ca 0.02 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.06 2qcu n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qcu n ARG 25 N -1.55 2.21 -0.44 1.61 1.74 -0.59 -4.95 116.66 114.69 2qcu n ARG 25 Ca 0.06 -1.85 0.00 0.00 -0.77 0.00 0.00 57.85 55.29 2qcu n ARG 25 Cb 0.29 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 2qcu n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qcu n GLY 26 N 1.36 0.78 3.76 -0.13 0.00 -0.85 -3.70 105.19 106.41 2qcu n GLY 26 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 2qcu n GLY 26 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qcu s LEU 27 N 0.00 4.52 -0.15 0.99 1.43 -0.98 -5.01 118.68 119.48 2qcu s LEU 27 Ca 0.00 2.17 -0.29 0.00 -1.03 0.00 0.00 54.13 54.98 2qcu s LEU 27 Cb 0.00 -3.69 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2qcu s LEU 27 CO 0.00 -0.12 1.23 -0.94 0.23 0.00 0.00 176.35 176.76 2qcu s SER 28 N -1.03 6.98 -0.01 2.29 1.04 -1.26 -4.30 113.70 117.40 2qcu s SER 28 Ca 0.45 1.69 0.06 0.00 0.48 0.00 0.00 55.95 58.64 2qcu s SER 28 Cb -0.29 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.27 2qcu s SER 28 CO 0.37 -0.72 -0.21 -0.69 0.98 0.00 0.00 173.24 172.97 2qcu s VAL 29 N 3.25 1.64 -0.09 5.02 1.01 -1.26 -1.64 120.40 128.32 2qcu s VAL 29 Ca 0.54 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.61 2qcu s VAL 29 Cb -0.22 -1.37 0.02 0.00 0.00 0.00 0.00 36.38 34.81 2qcu s VAL 29 CO 0.15 0.43 -0.12 -0.22 0.00 0.00 0.00 175.10 175.35 2qcu s LEU 30 N -0.57 1.52 -0.13 3.92 2.96 -0.73 -1.03 118.68 124.62 2qcu s LEU 30 Ca 0.08 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.63 2qcu s LEU 30 Cb -0.08 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.67 2qcu s LEU 30 CO -0.00 -0.02 -0.05 -0.32 -1.32 0.00 0.00 176.35 174.63 2qcu s MET 31 N 1.11 3.46 -0.12 1.98 -2.45 -0.17 -0.43 119.30 122.67 2qcu s MET 31 Ca -0.06 -0.54 0.00 0.00 -1.25 0.00 0.00 55.69 53.85 2qcu s MET 31 Cb -0.14 -2.82 -0.01 0.00 1.25 0.00 0.00 34.83 33.10 2qcu s MET 31 CO -0.02 0.33 -0.14 -0.51 1.05 0.00 0.00 175.02 175.73 2qcu s LEU 32 N 0.11 2.67 -0.11 4.11 1.43 -0.15 -1.50 118.68 125.24 2qcu s LEU 32 Ca -0.02 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 2qcu s LEU 32 Cb -0.14 -1.59 0.02 0.00 0.03 0.00 0.00 46.19 44.51 2qcu s LEU 32 CO 0.03 0.17 -0.13 -0.70 0.23 0.00 0.00 176.35 175.95 2qcu s GLU 33 N 0.30 2.02 0.27 1.70 2.56 -0.07 -0.47 118.70 125.01 2qcu s GLU 33 Ca -0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 54.97 54.35 2qcu s GLU 33 Cb -0.16 -1.79 0.35 0.00 2.00 0.00 0.00 34.13 34.53 2qcu s GLU 33 CO 0.06 -0.12 1.94 0.00 -0.56 0.00 0.00 175.26 176.58 2qcu h ALA 34 N 7.60 1.33 -3.00 6.30 0.00 -1.83 -0.19 119.26 129.47 2qcu h ALA 34 Ca -0.32 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2qcu h ALA 34 Cb 1.16 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2qcu h ALA 34 CO 0.48 0.60 0.00 0.94 0.00 0.00 0.00 179.25 181.27 2qcu n GLN 35 N -4.39 0.00 -4.31 0.00 7.27 -1.26 -2.91 117.38 111.79 2qcu n GLN 35 Ca 0.10 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.97 2qcu n GLN 35 Cb 0.03 0.00 -0.11 0.00 2.41 0.00 0.00 30.24 32.57 2qcu n GLN 35 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2qcu s ASP 36 N 1.00 2.49 0.06 1.69 2.15 -1.26 -0.94 116.67 121.86 2qcu s ASP 36 Ca 0.00 -0.85 -0.36 0.00 0.43 0.00 0.00 52.55 51.77 2qcu s ASP 36 Cb 0.00 -0.13 -0.16 0.00 -0.30 0.00 0.00 42.92 42.33 2qcu s ASP 36 CO 0.00 -0.07 1.47 0.18 -0.17 0.00 0.00 175.17 176.58 2qcu n LEU 37 N 0.34 2.17 -1.43 -1.34 4.77 -1.26 -1.64 117.00 118.60 2qcu n LEU 37 Ca -0.14 1.10 -0.17 0.00 -0.03 0.00 0.00 56.01 56.77 2qcu n LEU 37 Cb 0.57 -1.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.34 2qcu n LEU 37 CO 0.29 -0.75 -0.17 0.00 -1.33 0.00 0.00 177.39 175.42 2qcu n ALA 38 N 3.22 -0.30 0.32 -1.18 0.00 -0.41 -4.89 120.51 117.26 2qcu n ALA 38 Ca 0.19 0.26 0.14 0.00 0.00 0.00 0.00 53.44 54.03 2qcu n ALA 38 Cb 0.21 -1.81 0.62 0.00 0.00 0.00 0.00 19.45 18.47 2qcu n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qcu n ALA 40 N -1.88 0.00 0.02 0.00 0.00 -1.26 -4.88 120.51 112.51 2qcu n ALA 40 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.52 2qcu n ALA 40 Cb 0.20 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.13 2qcu n ALA 40 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2qcu h THR 41 N 0.00 1.03 0.00 0.00 2.02 -1.86 -2.47 112.91 111.63 2qcu h THR 41 Ca 0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 2qcu h THR 41 Cb 0.00 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2qcu h THR 41 CO 0.00 0.08 0.00 -1.20 0.37 0.00 0.00 175.52 174.77 2qcu n SER 42 N -4.48 0.00 -0.60 4.18 7.64 -1.26 -1.11 113.62 117.99 2qcu n SER 42 Ca 0.04 0.10 0.07 0.00 1.01 0.00 0.00 58.87 60.09 2qcu n SER 42 Cb 0.15 -0.33 0.08 0.00 -1.01 0.00 0.00 64.21 63.10 2qcu n SER 42 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2qcu n SER 43 N -1.33 2.33 -0.81 6.43 3.41 -0.93 -3.61 113.62 119.11 2qcu n SER 43 Ca 0.09 -1.65 0.07 0.00 -0.26 0.00 0.00 58.87 57.12 2qcu n SER 43 Cb 0.19 -0.05 0.22 0.00 -0.26 0.00 0.00 64.21 64.30 2qcu n SER 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qcu n ALA 44 N 0.77 2.64 -1.96 7.33 0.00 -0.26 -4.92 120.51 124.11 2qcu n ALA 44 Ca 0.09 -1.76 -0.27 0.00 0.00 0.00 0.00 53.44 51.50 2qcu n ALA 44 Cb 0.37 -0.60 0.15 0.00 0.00 0.00 0.00 19.45 19.37 2qcu n ALA 44 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2qcu s SER 45 N -1.47 3.68 0.00 0.00 1.04 -1.23 -4.52 113.70 111.19 2qcu s SER 45 Ca 0.34 -0.01 0.28 0.00 0.48 0.00 0.00 55.95 57.04 2qcu s SER 45 Cb 0.24 -0.19 1.41 0.00 0.10 0.00 0.00 66.02 67.59 2qcu s SER 45 CO 0.12 -2.34 1.94 -1.20 0.98 0.00 0.00 173.24 172.74 2qcu n SER 46 N -3.35 0.63 -2.37 7.02 7.64 -1.26 -4.93 113.62 117.00 2qcu n SER 46 Ca 0.15 -1.29 -0.16 0.00 1.01 0.00 0.00 58.87 58.58 2qcu n SER 46 Cb 0.60 -0.01 0.04 0.00 -1.01 0.00 0.00 64.21 63.83 2qcu n SER 46 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2qcu n LYS 47 N -0.47 -4.26 -4.85 1.43 5.02 -1.26 -4.96 118.16 108.80 2qcu n LYS 47 Ca 0.20 0.62 -0.33 0.00 -2.02 0.00 0.00 58.31 56.79 2qcu n LYS 47 Cb 0.20 -4.92 -0.13 0.00 -0.02 0.00 0.00 35.03 30.16 2qcu n LYS 47 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2qcu s LEU 48 N -5.07 2.75 -0.44 -0.35 1.43 -1.26 -0.07 118.68 115.67 2qcu s LEU 48 Ca 0.29 -0.21 -0.09 0.00 -1.03 0.00 0.00 54.13 53.09 2qcu s LEU 48 Cb -0.13 -1.57 0.10 0.00 0.03 0.00 0.00 46.19 44.63 2qcu s LEU 48 CO 0.36 0.34 0.30 -0.63 0.23 0.00 0.00 176.35 176.94 2qcu s ILE 49 N -0.76 4.24 -0.03 -0.59 1.01 -0.13 -4.59 121.20 120.35 2qcu s ILE 49 Ca 0.12 -1.57 -0.07 0.00 0.00 0.00 0.00 60.65 59.12 2qcu s ILE 49 Cb -0.11 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 2qcu s ILE 49 CO 0.01 -0.63 -0.15 0.00 0.00 0.00 0.00 174.94 174.17 2qcu n HIS 50 N 4.92 0.00 0.00 3.97 1.44 -1.26 -1.95 115.22 122.34 2qcu n HIS 50 Ca -0.09 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 2qcu n HIS 50 Cb 0.42 -0.21 0.00 0.00 0.12 0.00 0.00 29.99 30.32 2qcu n HIS 50 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2qcu n GLY 51 N 2.48 3.21 0.70 -1.39 0.00 -1.26 -4.48 105.19 104.44 2qcu n GLY 51 Ca -0.06 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2qcu n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcu n GLY 52 N 0.00 0.70 0.34 -0.02 0.00 -1.26 -3.98 105.19 100.98 2qcu n GLY 52 Ca 0.00 -0.55 0.04 0.00 0.00 0.00 0.00 46.02 45.51 2qcu n GLY 52 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qcu n LEU 53 N -0.62 -0.41 0.15 0.99 0.00 -1.26 -0.47 117.00 115.38 2qcu n LEU 53 Ca 0.00 1.61 0.13 0.00 0.00 0.00 0.00 56.01 57.75 2qcu n LEU 53 Cb 0.23 -0.45 0.53 0.00 0.00 0.00 0.00 43.42 43.73 2qcu n LEU 53 CO 0.00 -1.52 0.88 0.08 0.00 0.00 0.00 177.39 176.83 2qcu h ARG 54 N 0.00 0.00 0.00 1.96 0.11 -2.01 -2.48 114.38 111.96 2qcu h ARG 54 Ca 0.41 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.49 2qcu h ARG 54 Cb 0.65 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.73 2qcu h ARG 54 CO -0.95 0.00 0.00 1.88 0.10 0.00 0.00 179.97 181.00 2qcu h TYR 55 N 0.00 0.00 -0.82 4.08 0.05 -1.12 -3.21 116.97 115.95 2qcu h TYR 55 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.82 2qcu h TYR 55 Cb 0.36 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.05 2qcu h TYR 55 CO 0.00 0.00 0.52 -0.07 -1.05 0.00 0.00 178.16 177.56 2qcu h LEU 56 N 0.00 0.85 -2.23 3.88 4.07 -1.53 -1.22 115.31 119.13 2qcu h LEU 56 Ca 0.00 0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.00 2qcu h LEU 56 Cb 0.72 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.27 2qcu h LEU 56 CO 0.00 0.58 0.25 -0.33 -1.08 0.00 0.00 178.44 177.86 2qcu h GLU 57 N 1.00 0.00 -0.02 1.13 5.08 -1.77 -0.57 114.58 119.43 2qcu h GLU 57 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2qcu h GLU 57 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2qcu h GLU 57 CO -0.13 0.00 -0.20 0.72 -1.00 0.00 0.00 179.01 178.40 2qcu n HIS 58 N -3.45 0.00 -2.20 4.33 8.25 -0.51 -4.98 115.22 116.66 2qcu n HIS 58 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 2qcu n HIS 58 Cb 0.35 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.46 2qcu n HIS 58 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2qcu n TYR 59 N 0.73 -0.54 -1.77 4.41 0.53 -0.22 -4.94 117.16 115.36 2qcu n TYR 59 Ca 0.12 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.59 2qcu n TYR 59 Cb 0.53 -2.63 -0.01 0.00 -1.03 0.00 0.00 39.34 36.20 2qcu n TYR 59 CO 0.00 0.00 0.00 0.39 -1.02 0.00 0.00 176.86 176.23 2qcu n GLU 60 N -2.12 3.94 -0.09 -0.72 -0.58 -0.98 -4.71 120.64 115.38 2qcu n GLU 60 Ca -0.14 -2.93 -0.04 0.00 -0.42 0.00 0.00 57.16 53.63 2qcu n GLU 60 Cb 0.60 -2.81 0.18 0.00 -0.57 0.00 0.00 31.44 28.84 2qcu n GLU 60 CO 0.00 0.00 0.00 0.74 -0.48 0.00 0.00 177.13 177.39 2qcu h PHE 61 N 5.07 0.80 -0.28 -0.32 0.04 -1.92 -1.85 116.94 118.47 2qcu h PHE 61 Ca 0.70 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 61.36 2qcu h PHE 61 Cb 0.38 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 2qcu h PHE 61 CO 1.64 0.75 0.13 0.07 -0.60 0.00 0.00 178.31 180.30 2qcu h ARG 62 N 0.70 0.41 0.47 1.51 0.11 -1.99 0.87 114.38 116.46 2qcu h ARG 62 Ca 0.14 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 60.13 2qcu h ARG 62 Cb 0.44 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.45 2qcu h ARG 62 CO 0.02 0.40 -0.22 1.25 0.10 0.00 0.00 179.97 181.51 2qcu h LEU 63 N 0.32 -0.53 0.34 0.08 7.12 -1.93 -1.01 115.31 119.70 2qcu h LEU 63 Ca 0.10 -0.04 -0.02 0.00 0.13 0.00 0.00 57.88 58.05 2qcu h LEU 63 Cb 0.13 0.14 0.00 0.00 -0.53 0.00 0.00 40.66 40.40 2qcu h LEU 63 CO -0.01 -0.29 -0.16 0.58 -0.13 0.00 0.00 178.44 178.43 2qcu h VAL 64 N -0.76 0.67 -0.21 1.05 2.07 -1.36 0.15 116.25 117.85 2qcu h VAL 64 Ca -0.06 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.46 2qcu h VAL 64 Cb 0.54 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 2qcu h VAL 64 CO 0.11 0.00 -0.13 -0.24 0.02 0.00 0.00 177.57 177.33 2qcu n SER 65 N -5.28 -0.23 0.12 0.57 2.88 0.30 -0.03 113.62 111.95 2qcu n SER 65 Ca -0.10 0.81 -0.13 0.00 -1.33 0.00 0.00 58.87 58.11 2qcu n SER 65 Cb 0.20 -0.26 -0.08 0.00 -0.75 0.00 0.00 64.21 63.32 2qcu n SER 65 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2qcu h GLU 66 N 0.00 -0.22 -0.87 -1.46 4.81 -0.79 -2.69 114.58 113.36 2qcu h GLU 66 Ca 0.03 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.30 2qcu h GLU 66 Cb 0.09 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.47 2qcu h GLU 66 CO -0.20 -0.14 0.57 0.00 -0.73 0.00 0.00 179.01 178.51 2qcu h ALA 67 N 0.59 1.13 -0.05 2.92 0.00 -0.36 -1.21 119.26 122.29 2qcu h ALA 67 Ca -0.02 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2qcu h ALA 67 Cb 0.18 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2qcu h ALA 67 CO 0.04 0.45 -0.04 -0.07 0.00 0.00 0.00 179.25 179.63 2qcu h LEU 68 N 1.13 -0.13 -0.39 0.00 3.38 -0.18 -2.67 115.31 116.44 2qcu h LEU 68 Ca 0.34 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 2qcu h LEU 68 Cb -0.05 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2qcu h LEU 68 CO -0.10 -0.06 -0.42 0.00 0.09 0.00 0.00 178.44 177.96 2qcu h ALA 69 N 0.99 0.81 0.00 1.53 0.00 -1.07 -2.48 119.26 119.04 2qcu h ALA 69 Ca 0.03 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2qcu h ALA 69 Cb 0.10 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2qcu h ALA 69 CO -0.08 0.52 -0.16 0.93 0.00 0.00 0.00 179.25 180.46 2qcu h GLU 70 N 0.00 0.00 -0.49 0.00 4.39 -1.14 -3.15 114.58 114.19 2qcu h GLU 70 Ca -0.00 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.79 2qcu h GLU 70 Cb 1.16 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.72 2qcu h GLU 70 CO 0.05 0.16 -0.12 0.00 -1.16 0.00 0.00 179.01 177.95 2qcu h ARG 71 N 0.00 0.00 -0.29 2.33 3.08 -1.09 0.25 114.38 118.67 2qcu h ARG 71 Ca -0.00 -0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 2qcu h ARG 71 Cb 0.30 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2qcu h ARG 71 CO 0.02 0.00 -0.34 0.93 -1.07 0.00 0.00 179.97 179.52 2qcu h GLU 72 N 0.00 0.64 0.14 0.04 4.39 -1.71 -1.45 114.58 116.65 2qcu h GLU 72 Ca 0.24 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.64 2qcu h GLU 72 Cb 0.36 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2qcu h GLU 72 CO -0.50 0.89 -0.17 0.28 -1.16 0.00 0.00 179.01 178.35 2qcu h VAL 73 N 0.54 0.61 -0.61 3.13 2.07 -1.38 -2.93 116.25 117.68 2qcu h VAL 73 Ca 0.06 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 2qcu h VAL 73 Cb 0.84 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 2qcu h VAL 73 CO 0.07 0.00 0.30 -0.07 0.02 0.00 0.00 177.57 177.89 2qcu h LEU 74 N -0.36 0.77 -1.31 2.57 3.38 -0.34 -1.72 115.31 118.30 2qcu h LEU 74 Ca 0.01 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2qcu h LEU 74 Cb 0.35 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2qcu h LEU 74 CO -0.06 0.65 0.49 -0.07 0.09 0.00 0.00 178.44 179.54 2qcu h LEU 75 N 0.86 0.77 -0.31 1.67 3.38 -1.25 -1.68 115.31 118.75 2qcu h LEU 75 Ca 0.21 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.98 2qcu h LEU 75 Cb 0.08 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2qcu h LEU 75 CO -0.03 0.52 -0.73 0.11 0.09 0.00 0.00 178.44 178.41 2qcu h LYS 76 N 0.89 0.61 -0.01 1.13 1.79 -1.25 -2.94 116.57 116.78 2qcu h LYS 76 Ca 0.30 -0.48 -0.13 0.00 -2.18 0.00 0.00 60.65 58.16 2qcu h LYS 76 Cb 0.08 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 2qcu h LYS 76 CO -0.09 1.10 -0.59 0.52 -1.08 0.00 0.00 179.45 179.31 2qcu h MET 77 N 0.42 0.04 -1.13 3.15 2.86 -0.79 -3.39 114.93 116.09 2qcu h MET 77 Ca -0.03 -0.03 -0.37 0.00 -2.06 0.00 0.00 59.70 57.21 2qcu h MET 77 Cb 1.32 0.00 -0.30 0.00 0.06 0.00 0.00 31.60 32.68 2qcu h MET 77 CO 0.14 0.62 -0.90 0.00 1.06 0.00 0.00 176.91 177.82 2qcu n ALA 78 N -2.43 1.19 0.31 6.32 0.00 -0.68 -0.91 120.51 124.31 2qcu n ALA 78 Ca -0.01 -2.62 0.17 0.00 0.00 0.00 0.00 53.44 50.98 2qcu n ALA 78 Cb 0.59 -1.01 0.75 0.00 0.00 0.00 0.00 19.45 19.78 2qcu n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2qcu h PRO 79 N 2.94 0.00 -0.18 0.00 0.13 -1.71 -0.39 132.00 132.79 2qcu h PRO 79 Ca -0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 2qcu h PRO 79 Cb 1.05 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 2qcu h PRO 79 CO 0.34 0.00 -0.16 1.12 -0.23 0.00 0.00 178.00 179.07 2qcu h HIS 80 N 0.00 0.31 0.00 1.56 2.07 -1.85 -3.37 115.15 113.88 2qcu h HIS 80 Ca 0.00 -0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.48 2qcu h HIS 80 Cb 0.32 -0.08 0.00 0.00 2.57 0.00 0.00 27.41 30.21 2qcu h HIS 80 CO 0.00 0.45 0.00 0.44 -3.07 0.00 0.00 177.93 175.75 2qcu n ILE 81 N -4.23 0.00 -5.01 6.12 -5.35 -0.84 -4.44 119.36 105.61 2qcu n ILE 81 Ca -0.00 -0.48 -0.27 0.00 -0.27 0.00 0.00 62.75 61.72 2qcu n ILE 81 Cb 0.30 1.01 -0.16 0.00 -1.74 0.00 0.00 39.64 39.06 2qcu n ILE 81 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qcu s ALA 82 N -0.59 1.72 0.06 -1.28 0.00 -0.22 -1.70 121.76 119.76 2qcu s ALA 82 Ca 0.00 -0.88 -0.24 0.00 0.00 0.00 0.00 51.96 50.84 2qcu s ALA 82 Cb 0.00 -0.46 0.06 0.00 0.00 0.00 0.00 23.12 22.72 2qcu s ALA 82 CO 0.00 0.40 0.57 -0.59 0.00 0.00 0.00 175.76 176.14 2qcu s PHE 83 N -0.40 -0.49 0.46 0.00 -0.71 -0.74 -4.49 117.98 111.61 2qcu s PHE 83 Ca 0.06 0.53 -0.25 0.00 -1.04 0.00 0.00 56.93 56.23 2qcu s PHE 83 Cb -0.09 0.42 -0.08 0.00 -1.21 0.00 0.00 43.02 42.06 2qcu s PHE 83 CO -0.00 -0.70 1.40 -2.14 -1.34 0.00 0.00 175.22 172.44 2qcu s PRO 84 N -2.65 3.62 0.05 1.99 0.02 -1.26 -0.92 135.00 135.85 2qcu s PRO 84 Ca -0.04 2.36 0.02 0.00 0.02 0.00 0.00 61.00 63.36 2qcu s PRO 84 Cb -0.00 -2.60 -0.03 0.00 0.02 0.00 0.00 34.50 31.89 2qcu s PRO 84 CO -0.03 -0.85 -0.08 1.41 -0.33 0.00 0.00 177.00 177.12 2qcu s MET 85 N -2.51 0.57 -0.14 5.54 1.75 -0.23 -4.81 119.30 119.47 2qcu s MET 85 Ca 0.62 -0.83 -0.08 0.00 -1.25 0.00 0.00 55.69 54.16 2qcu s MET 85 Cb -0.43 -0.29 -0.04 0.00 2.84 0.00 0.00 34.83 36.91 2qcu s MET 85 CO 0.54 0.04 0.13 1.03 -0.65 0.00 0.00 175.02 176.12 2qcu s ARG 86 N -1.85 3.64 -0.12 4.11 1.81 -1.26 -1.71 118.95 123.57 2qcu s ARG 86 Ca -0.07 -0.17 0.01 0.00 -1.72 0.00 0.00 55.73 53.78 2qcu s ARG 86 Cb -0.08 -3.24 -0.01 0.00 -0.45 0.00 0.00 34.95 31.16 2qcu s ARG 86 CO -0.00 0.64 -0.15 -0.06 -0.68 0.00 0.00 175.30 175.05 2qcu s PHE 87 N -0.63 2.77 -0.20 -0.53 0.40 0.30 -0.17 117.98 119.92 2qcu s PHE 87 Ca 0.13 -0.72 -0.06 0.00 -0.60 0.00 0.00 56.93 55.68 2qcu s PHE 87 Cb -0.12 -1.82 -0.03 0.00 0.51 0.00 0.00 43.02 41.56 2qcu s PHE 87 CO 0.02 -0.25 0.04 1.03 0.70 0.00 0.00 175.22 176.76 2qcu s ARG 88 N 0.35 3.77 -0.38 0.44 0.52 0.85 -1.60 118.95 122.91 2qcu s ARG 88 Ca -0.12 -0.44 -0.08 0.00 -0.52 0.00 0.00 55.73 54.57 2qcu s ARG 88 Cb -0.16 -3.17 0.06 0.00 0.52 0.00 0.00 34.95 32.20 2qcu s ARG 88 CO 0.06 0.10 0.18 -1.17 0.02 0.00 0.00 175.30 174.49 2qcu s LEU 89 N 0.81 4.72 0.11 2.53 2.96 0.12 -0.88 118.68 129.05 2qcu s LEU 89 Ca 0.02 -1.32 -0.31 0.00 -0.22 0.00 0.00 54.13 52.30 2qcu s LEU 89 Cb -0.14 -1.92 -0.08 0.00 0.50 0.00 0.00 46.19 44.55 2qcu s LEU 89 CO 0.02 -0.42 1.42 -2.84 -1.32 0.00 0.00 176.35 173.21 2qcu s PRO 90 N 1.41 4.30 0.03 0.98 0.02 -1.25 -1.01 135.00 139.47 2qcu s PRO 90 Ca 0.01 2.11 -0.30 0.00 0.02 0.00 0.00 61.00 62.84 2qcu s PRO 90 Cb -0.21 -3.28 -0.06 0.00 0.02 0.00 0.00 34.50 30.98 2qcu s PRO 90 CO 0.02 -0.48 1.31 -1.58 -0.33 0.00 0.00 177.00 175.95 2qcu s HIS 91 N 1.28 3.13 -0.43 6.54 2.46 -0.05 -4.74 115.29 123.48 2qcu s HIS 91 Ca 0.66 1.03 0.02 0.00 0.47 0.00 0.00 55.06 57.24 2qcu s HIS 91 Cb -0.37 -3.56 0.14 0.00 -0.13 0.00 0.00 32.58 28.66 2qcu s HIS 91 CO 0.30 -1.95 0.27 1.03 -2.47 0.00 0.00 174.74 171.92 2qcu s ARG 92 N 1.79 1.14 0.42 2.88 0.52 -1.26 -4.79 118.95 119.65 2qcu s ARG 92 Ca 0.61 -1.96 0.29 0.00 -0.52 0.00 0.00 55.73 54.16 2qcu s ARG 92 Cb -0.31 -2.04 1.18 0.00 0.52 0.00 0.00 34.95 34.31 2qcu s ARG 92 CO 0.27 -1.21 1.86 -1.00 0.02 0.00 0.00 175.30 175.24 2qcu h PRO 93 N 6.54 0.00 0.00 3.54 0.13 -1.95 0.09 132.00 140.34 2qcu h PRO 93 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2qcu h PRO 93 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2qcu h PRO 93 CO 0.43 0.00 0.00 1.12 -0.23 0.00 0.00 178.00 179.32 2qcu h HIS 94 N 0.00 0.00 0.00 1.56 2.07 -2.01 -3.34 115.15 113.43 2qcu h HIS 94 Ca 0.00 0.00 -0.19 0.00 -2.85 0.00 0.00 60.37 57.33 2qcu h HIS 94 Cb 0.46 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.42 2qcu h HIS 94 CO 0.00 0.00 -1.55 1.28 -3.07 0.00 0.00 177.93 174.59 2qcu n LEU 95 N -2.98 1.70 -3.97 6.12 4.77 -0.03 -5.01 117.00 117.60 2qcu n LEU 95 Ca -0.01 0.29 -0.19 0.00 -0.03 0.00 0.00 56.01 56.06 2qcu n LEU 95 Cb 0.17 -0.67 -0.15 0.00 -2.33 0.00 0.00 43.42 40.43 2qcu n LEU 95 CO 0.22 0.06 -0.42 -0.13 -1.33 0.00 0.00 177.39 175.79 2qcu s ARG 96 N -2.58 0.81 0.32 3.23 0.52 -0.90 -5.12 118.95 115.22 2qcu s ARG 96 Ca -0.28 -0.25 -0.20 0.00 -0.52 0.00 0.00 55.73 54.48 2qcu s ARG 96 Cb 0.08 -0.77 -0.09 0.00 0.52 0.00 0.00 34.95 34.68 2qcu s ARG 96 CO 0.38 0.09 0.83 -1.25 0.02 0.00 0.00 175.30 175.37 2qcu s PRO 97 N 0.22 4.27 0.35 3.54 0.04 -1.26 -3.97 135.00 138.19 2qcu s PRO 97 Ca -0.03 0.99 0.16 0.00 0.04 0.00 0.00 61.00 62.16 2qcu s PRO 97 Cb -0.08 -2.59 1.14 0.00 0.04 0.00 0.00 34.50 33.01 2qcu s PRO 97 CO 0.00 0.21 1.65 0.00 0.04 0.00 0.00 177.00 178.90 2qcu h ALA 98 N 2.72 2.02 -0.72 8.56 0.00 -1.94 -1.83 119.26 128.07 2qcu h ALA 98 Ca -0.48 0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 2qcu h ALA 98 Cb 1.19 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2qcu h ALA 98 CO 0.64 -0.65 0.25 0.11 0.00 0.00 0.00 179.25 179.60 2qcu h TRP 99 N 0.27 1.14 -0.57 0.00 5.08 -1.99 0.30 115.95 120.18 2qcu h TRP 99 Ca 0.75 -0.10 -0.02 0.00 1.08 0.00 0.00 58.89 60.60 2qcu h TRP 99 Cb 1.79 -0.33 -0.03 0.00 -3.00 0.00 0.00 29.16 27.59 2qcu h TRP 99 CO -0.01 0.89 0.29 1.98 -1.28 0.00 0.00 178.44 180.31 2qcu h MET 100 N 1.06 0.82 -0.32 0.12 4.05 -1.72 -2.92 114.93 116.02 2qcu h MET 100 Ca 0.24 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.53 2qcu h MET 100 Cb 0.27 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.90 2qcu h MET 100 CO -0.01 0.65 0.13 0.82 0.23 0.00 0.00 176.91 178.73 2qcu h ILE 101 N 0.77 1.18 -0.77 1.77 1.08 -1.30 -0.23 117.51 120.02 2qcu h ILE 101 Ca 0.20 -0.55 0.21 0.00 -0.39 0.00 0.00 64.86 64.33 2qcu h ILE 101 Cb 0.10 0.94 -0.04 0.00 -3.07 0.00 0.00 36.82 34.75 2qcu h ILE 101 CO -0.03 0.19 0.54 0.03 -0.69 0.00 0.00 178.15 178.20 2qcu h ARG 102 N 0.38 0.06 0.00 2.37 2.47 -0.83 -1.67 114.38 117.17 2qcu h ARG 102 Ca 0.11 -0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.53 2qcu h ARG 102 Cb 0.18 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.44 2qcu h ARG 102 CO -0.01 0.04 -1.60 -0.89 0.56 0.00 0.00 179.97 178.07 2qcu n ILE 103 N -4.34 1.54 -0.31 2.04 2.08 -1.01 -3.96 119.36 115.40 2qcu n ILE 103 Ca 0.15 -0.13 0.29 0.00 0.56 0.00 0.00 62.75 63.63 2qcu n ILE 103 Cb 0.79 -2.00 0.51 0.00 -0.75 0.00 0.00 39.64 38.20 2qcu n ILE 103 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2qcu n GLY 104 N 1.40 -0.65 0.16 7.39 0.00 -0.13 -0.58 105.19 112.78 2qcu n GLY 104 Ca -0.38 0.66 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 2qcu n GLY 104 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qcu h LEU 105 N 0.00 0.40 -0.68 0.99 4.07 -1.44 -2.55 115.31 116.10 2qcu h LEU 105 Ca 0.71 -0.27 -0.14 0.00 0.08 0.00 0.00 57.88 58.26 2qcu h LEU 105 Cb 2.03 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 43.64 2qcu h LEU 105 CO -0.56 1.01 -0.55 0.15 -1.08 0.00 0.00 178.44 177.41 2qcu h PHE 106 N 0.22 0.39 -0.12 1.13 3.57 -0.97 -1.03 116.94 120.13 2qcu h PHE 106 Ca -0.03 -0.14 -0.00 0.00 3.53 0.00 0.00 57.97 61.33 2qcu h PHE 106 Cb 1.32 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 2qcu h PHE 106 CO 0.04 0.79 0.06 0.52 -2.23 0.00 0.00 178.31 177.49 2qcu h MET 107 N 0.24 0.17 0.00 1.11 2.86 -1.38 -0.00 114.93 117.93 2qcu h MET 107 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2qcu h MET 107 Cb 1.04 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.67 2qcu h MET 107 CO 0.09 0.24 0.00 -0.92 1.06 0.00 0.00 176.91 177.38 2qcu h TYR 108 N 0.07 0.00 0.00 -0.22 3.20 -1.28 0.25 116.97 118.99 2qcu h TYR 108 Ca 0.04 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.63 2qcu h TYR 108 Cb 0.12 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 2qcu h TYR 108 CO -0.03 0.00 -1.63 -0.44 -1.64 0.00 0.00 178.16 174.42 2qcu h ASP 109 N 0.00 0.00 -0.83 -2.11 3.32 -0.46 -3.42 116.42 112.92 2qcu h ASP 109 Ca 0.00 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.73 2qcu h ASP 109 Cb 0.11 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.26 2qcu h ASP 109 CO 0.00 0.99 -1.18 1.41 -1.72 0.00 0.00 179.24 178.75 2qcu n HIS 110 N -3.07 1.19 0.68 4.55 8.25 -0.08 -4.54 115.22 122.19 2qcu n HIS 110 Ca -0.15 -2.60 0.07 0.00 -0.26 0.00 0.00 57.72 54.78 2qcu n HIS 110 Cb 1.04 -0.33 -0.06 0.00 1.12 0.00 0.00 29.99 31.75 2qcu n HIS 110 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2qcu n LEU 111 N -0.22 0.91 -0.06 2.41 7.99 0.83 -4.85 117.00 124.00 2qcu n LEU 111 Ca 0.08 -0.57 -0.13 0.00 -0.01 0.00 0.00 56.01 55.38 2qcu n LEU 111 Cb 0.81 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 44.08 2qcu n LEU 111 CO 0.21 0.20 -0.84 0.61 -1.51 0.00 0.00 177.39 176.07 2qcu n GLY 112 N 1.28 -0.28 0.00 -0.72 0.00 -1.26 -4.65 105.19 99.56 2qcu n GLY 112 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2qcu n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qcu n LYS 113 N -3.82 0.00 -1.88 1.61 5.02 -1.26 -4.58 118.16 113.24 2qcu n LYS 113 Ca -0.24 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.05 2qcu n LYS 113 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 2qcu n LYS 113 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2qcu n ARG 114 N 0.00 -3.98 -0.00 1.97 0.00 -1.26 -4.96 116.66 108.43 2qcu n ARG 114 Ca 0.00 2.83 0.01 0.00 -0.00 0.00 0.00 57.85 60.69 2qcu n ARG 114 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 32.46 29.21 2qcu n ARG 114 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2qcu n THR 115 N 1.20 0.00 -0.05 5.15 -1.04 -1.26 -4.88 114.28 113.40 2qcu n THR 115 Ca 0.00 -0.38 0.00 0.00 -2.04 0.00 0.00 64.05 61.63 2qcu n THR 115 Cb 0.00 0.90 0.00 0.00 -1.82 0.00 0.00 70.33 69.41 2qcu n THR 115 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2qcu n SER 116 N -1.14 0.00 -4.73 8.00 3.41 -1.26 -5.09 113.62 112.81 2qcu n SER 116 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 2qcu n SER 116 Cb 0.03 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.93 2qcu n SER 116 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qcu s LEU 117 N 0.00 4.38 0.95 1.04 1.43 -1.26 -5.03 118.68 120.19 2qcu s LEU 117 Ca 0.00 1.36 -0.12 0.00 -1.03 0.00 0.00 54.13 54.34 2qcu s LEU 117 Cb 0.00 -3.21 0.09 0.00 0.03 0.00 0.00 46.19 43.10 2qcu s LEU 117 CO 0.00 -0.08 0.71 -0.81 0.23 0.00 0.00 176.35 176.40 2qcu n PRO 118 N 3.36 -0.46 0.00 1.29 -0.04 -1.26 -5.03 135.00 132.87 2qcu n PRO 118 Ca -0.01 -0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2qcu n PRO 118 Cb 0.51 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 2qcu n PRO 118 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qcu n GLY 119 N 1.01 -0.20 3.83 0.55 0.00 -1.26 -4.37 105.19 104.75 2qcu n GLY 119 Ca 0.09 -1.61 -0.28 0.00 0.00 0.00 0.00 46.02 44.22 2qcu n GLY 119 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qcu s SER 120 N -1.00 5.77 0.08 1.61 0.01 -1.26 -4.32 113.70 114.58 2qcu s SER 120 Ca 0.00 -0.00 -0.03 0.00 1.31 0.00 0.00 55.95 57.23 2qcu s SER 120 Cb 0.00 -1.60 -0.03 0.00 0.21 0.00 0.00 66.02 64.60 2qcu s SER 120 CO 0.00 0.10 0.04 0.42 0.41 0.00 0.00 173.24 174.20 2qcu s THR 121 N -1.64 0.18 0.33 1.44 -4.23 0.27 -4.99 115.64 106.99 2qcu s THR 121 Ca 0.32 -1.70 -0.01 0.00 -1.18 0.00 0.00 61.69 59.12 2qcu s THR 121 Cb -0.11 -1.60 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 2qcu s THR 121 CO 0.25 -0.81 0.54 -0.83 -0.54 0.00 0.00 174.62 173.22 2qcu s GLY 122 N -2.94 1.46 0.07 3.99 0.00 -1.26 -0.74 107.32 107.90 2qcu s GLY 122 Ca 0.10 -0.84 0.04 0.00 0.00 0.00 0.00 44.72 44.03 2qcu s GLY 122 CO -0.08 -0.77 -0.12 1.08 0.00 0.00 0.00 173.10 173.22 2qcu s LEU 123 N -4.12 2.29 0.04 0.66 1.43 -0.11 -4.85 118.68 114.04 2qcu s LEU 123 Ca 0.41 -0.63 0.09 0.00 -1.03 0.00 0.00 54.13 52.96 2qcu s LEU 123 Cb -0.10 -0.39 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 2qcu s LEU 123 CO 0.35 -0.14 -0.24 -0.13 0.23 0.00 0.00 176.35 176.41 2qcu s ARG 124 N -1.87 1.87 -0.10 1.70 0.52 -1.26 -1.33 118.95 118.48 2qcu s ARG 124 Ca -0.03 -1.08 0.02 0.00 -0.52 0.00 0.00 55.73 54.12 2qcu s ARG 124 Cb -0.09 -2.03 -0.01 0.00 0.52 0.00 0.00 34.95 33.33 2qcu s ARG 124 CO 0.01 0.52 -0.16 -0.06 0.02 0.00 0.00 175.30 175.63 2qcu s PHE 125 N -0.84 2.70 0.00 -0.53 0.08 0.24 -4.96 117.98 114.68 2qcu s PHE 125 Ca 0.12 -0.59 0.00 0.00 0.12 0.00 0.00 56.93 56.58 2qcu s PHE 125 Cb -0.10 -1.74 0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2qcu s PHE 125 CO 0.03 -0.15 0.00 0.41 -0.10 0.00 0.00 175.22 175.41 2qcu n GLY 126 N 3.16 3.93 0.22 4.36 0.00 -1.26 -4.59 105.19 111.02 2qcu n GLY 126 Ca -0.18 -2.16 0.15 0.00 0.00 0.00 0.00 46.02 43.84 2qcu n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qcu h ALA 127 N 0.76 1.00 -0.45 4.61 0.00 -1.96 -2.10 119.26 121.12 2qcu h ALA 127 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qcu h ALA 127 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2qcu h ALA 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 2qcu n ASN 128 N -2.75 3.29 -4.04 0.00 3.02 -1.26 -4.98 115.26 108.53 2qcu n ASN 128 Ca 0.01 -1.95 -0.30 0.00 -0.03 0.00 0.00 54.58 52.31 2qcu n ASN 128 Cb 0.26 -0.29 0.20 0.00 -0.61 0.00 0.00 39.78 39.33 2qcu n ASN 128 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2qcu s SER 129 N -1.11 2.53 0.08 6.41 1.04 -0.79 -4.95 113.70 116.91 2qcu s SER 129 Ca 0.34 0.36 0.27 0.00 0.48 0.00 0.00 55.95 57.40 2qcu s SER 129 Cb 0.19 -0.45 0.87 0.00 0.10 0.00 0.00 66.02 66.73 2qcu s SER 129 CO 0.25 -3.11 1.72 1.33 0.98 0.00 0.00 173.24 174.42 2qcu n VAL 130 N -4.03 0.24 -3.42 5.02 0.24 -1.26 -4.87 118.33 110.25 2qcu n VAL 130 Ca 0.15 -0.13 -0.26 0.00 -2.04 0.00 0.00 64.34 62.06 2qcu n VAL 130 Cb 0.59 -0.37 -0.02 0.00 -1.47 0.00 0.00 33.84 32.57 2qcu n VAL 130 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2qcu s LEU 131 N -3.66 4.07 0.52 1.34 1.43 -1.26 -1.09 118.68 120.02 2qcu s LEU 131 Ca 0.11 0.53 -0.22 0.00 -1.03 0.00 0.00 54.13 53.53 2qcu s LEU 131 Cb 0.16 -3.36 -0.06 0.00 0.03 0.00 0.00 46.19 42.96 2qcu s LEU 131 CO 0.60 -0.21 1.28 -0.54 0.23 0.00 0.00 176.35 177.71 2qcu s LYS 132 N -3.85 3.36 0.53 1.70 1.02 0.32 -4.54 119.74 118.27 2qcu s LYS 132 Ca 0.41 2.05 0.18 0.00 0.02 0.00 0.00 55.97 58.63 2qcu s LYS 132 Cb -0.10 -2.30 1.33 0.00 -0.52 0.00 0.00 37.83 36.25 2qcu s LYS 132 CO 0.33 -0.96 2.16 -1.00 -0.92 0.00 0.00 175.35 174.96 2qcu h PRO 133 N 1.65 0.00 -0.05 -1.68 0.13 -1.91 -1.73 132.00 128.40 2qcu h PRO 133 Ca -0.50 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2qcu h PRO 133 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2qcu h PRO 133 CO 0.58 0.01 0.07 1.05 -0.23 0.00 0.00 178.00 179.48 2qcu h GLU 134 N 0.00 0.00 -5.55 0.86 9.09 -1.98 -3.39 114.58 113.61 2qcu h GLU 134 Ca -0.00 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 58.81 2qcu h GLU 134 Cb 0.01 0.00 -0.11 0.00 -1.65 0.00 0.00 28.75 27.01 2qcu h GLU 134 CO 0.00 0.00 0.10 0.42 0.05 0.00 0.00 179.01 179.58 2qcu s ILE 135 N -4.55 5.02 -0.02 -1.06 1.01 -0.65 -4.91 121.20 116.05 2qcu s ILE 135 Ca -0.05 1.10 0.04 0.00 0.00 0.00 0.00 60.65 61.74 2qcu s ILE 135 Cb 0.15 -3.91 -0.06 0.00 0.01 0.00 0.00 42.46 38.65 2qcu s ILE 135 CO 0.52 0.09 0.06 0.29 0.00 0.00 0.00 174.94 175.89 2qcu n LYS 136 N 5.32 1.47 -4.20 2.79 4.76 -1.26 -4.68 118.16 122.35 2qcu n LYS 136 Ca -0.02 -0.02 -0.16 0.00 -2.87 0.00 0.00 58.31 55.24 2qcu n LYS 136 Cb 0.49 -1.10 -0.11 0.00 -1.84 0.00 0.00 35.03 32.48 2qcu n LYS 136 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2qcu s ARG 137 N -2.20 0.92 0.00 1.97 3.52 -1.26 -0.59 118.95 121.31 2qcu s ARG 137 Ca -0.02 -1.20 0.00 0.00 -0.13 0.00 0.00 55.73 54.38 2qcu s ARG 137 Cb 0.02 -0.66 0.00 0.00 -1.56 0.00 0.00 34.95 32.75 2qcu s ARG 137 CO 0.16 0.11 0.00 0.41 -0.81 0.00 0.00 175.30 175.17 2qcu n GLY 138 N 0.50 1.42 3.10 8.12 0.00 -0.44 -0.87 105.19 117.02 2qcu n GLY 138 Ca -0.15 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 2qcu n GLY 138 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qcu s PHE 139 N -4.94 0.23 -0.01 1.61 0.08 -0.18 -0.93 117.98 113.83 2qcu s PHE 139 Ca 0.00 -0.54 0.00 0.00 0.12 0.00 0.00 56.93 56.51 2qcu s PHE 139 Cb 0.00 -0.16 0.01 0.00 -0.57 0.00 0.00 43.02 42.30 2qcu s PHE 139 CO 0.00 -0.35 -0.01 -2.00 -0.10 0.00 0.00 175.22 172.76 2qcu s GLU 140 N -2.60 0.18 0.24 0.44 2.12 0.08 0.12 118.70 119.29 2qcu s GLU 140 Ca -0.05 0.01 -0.06 0.00 0.36 0.00 0.00 54.97 55.22 2qcu s GLU 140 Cb -0.01 -0.28 -0.02 0.00 0.26 0.00 0.00 34.13 34.08 2qcu s GLU 140 CO -0.05 -0.04 0.34 1.52 -0.54 0.00 0.00 175.26 176.49 2qcu s TYR 141 N 0.45 0.79 -0.03 5.30 1.13 -0.63 -0.57 117.35 123.80 2qcu s TYR 141 Ca -0.04 -1.07 -0.04 0.00 -1.41 0.00 0.00 57.07 54.51 2qcu s TYR 141 Cb -0.07 -0.15 -0.04 0.00 -1.10 0.00 0.00 41.96 40.60 2qcu s TYR 141 CO -0.01 -0.88 0.19 -1.12 -2.51 0.00 0.00 175.55 171.22 2qcu s SER 142 N -3.11 6.39 0.00 -0.18 0.01 -1.26 -0.54 113.70 115.01 2qcu s SER 142 Ca 0.30 0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.96 2qcu s SER 142 Cb 0.02 -2.03 0.00 0.00 0.21 0.00 0.00 66.02 64.23 2qcu s SER 142 CO 0.12 0.29 0.00 0.47 0.41 0.00 0.00 173.24 174.53 2qcu n ASP 143 N 1.16 0.00 -4.16 2.44 8.00 -0.69 -4.96 116.55 118.34 2qcu n ASP 143 Ca -0.13 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.24 2qcu n ASP 143 Cb 0.53 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.52 2qcu n ASP 143 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qcu s TRP 145 N -2.44 2.91 -0.06 0.00 -0.00 -0.10 -0.96 118.94 118.30 2qcu s TRP 145 Ca 0.04 -0.04 -0.07 0.00 -0.00 0.00 0.00 56.10 56.03 2qcu s TRP 145 Cb -0.03 -1.58 0.02 0.00 -0.00 0.00 0.00 33.47 31.88 2qcu s TRP 145 CO -0.01 0.41 0.19 0.54 -0.00 0.00 0.00 176.95 178.09 2qcu s VAL 146 N -1.10 0.02 -0.86 5.86 0.11 0.90 -1.79 120.40 123.55 2qcu s VAL 146 Ca 0.20 -0.16 -0.25 0.00 -2.93 0.00 0.00 61.98 58.83 2qcu s VAL 146 Cb -0.11 -0.33 0.03 0.00 -1.53 0.00 0.00 36.38 34.43 2qcu s VAL 146 CO 0.11 -0.09 1.48 -0.62 -3.33 0.00 0.00 175.10 172.65 2qcu s ASP 147 N -0.26 6.11 0.15 3.54 -1.08 -0.69 -4.57 116.67 119.87 2qcu s ASP 147 Ca -0.04 -0.81 -0.18 0.00 -0.52 0.00 0.00 52.55 51.00 2qcu s ASP 147 Cb -0.03 -2.56 0.04 0.00 -1.46 0.00 0.00 42.92 38.91 2qcu s ASP 147 CO 0.01 -1.85 1.70 -2.24 0.52 0.00 0.00 175.17 173.31 2qcu h ASP 148 N 10.55 -0.17 0.26 -0.34 3.04 -1.90 -1.07 116.42 126.78 2qcu h ASP 148 Ca -0.04 0.08 -0.10 0.00 -3.24 0.00 0.00 57.03 53.73 2qcu h ASP 148 Cb 1.04 0.14 -0.01 0.00 -1.04 0.00 0.00 39.33 39.46 2qcu h ASP 148 CO 1.33 -0.05 -0.39 0.00 -2.04 0.00 0.00 179.24 178.09 2qcu h ALA 149 N 1.27 1.18 0.00 4.15 0.00 -1.84 -2.13 119.26 121.89 2qcu h ALA 149 Ca 0.15 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2qcu h ALA 149 Cb 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2qcu h ALA 149 CO -0.27 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2qcu h ARG 150 N 0.15 0.00 -0.37 0.00 3.08 -1.54 -2.16 114.38 113.54 2qcu h ARG 150 Ca 0.02 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 2qcu h ARG 150 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 2qcu h ARG 150 CO 0.06 0.00 -0.16 1.25 -1.07 0.00 0.00 179.97 180.04 2qcu h LEU 151 N 0.00 0.79 -0.42 3.04 5.85 -0.57 -0.22 115.31 123.78 2qcu h LEU 151 Ca 0.00 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 2qcu h LEU 151 Cb 0.92 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 2qcu h LEU 151 CO 0.00 1.01 0.18 0.58 -0.34 0.00 0.00 178.44 179.87 2qcu h VAL 152 N 0.56 1.19 -0.72 1.05 2.07 -1.38 -2.15 116.25 116.88 2qcu h VAL 152 Ca 0.09 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.09 2qcu h VAL 152 Cb 0.71 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 2qcu h VAL 152 CO 0.05 0.21 0.43 0.25 0.02 0.00 0.00 177.57 178.53 2qcu h LEU 153 N 0.54 0.66 -0.39 2.57 7.12 -1.25 -0.58 115.31 123.97 2qcu h LEU 153 Ca 0.14 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 58.16 2qcu h LEU 153 Cb 0.16 -0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 40.16 2qcu h LEU 153 CO -0.01 0.43 0.21 0.00 -0.13 0.00 0.00 178.44 178.94 2qcu h ALA 154 N 1.35 0.50 -0.70 1.25 0.00 -0.83 0.37 119.26 121.19 2qcu h ALA 154 Ca 0.31 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2qcu h ALA 154 Cb 0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2qcu h ALA 154 CO -0.16 0.02 0.28 -0.91 0.00 0.00 0.00 179.25 178.48 2qcu h ASN 155 N 0.50 0.94 -0.73 0.00 2.35 -0.65 -1.57 115.58 116.43 2qcu h ASN 155 Ca 0.14 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.69 2qcu h ASN 155 Cb 0.06 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 2qcu h ASN 155 CO -0.02 0.84 0.20 0.00 -1.65 0.00 0.00 177.43 176.80 2qcu h ALA 156 N 1.30 0.96 -0.94 -0.83 0.00 -0.36 -1.01 119.26 118.37 2qcu h ALA 156 Ca 0.23 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2qcu h ALA 156 Cb 0.19 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 2qcu h ALA 156 CO -0.02 0.66 0.62 1.96 0.00 0.00 0.00 179.25 182.47 2qcu h GLN 157 N 1.09 1.11 -0.34 0.00 4.20 -0.76 -2.75 115.11 117.66 2qcu h GLN 157 Ca 0.23 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.84 2qcu h GLN 157 Cb 0.35 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 2qcu h GLN 157 CO -0.00 0.74 0.08 1.98 -0.67 0.00 0.00 178.83 180.95 2qcu h MET 158 N 1.14 0.55 -0.71 1.46 4.05 -0.50 0.11 114.93 121.04 2qcu h MET 158 Ca 0.39 -0.13 0.11 0.00 -0.28 0.00 0.00 59.70 59.78 2qcu h MET 158 Cb 0.08 -0.07 -0.12 0.00 -0.80 0.00 0.00 31.60 30.69 2qcu h MET 158 CO -0.13 0.60 -0.39 0.28 0.23 0.00 0.00 176.91 177.50 2qcu h VAL 159 N 0.40 0.09 -0.38 -5.77 2.07 -0.93 -1.30 116.25 110.43 2qcu h VAL 159 Ca 0.11 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.54 2qcu h VAL 159 Cb 0.30 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 2qcu h VAL 159 CO 0.00 0.00 -0.11 0.58 0.02 0.00 0.00 177.57 178.06 2qcu h VAL 160 N -0.13 1.25 -0.54 2.57 2.07 -1.23 0.14 116.25 120.37 2qcu h VAL 160 Ca 0.24 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.56 2qcu h VAL 160 Cb 0.56 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2qcu h VAL 160 CO -0.77 0.38 0.01 -0.09 0.02 0.00 0.00 177.57 177.12 2qcu h ARG 161 N 0.62 0.92 -0.06 1.57 2.43 -0.62 -1.16 114.38 118.08 2qcu h ARG 161 Ca 0.11 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2qcu h ARG 161 Cb 0.55 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2qcu h ARG 161 CO 0.03 0.90 0.00 1.63 -1.51 0.00 0.00 179.97 181.02 2qcu n LYS 162 N -4.20 1.19 -0.13 0.20 4.76 -0.52 -4.89 118.16 114.56 2qcu n LYS 162 Ca 0.03 -0.29 0.00 0.00 -2.87 0.00 0.00 58.31 55.18 2qcu n LYS 162 Cb 0.31 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 2qcu n LYS 162 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qcu n GLY 163 N 0.78 0.65 3.87 0.72 0.00 -0.44 -4.78 105.19 105.99 2qcu n GLY 163 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2qcu n GLY 163 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qcu s GLY 164 N -1.33 1.71 -0.05 -0.02 0.00 0.45 -4.78 107.32 103.32 2qcu s GLY 164 Ca 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 44.72 43.74 2qcu s GLY 164 CO 0.00 -0.31 -0.21 1.85 0.00 0.00 0.00 173.10 174.43 2qcu s GLU 165 N -5.73 2.12 -0.07 2.90 2.12 -0.20 -4.14 118.70 115.70 2qcu s GLU 165 Ca 0.71 -0.77 0.03 0.00 0.36 0.00 0.00 54.97 55.30 2qcu s GLU 165 Cb -0.07 -1.84 0.01 0.00 0.26 0.00 0.00 34.13 32.49 2qcu s GLU 165 CO 0.53 0.34 -0.16 0.08 -0.54 0.00 0.00 175.26 175.51 2qcu s VAL 166 N -0.14 1.40 -0.10 3.70 1.01 -1.26 -1.00 120.40 124.01 2qcu s VAL 166 Ca -0.02 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2qcu s VAL 166 Cb -0.12 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.03 2qcu s VAL 166 CO 0.02 0.41 -0.14 -0.76 0.00 0.00 0.00 175.10 174.64 2qcu s LEU 167 N 0.55 1.64 0.54 3.92 1.43 -0.56 -4.98 118.68 121.22 2qcu s LEU 167 Ca -0.15 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 52.61 2qcu s LEU 167 Cb -0.16 -1.02 0.04 0.00 0.03 0.00 0.00 46.19 45.08 2qcu s LEU 167 CO 0.05 -0.00 0.45 0.42 0.23 0.00 0.00 176.35 177.50 2qcu s THR 168 N 1.05 1.75 -1.20 5.49 -4.23 -1.26 -0.89 115.64 116.35 2qcu s THR 168 Ca -0.06 -1.43 -0.06 0.00 -1.18 0.00 0.00 61.69 58.96 2qcu s THR 168 Cb -0.15 -2.18 0.04 0.00 1.34 0.00 0.00 72.50 71.56 2qcu s THR 168 CO -0.02 0.00 0.34 0.54 -0.54 0.00 0.00 174.62 174.94 2qcu n ARG 169 N -1.81 -3.16 -3.67 3.99 1.74 -0.11 -4.87 116.66 108.78 2qcu n ARG 169 Ca 0.01 0.53 -0.28 0.00 -0.77 0.00 0.00 57.85 57.33 2qcu n ARG 169 Cb 0.64 -5.21 -0.16 0.00 -1.02 0.00 0.00 32.46 26.71 2qcu n ARG 169 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2qcu s THR 170 N -2.83 0.38 -0.19 0.55 2.01 -0.16 -0.58 115.64 114.81 2qcu s THR 170 Ca 0.27 -0.81 -0.17 0.00 0.31 0.00 0.00 61.69 61.29 2qcu s THR 170 Cb -0.14 -1.14 -0.04 0.00 0.01 0.00 0.00 72.50 71.19 2qcu s THR 170 CO 0.33 -0.50 0.43 -0.60 -0.69 0.00 0.00 174.62 173.59 2qcu s ARG 171 N 1.89 4.19 0.22 4.92 3.52 -0.34 -2.90 118.95 130.45 2qcu s ARG 171 Ca 0.05 0.26 -0.30 0.00 -0.13 0.00 0.00 55.73 55.62 2qcu s ARG 171 Cb -0.17 -3.53 -0.08 0.00 -1.56 0.00 0.00 34.95 29.61 2qcu s ARG 171 CO -0.21 -0.04 1.08 0.00 -0.81 0.00 0.00 175.30 175.32 2qcu s ALA 172 N 1.31 3.38 -0.02 6.12 0.00 -1.26 -0.66 121.76 130.62 2qcu s ALA 172 Ca 0.21 0.82 0.05 0.00 0.00 0.00 0.00 51.96 53.04 2qcu s ALA 172 Cb -0.15 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 2qcu s ALA 172 CO 0.08 -0.15 0.09 0.25 0.00 0.00 0.00 175.76 176.02 2qcu n THR 173 N 1.91 0.13 -3.44 0.00 -2.24 0.12 -4.93 114.28 105.83 2qcu n THR 173 Ca 0.01 -0.16 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2qcu n THR 173 Cb 0.46 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 2qcu n THR 173 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2qcu s SER 174 N -2.99 -0.59 -0.07 3.42 1.04 -1.07 -4.62 113.70 108.83 2qcu s SER 174 Ca -0.02 0.15 -0.03 0.00 0.48 0.00 0.00 55.95 56.53 2qcu s SER 174 Cb 0.03 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.78 2qcu s SER 174 CO 0.22 -0.89 0.14 0.00 0.98 0.00 0.00 173.24 173.69 2qcu s ALA 175 N -3.22 -0.21 0.01 5.32 0.00 -0.82 -0.90 121.76 121.95 2qcu s ALA 175 Ca -0.01 0.62 -0.06 0.00 0.00 0.00 0.00 51.96 52.51 2qcu s ALA 175 Cb -0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 23.12 22.55 2qcu s ALA 175 CO -0.08 -0.28 0.10 -0.98 0.00 0.00 0.00 175.76 174.52 2qcu s ARG 176 N 1.51 0.47 -0.21 0.00 1.70 -0.84 -4.39 118.95 117.19 2qcu s ARG 176 Ca -0.05 -0.49 -0.17 0.00 -0.47 0.00 0.00 55.73 54.55 2qcu s ARG 176 Cb -0.12 0.19 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 2qcu s ARG 176 CO -0.06 -0.11 0.46 1.03 -1.08 0.00 0.00 175.30 175.54 2qcu s ARG 177 N -1.56 4.17 -0.05 3.89 0.52 -1.26 -0.96 118.95 123.69 2qcu s ARG 177 Ca -0.14 0.30 0.01 0.00 -0.52 0.00 0.00 55.73 55.38 2qcu s ARG 177 Cb -0.07 -3.56 0.02 0.00 0.52 0.00 0.00 34.95 31.86 2qcu s ARG 177 CO 0.00 -0.12 -0.04 -1.21 0.02 0.00 0.00 175.30 173.95 2qcu s GLU 178 N 1.56 0.84 -1.46 3.54 2.02 0.27 -4.89 118.70 120.58 2qcu s GLU 178 Ca 0.21 -0.09 -0.06 0.00 0.02 0.00 0.00 54.97 55.05 2qcu s GLU 178 Cb -0.15 -0.88 0.03 0.00 0.10 0.00 0.00 34.13 33.22 2qcu s GLU 178 CO 0.09 -0.11 0.54 0.09 0.02 0.00 0.00 175.26 175.89 2qcu n ASN 179 N 4.17 -5.25 0.00 -0.19 3.02 -1.26 -2.35 115.26 113.40 2qcu n ASN 179 Ca -0.23 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.03 2qcu n ASN 179 Cb 0.51 -4.28 0.00 0.00 -0.61 0.00 0.00 39.78 35.40 2qcu n ASN 179 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qcu n GLY 180 N -1.37 0.77 3.32 7.41 0.00 -1.26 -5.03 105.19 109.02 2qcu n GLY 180 Ca -0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.75 2qcu n GLY 180 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qcu s LEU 181 N 0.00 2.50 0.20 0.99 1.43 -0.99 -4.04 118.68 118.77 2qcu s LEU 181 Ca 0.00 -0.94 -0.26 0.00 -1.03 0.00 0.00 54.13 51.90 2qcu s LEU 181 Cb 0.00 -0.67 -0.08 0.00 0.03 0.00 0.00 46.19 45.46 2qcu s LEU 181 CO 0.00 -0.14 0.83 0.26 0.23 0.00 0.00 176.35 177.53 2qcu s TRP 182 N -2.59 3.89 -0.26 0.29 0.52 0.40 -0.56 118.94 120.63 2qcu s TRP 182 Ca 0.18 1.70 -0.05 0.00 0.02 0.00 0.00 56.10 57.95 2qcu s TRP 182 Cb -0.03 -2.82 -0.00 0.00 -1.15 0.00 0.00 33.47 29.47 2qcu s TRP 182 CO 0.06 0.46 0.02 0.42 0.02 0.00 0.00 176.95 177.93 2qcu s ILE 183 N -1.23 3.75 -0.15 2.03 1.09 -0.13 -1.05 121.20 125.52 2qcu s ILE 183 Ca 0.39 -0.53 -0.01 0.00 -1.10 0.00 0.00 60.65 59.40 2qcu s ILE 183 Cb -0.23 -2.82 -0.01 0.00 -1.06 0.00 0.00 42.46 38.34 2qcu s ILE 183 CO 0.27 0.26 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.56 2qcu s VAL 184 N 1.50 3.04 -0.00 2.92 1.01 0.34 -1.99 120.40 127.22 2qcu s VAL 184 Ca 0.04 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.39 2qcu s VAL 184 Cb -0.16 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 2qcu s VAL 184 CO 0.00 0.51 -0.02 -1.61 0.00 0.00 0.00 175.10 173.98 2qcu s GLU 185 N 0.57 2.72 0.12 2.72 2.02 -0.08 -1.18 118.70 125.60 2qcu s GLU 185 Ca -0.08 -0.63 -0.12 0.00 0.02 0.00 0.00 54.97 54.16 2qcu s GLU 185 Cb -0.16 -2.62 0.01 0.00 0.10 0.00 0.00 34.13 31.46 2qcu s GLU 185 CO 0.03 0.62 0.31 0.00 0.02 0.00 0.00 175.26 176.24 2qcu s ALA 186 N -1.05 -0.48 0.01 5.21 0.00 -0.74 0.16 121.76 124.87 2qcu s ALA 186 Ca 0.18 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.71 2qcu s ALA 186 Cb -0.11 0.66 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 2qcu s ALA 186 CO 0.09 -0.61 -0.03 -1.83 0.00 0.00 0.00 175.76 173.38 2qcu s GLU 187 N -3.86 0.26 0.04 0.00 -1.05 0.16 -0.34 118.70 113.91 2qcu s GLU 187 Ca 0.07 -0.36 -0.30 0.00 -0.15 0.00 0.00 54.97 54.22 2qcu s GLU 187 Cb 0.03 -0.08 -0.07 0.00 -0.44 0.00 0.00 34.13 33.57 2qcu s GLU 187 CO -0.09 0.01 1.59 0.34 0.95 0.00 0.00 175.26 178.07 2qcu s ASP 188 N -0.77 6.67 0.30 0.83 2.15 0.31 -1.20 116.67 124.96 2qcu s ASP 188 Ca -0.07 2.37 0.25 0.00 0.43 0.00 0.00 52.55 55.54 2qcu s ASP 188 Cb -0.05 -2.56 0.98 0.00 -0.30 0.00 0.00 42.92 40.99 2qcu s ASP 188 CO -0.00 -0.85 1.76 0.16 -0.17 0.00 0.00 175.17 176.07 2qcu h ILE 189 N 4.91 0.00 0.00 4.11 3.07 -1.15 -1.78 117.51 126.67 2qcu h ILE 189 Ca -0.41 -0.35 -0.37 0.00 1.55 0.00 0.00 64.86 65.28 2qcu h ILE 189 Cb 1.19 1.18 -0.06 0.00 -0.27 0.00 0.00 36.82 38.86 2qcu h ILE 189 CO 0.93 0.00 -2.20 0.47 -1.05 0.00 0.00 178.15 176.29 2qcu n ASP 190 N -2.39 1.95 -0.02 2.16 8.00 -1.26 -4.72 116.55 120.27 2qcu n ASP 190 Ca 0.03 0.35 0.11 0.00 0.71 0.00 0.00 54.79 55.98 2qcu n ASP 190 Cb 0.29 -0.82 0.01 0.00 -0.02 0.00 0.00 41.12 40.59 2qcu n ASP 190 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2qcu n THR 191 N -4.30 0.00 -0.88 -3.53 -2.24 -1.23 -4.97 114.28 97.14 2qcu n THR 191 Ca -0.46 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2qcu n THR 191 Cb 0.81 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.80 2qcu n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qcu n GLY 192 N 1.49 0.53 3.67 3.38 0.00 -0.67 -4.97 105.19 108.62 2qcu n GLY 192 Ca 0.05 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.57 2qcu n GLY 192 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qcu n LYS 193 N -1.85 1.83 -3.60 1.61 4.81 -1.26 -4.59 118.16 115.11 2qcu n LYS 193 Ca 0.00 0.67 -0.34 0.00 -0.87 0.00 0.00 58.31 57.77 2qcu n LYS 193 Cb 0.06 -2.43 -0.05 0.00 0.02 0.00 0.00 35.03 32.63 2qcu n LYS 193 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2qcu s LYS 194 N 2.62 3.71 0.13 1.64 -0.14 -1.26 -0.53 119.74 125.91 2qcu s LYS 194 Ca 0.89 0.09 0.07 0.00 -1.36 0.00 0.00 55.97 55.66 2qcu s LYS 194 Cb -0.80 -2.94 -0.04 0.00 -1.68 0.00 0.00 37.83 32.37 2qcu s LYS 194 CO 0.50 0.53 -0.16 0.71 -0.76 0.00 0.00 175.35 176.17 2qcu s TYR 195 N -1.48 1.57 -0.07 3.18 2.02 0.54 -4.99 117.35 118.12 2qcu s TYR 195 Ca 0.35 -0.51 -0.03 0.00 -0.37 0.00 0.00 57.07 56.52 2qcu s TYR 195 Cb -0.13 -0.82 0.04 0.00 -0.40 0.00 0.00 41.96 40.65 2qcu s TYR 195 CO 0.20 0.21 0.14 0.45 -1.57 0.00 0.00 175.55 174.98 2qcu s SER 196 N -2.43 0.07 0.20 2.29 0.15 -1.26 -1.80 113.70 110.92 2qcu s SER 196 Ca 0.10 0.29 0.09 0.00 0.70 0.00 0.00 55.95 57.14 2qcu s SER 196 Cb -0.06 0.19 -0.05 0.00 -1.71 0.00 0.00 66.02 64.40 2qcu s SER 196 CO 0.04 -0.17 -0.17 0.26 1.20 0.00 0.00 173.24 174.41 2qcu s TRP 197 N 1.39 1.88 -0.02 3.44 0.51 -0.33 -4.97 118.94 120.84 2qcu s TRP 197 Ca -0.07 -0.48 -0.02 0.00 -2.12 0.00 0.00 56.10 53.40 2qcu s TRP 197 Cb -0.12 -0.88 -0.04 0.00 -0.81 0.00 0.00 33.47 31.62 2qcu s TRP 197 CO -0.06 0.42 0.14 -0.65 -0.51 0.00 0.00 176.95 176.29 2qcu s GLN 198 N -3.30 3.31 0.01 4.98 -0.21 -1.08 -0.50 119.66 122.87 2qcu s GLN 198 Ca 0.22 -0.35 -0.07 0.00 0.02 0.00 0.00 55.36 55.17 2qcu s GLN 198 Cb -0.03 -3.02 -0.00 0.00 1.00 0.00 0.00 33.01 30.95 2qcu s GLN 198 CO 0.08 0.68 0.13 0.00 -2.12 0.00 0.00 175.29 174.07 2qcu s ALA 199 N -1.23 -0.27 -0.39 6.09 0.00 -0.22 -0.80 121.76 124.94 2qcu s ALA 199 Ca 0.24 -0.24 0.26 0.00 0.00 0.00 0.00 51.96 52.21 2qcu s ALA 199 Cb -0.12 0.16 0.64 0.00 0.00 0.00 0.00 23.12 23.79 2qcu s ALA 199 CO 0.15 -0.24 1.71 0.00 0.00 0.00 0.00 175.76 177.38 2qcu h ARG 200 N 4.07 0.00 -2.08 0.00 3.08 -1.02 0.11 114.38 118.55 2qcu h ARG 200 Ca -0.31 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.68 2qcu h ARG 200 Cb 1.19 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.05 2qcu h ARG 200 CO 0.43 0.00 0.17 0.20 -1.07 0.00 0.00 179.97 179.70 2qcu s GLY 201 N -4.07 -0.56 -0.02 0.04 0.00 -0.78 -3.68 107.32 98.25 2qcu s GLY 201 Ca 0.06 1.24 0.03 0.00 0.00 0.00 0.00 44.72 46.05 2qcu s GLY 201 CO 0.62 0.89 -0.10 -2.27 0.00 0.00 0.00 173.10 172.24 2qcu s LEU 202 N -1.25 1.85 -0.15 0.66 2.96 -0.85 -1.96 118.68 119.94 2qcu s LEU 202 Ca -0.11 -0.20 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 2qcu s LEU 202 Cb -0.00 -0.59 0.01 0.00 0.50 0.00 0.00 46.19 46.11 2qcu s LEU 202 CO 0.09 0.09 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.32 2qcu s VAL 203 N 0.09 2.23 -0.92 1.68 1.01 -0.08 -1.25 120.40 123.16 2qcu s VAL 203 Ca -0.02 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 60.93 2qcu s VAL 203 Cb -0.08 -1.91 0.24 0.00 0.00 0.00 0.00 36.38 34.63 2qcu s VAL 203 CO 0.00 0.54 0.88 0.21 0.00 0.00 0.00 175.10 176.73 2qcu s ASN 204 N 0.84 6.91 -0.73 3.32 2.47 -0.07 -0.98 114.94 126.70 2qcu s ASN 204 Ca -0.06 -3.02 0.01 0.00 0.42 0.00 0.00 52.86 50.20 2qcu s ASN 204 Cb -0.15 -2.20 0.37 0.00 -1.45 0.00 0.00 41.25 37.82 2qcu s ASN 204 CO -0.02 -0.46 1.68 0.00 -3.72 0.00 0.00 177.10 174.57 2qcu n ALA 205 N 3.50 5.95 -0.12 1.71 0.00 -0.24 -1.53 120.51 129.78 2qcu n ALA 205 Ca 0.17 -4.26 0.08 0.00 0.00 0.00 0.00 53.44 49.43 2qcu n ALA 205 Cb 0.44 -1.51 0.28 0.00 0.00 0.00 0.00 19.45 18.67 2qcu n ALA 205 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qcu n THR 206 N -0.46 1.35 0.00 0.00 -2.24 -1.23 -4.37 114.28 107.33 2qcu n THR 206 Ca 0.48 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 2qcu n THR 206 Cb 0.37 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 2qcu n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qcu n GLY 207 N 1.05 3.35 0.33 3.38 0.00 -1.26 -1.38 105.19 110.67 2qcu n GLY 207 Ca 0.21 -0.12 0.18 0.00 0.00 0.00 0.00 46.02 46.29 2qcu n GLY 207 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qcu h PRO 208 N 0.00 0.00 -0.30 1.61 0.11 -1.93 -1.46 132.00 130.03 2qcu h PRO 208 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2qcu h PRO 208 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2qcu h PRO 208 CO 0.00 0.00 0.00 0.91 -0.21 0.00 0.00 178.00 178.70 2qcu n TRP 209 N -3.38 0.39 -0.28 0.65 8.01 -0.48 -4.63 117.44 117.72 2qcu n TRP 209 Ca -0.01 -0.20 -0.05 0.00 -1.31 0.00 0.00 57.50 55.93 2qcu n TRP 209 Cb 0.22 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.58 2qcu n TRP 209 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.69 176.44 2qcu h VAL 210 N 2.80 1.23 -0.15 -0.99 3.04 -1.38 0.16 116.25 120.97 2qcu h VAL 210 Ca 0.00 -0.60 -0.16 0.00 -1.01 0.00 0.00 66.70 64.92 2qcu h VAL 210 Cb 0.62 0.24 0.01 0.00 -2.01 0.00 0.00 31.29 30.15 2qcu h VAL 210 CO 0.00 0.26 -0.54 0.50 -1.01 0.00 0.00 177.57 176.78 2qcu h LYS 211 N 1.05 0.63 -0.99 4.17 3.64 -1.84 -2.90 116.57 120.33 2qcu h LYS 211 Ca 0.26 -0.48 0.16 0.00 -1.27 0.00 0.00 60.65 59.33 2qcu h LYS 211 Cb 0.06 0.09 -0.10 0.00 -0.41 0.00 0.00 32.23 31.87 2qcu h LYS 211 CO -0.04 1.10 0.60 0.37 -2.27 0.00 0.00 179.45 179.21 2qcu h GLN 212 N 0.29 0.80 -0.47 1.90 -0.00 -1.69 -0.46 115.11 115.48 2qcu h GLN 212 Ca -0.03 -0.05 -0.10 0.00 -0.00 0.00 0.00 58.65 58.47 2qcu h GLN 212 Cb 1.17 -0.18 -0.02 0.00 0.00 0.00 0.00 27.48 28.45 2qcu h GLN 212 CO 0.11 0.53 -0.13 0.35 0.00 0.00 0.00 178.83 179.70 2qcu h PHE 213 N 0.82 0.97 -0.37 3.99 3.57 -0.61 0.18 116.94 125.50 2qcu h PHE 213 Ca 0.54 -0.19 0.05 0.00 3.53 0.00 0.00 57.97 61.90 2qcu h PHE 213 Cb 0.75 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.20 2qcu h PHE 213 CO -0.01 0.94 0.09 0.74 -2.23 0.00 0.00 178.31 177.84 2qcu h PHE 214 N 0.78 0.15 -0.11 0.41 0.04 -1.09 0.91 116.94 118.03 2qcu h PHE 214 Ca 0.12 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.80 2qcu h PHE 214 Cb 0.65 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.79 2qcu h PHE 214 CO 0.04 0.03 -0.40 -0.44 -0.60 0.00 0.00 178.31 176.94 2qcu h ASP 215 N 0.22 0.55 0.00 2.17 3.32 -0.63 -0.82 116.42 121.22 2qcu h ASP 215 Ca 0.18 -0.61 -0.27 0.00 0.02 0.00 0.00 57.03 56.34 2qcu h ASP 215 Cb 0.19 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.53 2qcu h ASP 215 CO -0.22 1.07 -2.12 0.47 -1.72 0.00 0.00 179.24 176.72 2qcu n ASP 216 N -4.32 0.83 -0.05 6.45 8.00 0.59 -3.77 116.55 124.28 2qcu n ASP 216 Ca -0.08 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.30 2qcu n ASP 216 Cb 0.54 1.03 -0.14 0.00 -0.02 0.00 0.00 41.12 42.53 2qcu n ASP 216 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qcu n GLY 217 N 1.90 -0.83 0.00 0.44 0.00 0.23 -4.70 105.19 102.23 2qcu n GLY 217 Ca -0.25 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2qcu n GLY 217 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2qcu n MET 218 N -3.10 4.46 -4.17 1.61 2.81 -0.70 -1.94 117.12 116.08 2qcu n MET 218 Ca -0.27 0.00 -0.33 0.00 -1.81 0.00 0.00 57.70 55.29 2qcu n MET 218 Cb 1.07 -0.57 -0.04 0.00 -0.71 0.00 0.00 33.22 32.98 2qcu n MET 218 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2qcu n HIS 219 N -0.97 -1.62 -4.39 2.03 -0.00 -0.37 -4.92 115.22 104.99 2qcu n HIS 219 Ca 0.00 0.75 -0.28 0.00 -0.00 0.00 0.00 57.72 58.20 2qcu n HIS 219 Cb 0.00 -3.11 -0.13 0.00 -0.00 0.00 0.00 29.99 26.76 2qcu n HIS 219 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2qcu s LEU 220 N -7.19 2.35 0.03 2.41 1.43 -0.83 -5.03 118.68 111.85 2qcu s LEU 220 Ca 0.43 -0.78 -0.30 0.00 -1.03 0.00 0.00 54.13 52.45 2qcu s LEU 220 Cb -0.24 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.77 2qcu s LEU 220 CO 0.93 0.14 1.19 -2.16 0.23 0.00 0.00 176.35 176.68 2qcu s PRO 221 N -2.24 4.42 0.24 1.29 0.04 -1.26 -4.29 135.00 133.20 2qcu s PRO 221 Ca 0.15 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 62.62 2qcu s PRO 221 Cb -0.09 -3.40 -0.10 0.00 0.04 0.00 0.00 34.50 30.94 2qcu s PRO 221 CO 0.07 -0.28 1.44 0.45 0.04 0.00 0.00 177.00 178.72 2qcu s SER 222 N 1.16 6.66 0.46 6.66 0.15 -1.26 -4.92 113.70 122.60 2qcu s SER 222 Ca 0.58 2.65 0.22 0.00 0.70 0.00 0.00 55.95 60.10 2qcu s SER 222 Cb -0.28 -2.62 1.10 0.00 -1.71 0.00 0.00 66.02 62.52 2qcu s SER 222 CO 0.28 -0.71 1.94 1.55 1.20 0.00 0.00 173.24 177.50 2qcu h PRO 223 N 5.19 0.00 -4.67 5.44 0.13 -2.00 -3.45 132.00 132.63 2qcu h PRO 223 Ca -0.46 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.41 2qcu h PRO 223 Cb 1.22 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 2qcu h PRO 223 CO 0.79 0.22 -0.63 0.71 -0.23 0.00 0.00 178.00 178.86 2qcu s TYR 224 N -4.05 1.22 -0.50 1.56 2.02 -1.26 -5.11 117.35 111.23 2qcu s TYR 224 Ca -0.02 -1.24 0.22 0.00 -0.37 0.00 0.00 57.07 55.66 2qcu s TYR 224 Cb 0.13 -0.66 -0.20 0.00 -0.40 0.00 0.00 41.96 40.82 2qcu s TYR 224 CO 0.64 -0.46 0.76 0.41 -1.57 0.00 0.00 175.55 175.33 2qcu n GLY 225 N -0.29 -1.06 2.30 0.71 0.00 -1.26 -4.90 105.19 100.70 2qcu n GLY 225 Ca -0.01 -0.51 -0.00 0.00 0.00 0.00 0.00 46.02 45.49 2qcu n GLY 225 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qcu n ILE 226 N -1.95-10.72 -3.47 -0.61 3.06 -1.26 -4.87 119.36 99.54 2qcu n ILE 226 Ca 0.00 2.53 -0.39 0.00 -2.50 0.00 0.00 62.75 62.38 2qcu n ILE 226 Cb 0.46 -5.18 -0.10 0.00 0.54 0.00 0.00 39.64 35.36 2qcu n ILE 226 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 2qcu s ARG 227 N -0.48 3.78 -0.44 9.51 1.81 -0.41 -4.85 118.95 127.86 2qcu s ARG 227 Ca -0.01 -0.31 -0.22 0.00 -1.72 0.00 0.00 55.73 53.48 2qcu s ARG 227 Cb 0.00 -3.73 0.03 0.00 -0.45 0.00 0.00 34.95 30.80 2qcu s ARG 227 CO 0.02 -0.35 0.70 -0.51 -0.68 0.00 0.00 175.30 174.47 2qcu s LEU 228 N 1.91 4.41 -0.31 2.53 1.43 -1.25 -3.30 118.68 124.10 2qcu s LEU 228 Ca 0.10 -0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 52.93 2qcu s LEU 228 Cb -0.16 -2.81 0.06 0.00 0.03 0.00 0.00 46.19 43.30 2qcu s LEU 228 CO 0.11 -0.84 0.00 -0.63 0.23 0.00 0.00 176.35 175.23 2qcu s ILE 229 N 3.00 2.85 0.34 -0.59 -1.09 -0.86 -1.27 121.20 123.58 2qcu s ILE 229 Ca 0.25 -1.53 -0.28 0.00 -2.23 0.00 0.00 60.65 56.86 2qcu s ILE 229 Cb -0.13 -2.70 -0.09 0.00 -1.58 0.00 0.00 42.46 37.95 2qcu s ILE 229 CO 0.20 -0.17 1.20 -0.75 -1.23 0.00 0.00 174.94 174.19 2qcu s LYS 230 N 1.20 4.33 0.01 2.79 2.20 0.45 -1.03 119.74 129.69 2qcu s LYS 230 Ca -0.04 1.98 0.01 0.00 -0.36 0.00 0.00 55.97 57.56 2qcu s LYS 230 Cb -0.20 -2.97 -0.01 0.00 -1.51 0.00 0.00 37.83 33.14 2qcu s LYS 230 CO -0.02 -0.13 -0.05 0.20 -0.36 0.00 0.00 175.35 174.99 2qcu s GLY 231 N -0.82 0.27 0.24 5.54 0.00 -0.40 -1.22 107.32 110.92 2qcu s GLY 231 Ca 0.51 -0.35 0.08 0.00 0.00 0.00 0.00 44.72 44.95 2qcu s GLY 231 CO 0.45 -0.36 -0.12 -0.56 0.00 0.00 0.00 173.10 172.51 2qcu s SER 232 N -0.60 2.72 0.08 1.64 0.01 -1.26 -1.64 113.70 114.65 2qcu s SER 232 Ca -0.03 -1.08 0.05 0.00 1.31 0.00 0.00 55.95 56.20 2qcu s SER 232 Cb -0.04 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 2qcu s SER 232 CO -0.00 -0.21 -0.14 -1.00 0.41 0.00 0.00 173.24 172.29 2qcu s HIS 233 N -2.95 1.28 0.24 2.43 3.76 -0.06 -3.73 115.29 116.26 2qcu s HIS 233 Ca 0.26 -0.48 0.11 0.00 -0.15 0.00 0.00 55.06 54.79 2qcu s HIS 233 Cb 0.00 -0.71 -0.05 0.00 1.11 0.00 0.00 32.58 32.94 2qcu s HIS 233 CO 0.09 0.08 -0.13 0.96 -0.85 0.00 0.00 174.74 174.89 2qcu s ILE 234 N -1.46 2.87 -0.04 0.60 -4.36 -0.07 -1.97 121.20 116.77 2qcu s ILE 234 Ca 0.01 -2.04 0.04 0.00 -0.26 0.00 0.00 60.65 58.40 2qcu s ILE 234 Cb -0.09 -2.47 -0.00 0.00 1.25 0.00 0.00 42.46 41.15 2qcu s ILE 234 CO 0.02 -0.27 -0.15 -0.69 0.24 0.00 0.00 174.94 174.09 2qcu s VAL 235 N -2.11 1.28 0.10 8.37 1.01 0.76 -0.89 120.40 128.91 2qcu s VAL 235 Ca 0.27 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2qcu s VAL 235 Cb -0.07 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 2qcu s VAL 235 CO 0.15 0.37 -0.09 0.68 0.00 0.00 0.00 175.10 176.22 2qcu s VAL 236 N 0.08 0.86 0.37 2.92 -7.23 -0.73 -0.87 120.40 115.81 2qcu s VAL 236 Ca -0.04 -1.73 -0.25 0.00 -1.81 0.00 0.00 61.98 58.15 2qcu s VAL 236 Cb -0.11 -1.45 -0.12 0.00 0.56 0.00 0.00 36.38 35.26 2qcu s VAL 236 CO 0.02 -0.66 0.97 -2.65 -0.31 0.00 0.00 175.10 172.47 2qcu n PRO 237 N 0.37 1.29 -1.62 4.82 -0.02 -1.26 -0.71 135.00 137.86 2qcu n PRO 237 Ca -0.15 0.46 -0.54 0.00 -2.02 0.00 0.00 63.50 61.25 2qcu n PRO 237 Cb 0.59 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 2qcu n PRO 237 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2qcu n ARG 238 N 0.40 1.09 0.17 -0.52 0.63 -0.23 -4.39 116.66 113.81 2qcu n ARG 238 Ca 0.09 0.40 0.13 0.00 -0.92 0.00 0.00 57.85 57.55 2qcu n ARG 238 Cb 0.37 -2.04 0.41 0.00 0.45 0.00 0.00 32.46 31.65 2qcu n ARG 238 CO 0.00 0.00 0.00 -0.39 -2.51 0.00 0.00 177.63 174.73 2qcu h VAL 239 N 3.86 0.00 -2.87 5.15 -1.51 -1.87 -3.46 116.25 115.55 2qcu h VAL 239 Ca -0.47 -0.57 0.08 0.00 -1.23 0.00 0.00 66.70 64.50 2qcu h VAL 239 Cb 1.34 1.52 -0.04 0.00 -2.13 0.00 0.00 31.29 31.97 2qcu h VAL 239 CO 0.82 0.00 0.29 -1.38 -1.23 0.00 0.00 177.57 176.08 2qcu s HIS 240 N -3.28 -0.11 -1.61 5.19 0.00 -1.26 -4.94 115.29 109.27 2qcu s HIS 240 Ca 0.07 -0.36 0.16 0.00 -3.00 0.00 0.00 55.06 51.93 2qcu s HIS 240 Cb 0.09 0.72 0.55 0.00 -4.00 0.00 0.00 32.58 29.94 2qcu s HIS 240 CO 0.56 -1.22 1.44 0.25 -1.00 0.00 0.00 174.74 174.78 2qcu n THR 241 N -0.48 1.12 -2.66 -5.38 -2.24 -1.26 -4.97 114.28 98.41 2qcu n THR 241 Ca -0.05 -0.86 -0.34 0.00 -2.27 0.00 0.00 64.05 60.53 2qcu n THR 241 Cb 0.59 0.22 -0.05 0.00 -2.10 0.00 0.00 70.33 68.99 2qcu n THR 241 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qcu s GLN 242 N -1.50 4.04 0.41 -0.78 -0.21 -1.26 -4.97 119.66 115.39 2qcu s GLN 242 Ca 0.40 1.28 0.22 0.00 0.02 0.00 0.00 55.36 57.28 2qcu s GLN 242 Cb 0.23 -2.20 0.31 0.00 1.00 0.00 0.00 33.01 32.35 2qcu s GLN 242 CO 0.23 -0.22 1.59 0.87 -2.12 0.00 0.00 175.29 175.64 2qcu h LYS 243 N 1.86 0.00 -7.02 2.91 1.79 -1.98 -3.47 116.57 110.66 2qcu h LYS 243 Ca -0.49 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.49 2qcu h LYS 243 Cb 1.20 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.89 2qcu h LYS 243 CO 0.60 0.11 0.42 -0.65 -1.08 0.00 0.00 179.45 178.85 2qcu s GLN 244 N -3.17 3.87 0.51 3.15 1.11 -1.26 -4.72 119.66 119.15 2qcu s GLN 244 Ca 0.06 1.53 -0.07 0.00 0.01 0.00 0.00 55.36 56.90 2qcu s GLN 244 Cb 0.06 -2.31 -0.04 0.00 -1.01 0.00 0.00 33.01 29.71 2qcu s GLN 244 CO 0.68 -0.41 0.85 0.00 0.01 0.00 0.00 175.29 176.42 2qcu s ALA 245 N -1.75 3.32 0.02 6.09 0.00 0.77 -4.59 121.76 125.62 2qcu s ALA 245 Ca 0.64 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 52.28 2qcu s ALA 245 Cb -0.22 -2.72 -0.03 0.00 0.00 0.00 0.00 23.12 20.15 2qcu s ALA 245 CO 0.27 -0.42 -0.17 0.71 0.00 0.00 0.00 175.76 176.14 2qcu s TYR 246 N -2.84 2.59 -0.22 0.00 1.51 -0.30 -0.11 117.35 117.98 2qcu s TYR 246 Ca 0.50 -0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 56.30 2qcu s TYR 246 Cb -0.10 -1.50 0.01 0.00 -0.11 0.00 0.00 41.96 40.25 2qcu s TYR 246 CO 0.47 0.23 -0.09 -1.50 -1.11 0.00 0.00 175.55 173.55 2qcu s ILE 247 N -0.88 2.89 -0.23 2.71 2.07 -0.06 -0.66 121.20 127.06 2qcu s ILE 247 Ca 0.14 -0.74 -0.08 0.00 -1.41 0.00 0.00 60.65 58.56 2qcu s ILE 247 Cb -0.11 -2.33 -0.04 0.00 0.13 0.00 0.00 42.46 40.12 2qcu s ILE 247 CO 0.04 0.40 0.09 -0.76 -1.91 0.00 0.00 174.94 172.80 2qcu s LEU 248 N 1.39 3.69 -0.34 8.50 1.43 0.84 -3.89 118.68 130.30 2qcu s LEU 248 Ca 0.04 -0.06 -0.28 0.00 -1.03 0.00 0.00 54.13 52.80 2qcu s LEU 248 Cb -0.14 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 44.12 2qcu s LEU 248 CO -0.06 0.05 1.05 -1.10 0.23 0.00 0.00 176.35 176.52 2qcu s GLN 249 N 1.11 4.00 0.55 1.70 -0.21 -1.26 -1.25 119.66 124.30 2qcu s GLN 249 Ca 0.05 0.93 -0.01 0.00 0.02 0.00 0.00 55.36 56.35 2qcu s GLN 249 Cb -0.14 -3.76 0.03 0.00 1.00 0.00 0.00 33.01 30.13 2qcu s GLN 249 CO 0.04 -0.95 0.80 1.21 -2.12 0.00 0.00 175.29 174.27 2qcu s ASN 250 N 1.76 5.38 0.49 5.90 2.47 0.05 -4.98 114.94 126.01 2qcu s ASN 250 Ca 0.44 0.22 0.28 0.00 0.42 0.00 0.00 52.86 54.23 2qcu s ASN 250 Cb -0.12 -1.17 1.05 0.00 -1.45 0.00 0.00 41.25 39.55 2qcu s ASN 250 CO 0.17 -1.09 1.87 -0.33 -3.72 0.00 0.00 177.10 174.00 2qcu h GLU 251 N 0.02 0.00 -0.10 0.43 4.39 -1.96 -1.80 114.58 115.55 2qcu h GLU 251 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2qcu h GLU 251 Cb 1.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 2qcu h GLU 251 CO 0.56 0.10 0.00 -0.40 -1.16 0.00 0.00 179.01 178.11 2qcu n ASP 252 N -3.22 0.77 0.00 1.42 5.75 -1.26 -4.93 116.55 115.07 2qcu n ASP 252 Ca 0.01 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.08 2qcu n ASP 252 Cb 0.39 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 2qcu n ASP 252 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qcu n LYS 253 N -0.21 0.00 -1.73 0.11 4.76 -0.68 -5.02 118.16 115.39 2qcu n LYS 253 Ca 0.11 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.25 2qcu n LYS 253 Cb 0.16 -2.63 0.06 0.00 -1.84 0.00 0.00 35.03 30.77 2qcu n LYS 253 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2qcu s ARG 254 N -0.12 2.73 -0.03 1.97 0.52 -1.26 -4.85 118.95 117.91 2qcu s ARG 254 Ca 0.00 0.62 0.07 0.00 -0.52 0.00 0.00 55.73 55.90 2qcu s ARG 254 Cb 0.00 -1.99 -0.02 0.00 0.52 0.00 0.00 34.95 33.46 2qcu s ARG 254 CO 0.00 -1.16 -0.23 0.96 0.02 0.00 0.00 175.30 174.88 2qcu s ILE 255 N -3.23 2.28 -0.03 1.52 -5.25 -1.26 -0.77 121.20 114.45 2qcu s ILE 255 Ca 0.59 -1.02 0.06 0.00 -0.99 0.00 0.00 60.65 59.28 2qcu s ILE 255 Cb -0.12 -1.81 -0.01 0.00 2.95 0.00 0.00 42.46 43.46 2qcu s ILE 255 CO 0.53 0.58 -0.21 -0.69 -1.79 0.00 0.00 174.94 173.37 2qcu s VAL 256 N -0.63 1.68 0.15 8.37 1.01 -0.38 -4.59 120.40 126.01 2qcu s VAL 256 Ca 0.10 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2qcu s VAL 256 Cb -0.10 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2qcu s VAL 256 CO -0.01 0.48 0.34 -0.36 0.00 0.00 0.00 175.10 175.56 2qcu s PHE 257 N -0.25 3.49 -0.26 5.22 0.40 0.12 -0.11 117.98 126.60 2qcu s PHE 257 Ca 0.02 0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 56.75 2qcu s PHE 257 Cb -0.11 -1.89 0.08 0.00 0.51 0.00 0.00 43.02 41.61 2qcu s PHE 257 CO 0.01 0.45 0.03 0.08 0.70 0.00 0.00 175.22 176.49 2qcu s VAL 258 N -1.70 1.11 -0.14 -0.44 1.01 0.17 -1.90 120.40 118.51 2qcu s VAL 258 Ca 0.39 -1.19 0.02 0.00 0.00 0.00 0.00 61.98 61.20 2qcu s VAL 258 Cb -0.12 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.64 2qcu s VAL 258 CO 0.27 -0.35 -0.20 -0.63 0.00 0.00 0.00 175.10 174.19 2qcu s ILE 259 N 1.55 2.33 0.34 2.22 1.01 -0.09 -1.15 121.20 127.41 2qcu s ILE 259 Ca 0.02 -0.90 -0.29 0.00 0.00 0.00 0.00 60.65 59.48 2qcu s ILE 259 Cb -0.18 -1.94 -0.10 0.00 0.01 0.00 0.00 42.46 40.24 2qcu s ILE 259 CO -0.13 0.54 1.35 -2.84 0.00 0.00 0.00 174.94 173.86 2qcu s PRO 260 N 0.68 4.29 -0.04 2.79 0.02 -1.26 -0.68 135.00 140.80 2qcu s PRO 260 Ca -0.09 2.31 -0.02 0.00 0.02 0.00 0.00 61.00 63.22 2qcu s PRO 260 Cb -0.16 -3.04 0.03 0.00 0.02 0.00 0.00 34.50 31.35 2qcu s PRO 260 CO 0.02 -0.28 0.05 -0.46 -0.33 0.00 0.00 177.00 176.00 2qcu s TRP 261 N -1.14 0.09 -1.45 6.54 -0.00 0.04 -4.84 118.94 118.19 2qcu s TRP 261 Ca 0.50 0.21 -0.09 0.00 -0.00 0.00 0.00 56.10 56.72 2qcu s TRP 261 Cb -0.42 -0.46 0.05 0.00 -0.00 0.00 0.00 33.47 32.64 2qcu s TRP 261 CO 0.56 -0.18 0.73 -1.33 -0.00 0.00 0.00 176.95 176.72 2qcu n MET 262 N 5.12 -4.87 0.00 5.86 2.81 -1.26 -1.46 117.12 123.32 2qcu n MET 262 Ca -0.07 0.67 0.00 0.00 -1.81 0.00 0.00 57.70 56.49 2qcu n MET 262 Cb 0.50 -5.51 0.00 0.00 -0.71 0.00 0.00 33.22 27.50 2qcu n MET 262 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2qcu n ASP 263 N -2.58 0.00 0.00 7.83 8.00 -1.26 -4.52 116.55 124.02 2qcu n ASP 263 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2qcu n ASP 263 Cb 0.56 -1.00 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 2qcu n ASP 263 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2qcu n GLU 264 N -1.81 2.88 -4.49 -1.24 1.02 -1.11 -4.97 120.64 110.92 2qcu n GLU 264 Ca 0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 2qcu n GLU 264 Cb 0.00 -0.66 -0.09 0.00 -0.02 0.00 0.00 31.44 30.66 2qcu n GLU 264 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2qcu s PHE 265 N -1.06 1.87 -0.03 -0.32 0.08 -0.53 -1.06 117.98 116.92 2qcu s PHE 265 Ca 0.00 -1.11 0.02 0.00 0.12 0.00 0.00 56.93 55.97 2qcu s PHE 265 Cb 0.00 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.22 2qcu s PHE 265 CO 0.00 -0.13 -0.09 -1.12 -0.10 0.00 0.00 175.22 173.78 2qcu s SER 266 N -3.55 1.29 -0.12 1.36 0.01 0.11 -0.78 113.70 112.01 2qcu s SER 266 Ca 0.29 -0.20 -0.14 0.00 1.31 0.00 0.00 55.95 57.22 2qcu s SER 266 Cb 0.06 -0.38 -0.05 0.00 0.21 0.00 0.00 66.02 65.86 2qcu s SER 266 CO 0.14 0.06 0.31 -0.63 0.41 0.00 0.00 173.24 173.54 2qcu s ILE 267 N 0.26 5.26 -0.13 1.44 1.01 0.15 -1.77 121.20 127.42 2qcu s ILE 267 Ca -0.04 0.60 0.03 0.00 0.00 0.00 0.00 60.65 61.24 2qcu s ILE 267 Cb -0.10 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.74 2qcu s ILE 267 CO 0.01 0.45 -0.22 -0.63 0.00 0.00 0.00 174.94 174.55 2qcu s ILE 268 N -0.03 2.16 -0.07 2.92 1.01 -0.07 -0.91 121.20 126.20 2qcu s ILE 268 Ca 0.19 -0.96 -0.32 0.00 0.00 0.00 0.00 60.65 59.56 2qcu s ILE 268 Cb -0.14 -1.86 0.13 0.00 0.01 0.00 0.00 42.46 40.61 2qcu s ILE 268 CO 0.06 0.55 1.39 -0.83 0.00 0.00 0.00 174.94 176.12 2qcu s GLY 269 N 0.63 -0.43 0.00 6.18 0.00 -0.80 -0.89 107.32 112.01 2qcu s GLY 269 Ca -0.11 0.77 0.00 0.00 0.00 0.00 0.00 44.72 45.37 2qcu s GLY 269 CO 0.02 1.25 0.00 2.41 0.00 0.00 0.00 173.10 176.78 2qcu n THR 270 N -0.58 0.00 -4.30 0.90 -1.04 -1.26 0.16 114.28 108.16 2qcu n THR 270 Ca -0.07 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.77 2qcu n THR 270 Cb 0.63 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.04 2qcu n THR 270 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2qcu s THR 271 N 2.17 0.27 -0.30 12.58 -4.23 -1.24 -4.88 115.64 120.01 2qcu s THR 271 Ca 0.00 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.48 2qcu s THR 271 Cb 0.00 -2.53 0.11 0.00 1.34 0.00 0.00 72.50 71.42 2qcu s THR 271 CO 0.00 0.00 0.16 -1.81 -0.54 0.00 0.00 174.62 172.43 2qcu s ASP 272 N -3.32 3.23 -0.17 3.99 1.01 -1.24 -4.11 116.67 116.06 2qcu s ASP 272 Ca 0.37 -1.38 -0.00 0.00 0.71 0.00 0.00 52.55 52.25 2qcu s ASP 272 Cb 0.06 -0.26 0.04 0.00 1.01 0.00 0.00 42.92 43.77 2qcu s ASP 272 CO 0.16 -0.41 -0.06 -0.69 0.21 0.00 0.00 175.17 174.38 2qcu s VAL 273 N 1.96 1.17 0.29 -1.27 1.01 -0.36 -4.86 120.40 118.34 2qcu s VAL 273 Ca 0.11 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 2qcu s VAL 273 Cb -0.17 -1.34 -0.12 0.00 0.00 0.00 0.00 36.38 34.75 2qcu s VAL 273 CO -0.30 0.12 1.60 1.21 0.00 0.00 0.00 175.10 177.73 2qcu n GLU 274 N 4.85 2.70 -4.76 2.72 4.07 -1.26 -0.41 120.64 128.55 2qcu n GLU 274 Ca -0.12 0.96 -0.24 0.00 -0.06 0.00 0.00 57.16 57.70 2qcu n GLU 274 Cb 0.47 -2.75 -0.15 0.00 -0.06 0.00 0.00 31.44 28.96 2qcu n GLU 274 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 2qcu s TYR 275 N 0.04 1.45 -0.00 4.31 5.04 -0.40 -4.82 117.35 122.97 2qcu s TYR 275 Ca 0.64 -0.28 0.03 0.00 -2.44 0.00 0.00 57.07 55.02 2qcu s TYR 275 Cb -0.50 -0.94 -0.01 0.00 0.35 0.00 0.00 41.96 40.87 2qcu s TYR 275 CO 0.48 -0.03 -0.09 0.15 -1.34 0.00 0.00 175.55 174.72 2qcu s LYS 276 N -0.36 0.70 0.00 4.97 -0.14 -1.26 -4.51 119.74 119.14 2qcu s LYS 276 Ca 0.06 -0.35 0.00 0.00 -1.36 0.00 0.00 55.97 54.32 2qcu s LYS 276 Cb -0.06 -0.67 0.00 0.00 -1.68 0.00 0.00 37.83 35.41 2qcu s LYS 276 CO -0.01 0.18 0.00 0.41 -0.76 0.00 0.00 175.35 175.18 2qcu n GLY 277 N 2.77 0.45 3.65 -3.33 0.00 -1.26 -5.03 105.19 102.45 2qcu n GLY 277 Ca -0.14 -2.25 -0.43 0.00 0.00 0.00 0.00 46.02 43.20 2qcu n GLY 277 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qcu s ASP 278 N -4.00 7.04 0.63 1.61 -1.08 -1.26 -4.92 116.67 114.68 2qcu s ASP 278 Ca 0.00 1.26 0.34 0.00 -0.52 0.00 0.00 52.55 53.63 2qcu s ASP 278 Cb 0.00 -2.54 1.93 0.00 -1.46 0.00 0.00 42.92 40.85 2qcu s ASP 278 CO 0.00 -0.73 2.19 -0.65 0.52 0.00 0.00 175.17 176.50 2qcu h PRO 279 N 7.65 0.00 0.00 4.34 0.11 -1.95 0.54 132.00 142.69 2qcu h PRO 279 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 2qcu h PRO 279 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2qcu h PRO 279 CO 0.99 0.00 0.00 1.17 -0.21 0.00 0.00 178.00 179.95 2qcu n LYS 280 N -3.44 0.12 0.00 1.05 3.00 -1.26 -3.04 118.16 114.59 2qcu n LYS 280 Ca -0.01 0.20 0.13 0.00 -0.00 0.00 0.00 58.31 58.63 2qcu n LYS 280 Cb 0.21 -1.67 0.40 0.00 0.00 0.00 0.00 35.03 33.97 2qcu n LYS 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qcu n ALA 281 N -1.65 2.63 -1.90 3.14 0.00 0.18 -4.96 120.51 117.96 2qcu n ALA 281 Ca 0.05 -0.50 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 2qcu n ALA 281 Cb 0.31 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 2qcu n ALA 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qcu s VAL 282 N -2.07 2.87 0.04 0.00 0.11 -1.17 -5.01 120.40 115.18 2qcu s VAL 282 Ca 0.34 0.76 -0.22 0.00 -2.93 0.00 0.00 61.98 59.92 2qcu s VAL 282 Cb 0.20 -3.48 0.05 0.00 -1.53 0.00 0.00 36.38 31.62 2qcu s VAL 282 CO 0.35 0.13 0.52 -0.54 -3.33 0.00 0.00 175.10 172.23 2qcu s LYS 283 N -0.58 1.02 0.52 1.54 1.02 -1.26 -4.79 119.74 117.20 2qcu s LYS 283 Ca 0.56 -0.22 -0.21 0.00 0.02 0.00 0.00 55.97 56.12 2qcu s LYS 283 Cb -0.39 0.47 -0.06 0.00 -0.52 0.00 0.00 37.83 37.33 2qcu s LYS 283 CO 0.43 -0.36 1.23 -1.50 -0.92 0.00 0.00 175.35 174.23 2qcu s ILE 284 N -2.36 2.69 0.38 2.17 2.07 -1.26 -5.02 121.20 119.86 2qcu s ILE 284 Ca -0.06 0.49 0.08 0.00 -1.41 0.00 0.00 60.65 59.75 2qcu s ILE 284 Cb -0.01 -3.23 -0.06 0.00 0.13 0.00 0.00 42.46 39.29 2qcu s ILE 284 CO -0.01 -0.03 0.06 -1.83 -1.91 0.00 0.00 174.94 171.22 2qcu s GLU 285 N -2.95 2.09 0.17 3.50 -1.05 -1.26 -5.04 118.70 114.15 2qcu s GLU 285 Ca 0.70 -1.87 -0.16 0.00 -0.15 0.00 0.00 54.97 53.49 2qcu s GLU 285 Cb -0.32 -1.87 0.11 0.00 -0.44 0.00 0.00 34.13 31.60 2qcu s GLU 285 CO 0.38 0.01 1.71 1.49 0.95 0.00 0.00 175.26 179.79 2qcu h GLU 286 N 1.68 0.13 0.00 -4.83 4.57 -2.00 -1.30 114.58 112.83 2qcu h GLU 286 Ca -0.43 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 57.71 2qcu h GLU 286 Cb 1.25 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2qcu h GLU 286 CO 0.71 0.09 -0.13 0.66 -1.18 0.00 0.00 179.01 179.16 2qcu h SER 287 N 0.14 0.00 -0.22 1.04 4.64 -1.99 -0.35 113.55 116.82 2qcu h SER 287 Ca 0.19 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 2qcu h SER 287 Cb 0.26 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2qcu h SER 287 CO -0.30 0.13 -0.05 -0.33 -0.87 0.00 0.00 176.83 175.41 2qcu h GLU 288 N 0.00 0.41 -0.40 4.77 5.08 -1.66 0.04 114.58 122.82 2qcu h GLU 288 Ca -0.00 -0.16 0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2qcu h GLU 288 Cb 0.37 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 2qcu h GLU 288 CO 0.02 0.65 0.07 0.82 -1.00 0.00 0.00 179.01 179.57 2qcu h ILE 289 N 0.14 0.78 -0.83 3.13 2.04 -1.00 -1.04 117.51 120.74 2qcu h ILE 289 Ca 0.05 -0.07 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 2qcu h ILE 289 Cb 0.50 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2qcu h ILE 289 CO 0.02 0.04 0.37 0.78 0.00 0.00 0.00 178.15 179.36 2qcu h ASN 290 N 0.19 1.11 0.15 1.72 2.35 -0.98 0.01 115.58 120.13 2qcu h ASN 290 Ca 0.19 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2qcu h ASN 290 Cb 0.24 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2qcu h ASN 290 CO -0.26 0.96 -0.07 0.22 -1.65 0.00 0.00 177.43 176.62 2qcu h TYR 291 N 1.20 -0.18 -0.40 1.19 3.20 -0.72 -0.31 116.97 120.95 2qcu h TYR 291 Ca 0.28 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.06 2qcu h TYR 291 Cb 0.16 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2qcu h TYR 291 CO 0.02 0.01 -0.11 -0.07 -1.64 0.00 0.00 178.16 176.37 2qcu h LEU 292 N -0.35 0.79 -0.89 2.82 3.38 -0.90 -2.71 115.31 117.45 2qcu h LEU 292 Ca -0.02 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 2qcu h LEU 292 Cb 0.28 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2qcu h LEU 292 CO 0.03 0.97 0.22 -0.07 0.09 0.00 0.00 178.44 179.68 2qcu h LEU 293 N 0.59 0.96 0.17 1.67 3.38 -1.02 -2.48 115.31 118.59 2qcu h LEU 293 Ca 0.10 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2qcu h LEU 293 Cb 0.64 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2qcu h LEU 293 CO 0.04 0.90 -0.35 -1.13 0.09 0.00 0.00 178.44 177.99 2qcu h ASN 294 N 1.00 -1.00 0.03 -0.43 -0.73 -0.92 0.72 115.58 114.25 2qcu h ASN 294 Ca 0.22 0.11 -0.07 0.00 1.87 0.00 0.00 56.30 58.43 2qcu h ASN 294 Cb 0.28 0.37 -0.01 0.00 0.27 0.00 0.00 38.32 39.22 2qcu h ASN 294 CO -0.01 -0.44 -0.19 1.62 -0.37 0.00 0.00 177.43 178.04 2qcu h VAL 295 N -0.61 1.22 0.31 2.57 3.04 -1.38 0.63 116.25 122.02 2qcu h VAL 295 Ca 0.02 -0.99 -0.02 0.00 -1.01 0.00 0.00 66.70 64.71 2qcu h VAL 295 Cb 0.62 1.29 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 2qcu h VAL 295 CO -0.18 0.31 -0.15 0.22 -1.01 0.00 0.00 177.57 176.76 2qcu h TYR 296 N 0.27 -0.38 0.00 3.17 3.20 -1.38 -3.14 116.97 118.71 2qcu h TYR 296 Ca 0.05 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2qcu h TYR 296 Cb 0.49 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2qcu h TYR 296 CO 0.01 -0.09 -0.24 -0.91 -1.64 0.00 0.00 178.16 175.29 2qcu h ASN 297 N -0.67 0.00 0.40 -2.11 2.35 -0.30 -0.75 115.58 114.50 2qcu h ASN 297 Ca -0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 2qcu h ASN 297 Cb 0.47 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 2qcu h ASN 297 CO 0.07 0.24 -0.28 0.74 -1.65 0.00 0.00 177.43 176.55 2qcu h THR 298 N 0.00 1.03 0.00 2.81 2.02 -0.92 -3.35 112.91 114.49 2qcu h THR 298 Ca -0.00 -1.02 -0.37 0.00 0.77 0.00 0.00 66.41 65.79 2qcu h THR 298 Cb 0.54 1.58 -0.07 0.00 -1.74 0.00 0.00 68.15 68.47 2qcu h THR 298 CO 0.03 0.27 -2.40 1.41 0.37 0.00 0.00 175.52 175.21 2qcu n HIS 299 N -3.95 0.00 -3.93 3.16 8.25 -0.46 -4.85 115.22 113.44 2qcu n HIS 299 Ca -0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.11 2qcu n HIS 299 Cb 0.35 -0.95 -0.05 0.00 1.12 0.00 0.00 29.99 30.46 2qcu n HIS 299 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2qcu s PHE 300 N -2.49 3.52 0.08 4.41 0.08 -0.41 -0.52 117.98 122.65 2qcu s PHE 300 Ca -0.33 0.35 -0.20 0.00 0.12 0.00 0.00 56.93 56.87 2qcu s PHE 300 Cb 0.08 -1.82 -0.09 0.00 -0.57 0.00 0.00 43.02 40.62 2qcu s PHE 300 CO 0.57 0.64 1.57 0.87 -0.10 0.00 0.00 175.22 178.77 2qcu h LYS 301 N 3.90 0.34 -6.33 0.44 1.57 -1.35 -3.41 116.57 111.73 2qcu h LYS 301 Ca -0.49 -0.08 -0.54 0.00 -1.87 0.00 0.00 60.65 57.66 2qcu h LYS 301 Cb 1.19 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.40 2qcu h LYS 301 CO 0.68 0.47 1.15 0.21 -0.57 0.00 0.00 179.45 181.38 2qcu s LYS 302 N -5.26 3.20 0.39 3.15 2.36 -1.26 -4.96 119.74 117.36 2qcu s LYS 302 Ca -0.14 0.49 -0.25 0.00 -2.55 0.00 0.00 55.97 53.52 2qcu s LYS 302 Cb 0.07 -4.17 -0.09 0.00 -1.05 0.00 0.00 37.83 32.59 2qcu s LYS 302 CO 0.72 -2.06 1.14 -0.65 1.55 0.00 0.00 175.35 176.05 2qcu s GLN 303 N 5.76 4.13 -0.00 4.03 -1.52 -1.26 -4.97 119.66 125.82 2qcu s GLN 303 Ca 0.55 1.78 0.02 0.00 -1.95 0.00 0.00 55.36 55.77 2qcu s GLN 303 Cb -0.12 -2.70 -0.03 0.00 -0.22 0.00 0.00 33.01 29.94 2qcu s GLN 303 CO 0.24 -0.24 -0.05 -0.51 -0.25 0.00 0.00 175.29 174.49 2qcu s LEU 304 N -2.42 3.28 0.50 2.90 1.43 -1.26 -5.13 118.68 117.98 2qcu s LEU 304 Ca 0.56 -0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.61 2qcu s LEU 304 Cb -0.29 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2qcu s LEU 304 CO 0.37 0.29 0.25 -0.94 0.23 0.00 0.00 176.35 176.55 2qcu s SER 305 N -1.42 4.46 0.46 2.29 1.04 -1.26 -4.99 113.70 114.29 2qcu s SER 305 Ca 0.17 -1.31 0.20 0.00 0.48 0.00 0.00 55.95 55.50 2qcu s SER 305 Cb -0.11 0.23 1.13 0.00 0.10 0.00 0.00 66.02 67.37 2qcu s SER 305 CO 0.08 -0.91 1.98 0.08 0.98 0.00 0.00 173.24 175.45 2qcu h ARG 306 N 1.06 0.00 0.00 4.02 0.11 -1.98 -0.83 114.38 116.75 2qcu h ARG 306 Ca -0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.68 2qcu h ARG 306 Cb 1.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.37 2qcu h ARG 306 CO 0.64 0.20 0.00 -0.44 0.10 0.00 0.00 179.97 180.47 2qcu h ASP 307 N 0.00 0.00 1.75 0.08 3.32 -2.04 -2.53 116.42 117.00 2qcu h ASP 307 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qcu h ASP 307 Cb 0.42 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.97 2qcu h ASP 307 CO 0.03 0.00 -0.10 0.44 -1.72 0.00 0.00 179.24 177.88 2qcu h ASP 308 N 0.00 0.00 -2.97 6.45 3.32 -1.55 -3.46 116.42 118.21 2qcu h ASP 308 Ca 0.00 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.51 2qcu h ASP 308 Cb 0.31 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.88 2qcu h ASP 308 CO 0.00 0.00 0.75 -0.63 -1.72 0.00 0.00 179.24 177.65 2qcu s ILE 309 N -3.19 3.39 -0.05 0.35 1.01 -0.96 -4.26 121.20 117.49 2qcu s ILE 309 Ca 0.07 0.96 0.13 0.00 0.00 0.00 0.00 60.65 61.82 2qcu s ILE 309 Cb 0.07 -3.61 -0.20 0.00 0.01 0.00 0.00 42.46 38.73 2qcu s ILE 309 CO 0.66 0.06 0.31 1.33 0.00 0.00 0.00 174.94 177.30 2qcu n VAL 310 N 4.11 0.00 -3.44 2.92 0.24 -0.05 -5.01 118.33 117.10 2qcu n VAL 310 Ca 0.12 -0.30 -0.13 0.00 -2.04 0.00 0.00 64.34 61.99 2qcu n VAL 310 Cb 0.43 0.23 -0.03 0.00 -1.47 0.00 0.00 33.84 33.00 2qcu n VAL 310 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2qcu s TRP 311 N -2.89 -0.53 0.16 6.34 -0.00 -1.19 -5.01 118.94 115.81 2qcu s TRP 311 Ca -0.04 0.39 0.01 0.00 -0.00 0.00 0.00 56.10 56.45 2qcu s TRP 311 Cb 0.09 0.53 -0.04 0.00 -0.00 0.00 0.00 33.47 34.04 2qcu s TRP 311 CO 0.55 -0.81 0.02 0.95 -0.00 0.00 0.00 176.95 177.66 2qcu s THR 312 N -3.47 0.50 0.22 5.86 -4.23 -1.26 -0.17 115.64 113.08 2qcu s THR 312 Ca -0.00 -1.96 -0.17 0.00 -1.18 0.00 0.00 61.69 58.38 2qcu s THR 312 Cb -0.01 -2.09 0.02 0.00 1.34 0.00 0.00 72.50 71.76 2qcu s THR 312 CO -0.10 -0.48 0.55 -0.72 -0.54 0.00 0.00 174.62 173.33 2qcu s TYR 313 N -3.78 -0.04 -0.00 3.99 1.13 -0.83 -5.00 117.35 112.82 2qcu s TYR 313 Ca 0.24 -0.32 -0.24 0.00 -1.41 0.00 0.00 57.07 55.33 2qcu s TYR 313 Cb 0.07 0.40 0.05 0.00 -1.10 0.00 0.00 41.96 41.38 2qcu s TYR 313 CO 0.03 -0.98 0.54 0.45 -2.51 0.00 0.00 175.55 173.08 2qcu s SER 314 N -2.91 -0.48 0.30 -0.18 0.15 -1.26 -0.88 113.70 108.44 2qcu s SER 314 Ca 0.12 0.37 -0.15 0.00 0.70 0.00 0.00 55.95 56.98 2qcu s SER 314 Cb -0.02 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.79 2qcu s SER 314 CO 0.01 -0.63 0.63 -0.83 1.20 0.00 0.00 173.24 173.62 2qcu s GLY 315 N -1.56 0.38 -0.18 9.45 0.00 -0.66 -4.86 107.32 109.90 2qcu s GLY 315 Ca -0.09 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 43.92 2qcu s GLY 315 CO 0.04 -0.40 -0.20 -1.34 0.00 0.00 0.00 173.10 171.20 2qcu s VAL 316 N -3.49 2.10 -0.00 1.40 -7.23 -1.26 -1.28 120.40 110.64 2qcu s VAL 316 Ca 0.18 -0.93 -0.30 0.00 -1.81 0.00 0.00 61.98 59.12 2qcu s VAL 316 Cb -0.04 -1.88 -0.06 0.00 0.56 0.00 0.00 36.38 34.96 2qcu s VAL 316 CO 0.10 0.54 1.59 -0.13 -0.31 0.00 0.00 175.10 176.88 2qcu s ARG 317 N 1.28 4.21 0.35 4.82 0.52 -0.20 -4.78 118.95 125.15 2qcu s ARG 317 Ca 0.05 2.17 0.06 0.00 -0.52 0.00 0.00 55.73 57.48 2qcu s ARG 317 Cb -0.13 -3.76 0.65 0.00 0.52 0.00 0.00 34.95 32.23 2qcu s ARG 317 CO -0.12 -0.74 1.89 -1.00 0.02 0.00 0.00 175.30 175.34 2qcu h PRO 318 N 8.71 0.46 -2.65 3.54 0.13 -1.89 -2.29 132.00 138.01 2qcu h PRO 318 Ca -0.40 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2qcu h PRO 318 Cb 1.18 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2qcu h PRO 318 CO 0.93 0.51 0.00 1.28 -0.23 0.00 0.00 178.00 180.49 2qcu n LEU 319 N -4.28 0.00 -4.68 1.56 4.77 -1.21 -2.64 117.00 110.52 2qcu n LEU 319 Ca 0.01 0.88 -0.45 0.00 -0.03 0.00 0.00 56.01 56.41 2qcu n LEU 319 Cb 0.25 -1.32 -0.04 0.00 -2.33 0.00 0.00 43.42 39.98 2qcu n LEU 319 CO 0.39 -0.46 1.29 0.00 -1.33 0.00 0.00 177.39 177.27 2qcu s ASP 321 N 1.53 5.51 0.00 0.00 2.15 -1.26 -4.69 116.67 119.91 2qcu s ASP 321 Ca 0.80 -1.11 0.07 0.00 0.43 0.00 0.00 52.55 52.75 2qcu s ASP 321 Cb -0.64 -2.57 0.22 0.00 -0.30 0.00 0.00 42.92 39.63 2qcu s ASP 321 CO 0.39 -2.45 1.18 -0.90 -0.17 0.00 0.00 175.17 173.21 2qcu n ASP 322 N 12.65 1.19 -0.07 -0.34 5.68 -1.26 -4.75 116.55 129.65 2qcu n ASP 322 Ca 0.40 -1.99 -0.01 0.00 -0.50 0.00 0.00 54.79 52.69 2qcu n ASP 322 Cb 0.48 -0.15 -0.00 0.00 -1.14 0.00 0.00 41.12 40.31 2qcu n ASP 322 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2qcu n GLU 323 N 0.15 -0.61 -1.64 0.11 1.02 -1.26 -4.97 120.64 113.43 2qcu n GLU 323 Ca 0.08 0.24 -0.45 0.00 -0.02 0.00 0.00 57.16 57.01 2qcu n GLU 323 Cb 0.19 -3.75 -0.02 0.00 -0.02 0.00 0.00 31.44 27.84 2qcu n GLU 323 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2qcu n SER 324 N -0.15 2.20 0.13 1.62 7.64 -1.26 -4.90 113.62 118.90 2qcu n SER 324 Ca -0.01 1.17 -0.02 0.00 1.01 0.00 0.00 58.87 61.02 2qcu n SER 324 Cb 0.17 -1.38 0.16 0.00 -1.01 0.00 0.00 64.21 62.15 2qcu n SER 324 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2qcu h ASP 325 N 3.12 0.02 -3.35 6.43 1.82 -1.96 -3.44 116.42 119.07 2qcu h ASP 325 Ca -0.44 -0.01 -0.64 0.00 -0.39 0.00 0.00 57.03 55.55 2qcu h ASP 325 Cb 1.30 -0.01 -0.22 0.00 0.68 0.00 0.00 39.33 41.09 2qcu h ASP 325 CO 0.68 0.65 -0.66 -0.55 -1.61 0.00 0.00 179.24 177.74 2qcu s SER 326 N -6.85 4.85 0.21 2.28 0.15 -1.26 -5.01 113.70 108.07 2qcu s SER 326 Ca -0.01 -0.15 -0.09 0.00 0.70 0.00 0.00 55.95 56.40 2qcu s SER 326 Cb 0.13 -1.81 0.25 0.00 -1.71 0.00 0.00 66.02 62.88 2qcu s SER 326 CO 0.77 0.13 1.80 -0.65 1.20 0.00 0.00 173.24 176.49 2qcu h PRO 327 N 7.00 0.64 0.00 5.44 0.11 -1.91 0.81 132.00 144.09 2qcu h PRO 327 Ca -0.33 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2qcu h PRO 327 Cb 1.18 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2qcu h PRO 327 CO 0.63 0.42 0.00 -0.56 -0.21 0.00 0.00 178.00 178.28 2qcu h GLN 328 N 0.66 0.00 -0.00 1.05 3.07 -1.95 -1.45 115.11 116.49 2qcu h GLN 328 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.05 2qcu h GLN 328 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.78 2qcu h GLN 328 CO -0.20 0.00 -0.83 0.00 0.09 0.00 0.00 178.83 177.90 2qcu n ALA 329 N -1.85 4.36 -1.91 0.06 0.00 0.25 -4.95 120.51 116.47 2qcu n ALA 329 Ca -0.01 -0.57 -0.41 0.00 0.00 0.00 0.00 53.44 52.45 2qcu n ALA 329 Cb 0.06 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 2qcu n ALA 329 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2qcu s ILE 330 N -2.91 2.87 0.53 0.00 1.01 -0.55 -4.92 121.20 117.23 2qcu s ILE 330 Ca 0.11 0.74 -0.21 0.00 0.00 0.00 0.00 60.65 61.28 2qcu s ILE 330 Cb 0.17 -3.47 -0.07 0.00 0.01 0.00 0.00 42.46 39.10 2qcu s ILE 330 CO 0.79 0.12 1.07 1.07 0.00 0.00 0.00 174.94 177.99 2qcu n THR 331 N 2.26 3.25 0.18 2.92 5.66 -1.26 -4.92 114.28 122.37 2qcu n THR 331 Ca 0.06 -0.50 0.09 0.00 -3.05 0.00 0.00 64.05 60.65 2qcu n THR 331 Cb 0.41 -1.28 0.17 0.00 -1.55 0.00 0.00 70.33 68.08 2qcu n THR 331 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2qcu n ARG 332 N -0.59 2.21 -2.69 1.09 1.74 -1.26 -4.59 116.66 112.58 2qcu n ARG 332 Ca 0.11 -2.02 -0.34 0.00 -0.77 0.00 0.00 57.85 54.83 2qcu n ARG 332 Cb 0.44 -1.39 -0.05 0.00 -1.02 0.00 0.00 32.46 30.43 2qcu n ARG 332 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2qcu s ASP 333 N -1.22 6.67 0.44 0.55 -1.08 -1.26 -4.33 116.67 116.44 2qcu s ASP 333 Ca 0.30 1.81 -0.07 0.00 -0.52 0.00 0.00 52.55 54.08 2qcu s ASP 333 Cb 0.17 -2.55 -0.05 0.00 -1.46 0.00 0.00 42.92 39.04 2qcu s ASP 333 CO 0.24 -0.55 0.75 -0.72 0.52 0.00 0.00 175.17 175.41 2qcu s TYR 334 N -2.07 3.53 -0.07 -5.34 1.13 -1.26 -4.57 117.35 108.70 2qcu s TYR 334 Ca 0.64 0.85 0.02 0.00 -1.41 0.00 0.00 57.07 57.17 2qcu s TYR 334 Cb -0.13 -2.31 0.01 0.00 -1.10 0.00 0.00 41.96 38.43 2qcu s TYR 334 CO 0.17 -0.18 -0.12 0.99 -2.51 0.00 0.00 175.55 173.90 2qcu s THR 335 N -2.56 1.10 -0.15 -3.49 2.01 0.02 -4.98 115.64 107.59 2qcu s THR 335 Ca 0.48 -0.46 -0.08 0.00 0.31 0.00 0.00 61.69 61.95 2qcu s THR 335 Cb -0.10 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 2qcu s THR 335 CO 0.39 0.35 0.11 -0.76 -0.69 0.00 0.00 174.62 174.02 2qcu s LEU 336 N 0.70 4.17 -0.08 4.42 1.43 -1.26 -1.35 118.68 126.72 2qcu s LEU 336 Ca -0.14 0.31 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 2qcu s LEU 336 Cb -0.16 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 2qcu s LEU 336 CO 0.03 0.30 -0.18 -0.62 0.23 0.00 0.00 176.35 176.11 2qcu s ASP 337 N -0.37 3.65 -0.02 2.29 2.15 -0.85 -4.98 116.67 118.55 2qcu s ASP 337 Ca 0.11 -0.36 0.03 0.00 0.43 0.00 0.00 52.55 52.75 2qcu s ASP 337 Cb -0.12 -1.13 -0.00 0.00 -0.30 0.00 0.00 42.92 41.37 2qcu s ASP 337 CO 0.01 0.24 -0.10 -0.51 -0.17 0.00 0.00 175.17 174.64 2qcu s ILE 338 N -0.12 0.85 -0.03 4.11 2.07 -1.26 -0.92 121.20 125.90 2qcu s ILE 338 Ca -0.03 -0.43 -0.04 0.00 -1.41 0.00 0.00 60.65 58.74 2qcu s ILE 338 Cb -0.14 -0.73 0.01 0.00 0.13 0.00 0.00 42.46 41.73 2qcu s ILE 338 CO 0.04 0.25 0.11 -2.28 -1.91 0.00 0.00 174.94 171.15 2qcu s HIS 339 N -0.04 -0.07 0.45 3.50 2.46 -0.79 -4.99 115.29 115.82 2qcu s HIS 339 Ca 0.01 0.17 0.05 0.00 0.47 0.00 0.00 55.06 55.75 2qcu s HIS 339 Cb -0.06 0.01 -0.05 0.00 -0.13 0.00 0.00 32.58 32.34 2qcu s HIS 339 CO 0.00 -0.12 0.01 0.16 -2.47 0.00 0.00 174.74 172.33 2qcu s ASP 340 N -0.33 3.98 -0.20 9.88 1.47 -1.26 -0.59 116.67 129.62 2qcu s ASP 340 Ca -0.04 -1.47 0.01 0.00 1.18 0.00 0.00 52.55 52.22 2qcu s ASP 340 Cb -0.03 -0.05 0.03 0.00 -0.34 0.00 0.00 42.92 42.53 2qcu s ASP 340 CO 0.00 -0.61 -0.16 -0.70 0.68 0.00 0.00 175.17 174.38 2qcu s GLU 341 N -3.78 2.84 -1.62 2.11 2.12 -0.75 -4.76 118.70 114.86 2qcu s GLU 341 Ca 0.24 -0.94 -0.02 0.00 0.36 0.00 0.00 54.97 54.61 2qcu s GLU 341 Cb 0.07 -2.69 0.01 0.00 0.26 0.00 0.00 34.13 31.77 2qcu s GLU 341 CO 0.12 -0.30 0.24 0.09 -0.54 0.00 0.00 175.26 174.88 2qcu n ASN 342 N 4.59 -5.73 0.00 -1.70 3.02 -1.26 -2.38 115.26 111.80 2qcu n ASN 342 Ca -0.19 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 2qcu n ASN 342 Cb 0.48 -4.72 0.00 0.00 -0.61 0.00 0.00 39.78 34.93 2qcu n ASN 342 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qcu n GLY 343 N -1.19 0.79 3.46 7.41 0.00 -1.26 -4.99 105.19 109.42 2qcu n GLY 343 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 2qcu n GLY 343 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qcu s LYS 344 N -0.27 1.70 -1.13 1.61 1.02 -1.00 -4.93 119.74 116.74 2qcu s LYS 344 Ca 0.00 -1.97 -0.19 0.00 0.02 0.00 0.00 55.97 53.84 2qcu s LYS 344 Cb 0.00 -0.82 -0.02 0.00 -0.52 0.00 0.00 37.83 36.47 2qcu s LYS 344 CO 0.00 -0.24 0.81 0.00 -0.92 0.00 0.00 175.35 175.00 2qcu n ALA 345 N -0.73 -2.54 -1.78 5.17 0.00 -1.24 -1.82 120.51 117.58 2qcu n ALA 345 Ca -0.03 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.82 2qcu n ALA 345 Cb 0.66 -4.36 -0.02 0.00 0.00 0.00 0.00 19.45 15.73 2qcu n ALA 345 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2qcu s PRO 346 N -5.75 4.34 -0.23 0.00 0.04 -1.25 -4.29 135.00 127.85 2qcu s PRO 346 Ca 0.47 2.23 -0.07 0.00 0.04 0.00 0.00 61.00 63.67 2qcu s PRO 346 Cb -0.15 -3.07 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 2qcu s PRO 346 CO 0.84 -0.21 0.07 -1.17 0.04 0.00 0.00 177.00 176.56 2qcu s LEU 347 N -1.72 3.53 -0.18 -3.56 2.96 0.24 -2.01 118.68 117.93 2qcu s LEU 347 Ca 0.50 -0.14 -0.02 0.00 -0.22 0.00 0.00 54.13 54.25 2qcu s LEU 347 Cb -0.40 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.35 2qcu s LEU 347 CO 0.53 0.02 -0.08 -0.22 -1.32 0.00 0.00 176.35 175.28 2qcu s LEU 348 N 1.29 2.82 -0.02 -0.68 0.20 -0.38 -1.88 118.68 120.03 2qcu s LEU 348 Ca 0.05 -0.36 0.08 0.00 0.69 0.00 0.00 54.13 54.58 2qcu s LEU 348 Cb -0.15 -1.68 -0.02 0.00 -0.43 0.00 0.00 46.19 43.91 2qcu s LEU 348 CO 0.03 0.06 -0.25 -0.94 -0.29 0.00 0.00 176.35 174.96 2qcu s SER 349 N 1.00 2.98 -0.21 3.68 1.04 -0.09 -0.89 113.70 121.20 2qcu s SER 349 Ca -0.01 -0.46 -0.06 0.00 0.48 0.00 0.00 55.95 55.90 2qcu s SER 349 Cb -0.15 -0.36 -0.03 0.00 0.10 0.00 0.00 66.02 65.59 2qcu s SER 349 CO -0.01 0.31 0.04 -0.69 0.98 0.00 0.00 173.24 173.87 2qcu s VAL 350 N -0.57 4.24 -0.25 5.02 1.01 -0.58 -2.01 120.40 127.25 2qcu s VAL 350 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 2qcu s VAL 350 Cb -0.10 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 33.38 2qcu s VAL 350 CO -0.01 0.40 -0.07 -0.36 0.00 0.00 0.00 175.10 175.06 2qcu s PHE 351 N 1.10 3.11 0.00 5.22 0.40 -0.45 -4.72 117.98 122.64 2qcu s PHE 351 Ca 0.03 -1.76 0.00 0.00 -0.60 0.00 0.00 56.93 54.60 2qcu s PHE 351 Cb -0.14 -2.03 0.00 0.00 0.51 0.00 0.00 43.02 41.35 2qcu s PHE 351 CO 0.02 -0.78 0.00 0.41 0.70 0.00 0.00 175.22 175.58 2qcu n GLY 352 N 4.61 -0.75 0.00 4.36 0.00 -1.26 -0.80 105.19 111.35 2qcu n GLY 352 Ca -0.16 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2qcu n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcu n GLY 353 N 0.00 2.12 3.71 -0.02 0.00 -1.26 -4.82 105.19 104.91 2qcu n GLY 353 Ca 0.00 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 2qcu n GLY 353 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qcu s LYS 354 N -0.71 1.85 0.25 1.61 1.02 -1.26 -4.91 119.74 117.58 2qcu s LYS 354 Ca 0.00 1.75 -0.05 0.00 0.02 0.00 0.00 55.97 57.69 2qcu s LYS 354 Cb 0.00 -1.80 0.48 0.00 -0.52 0.00 0.00 37.83 35.98 2qcu s LYS 354 CO 0.00 -2.05 1.68 1.25 -0.92 0.00 0.00 175.35 175.31 2qcu h LEU 355 N -0.66 -0.02 -1.30 3.17 5.85 -1.99 -2.61 115.31 117.75 2qcu h LEU 355 Ca -0.47 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.49 2qcu h LEU 355 Cb 1.29 0.21 -0.05 0.00 0.37 0.00 0.00 40.66 42.48 2qcu h LEU 355 CO 0.48 -0.06 0.53 0.74 -0.34 0.00 0.00 178.44 179.79 2qcu h THR 356 N 0.25 1.00 -0.35 1.05 2.02 -1.91 -2.31 112.91 112.66 2qcu h THR 356 Ca 0.42 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.32 2qcu h THR 356 Cb 0.74 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2qcu h THR 356 CO -0.53 0.15 0.00 0.35 0.37 0.00 0.00 175.52 175.86 2qcu n THR 357 N -4.50 0.45 -0.30 3.16 -2.24 -0.99 -4.63 114.28 105.23 2qcu n THR 357 Ca 0.13 -0.66 0.07 0.00 -2.27 0.00 0.00 64.05 61.32 2qcu n THR 357 Cb 0.27 0.82 0.28 0.00 -2.10 0.00 0.00 70.33 69.60 2qcu n THR 357 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 2qcu h TYR 358 N 3.94 1.00 -0.37 4.78 -0.00 -1.33 0.45 116.97 125.43 2qcu h TYR 358 Ca 0.00 0.03 -0.14 0.00 -0.00 0.00 0.00 58.73 58.62 2qcu h TYR 358 Cb 0.87 -0.32 -0.01 0.00 -0.00 0.00 0.00 36.73 37.27 2qcu h TYR 358 CO 0.22 0.45 -0.30 -0.09 -0.00 0.00 0.00 178.16 178.44 2qcu h ARG 359 N 0.92 0.87 -0.31 0.10 2.43 -1.83 -0.32 114.38 116.23 2qcu h ARG 359 Ca 0.43 -0.43 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 2qcu h ARG 359 Cb 0.42 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2qcu h ARG 359 CO -0.19 1.08 -0.10 0.87 -1.51 0.00 0.00 179.97 180.12 2qcu h LYS 360 N 0.67 0.61 -0.29 0.20 1.79 -1.73 -0.83 116.57 117.00 2qcu h LYS 360 Ca 0.07 -0.25 0.05 0.00 -2.18 0.00 0.00 60.65 58.34 2qcu h LYS 360 Cb 0.89 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.46 2qcu h LYS 360 CO 0.08 0.81 0.02 1.25 -1.08 0.00 0.00 179.45 180.54 2qcu h LEU 361 N 0.38 -0.06 -0.56 2.94 6.46 -0.82 -0.32 115.31 123.33 2qcu h LEU 361 Ca 0.08 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2qcu h LEU 361 Cb 0.60 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.59 2qcu h LEU 361 CO 0.04 0.00 0.34 0.00 -0.62 0.00 0.00 178.44 178.20 2qcu h ALA 362 N 1.23 0.71 -0.29 1.25 0.00 -0.88 0.94 119.26 122.21 2qcu h ALA 362 Ca 0.14 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2qcu h ALA 362 Cb 0.16 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2qcu h ALA 362 CO -0.21 0.19 0.18 1.49 0.00 0.00 0.00 179.25 180.90 2qcu h GLU 363 N 0.75 0.35 -0.58 0.00 4.81 -0.80 -1.24 114.58 117.87 2qcu h GLU 363 Ca 0.20 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.46 2qcu h GLU 363 Cb -0.02 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 2qcu h GLU 363 CO -0.04 0.23 0.30 1.25 -0.73 0.00 0.00 179.01 180.02 2qcu h HIS 364 N 0.36 0.55 -0.56 0.92 2.76 -0.69 -0.98 115.15 117.52 2qcu h HIS 364 Ca 0.11 0.02 0.09 0.00 -2.20 0.00 0.00 60.37 58.40 2qcu h HIS 364 Cb -0.01 -0.16 -0.07 0.00 1.55 0.00 0.00 27.41 28.72 2qcu h HIS 364 CO -0.07 0.26 0.17 0.00 -1.30 0.00 0.00 177.93 176.99 2qcu h ALA 365 N 1.31 0.69 0.00 5.26 0.00 -0.60 -1.39 119.26 124.54 2qcu h ALA 365 Ca 0.26 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2qcu h ALA 365 Cb 0.17 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2qcu h ALA 365 CO -0.18 -0.24 -0.53 -0.07 0.00 0.00 0.00 179.25 178.23 2qcu h LEU 366 N 0.33 0.00 -0.30 0.00 -0.00 -0.67 -0.92 115.31 113.75 2qcu h LEU 366 Ca 0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.12 2qcu h LEU 366 Cb 0.36 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.01 2qcu h LEU 366 CO -0.32 0.53 0.01 -0.08 -0.00 0.00 0.00 178.44 178.59 2qcu h GLU 367 N 0.00 0.53 -0.42 1.13 4.81 -0.63 -1.15 114.58 118.85 2qcu h GLU 367 Ca -0.01 -0.16 -0.05 0.00 -0.13 0.00 0.00 59.36 59.01 2qcu h GLU 367 Cb 1.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.30 2qcu h GLU 367 CO 0.07 0.66 0.05 0.87 -0.73 0.00 0.00 179.01 179.93 2qcu h LYS 368 N 0.33 0.64 0.00 1.92 1.57 -1.08 -2.64 116.57 117.31 2qcu h LYS 368 Ca 0.09 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2qcu h LYS 368 Cb 0.41 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2qcu h LYS 368 CO 0.01 0.62 0.00 1.28 -0.57 0.00 0.00 179.45 180.80 2qcu n LEU 369 N -4.28 0.80 -0.32 2.94 4.77 -0.37 -4.35 117.00 116.19 2qcu n LEU 369 Ca 0.02 0.60 -0.04 0.00 -0.03 0.00 0.00 56.01 56.56 2qcu n LEU 369 Cb 0.23 -0.37 0.08 0.00 -2.33 0.00 0.00 43.42 41.04 2qcu n LEU 369 CO 0.39 -0.26 1.22 0.74 -1.33 0.00 0.00 177.39 178.15 2qcu h THR 370 N 0.00 1.23 -0.03 -5.08 2.02 -0.83 -1.78 112.91 108.44 2qcu h THR 370 Ca 0.00 -0.45 0.01 0.00 0.77 0.00 0.00 66.41 66.74 2qcu h THR 370 Cb 0.67 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 2qcu h THR 370 CO 0.00 0.23 0.17 -0.65 0.37 0.00 0.00 175.52 175.64 2qcu h PRO 371 N 1.18 0.00 -0.01 6.66 0.11 -1.77 -1.99 132.00 136.17 2qcu h PRO 371 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2qcu h PRO 371 Cb -0.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.01 2qcu h PRO 371 CO -0.06 0.00 -0.20 0.66 -0.21 0.00 0.00 178.00 178.19 2qcu n TYR 372 N -3.14 0.00 -3.75 0.65 4.02 -0.67 -4.75 117.16 109.52 2qcu n TYR 372 Ca -0.02 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.57 2qcu n TYR 372 Cb 0.24 -0.13 -0.14 0.00 -0.02 0.00 0.00 39.34 39.29 2qcu n TYR 372 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2qcu s TYR 373 N -2.46 1.97 0.05 -0.72 2.02 -0.75 -5.06 117.35 112.40 2qcu s TYR 373 Ca 0.27 -2.05 -0.31 0.00 -0.37 0.00 0.00 57.07 54.60 2qcu s TYR 373 Cb 0.20 -1.87 -0.10 0.00 -0.40 0.00 0.00 41.96 39.78 2qcu s TYR 373 CO 0.49 -0.86 1.91 0.94 -1.57 0.00 0.00 175.55 176.47 2qcu n GLN 374 N 4.42 2.72 -0.85 -0.62 -0.06 -1.26 -2.42 117.38 119.31 2qcu n GLN 374 Ca 0.02 0.99 0.00 0.00 -2.00 0.00 0.00 57.00 56.01 2qcu n GLN 374 Cb 0.40 -2.91 0.00 0.00 -4.06 0.00 0.00 30.24 23.67 2qcu n GLN 374 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2qcu n GLY 375 N 4.41 0.51 0.00 1.69 0.00 -1.26 -5.02 105.19 105.52 2qcu n GLY 375 Ca 0.20 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2qcu n GLY 375 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qcu n ILE 376 N -2.85 0.00 0.00 -0.61 3.06 -1.02 -5.00 119.36 112.94 2qcu n ILE 376 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2qcu n ILE 376 Cb 0.00 -0.35 0.00 0.00 0.54 0.00 0.00 39.64 39.83 2qcu n ILE 376 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2qcu n GLY 377 N 0.00 1.08 3.91 4.50 0.00 -1.24 -4.71 105.19 108.73 2qcu n GLY 377 Ca 0.00 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.03 2qcu n GLY 377 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qcu s PRO 378 N -2.00 3.58 0.62 1.61 0.04 -1.26 -4.98 135.00 132.62 2qcu s PRO 378 Ca 0.00 -0.03 -0.12 0.00 0.04 0.00 0.00 61.00 60.88 2qcu s PRO 378 Cb 0.00 -2.59 -0.11 0.00 0.04 0.00 0.00 34.50 31.84 2qcu s PRO 378 CO 0.00 0.11 -0.46 0.00 0.04 0.00 0.00 177.00 176.69 2qcu n ALA 379 N -1.44 -4.15 0.00 8.56 0.00 -1.26 -4.93 120.51 117.29 2qcu n ALA 379 Ca -0.02 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2qcu n ALA 379 Cb 0.55 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 19.14 2qcu n ALA 379 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 2qcu n TRP 380 N -1.61 0.00 0.24 0.00 4.27 -1.26 -5.00 117.44 114.08 2qcu n TRP 380 Ca 0.00 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.73 2qcu n TRP 380 Cb 0.38 0.00 0.54 0.00 -1.36 0.00 0.00 31.31 30.87 2qcu n TRP 380 CO 0.00 0.00 0.00 1.79 -2.29 0.00 0.00 177.69 177.19 2qcu h THR 381 N 0.00 0.47 -0.19 -1.67 1.35 -1.96 -3.08 112.91 107.83 2qcu h THR 381 Ca 0.00 -0.94 -0.01 0.00 -0.55 0.00 0.00 66.41 64.91 2qcu h THR 381 Cb 0.00 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 2qcu h THR 381 CO 0.00 0.17 0.07 0.50 -0.25 0.00 0.00 175.52 176.01 2qcu h LYS 382 N 0.00 0.25 -0.01 4.72 3.64 -1.97 -0.48 116.57 122.72 2qcu h LYS 382 Ca -0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2qcu h LYS 382 Cb 0.64 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2qcu h LYS 382 CO 0.02 0.22 -0.00 0.39 -2.27 0.00 0.00 179.45 177.81 2qcu n GLU 383 N -4.45 1.46 -2.82 1.90 4.71 -1.16 -4.96 120.64 115.33 2qcu n GLU 383 Ca -0.00 -0.69 -0.26 0.00 -0.01 0.00 0.00 57.16 56.20 2qcu n GLU 383 Cb 0.12 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.07 2qcu n GLU 383 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 2qcu s SER 384 N -2.01 6.18 -0.17 1.62 1.04 -0.19 -5.08 113.70 115.09 2qcu s SER 384 Ca 0.41 0.75 0.01 0.00 0.48 0.00 0.00 55.95 57.60 2qcu s SER 384 Cb 0.21 -2.10 0.02 0.00 0.10 0.00 0.00 66.02 64.25 2qcu s SER 384 CO 0.35 -0.56 -0.20 -0.69 0.98 0.00 0.00 173.24 173.11 2qcu s VAL 385 N -2.65 2.09 0.81 5.02 1.01 -1.26 -4.44 120.40 120.98 2qcu s VAL 385 Ca 0.46 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.38 2qcu s VAL 385 Cb -0.10 -1.86 0.08 0.00 0.00 0.00 0.00 36.38 34.50 2qcu s VAL 385 CO 0.42 0.54 1.13 -0.76 0.00 0.00 0.00 175.10 176.44 2qcu s LEU 386 N 1.15 3.04 0.13 3.92 1.43 -0.08 -4.84 118.68 123.42 2qcu s LEU 386 Ca 0.01 2.07 -0.34 0.00 -1.03 0.00 0.00 54.13 54.84 2qcu s LEU 386 Cb -0.14 -4.55 -0.14 0.00 0.03 0.00 0.00 46.19 41.39 2qcu s LEU 386 CO -0.09 -2.45 1.56 -2.65 0.23 0.00 0.00 176.35 172.95 2qcu n PRO 387 N -3.56 1.98 0.00 1.29 -0.02 -1.26 -0.23 135.00 133.20 2qcu n PRO 387 Ca 0.11 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2qcu n PRO 387 Cb 0.52 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2qcu n PRO 387 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qcu n GLY 388 N 3.33 3.31 0.41 -1.23 0.00 -1.26 -4.84 105.19 104.91 2qcu n GLY 388 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2qcu n GLY 388 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcu n GLY 389 N -1.76 -0.10 2.74 -0.02 0.00 0.67 -0.64 105.19 106.09 2qcu n GLY 389 Ca 0.00 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 2qcu n GLY 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qcu n ALA 390 N 0.01 5.86 -2.00 4.61 0.00 -1.26 -4.53 120.51 123.20 2qcu n ALA 390 Ca 0.18 -4.33 0.00 0.00 0.00 0.00 0.00 53.44 49.29 2qcu n ALA 390 Cb 0.29 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 16.97 2qcu n ALA 390 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2qcu n ILE 391 N 2.30 0.00 0.00 0.00 -5.35 -1.26 -4.69 119.36 110.36 2qcu n ILE 391 Ca 0.45 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.93 2qcu n ILE 391 Cb 0.31 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.21 2qcu n ILE 391 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2qcu n GLU 392 N 0.00 0.00 0.00 6.28 -0.58 -1.26 -5.05 120.64 120.03 2qcu n GLU 392 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2qcu n GLU 392 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2qcu n GLU 392 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qcu n GLY 393 N 0.00 2.14 0.00 0.62 0.00 -1.26 -2.97 105.19 103.72 2qcu n GLY 393 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2qcu n GLY 393 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qcu n ASP 394 N 0.00 0.00 -0.10 1.61 -0.08 -1.26 -4.45 116.55 112.27 2qcu n ASP 394 Ca 0.00 0.00 -0.17 0.00 -1.51 0.00 0.00 54.79 53.11 2qcu n ASP 394 Cb 0.00 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.33 2qcu n ASP 394 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2qcu n ARG 395 N 0.00 0.67 -3.76 -0.67 1.74 -1.26 -1.86 116.66 111.52 2qcu n ARG 395 Ca 0.00 0.15 -0.28 0.00 -0.77 0.00 0.00 57.85 56.95 2qcu n ARG 395 Cb 0.00 -1.56 -0.16 0.00 -1.02 0.00 0.00 32.46 29.71 2qcu n ARG 395 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qcu s ASP 396 N -6.44 2.95 -0.48 0.55 1.01 -1.26 -3.75 116.67 109.25 2qcu s ASP 396 Ca -0.28 -0.82 0.08 0.00 0.71 0.00 0.00 52.55 52.24 2qcu s ASP 396 Cb 0.08 -0.66 0.37 0.00 1.01 0.00 0.00 42.92 43.72 2qcu s ASP 396 CO 0.67 -0.29 0.92 -0.67 0.21 0.00 0.00 175.17 176.01 2qcu n ASP 397 N 5.01 3.28 -0.10 0.27 2.03 -1.16 -4.11 116.55 121.77 2qcu n ASP 397 Ca -0.09 -3.43 -0.21 0.00 0.52 0.00 0.00 54.79 51.58 2qcu n ASP 397 Cb 0.47 -0.56 -0.10 0.00 -0.72 0.00 0.00 41.12 40.21 2qcu n ASP 397 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qcu n TYR 398 N -0.13 0.94 -0.29 -0.67 9.36 -1.21 -2.87 117.16 122.30 2qcu n TYR 398 Ca 0.29 0.41 -0.01 0.00 3.32 0.00 0.00 57.90 61.91 2qcu n TYR 398 Cb 0.54 -1.06 0.18 0.00 -0.63 0.00 0.00 39.34 38.38 2qcu n TYR 398 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qcu h ALA 399 N -0.58 1.38 -0.23 2.98 0.00 -1.52 0.25 119.26 121.53 2qcu h ALA 399 Ca -0.34 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2qcu h ALA 399 Cb 1.24 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2qcu h ALA 399 CO -0.20 0.57 0.08 0.00 0.00 0.00 0.00 179.25 179.70 2qcu h ALA 400 N 1.46 0.30 -0.13 0.00 0.00 -1.75 -1.64 119.26 117.49 2qcu h ALA 400 Ca 0.31 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2qcu h ALA 400 Cb -0.13 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 2qcu h ALA 400 CO -0.07 -0.09 -0.15 0.00 0.00 0.00 0.00 179.25 178.95 2qcu h ARG 401 N 0.22 -0.17 -0.58 0.00 3.08 -1.31 -1.16 114.38 114.46 2qcu h ARG 401 Ca 0.08 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.23 2qcu h ARG 401 Cb 0.20 0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.22 2qcu h ARG 401 CO -0.00 -0.12 0.17 1.25 -1.07 0.00 0.00 179.97 180.20 2qcu h LEU 402 N -0.18 0.12 -1.29 3.04 5.85 -0.30 -0.40 115.31 122.14 2qcu h LEU 402 Ca 0.09 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 2qcu h LEU 402 Cb 0.32 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2qcu h LEU 402 CO -0.24 0.08 -0.13 -0.09 -0.34 0.00 0.00 178.44 177.72 2qcu h ARG 403 N 0.33 0.32 -0.56 1.25 2.43 -0.89 0.16 114.38 117.43 2qcu h ARG 403 Ca 0.29 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.31 2qcu h ARG 403 Cb 0.39 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2qcu h ARG 403 CO -0.33 0.46 0.07 -0.09 -1.51 0.00 0.00 179.97 178.57 2qcu h ARG 404 N 0.30 0.94 -0.32 0.20 2.43 0.13 -2.75 114.38 115.31 2qcu h ARG 404 Ca 0.06 -0.26 -0.17 0.00 -0.81 0.00 0.00 59.98 58.80 2qcu h ARG 404 Cb 0.42 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2qcu h ARG 404 CO 0.02 0.91 -0.48 -0.09 -1.51 0.00 0.00 179.97 178.82 2qcu h ARG 405 N 0.83 0.87 -2.92 0.20 9.65 -0.90 -3.39 114.38 118.71 2qcu h ARG 405 Ca 0.17 -0.51 -0.61 0.00 -1.10 0.00 0.00 59.98 57.92 2qcu h ARG 405 Cb 0.44 0.04 -0.41 0.00 -1.39 0.00 0.00 29.97 28.65 2qcu h ARG 405 CO 0.01 1.15 -0.64 0.66 2.80 0.00 0.00 179.97 183.95 2qcu n TYR 406 N -4.02 2.58 0.45 2.20 4.01 0.55 -4.96 117.16 117.97 2qcu n TYR 406 Ca -0.03 -4.14 0.10 0.00 -0.16 0.00 0.00 57.90 53.67 2qcu n TYR 406 Cb 0.59 -0.48 0.43 0.00 -0.31 0.00 0.00 39.34 39.57 2qcu n TYR 406 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2qcu n PRO 407 N 2.04 0.12 0.15 -0.72 -0.02 -1.05 -2.02 135.00 133.51 2qcu n PRO 407 Ca 0.22 0.35 0.12 0.00 -2.02 0.00 0.00 63.50 62.17 2qcu n PRO 407 Cb 0.37 -1.73 0.54 0.00 -0.02 0.00 0.00 33.50 32.66 2qcu n PRO 407 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2qcu h PHE 408 N 0.00 0.00 -3.26 6.00 -0.00 -1.85 -3.44 116.94 114.38 2qcu h PHE 408 Ca 0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 57.97 57.44 2qcu h PHE 408 Cb 0.34 0.00 0.03 0.00 -0.00 0.00 0.00 35.95 36.32 2qcu h PHE 408 CO 0.00 0.00 0.68 -0.51 -0.00 0.00 0.00 178.31 178.48 2qcu s LEU 409 N -4.61 4.40 0.92 2.10 1.43 -0.86 -4.63 118.68 117.43 2qcu s LEU 409 Ca 0.02 2.40 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 2qcu s LEU 409 Cb 0.08 -3.60 0.14 0.00 0.03 0.00 0.00 46.19 42.84 2qcu s LEU 409 CO 0.35 -0.58 1.10 0.42 0.23 0.00 0.00 176.35 177.87 2qcu s THR 410 N 0.42 2.52 0.32 5.49 -4.23 -1.26 -4.80 115.64 114.11 2qcu s THR 410 Ca 0.59 0.17 0.01 0.00 -1.18 0.00 0.00 61.69 61.28 2qcu s THR 410 Cb -0.37 -2.44 0.23 0.00 1.34 0.00 0.00 72.50 71.26 2qcu s THR 410 CO 0.36 -0.22 1.95 -0.33 -0.54 0.00 0.00 174.62 175.84 2qcu h GLU 411 N -1.73 0.87 -0.12 3.99 5.08 -1.98 -0.31 114.58 120.39 2qcu h GLU 411 Ca -0.48 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 57.69 2qcu h GLU 411 Cb 1.27 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2qcu h GLU 411 CO 0.49 0.64 -0.34 0.66 -1.00 0.00 0.00 179.01 179.45 2qcu h SER 412 N 0.88 0.50 -0.36 1.42 4.64 -1.99 -1.46 113.55 117.18 2qcu h SER 412 Ca 0.23 -0.60 -0.08 0.00 -0.47 0.00 0.00 61.79 60.87 2qcu h SER 412 Cb 0.01 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 2qcu h SER 412 CO -0.04 1.01 -0.08 0.25 -0.87 0.00 0.00 176.83 177.10 2qcu h LEU 413 N 0.02 0.69 -1.28 5.97 6.46 -1.87 -0.71 115.31 124.59 2qcu h LEU 413 Ca -0.01 -0.36 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2qcu h LEU 413 Cb 0.96 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 40.67 2qcu h LEU 413 CO 0.07 0.89 0.43 0.00 -0.62 0.00 0.00 178.44 179.22 2qcu h ALA 414 N 0.82 1.47 -0.50 1.25 0.00 -1.01 -0.21 119.26 121.08 2qcu h ALA 414 Ca 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2qcu h ALA 414 Cb 0.59 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2qcu h ALA 414 CO 0.03 0.48 0.14 -0.09 0.00 0.00 0.00 179.25 179.81 2qcu h ARG 415 N 0.94 0.79 -0.22 0.00 2.43 -0.96 -1.34 114.38 116.02 2qcu h ARG 415 Ca 0.25 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2qcu h ARG 415 Cb -0.07 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 2qcu h ARG 415 CO -0.05 0.75 0.06 1.25 -1.51 0.00 0.00 179.97 180.47 2qcu h HIS 416 N 0.68 0.36 -0.53 2.20 2.76 -0.41 -1.68 115.15 118.54 2qcu h HIS 416 Ca 0.16 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 2qcu h HIS 416 Cb 0.30 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.13 2qcu h HIS 416 CO 0.02 0.44 0.24 1.88 -1.30 0.00 0.00 177.93 179.20 2qcu h TYR 417 N 0.19 0.78 -0.69 5.26 0.05 -1.01 -0.55 116.97 121.00 2qcu h TYR 417 Ca 0.07 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2qcu h TYR 417 Cb 0.25 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.71 2qcu h TYR 417 CO 0.01 0.62 0.44 0.00 -1.05 0.00 0.00 178.16 178.18 2qcu h ALA 418 N 1.08 0.88 0.00 3.88 0.00 -1.12 0.12 119.26 124.10 2qcu h ALA 418 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qcu h ALA 418 Cb 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2qcu h ALA 418 CO -0.02 0.32 -0.12 0.54 0.00 0.00 0.00 179.25 179.98 2qcu n ARG 419 N -4.58 0.11 -0.04 0.00 1.74 -0.64 -2.75 116.66 110.49 2qcu n ARG 419 Ca 0.06 0.07 -0.09 0.00 -0.77 0.00 0.00 57.85 57.12 2qcu n ARG 419 Cb 0.04 -1.61 -0.03 0.00 -1.02 0.00 0.00 32.46 29.84 2qcu n ARG 419 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 2qcu n THR 420 N -1.79 1.00 0.09 0.55 5.66 -0.23 -4.52 114.28 115.02 2qcu n THR 420 Ca 0.06 0.05 0.09 0.00 -3.05 0.00 0.00 64.05 61.20 2qcu n THR 420 Cb 0.38 -1.79 -0.02 0.00 -1.55 0.00 0.00 70.33 67.35 2qcu n THR 420 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2qcu n TYR 421 N -3.73 0.96 -1.09 1.09 4.01 0.35 -4.91 117.16 113.84 2qcu n TYR 421 Ca -0.16 0.29 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 2qcu n TYR 421 Cb 0.46 -0.98 0.00 0.00 -0.31 0.00 0.00 39.34 38.51 2qcu n TYR 421 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qcu n GLY 422 N 1.23 3.32 0.10 2.72 0.00 -0.76 -1.75 105.19 110.05 2qcu n GLY 422 Ca -0.02 -0.15 0.09 0.00 0.00 0.00 0.00 46.02 45.93 2qcu n GLY 422 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qcu n SER 423 N 3.55 0.41 0.00 1.61 3.41 0.19 -1.25 113.62 121.55 2qcu n SER 423 Ca 0.00 0.65 0.14 0.00 -0.26 0.00 0.00 58.87 59.40 2qcu n SER 423 Cb 0.00 -0.72 0.76 0.00 -0.26 0.00 0.00 64.21 63.99 2qcu n SER 423 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2qcu n ASN 424 N -2.01 0.00 0.01 4.04 5.03 -0.71 -4.08 115.26 117.53 2qcu n ASN 424 Ca 0.01 -0.46 0.04 0.00 0.87 0.00 0.00 54.58 55.03 2qcu n ASN 424 Cb 0.10 -0.16 0.41 0.00 -1.02 0.00 0.00 39.78 39.12 2qcu n ASN 424 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 2qcu h SER 425 N 0.00 0.46 -0.59 6.41 0.02 -1.32 -2.08 113.55 116.45 2qcu h SER 425 Ca 0.00 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2qcu h SER 425 Cb 0.14 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 2qcu h SER 425 CO 0.00 0.36 0.35 -0.33 -1.14 0.00 0.00 176.83 176.07 2qcu h GLU 426 N 0.53 0.82 -0.39 3.45 5.08 -1.82 -0.21 114.58 122.04 2qcu h GLU 426 Ca 0.14 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 2qcu h GLU 426 Cb -0.01 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 2qcu h GLU 426 CO -0.03 0.58 -0.26 1.25 -1.00 0.00 0.00 179.01 179.55 2qcu h LEU 427 N 0.83 0.84 -0.17 1.33 5.85 -1.67 -1.30 115.31 121.03 2qcu h LEU 427 Ca 0.22 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 2qcu h LEU 427 Cb -0.01 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 2qcu h LEU 427 CO -0.04 1.06 0.09 0.25 -0.34 0.00 0.00 178.44 179.46 2qcu h LEU 428 N 0.70 0.21 -0.40 2.25 6.46 -0.92 -3.20 115.31 120.40 2qcu h LEU 428 Ca 0.09 -0.08 -0.06 0.00 -0.12 0.00 0.00 57.88 57.70 2qcu h LEU 428 Cb 0.80 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 2qcu h LEU 428 CO 0.07 0.23 -0.30 -0.07 -0.62 0.00 0.00 178.44 177.75 2qcu h LEU 429 N 0.17 0.00 0.00 2.25 3.38 -0.92 -3.46 115.31 116.73 2qcu h LEU 429 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2qcu h LEU 429 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2qcu h LEU 429 CO -0.01 0.30 0.00 0.61 0.09 0.00 0.00 178.44 179.43 2qcu n GLY 430 N 0.82 3.10 1.27 0.83 0.00 -0.50 -1.24 105.19 109.47 2qcu n GLY 430 Ca 0.02 -0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 2qcu n GLY 430 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qcu n ASN 431 N 3.28 3.71 -4.76 1.61 0.23 -1.26 -4.96 115.26 113.10 2qcu n ASN 431 Ca 0.00 -2.36 -0.41 0.00 -0.53 0.00 0.00 54.58 51.28 2qcu n ASN 431 Cb 0.00 -0.51 -0.01 0.00 -2.08 0.00 0.00 39.78 37.18 2qcu n ASN 431 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2qcu s ALA 432 N -1.81 3.67 0.00 -2.53 0.00 -0.37 -4.92 121.76 115.79 2qcu s ALA 432 Ca 0.38 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.91 2qcu s ALA 432 Cb 0.25 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2qcu s ALA 432 CO 0.17 -1.02 0.43 0.41 0.00 0.00 0.00 175.76 175.76 2qcu n GLY 433 N 1.41 -0.81 3.33 0.00 0.00 -1.26 -5.09 105.19 102.77 2qcu n GLY 433 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 2qcu n GLY 433 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qcu s THR 434 N -0.15 0.00 0.24 2.61 -4.23 -1.26 -4.76 115.64 108.09 2qcu s THR 434 Ca 0.00 -1.83 -0.06 0.00 -1.18 0.00 0.00 61.69 58.62 2qcu s THR 434 Cb 0.00 -2.44 0.22 0.00 1.34 0.00 0.00 72.50 71.62 2qcu s THR 434 CO 0.00 0.00 1.88 0.58 -0.54 0.00 0.00 174.62 176.54 2qcu h VAL 435 N 2.44 1.13 0.00 2.29 2.07 -1.99 -2.44 116.25 119.75 2qcu h VAL 435 Ca -0.32 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 2qcu h VAL 435 Cb 1.25 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2qcu h VAL 435 CO 0.46 0.20 -0.08 0.77 0.02 0.00 0.00 177.57 178.94 2qcu h SER 436 N 1.09 0.00 0.69 0.57 4.64 -1.96 -0.96 113.55 117.63 2qcu h SER 436 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2qcu h SER 436 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2qcu h SER 436 CO -0.13 0.08 0.00 0.44 -0.87 0.00 0.00 176.83 176.35 2qcu h ASP 437 N 0.00 0.00 0.81 4.97 3.32 -1.84 -2.35 116.42 121.32 2qcu h ASP 437 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qcu h ASP 437 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2qcu h ASP 437 CO 0.01 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.71 2qcu n LEU 438 N -2.81 0.46 0.00 1.55 4.77 -0.36 -4.88 117.00 115.73 2qcu n LEU 438 Ca 0.00 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 2qcu n LEU 438 Cb 0.22 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 2qcu n LEU 438 CO 0.23 -0.37 0.00 0.61 -1.33 0.00 0.00 177.39 176.52 2qcu n GLY 439 N 0.33 -0.43 3.73 -0.72 0.00 -0.89 -1.03 105.19 106.19 2qcu n GLY 439 Ca 0.03 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 2qcu n GLY 439 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qcu n GLU 440 N 0.00 2.69 -3.06 1.61 2.13 -1.26 -4.52 120.64 118.23 2qcu n GLU 440 Ca 0.00 0.96 -0.42 0.00 0.66 0.00 0.00 57.16 58.36 2qcu n GLU 440 Cb 0.00 -2.75 -0.06 0.00 0.27 0.00 0.00 31.44 28.89 2qcu n GLU 440 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2qcu s ASP 441 N 0.67 6.43 0.00 4.31 -1.08 -1.26 -0.25 116.67 125.48 2qcu s ASP 441 Ca 0.67 0.05 0.26 0.00 -0.52 0.00 0.00 52.55 53.01 2qcu s ASP 441 Cb -0.51 -2.35 0.77 0.00 -1.46 0.00 0.00 42.92 39.37 2qcu s ASP 441 CO 0.44 -0.71 1.59 0.49 0.52 0.00 0.00 175.17 177.50 2qcu n PHE 442 N 6.27 0.00 0.00 -5.34 3.72 -0.04 -5.01 117.46 117.06 2qcu n PHE 442 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2qcu n PHE 442 Cb 0.48 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.75 2qcu n PHE 442 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qcu n GLY 443 N 1.45 3.75 3.95 1.37 0.00 -1.25 -4.84 105.19 109.61 2qcu n GLY 443 Ca 0.08 -1.52 -0.30 0.00 0.00 0.00 0.00 46.02 44.28 2qcu n GLY 443 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2qcu n HIS 444 N -0.75 -2.18 -2.91 1.61 -0.00 -1.26 -0.95 115.22 108.78 2qcu n HIS 444 Ca 0.00 0.88 -0.20 0.00 -0.00 0.00 0.00 57.72 58.40 2qcu n HIS 444 Cb 0.00 -3.85 0.01 0.00 -0.00 0.00 0.00 29.99 26.15 2qcu n HIS 444 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2qcu n GLU 445 N -4.61 -3.42 -3.28 1.57 1.02 -1.26 -4.94 120.64 105.72 2qcu n GLU 445 Ca 0.01 0.72 -0.46 0.00 -0.02 0.00 0.00 57.16 57.41 2qcu n GLU 445 Cb 0.54 -5.45 -0.04 0.00 -0.02 0.00 0.00 31.44 26.46 2qcu n GLU 445 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2qcu s PHE 446 N -2.96 3.31 0.31 -0.32 5.36 -0.13 -5.03 117.98 118.53 2qcu s PHE 446 Ca 0.22 -1.38 0.02 0.00 -0.96 0.00 0.00 56.93 54.84 2qcu s PHE 446 Cb -0.11 -3.84 -0.03 0.00 -0.34 0.00 0.00 43.02 38.70 2qcu s PHE 446 CO 0.28 -1.06 0.48 0.71 -1.46 0.00 0.00 175.22 174.17 2qcu s TYR 447 N 1.50 3.48 0.31 10.12 1.51 -1.26 -0.86 117.35 132.15 2qcu s TYR 447 Ca 0.07 0.22 0.08 0.00 -1.01 0.00 0.00 57.07 56.42 2qcu s TYR 447 Cb -0.25 -1.78 0.88 0.00 -0.11 0.00 0.00 41.96 40.70 2qcu s TYR 447 CO 0.01 0.24 1.65 1.49 -1.11 0.00 0.00 175.55 177.82 2qcu h GLU 448 N 0.90 0.24 -0.73 -0.62 4.81 -0.53 -0.18 114.58 118.46 2qcu h GLU 448 Ca -0.51 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 58.78 2qcu h GLU 448 Cb 1.22 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.50 2qcu h GLU 448 CO 0.61 0.16 0.48 0.00 -0.73 0.00 0.00 179.01 179.53 2qcu h ALA 449 N 1.82 1.70 0.00 2.92 0.00 -1.38 0.31 119.26 124.64 2qcu h ALA 449 Ca 0.64 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.43 2qcu h ALA 449 Cb 1.37 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.97 2qcu h ALA 449 CO -0.65 0.18 -0.35 1.49 0.00 0.00 0.00 179.25 179.92 2qcu h GLU 450 N 0.76 0.23 -0.81 0.00 4.81 -1.34 -1.99 114.58 116.24 2qcu h GLU 450 Ca 0.32 -0.26 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 2qcu h GLU 450 Cb 0.26 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 2qcu h GLU 450 CO -0.11 0.98 0.35 1.25 -0.73 0.00 0.00 179.01 180.75 2qcu h LEU 451 N -0.41 1.10 -0.25 1.64 5.85 -1.10 0.56 115.31 122.69 2qcu h LEU 451 Ca -0.05 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2qcu h LEU 451 Cb 1.11 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 2qcu h LEU 451 CO 0.07 0.96 0.16 0.50 -0.34 0.00 0.00 178.44 179.78 2qcu h LYS 452 N 1.17 0.31 -0.73 1.25 3.64 -0.99 -1.90 116.57 119.32 2qcu h LYS 452 Ca 0.27 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2qcu h LYS 452 Cb 0.18 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.88 2qcu h LYS 452 CO -0.03 0.21 0.43 -0.92 -2.27 0.00 0.00 179.45 176.87 2qcu h TYR 453 N 0.32 0.80 -0.61 1.91 3.20 -0.93 0.11 116.97 121.76 2qcu h TYR 453 Ca 0.10 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 2qcu h TYR 453 Cb -0.02 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 37.97 2qcu h TYR 453 CO -0.07 0.40 0.31 -0.07 -1.64 0.00 0.00 178.16 177.09 2qcu h LEU 454 N 0.80 0.78 -0.19 2.82 3.38 -0.46 0.13 115.31 122.58 2qcu h LEU 454 Ca 0.32 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 2qcu h LEU 454 Cb 0.16 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2qcu h LEU 454 CO -0.17 0.68 -0.04 0.58 0.09 0.00 0.00 178.44 179.58 2qcu h VAL 455 N 0.83 1.28 -0.42 1.22 2.07 -0.82 -0.71 116.25 119.70 2qcu h VAL 455 Ca 0.21 -1.00 -0.08 0.00 0.82 0.00 0.00 66.70 66.65 2qcu h VAL 455 Cb 0.09 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 2qcu h VAL 455 CO -0.03 0.30 -0.06 0.44 0.02 0.00 0.00 177.57 178.25 2qcu h ASP 456 N 0.08 0.69 0.00 0.57 3.32 -0.45 -3.35 116.42 117.27 2qcu h ASP 456 Ca 0.05 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2qcu h ASP 456 Cb 0.48 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2qcu h ASP 456 CO 0.02 0.80 0.00 1.41 -1.72 0.00 0.00 179.24 179.74 2qcu n HIS 457 N -4.20 0.00 -1.40 4.55 8.25 0.44 -4.79 115.22 118.08 2qcu n HIS 457 Ca 0.02 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.53 2qcu n HIS 457 Cb 0.32 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.50 2qcu n HIS 457 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2qcu n GLU 458 N -0.80 0.80 -1.80 -0.41 1.02 -0.32 -4.97 120.64 114.17 2qcu n GLU 458 Ca 0.00 -1.83 -0.17 0.00 -0.02 0.00 0.00 57.16 55.15 2qcu n GLU 458 Cb 0.00 -1.04 -0.05 0.00 -0.02 0.00 0.00 31.44 30.33 2qcu n GLU 458 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2qcu n TRP 459 N -0.77 -0.54 -2.30 -0.32 8.01 -1.10 -4.90 117.44 115.52 2qcu n TRP 459 Ca 0.08 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.86 2qcu n TRP 459 Cb 0.64 -3.13 -0.03 0.00 -2.01 0.00 0.00 31.31 26.78 2qcu n TRP 459 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 2qcu s VAL 460 N -2.56 3.61 0.00 -0.99 1.01 -0.95 -4.87 120.40 115.65 2qcu s VAL 460 Ca 0.00 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.18 2qcu s VAL 460 Cb 0.00 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2qcu s VAL 460 CO 0.00 0.12 0.00 0.54 0.00 0.00 0.00 175.10 175.76 2qcu n ARG 461 N 3.56 2.54 -4.22 2.72 5.12 -1.26 -4.46 116.66 120.66 2qcu n ARG 461 Ca 0.09 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.88 2qcu n ARG 461 Cb 0.44 -0.93 -0.10 0.00 -1.16 0.00 0.00 32.46 30.72 2qcu n ARG 461 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2qcu s ARG 462 N -1.85 0.98 0.23 5.56 1.81 -1.26 -4.87 118.95 119.55 2qcu s ARG 462 Ca 0.00 -1.40 -0.07 0.00 -1.72 0.00 0.00 55.73 52.54 2qcu s ARG 462 Cb 0.00 -0.49 0.27 0.00 -0.45 0.00 0.00 34.95 34.28 2qcu s ARG 462 CO 0.00 0.05 1.85 0.00 -0.68 0.00 0.00 175.30 176.52 2qcu h ALA 463 N 2.89 1.08 -0.84 2.13 0.00 -1.91 -1.82 119.26 120.78 2qcu h ALA 463 Ca -0.36 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.59 2qcu h ALA 463 Cb 1.18 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 2qcu h ALA 463 CO 0.63 0.27 0.55 -0.44 0.00 0.00 0.00 179.25 180.26 2qcu h ASP 464 N 0.94 0.84 -0.65 0.00 5.19 -1.97 0.46 116.42 121.24 2qcu h ASP 464 Ca 0.34 -0.00 0.11 0.00 -0.62 0.00 0.00 57.03 56.86 2qcu h ASP 464 Cb 0.09 -0.18 -0.08 0.00 0.18 0.00 0.00 39.33 39.34 2qcu h ASP 464 CO -0.14 0.56 0.24 0.44 -3.12 0.00 0.00 179.24 177.21 2qcu h ASP 465 N 0.97 0.21 0.37 6.45 3.32 -1.74 -0.68 116.42 125.32 2qcu h ASP 465 Ca 0.35 0.09 -0.29 0.00 0.02 0.00 0.00 57.03 57.20 2qcu h ASP 465 Cb 0.15 0.08 0.02 0.00 0.22 0.00 0.00 39.33 39.80 2qcu h ASP 465 CO -0.12 0.11 -1.26 0.00 -1.72 0.00 0.00 179.24 176.25 2qcu h ALA 466 N 1.46 0.04 0.00 3.45 0.00 -1.15 0.74 119.26 123.81 2qcu h ALA 466 Ca 0.34 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2qcu h ALA 466 Cb 0.46 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2qcu h ALA 466 CO -0.35 0.81 -1.33 1.28 0.00 0.00 0.00 179.25 179.66 2qcu n LEU 467 N -3.68 0.52 0.00 0.00 4.77 0.03 -2.01 117.00 116.63 2qcu n LEU 467 Ca -0.12 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2qcu n LEU 467 Cb 1.01 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 2qcu n LEU 467 CO 0.56 -0.07 -0.25 0.79 -1.33 0.00 0.00 177.39 177.10 2qcu n TRP 468 N -2.36 0.00 0.01 -1.77 7.02 -0.27 -0.64 117.44 119.42 2qcu n TRP 468 Ca -0.01 0.00 -0.03 0.00 -1.02 0.00 0.00 57.50 56.44 2qcu n TRP 468 Cb 0.53 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.41 2qcu n TRP 468 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2qcu n ARG 469 N -0.96 0.11 -0.19 -0.99 1.74 -1.09 -4.73 116.66 110.55 2qcu n ARG 469 Ca 0.00 0.04 -0.04 0.00 -0.77 0.00 0.00 57.85 57.08 2qcu n ARG 469 Cb 0.00 -0.69 0.06 0.00 -1.02 0.00 0.00 32.46 30.81 2qcu n ARG 469 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qcu h ARG 470 N -0.20 0.62 0.00 5.56 2.47 -1.00 -3.39 114.38 118.44 2qcu h ARG 470 Ca -0.04 -0.04 -0.11 0.00 -1.26 0.00 0.00 59.98 58.53 2qcu h ARG 470 Cb 0.45 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.61 2qcu h ARG 470 CO -0.02 0.41 -0.10 0.25 0.56 0.00 0.00 179.97 181.07 2qcu n THR 471 N -4.79 0.00 -2.25 2.04 -2.24 -0.85 -4.85 114.28 101.34 2qcu n THR 471 Ca 0.05 -0.49 -0.06 0.00 -2.27 0.00 0.00 64.05 61.28 2qcu n THR 471 Cb 0.11 0.17 0.07 0.00 -2.10 0.00 0.00 70.33 68.58 2qcu n THR 471 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qcu n LYS 472 N -0.19 2.07 0.19 -0.78 4.76 -1.24 -2.75 118.16 120.23 2qcu n LYS 472 Ca -0.01 -3.45 0.13 0.00 -2.87 0.00 0.00 58.31 52.11 2qcu n LYS 472 Cb 0.13 -1.58 0.69 0.00 -1.84 0.00 0.00 35.03 32.43 2qcu n LYS 472 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 2qcu h GLN 473 N 1.87 0.00 -0.10 1.97 1.08 -1.74 -1.48 115.11 116.71 2qcu h GLN 473 Ca 0.05 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.28 2qcu h GLN 473 Cb 1.41 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.84 2qcu h GLN 473 CO 0.33 0.00 0.12 0.78 -0.95 0.00 0.00 178.83 179.11 2qcu h GLY 474 N 0.24 0.00 2.00 3.46 0.00 -1.19 -0.42 103.07 107.16 2qcu h GLY 474 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2qcu h GLY 474 CO 0.00 0.00 -0.05 -0.33 0.00 0.00 0.00 176.54 176.16 2qcu h MET 475 N 0.00 0.00 0.00 4.80 2.86 -1.51 -3.35 114.93 117.73 2qcu h MET 475 Ca 0.05 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.58 2qcu h MET 475 Cb 0.28 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 2qcu h MET 475 CO -0.00 0.05 -1.39 0.91 1.06 0.00 0.00 176.91 177.53 2qcu n TRP 476 N -3.27 0.00 -2.38 -0.22 8.01 -0.25 -5.02 117.44 114.31 2qcu n TRP 476 Ca -0.01 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.77 2qcu n TRP 476 Cb 0.22 -0.27 -0.04 0.00 -2.01 0.00 0.00 31.31 29.21 2qcu n TRP 476 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 2qcu s LEU 477 N -4.86 4.47 0.99 -0.99 1.02 -0.73 -4.98 118.68 113.60 2qcu s LEU 477 Ca -0.06 2.26 -0.16 0.00 0.02 0.00 0.00 54.13 56.18 2qcu s LEU 477 Cb 0.02 -3.61 0.21 0.00 0.02 0.00 0.00 46.19 42.83 2qcu s LEU 477 CO 0.20 -0.34 1.32 0.54 0.02 0.00 0.00 176.35 178.09 2qcu s ASN 478 N -0.06 2.90 0.18 2.29 2.20 -1.26 -4.74 114.94 116.45 2qcu s ASN 478 Ca 0.51 0.25 -0.12 0.00 -0.94 0.00 0.00 52.86 52.57 2qcu s ASN 478 Cb -0.33 -0.28 0.10 0.00 -2.00 0.00 0.00 41.25 38.74 2qcu s ASN 478 CO 0.38 -2.87 1.81 0.00 -2.94 0.00 0.00 177.10 173.48 2qcu h ALA 479 N -1.73 0.80 -0.59 3.54 0.00 -1.99 -0.86 119.26 118.43 2qcu h ALA 479 Ca -0.44 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2qcu h ALA 479 Cb 1.23 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2qcu h ALA 479 CO 0.36 0.30 0.28 -0.44 0.00 0.00 0.00 179.25 179.75 2qcu h ASP 480 N 0.85 0.78 -0.41 0.00 3.32 -1.99 -0.11 116.42 118.87 2qcu h ASP 480 Ca 0.22 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 2qcu h ASP 480 Cb 0.01 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2qcu h ASP 480 CO -0.04 0.70 -0.04 1.56 -1.72 0.00 0.00 179.24 179.70 2qcu h GLN 481 N 0.81 0.82 -0.29 3.56 4.20 -1.79 -0.84 115.11 121.58 2qcu h GLN 481 Ca 0.20 -0.24 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 2qcu h GLN 481 Cb 0.13 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2qcu h GLN 481 CO -0.02 0.85 -0.39 1.96 -0.67 0.00 0.00 178.83 180.55 2qcu h GLN 482 N 0.76 0.68 -0.63 1.46 4.20 -0.91 -1.57 115.11 119.11 2qcu h GLN 482 Ca 0.14 -0.35 0.02 0.00 0.06 0.00 0.00 58.65 58.52 2qcu h GLN 482 Cb 0.51 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 2qcu h GLN 482 CO 0.03 0.96 0.40 1.03 -0.67 0.00 0.00 178.83 180.57 2qcu h SER 483 N 0.56 0.66 -0.61 1.46 0.87 -0.79 -1.74 113.55 113.96 2qcu h SER 483 Ca 0.05 -0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2qcu h SER 483 Cb 0.92 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.70 2qcu h SER 483 CO 0.08 0.46 0.40 -0.09 -0.53 0.00 0.00 176.83 177.16 2qcu h ARG 484 N 0.79 0.79 -0.77 2.24 9.65 -0.89 -1.38 114.38 124.81 2qcu h ARG 484 Ca 0.25 -0.05 0.08 0.00 -1.10 0.00 0.00 59.98 59.16 2qcu h ARG 484 Cb -0.01 -0.18 -0.07 0.00 -1.39 0.00 0.00 29.97 28.32 2qcu h ARG 484 CO -0.09 0.52 0.44 0.28 2.80 0.00 0.00 179.97 183.92 2qcu h VAL 485 N 0.81 0.93 -0.68 0.20 2.07 -0.98 -0.15 116.25 118.46 2qcu h VAL 485 Ca 0.23 -0.26 -0.07 0.00 0.82 0.00 0.00 66.70 67.42 2qcu h VAL 485 Cb -0.07 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 29.78 2qcu h VAL 485 CO -0.06 0.14 0.14 0.28 0.02 0.00 0.00 177.57 178.09 2qcu h SER 486 N 0.76 1.04 -0.42 0.57 0.02 -0.77 -1.58 113.55 113.18 2qcu h SER 486 Ca 0.36 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 61.00 2qcu h SER 486 Cb 0.29 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2qcu h SER 486 CO -0.22 1.02 -0.03 -0.61 -1.14 0.00 0.00 176.83 175.84 2qcu h GLN 487 N 1.03 0.76 -0.71 3.45 4.15 -0.86 -1.31 115.11 121.63 2qcu h GLN 487 Ca 0.21 -0.26 0.01 0.00 0.77 0.00 0.00 58.65 59.38 2qcu h GLN 487 Cb 0.40 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.99 2qcu h GLN 487 CO 0.01 0.86 0.47 2.35 -1.93 0.00 0.00 178.83 180.58 2qcu h TRP 488 N 0.59 0.90 -0.22 3.99 7.01 -0.77 -2.24 115.95 125.21 2qcu h TRP 488 Ca 0.12 0.02 -0.14 0.00 2.11 0.00 0.00 58.89 60.99 2qcu h TRP 488 Cb 0.53 -0.30 0.00 0.00 -2.10 0.00 0.00 29.16 27.29 2qcu h TRP 488 CO 0.04 0.57 -0.41 -0.07 -2.79 0.00 0.00 178.44 175.78 2qcu h LEU 489 N 0.97 0.75 -0.42 0.65 3.38 -0.61 0.38 115.31 120.41 2qcu h LEU 489 Ca 0.26 -0.54 0.07 0.00 0.09 0.00 0.00 57.88 57.76 2qcu h LEU 489 Cb -0.10 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.37 2qcu h LEU 489 CO -0.06 1.15 0.08 0.58 0.09 0.00 0.00 178.44 180.29 2qcu h VAL 490 N 0.38 0.78 0.46 1.22 2.07 -1.03 0.11 116.25 120.24 2qcu h VAL 490 Ca 0.01 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2qcu h VAL 490 Cb 1.01 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2qcu h VAL 490 CO 0.09 0.04 -0.22 -0.33 0.02 0.00 0.00 177.57 177.17 2qcu h GLU 491 N 0.22 -0.59 -0.34 1.57 5.08 -1.02 -1.67 114.58 117.82 2qcu h GLU 491 Ca 0.20 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2qcu h GLU 491 Cb 0.25 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2qcu h GLU 491 CO -0.27 -0.32 0.22 -0.92 -1.00 0.00 0.00 179.01 176.72 2qcu h TYR 492 N -0.76 0.43 0.00 4.33 3.20 -0.77 -3.14 116.97 120.26 2qcu h TYR 492 Ca -0.06 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.82 2qcu h TYR 492 Cb 0.54 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2qcu h TYR 492 CO -0.01 0.28 -0.34 0.25 -1.64 0.00 0.00 178.16 176.70 2qcu n THR 493 N -4.84 0.20 -0.03 1.81 -2.24 0.38 -3.70 114.28 105.86 2qcu n THR 493 Ca -0.01 -0.13 0.06 0.00 -2.27 0.00 0.00 64.05 61.70 2qcu n THR 493 Cb 0.03 -0.17 -0.16 0.00 -2.10 0.00 0.00 70.33 67.92 2qcu n THR 493 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qcu n GLN 494 N -1.80 0.68 -3.68 -0.78 6.02 -0.63 -4.61 117.38 112.57 2qcu n GLN 494 Ca 0.05 -0.15 -0.10 0.00 -0.01 0.00 0.00 57.00 56.79 2qcu n GLN 494 Cb 0.38 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 30.09 2qcu n GLN 494 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2qcu s GLN 495 N -3.23 1.15 -1.39 -1.09 -2.07 -1.19 -4.62 119.66 107.23 2qcu s GLN 495 Ca -0.08 -0.78 -0.00 0.00 -1.82 0.00 0.00 55.36 52.68 2qcu s GLN 495 Cb 0.12 0.48 -0.00 0.00 -1.09 0.00 0.00 33.01 32.51 2qcu s GLN 495 CO 0.87 -0.46 0.47 2.89 -1.32 0.00 0.00 175.29 177.73 2qcu n ARG 496 N -0.25 -3.57 0.00 9.60 1.85 -1.26 -4.42 116.66 118.60 2qcu n ARG 496 Ca -0.14 0.44 0.00 0.00 -1.00 0.00 0.00 57.85 57.15 2qcu n ARG 496 Cb 0.63 -4.64 0.00 0.00 -1.05 0.00 0.00 32.46 27.40 2qcu n ARG 496 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2qcu n LEU 497 N -4.38 0.00 -4.71 2.89 7.94 -1.24 -4.82 117.00 112.69 2qcu n LEU 497 Ca -0.31 0.00 -0.64 0.00 -1.11 0.00 0.00 56.01 53.95 2qcu n LEU 497 Cb 0.69 0.44 -0.09 0.00 0.53 0.00 0.00 43.42 44.98 2qcu n LEU 497 CO 0.74 -0.44 1.25 -1.20 -1.11 0.00 0.00 177.39 176.64 2qcu n SER 498 N -2.36 1.64 -3.61 1.96 7.64 -1.26 -4.77 113.62 112.87 2qcu n SER 498 Ca 0.00 1.11 -0.41 0.00 1.01 0.00 0.00 58.87 60.58 2qcu n SER 498 Cb 0.00 -0.98 0.01 0.00 -1.01 0.00 0.00 64.21 62.23 2qcu n SER 498 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2qcu n LEU 499 N 4.78 7.53 0.00 -3.43 7.94 -1.26 -3.96 117.00 128.59 2qcu n LEU 499 Ca 0.31 -5.23 0.00 0.00 -1.11 0.00 0.00 56.01 49.98 2qcu n LEU 499 Cb 0.02 -1.23 0.00 0.00 0.53 0.00 0.00 43.42 42.73 2qcu n LEU 499 CO 0.86 2.03 0.00 0.00 -1.11 0.00 0.00 177.39 179.18 2qcu n ALA 500 N 0.58 0.00 -0.07 1.96 0.00 -1.26 -4.98 120.51 116.74 2qcu n ALA 500 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2qcu n ALA 500 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2qcu n ALA 500 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93