#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqs s ARG 2 N 0.00 1.38 -0.05 2.12 0.52 -1.26 -2.78 118.95 118.87 2cqs s ARG 2 Ca 0.00 -1.45 0.08 0.00 -0.52 0.00 0.00 55.73 53.84 2cqs s ARG 2 Cb 0.00 -1.57 0.12 0.00 0.52 0.00 0.00 34.95 34.01 2cqs s ARG 2 CO 0.00 0.33 1.02 0.66 0.02 0.00 0.00 175.30 177.34 2cqs n TYR 3 N 0.33 0.00 -3.38 -0.53 4.01 -1.26 -5.07 117.16 111.26 2cqs n TYR 3 Ca -0.13 -0.63 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 2cqs n TYR 3 Cb 0.56 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 2cqs n TYR 3 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2cqs n GLY 4 N -0.81 -0.75 3.47 2.72 0.00 -1.26 -1.46 105.19 107.10 2cqs n GLY 4 Ca 0.06 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.13 2cqs n GLY 4 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2cqs s HIS 5 N -3.00 -0.48 0.26 1.61 -3.43 0.05 -4.96 115.29 105.34 2cqs s HIS 5 Ca 0.00 0.26 -0.25 0.00 -0.80 0.00 0.00 55.06 54.27 2cqs s HIS 5 Cb 0.00 0.57 -0.09 0.00 -1.43 0.00 0.00 32.58 31.63 2cqs s HIS 5 CO 0.00 -0.85 0.87 -0.06 -2.00 0.00 0.00 174.74 172.70 2cqs s PHE 6 N -3.69 3.76 -0.51 0.38 0.08 -1.26 -0.08 117.98 116.66 2cqs s PHE 6 Ca 0.02 1.69 0.04 0.00 0.12 0.00 0.00 56.93 58.80 2cqs s PHE 6 Cb -0.01 -2.84 0.14 0.00 -0.57 0.00 0.00 43.02 39.73 2cqs s PHE 6 CO -0.11 0.33 0.28 0.34 -0.10 0.00 0.00 175.22 175.96 2cqs s ASP 7 N -1.48 4.12 0.19 1.36 -1.08 -0.08 -4.89 116.67 114.80 2cqs s ASP 7 Ca 0.45 -2.98 -0.13 0.00 -0.52 0.00 0.00 52.55 49.37 2cqs s ASP 7 Cb -0.20 -1.44 0.10 0.00 -1.46 0.00 0.00 42.92 39.91 2cqs s ASP 7 CO 0.25 -0.23 1.84 0.44 0.52 0.00 0.00 175.17 177.99 2cqs h ASP 8 N 6.45 0.72 -0.52 -0.34 3.32 -1.96 0.24 116.42 124.33 2cqs h ASP 8 Ca -0.03 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.01 2cqs h ASP 8 Cb 0.89 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 2cqs h ASP 8 CO 0.63 0.55 0.35 0.00 -1.72 0.00 0.00 179.24 179.04 2cqs h ALA 9 N 1.21 1.73 -0.01 3.45 0.00 -1.95 -1.61 119.26 122.08 2cqs h ALA 9 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2cqs h ALA 9 Cb -0.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2cqs h ALA 9 CO -0.05 0.21 -0.35 0.00 0.00 0.00 0.00 179.25 179.06 2cqs n ALA 10 N -2.47 3.28 -3.62 0.00 0.00 -1.05 -4.97 120.51 111.68 2cqs n ALA 10 Ca 0.06 -0.57 -0.22 0.00 0.00 0.00 0.00 53.44 52.71 2cqs n ALA 10 Cb 0.13 -0.91 0.04 0.00 0.00 0.00 0.00 19.45 18.72 2cqs n ALA 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2cqs n ARG 11 N -0.07 -4.22 -4.10 0.00 1.74 0.01 -4.88 116.66 105.13 2cqs n ARG 11 Ca 0.11 0.65 -0.08 0.00 -0.77 0.00 0.00 57.85 57.75 2cqs n ARG 11 Cb 0.44 -5.16 -0.10 0.00 -1.02 0.00 0.00 32.46 26.62 2cqs n ARG 11 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2cqs s GLU 12 N -5.74 0.80 -0.17 5.56 2.02 -0.80 -3.91 118.70 116.47 2cqs s GLU 12 Ca 0.12 -1.31 -0.02 0.00 0.02 0.00 0.00 54.97 53.79 2cqs s GLU 12 Cb -0.03 0.24 -0.01 0.00 0.10 0.00 0.00 34.13 34.43 2cqs s GLU 12 CO 0.80 -0.21 -0.10 -0.47 0.02 0.00 0.00 175.26 175.31 2cqs s TYR 13 N -3.98 2.88 -0.39 1.61 5.04 -0.31 -0.90 117.35 121.30 2cqs s TYR 13 Ca 0.16 -0.80 -0.15 0.00 -2.44 0.00 0.00 57.07 53.84 2cqs s TYR 13 Cb 0.07 -1.95 0.01 0.00 0.35 0.00 0.00 41.96 40.44 2cqs s TYR 13 CO -0.04 -0.37 0.31 0.08 -1.34 0.00 0.00 175.55 174.19 2cqs s VAL 14 N 0.83 5.23 -0.31 3.14 1.01 0.88 -1.57 120.40 129.61 2cqs s VAL 14 Ca -0.03 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 61.36 2cqs s VAL 14 Cb -0.15 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 2cqs s VAL 14 CO 0.01 -0.22 0.46 -0.63 0.00 0.00 0.00 175.10 174.72 2cqs s ILE 15 N 1.79 5.08 -2.04 2.22 1.01 0.68 -0.77 121.20 129.17 2cqs s ILE 15 Ca 0.07 0.47 0.18 0.00 0.00 0.00 0.00 60.65 61.37 2cqs s ILE 15 Cb -0.18 -3.86 0.51 0.00 0.01 0.00 0.00 42.46 38.94 2cqs s ILE 15 CO 0.11 -0.05 1.43 0.35 0.00 0.00 0.00 174.94 176.78 2cqs n THR 16 N 5.28 0.74 -3.62 2.92 -2.24 -0.54 -1.20 114.28 115.62 2cqs n THR 16 Ca -0.06 -0.76 -0.13 0.00 -2.27 0.00 0.00 64.05 60.82 2cqs n THR 16 Cb 0.50 0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.09 2cqs n THR 16 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2cqs s THR 17 N -1.26 0.04 -0.32 4.28 -1.32 -1.26 -4.80 115.64 111.01 2cqs s THR 17 Ca 0.39 -0.35 0.21 0.00 -1.21 0.00 0.00 61.69 60.73 2cqs s THR 17 Cb 0.20 -0.95 0.17 0.00 -1.51 0.00 0.00 72.50 70.41 2cqs s THR 17 CO 0.27 -0.19 1.36 -0.65 -2.21 0.00 0.00 174.62 173.20 2cqs h PRO 18 N 2.94 0.00 -3.08 7.08 0.11 -1.93 -3.40 132.00 133.73 2cqs h PRO 18 Ca -0.31 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 65.11 2cqs h PRO 18 Cb 1.21 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2cqs h PRO 18 CO 0.42 0.09 3.38 0.72 -0.21 0.00 0.00 178.00 182.40 2cqs n HIS 19 N -2.98 2.63 -2.25 0.65 8.25 -1.26 -4.95 115.22 115.31 2cqs n HIS 19 Ca 0.02 -3.01 -0.27 0.00 -0.26 0.00 0.00 57.72 54.19 2cqs n HIS 19 Cb 0.59 -2.34 0.04 0.00 1.12 0.00 0.00 29.99 29.40 2cqs n HIS 19 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2cqs s THR 20 N 1.53 3.28 0.40 1.59 -4.23 -1.26 -4.97 115.64 111.98 2cqs s THR 20 Ca 0.62 0.02 0.16 0.00 -1.18 0.00 0.00 61.69 61.32 2cqs s THR 20 Cb 0.17 -3.34 0.17 0.00 1.34 0.00 0.00 72.50 70.84 2cqs s THR 20 CO -0.07 -0.38 1.94 -0.65 -0.54 0.00 0.00 174.62 174.92 2cqs h PRO 21 N -0.37 0.00 -3.23 3.99 0.11 -1.91 -3.45 132.00 127.14 2cqs h PRO 21 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 2cqs h PRO 21 Cb 1.27 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.26 2cqs h PRO 21 CO 0.61 0.25 0.05 -0.47 -0.21 0.00 0.00 178.00 178.23 2cqs s TYR 22 N -4.35 -0.33 0.18 0.65 5.04 -1.24 -5.01 117.35 112.29 2cqs s TYR 22 Ca -0.03 0.06 -0.32 0.00 -2.44 0.00 0.00 57.07 54.34 2cqs s TYR 22 Cb 0.15 0.39 -0.11 0.00 0.35 0.00 0.00 41.96 42.73 2cqs s TYR 22 CO 0.69 -0.77 1.74 -2.14 -1.34 0.00 0.00 175.55 173.72 2cqs s PRO 23 N -3.79 4.13 -0.26 4.97 0.02 -1.26 -4.94 135.00 133.88 2cqs s PRO 23 Ca 0.02 2.59 -0.07 0.00 0.02 0.00 0.00 61.00 63.57 2cqs s PRO 23 Cb 0.01 -3.21 -0.01 0.00 0.02 0.00 0.00 34.50 31.30 2cqs s PRO 23 CO -0.12 -0.76 0.05 -1.58 -0.33 0.00 0.00 177.00 174.26 2cqs s TRP 24 N 1.57 3.08 0.36 6.54 0.51 -1.26 -4.80 118.94 124.93 2cqs s TRP 24 Ca 0.76 -0.67 0.08 0.00 -2.12 0.00 0.00 56.10 54.15 2cqs s TRP 24 Cb -0.48 -2.22 -0.03 0.00 -0.81 0.00 0.00 33.47 29.92 2cqs s TRP 24 CO 0.33 -0.45 0.24 0.96 -0.51 0.00 0.00 176.95 177.51 2cqs s ILE 25 N 1.56 3.08 0.17 2.03 -4.36 -1.26 -0.95 121.20 121.47 2cqs s ILE 25 Ca 0.05 -1.52 0.05 0.00 -0.26 0.00 0.00 60.65 58.98 2cqs s ILE 25 Cb -0.15 -3.06 -0.05 0.00 1.25 0.00 0.00 42.46 40.45 2cqs s ILE 25 CO 0.02 -0.13 -0.11 0.21 0.24 0.00 0.00 174.94 175.17 2cqs s ASN 26 N -3.95 2.06 -0.12 4.36 2.47 0.51 -4.96 114.94 115.30 2cqs s ASN 26 Ca 0.41 -1.03 -0.01 0.00 0.42 0.00 0.00 52.86 52.65 2cqs s ASN 26 Cb -0.03 -0.05 -0.02 0.00 -1.45 0.00 0.00 41.25 39.69 2cqs s ASN 26 CO 0.25 -0.29 -0.10 -0.31 -3.72 0.00 0.00 177.10 172.93 2cqs s TYR 27 N -3.21 2.88 -0.08 0.43 2.02 -1.26 -1.43 117.35 116.69 2cqs s TYR 27 Ca 0.19 -0.42 -0.02 0.00 -0.37 0.00 0.00 57.07 56.46 2cqs s TYR 27 Cb 0.02 -1.84 -0.03 0.00 -0.40 0.00 0.00 41.96 39.70 2cqs s TYR 27 CO 0.03 -0.06 -0.00 -0.51 -1.57 0.00 0.00 175.55 173.43 2cqs s LEU 28 N 0.13 3.54 0.00 -1.29 1.43 0.07 -4.29 118.68 118.27 2cqs s LEU 28 Ca -0.04 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 2cqs s LEU 28 Cb -0.14 -1.81 0.00 0.00 0.03 0.00 0.00 46.19 44.27 2cqs s LEU 28 CO 0.04 0.38 0.00 0.61 0.23 0.00 0.00 176.35 177.61 2cqs n GLY 29 N 2.15 1.60 0.00 -3.19 0.00 -1.26 -1.36 105.19 103.13 2cqs n GLY 29 Ca -0.19 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2cqs n GLY 29 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqs n SER 30 N -0.17 0.00 0.00 1.61 3.41 -1.26 -4.93 113.62 112.28 2cqs n SER 30 Ca 0.00 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 2cqs n SER 30 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2cqs n SER 30 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2cqs n GLU 31 N 0.00 0.00 0.00 4.33 1.02 -1.26 -5.00 120.64 119.73 2cqs n GLU 31 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2cqs n GLU 31 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.84 2cqs n GLU 31 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2cqs n GLN 32 N 0.00 2.72 -4.68 3.49 6.02 -1.26 -5.00 117.38 118.67 2cqs n GLN 32 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.66 2cqs n GLN 32 Cb 0.00 -0.75 -0.14 0.00 1.02 0.00 0.00 30.24 30.36 2cqs n GLN 32 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2cqs s PHE 33 N -1.43 2.83 0.09 1.08 5.36 -1.26 0.73 117.98 125.37 2cqs s PHE 33 Ca 0.00 -0.68 0.05 0.00 -0.96 0.00 0.00 56.93 55.34 2cqs s PHE 33 Cb 0.00 -1.87 -0.03 0.00 -0.34 0.00 0.00 43.02 40.78 2cqs s PHE 33 CO 0.00 -0.24 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.33 2cqs s PHE 34 N 0.46 1.17 -0.02 10.12 0.08 -0.56 -4.33 117.98 124.90 2cqs s PHE 34 Ca -0.09 -0.53 0.02 0.00 0.12 0.00 0.00 56.93 56.44 2cqs s PHE 34 Cb -0.16 -0.65 0.01 0.00 -0.57 0.00 0.00 43.02 41.65 2cqs s PHE 34 CO 0.04 0.05 -0.06 -1.12 -0.10 0.00 0.00 175.22 174.04 2cqs s SER 35 N -2.07 0.86 -0.27 1.36 0.01 -0.46 -1.25 113.70 111.88 2cqs s SER 35 Ca 0.02 -0.13 -0.11 0.00 1.31 0.00 0.00 55.95 57.04 2cqs s SER 35 Cb -0.07 -0.24 -0.05 0.00 0.21 0.00 0.00 66.02 65.87 2cqs s SER 35 CO 0.02 0.03 0.18 -0.76 0.41 0.00 0.00 173.24 173.11 2cqs s LEU 36 N 0.28 3.98 -0.16 2.44 1.02 0.40 -0.75 118.68 125.88 2cqs s LEU 36 Ca -0.03 -0.02 -0.00 0.00 0.02 0.00 0.00 54.13 54.10 2cqs s LEU 36 Cb -0.08 -2.10 0.04 0.00 0.02 0.00 0.00 46.19 44.07 2cqs s LEU 36 CO -0.00 -0.04 -0.07 -0.22 0.02 0.00 0.00 176.35 176.04 2cqs s LEU 37 N 1.68 1.59 0.73 1.79 2.96 -0.51 -2.42 118.68 124.51 2cqs s LEU 37 Ca 0.07 -0.59 -0.08 0.00 -0.22 0.00 0.00 54.13 53.31 2cqs s LEU 37 Cb -0.16 -0.95 0.07 0.00 0.50 0.00 0.00 46.19 45.65 2cqs s LEU 37 CO 0.10 -0.16 1.05 -0.94 -1.32 0.00 0.00 176.35 175.09 2cqs s SER 38 N 1.61 4.68 0.00 3.68 1.04 0.03 -0.36 113.70 124.38 2cqs s SER 38 Ca 0.02 0.48 0.15 0.00 0.48 0.00 0.00 55.95 57.08 2cqs s SER 38 Cb -0.15 -1.07 0.90 0.00 0.10 0.00 0.00 66.02 65.81 2cqs s SER 38 CO -0.08 -1.70 1.32 0.00 0.98 0.00 0.00 173.24 173.76 2cqs n HIS 39 N -3.02 0.00 -1.45 5.02 1.44 -0.13 -1.36 115.22 115.73 2cqs n HIS 39 Ca 0.08 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.87 2cqs n HIS 39 Cb 0.61 0.00 0.16 0.00 0.12 0.00 0.00 29.99 30.88 2cqs n HIS 39 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2cqs n GLN 40 N -0.96 1.31 -1.10 -1.40 1.13 -1.26 -4.84 117.38 110.26 2cqs n GLN 40 Ca 0.11 -2.83 -0.03 0.00 -1.94 0.00 0.00 57.00 52.31 2cqs n GLN 40 Cb 0.05 -1.43 -0.01 0.00 0.11 0.00 0.00 30.24 28.95 2cqs n GLN 40 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2cqs n ALA 41 N -1.12 -0.05 -1.90 -1.58 0.00 -0.46 -4.81 120.51 110.59 2cqs n ALA 41 Ca 0.16 0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.36 2cqs n ALA 41 Cb 0.69 -1.34 0.04 0.00 0.00 0.00 0.00 19.45 18.84 2cqs n ALA 41 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cqs s GLY 42 N -2.16 1.63 0.00 0.00 0.00 -1.26 -1.53 107.32 104.01 2cqs s GLY 42 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 44.72 44.40 2cqs s GLY 42 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 173.10 173.73 2cqs n GLY 43 N -2.91 0.57 3.79 0.20 0.00 -1.03 -0.79 105.19 105.02 2cqs n GLY 43 Ca 0.06 -2.15 -0.09 0.00 0.00 0.00 0.00 46.02 43.85 2cqs n GLY 43 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cqs s TYR 44 N -0.66 0.13 0.09 1.61 -0.85 -1.01 -4.57 117.35 112.09 2cqs s TYR 44 Ca 0.00 -0.70 0.05 0.00 -0.52 0.00 0.00 57.07 55.90 2cqs s TYR 44 Cb 0.00 0.71 -0.03 0.00 0.38 0.00 0.00 41.96 43.01 2cqs s TYR 44 CO 0.00 -1.43 -0.13 -1.12 -1.52 0.00 0.00 175.55 171.35 2cqs s SER 45 N -3.04 1.69 0.14 -0.18 0.01 -1.26 -0.46 113.70 110.60 2cqs s SER 45 Ca 0.16 -0.73 -0.17 0.00 1.31 0.00 0.00 55.95 56.52 2cqs s SER 45 Cb -0.05 -0.04 0.04 0.00 0.21 0.00 0.00 66.02 66.18 2cqs s SER 45 CO 0.11 -0.16 0.44 0.72 0.41 0.00 0.00 173.24 174.76 2cqs s PHE 46 N -1.90 -0.20 -0.29 2.43 -0.12 -0.38 -0.78 117.98 116.74 2cqs s PHE 46 Ca 0.03 -0.11 -0.05 0.00 -0.05 0.00 0.00 56.93 56.75 2cqs s PHE 46 Cb -0.06 0.30 0.02 0.00 -0.63 0.00 0.00 43.02 42.65 2cqs s PHE 46 CO 0.02 -0.75 0.05 -0.47 -0.05 0.00 0.00 175.22 174.02 2cqs s TYR 47 N -3.82 3.16 0.00 3.49 5.04 -0.45 -1.50 117.35 123.27 2cqs s TYR 47 Ca 0.04 -1.23 0.00 0.00 -2.44 0.00 0.00 57.07 53.44 2cqs s TYR 47 Cb 0.01 -2.21 0.00 0.00 0.35 0.00 0.00 41.96 40.11 2cqs s TYR 47 CO -0.10 -0.65 0.00 0.54 -1.34 0.00 0.00 175.55 174.00 2cqs n ARG 48 N 4.80 0.00 -3.72 4.97 1.74 0.22 -4.54 116.66 120.14 2cqs n ARG 48 Ca -0.14 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.70 2cqs n ARG 48 Cb 0.47 -0.56 -0.17 0.00 -1.02 0.00 0.00 32.46 31.17 2cqs n ARG 48 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2cqs s ASP 49 N 0.00 1.86 0.58 0.55 3.68 -1.26 -4.45 116.67 117.63 2cqs s ASP 49 Ca 0.00 -0.27 0.36 0.00 2.13 0.00 0.00 52.55 54.78 2cqs s ASP 49 Cb 0.00 -0.38 1.73 0.00 -1.45 0.00 0.00 42.92 42.81 2cqs s ASP 49 CO 0.00 -0.25 2.12 0.00 0.13 0.00 0.00 175.17 177.18 2cqs h ALA 50 N 8.35 1.04 0.08 3.66 0.00 -1.84 -1.31 119.26 129.22 2cqs h ALA 50 Ca -0.17 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 54.35 2cqs h ALA 50 Cb 1.13 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2cqs h ALA 50 CO 0.26 0.03 -2.11 1.17 0.00 0.00 0.00 179.25 178.60 2cqs n LYS 51 N -3.17 0.71 0.06 0.00 4.81 -0.96 -4.37 118.16 115.23 2cqs n LYS 51 Ca -0.01 0.25 0.09 0.00 -0.87 0.00 0.00 58.31 57.77 2cqs n LYS 51 Cb 0.22 -1.65 -0.05 0.00 0.02 0.00 0.00 35.03 33.57 2cqs n LYS 51 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 2cqs n MET 52 N -3.51 0.62 -2.95 1.64 2.81 -1.19 -0.53 117.12 114.00 2cqs n MET 52 Ca -0.37 0.06 -0.16 0.00 -1.81 0.00 0.00 57.70 55.42 2cqs n MET 52 Cb 1.00 -1.75 -0.01 0.00 -0.71 0.00 0.00 33.22 31.75 2cqs n MET 52 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2cqs n ARG 53 N -2.62 1.32 -2.98 0.03 5.12 -0.50 -4.07 116.66 112.96 2cqs n ARG 53 Ca -0.03 -3.50 -0.42 0.00 -1.93 0.00 0.00 57.85 51.97 2cqs n ARG 53 Cb 0.61 -1.61 -0.05 0.00 -1.16 0.00 0.00 32.46 30.24 2cqs n ARG 53 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2cqs s ARG 54 N -2.80 3.97 0.06 5.56 3.52 -0.24 -1.35 118.95 127.68 2cqs s ARG 54 Ca 0.37 0.54 -0.18 0.00 -0.13 0.00 0.00 55.73 56.32 2cqs s ARG 54 Cb 0.39 -3.72 -0.12 0.00 -1.56 0.00 0.00 34.95 29.94 2cqs s ARG 54 CO -0.05 -0.64 1.38 -0.07 -0.81 0.00 0.00 175.30 175.12 2cqs h LEU 55 N 9.35 0.50 -8.90 -0.88 3.38 -1.25 -3.15 115.31 114.36 2cqs h LEU 55 Ca -0.25 -0.46 -0.58 0.00 0.09 0.00 0.00 57.88 56.67 2cqs h LEU 55 Cb 1.10 -0.14 -0.19 0.00 0.09 0.00 0.00 40.66 41.52 2cqs h LEU 55 CO 0.86 0.86 -0.80 0.42 0.09 0.00 0.00 178.44 179.87 2cqs s THR 56 N -4.38 2.04 0.05 0.22 -4.23 -1.21 -1.65 115.64 106.49 2cqs s THR 56 Ca -0.13 -1.93 -0.20 0.00 -1.18 0.00 0.00 61.69 58.25 2cqs s THR 56 Cb 0.07 -1.94 -0.06 0.00 1.34 0.00 0.00 72.50 71.90 2cqs s THR 56 CO 0.78 -0.20 0.59 -0.60 -0.54 0.00 0.00 174.62 174.64 2cqs s ARG 57 N -2.65 4.25 -0.01 3.99 3.52 0.23 -4.45 118.95 123.83 2cqs s ARG 57 Ca 0.17 0.76 0.01 0.00 -0.13 0.00 0.00 55.73 56.53 2cqs s ARG 57 Cb -0.07 -3.27 0.00 0.00 -1.56 0.00 0.00 34.95 30.05 2cqs s ARG 57 CO 0.08 0.55 -0.01 -0.47 -0.81 0.00 0.00 175.30 174.64 2cqs s TYR 58 N -0.83 0.20 -0.32 5.12 5.04 -1.26 -4.81 117.35 120.49 2cqs s TYR 58 Ca 0.30 -0.02 -0.11 0.00 -2.44 0.00 0.00 57.07 54.80 2cqs s TYR 58 Cb -0.19 -0.18 -0.01 0.00 0.35 0.00 0.00 41.96 41.93 2cqs s TYR 58 CO 0.19 -0.03 0.18 1.03 -1.34 0.00 0.00 175.55 175.58 2cqs s ARG 59 N 0.19 3.35 0.42 4.97 0.52 -1.26 -5.08 118.95 122.06 2cqs s ARG 59 Ca -0.02 -0.72 -0.22 0.00 -0.52 0.00 0.00 55.73 54.26 2cqs s ARG 59 Cb -0.04 -3.64 -0.11 0.00 0.52 0.00 0.00 34.95 31.68 2cqs s ARG 59 CO -0.01 -0.44 0.96 0.71 0.02 0.00 0.00 175.30 176.55 2cqs s TYR 60 N 1.64 3.34 -1.33 -0.53 2.02 -1.26 -3.84 117.35 117.39 2cqs s TYR 60 Ca 0.05 1.63 -0.02 0.00 -0.37 0.00 0.00 57.07 58.37 2cqs s TYR 60 Cb -0.17 -2.89 0.01 0.00 -0.40 0.00 0.00 41.96 38.51 2cqs s TYR 60 CO 0.07 -0.15 0.75 -1.71 -1.57 0.00 0.00 175.55 172.95 2cqs n ASN 61 N -0.47 -1.70 -4.94 2.29 5.15 -1.26 -4.98 115.26 109.35 2cqs n ASN 61 Ca 0.06 -0.80 -0.24 0.00 -0.60 0.00 0.00 54.58 53.00 2cqs n ASN 61 Cb 0.53 -4.11 0.02 0.00 -0.53 0.00 0.00 39.78 35.69 2cqs n ASN 61 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2cqs s ASN 62 N -4.23 5.82 -0.29 1.20 2.47 -1.25 -5.01 114.94 113.66 2cqs s ASN 62 Ca 0.09 0.47 0.02 0.00 0.42 0.00 0.00 52.86 53.86 2cqs s ASN 62 Cb -0.04 -1.67 0.08 0.00 -1.45 0.00 0.00 41.25 38.17 2cqs s ASN 62 CO 0.81 -0.78 0.02 -0.63 -3.72 0.00 0.00 177.10 172.79 2cqs s ILE 63 N -2.69 1.64 0.81 -5.21 1.01 -1.26 -2.16 121.20 113.35 2cqs s ILE 63 Ca 0.50 -1.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.37 2cqs s ILE 63 Cb -0.10 -2.08 0.08 0.00 0.01 0.00 0.00 42.46 40.37 2cqs s ILE 63 CO 0.41 -0.40 1.17 -2.16 0.00 0.00 0.00 174.94 173.95 2cqs s PRO 64 N 1.28 1.94 0.50 2.79 0.04 -1.26 -5.05 135.00 135.23 2cqs s PRO 64 Ca 0.03 0.16 -0.23 0.00 0.04 0.00 0.00 61.00 61.00 2cqs s PRO 64 Cb -0.19 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 2cqs s PRO 64 CO -0.11 -1.62 1.35 0.00 0.04 0.00 0.00 177.00 176.65 2cqs s ALA 65 N -3.53 2.97 -1.51 8.56 0.00 -0.92 -3.40 121.76 123.93 2cqs s ALA 65 Ca 0.62 1.31 -0.04 0.00 0.00 0.00 0.00 51.96 53.85 2cqs s ALA 65 Cb -0.11 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2cqs s ALA 65 CO 0.50 -1.20 0.52 -3.47 0.00 0.00 0.00 175.76 172.11 2cqs n ASP 66 N -0.67 -5.91 -4.37 0.00 2.03 -1.26 -4.94 116.55 101.44 2cqs n ASP 66 Ca 0.08 -0.25 -0.45 0.00 0.52 0.00 0.00 54.79 54.69 2cqs n ASP 66 Cb 0.44 -4.75 -0.01 0.00 -0.72 0.00 0.00 41.12 36.09 2cqs n ASP 66 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cqs s ALA 67 N -3.14 4.38 0.00 -1.67 0.00 -1.22 -4.70 121.76 115.42 2cqs s ALA 67 Ca 0.26 -3.58 0.00 0.00 0.00 0.00 0.00 51.96 48.64 2cqs s ALA 67 Cb -0.11 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2cqs s ALA 67 CO 0.32 -2.37 0.00 0.41 0.00 0.00 0.00 175.76 174.12 2cqs n GLY 68 N 3.41 2.95 0.00 0.00 0.00 -1.26 -4.91 105.19 105.38 2cqs n GLY 68 Ca 0.24 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2cqs n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqs n GLY 69 N 0.00 -0.75 3.43 -0.02 0.00 -1.26 -2.46 105.19 104.12 2cqs n GLY 69 Ca 0.00 -0.35 -0.44 0.00 0.00 0.00 0.00 46.02 45.23 2cqs n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cqs s ARG 70 N -0.59 3.12 0.21 1.61 3.00 -0.58 -4.48 118.95 121.25 2cqs s ARG 70 Ca 0.00 -0.94 0.07 0.00 0.00 0.00 0.00 55.73 54.86 2cqs s ARG 70 Cb 0.00 -4.18 -0.04 0.00 0.00 0.00 0.00 34.95 30.73 2cqs s ARG 70 CO 0.00 -1.50 0.12 0.71 0.00 0.00 0.00 175.30 174.63 2cqs s TYR 71 N 3.15 3.03 -0.35 -0.53 2.02 -0.76 -4.84 117.35 119.06 2cqs s TYR 71 Ca 0.17 -0.10 -0.00 0.00 -0.37 0.00 0.00 57.07 56.77 2cqs s TYR 71 Cb -0.19 -1.41 0.12 0.00 -0.40 0.00 0.00 41.96 40.08 2cqs s TYR 71 CO 0.11 0.53 0.16 -1.17 -1.57 0.00 0.00 175.55 173.61 2cqs s LEU 72 N -3.43 1.74 0.04 -1.29 2.96 -1.26 -1.10 118.68 116.35 2cqs s LEU 72 Ca 0.31 -1.94 -0.30 0.00 -0.22 0.00 0.00 54.13 51.98 2cqs s LEU 72 Cb -0.09 -0.70 -0.05 0.00 0.50 0.00 0.00 46.19 45.85 2cqs s LEU 72 CO 0.23 -0.36 1.15 -0.31 -1.32 0.00 0.00 176.35 175.73 2cqs s TYR 73 N 1.28 3.49 -0.22 5.38 2.02 0.51 -4.30 117.35 125.50 2cqs s TYR 73 Ca 0.13 1.40 -0.05 0.00 -0.37 0.00 0.00 57.07 58.18 2cqs s TYR 73 Cb -0.20 -3.35 -0.01 0.00 -0.40 0.00 0.00 41.96 38.00 2cqs s TYR 73 CO -0.15 -0.97 -0.02 0.08 -1.57 0.00 0.00 175.55 172.92 2cqs s VAL 74 N 1.08 3.62 -0.33 0.71 1.01 0.40 -0.36 120.40 126.54 2cqs s VAL 74 Ca 0.57 -0.41 -0.08 0.00 0.00 0.00 0.00 61.98 62.06 2cqs s VAL 74 Cb -0.27 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.47 2cqs s VAL 74 CO 0.29 0.41 0.12 0.21 0.00 0.00 0.00 175.10 176.12 2cqs s ASN 75 N 1.44 5.33 -0.36 3.32 3.84 -0.37 -1.49 114.94 126.66 2cqs s ASN 75 Ca 0.05 -0.90 0.01 0.00 0.21 0.00 0.00 52.86 52.24 2cqs s ASN 75 Cb -0.14 -1.91 0.10 0.00 -0.55 0.00 0.00 41.25 38.74 2cqs s ASN 75 CO -0.01 -0.27 0.10 -0.62 -2.79 0.00 0.00 177.10 173.50 2cqs s ASP 76 N 1.48 4.93 -1.45 -4.21 -1.08 0.22 -1.55 116.67 115.02 2cqs s ASP 76 Ca 0.01 -2.05 -0.07 0.00 -0.52 0.00 0.00 52.55 49.92 2cqs s ASP 76 Cb -0.18 -1.70 0.03 0.00 -1.46 0.00 0.00 42.92 39.61 2cqs s ASP 76 CO 0.04 -0.43 0.61 0.61 0.52 0.00 0.00 175.17 176.52 2cqs n GLY 77 N 4.39 -0.51 0.00 2.66 0.00 -1.26 -1.63 105.19 108.84 2cqs n GLY 77 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2cqs n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqs n GLY 78 N -1.43 3.26 3.67 -0.02 0.00 -1.26 -5.04 105.19 104.37 2cqs n GLY 78 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2cqs n GLY 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2cqs s ASP 79 N -0.20 7.07 -0.15 1.61 2.15 -0.65 -4.98 116.67 121.52 2cqs s ASP 79 Ca 0.00 1.33 -0.03 0.00 0.43 0.00 0.00 52.55 54.27 2cqs s ASP 79 Cb 0.00 -2.51 -0.03 0.00 -0.30 0.00 0.00 42.92 40.08 2cqs s ASP 79 CO 0.00 -0.52 -0.03 -0.69 -0.17 0.00 0.00 175.17 173.76 2cqs s VAL 80 N 2.54 3.94 0.14 1.11 1.01 -1.26 -0.61 120.40 127.27 2cqs s VAL 80 Ca 0.43 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.92 2cqs s VAL 80 Cb -0.16 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.52 2cqs s VAL 80 CO 0.11 0.50 0.37 -1.66 0.00 0.00 0.00 175.10 174.43 2cqs s TRP 81 N 0.22 -0.05 -0.07 5.22 1.48 -0.55 -4.87 118.94 120.32 2cqs s TRP 81 Ca -0.02 -0.30 0.03 0.00 -1.06 0.00 0.00 56.10 54.76 2cqs s TRP 81 Cb -0.14 0.19 0.00 0.00 -1.16 0.00 0.00 33.47 32.37 2cqs s TRP 81 CO 0.03 -0.72 -0.18 0.95 -4.06 0.00 0.00 176.95 172.97 2cqs s THR 82 N -3.85 1.56 0.65 0.66 -4.23 -1.26 -0.45 115.64 108.72 2cqs s THR 82 Ca 0.06 -0.74 0.41 0.00 -1.18 0.00 0.00 61.69 60.24 2cqs s THR 82 Cb 0.02 -1.37 0.42 0.00 1.34 0.00 0.00 72.50 72.91 2cqs s THR 82 CO -0.09 0.45 2.35 1.55 -0.54 0.00 0.00 174.62 178.34 2cqs h PRO 83 N 6.72 0.00 -0.20 3.99 0.13 -1.87 0.35 132.00 141.12 2cqs h PRO 83 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2cqs h PRO 83 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2cqs h PRO 83 CO 0.47 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.11 2cqs n SER 84 N -3.29 1.18 0.00 1.44 3.41 -1.26 -3.58 113.62 111.52 2cqs n SER 84 Ca -0.03 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 2cqs n SER 84 Cb 0.07 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 2cqs n SER 84 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 175.04 176.75 2cqs n TRP 85 N 0.10 0.00 -1.67 7.33 -0.00 0.11 -4.69 117.44 118.63 2cqs n TRP 85 Ca 0.10 0.00 -0.34 0.00 -0.00 0.00 0.00 57.50 57.26 2cqs n TRP 85 Cb 0.20 0.00 0.07 0.00 -0.00 0.00 0.00 31.31 31.58 2cqs n TRP 85 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 2cqs s LEU 86 N 0.00 3.42 0.15 5.87 1.43 -1.26 -0.07 118.68 128.22 2cqs s LEU 86 Ca 0.00 2.26 0.24 0.00 -1.03 0.00 0.00 54.13 55.60 2cqs s LEU 86 Cb 0.00 -4.58 0.31 0.00 0.03 0.00 0.00 46.19 41.95 2cqs s LEU 86 CO 0.00 -1.92 1.31 1.55 0.23 0.00 0.00 176.35 177.52 2cqs h PRO 87 N 0.09 0.00 -0.14 1.29 0.13 -1.90 -3.45 132.00 128.02 2cqs h PRO 87 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 2cqs h PRO 87 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2cqs h PRO 87 CO 0.52 0.00 -0.56 0.28 -0.23 0.00 0.00 178.00 178.01 2cqs h VAL 88 N 0.00 1.34 -4.47 1.56 2.07 -1.74 -3.36 116.25 111.65 2cqs h VAL 88 Ca 0.00 -1.84 -0.37 0.00 0.82 0.00 0.00 66.70 65.31 2cqs h VAL 88 Cb 0.80 1.84 0.08 0.00 -1.52 0.00 0.00 31.29 32.49 2cqs h VAL 88 CO 0.00 0.56 -0.57 0.29 0.02 0.00 0.00 177.57 177.87 2cqs n LYS 89 N -3.93 -5.31 -2.88 1.57 5.02 0.90 -4.98 118.16 108.55 2cqs n LYS 89 Ca -0.03 0.80 -0.37 0.00 -2.02 0.00 0.00 58.31 56.69 2cqs n LYS 89 Cb 0.60 -5.52 -0.06 0.00 -0.02 0.00 0.00 35.03 30.03 2cqs n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cqs s ALA 90 N -3.17 3.30 0.11 7.82 0.00 -1.26 -4.97 121.76 123.58 2cqs s ALA 90 Ca 0.35 0.43 -0.34 0.00 0.00 0.00 0.00 51.96 52.40 2cqs s ALA 90 Cb -0.16 -3.07 -0.13 0.00 0.00 0.00 0.00 23.12 19.76 2cqs s ALA 90 CO 0.44 0.23 1.64 -0.25 0.00 0.00 0.00 175.76 177.82 2cqs n ASP 91 N 0.79 3.17 -4.58 0.00 9.92 -1.26 -4.93 116.55 119.65 2cqs n ASP 91 Ca -0.00 1.06 -0.34 0.00 -0.53 0.00 0.00 54.79 54.98 2cqs n ASP 91 Cb 0.50 -1.42 -0.11 0.00 -0.64 0.00 0.00 41.12 39.45 2cqs n ASP 91 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2cqs s LEU 92 N 1.56 3.19 0.28 0.64 1.43 -1.26 -4.85 118.68 119.67 2cqs s LEU 92 Ca 0.82 -0.02 0.13 0.00 -1.03 0.00 0.00 54.13 54.03 2cqs s LEU 92 Cb -0.68 -1.70 0.32 0.00 0.03 0.00 0.00 46.19 44.17 2cqs s LEU 92 CO 0.41 0.36 1.57 0.44 0.23 0.00 0.00 176.35 179.35 2cqs h ASP 93 N 5.30 0.00 -4.13 2.29 3.32 -0.60 -3.45 116.42 119.15 2cqs h ASP 93 Ca -0.48 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.45 2cqs h ASP 93 Cb 1.17 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.49 2cqs h ASP 93 CO 0.53 0.59 -0.23 -1.00 -1.72 0.00 0.00 179.24 177.40 2cqs s HIS 94 N -3.36 -0.40 -0.09 4.55 3.76 -1.15 -4.99 115.29 113.61 2cqs s HIS 94 Ca 0.00 0.93 -0.13 0.00 -0.15 0.00 0.00 55.06 55.71 2cqs s HIS 94 Cb 0.11 0.15 0.03 0.00 1.11 0.00 0.00 32.58 33.98 2cqs s HIS 94 CO 0.74 -0.26 0.33 0.12 -0.85 0.00 0.00 174.74 174.83 2cqs s PHE 95 N -0.13 -0.30 -0.28 1.40 5.36 -1.26 -1.23 117.98 121.54 2cqs s PHE 95 Ca -0.03 0.68 -0.24 0.00 -0.96 0.00 0.00 56.93 56.38 2cqs s PHE 95 Cb -0.03 0.12 0.11 0.00 -0.34 0.00 0.00 43.02 42.88 2cqs s PHE 95 CO 0.02 -0.26 0.97 -2.00 -1.46 0.00 0.00 175.22 172.49 2cqs s GLU 96 N -0.38 0.55 -0.10 10.12 2.12 -0.54 -4.59 118.70 125.88 2cqs s GLU 96 Ca -0.05 0.68 0.00 0.00 0.36 0.00 0.00 54.97 55.97 2cqs s GLU 96 Cb -0.03 0.26 0.02 0.00 0.26 0.00 0.00 34.13 34.63 2cqs s GLU 96 CO 0.02 -0.07 -0.08 0.00 -0.54 0.00 0.00 175.26 174.59 2cqs s ALA 97 N 0.37 1.27 -0.23 6.30 0.00 -0.34 -0.07 121.76 129.06 2cqs s ALA 97 Ca 0.01 -0.48 -0.04 0.00 0.00 0.00 0.00 51.96 51.46 2cqs s ALA 97 Cb -0.05 -0.81 -0.00 0.00 0.00 0.00 0.00 23.12 22.26 2cqs s ALA 97 CO -0.06 -0.28 -0.04 1.03 0.00 0.00 0.00 175.76 176.41 2cqs s ARG 98 N 1.44 3.27 -0.31 0.00 0.52 0.18 -0.23 118.95 123.82 2cqs s ARG 98 Ca -0.00 -0.70 -0.12 0.00 -0.52 0.00 0.00 55.73 54.39 2cqs s ARG 98 Cb -0.13 -3.02 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 2cqs s ARG 98 CO -0.05 -0.24 0.23 -1.01 0.02 0.00 0.00 175.30 174.24 2cqs s HIS 99 N 1.45 3.22 0.00 -0.53 3.76 -0.61 -0.33 115.29 122.25 2cqs s HIS 99 Ca 0.05 -0.03 0.00 0.00 -0.15 0.00 0.00 55.06 54.93 2cqs s HIS 99 Cb -0.15 -2.45 0.00 0.00 1.11 0.00 0.00 32.58 31.10 2cqs s HIS 99 CO -0.03 -0.27 0.00 0.41 -0.85 0.00 0.00 174.74 174.00 2cqs n GLY 100 N 5.06 4.95 3.49 -2.22 0.00 0.11 -1.16 105.19 115.41 2cqs n GLY 100 Ca -0.13 -2.11 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 2cqs n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cqs s LEU 101 N 0.00 4.08 0.00 0.99 1.43 -1.25 -3.81 118.68 120.12 2cqs s LEU 101 Ca 0.00 -1.00 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 2cqs s LEU 101 Cb 0.00 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.76 2cqs s LEU 101 CO 0.00 -1.51 0.00 0.61 0.23 0.00 0.00 176.35 175.68 2cqs n GLY 102 N 5.48 0.81 3.37 -3.19 0.00 -1.26 -4.88 105.19 105.51 2cqs n GLY 102 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2cqs n GLY 102 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cqs s TYR 103 N -3.12 -0.08 0.02 1.61 -0.85 -1.25 -3.78 117.35 109.90 2cqs s TYR 103 Ca 0.00 -0.25 -0.08 0.00 -0.52 0.00 0.00 57.07 56.21 2cqs s TYR 103 Cb 0.00 0.24 0.00 0.00 0.38 0.00 0.00 41.96 42.58 2cqs s TYR 103 CO 0.00 -0.75 0.16 -1.12 -1.52 0.00 0.00 175.55 172.32 2cqs s SER 104 N -2.85 0.03 -0.08 -0.18 0.01 -0.17 0.10 113.70 110.56 2cqs s SER 104 Ca 0.06 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.07 2cqs s SER 104 Cb 0.01 0.24 0.01 0.00 0.21 0.00 0.00 66.02 66.50 2cqs s SER 104 CO -0.08 -0.45 -0.14 -0.13 0.41 0.00 0.00 173.24 172.85 2cqs s ARG 105 N -1.89 1.92 -0.11 12.44 0.52 0.55 0.04 118.95 132.42 2cqs s ARG 105 Ca -0.11 -0.48 0.02 0.00 -0.52 0.00 0.00 55.73 54.65 2cqs s ARG 105 Cb -0.05 -1.60 0.01 0.00 0.52 0.00 0.00 34.95 33.84 2cqs s ARG 105 CO -0.01 0.00 -0.16 0.42 0.02 0.00 0.00 175.30 175.57 2cqs s ILE 106 N 0.77 1.58 -0.06 1.52 1.01 -0.45 0.50 121.20 126.07 2cqs s ILE 106 Ca -0.12 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 59.87 2cqs s ILE 106 Cb -0.16 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 40.89 2cqs s ILE 106 CO 0.02 0.46 -0.16 -0.89 0.00 0.00 0.00 174.94 174.37 2cqs s THR 107 N 0.87 1.36 -0.01 2.92 2.01 0.89 -1.24 115.64 122.44 2cqs s THR 107 Ca -0.09 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.28 2cqs s THR 107 Cb -0.15 -1.19 -0.00 0.00 0.01 0.00 0.00 72.50 71.16 2cqs s THR 107 CO 0.00 0.40 -0.05 -0.83 -0.69 0.00 0.00 174.62 173.45 2cqs s GLY 108 N 0.28 0.27 -0.03 4.40 0.00 -0.80 -1.47 107.32 109.97 2cqs s GLY 108 Ca -0.09 -0.22 0.02 0.00 0.00 0.00 0.00 44.72 44.43 2cqs s GLY 108 CO 0.03 -0.17 -0.07 1.85 0.00 0.00 0.00 173.10 174.74 2cqs s GLU 109 N -0.09 0.87 -0.16 2.90 2.12 -0.37 -0.78 118.70 123.19 2cqs s GLU 109 Ca 0.02 -0.24 -0.08 0.00 0.36 0.00 0.00 54.97 55.03 2cqs s GLU 109 Cb -0.02 -0.83 0.06 0.00 0.26 0.00 0.00 34.13 33.60 2cqs s GLU 109 CO -0.00 0.06 0.39 0.50 -0.54 0.00 0.00 175.26 175.67 2cqs s ARG 110 N 0.36 0.36 -1.33 4.30 3.52 -0.63 0.23 118.95 125.76 2cqs s ARG 110 Ca -0.05 0.79 -0.07 0.00 -0.13 0.00 0.00 55.73 56.27 2cqs s ARG 110 Cb -0.10 0.00 -0.00 0.00 -1.56 0.00 0.00 34.95 33.30 2cqs s ARG 110 CO 0.00 -0.17 0.53 0.09 -0.81 0.00 0.00 175.30 174.94 2cqs n ASN 111 N 4.42 -1.76 0.00 -2.12 3.02 -1.26 -2.46 115.26 115.09 2cqs n ASN 111 Ca -0.21 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 2cqs n ASN 111 Cb 0.54 -3.12 0.00 0.00 -0.61 0.00 0.00 39.78 36.59 2cqs n ASN 111 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cqs n GLY 112 N -1.90 0.61 2.89 7.41 0.00 -1.26 -4.94 105.19 108.00 2cqs n GLY 112 Ca -0.25 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 2cqs n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2cqs s LEU 113 N 0.00 1.38 -0.14 0.99 2.96 -1.03 -0.66 118.68 122.18 2cqs s LEU 113 Ca 0.00 -0.48 -0.04 0.00 -0.22 0.00 0.00 54.13 53.39 2cqs s LEU 113 Cb 0.00 -0.87 -0.03 0.00 0.50 0.00 0.00 46.19 45.79 2cqs s LEU 113 CO 0.00 -0.15 0.00 -0.75 -1.32 0.00 0.00 176.35 174.13 2cqs s LYS 114 N 1.68 3.54 -0.18 1.98 2.20 -0.34 -1.60 119.74 127.01 2cqs s LYS 114 Ca 0.03 -0.43 -0.00 0.00 -0.36 0.00 0.00 55.97 55.20 2cqs s LYS 114 Cb -0.14 -2.96 0.04 0.00 -1.51 0.00 0.00 37.83 33.27 2cqs s LYS 114 CO -0.08 0.40 -0.06 0.08 -0.36 0.00 0.00 175.35 175.33 2cqs s VAL 115 N -0.04 1.24 -0.12 4.02 1.01 0.04 -0.54 120.40 126.02 2cqs s VAL 115 Ca 0.03 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 2cqs s VAL 115 Cb -0.13 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2cqs s VAL 115 CO 0.02 0.09 -0.05 -0.70 0.00 0.00 0.00 175.10 174.46 2cqs s GLU 116 N 1.57 3.27 -0.10 2.72 2.12 -0.28 -1.91 118.70 126.09 2cqs s GLU 116 Ca -0.01 -0.53 0.02 0.00 0.36 0.00 0.00 54.97 54.81 2cqs s GLU 116 Cb -0.16 -2.77 0.01 0.00 0.26 0.00 0.00 34.13 31.47 2cqs s GLU 116 CO -0.08 0.43 -0.15 0.99 -0.54 0.00 0.00 175.26 175.91 2cqs s THR 117 N -0.15 1.41 -0.26 -1.70 2.01 -0.38 -0.34 115.64 116.24 2cqs s THR 117 Ca 0.02 -0.61 -0.11 0.00 0.31 0.00 0.00 61.69 61.31 2cqs s THR 117 Cb -0.13 -1.29 -0.05 0.00 0.01 0.00 0.00 72.50 71.04 2cqs s THR 117 CO 0.03 0.42 0.20 -0.22 -0.69 0.00 0.00 174.62 174.36 2cqs s LEU 118 N 0.88 4.07 -0.12 4.42 2.96 -0.34 -1.34 118.68 129.22 2cqs s LEU 118 Ca -0.09 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2cqs s LEU 118 Cb -0.15 -2.15 -0.02 0.00 0.50 0.00 0.00 46.19 44.36 2cqs s LEU 118 CO 0.00 -0.01 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.56 2cqs s PHE 119 N 1.47 2.86 -0.08 5.38 0.08 0.11 -1.28 117.98 126.52 2cqs s PHE 119 Ca 0.08 -0.41 -0.31 0.00 0.12 0.00 0.00 56.93 56.41 2cqs s PHE 119 Cb -0.15 -1.83 0.12 0.00 -0.57 0.00 0.00 43.02 40.59 2cqs s PHE 119 CO 0.08 -0.05 1.01 -0.59 -0.10 0.00 0.00 175.22 175.57 2cqs s PHE 120 N 0.07 -0.26 -0.32 0.36 -0.12 -0.81 -1.00 117.98 115.89 2cqs s PHE 120 Ca -0.04 0.16 -0.06 0.00 -0.05 0.00 0.00 56.93 56.94 2cqs s PHE 120 Cb -0.14 0.53 0.03 0.00 -0.63 0.00 0.00 43.02 42.81 2cqs s PHE 120 CO 0.04 -0.41 0.09 0.08 -0.05 0.00 0.00 175.22 174.97 2cqs s VAL 121 N -2.85 3.82 0.61 -2.49 1.01 -1.25 -0.39 120.40 118.87 2cqs s VAL 121 Ca 0.07 -1.00 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 2cqs s VAL 121 Cb -0.01 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2cqs s VAL 121 CO -0.07 -0.09 1.21 -2.84 0.00 0.00 0.00 175.10 173.31 2cqs s PRO 122 N 1.43 2.84 0.36 2.72 0.02 -1.26 -4.51 135.00 136.60 2cqs s PRO 122 Ca -0.00 1.83 -0.28 0.00 0.02 0.00 0.00 61.00 62.57 2cqs s PRO 122 Cb -0.19 -1.91 -0.11 0.00 0.02 0.00 0.00 34.50 32.32 2cqs s PRO 122 CO 0.03 -1.31 1.41 -0.51 -0.33 0.00 0.00 177.00 176.28 2cqs s LEU 123 N -4.23 4.36 0.00 -5.54 1.43 -1.26 -2.21 118.68 111.23 2cqs s LEU 123 Ca 0.77 2.89 0.00 0.00 -1.03 0.00 0.00 54.13 56.76 2cqs s LEU 123 Cb -0.31 -3.67 0.00 0.00 0.03 0.00 0.00 46.19 42.24 2cqs s LEU 123 CO 0.35 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.81 2cqs n GLY 124 N 0.60 0.60 3.47 -3.19 0.00 -1.26 -4.99 105.19 100.42 2cqs n GLY 124 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2cqs n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqs s GLU 125 N -0.40 2.20 -1.04 1.61 0.41 -0.94 -5.03 118.70 115.52 2cqs s GLU 125 Ca 0.00 -0.90 -0.03 0.00 -0.41 0.00 0.00 54.97 53.64 2cqs s GLU 125 Cb 0.00 -2.25 0.31 0.00 -1.78 0.00 0.00 34.13 30.41 2cqs s GLU 125 CO 0.00 0.56 1.53 0.09 -0.49 0.00 0.00 175.26 176.95 2cqs n ASN 126 N 1.75 6.51 -3.46 -0.19 5.03 -1.26 -4.65 115.26 118.99 2cqs n ASN 126 Ca -0.16 -3.49 -0.13 0.00 0.87 0.00 0.00 54.58 51.66 2cqs n ASN 126 Cb 0.52 -1.21 -0.03 0.00 -1.02 0.00 0.00 39.78 38.04 2cqs n ASN 126 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2cqs s ALA 127 N -3.17 -1.60 -0.22 5.41 0.00 -1.26 -1.19 121.76 119.73 2cqs s ALA 127 Ca 0.34 0.67 -0.04 0.00 0.00 0.00 0.00 51.96 52.93 2cqs s ALA 127 Cb 0.09 0.65 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 2cqs s ALA 127 CO 0.04 -0.66 -0.04 -2.00 0.00 0.00 0.00 175.76 173.10 2cqs s GLU 128 N -3.08 3.35 -0.09 0.00 2.12 0.51 -4.03 118.70 117.48 2cqs s GLU 128 Ca -0.02 -0.64 -0.03 0.00 0.36 0.00 0.00 54.97 54.64 2cqs s GLU 128 Cb -0.01 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.34 2cqs s GLU 128 CO -0.07 -0.21 0.05 0.08 -0.54 0.00 0.00 175.26 174.57 2cqs s VAL 129 N 1.47 4.69 -0.09 3.70 1.01 0.47 -1.30 120.40 130.35 2cqs s VAL 129 Ca 0.06 -0.12 0.03 0.00 0.00 0.00 0.00 61.98 61.95 2cqs s VAL 129 Cb -0.14 -3.00 0.01 0.00 0.00 0.00 0.00 36.38 33.24 2cqs s VAL 129 CO -0.03 0.60 -0.19 -1.10 0.00 0.00 0.00 175.10 174.37 2cqs s GLN 130 N -0.97 2.52 -0.32 2.72 -0.21 0.13 -1.92 119.66 121.60 2cqs s GLN 130 Ca 0.14 -0.69 -0.02 0.00 0.02 0.00 0.00 55.36 54.81 2cqs s GLN 130 Cb -0.12 -1.98 0.06 0.00 1.00 0.00 0.00 33.01 31.97 2cqs s GLN 130 CO 0.03 0.08 0.04 0.21 -2.12 0.00 0.00 175.29 173.54 2cqs s LYS 131 N 0.57 2.36 -0.21 2.91 2.20 -0.41 -0.54 119.74 126.62 2cqs s LYS 131 Ca -0.15 -1.36 -0.10 0.00 -0.36 0.00 0.00 55.97 54.01 2cqs s LYS 131 Cb -0.17 -3.27 -0.05 0.00 -1.51 0.00 0.00 37.83 32.84 2cqs s LYS 131 CO 0.05 -0.70 0.12 0.08 -0.36 0.00 0.00 175.35 174.54 2cqs s VAL 132 N 1.24 5.23 -0.22 4.02 1.01 0.65 -1.19 120.40 131.13 2cqs s VAL 132 Ca -0.02 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2cqs s VAL 132 Cb -0.20 -3.40 0.03 0.00 0.00 0.00 0.00 36.38 32.81 2cqs s VAL 132 CO -0.01 0.42 -0.12 -0.89 0.00 0.00 0.00 175.10 174.49 2cqs s THR 133 N 0.59 2.45 -0.22 3.92 2.01 0.54 -0.81 115.64 124.12 2cqs s THR 133 Ca 0.07 -1.07 -0.07 0.00 0.31 0.00 0.00 61.69 60.92 2cqs s THR 133 Cb -0.12 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 2cqs s THR 133 CO 0.00 0.31 0.07 -0.69 -0.69 0.00 0.00 174.62 173.62 2cqs s VAL 134 N 1.28 4.59 -0.06 3.82 1.01 0.00 -1.13 120.40 129.91 2cqs s VAL 134 Ca 0.01 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 61.93 2cqs s VAL 134 Cb -0.16 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2cqs s VAL 134 CO -0.08 0.39 -0.18 -0.89 0.00 0.00 0.00 175.10 174.34 2cqs s THR 135 N 1.03 1.51 -0.54 3.92 2.01 0.30 -0.42 115.64 123.45 2cqs s THR 135 Ca 0.04 -0.74 -0.25 0.00 0.31 0.00 0.00 61.69 61.06 2cqs s THR 135 Cb -0.14 -1.31 0.04 0.00 0.01 0.00 0.00 72.50 71.09 2cqs s THR 135 CO 0.03 0.44 0.97 0.21 -0.69 0.00 0.00 174.62 175.58 2cqs s ASN 136 N 0.23 6.38 0.00 3.53 3.84 -0.14 -1.20 114.94 127.57 2cqs s ASN 136 Ca -0.09 -0.22 0.23 0.00 0.21 0.00 0.00 52.86 52.99 2cqs s ASN 136 Cb -0.14 -2.45 0.54 0.00 -0.55 0.00 0.00 41.25 38.65 2cqs s ASN 136 CO 0.04 -1.23 1.45 0.35 -2.79 0.00 0.00 177.10 174.92 2cqs n THR 137 N 6.29 0.27 -2.52 -5.21 -2.24 0.17 -0.01 114.28 111.03 2cqs n THR 137 Ca 0.03 -0.53 -0.22 0.00 -2.27 0.00 0.00 64.05 61.06 2cqs n THR 137 Cb 0.48 0.85 0.12 0.00 -2.10 0.00 0.00 70.33 69.68 2cqs n THR 137 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2cqs n SER 138 N 0.99 1.15 -1.75 3.42 3.41 -1.19 -4.89 113.62 114.76 2cqs n SER 138 Ca 0.17 -2.01 0.07 0.00 -0.26 0.00 0.00 58.87 56.85 2cqs n SER 138 Cb 0.50 -0.64 0.38 0.00 -0.26 0.00 0.00 64.21 64.19 2cqs n SER 138 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2cqs n ASP 139 N -3.00 5.46 -3.97 4.04 3.85 -1.26 -4.20 116.55 117.47 2cqs n ASP 139 Ca 0.15 -2.96 -0.08 0.00 -0.71 0.00 0.00 54.79 51.19 2cqs n ASP 139 Cb 0.55 -0.67 -0.09 0.00 -1.35 0.00 0.00 41.12 39.56 2cqs n ASP 139 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2cqs s ALA 140 N -2.79 0.12 0.65 2.12 0.00 -1.26 -4.88 121.76 115.72 2cqs s ALA 140 Ca 0.53 -0.86 -0.18 0.00 0.00 0.00 0.00 51.96 51.46 2cqs s ALA 140 Cb 0.41 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.86 2cqs s ALA 140 CO 0.15 -0.41 1.23 -0.35 0.00 0.00 0.00 175.76 176.38 2cqs n PRO 141 N 0.20 1.01 -4.33 0.00 -0.04 -1.26 -4.22 135.00 126.36 2cqs n PRO 141 Ca -0.16 0.40 -0.18 0.00 -0.04 0.00 0.00 63.50 63.52 2cqs n PRO 141 Cb 0.61 -2.47 -0.14 0.00 -0.04 0.00 0.00 33.50 31.46 2cqs n PRO 141 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2cqs s LYS 142 N -3.33 0.75 -0.09 0.54 -0.14 0.23 -4.98 119.74 112.72 2cqs s LYS 142 Ca 0.81 -0.46 -0.01 0.00 -1.36 0.00 0.00 55.97 54.95 2cqs s LYS 142 Cb -0.38 -0.71 0.03 0.00 -1.68 0.00 0.00 37.83 35.09 2cqs s LYS 142 CO 0.42 0.18 -0.04 0.99 -0.76 0.00 0.00 175.35 176.14 2cqs s THR 143 N -0.48 0.73 0.04 2.17 2.01 -1.26 -0.03 115.64 118.82 2cqs s THR 143 Ca 0.02 -0.12 -0.06 0.00 0.31 0.00 0.00 61.69 61.84 2cqs s THR 143 Cb -0.05 -0.80 -0.01 0.00 0.01 0.00 0.00 72.50 71.65 2cqs s THR 143 CO 0.00 0.31 0.10 0.00 -0.69 0.00 0.00 174.62 174.34 2cqs s ALA 144 N 1.68 -0.08 -0.14 7.40 0.00 -0.44 -4.14 121.76 126.05 2cqs s ALA 144 Ca 0.02 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.43 2cqs s ALA 144 Cb -0.13 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 2cqs s ALA 144 CO -0.06 -0.32 -0.09 0.99 0.00 0.00 0.00 175.76 176.28 2cqs s THR 145 N -2.64 3.40 -0.20 0.00 2.01 -0.59 -0.21 115.64 117.41 2cqs s THR 145 Ca -0.05 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 61.35 2cqs s THR 145 Cb -0.01 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 2cqs s THR 145 CO -0.05 0.51 0.05 -0.76 -0.69 0.00 0.00 174.62 173.68 2cqs s LEU 146 N 0.32 3.57 -0.27 4.42 1.43 -0.00 -1.23 118.68 126.91 2cqs s LEU 146 Ca -0.08 -0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 52.92 2cqs s LEU 146 Cb -0.15 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.18 2cqs s LEU 146 CO 0.05 0.10 -0.00 -0.36 0.23 0.00 0.00 176.35 176.36 2cqs s PHE 147 N 0.83 3.11 0.62 0.29 0.08 0.52 -1.36 117.98 122.08 2cqs s PHE 147 Ca 0.03 -1.38 -0.10 0.00 0.12 0.00 0.00 56.93 55.59 2cqs s PHE 147 Cb -0.14 -2.13 -0.03 0.00 -0.57 0.00 0.00 43.02 40.15 2cqs s PHE 147 CO 0.02 -0.68 1.01 -1.54 -0.10 0.00 0.00 175.22 173.93 2cqs s SER 148 N 1.38 6.07 -0.28 1.36 1.04 -0.59 -0.36 113.70 122.32 2cqs s SER 148 Ca 0.00 1.29 -0.17 0.00 0.48 0.00 0.00 55.95 57.55 2cqs s SER 148 Cb -0.17 -2.32 0.08 0.00 0.10 0.00 0.00 66.02 63.71 2cqs s SER 148 CO -0.02 -0.93 0.72 0.12 0.98 0.00 0.00 173.24 174.11 2cqs s PHE 149 N -3.16 -0.99 -0.13 5.02 5.36 -0.26 -3.80 117.98 120.01 2cqs s PHE 149 Ca 0.55 2.03 -0.13 0.00 -0.96 0.00 0.00 56.93 58.42 2cqs s PHE 149 Cb -0.11 0.57 0.04 0.00 -0.34 0.00 0.00 43.02 43.18 2cqs s PHE 149 CO 0.52 -0.49 0.36 0.54 -1.46 0.00 0.00 175.22 174.70 2cqs s VAL 150 N 1.45 0.00 -0.24 3.12 0.11 -0.57 -1.84 120.40 122.43 2cqs s VAL 150 Ca -0.09 -0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 58.87 2cqs s VAL 150 Cb -0.05 -0.51 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 2cqs s VAL 150 CO -0.17 -0.00 0.10 -0.70 -3.33 0.00 0.00 175.10 171.00 2cqs s GLU 151 N 0.16 3.85 0.55 1.54 2.12 -1.26 -0.71 118.70 124.95 2cqs s GLU 151 Ca -0.00 -0.38 -0.17 0.00 0.36 0.00 0.00 54.97 54.78 2cqs s GLU 151 Cb -0.03 -3.39 -0.06 0.00 0.26 0.00 0.00 34.13 30.91 2cqs s GLU 151 CO 0.01 -0.03 1.02 -0.06 -0.54 0.00 0.00 175.26 175.66 2cqs s PHE 152 N 1.25 3.18 0.09 5.30 0.08 -0.99 -0.60 117.98 126.28 2cqs s PHE 152 Ca 0.06 1.50 0.07 0.00 0.12 0.00 0.00 56.93 58.68 2cqs s PHE 152 Cb -0.14 -2.92 -0.04 0.00 -0.57 0.00 0.00 43.02 39.34 2cqs s PHE 152 CO 0.05 -0.77 -0.13 0.00 -0.10 0.00 0.00 175.22 174.27 2cqs n LEU 154 N 0.96 5.49 0.00 0.00 4.77 -1.26 -4.68 117.00 122.28 2cqs n LEU 154 Ca -0.15 -3.22 0.00 0.00 -0.03 0.00 0.00 56.01 52.62 2cqs n LEU 154 Cb 0.52 -1.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.27 2cqs n LEU 154 CO 0.31 1.60 0.00 0.79 -1.33 0.00 0.00 177.39 178.75 2cqs n TRP 155 N 2.04 0.00 -2.79 -1.77 7.02 -1.19 -4.71 117.44 116.03 2cqs n TRP 155 Ca 0.38 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.43 2cqs n TRP 155 Cb 0.79 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.65 2cqs n TRP 155 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2cqs s ASN 156 N 0.00 6.23 0.28 -0.99 3.84 -1.26 -1.07 114.94 121.96 2cqs s ASN 156 Ca 0.00 -0.68 0.00 0.00 0.21 0.00 0.00 52.86 52.39 2cqs s ASN 156 Cb 0.00 -2.45 0.52 0.00 -0.55 0.00 0.00 41.25 38.77 2cqs s ASN 156 CO 0.00 -1.45 1.85 0.00 -2.79 0.00 0.00 177.10 174.71 2cqs h ALA 157 N 9.57 1.49 -0.21 1.71 0.00 -1.07 0.44 119.26 131.20 2cqs h ALA 157 Ca -0.28 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2cqs h ALA 157 Cb 1.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2cqs h ALA 157 CO 1.17 0.28 0.06 0.37 0.00 0.00 0.00 179.25 181.13 2cqs h GLN 158 N 1.04 0.33 -0.42 0.00 4.15 -1.91 -2.48 115.11 115.83 2cqs h GLN 158 Ca 0.48 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.82 2cqs h GLN 158 Cb 0.41 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 2cqs h GLN 158 CO -0.24 0.44 0.22 0.22 -1.93 0.00 0.00 178.83 177.54 2cqs h ASP 159 N 0.16 0.53 -0.98 -0.69 3.58 -1.78 -2.63 116.42 114.60 2cqs h ASP 159 Ca 0.07 -0.10 0.20 0.00 0.42 0.00 0.00 57.03 57.62 2cqs h ASP 159 Cb 0.25 -0.13 -0.11 0.00 1.72 0.00 0.00 39.33 41.06 2cqs h ASP 159 CO -0.00 0.47 0.58 -0.78 -2.88 0.00 0.00 179.24 176.63 2cqs h ASP 160 N 0.54 0.71 0.26 2.28 3.58 -0.75 0.25 116.42 123.29 2cqs h ASP 160 Ca 0.15 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.70 2cqs h ASP 160 Cb 0.07 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.11 2cqs h ASP 160 CO -0.02 0.22 -0.45 0.00 -2.88 0.00 0.00 179.24 176.10 2cqs n GLN 161 N -4.82 0.51 0.00 0.28 6.02 -0.95 -4.59 117.38 113.83 2cqs n GLN 161 Ca 0.23 -0.33 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 2cqs n GLN 161 Cb 0.60 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.37 2cqs n GLN 161 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2cqs n THR 162 N -0.96 0.00 -1.89 5.09 -2.24 -0.82 -4.92 114.28 108.54 2cqs n THR 162 Ca 0.09 -0.02 -0.33 0.00 -2.27 0.00 0.00 64.05 61.51 2cqs n THR 162 Cb 0.36 0.24 0.04 0.00 -2.10 0.00 0.00 70.33 68.87 2cqs n THR 162 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2cqs n ASN 163 N -0.43 6.59 0.11 3.42 5.15 0.82 -4.74 115.26 126.18 2cqs n ASN 163 Ca 0.00 -3.79 0.11 0.00 -0.60 0.00 0.00 54.58 50.30 2cqs n ASN 163 Cb 0.00 -0.80 0.60 0.00 -0.53 0.00 0.00 39.78 39.04 2cqs n ASN 163 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 2cqs h TYR 164 N 2.51 0.14 -0.43 1.20 0.05 -1.86 -0.67 116.97 117.91 2cqs h TYR 164 Ca 0.49 0.00 0.12 0.00 0.05 0.00 0.00 58.73 59.40 2cqs h TYR 164 Cb 0.66 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.34 2cqs h TYR 164 CO 1.12 0.08 0.41 -0.56 -1.05 0.00 0.00 178.16 178.17 2cqs h GLN 165 N 0.15 0.00 0.00 4.88 -0.00 -1.97 -2.55 115.11 115.61 2cqs h GLN 165 Ca 0.12 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.69 2cqs h GLN 165 Cb 0.30 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.77 2cqs h GLN 165 CO -0.02 0.00 -0.98 -2.13 -0.00 0.00 0.00 178.83 175.70 2cqs n ARG 166 N -3.88 0.35 0.00 0.06 0.63 -0.73 -4.78 116.66 108.30 2cqs n ARG 166 Ca 0.08 0.14 0.04 0.00 -0.92 0.00 0.00 57.85 57.19 2cqs n ARG 166 Cb 0.60 -1.10 0.21 0.00 0.45 0.00 0.00 32.46 32.62 2cqs n ARG 166 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2cqs n ASN 167 N -4.03 0.00 0.00 6.15 0.23 -0.34 -2.19 115.26 115.09 2cqs n ASN 167 Ca -0.16 0.27 0.13 0.00 -0.53 0.00 0.00 54.58 54.29 2cqs n ASN 167 Cb 0.44 -0.35 0.58 0.00 -2.08 0.00 0.00 39.78 38.36 2cqs n ASN 167 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2cqs n LEU 168 N -1.35 0.00 -0.52 -4.53 4.77 -0.97 -3.13 117.00 111.27 2cqs n LEU 168 Ca 0.04 0.46 0.06 0.00 -0.03 0.00 0.00 56.01 56.53 2cqs n LEU 168 Cb 0.08 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 40.79 2cqs n LEU 168 CO 0.07 -0.05 0.50 -1.20 -1.33 0.00 0.00 177.39 175.38 2cqs n SER 169 N -1.46 2.29 -0.00 -1.43 7.64 -0.93 0.28 113.62 120.00 2cqs n SER 169 Ca 0.07 -1.65 0.06 0.00 1.01 0.00 0.00 58.87 58.36 2cqs n SER 169 Cb 0.29 -0.08 -0.07 0.00 -1.01 0.00 0.00 64.21 63.33 2cqs n SER 169 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2cqs n ILE 170 N 0.59 0.00 -1.68 0.44 -5.35 -1.18 -4.66 119.36 107.52 2cqs n ILE 170 Ca 0.08 -0.21 -0.45 0.00 -0.27 0.00 0.00 62.75 61.90 2cqs n ILE 170 Cb 0.33 0.95 -0.04 0.00 -1.74 0.00 0.00 39.64 39.14 2cqs n ILE 170 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cqs n GLY 171 N 1.33 1.43 2.97 3.28 0.00 -1.26 -4.46 105.19 108.48 2cqs n GLY 171 Ca 0.02 0.73 -0.13 0.00 0.00 0.00 0.00 46.02 46.64 2cqs n GLY 171 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqs s GLU 172 N 2.34 0.34 0.16 1.61 2.02 -1.26 -0.64 118.70 123.27 2cqs s GLU 172 Ca 0.83 -0.39 -0.04 0.00 0.02 0.00 0.00 54.97 55.39 2cqs s GLU 172 Cb -0.60 -0.19 -0.03 0.00 0.10 0.00 0.00 34.13 33.41 2cqs s GLU 172 CO 0.41 0.04 0.17 0.14 0.02 0.00 0.00 175.26 176.03 2cqs s VAL 173 N -0.71 0.06 0.03 2.63 -7.23 -1.26 -1.24 120.40 112.69 2cqs s VAL 173 Ca -0.05 -1.74 0.03 0.00 -1.81 0.00 0.00 61.98 58.41 2cqs s VAL 173 Cb -0.05 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.78 2cqs s VAL 173 CO -0.00 -0.29 -0.09 -1.61 -0.31 0.00 0.00 175.10 172.80 2cqs s GLU 174 N -4.04 0.60 -0.12 4.82 2.02 -0.37 -4.93 118.70 116.68 2cqs s GLU 174 Ca 0.25 -0.64 0.03 0.00 0.02 0.00 0.00 54.97 54.63 2cqs s GLU 174 Cb 0.06 -0.48 0.01 0.00 0.10 0.00 0.00 34.13 33.81 2cqs s GLU 174 CO 0.04 0.11 -0.22 0.08 0.02 0.00 0.00 175.26 175.29 2cqs s VAL 175 N -0.98 1.96 -0.56 2.63 1.01 -1.26 -0.52 120.40 122.67 2cqs s VAL 175 Ca -0.04 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2cqs s VAL 175 Cb -0.08 -1.72 0.15 0.00 0.00 0.00 0.00 36.38 34.74 2cqs s VAL 175 CO 0.01 0.53 0.37 -0.70 0.00 0.00 0.00 175.10 175.30 2cqs s GLU 176 N 0.62 1.84 0.26 2.72 2.12 0.71 -4.95 118.70 122.02 2cqs s GLU 176 Ca -0.12 -2.70 0.00 0.00 0.36 0.00 0.00 54.97 52.51 2cqs s GLU 176 Cb -0.17 -2.82 0.33 0.00 0.26 0.00 0.00 34.13 31.74 2cqs s GLU 176 CO 0.03 -1.24 1.68 1.96 -0.54 0.00 0.00 175.26 177.15 2cqs h GLN 177 N 5.95 0.55 -2.35 4.30 1.08 -1.89 0.23 115.11 122.98 2cqs h GLN 177 Ca 0.09 -0.22 -0.68 0.00 -1.45 0.00 0.00 58.65 56.38 2cqs h GLN 177 Cb 0.84 -0.03 -0.36 0.00 -0.05 0.00 0.00 27.48 27.89 2cqs h GLN 177 CO 0.60 0.77 0.02 -0.25 -0.95 0.00 0.00 178.83 179.02 2cqs n ASP 178 N -4.10 5.37 -4.38 1.46 8.00 -1.26 -3.74 116.55 117.90 2cqs n ASP 178 Ca -0.00 -3.60 -0.29 0.00 0.71 0.00 0.00 54.79 51.61 2cqs n ASP 178 Cb 0.43 -0.85 0.16 0.00 -0.02 0.00 0.00 41.12 40.83 2cqs n ASP 178 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2cqs s GLY 179 N -2.46 1.73 0.55 0.44 0.00 0.02 -4.96 107.32 102.62 2cqs s GLY 179 Ca 0.42 -1.05 0.24 0.00 0.00 0.00 0.00 44.72 44.32 2cqs s GLY 179 CO -0.07 -0.37 2.18 -0.56 0.00 0.00 0.00 173.10 174.27 2cqs h PRO 180 N -1.44 0.00 0.00 2.90 0.13 -1.96 -3.18 132.00 128.46 2cqs h PRO 180 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2cqs h PRO 180 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2cqs h PRO 180 CO 0.46 0.03 0.00 0.72 -0.23 0.00 0.00 178.00 178.99 2cqs n HIS 181 N -4.07 0.00 -2.23 1.56 8.25 -1.26 -5.11 115.22 112.36 2cqs n HIS 181 Ca -0.03 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2cqs n HIS 181 Cb 0.12 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.22 2cqs n HIS 181 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cqs n GLY 182 N -0.04 0.06 3.88 -1.41 0.00 -1.20 -3.19 105.19 103.29 2cqs n GLY 182 Ca 0.00 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 2cqs n GLY 182 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqs s SER 183 N -4.00 6.57 -0.01 1.61 0.01 -0.58 -0.80 113.70 116.49 2cqs s SER 183 Ca 0.00 0.74 -0.13 0.00 1.31 0.00 0.00 55.95 57.87 2cqs s SER 183 Cb 0.00 -2.15 0.02 0.00 0.21 0.00 0.00 66.02 64.09 2cqs s SER 183 CO 0.00 0.05 0.27 0.00 0.41 0.00 0.00 173.24 173.97 2cqs s ALA 184 N -1.64 -0.68 -0.04 1.44 0.00 0.80 -1.16 121.76 120.49 2cqs s ALA 184 Ca 0.41 0.24 0.06 0.00 0.00 0.00 0.00 51.96 52.67 2cqs s ALA 184 Cb -0.12 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 2cqs s ALA 184 CO 0.22 -0.24 -0.24 0.42 0.00 0.00 0.00 175.76 175.92 2cqs s ILE 185 N -1.28 1.91 -0.18 0.00 1.01 -0.21 -0.21 121.20 122.25 2cqs s ILE 185 Ca -0.13 -1.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.49 2cqs s ILE 185 Cb -0.06 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.79 2cqs s ILE 185 CO 0.03 0.54 -0.08 -0.31 0.00 0.00 0.00 174.94 175.12 2cqs s TYR 186 N -0.27 2.90 -0.37 3.97 2.02 0.32 -1.03 117.35 124.89 2cqs s TYR 186 Ca 0.01 -0.86 -0.15 0.00 -0.37 0.00 0.00 57.07 55.70 2cqs s TYR 186 Cb -0.12 -1.99 -0.00 0.00 -0.40 0.00 0.00 41.96 39.45 2cqs s TYR 186 CO 0.02 -0.43 0.36 -1.58 -1.57 0.00 0.00 175.55 172.35 2cqs s HIS 187 N 1.02 3.21 -0.20 2.71 5.65 0.16 -1.24 115.29 126.60 2cqs s HIS 187 Ca -0.00 -0.20 0.14 0.00 0.25 0.00 0.00 55.06 55.24 2cqs s HIS 187 Cb -0.15 -2.69 0.44 0.00 -1.18 0.00 0.00 32.58 29.00 2cqs s HIS 187 CO -0.01 -0.51 1.20 0.36 -0.65 0.00 0.00 174.74 175.13 2cqs n LYS 188 N 5.38 1.80 -1.67 2.88 2.85 -0.37 -1.52 118.16 127.50 2cqs n LYS 188 Ca -0.09 -3.30 -0.46 0.00 -1.05 0.00 0.00 58.31 53.41 2cqs n LYS 188 Cb 0.49 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.33 2cqs n LYS 188 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2cqs n THR 189 N -0.71 0.02 -0.90 0.58 -1.04 -1.21 -1.21 114.28 109.81 2cqs n THR 189 Ca 0.22 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.22 2cqs n THR 189 Cb 0.84 -1.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.76 2cqs n THR 189 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2cqs n GLU 190 N 3.57 -0.74 0.18 -2.82 1.02 -1.26 -4.83 120.64 115.76 2cqs n GLU 190 Ca 0.17 0.18 0.03 0.00 -0.02 0.00 0.00 57.16 57.52 2cqs n GLU 190 Cb 0.29 -3.95 0.33 0.00 -0.02 0.00 0.00 31.44 28.10 2cqs n GLU 190 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2cqs h TYR 191 N 0.00 0.00 0.00 -0.32 3.20 -1.37 -1.24 116.97 117.23 2cqs h TYR 191 Ca 0.00 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 2cqs h TYR 191 Cb 0.37 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 2cqs h TYR 191 CO 0.23 0.42 -0.08 0.07 -1.64 0.00 0.00 178.16 177.16 2cqs h ARG 192 N 0.00 0.00 0.00 1.82 0.11 -1.84 -3.41 114.38 111.05 2cqs h ARG 192 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2cqs h ARG 192 Cb 0.81 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.89 2cqs h ARG 192 CO 0.05 0.08 0.00 -0.85 0.10 0.00 0.00 179.97 179.35 2cqs n GLU 193 N -3.37 0.00 0.12 0.08 0.28 -0.51 -4.98 120.64 112.25 2cqs n GLU 193 Ca -0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.11 2cqs n GLU 193 Cb 0.24 0.00 0.46 0.00 1.43 0.00 0.00 31.44 33.57 2cqs n GLU 193 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2cqs n ARG 194 N 0.00 0.22 -2.86 3.44 1.74 -1.21 -4.83 116.66 113.17 2cqs n ARG 194 Ca 0.00 0.33 -0.41 0.00 -0.77 0.00 0.00 57.85 57.00 2cqs n ARG 194 Cb 0.00 -1.84 -0.04 0.00 -1.02 0.00 0.00 32.46 29.56 2cqs n ARG 194 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2cqs s ARG 195 N -3.23 4.51 -0.18 5.56 0.52 -0.96 -4.92 118.95 120.25 2cqs s ARG 195 Ca 0.07 1.19 0.16 0.00 -0.52 0.00 0.00 55.73 56.63 2cqs s ARG 195 Cb 0.11 -3.45 0.78 0.00 0.52 0.00 0.00 34.95 32.91 2cqs s ARG 195 CO 0.48 0.02 1.70 -0.40 0.02 0.00 0.00 175.30 177.11 2cqs n ASP 196 N 3.78 5.32 -4.12 0.23 5.75 -1.26 -4.43 116.55 121.82 2cqs n ASP 196 Ca 0.03 -2.72 -0.12 0.00 -0.01 0.00 0.00 54.79 51.97 2cqs n ASP 196 Cb 0.51 -0.64 -0.11 0.00 -1.03 0.00 0.00 41.12 39.85 2cqs n ASP 196 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2cqs s HIS 197 N -2.36 0.81 0.20 2.11 -3.43 -1.26 -1.57 115.29 109.79 2cqs s HIS 197 Ca 0.53 -0.70 -0.10 0.00 -0.80 0.00 0.00 55.06 53.99 2cqs s HIS 197 Cb 0.38 -0.47 -0.01 0.00 -1.43 0.00 0.00 32.58 31.05 2cqs s HIS 197 CO 0.20 -0.11 0.36 1.52 -2.00 0.00 0.00 174.74 174.71 2cqs s TYR 198 N -2.49 0.39 0.10 0.38 -0.85 -0.70 -4.70 117.35 109.47 2cqs s TYR 198 Ca 0.01 -0.74 0.07 0.00 -0.52 0.00 0.00 57.07 55.89 2cqs s TYR 198 Cb -0.02 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.31 2cqs s TYR 198 CO -0.02 -0.82 -0.10 0.00 -1.52 0.00 0.00 175.55 173.09 2cqs s ALA 199 N -3.99 2.96 0.07 9.51 0.00 -0.58 -1.14 121.76 128.60 2cqs s ALA 199 Ca 0.20 -1.23 0.08 0.00 0.00 0.00 0.00 51.96 51.00 2cqs s ALA 199 Cb 0.02 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 2cqs s ALA 199 CO 0.04 0.64 -0.21 0.54 0.00 0.00 0.00 175.76 176.77 2cqs s VAL 200 N -1.21 1.70 -0.22 0.00 0.11 -0.30 -0.66 120.40 119.82 2cqs s VAL 200 Ca 0.21 -1.38 -0.04 0.00 -2.93 0.00 0.00 61.98 57.84 2cqs s VAL 200 Cb -0.11 -1.51 0.07 0.00 -1.53 0.00 0.00 36.38 33.30 2cqs s VAL 200 CO 0.13 0.07 0.10 0.12 -3.33 0.00 0.00 175.10 172.19 2cqs s PHE 201 N -0.99 0.36 0.30 1.54 5.36 -0.19 -0.67 117.98 123.69 2cqs s PHE 201 Ca 0.07 -0.60 0.03 0.00 -0.96 0.00 0.00 56.93 55.47 2cqs s PHE 201 Cb -0.09 -0.82 -0.04 0.00 -0.34 0.00 0.00 43.02 41.72 2cqs s PHE 201 CO 0.03 -0.64 0.14 0.20 -1.46 0.00 0.00 175.22 173.50 2cqs s GLY 202 N 2.08 2.03 0.03 13.12 0.00 -0.50 -1.04 107.32 123.05 2cqs s GLY 202 Ca 0.04 -1.75 0.03 0.00 0.00 0.00 0.00 44.72 43.04 2cqs s GLY 202 CO -0.19 -1.61 -0.09 0.54 0.00 0.00 0.00 173.10 171.75 2cqs s VAL 203 N -3.60 0.71 0.00 1.40 0.11 -0.31 -0.79 120.40 117.91 2cqs s VAL 203 Ca 0.35 -0.89 -0.01 0.00 -2.93 0.00 0.00 61.98 58.51 2cqs s VAL 203 Cb 0.05 -0.69 -0.03 0.00 -1.53 0.00 0.00 36.38 34.18 2cqs s VAL 203 CO 0.17 -0.16 1.81 -0.46 -3.33 0.00 0.00 175.10 173.13 2cqs n ASN 204 N 1.89 4.33 -3.47 3.54 6.94 -0.40 -2.81 115.26 125.28 2cqs n ASN 204 Ca -0.19 -2.16 -0.13 0.00 -0.02 0.00 0.00 54.58 52.08 2cqs n ASN 204 Cb 0.55 -0.95 -0.03 0.00 -2.36 0.00 0.00 39.78 36.99 2cqs n ASN 204 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 2cqs s THR 205 N 0.51 0.00 -0.49 5.53 -1.32 -1.19 -4.79 115.64 113.88 2cqs s THR 205 Ca 0.07 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.27 2cqs s THR 205 Cb 0.03 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.04 2cqs s THR 205 CO 0.00 0.00 1.33 -0.60 -2.21 0.00 0.00 174.62 173.14 2cqs s ARG 206 N -2.87 3.50 0.59 7.08 3.00 -1.26 -1.53 118.95 127.45 2cqs s ARG 206 Ca -0.01 0.62 -0.19 0.00 -1.00 0.00 0.00 55.73 55.15 2cqs s ARG 206 Cb -0.01 -4.03 -0.04 0.00 0.00 0.00 0.00 34.95 30.87 2cqs s ARG 206 CO -0.06 -1.67 1.21 0.00 0.00 0.00 0.00 175.30 174.77 2cqs s ALA 207 N 5.41 2.57 0.22 6.12 0.00 -1.26 -4.94 121.76 129.87 2cqs s ALA 207 Ca 0.54 1.01 0.06 0.00 0.00 0.00 0.00 51.96 53.56 2cqs s ALA 207 Cb -0.11 -3.45 0.19 0.00 0.00 0.00 0.00 23.12 19.75 2cqs s ALA 207 CO 0.29 -1.14 1.51 -0.44 0.00 0.00 0.00 175.76 175.99 2cqs h ASP 208 N 0.94 0.19 -5.02 0.00 3.32 -1.09 -3.48 116.42 111.28 2cqs h ASP 208 Ca -0.50 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 2cqs h ASP 208 Cb 1.30 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2cqs h ASP 208 CO 0.55 0.82 0.29 -0.83 -1.72 0.00 0.00 179.24 178.35 2cqs s GLY 209 N -4.43 0.37 0.32 2.75 0.00 -1.20 -4.98 107.32 100.15 2cqs s GLY 209 Ca -0.03 -0.75 -0.09 0.00 0.00 0.00 0.00 44.72 43.86 2cqs s GLY 209 CO 0.80 -0.19 0.54 -0.11 0.00 0.00 0.00 173.10 174.14 2cqs s PHE 210 N -2.25 0.61 -0.28 1.90 -0.12 -1.26 -1.16 117.98 115.42 2cqs s PHE 210 Ca 0.16 -0.98 -0.20 0.00 -0.05 0.00 0.00 56.93 55.86 2cqs s PHE 210 Cb -0.05 0.21 0.08 0.00 -0.63 0.00 0.00 43.02 42.63 2cqs s PHE 210 CO 0.11 -1.18 0.72 -0.51 -0.05 0.00 0.00 175.22 174.31 2cqs s ASP 211 N -3.12 -0.85 0.00 1.98 1.01 -0.37 -0.37 116.67 114.95 2cqs s ASP 211 Ca 0.24 1.46 0.00 0.00 0.71 0.00 0.00 52.55 54.96 2cqs s ASP 211 Cb -0.02 1.40 0.00 0.00 1.01 0.00 0.00 42.92 45.32 2cqs s ASP 211 CO 0.14 -0.24 0.24 0.35 0.21 0.00 0.00 175.17 175.88 2cqs n THR 212 N 3.63 0.00 -3.81 -1.27 -2.24 -0.58 -2.29 114.28 107.72 2cqs n THR 212 Ca -0.18 -0.35 -0.36 0.00 -2.27 0.00 0.00 64.05 60.89 2cqs n THR 212 Cb 0.57 1.21 -0.13 0.00 -2.10 0.00 0.00 70.33 69.88 2cqs n THR 212 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2cqs s ASP 213 N -0.22 4.85 0.10 3.42 2.15 -1.26 -0.40 116.67 125.32 2cqs s ASP 213 Ca 0.00 -0.43 -0.23 0.00 0.43 0.00 0.00 52.55 52.32 2cqs s ASP 213 Cb 0.00 -1.85 -0.13 0.00 -0.30 0.00 0.00 42.92 40.64 2cqs s ASP 213 CO 0.00 -0.08 1.72 -0.09 -0.17 0.00 0.00 175.17 176.56 2cqs h ARG 214 N 8.19 -0.06 -0.73 4.34 2.43 -1.29 -2.05 114.38 125.21 2cqs h ARG 214 Ca -0.37 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 58.92 2cqs h ARG 214 Cb 1.15 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.67 2cqs h ARG 214 CO 0.59 -0.04 0.48 -0.44 -1.51 0.00 0.00 179.97 179.05 2cqs h ASP 215 N -0.07 0.48 -0.09 -3.80 3.32 -1.94 0.14 116.42 114.46 2cqs h ASP 215 Ca 0.01 0.02 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 2cqs h ASP 215 Cb 0.08 -0.08 0.01 0.00 0.22 0.00 0.00 39.33 39.56 2cqs h ASP 215 CO -0.03 0.27 -0.79 0.74 -1.72 0.00 0.00 179.24 177.71 2cqs h THR 216 N 0.53 1.31 -0.25 0.35 2.02 -1.87 0.16 112.91 115.15 2cqs h THR 216 Ca 0.35 -2.03 -0.05 0.00 0.77 0.00 0.00 66.41 65.44 2cqs h THR 216 Cb 0.63 2.19 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 2cqs h THR 216 CO -0.12 0.63 -0.04 0.15 0.37 0.00 0.00 175.52 176.51 2cqs h PHE 217 N 0.37 0.53 0.21 3.16 3.57 -0.62 -3.33 116.94 120.83 2cqs h PHE 217 Ca -0.07 -0.11 -0.34 0.00 3.53 0.00 0.00 57.97 60.97 2cqs h PHE 217 Cb 1.44 -0.13 0.02 0.00 2.79 0.00 0.00 35.95 40.06 2cqs h PHE 217 CO 0.10 0.68 -1.64 0.28 -2.23 0.00 0.00 178.31 175.50 2cqs h VAL 218 N 0.23 1.07 0.00 1.41 2.07 -0.85 -1.53 116.25 118.64 2cqs h VAL 218 Ca 0.07 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 65.01 2cqs h VAL 218 Cb 0.50 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.14 2cqs h VAL 218 CO 0.02 0.84 0.00 0.61 0.02 0.00 0.00 177.57 179.06 2cqs n GLY 219 N 1.81 0.50 3.74 2.17 0.00 0.56 -1.16 105.19 112.81 2cqs n GLY 219 Ca -0.22 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 2cqs n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqs n ALA 220 N 0.87 1.63 -0.78 4.61 0.00 -1.26 -2.51 120.51 123.07 2cqs n ALA 220 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2cqs n ALA 220 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.11 2cqs n ALA 220 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cqs n TYR 221 N -0.59 0.00 -4.01 0.00 4.01 -1.26 -4.97 117.16 110.34 2cqs n TYR 221 Ca 0.08 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.51 2cqs n TYR 221 Cb 0.42 -1.35 -0.06 0.00 -0.31 0.00 0.00 39.34 38.05 2cqs n TYR 221 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2cqs s ASN 222 N -2.12 5.86 0.60 7.72 0.01 -1.05 -5.12 114.94 120.84 2cqs s ASN 222 Ca 0.00 0.12 0.03 0.00 -0.71 0.00 0.00 52.86 52.30 2cqs s ASN 222 Cb 0.00 -1.69 0.07 0.00 0.41 0.00 0.00 41.25 40.05 2cqs s ASN 222 CO 0.00 0.19 0.83 -0.94 -1.51 0.00 0.00 177.10 175.67 2cqs s SER 223 N -2.32 4.97 0.56 -1.22 1.04 -1.26 -4.85 113.70 110.61 2cqs s SER 223 Ca 0.30 -0.33 0.24 0.00 0.48 0.00 0.00 55.95 56.65 2cqs s SER 223 Cb -0.12 -0.35 1.58 0.00 0.10 0.00 0.00 66.02 67.23 2cqs s SER 223 CO 0.23 -1.38 2.20 -0.07 0.98 0.00 0.00 173.24 175.20 2cqs h LEU 224 N -0.05 0.00 -0.45 2.42 3.38 -1.94 -0.99 115.31 117.68 2cqs h LEU 224 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2cqs h LEU 224 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2cqs h LEU 224 CO 0.45 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.60 2cqs n GLY 225 N -1.37 -1.41 0.43 0.83 0.00 -1.26 -2.98 105.19 99.44 2cqs n GLY 225 Ca -0.03 0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.11 2cqs n GLY 225 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cqs n GLU 226 N -2.21 1.74 -1.65 1.61 1.02 -0.39 -4.50 120.64 116.26 2cqs n GLU 226 Ca 0.03 -2.80 -0.58 0.00 -0.02 0.00 0.00 57.16 53.80 2cqs n GLU 226 Cb 0.29 -1.62 -0.07 0.00 -0.02 0.00 0.00 31.44 30.02 2cqs n GLU 226 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cqs n ALA 227 N -1.16 -1.11 -0.12 0.62 0.00 -1.14 -4.77 120.51 112.82 2cqs n ALA 227 Ca 0.19 0.48 -0.10 0.00 0.00 0.00 0.00 53.44 54.01 2cqs n ALA 227 Cb 0.74 -2.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.11 2cqs n ALA 227 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cqs h SER 228 N 5.44 0.53 0.17 0.00 0.02 -0.95 -3.14 113.55 115.62 2cqs h SER 228 Ca -0.47 -0.20 0.01 0.00 -0.84 0.00 0.00 61.79 60.29 2cqs h SER 228 Cb 1.35 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.72 2cqs h SER 228 CO 0.86 0.59 -0.30 0.58 -1.14 0.00 0.00 176.83 177.43 2cqs h VAL 229 N 0.44 0.36 -0.99 2.27 2.07 -1.53 0.13 116.25 119.01 2cqs h VAL 229 Ca 0.12 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.71 2cqs h VAL 229 Cb 0.25 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.32 2cqs h VAL 229 CO -0.00 0.00 0.64 -0.65 0.02 0.00 0.00 177.57 177.58 2cqs h PRO 230 N -0.55 1.09 -0.31 1.57 0.11 -1.81 -0.64 132.00 131.45 2cqs h PRO 230 Ca 0.02 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.99 2cqs h PRO 230 Cb 0.55 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 2cqs h PRO 230 CO -0.14 0.72 -0.11 0.00 -0.21 0.00 0.00 178.00 178.26 2cqs h ARG 231 N 1.12 0.53 0.00 1.05 3.08 -1.39 -2.02 114.38 116.75 2cqs h ARG 231 Ca 0.44 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 60.29 2cqs h ARG 231 Cb 0.24 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 2cqs h ARG 231 CO -0.19 0.64 -0.24 0.00 -1.07 0.00 0.00 179.97 179.11 2cqs h ALA 232 N 1.39 0.98 0.00 0.04 0.00 0.65 -3.47 119.26 118.85 2cqs h ALA 232 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2cqs h ALA 232 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2cqs h ALA 232 CO 0.03 0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.99 2cqs n GLY 233 N 0.32 0.73 3.50 0.00 0.00 -0.39 -5.03 105.19 104.33 2cqs n GLY 233 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.87 2cqs n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cqs s LYS 234 N -0.39 0.90 0.76 1.61 -2.85 -1.21 -4.98 119.74 113.58 2cqs s LYS 234 Ca 0.00 0.46 -0.14 0.00 -1.00 0.00 0.00 55.97 55.30 2cqs s LYS 234 Cb 0.00 0.43 0.05 0.00 -2.06 0.00 0.00 37.83 36.25 2cqs s LYS 234 CO 0.00 -0.22 1.17 -1.12 0.10 0.00 0.00 175.35 175.28 2cqs s SER 235 N -0.61 4.13 0.00 0.03 0.01 -1.26 -4.76 113.70 111.24 2cqs s SER 235 Ca -0.07 2.22 0.24 0.00 1.31 0.00 0.00 55.95 59.65 2cqs s SER 235 Cb -0.02 -2.57 0.26 0.00 0.21 0.00 0.00 66.02 63.89 2cqs s SER 235 CO 0.06 -2.30 1.30 0.00 0.41 0.00 0.00 173.24 172.71 2cqs n ALA 236 N -3.03 2.52 -4.05 1.44 0.00 -1.25 -4.87 120.51 111.27 2cqs n ALA 236 Ca 0.12 -0.67 -0.31 0.00 0.00 0.00 0.00 53.44 52.59 2cqs n ALA 236 Cb 0.51 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 2cqs n ALA 236 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2cqs n ASP 237 N 1.18 -2.46 -4.75 0.00 8.00 0.50 -4.90 116.55 114.11 2cqs n ASP 237 Ca 0.14 -0.96 -0.40 0.00 0.71 0.00 0.00 54.79 54.28 2cqs n ASP 237 Cb 0.57 -3.12 -0.05 0.00 -0.02 0.00 0.00 41.12 38.50 2cqs n ASP 237 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2cqs s SER 238 N -3.71 7.34 -0.27 -2.24 1.04 -1.24 -4.92 113.70 109.70 2cqs s SER 238 Ca 0.44 2.18 -0.00 0.00 0.48 0.00 0.00 55.95 59.05 2cqs s SER 238 Cb -0.24 -2.62 0.04 0.00 0.10 0.00 0.00 66.02 63.31 2cqs s SER 238 CO 0.89 -0.10 -0.06 -0.69 0.98 0.00 0.00 173.24 174.26 2cqs s VAL 239 N -1.00 2.68 0.55 5.02 1.01 -1.26 -1.53 120.40 125.87 2cqs s VAL 239 Ca 0.45 -1.34 -0.19 0.00 0.00 0.00 0.00 61.98 60.90 2cqs s VAL 239 Cb -0.30 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 2cqs s VAL 239 CO 0.38 0.03 1.15 0.00 0.00 0.00 0.00 175.10 176.66 2cqs s ALA 240 N 1.23 2.66 -0.36 5.51 0.00 -1.26 -4.89 121.76 124.65 2cqs s ALA 240 Ca -0.04 0.88 0.02 0.00 0.00 0.00 0.00 51.96 52.81 2cqs s ALA 240 Cb -0.19 -3.39 0.15 0.00 0.00 0.00 0.00 23.12 19.70 2cqs s ALA 240 CO -0.04 -0.87 0.30 0.45 0.00 0.00 0.00 175.76 175.60 2cqs s SER 241 N -1.71 2.00 0.07 0.00 0.15 -1.26 -4.53 113.70 108.42 2cqs s SER 241 Ca 0.74 -1.87 0.00 0.00 0.70 0.00 0.00 55.95 55.52 2cqs s SER 241 Cb -0.26 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 2cqs s SER 241 CO 0.29 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2cqs n GLY 242 N 4.15 -1.38 7.00 9.45 0.00 0.19 -4.93 105.19 119.66 2cqs n GLY 242 Ca 0.12 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2cqs n GLY 242 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2cqs n TRP 243 N -0.01 0.00 -3.87 1.61 7.02 0.14 -4.41 117.44 117.92 2cqs n TRP 243 Ca 0.00 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.14 2cqs n TRP 243 Cb 0.00 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 28.76 2cqs n TRP 243 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 2cqs s TYR 244 N 0.00 3.57 0.37 -5.99 2.02 -1.26 -4.71 117.35 111.34 2cqs s TYR 244 Ca 0.00 -2.76 -0.27 0.00 -0.37 0.00 0.00 57.07 53.67 2cqs s TYR 244 Cb 0.00 -3.07 -0.10 0.00 -0.40 0.00 0.00 41.96 38.39 2cqs s TYR 244 CO 0.00 -0.92 1.30 -2.14 -1.57 0.00 0.00 175.55 172.23 2cqs s PRO 245 N 0.70 4.17 0.23 -1.71 0.02 -1.26 -0.83 135.00 136.32 2cqs s PRO 245 Ca 0.12 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.32 2cqs s PRO 245 Cb -0.22 -2.92 -0.04 0.00 0.02 0.00 0.00 34.50 31.34 2cqs s PRO 245 CO -0.05 -0.33 0.13 0.96 -0.33 0.00 0.00 177.00 177.38 2cqs s ILE 246 N -1.20 0.17 -0.14 2.83 -4.36 0.47 -2.35 121.20 116.62 2cqs s ILE 246 Ca 0.53 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.93 2cqs s ILE 246 Cb -0.39 -2.54 0.01 0.00 1.25 0.00 0.00 42.46 40.80 2cqs s ILE 246 CO 0.51 0.00 -0.18 -0.83 0.24 0.00 0.00 174.94 174.68 2cqs s GLY 247 N -3.22 1.21 -0.25 6.27 0.00 0.11 -4.20 107.32 107.24 2cqs s GLY 247 Ca 0.39 -0.95 -0.15 0.00 0.00 0.00 0.00 44.72 44.01 2cqs s GLY 247 CO 0.14 0.20 0.62 -0.45 0.00 0.00 0.00 173.10 173.60 2cqs s SER 248 N 1.05 -0.82 0.06 1.64 0.15 -0.97 -1.52 113.70 113.29 2cqs s SER 248 Ca -0.03 1.34 0.06 0.00 0.70 0.00 0.00 55.95 58.02 2cqs s SER 248 Cb -0.15 1.23 -0.03 0.00 -1.71 0.00 0.00 66.02 65.37 2cqs s SER 248 CO -0.05 -0.23 -0.16 -1.00 1.20 0.00 0.00 173.24 173.01 2cqs s HIS 249 N 1.45 1.39 -0.07 3.44 3.76 -1.25 -1.24 115.29 122.78 2cqs s HIS 249 Ca -0.09 -0.39 0.03 0.00 -0.15 0.00 0.00 55.06 54.46 2cqs s HIS 249 Cb -0.06 -0.81 -0.02 0.00 1.11 0.00 0.00 32.58 32.80 2cqs s HIS 249 CO -0.16 0.07 -0.15 -1.54 -0.85 0.00 0.00 174.74 172.11 2cqs s SER 250 N -1.39 3.96 -0.06 1.40 1.04 -0.31 -1.54 113.70 116.81 2cqs s SER 250 Ca 0.02 -0.24 -0.02 0.00 0.48 0.00 0.00 55.95 56.19 2cqs s SER 250 Cb -0.09 -1.00 0.03 0.00 0.10 0.00 0.00 66.02 65.06 2cqs s SER 250 CO 0.02 0.30 0.03 -0.69 0.98 0.00 0.00 173.24 173.88 2cqs s VAL 251 N -0.47 0.12 0.01 5.02 1.01 -0.46 -0.38 120.40 125.25 2cqs s VAL 251 Ca 0.06 0.28 -0.21 0.00 0.00 0.00 0.00 61.98 62.11 2cqs s VAL 251 Cb -0.12 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 35.87 2cqs s VAL 251 CO 0.02 0.21 0.60 0.00 0.00 0.00 0.00 175.10 175.94 2cqs s ALA 252 N 2.07 3.49 0.05 5.51 0.00 -1.26 -0.82 121.76 130.80 2cqs s ALA 252 Ca 0.05 0.05 0.05 0.00 0.00 0.00 0.00 51.96 52.11 2cqs s ALA 252 Cb -0.12 -2.75 -0.02 0.00 0.00 0.00 0.00 23.12 20.23 2cqs s ALA 252 CO -0.04 0.19 -0.14 0.14 0.00 0.00 0.00 175.76 175.90 2cqs s VAL 253 N -0.29 1.13 -0.12 0.00 -7.23 0.71 -4.99 120.40 109.61 2cqs s VAL 253 Ca 0.31 -1.07 0.01 0.00 -1.81 0.00 0.00 61.98 59.43 2cqs s VAL 253 Cb -0.19 -1.03 0.02 0.00 0.56 0.00 0.00 36.38 35.74 2cqs s VAL 253 CO 0.18 -0.04 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.90 2cqs s THR 254 N -0.94 1.48 -0.05 5.32 2.01 -1.26 -1.32 115.64 120.88 2cqs s THR 254 Ca 0.01 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2cqs s THR 254 Cb -0.08 -1.37 0.01 0.00 0.01 0.00 0.00 72.50 71.07 2cqs s THR 254 CO 0.01 0.44 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.51 2cqs s LEU 255 N 1.19 1.73 0.70 4.42 1.43 0.95 -4.97 118.68 124.13 2cqs s LEU 255 Ca -0.02 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.70 2cqs s LEU 255 Cb -0.14 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.35 2cqs s LEU 255 CO -0.05 0.07 1.08 -1.10 0.23 0.00 0.00 176.35 176.58 2cqs s GLN 256 N 0.38 2.91 0.17 1.70 -0.21 -1.26 -0.60 119.66 122.75 2cqs s GLN 256 Ca -0.08 0.59 -0.33 0.00 0.02 0.00 0.00 55.36 55.56 2cqs s GLN 256 Cb -0.12 -2.02 -0.15 0.00 1.00 0.00 0.00 33.01 31.72 2cqs s GLN 256 CO 0.02 -1.03 1.33 -2.30 -2.12 0.00 0.00 175.29 171.20 2cqs n PRO 257 N -3.02 1.54 -0.11 2.91 -0.02 -1.26 -0.87 135.00 134.17 2cqs n PRO 257 Ca 0.07 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2cqs n PRO 257 Cb 0.56 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2cqs n PRO 257 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cqs n GLY 258 N 2.39 2.60 3.80 -1.23 0.00 0.98 -5.01 105.19 108.73 2cqs n GLY 258 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2cqs n GLY 258 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cqs s GLU 259 N -0.01 4.44 0.26 1.61 2.12 -0.05 -4.75 118.70 122.32 2cqs s GLU 259 Ca 0.00 1.18 0.05 0.00 0.36 0.00 0.00 54.97 56.57 2cqs s GLU 259 Cb 0.00 -2.69 -0.06 0.00 0.26 0.00 0.00 34.13 31.64 2cqs s GLU 259 CO 0.00 0.24 -0.04 -1.54 -0.54 0.00 0.00 175.26 173.39 2cqs s SER 260 N -1.75 2.42 -0.04 -1.70 1.04 -1.26 -0.97 113.70 111.44 2cqs s SER 260 Ca 0.51 -1.20 -0.03 0.00 0.48 0.00 0.00 55.95 55.70 2cqs s SER 260 Cb -0.16 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 65.87 2cqs s SER 260 CO 0.21 -0.41 0.11 -0.60 0.98 0.00 0.00 173.24 173.53 2cqs s ARG 261 N -3.78 0.11 -0.01 4.02 6.06 0.44 -4.97 118.95 120.82 2cqs s ARG 261 Ca 0.29 0.17 -0.00 0.00 -2.50 0.00 0.00 55.73 53.69 2cqs s ARG 261 Cb 0.05 0.02 -0.04 0.00 0.06 0.00 0.00 34.95 35.04 2cqs s ARG 261 CO 0.11 -0.04 0.07 -0.51 -2.50 0.00 0.00 175.30 172.43 2cqs s ASP 262 N 0.23 5.63 -0.03 -2.12 -0.00 -1.26 -0.82 116.67 118.30 2cqs s ASP 262 Ca -0.01 0.14 -0.01 0.00 -0.00 0.00 0.00 52.55 52.67 2cqs s ASP 262 Cb -0.02 -1.61 0.03 0.00 -0.00 0.00 0.00 42.92 41.32 2cqs s ASP 262 CO -0.01 0.28 0.06 -0.76 -0.00 0.00 0.00 175.17 174.74 2cqs s LEU 263 N -1.68 1.06 -0.22 1.23 1.43 0.01 -4.99 118.68 115.50 2cqs s LEU 263 Ca 0.22 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 53.41 2cqs s LEU 263 Cb -0.12 0.05 0.01 0.00 0.03 0.00 0.00 46.19 46.16 2cqs s LEU 263 CO 0.13 -0.12 -0.09 -0.69 0.23 0.00 0.00 176.35 175.81 2cqs s VAL 264 N 1.01 2.86 0.04 -1.59 1.01 -1.26 -0.25 120.40 122.21 2cqs s VAL 264 Ca -0.08 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2cqs s VAL 264 Cb -0.12 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 2cqs s VAL 264 CO -0.03 0.36 0.04 -0.31 0.00 0.00 0.00 175.10 175.16 2cqs s TYR 265 N 1.37 3.15 -0.04 5.22 1.51 0.29 -1.27 117.35 127.58 2cqs s TYR 265 Ca 0.03 0.10 0.01 0.00 -1.01 0.00 0.00 57.07 56.20 2cqs s TYR 265 Cb -0.15 -1.65 0.02 0.00 -0.11 0.00 0.00 41.96 40.07 2cqs s TYR 265 CO -0.06 0.50 -0.04 0.08 -1.11 0.00 0.00 175.55 174.92 2cqs s VAL 266 N -1.24 0.52 -0.28 0.71 1.01 0.03 -0.70 120.40 120.45 2cqs s VAL 266 Ca 0.24 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.08 2cqs s VAL 266 Cb -0.12 -0.55 0.03 0.00 0.00 0.00 0.00 36.38 35.75 2cqs s VAL 266 CO 0.16 0.22 0.00 -0.22 0.00 0.00 0.00 175.10 175.26 2cqs s LEU 267 N 0.90 3.66 0.17 3.92 2.96 -0.42 -1.41 118.68 128.46 2cqs s LEU 267 Ca -0.11 -1.00 0.08 0.00 -0.22 0.00 0.00 54.13 52.88 2cqs s LEU 267 Cb -0.14 -1.74 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 2cqs s LEU 267 CO 0.00 -0.20 -0.17 -0.83 -1.32 0.00 0.00 176.35 173.83 2cqs s GLY 268 N 1.34 1.36 -0.21 7.98 0.00 0.16 -0.36 107.32 117.59 2cqs s GLY 268 Ca -0.01 -1.50 -0.06 0.00 0.00 0.00 0.00 44.72 43.15 2cqs s GLY 268 CO -0.01 -1.56 0.02 -0.47 0.00 0.00 0.00 173.10 171.08 2cqs s TYR 269 N -2.22 3.07 0.12 1.90 5.04 -0.33 -1.15 117.35 123.77 2cqs s TYR 269 Ca 0.16 -0.39 0.08 0.00 -2.44 0.00 0.00 57.07 54.49 2cqs s TYR 269 Cb -0.05 -2.11 -0.04 0.00 0.35 0.00 0.00 41.96 40.11 2cqs s TYR 269 CO 0.06 -0.22 -0.21 -0.51 -1.34 0.00 0.00 175.55 173.34 2cqs s LEU 270 N 1.05 2.33 0.06 6.97 2.01 -0.29 -4.79 118.68 126.03 2cqs s LEU 270 Ca 0.03 -0.73 0.04 0.00 0.01 0.00 0.00 54.13 53.47 2cqs s LEU 270 Cb -0.14 -0.89 -0.03 0.00 0.01 0.00 0.00 46.19 45.14 2cqs s LEU 270 CO 0.02 0.04 -0.11 -1.61 1.01 0.00 0.00 176.35 175.71 2cqs s GLU 271 N -2.12 0.69 0.02 1.70 2.02 -1.26 -1.73 118.70 118.02 2cqs s GLU 271 Ca 0.09 -0.89 0.03 0.00 0.02 0.00 0.00 54.97 54.22 2cqs s GLU 271 Cb -0.09 -0.54 -0.02 0.00 0.10 0.00 0.00 34.13 33.58 2cqs s GLU 271 CO 0.05 0.11 -0.09 -0.80 0.02 0.00 0.00 175.26 174.55 2cqs s ASN 272 N -1.76 1.02 0.57 -0.19 0.01 -0.61 -4.90 114.94 109.10 2cqs s ASN 272 Ca -0.05 -0.34 -0.20 0.00 -0.71 0.00 0.00 52.86 51.56 2cqs s ASN 272 Cb -0.09 -0.05 -0.04 0.00 0.41 0.00 0.00 41.25 41.48 2cqs s ASN 272 CO 0.01 -0.02 1.30 -2.84 -1.51 0.00 0.00 177.10 174.04 2cqs s PRO 273 N -0.85 3.00 0.28 -0.60 0.02 -1.26 -4.73 135.00 130.86 2cqs s PRO 273 Ca -0.02 2.08 0.01 0.00 0.02 0.00 0.00 61.00 63.09 2cqs s PRO 273 Cb -0.06 -2.10 0.64 0.00 0.02 0.00 0.00 34.50 33.00 2cqs s PRO 273 CO 0.00 -1.25 1.68 -0.44 -0.33 0.00 0.00 177.00 176.67 2cqs h ASP 274 N 1.16 0.17 0.33 2.53 5.19 -2.00 0.36 116.42 124.16 2cqs h ASP 274 Ca -0.51 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.06 2cqs h ASP 274 Cb 1.31 0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.99 2cqs h ASP 274 CO 0.56 -0.04 0.00 -0.62 -3.12 0.00 0.00 179.24 176.02 2cqs n GLU 275 N -5.11 0.52 -0.06 3.56 -0.58 -1.26 -2.90 120.64 114.81 2cqs n GLU 275 Ca 0.19 0.03 0.08 0.00 -0.42 0.00 0.00 57.16 57.04 2cqs n GLU 275 Cb 0.59 -1.50 0.11 0.00 -0.57 0.00 0.00 31.44 30.08 2cqs n GLU 275 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2cqs n GLU 276 N -1.19 1.55 -0.08 3.49 4.07 0.12 -4.79 120.64 123.81 2cqs n GLU 276 Ca 0.15 -2.37 -0.06 0.00 -0.06 0.00 0.00 57.16 54.83 2cqs n GLU 276 Cb 0.17 -1.40 0.13 0.00 -0.06 0.00 0.00 31.44 30.29 2cqs n GLU 276 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2cqs h LYS 277 N 0.00 0.73 -6.27 5.31 1.57 -1.23 -3.43 116.57 113.25 2cqs h LYS 277 Ca 0.00 -0.25 -0.68 0.00 -1.87 0.00 0.00 60.65 57.85 2cqs h LYS 277 Cb 0.92 -0.06 -0.19 0.00 0.08 0.00 0.00 32.23 32.98 2cqs h LYS 277 CO 0.00 0.84 -0.72 -1.58 -0.57 0.00 0.00 179.45 177.42 2cqs s TRP 278 N -4.73 2.85 0.08 -1.35 0.52 -1.26 -1.43 118.94 113.62 2cqs s TRP 278 Ca -0.09 -0.05 0.14 0.00 0.02 0.00 0.00 56.10 56.12 2cqs s TRP 278 Cb 0.14 -1.63 0.29 0.00 -1.15 0.00 0.00 33.47 31.11 2cqs s TRP 278 CO 0.82 0.32 1.55 0.00 0.02 0.00 0.00 176.95 179.66 2cqs h ALA 279 N 4.88 0.78 -2.43 0.98 0.00 -0.82 -3.43 119.26 119.22 2cqs h ALA 279 Ca -0.48 -0.51 -0.59 0.00 0.00 0.00 0.00 54.91 53.33 2cqs h ALA 279 Cb 1.17 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.75 2cqs h ALA 279 CO 0.52 0.70 -0.69 0.16 0.00 0.00 0.00 179.25 179.95 2cqs s ASP 280 N -6.55 4.29 0.36 0.00 3.84 -1.26 -5.03 116.67 112.33 2cqs s ASP 280 Ca 0.01 -0.70 0.08 0.00 -0.00 0.00 0.00 52.55 51.94 2cqs s ASP 280 Cb 0.10 -0.71 0.70 0.00 -1.38 0.00 0.00 42.92 41.63 2cqs s ASP 280 CO 0.74 0.04 1.88 0.44 -0.00 0.00 0.00 175.17 178.27 2cqs h ASP 281 N 2.24 0.29 0.44 2.11 3.45 -1.97 -2.46 116.42 120.53 2cqs h ASP 281 Ca -0.44 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 56.95 2cqs h ASP 281 Cb 1.24 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.93 2cqs h ASP 281 CO 0.59 0.46 0.00 0.00 -1.57 0.00 0.00 179.24 178.71 2cqs n ALA 282 N -2.49 2.21 -3.47 3.45 0.00 -1.26 -4.92 120.51 114.03 2cqs n ALA 282 Ca -0.00 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.15 2cqs n ALA 282 Cb 0.29 -1.38 0.08 0.00 0.00 0.00 0.00 19.45 18.43 2cqs n ALA 282 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2cqs n HIS 283 N -1.28 -2.16 0.00 0.00 8.25 -0.93 -4.93 115.22 114.18 2cqs n HIS 283 Ca 0.11 0.91 0.00 0.00 -0.26 0.00 0.00 57.72 58.48 2cqs n HIS 283 Cb 0.19 -4.87 0.00 0.00 1.12 0.00 0.00 29.99 26.43 2cqs n HIS 283 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2cqs n GLN 284 N -4.09 1.11 -4.66 -0.41 1.13 -1.26 -5.02 117.38 104.18 2cqs n GLN 284 Ca -0.27 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.46 2cqs n GLN 284 Cb 0.67 -0.99 -0.15 0.00 0.11 0.00 0.00 30.24 29.88 2cqs n GLN 284 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2cqs s VAL 285 N -1.97 2.89 0.33 5.09 1.01 -1.26 -5.07 120.40 121.42 2cqs s VAL 285 Ca 0.00 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.99 2cqs s VAL 285 Cb 0.00 -2.22 -0.10 0.00 0.00 0.00 0.00 36.38 34.07 2cqs s VAL 285 CO 0.00 0.52 1.23 0.68 0.00 0.00 0.00 175.10 177.53 2cqs s VAL 286 N 0.57 2.98 -0.31 2.92 -7.23 -1.26 -0.27 120.40 117.81 2cqs s VAL 286 Ca -0.08 0.96 -0.29 0.00 -1.81 0.00 0.00 61.98 60.76 2cqs s VAL 286 Cb -0.16 -3.60 -0.00 0.00 0.56 0.00 0.00 36.38 33.18 2cqs s VAL 286 CO 0.03 0.21 1.42 0.21 -0.31 0.00 0.00 175.10 176.66 2cqs s ASN 287 N -0.70 6.50 0.00 4.85 2.47 -0.52 -4.32 114.94 123.22 2cqs s ASN 287 Ca 0.49 1.22 0.21 0.00 0.42 0.00 0.00 52.86 55.20 2cqs s ASN 287 Cb -0.36 -2.54 0.63 0.00 -1.45 0.00 0.00 41.25 37.53 2cqs s ASN 287 CO 0.47 -1.23 1.49 0.29 -3.72 0.00 0.00 177.10 174.40 2cqs n LYS 288 N 7.61 1.95 -0.24 0.43 5.02 -1.26 -4.61 118.16 127.05 2cqs n LYS 288 Ca 0.16 -1.43 -0.11 0.00 -2.02 0.00 0.00 58.31 54.92 2cqs n LYS 288 Cb 0.47 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 33.98 2cqs n LYS 288 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cqs h ALA 289 N 4.14 -0.55 0.00 7.82 0.00 -1.97 0.14 119.26 128.84 2cqs h ALA 289 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2cqs h ALA 289 Cb 0.62 1.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.55 2cqs h ALA 289 CO 0.00 -0.95 -0.05 -1.00 0.00 0.00 0.00 179.25 177.25 2cqs h PRO 290 N -0.23 0.00 -0.15 0.00 0.13 -1.91 -1.06 132.00 128.79 2cqs h PRO 290 Ca 0.14 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.10 2cqs h PRO 290 Cb 0.54 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.68 2cqs h PRO 290 CO -0.73 0.05 -0.58 0.00 -0.23 0.00 0.00 178.00 176.51 2cqs h ALA 291 N 1.95 0.27 -0.44 -0.56 0.00 -1.38 -1.65 119.26 117.45 2cqs h ALA 291 Ca -0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 2cqs h ALA 291 Cb 0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2cqs h ALA 291 CO 0.01 0.50 0.02 0.45 0.00 0.00 0.00 179.25 180.23 2cqs h HIS 292 N 0.32 0.73 -0.22 0.00 3.86 -0.33 -0.80 115.15 118.72 2cqs h HIS 292 Ca -0.03 -0.09 -0.04 0.00 -1.16 0.00 0.00 60.37 59.05 2cqs h HIS 292 Cb 1.21 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.46 2cqs h HIS 292 CO 0.10 0.68 -0.02 0.00 0.86 0.00 0.00 177.93 179.55 2cqs h ALA 293 N 1.36 0.30 0.18 2.45 0.00 -1.14 -1.70 119.26 120.70 2cqs h ALA 293 Ca 0.14 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2cqs h ALA 293 Cb 0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2cqs h ALA 293 CO 0.01 0.05 -0.13 1.25 0.00 0.00 0.00 179.25 180.42 2cqs h LEU 294 N 0.15 -0.35 -2.00 0.00 5.85 -1.02 -1.93 115.31 116.01 2cqs h LEU 294 Ca 0.06 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.83 2cqs h LEU 294 Cb 0.45 0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 2cqs h LEU 294 CO 0.02 -0.21 0.05 -0.07 -0.34 0.00 0.00 178.44 177.88 2cqs h LEU 295 N -0.32 0.00 -0.86 2.25 3.38 -1.15 -1.09 115.31 117.53 2cqs h LEU 295 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2cqs h LEU 295 Cb 0.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2cqs h LEU 295 CO -0.01 0.00 -0.54 1.23 0.09 0.00 0.00 178.44 179.21 2cqs h GLY 296 N 0.00 0.00 1.84 0.83 0.00 -0.60 -2.61 103.07 102.52 2cqs h GLY 296 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2cqs h GLY 296 CO -0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.08 2cqs n ARG 297 N -3.78 0.14 -2.72 4.80 1.74 -0.42 -3.50 116.66 112.93 2cqs n ARG 297 Ca -0.01 0.06 -0.05 0.00 -0.77 0.00 0.00 57.85 57.08 2cqs n ARG 297 Cb 0.57 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.55 2cqs n ARG 297 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2cqs n PHE 298 N -1.42 1.44 0.66 -1.55 3.72 -1.07 -4.76 117.46 114.48 2cqs n PHE 298 Ca 0.09 -2.30 0.12 0.00 -0.05 0.00 0.00 57.45 55.31 2cqs n PHE 298 Cb 0.26 -0.27 0.27 0.00 -0.94 0.00 0.00 39.48 38.80 2cqs n PHE 298 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2cqs n ALA 299 N -0.50 2.80 -2.42 4.37 0.00 -1.01 -4.80 120.51 118.95 2cqs n ALA 299 Ca 0.12 -0.19 -0.16 0.00 0.00 0.00 0.00 53.44 53.20 2cqs n ALA 299 Cb 0.82 -1.26 -0.11 0.00 0.00 0.00 0.00 19.45 18.90 2cqs n ALA 299 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2cqs s THR 300 N -3.12 1.22 0.36 0.00 -4.23 -1.26 -4.87 115.64 103.74 2cqs s THR 300 Ca 0.08 -1.82 0.08 0.00 -1.18 0.00 0.00 61.69 58.85 2cqs s THR 300 Cb 0.14 -1.61 0.13 0.00 1.34 0.00 0.00 72.50 72.50 2cqs s THR 300 CO 0.68 -0.55 1.85 0.28 -0.54 0.00 0.00 174.62 176.34 2cqs h SER 301 N 3.27 0.24 -0.83 3.99 0.02 -1.98 -2.41 113.55 115.85 2cqs h SER 301 Ca -0.38 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2cqs h SER 301 Cb 1.19 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 2cqs h SER 301 CO 0.55 0.46 0.51 -0.33 -1.14 0.00 0.00 176.83 176.88 2cqs h GLU 302 N 0.23 1.13 -0.57 3.45 3.07 -1.99 0.10 114.58 120.00 2cqs h GLU 302 Ca 0.04 -0.10 -0.08 0.00 -0.50 0.00 0.00 59.36 58.73 2cqs h GLU 302 Cb 0.49 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 2cqs h GLU 302 CO 0.03 0.79 0.04 1.96 -1.40 0.00 0.00 179.01 180.43 2cqs h GLN 303 N 1.14 0.95 0.03 2.33 4.20 -1.77 -1.37 115.11 120.62 2cqs h GLN 303 Ca 0.30 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 2cqs h GLN 303 Cb -0.06 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.61 2cqs h GLN 303 CO -0.06 0.91 -0.02 0.28 -0.67 0.00 0.00 178.83 179.28 2cqs h VAL 304 N 0.88 1.10 -0.90 -0.54 2.07 -0.95 -2.26 116.25 115.65 2cqs h VAL 304 Ca 0.17 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.32 2cqs h VAL 304 Cb 0.46 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 2cqs h VAL 304 CO 0.02 0.10 0.59 0.44 0.02 0.00 0.00 177.57 178.74 2cqs h ASP 305 N -0.22 0.96 -0.69 0.57 3.32 -0.67 -0.41 116.42 119.27 2cqs h ASP 305 Ca -0.00 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 2cqs h ASP 305 Cb 0.21 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2cqs h ASP 305 CO 0.01 0.65 0.24 0.00 -1.72 0.00 0.00 179.24 178.41 2cqs h ALA 306 N 1.48 0.90 -0.49 3.45 0.00 -1.13 -0.32 119.26 123.16 2cqs h ALA 306 Ca 0.37 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 2cqs h ALA 306 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2cqs h ALA 306 CO -0.12 0.56 -0.20 0.00 0.00 0.00 0.00 179.25 179.49 2cqs h ALA 307 N 1.11 0.68 -0.71 0.00 0.00 -0.73 -1.24 119.26 118.38 2cqs h ALA 307 Ca 0.23 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2cqs h ALA 307 Cb 0.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2cqs h ALA 307 CO -0.01 0.66 0.17 1.25 0.00 0.00 0.00 179.25 181.31 2cqs h LEU 308 N 0.85 1.08 -0.69 0.00 5.85 -0.86 -0.57 115.31 120.98 2cqs h LEU 308 Ca 0.11 -0.24 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 2cqs h LEU 308 Cb 0.77 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2cqs h LEU 308 CO 0.06 1.03 0.17 -0.08 -0.34 0.00 0.00 178.44 179.29 2cqs h GLU 309 N 1.07 1.09 -0.66 1.25 4.57 -0.85 -0.08 114.58 120.98 2cqs h GLU 309 Ca 0.22 -0.26 -0.06 0.00 -1.18 0.00 0.00 59.36 58.09 2cqs h GLU 309 Cb 0.38 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 2cqs h GLU 309 CO 0.00 0.97 0.19 0.00 -1.18 0.00 0.00 179.01 178.99 2cqs h ALA 310 N 1.08 1.09 -0.49 2.92 0.00 -0.84 -0.58 119.26 122.44 2cqs h ALA 310 Ca 0.22 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2cqs h ALA 310 Cb 0.36 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2cqs h ALA 310 CO 0.00 0.61 0.14 1.25 0.00 0.00 0.00 179.25 181.25 2cqs h LEU 311 N 0.97 0.73 -0.78 0.00 5.85 -0.61 0.13 115.31 121.61 2cqs h LEU 311 Ca 0.21 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2cqs h LEU 311 Cb 0.30 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2cqs h LEU 311 CO -0.00 0.76 0.40 -1.13 -0.34 0.00 0.00 178.44 178.13 2cqs h ASN 312 N 0.67 1.00 -0.08 1.25 -0.73 -0.51 -1.51 115.58 115.66 2cqs h ASN 312 Ca 0.16 -0.12 -0.09 0.00 1.87 0.00 0.00 56.30 58.12 2cqs h ASN 312 Cb 0.30 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.62 2cqs h ASN 312 CO -0.00 0.83 -0.22 0.28 -0.37 0.00 0.00 177.43 177.94 2cqs h SER 313 N 1.09 0.49 -0.25 1.15 0.02 -0.80 -0.98 113.55 114.27 2cqs h SER 313 Ca 0.27 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2cqs h SER 313 Cb 0.08 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 2cqs h SER 313 CO -0.04 0.72 0.16 0.22 -1.14 0.00 0.00 176.83 176.75 2cqs h TYR 314 N 0.44 0.32 -0.20 3.45 3.20 -0.34 -1.25 116.97 122.60 2cqs h TYR 314 Ca 0.07 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.79 2cqs h TYR 314 Cb 0.64 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2cqs h TYR 314 CO 0.02 0.22 -0.51 -1.49 -1.64 0.00 0.00 178.16 174.76 2cqs h TRP 315 N 0.33 0.69 -0.61 -3.82 4.06 -0.99 -1.57 115.95 114.03 2cqs h TRP 315 Ca 0.09 -0.23 -0.00 0.00 2.06 0.00 0.00 58.89 60.80 2cqs h TRP 315 Cb -0.02 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 27.98 2cqs h TRP 315 CO -0.05 0.95 0.36 1.15 -3.56 0.00 0.00 178.44 177.29 2cqs h THR 316 N 0.43 1.18 -0.29 1.49 2.02 -1.00 -0.36 112.91 116.39 2cqs h THR 316 Ca 0.02 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 2cqs h THR 316 Cb 1.04 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2cqs h THR 316 CO 0.10 0.19 0.14 -1.13 0.37 0.00 0.00 175.52 175.18 2cqs h ASN 317 N 0.82 0.38 -0.88 4.18 -1.24 -1.06 -2.37 115.58 115.41 2cqs h ASN 317 Ca 0.22 -0.13 -0.01 0.00 0.71 0.00 0.00 56.30 57.09 2cqs h ASN 317 Cb -0.01 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 38.90 2cqs h ASN 317 CO -0.04 0.40 0.51 -0.07 -1.29 0.00 0.00 177.43 176.93 2cqs h LEU 318 N 0.33 1.08 -0.32 0.34 3.38 -0.93 -2.40 115.31 116.79 2cqs h LEU 318 Ca 0.10 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2cqs h LEU 318 Cb 0.12 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2cqs h LEU 318 CO -0.01 0.85 0.00 0.18 0.09 0.00 0.00 178.44 179.55 2cqs n LEU 319 N -4.38 0.48 0.00 1.67 4.77 -0.18 -3.63 117.00 115.74 2cqs n LEU 319 Ca 0.09 -0.22 0.13 0.00 -0.03 0.00 0.00 56.01 55.98 2cqs n LEU 319 Cb 0.08 -0.04 0.35 0.00 -2.33 0.00 0.00 43.42 41.47 2cqs n LEU 319 CO 0.38 0.11 0.59 -1.54 -1.33 0.00 0.00 177.39 175.60 2cqs n SER 320 N -0.37 0.38 0.00 -1.43 3.41 -0.90 -4.11 113.62 110.59 2cqs n SER 320 Ca 0.10 -0.02 -0.18 0.00 -0.26 0.00 0.00 58.87 58.50 2cqs n SER 320 Cb 0.11 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.00 2cqs n SER 320 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2cqs h THR 321 N 0.00 1.35 -3.29 6.66 2.02 -1.73 -3.42 112.91 114.49 2cqs h THR 321 Ca 0.00 -2.05 -0.43 0.00 0.77 0.00 0.00 66.41 64.70 2cqs h THR 321 Cb 0.51 2.35 -0.37 0.00 -1.74 0.00 0.00 68.15 68.90 2cqs h THR 321 CO 0.00 0.62 -0.77 -0.47 0.37 0.00 0.00 175.52 175.28 2cqs s TYR 322 N -3.43 0.65 0.05 3.16 5.04 -1.26 -0.90 117.35 120.67 2cqs s TYR 322 Ca -0.12 -0.16 -0.13 0.00 -2.44 0.00 0.00 57.07 54.22 2cqs s TYR 322 Cb 0.06 -0.76 0.02 0.00 0.35 0.00 0.00 41.96 41.63 2cqs s TYR 322 CO 0.87 -0.30 0.29 -1.54 -1.34 0.00 0.00 175.55 173.53 2cqs s SER 323 N 1.78 -0.10 0.04 4.32 1.04 -0.93 -4.76 113.70 115.08 2cqs s SER 323 Ca 0.02 -0.25 0.01 0.00 0.48 0.00 0.00 55.95 56.22 2cqs s SER 323 Cb -0.13 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 2cqs s SER 323 CO -0.04 -0.63 -0.06 0.54 0.98 0.00 0.00 173.24 174.03 2cqs s VAL 324 N -2.73 0.36 -0.18 5.02 0.11 -1.26 -1.25 120.40 120.47 2cqs s VAL 324 Ca -0.04 -1.11 -0.02 0.00 -2.93 0.00 0.00 61.98 57.89 2cqs s VAL 324 Cb -0.00 -0.59 0.05 0.00 -1.53 0.00 0.00 36.38 34.31 2cqs s VAL 324 CO -0.04 -0.50 0.01 -0.55 -3.33 0.00 0.00 175.10 170.69 2cqs s SER 325 N -1.70 2.86 0.00 3.54 0.15 -0.04 -4.87 113.70 113.65 2cqs s SER 325 Ca -0.10 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.79 2cqs s SER 325 Cb -0.08 -0.70 0.00 0.00 -1.71 0.00 0.00 66.02 63.53 2cqs s SER 325 CO -0.01 -0.27 0.00 -1.54 1.20 0.00 0.00 173.24 172.62 2cqs n SER 326 N 4.99 0.45 -0.87 5.45 3.41 -1.26 -0.87 113.62 124.91 2cqs n SER 326 Ca -0.10 -0.63 0.10 0.00 -0.26 0.00 0.00 58.87 57.99 2cqs n SER 326 Cb 0.47 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.70 2cqs n SER 326 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2cqs n THR 327 N 0.00 0.43 -3.96 6.66 -2.24 -1.25 -4.74 114.28 109.18 2cqs n THR 327 Ca 0.00 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.88 2cqs n THR 327 Cb 0.00 0.59 -0.14 0.00 -2.10 0.00 0.00 70.33 68.68 2cqs n THR 327 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2cqs s ASP 328 N -1.40 4.86 0.52 3.42 -1.08 -1.26 -4.98 116.67 116.74 2cqs s ASP 328 Ca 0.35 -2.00 0.33 0.00 -0.52 0.00 0.00 52.55 50.71 2cqs s ASP 328 Cb 0.19 -1.67 1.40 0.00 -1.46 0.00 0.00 42.92 41.38 2cqs s ASP 328 CO 0.27 -0.39 1.98 1.05 0.52 0.00 0.00 175.17 178.60 2cqs h GLU 329 N 7.75 0.00 0.10 4.34 9.09 -1.99 -1.49 114.58 132.38 2cqs h GLU 329 Ca -0.09 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.07 2cqs h GLU 329 Cb 1.03 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 28.16 2cqs h GLU 329 CO 0.56 0.00 -1.03 0.87 0.05 0.00 0.00 179.01 179.46 2cqs h LYS 330 N 0.00 0.53 0.37 1.06 1.57 -1.93 -2.25 116.57 115.91 2cqs h LYS 330 Ca 0.00 -0.70 -0.02 0.00 -1.87 0.00 0.00 60.65 58.07 2cqs h LYS 330 Cb 0.44 0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2cqs h LYS 330 CO 0.00 1.30 -0.18 1.25 -0.57 0.00 0.00 179.45 181.25 2cqs h LEU 331 N 0.08 -0.42 -0.58 2.94 5.85 -1.89 -2.36 115.31 118.94 2cqs h LEU 331 Ca -0.16 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.61 2cqs h LEU 331 Cb 1.74 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.81 2cqs h LEU 331 CO 0.20 -0.24 0.23 0.44 -0.34 0.00 0.00 178.44 178.74 2cqs h ASP 332 N -0.58 0.26 -0.52 1.25 5.19 -1.36 -0.45 116.42 120.22 2cqs h ASP 332 Ca -0.05 0.06 0.06 0.00 -0.62 0.00 0.00 57.03 56.48 2cqs h ASP 332 Cb 0.43 0.03 -0.05 0.00 0.18 0.00 0.00 39.33 39.91 2cqs h ASP 332 CO 0.08 0.17 0.22 -0.09 -3.12 0.00 0.00 179.24 176.51 2cqs h ARG 333 N 0.43 0.42 -0.11 3.56 2.43 -1.35 0.45 114.38 120.22 2cqs h ARG 333 Ca 0.28 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.39 2cqs h ARG 333 Cb 0.30 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2cqs h ARG 333 CO -0.26 0.28 -0.08 0.52 -1.51 0.00 0.00 179.97 178.92 2cqs h MET 334 N 0.43 0.24 -0.42 0.20 2.86 -0.84 -2.06 114.93 115.34 2cqs h MET 334 Ca 0.24 -0.12 -0.12 0.00 -2.06 0.00 0.00 59.70 57.65 2cqs h MET 334 Cb 0.22 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2cqs h MET 334 CO -0.21 0.62 -0.20 0.28 1.06 0.00 0.00 176.91 178.46 2cqs h VAL 335 N -0.14 1.28 0.00 -2.22 2.07 -0.89 0.68 116.25 117.03 2cqs h VAL 335 Ca 0.02 -1.35 -0.19 0.00 0.82 0.00 0.00 66.70 66.00 2cqs h VAL 335 Cb 0.56 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2cqs h VAL 335 CO 0.02 0.46 -0.94 0.78 0.02 0.00 0.00 177.57 177.91 2cqs h ASN 336 N 0.70 0.00 0.00 0.57 2.35 -0.19 -3.42 115.58 115.60 2cqs h ASN 336 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2cqs h ASN 336 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 2cqs h ASN 336 CO 0.06 0.90 0.00 -0.38 -1.65 0.00 0.00 177.43 176.37 2cqs n ILE 337 N -3.31 0.00 -0.33 2.81 5.41 -0.79 -4.89 119.36 118.25 2cqs n ILE 337 Ca -0.00 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.78 2cqs n ILE 337 Cb 0.91 -0.43 0.18 0.00 -0.71 0.00 0.00 39.64 39.59 2cqs n ILE 337 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2cqs h TRP 338 N 0.00 1.03 -0.37 1.39 4.06 -1.57 -0.24 115.95 120.24 2cqs h TRP 338 Ca 0.00 0.03 -0.14 0.00 2.06 0.00 0.00 58.89 60.84 2cqs h TRP 338 Cb 0.00 -0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 27.82 2cqs h TRP 338 CO 0.00 0.47 -0.34 -0.97 -3.56 0.00 0.00 178.44 174.04 2cqs h ASN 339 N 0.96 0.90 -0.10 -3.49 -0.73 -1.11 -1.15 115.58 110.85 2cqs h ASN 339 Ca 0.42 -0.39 -0.16 0.00 1.87 0.00 0.00 56.30 58.05 2cqs h ASN 339 Cb 0.31 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 2cqs h ASN 339 CO -0.22 1.15 -0.50 1.56 -0.37 0.00 0.00 177.43 179.05 2cqs h GLN 340 N 0.71 0.68 -0.28 6.67 4.20 -1.66 -1.37 115.11 124.06 2cqs h GLN 340 Ca 0.07 -0.40 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 2cqs h GLN 340 Cb 0.90 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 2cqs h GLN 340 CO 0.08 1.02 0.14 -0.92 -0.67 0.00 0.00 178.83 178.48 2cqs h TYR 341 N 0.53 0.40 -0.32 2.96 -0.00 -0.93 -2.46 116.97 117.15 2cqs h TYR 341 Ca 0.02 -0.02 -0.04 0.00 -0.00 0.00 0.00 58.73 58.70 2cqs h TYR 341 Cb 1.06 -0.12 -0.02 0.00 -0.00 0.00 0.00 36.73 37.65 2cqs h TYR 341 CO 0.05 0.35 0.03 0.37 -0.00 0.00 0.00 178.16 178.97 2cqs h GLN 342 N 0.33 0.47 0.00 1.82 4.15 -1.06 -2.16 115.11 118.66 2cqs h GLN 342 Ca 0.10 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 2cqs h GLN 342 Cb 0.10 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 2cqs h GLN 342 CO -0.01 0.48 -0.32 0.00 -1.93 0.00 0.00 178.83 177.04 2cqs h MET 344 N 0.00 0.75 -0.32 0.00 1.85 -1.00 -1.43 114.93 114.78 2cqs h MET 344 Ca -0.00 -0.41 -0.01 0.00 -0.61 0.00 0.00 59.70 58.67 2cqs h MET 344 Cb 0.59 0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.63 2cqs h MET 344 CO 0.04 1.03 0.14 0.28 -0.40 0.00 0.00 176.91 178.01 2cqs h VAL 345 N 0.50 1.16 -0.24 -5.77 2.07 -1.03 -1.75 116.25 111.20 2cqs h VAL 345 Ca 0.04 -0.48 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 2cqs h VAL 345 Cb 0.91 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 2cqs h VAL 345 CO 0.08 0.17 -0.23 0.71 0.02 0.00 0.00 177.57 178.32 2cqs h THR 346 N 0.37 1.26 -0.61 2.57 1.35 -1.05 0.19 112.91 116.99 2cqs h THR 346 Ca 0.11 -1.21 0.01 0.00 -0.55 0.00 0.00 66.41 64.77 2cqs h THR 346 Cb 0.14 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 67.86 2cqs h THR 346 CO -0.01 0.38 0.39 0.15 -0.25 0.00 0.00 175.52 176.18 2cqs h PHE 347 N 0.40 0.74 0.07 4.73 3.57 -0.94 0.28 116.94 125.79 2cqs h PHE 347 Ca 0.06 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.33 2cqs h PHE 347 Cb 0.63 -0.25 0.02 0.00 2.79 0.00 0.00 35.95 39.14 2cqs h PHE 347 CO 0.02 0.45 -1.02 -0.91 -2.23 0.00 0.00 178.31 174.62 2cqs h ASN 348 N 0.79 0.78 0.70 0.41 2.35 -0.90 -3.38 115.58 116.34 2cqs h ASN 348 Ca 0.23 -0.80 -0.00 0.00 -0.55 0.00 0.00 56.30 55.17 2cqs h ASN 348 Cb -0.06 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 2cqs h ASN 348 CO -0.06 1.50 -1.30 0.23 -1.65 0.00 0.00 177.43 176.14 2cqs n MET 349 N -3.93 0.62 0.00 0.81 2.81 0.63 -5.03 117.12 113.03 2cqs n MET 349 Ca -0.12 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 2cqs n MET 349 Cb 0.88 -1.74 0.00 0.00 -0.71 0.00 0.00 33.22 31.65 2cqs n MET 349 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2cqs n SER 350 N -2.56 0.00 -0.81 7.83 2.88 0.98 -1.15 113.62 120.79 2cqs n SER 350 Ca -0.01 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.58 2cqs n SER 350 Cb 0.56 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.13 2cqs n SER 350 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2cqs n ARG 351 N 10.88 0.77 0.04 -1.46 5.12 -1.26 -4.56 116.66 126.19 2cqs n ARG 351 Ca 0.00 -2.42 -0.08 0.00 -1.93 0.00 0.00 57.85 53.42 2cqs n ARG 351 Cb 0.00 -0.89 -0.06 0.00 -1.16 0.00 0.00 32.46 30.36 2cqs n ARG 351 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2cqs h SER 352 N 0.71 -0.17 -3.37 0.55 4.64 -1.26 -3.46 113.55 111.18 2cqs h SER 352 Ca -0.08 -0.28 -0.40 0.00 -0.47 0.00 0.00 61.79 60.56 2cqs h SER 352 Cb 1.37 0.04 -0.36 0.00 -0.31 0.00 0.00 62.40 63.14 2cqs h SER 352 CO 0.03 0.41 -0.76 0.00 -0.87 0.00 0.00 176.83 175.64 2cqs s ALA 353 N -3.26 0.54 0.00 5.18 0.00 -1.26 -0.46 121.76 122.50 2cqs s ALA 353 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2cqs s ALA 353 Cb -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.57 2cqs s ALA 353 CO 0.34 -0.27 0.00 -1.13 0.00 0.00 0.00 175.76 174.70 2cqs n SER 354 N 4.68 0.00 -0.74 0.00 3.41 -0.23 -4.92 113.62 115.81 2cqs n SER 354 Ca -0.15 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.53 2cqs n SER 354 Cb 0.50 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.68 2cqs n SER 354 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2cqs n PHE 355 N 0.00 0.49 0.01 7.33 3.01 -1.26 -4.15 117.46 122.88 2cqs n PHE 355 Ca 0.00 -0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.22 2cqs n PHE 355 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 2cqs n PHE 355 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2cqs n PHE 356 N 0.67 -0.05 -2.59 1.38 3.72 -1.26 -4.97 117.46 114.35 2cqs n PHE 356 Ca 0.15 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 57.13 2cqs n PHE 356 Cb 0.36 0.11 -0.03 0.00 -0.94 0.00 0.00 39.48 38.98 2cqs n PHE 356 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2cqs s GLU 357 N -2.00 4.43 0.00 -1.08 0.41 -1.26 -4.94 118.70 114.26 2cqs s GLU 357 Ca 0.00 1.53 0.29 0.00 -0.41 0.00 0.00 54.97 56.38 2cqs s GLU 357 Cb 0.00 -3.51 1.75 0.00 -1.78 0.00 0.00 34.13 30.59 2cqs s GLU 357 CO 0.00 -0.30 2.12 0.25 -0.49 0.00 0.00 175.26 176.84 2cqs n THR 358 N 4.38 0.00 -2.62 3.63 -2.24 -1.25 -1.07 114.28 115.11 2cqs n THR 358 Ca 0.09 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.71 2cqs n THR 358 Cb 0.48 -0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.25 2cqs n THR 358 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cqs n GLY 359 N 0.94 -0.23 1.07 3.38 0.00 0.40 -4.91 105.19 105.84 2cqs n GLY 359 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2cqs n GLY 359 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2cqs n ILE 360 N -4.12 0.00 0.17 -0.61 5.41 -1.26 -2.28 119.36 116.66 2cqs n ILE 360 Ca -0.12 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.66 2cqs n ILE 360 Cb 0.61 -0.71 0.25 0.00 -0.71 0.00 0.00 39.64 39.07 2cqs n ILE 360 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2cqs h GLY 361 N 0.00 0.00 -6.11 7.39 0.00 -1.91 -3.45 103.07 98.98 2cqs h GLY 361 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.71 2cqs h GLY 361 CO 0.00 0.00 -0.51 0.50 0.00 0.00 0.00 176.54 176.53 2cqs s ARG 362 N -3.52 4.00 0.00 4.80 0.52 -1.26 -4.73 118.95 118.75 2cqs s ARG 362 Ca 0.00 -0.24 0.00 0.00 -0.52 0.00 0.00 55.73 54.97 2cqs s ARG 362 Cb 0.11 -3.33 0.00 0.00 0.52 0.00 0.00 34.95 32.25 2cqs s ARG 362 CO 0.72 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.83 2cqs n GLY 363 N 3.25 0.91 3.31 -3.53 0.00 -1.26 -4.38 105.19 103.48 2cqs n GLY 363 Ca -0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 2cqs n GLY 363 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2cqs s MET 364 N 3.02 2.72 0.31 1.61 -1.94 -0.05 -3.98 119.30 120.99 2cqs s MET 364 Ca 0.00 -1.12 -0.29 0.00 -1.71 0.00 0.00 55.69 52.57 2cqs s MET 364 Cb 0.00 -3.52 -0.10 0.00 2.01 0.00 0.00 34.83 33.22 2cqs s MET 364 CO 0.00 -0.65 1.21 0.20 -0.01 0.00 0.00 175.02 175.77 2cqs s GLY 365 N 1.45 3.02 0.04 -0.03 0.00 -1.26 -1.22 107.32 109.32 2cqs s GLY 365 Ca -0.00 1.09 -0.24 0.00 0.00 0.00 0.00 44.72 45.57 2cqs s GLY 365 CO 0.04 1.71 1.52 -2.75 0.00 0.00 0.00 173.10 173.62 2cqs h PHE 366 N 3.51 0.02 0.20 1.90 3.57 -1.07 0.10 116.94 125.16 2cqs h PHE 366 Ca -0.48 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.01 2cqs h PHE 366 Cb 1.22 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.96 2cqs h PHE 366 CO 0.57 0.24 -0.09 -0.09 -2.23 0.00 0.00 178.31 176.71 2cqs h ARG 367 N -0.21 -0.25 -0.30 1.11 2.43 -1.88 -2.81 114.38 112.47 2cqs h ARG 367 Ca 0.00 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.25 2cqs h ARG 367 Cb 0.23 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.78 2cqs h ARG 367 CO 0.00 0.09 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.04 2cqs h ASP 368 N -0.63 -0.27 0.09 -3.80 3.32 -1.90 -1.55 116.42 111.67 2cqs h ASP 368 Ca -0.03 0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 2cqs h ASP 368 Cb 0.46 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 2cqs h ASP 368 CO 0.04 -0.10 -0.44 0.28 -1.72 0.00 0.00 179.24 177.30 2cqs h SER 369 N 0.00 0.46 -0.58 6.45 0.02 -0.89 -0.75 113.55 118.26 2cqs h SER 369 Ca 0.14 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 2cqs h SER 369 Cb 0.22 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2cqs h SER 369 CO -0.31 0.84 0.14 0.78 -1.14 0.00 0.00 176.83 177.15 2cqs h ASN 370 N 0.35 0.88 0.15 3.07 2.35 -1.21 -2.27 115.58 118.89 2cqs h ASN 370 Ca 0.02 -0.23 -0.16 0.00 -0.55 0.00 0.00 56.30 55.38 2cqs h ASN 370 Cb 0.92 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 2cqs h ASN 370 CO 0.08 0.89 -0.60 1.56 -1.65 0.00 0.00 177.43 177.71 2cqs h GLN 371 N 0.83 0.45 0.00 0.81 4.20 -1.16 -2.86 115.11 117.39 2cqs h GLN 371 Ca 0.18 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 2cqs h GLN 371 Cb 0.35 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 2cqs h GLN 371 CO 0.00 0.92 -0.14 -0.44 -0.67 0.00 0.00 178.83 178.50 2cqs h ASP 372 N 0.34 0.00 -0.43 1.46 3.32 -0.94 -1.46 116.42 118.72 2cqs h ASP 372 Ca -0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.06 2cqs h ASP 372 Cb 1.14 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 2cqs h ASP 372 CO 0.11 0.14 0.28 -0.07 -1.72 0.00 0.00 179.24 177.98 2cqs h LEU 373 N 0.00 0.45 -1.43 1.55 3.38 -1.17 -2.12 115.31 115.98 2cqs h LEU 373 Ca -0.00 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.09 2cqs h LEU 373 Cb 0.26 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 2cqs h LEU 373 CO 0.02 0.32 0.52 -0.07 0.09 0.00 0.00 178.44 179.32 2cqs h LEU 374 N 0.53 0.55 -2.66 1.67 3.38 -1.33 -0.10 115.31 117.35 2cqs h LEU 374 Ca 0.16 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2cqs h LEU 374 Cb 0.01 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2cqs h LEU 374 CO -0.04 0.30 0.00 0.61 0.09 0.00 0.00 178.44 179.40 2cqs n GLY 375 N -1.47 2.33 0.00 0.83 0.00 -0.83 -4.51 105.19 101.54 2cqs n GLY 375 Ca 0.14 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2cqs n GLY 375 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2cqs n PHE 376 N 1.20 0.00 -0.27 1.61 7.35 -0.36 -4.79 117.46 122.20 2cqs n PHE 376 Ca 0.19 0.00 0.21 0.00 -0.76 0.00 0.00 57.45 57.08 2cqs n PHE 376 Cb 0.54 -0.06 0.52 0.00 0.35 0.00 0.00 39.48 40.83 2cqs n PHE 376 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 2cqs h VAL 377 N 0.00 0.63 0.00 -2.13 -1.51 -1.31 -0.18 116.25 111.75 2cqs h VAL 377 Ca -0.01 -0.13 -0.05 0.00 -1.23 0.00 0.00 66.70 65.27 2cqs h VAL 377 Cb 0.36 0.20 -0.01 0.00 -2.13 0.00 0.00 31.29 29.71 2cqs h VAL 377 CO 0.00 0.07 -0.24 1.12 -1.23 0.00 0.00 177.57 177.30 2cqs h HIS 378 N 0.39 0.00 0.39 5.19 2.07 -1.86 -3.02 115.15 118.30 2cqs h HIS 378 Ca 0.51 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 58.01 2cqs h HIS 378 Cb 1.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.29 2cqs h HIS 378 CO -0.00 0.24 -0.19 -0.07 -3.07 0.00 0.00 177.93 174.84 2cqs h LEU 379 N 0.00 -0.44 -6.33 6.12 3.38 -1.35 -3.43 115.31 113.27 2cqs h LEU 379 Ca -0.00 0.02 -0.56 0.00 0.09 0.00 0.00 57.88 57.42 2cqs h LEU 379 Cb 0.91 0.11 -0.37 0.00 0.09 0.00 0.00 40.66 41.40 2cqs h LEU 379 CO 0.03 -0.10 -0.93 -0.63 0.09 0.00 0.00 178.44 176.91 2cqs s ILE 380 N -3.30 0.21 0.44 1.22 1.01 -1.21 -4.91 121.20 114.67 2cqs s ILE 380 Ca -0.08 -2.36 0.16 0.00 0.00 0.00 0.00 60.65 58.37 2cqs s ILE 380 Cb 0.01 -1.15 0.35 0.00 0.01 0.00 0.00 42.46 41.68 2cqs s ILE 380 CO 0.23 -1.12 1.96 1.55 0.00 0.00 0.00 174.94 177.56 2cqs h PRO 381 N 5.87 0.35 -0.34 2.79 0.13 -1.79 -1.75 132.00 137.27 2cqs h PRO 381 Ca 0.22 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.28 2cqs h PRO 381 Cb 0.93 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.97 2cqs h PRO 381 CO 0.33 0.23 0.02 0.93 -0.23 0.00 0.00 178.00 179.28 2cqs h GLU 382 N 0.36 0.51 0.00 0.86 3.07 -1.95 0.11 114.58 117.54 2cqs h GLU 382 Ca 0.31 -0.10 -0.18 0.00 -0.50 0.00 0.00 59.36 58.89 2cqs h GLU 382 Cb 0.73 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.53 2cqs h GLU 382 CO -0.09 0.52 -0.93 0.00 -1.40 0.00 0.00 179.01 177.11 2cqs h ARG 383 N 0.49 0.00 -0.10 2.33 3.08 -1.76 -2.93 114.38 115.49 2cqs h ARG 383 Ca 0.11 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.04 2cqs h ARG 383 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2cqs h ARG 383 CO 0.01 0.77 -0.45 0.00 -1.07 0.00 0.00 179.97 179.23 2cqs h ALA 384 N 1.17 1.05 0.00 0.04 0.00 -0.79 -1.62 119.26 119.12 2cqs h ALA 384 Ca -0.04 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2cqs h ALA 384 Cb 1.67 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2cqs h ALA 384 CO 0.10 0.62 -0.00 -0.09 0.00 0.00 0.00 179.25 179.88 2cqs h ARG 385 N 0.20 -0.00 -0.66 0.00 2.43 -0.74 -1.22 114.38 114.39 2cqs h ARG 385 Ca 0.01 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 2cqs h ARG 385 Cb 0.88 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 2cqs h ARG 385 CO 0.07 0.15 0.28 1.49 -1.51 0.00 0.00 179.97 180.45 2cqs h GLU 386 N -0.16 0.97 -0.93 0.20 4.81 -1.39 -2.51 114.58 115.57 2cqs h GLU 386 Ca -0.00 -0.16 0.04 0.00 -0.13 0.00 0.00 59.36 59.10 2cqs h GLU 386 Cb 0.15 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 2cqs h GLU 386 CO 0.00 0.80 0.60 -0.09 -0.73 0.00 0.00 179.01 179.59 2cqs h ARG 387 N 0.92 1.13 -0.28 1.92 9.65 -1.13 0.42 114.38 127.01 2cqs h ARG 387 Ca 0.22 -0.07 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2cqs h ARG 387 Cb 0.17 -0.26 -0.02 0.00 -1.39 0.00 0.00 29.97 28.48 2cqs h ARG 387 CO -0.02 0.75 0.17 0.82 2.80 0.00 0.00 179.97 184.49 2cqs h ILE 388 N 1.16 1.05 -0.67 1.20 2.04 -0.84 0.02 117.51 121.47 2cqs h ILE 388 Ca 0.37 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 66.11 2cqs h ILE 388 Cb 0.01 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2cqs h ILE 388 CO -0.12 0.06 0.43 0.40 0.00 0.00 0.00 178.15 178.92 2cqs h ILE 389 N 0.35 1.18 -0.56 -0.67 1.08 -0.93 0.37 117.51 118.33 2cqs h ILE 389 Ca 0.10 -0.37 -0.03 0.00 -0.39 0.00 0.00 64.86 64.17 2cqs h ILE 389 Cb -0.02 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 33.92 2cqs h ILE 389 CO -0.04 0.18 0.23 0.44 -0.69 0.00 0.00 178.15 178.28 2cqs h ASP 390 N 0.91 0.78 0.31 1.72 3.32 -0.57 -1.92 116.42 120.97 2cqs h ASP 390 Ca 0.24 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 2cqs h ASP 390 Cb -0.07 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.28 2cqs h ASP 390 CO -0.05 0.73 -0.15 0.40 -1.72 0.00 0.00 179.24 178.45 2cqs h ILE 391 N 0.77 0.72 0.00 0.35 2.04 -0.64 -2.98 117.51 117.77 2cqs h ILE 391 Ca 0.19 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 2cqs h ILE 391 Cb 0.19 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.18 2cqs h ILE 391 CO -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 178.15 178.19 2cqs h ALA 392 N 0.02 1.18 0.00 1.87 0.00 -0.90 -1.38 119.26 120.05 2cqs h ALA 392 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2cqs h ALA 392 Cb 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2cqs h ALA 392 CO 0.07 0.01 0.00 0.77 0.00 0.00 0.00 179.25 180.10 2cqs h SER 393 N 0.00 0.00 -0.65 0.00 0.02 -1.18 -2.61 113.55 109.13 2cqs h SER 393 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2cqs h SER 393 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 2cqs h SER 393 CO 0.00 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.04 2cqs n THR 394 N -2.50 0.86 -3.20 -2.27 -2.24 -0.52 -0.93 114.28 103.48 2cqs n THR 394 Ca 0.03 -0.89 -0.33 0.00 -2.27 0.00 0.00 64.05 60.58 2cqs n THR 394 Cb 0.32 0.53 -0.06 0.00 -2.10 0.00 0.00 70.33 69.01 2cqs n THR 394 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2cqs s GLN 395 N -1.14 4.00 0.36 -0.78 0.74 -0.99 -2.70 119.66 119.16 2cqs s GLN 395 Ca 0.45 0.61 -0.03 0.00 0.05 0.00 0.00 55.36 56.45 2cqs s GLN 395 Cb 0.24 -2.59 -0.04 0.00 1.10 0.00 0.00 33.01 31.72 2cqs s GLN 395 CO 0.31 0.25 0.61 -0.06 -0.55 0.00 0.00 175.29 175.86 2cqs s PHE 396 N -1.83 3.51 0.41 1.67 0.08 0.11 -1.52 117.98 120.41 2cqs s PHE 396 Ca 0.50 0.56 0.14 0.00 0.12 0.00 0.00 56.93 58.25 2cqs s PHE 396 Cb -0.12 -2.07 0.99 0.00 -0.57 0.00 0.00 43.02 41.26 2cqs s PHE 396 CO 0.19 0.04 1.91 0.00 -0.10 0.00 0.00 175.22 177.26 2cqs h ALA 397 N 0.94 2.04 0.00 5.36 0.00 -1.93 -1.11 119.26 124.55 2cqs h ALA 397 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2cqs h ALA 397 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2cqs h ALA 397 CO 0.63 -0.24 0.00 -0.40 0.00 0.00 0.00 179.25 179.24 2cqs n ASP 398 N -4.50 0.00 0.00 0.00 5.68 -1.26 -4.89 116.55 111.59 2cqs n ASP 398 Ca 0.15 -1.12 0.00 0.00 -0.50 0.00 0.00 54.79 53.32 2cqs n ASP 398 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 2cqs n ASP 398 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cqs n GLY 399 N 0.87 2.61 3.76 6.12 0.00 -0.42 -4.45 105.19 113.69 2cqs n GLY 399 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2cqs n GLY 399 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqs s SER 400 N 0.05 3.25 0.17 1.61 1.04 -1.26 -4.45 113.70 114.10 2cqs s SER 400 Ca 0.00 0.98 -0.17 0.00 0.48 0.00 0.00 55.95 57.24 2cqs s SER 400 Cb 0.00 -1.56 0.03 0.00 0.10 0.00 0.00 66.02 64.59 2cqs s SER 400 CO 0.00 -2.71 0.46 0.00 0.98 0.00 0.00 173.24 171.97 2cqs s ALA 401 N -3.22 -0.89 0.36 5.32 0.00 -1.26 0.06 121.76 122.13 2cqs s ALA 401 Ca 0.64 -0.18 -0.28 0.00 0.00 0.00 0.00 51.96 52.14 2cqs s ALA 401 Cb -0.15 0.80 -0.11 0.00 0.00 0.00 0.00 23.12 23.66 2cqs s ALA 401 CO 0.54 -0.73 1.47 0.71 0.00 0.00 0.00 175.76 177.75 2cqs s TYR 402 N -3.85 2.68 0.18 0.00 2.02 -1.10 -4.65 117.35 112.64 2cqs s TYR 402 Ca 0.07 1.17 0.28 0.00 -0.37 0.00 0.00 57.07 58.23 2cqs s TYR 402 Cb 0.00 -3.97 1.20 0.00 -0.40 0.00 0.00 41.96 38.79 2cqs s TYR 402 CO -0.06 -2.85 1.93 1.25 -1.57 0.00 0.00 175.55 174.24 2cqs h HIS 403 N 3.25 0.00 -2.77 2.71 -0.00 -1.76 -3.42 115.15 113.17 2cqs h HIS 403 Ca -0.50 0.00 0.07 0.00 -0.00 0.00 0.00 60.37 59.94 2cqs h HIS 403 Cb 1.23 0.00 -0.09 0.00 -0.00 0.00 0.00 27.41 28.55 2cqs h HIS 403 CO 0.54 0.13 0.31 1.14 -0.00 0.00 0.00 177.93 180.05 2cqs s GLN 404 N -3.75 1.38 0.07 5.26 -2.07 -1.26 -0.55 119.66 118.73 2cqs s GLN 404 Ca 0.00 -0.67 0.03 0.00 -1.82 0.00 0.00 55.36 52.90 2cqs s GLN 404 Cb 0.10 0.53 -0.03 0.00 -1.09 0.00 0.00 33.01 32.52 2cqs s GLN 404 CO 0.59 -0.62 -0.09 1.52 -1.32 0.00 0.00 175.29 175.37 2cqs s TYR 405 N -3.63 0.87 -0.06 9.60 -0.85 -0.36 -1.36 117.35 121.57 2cqs s TYR 405 Ca 0.07 -0.60 -0.30 0.00 -0.52 0.00 0.00 57.07 55.72 2cqs s TYR 405 Cb -0.03 -0.50 -0.05 0.00 0.38 0.00 0.00 41.96 41.76 2cqs s TYR 405 CO -0.02 -0.06 1.48 -1.14 -1.52 0.00 0.00 175.55 174.29 2cqs s GLN 406 N -2.28 4.23 0.24 -3.49 2.00 0.06 -0.87 119.66 119.56 2cqs s GLN 406 Ca -0.01 1.99 -0.04 0.00 -2.00 0.00 0.00 55.36 55.30 2cqs s GLN 406 Cb -0.06 -3.78 0.44 0.00 0.80 0.00 0.00 33.01 30.41 2cqs s GLN 406 CO -0.00 -0.72 1.76 -1.35 -0.50 0.00 0.00 175.29 174.47 2cqs h PRO 407 N 8.61 0.53 -0.59 1.67 0.11 -1.90 0.96 132.00 141.40 2cqs h PRO 407 Ca -0.36 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.68 2cqs h PRO 407 Cb 1.16 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2cqs h PRO 407 CO 0.94 0.35 0.20 1.25 -0.21 0.00 0.00 178.00 180.54 2cqs h LEU 408 N 0.55 0.84 0.00 2.35 5.85 -1.92 -3.29 115.31 119.70 2cqs h LEU 408 Ca 0.41 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2cqs h LEU 408 Cb 0.55 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.36 2cqs h LEU 408 CO -0.35 0.81 -1.14 0.35 -0.34 0.00 0.00 178.44 177.78 2cqs n THR 409 N -4.43 0.00 -2.13 1.05 -2.24 -1.08 -4.99 114.28 100.46 2cqs n THR 409 Ca 0.03 -0.19 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 2cqs n THR 409 Cb 0.19 0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 2cqs n THR 409 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2cqs n LYS 410 N -1.63 -1.50 -4.42 -0.78 5.02 0.33 -4.98 118.16 110.20 2cqs n LYS 410 Ca 0.01 1.02 -0.34 0.00 -2.02 0.00 0.00 58.31 56.98 2cqs n LYS 410 Cb 0.33 -5.52 -0.11 0.00 -0.02 0.00 0.00 35.03 29.71 2cqs n LYS 410 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2cqs s ARG 411 N -4.58 3.16 0.73 1.97 0.52 -1.24 -4.83 118.95 114.68 2cqs s ARG 411 Ca 0.00 -0.46 -0.12 0.00 -0.52 0.00 0.00 55.73 54.62 2cqs s ARG 411 Cb 0.00 -2.80 0.04 0.00 0.52 0.00 0.00 34.95 32.71 2cqs s ARG 411 CO 0.00 0.55 1.10 0.20 0.02 0.00 0.00 175.30 177.17 2cqs s GLY 412 N -0.48 1.85 0.16 -3.53 0.00 -1.26 -0.76 107.32 103.30 2cqs s GLY 412 Ca 0.08 0.37 -0.13 0.00 0.00 0.00 0.00 44.72 45.04 2cqs s GLY 412 CO 0.02 0.72 0.39 0.54 0.00 0.00 0.00 173.10 174.77 2cqs s ASN 413 N -3.10 -0.11 -0.22 1.64 2.20 -0.47 -4.83 114.94 110.06 2cqs s ASN 413 Ca 0.63 -0.61 0.15 0.00 -0.94 0.00 0.00 52.86 52.09 2cqs s ASN 413 Cb -0.18 0.49 0.65 0.00 -2.00 0.00 0.00 41.25 40.21 2cqs s ASN 413 CO 0.51 -0.93 1.58 0.59 -2.94 0.00 0.00 177.10 175.90 2cqs n ASN 414 N -0.25 4.60 -0.11 3.54 3.02 -1.26 -4.05 115.26 120.75 2cqs n ASN 414 Ca -0.10 -3.03 0.26 0.00 -0.03 0.00 0.00 54.58 51.67 2cqs n ASN 414 Cb 0.63 -0.62 0.72 0.00 -0.61 0.00 0.00 39.78 39.90 2cqs n ASN 414 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2cqs h ASP 415 N 2.64 0.00 -0.02 6.41 3.45 -1.94 0.07 116.42 127.04 2cqs h ASP 415 Ca 0.03 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.46 2cqs h ASP 415 Cb 1.72 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 40.46 2cqs h ASP 415 CO 0.37 0.00 -0.54 2.30 -1.57 0.00 0.00 179.24 179.80 2cqs n ILE 416 N -4.12 2.09 0.00 0.35 -5.35 -1.26 -4.89 119.36 106.18 2cqs n ILE 416 Ca 0.15 -3.15 0.00 0.00 -0.27 0.00 0.00 62.75 59.49 2cqs n ILE 416 Cb 0.88 -0.19 0.00 0.00 -1.74 0.00 0.00 39.64 38.59 2cqs n ILE 416 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2cqs n GLY 417 N -1.02 0.74 3.70 3.28 0.00 0.01 -4.60 105.19 107.31 2cqs n GLY 417 Ca 0.19 -2.10 -0.08 0.00 0.00 0.00 0.00 46.02 44.02 2cqs n GLY 417 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqs s SER 418 N 0.00 -0.28 0.00 1.61 1.04 -1.26 -4.37 113.70 110.44 2cqs s SER 418 Ca 0.00 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2cqs s SER 418 Cb 0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 2cqs s SER 418 CO 0.00 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.62 2cqs n GLY 419 N -0.42 0.50 3.50 7.32 0.00 -1.26 -4.63 105.19 110.19 2cqs n GLY 419 Ca -0.07 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.68 2cqs n GLY 419 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cqs s PHE 420 N -2.21 2.95 -1.80 1.61 0.08 -1.26 -0.41 117.98 116.94 2cqs s PHE 420 Ca 0.00 -0.17 0.16 0.00 0.12 0.00 0.00 56.93 57.03 2cqs s PHE 420 Cb 0.00 -3.73 0.88 0.00 -0.57 0.00 0.00 43.02 39.60 2cqs s PHE 420 CO 0.00 -1.12 1.38 0.09 -0.10 0.00 0.00 175.22 175.47 2cqs n ASN 421 N 6.75 0.00 0.06 1.36 4.13 -1.14 -2.26 115.26 124.15 2cqs n ASN 421 Ca -0.01 -0.30 0.11 0.00 1.68 0.00 0.00 54.58 56.06 2cqs n ASN 421 Cb 0.47 -0.10 -0.03 0.00 -1.54 0.00 0.00 39.78 38.58 2cqs n ASN 421 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2cqs n ASP 422 N -1.10 0.59 0.08 6.41 5.75 -1.26 -4.45 116.55 122.56 2cqs n ASP 422 Ca 0.10 0.10 -0.12 0.00 -0.01 0.00 0.00 54.79 54.86 2cqs n ASP 422 Cb 0.08 0.88 -0.05 0.00 -1.03 0.00 0.00 41.12 40.99 2cqs n ASP 422 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2cqs h ASP 423 N 0.00 -0.96 -0.73 -1.12 3.32 -1.81 -3.10 116.42 112.02 2cqs h ASP 423 Ca 0.00 0.12 0.16 0.00 0.02 0.00 0.00 57.03 57.33 2cqs h ASP 423 Cb 0.91 0.38 -0.13 0.00 0.22 0.00 0.00 39.33 40.72 2cqs h ASP 423 CO 0.00 -0.39 -0.01 -0.65 -1.72 0.00 0.00 179.24 176.47 2cqs h PRO 424 N -0.50 0.09 -0.23 3.56 0.11 -1.78 -1.62 132.00 131.63 2cqs h PRO 424 Ca 0.05 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.12 2cqs h PRO 424 Cb 0.57 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2cqs h PRO 424 CO -0.24 0.06 -0.03 -0.07 -0.21 0.00 0.00 178.00 177.50 2cqs h LEU 425 N 0.10 0.32 -2.43 2.35 3.38 -1.82 -2.65 115.31 114.56 2cqs h LEU 425 Ca 0.39 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.33 2cqs h LEU 425 Cb 0.68 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2cqs h LEU 425 CO -0.65 0.41 0.07 -0.50 0.09 0.00 0.00 178.44 177.85 2cqs h TRP 426 N 0.34 0.00 -0.53 1.13 -0.00 -1.29 -1.18 115.95 114.41 2cqs h TRP 426 Ca 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 58.89 58.89 2cqs h TRP 426 Cb 0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.43 2cqs h TRP 426 CO 0.01 0.00 0.05 1.25 -0.00 0.00 0.00 178.44 179.75 2cqs h LEU 427 N 0.00 0.88 -0.63 -4.49 5.85 -1.54 -1.47 115.31 113.91 2cqs h LEU 427 Ca 0.02 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 2cqs h LEU 427 Cb 0.16 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 2cqs h LEU 427 CO -0.00 0.94 0.21 0.40 -0.34 0.00 0.00 178.44 179.65 2cqs h ILE 428 N 0.79 1.24 -0.39 4.05 2.04 -1.37 -1.49 117.51 122.38 2cqs h ILE 428 Ca 0.16 -0.82 0.04 0.00 1.00 0.00 0.00 64.86 65.24 2cqs h ILE 428 Cb 0.45 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 2cqs h ILE 428 CO 0.02 0.31 0.18 0.00 0.00 0.00 0.00 178.15 178.66 2cqs h ALA 429 N 1.08 0.48 0.05 1.87 0.00 -1.20 0.69 119.26 122.23 2cqs h ALA 429 Ca 0.20 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2cqs h ALA 429 Cb 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2cqs h ALA 429 CO -0.01 -0.20 -0.03 0.78 0.00 0.00 0.00 179.25 179.80 2cqs h GLY 430 N 0.37 -0.08 1.00 0.00 0.00 -0.97 -1.51 103.07 101.88 2cqs h GLY 430 Ca 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 2cqs h GLY 430 CO -0.14 -0.03 0.38 -2.08 0.00 0.00 0.00 176.54 174.67 2cqs h VAL 431 N -0.20 1.20 -0.03 4.60 2.07 -1.10 -0.92 116.25 121.86 2cqs h VAL 431 Ca -0.01 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.06 2cqs h VAL 431 Cb 0.18 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2cqs h VAL 431 CO 0.01 0.21 -0.02 0.00 0.02 0.00 0.00 177.57 177.79 2cqs h ALA 432 N 1.19 0.01 -0.98 1.67 0.00 -0.77 0.36 119.26 120.75 2cqs h ALA 432 Ca 0.23 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.18 2cqs h ALA 432 Cb -0.00 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2cqs h ALA 432 CO -0.04 -0.51 0.64 0.00 0.00 0.00 0.00 179.25 179.35 2cqs h ALA 433 N 1.01 1.27 -0.45 0.00 0.00 -1.04 -0.76 119.26 119.28 2cqs h ALA 433 Ca 0.02 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2cqs h ALA 433 Cb 0.05 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 2cqs h ALA 433 CO -0.04 0.58 0.01 -0.92 0.00 0.00 0.00 179.25 178.87 2cqs h TYR 434 N 1.28 0.86 -0.48 0.00 5.03 -0.67 -2.24 116.97 120.75 2cqs h TYR 434 Ca 0.38 -0.15 -0.11 0.00 2.58 0.00 0.00 58.73 61.43 2cqs h TYR 434 Cb -0.07 -0.23 -0.01 0.00 1.55 0.00 0.00 36.73 37.97 2cqs h TYR 434 CO -0.00 0.83 -0.15 0.82 -1.32 0.00 0.00 178.16 178.34 2cqs h ILE 435 N 0.64 1.27 -0.61 1.81 2.04 -0.55 -0.33 117.51 121.78 2cqs h ILE 435 Ca 0.13 -1.29 -0.01 0.00 1.00 0.00 0.00 64.86 64.69 2cqs h ILE 435 Cb 0.48 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2cqs h ILE 435 CO 0.02 0.45 0.33 0.11 0.00 0.00 0.00 178.15 179.06 2cqs h LYS 436 N 0.80 0.84 0.04 2.37 1.57 -1.09 0.53 116.57 121.63 2cqs h LYS 436 Ca 0.12 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2cqs h LYS 436 Cb 0.71 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2cqs h LYS 436 CO 0.05 0.63 -0.02 1.49 -0.57 0.00 0.00 179.45 181.03 2cqs h GLU 437 N 0.85 -0.05 0.00 3.15 4.57 -1.16 -3.38 114.58 118.56 2cqs h GLU 437 Ca 0.22 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 58.17 2cqs h GLU 437 Cb 0.03 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 2cqs h GLU 437 CO -0.03 0.57 -1.84 -1.13 -1.18 0.00 0.00 179.01 175.39 2cqs n SER 438 N -4.79 0.47 -0.01 1.04 3.41 -0.16 -4.43 113.62 109.15 2cqs n SER 438 Ca -0.09 0.21 -0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2cqs n SER 438 Cb 0.32 0.64 -0.00 0.00 -0.26 0.00 0.00 64.21 64.91 2cqs n SER 438 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cqs n GLY 439 N 1.51 0.42 3.09 5.00 0.00 0.18 -4.92 105.19 110.48 2cqs n GLY 439 Ca -0.17 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2cqs n GLY 439 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2cqs n ASP 440 N -0.12 3.99 0.28 1.61 4.64 -1.26 -4.71 116.55 120.98 2cqs n ASP 440 Ca -0.00 -2.84 0.16 0.00 -1.38 0.00 0.00 54.79 50.73 2cqs n ASP 440 Cb 0.09 -1.63 0.81 0.00 -1.04 0.00 0.00 41.12 39.35 2cqs n ASP 440 CO 0.00 0.00 0.00 -0.50 -0.82 0.00 0.00 177.20 175.88 2cqs h TRP 441 N 6.96 0.00 0.00 -0.67 4.06 -1.91 -2.83 115.95 121.56 2cqs h TRP 441 Ca 0.49 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.44 2cqs h TRP 441 Cb 0.73 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.89 2cqs h TRP 441 CO 1.41 0.07 -0.01 0.78 -3.56 0.00 0.00 178.44 177.12 2cqs h GLY 442 N 1.06 0.00 1.85 1.49 0.00 -2.02 -2.42 103.07 103.03 2cqs h GLY 442 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2cqs h GLY 442 CO 0.01 0.00 0.01 1.19 0.00 0.00 0.00 176.54 177.75 2cqs h ILE 443 N 0.00 1.09 0.00 2.60 2.10 -1.91 -0.71 117.51 120.68 2cqs h ILE 443 Ca -0.00 -0.32 -0.00 0.00 1.08 0.00 0.00 64.86 65.62 2cqs h ILE 443 Cb 0.11 0.97 -0.00 0.00 -1.09 0.00 0.00 36.82 36.81 2cqs h ILE 443 CO 0.00 0.11 -0.00 -0.07 -1.08 0.00 0.00 178.15 177.11 2cqs h LEU 444 N 0.19 0.00 0.00 2.19 3.38 -1.67 -0.98 115.31 118.43 2cqs h LEU 444 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2cqs h LEU 444 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2cqs h LEU 444 CO 0.00 0.00 -0.76 0.47 0.09 0.00 0.00 178.44 178.25 2cqs n ASP 445 N -3.16 0.65 -4.68 -0.43 10.43 -0.28 -1.41 116.55 117.67 2cqs n ASP 445 Ca -0.03 -0.03 -0.46 0.00 2.57 0.00 0.00 54.79 56.84 2cqs n ASP 445 Cb 0.10 0.40 -0.04 0.00 1.84 0.00 0.00 41.12 43.42 2cqs n ASP 445 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 2cqs n GLU 446 N -2.00 2.32 -2.01 -1.24 4.07 -0.37 -4.55 120.64 116.86 2cqs n GLU 446 Ca 0.03 0.84 -0.42 0.00 -0.06 0.00 0.00 57.16 57.55 2cqs n GLU 446 Cb 0.43 -2.66 -0.03 0.00 -0.06 0.00 0.00 31.44 29.12 2cqs n GLU 446 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 2cqs s PRO 447 N 2.19 4.22 -0.07 5.31 0.02 -1.26 -0.73 135.00 144.67 2cqs s PRO 447 Ca 0.83 2.23 0.00 0.00 0.02 0.00 0.00 61.00 64.08 2cqs s PRO 447 Cb -0.63 -3.61 0.02 0.00 0.02 0.00 0.00 34.50 30.30 2cqs s PRO 447 CO 0.41 -0.70 -0.05 0.08 -0.33 0.00 0.00 177.00 176.41 2cqs s VAL 448 N 2.63 0.72 0.85 3.83 1.01 0.11 -4.83 120.40 124.73 2cqs s VAL 448 Ca 0.71 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.41 2cqs s VAL 448 Cb -0.37 -0.76 0.10 0.00 0.00 0.00 0.00 36.38 35.35 2cqs s VAL 448 CO 0.31 0.29 1.12 -2.16 0.00 0.00 0.00 175.10 174.66 2cqs s PRO 449 N 1.37 1.63 -0.18 2.72 0.04 -1.26 -1.52 135.00 137.79 2cqs s PRO 449 Ca -0.03 0.42 -0.05 0.00 0.04 0.00 0.00 61.00 61.39 2cqs s PRO 449 Cb -0.14 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 2cqs s PRO 449 CO -0.03 -1.89 -0.01 -0.06 0.04 0.00 0.00 177.00 175.05 2cqs s PHE 450 N -3.25 3.06 -1.54 0.56 0.08 -1.26 -4.20 117.98 111.43 2cqs s PHE 450 Ca 0.62 -0.33 -0.10 0.00 0.12 0.00 0.00 56.93 57.24 2cqs s PHE 450 Cb -0.14 -2.03 0.08 0.00 -0.57 0.00 0.00 43.02 40.36 2cqs s PHE 450 CO 0.53 -0.11 0.71 -3.47 -0.10 0.00 0.00 175.22 172.78 2cqs n ASP 451 N 3.87 -2.55 -2.22 1.36 2.03 -0.11 -1.33 116.55 117.60 2cqs n ASP 451 Ca -0.17 -0.94 -0.12 0.00 0.52 0.00 0.00 54.79 54.08 2cqs n ASP 451 Cb 0.52 -3.20 -0.01 0.00 -0.72 0.00 0.00 41.12 37.70 2cqs n ASP 451 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2cqs n ASN 452 N -2.83 -3.59 -4.60 1.67 4.13 -0.26 -4.91 115.26 104.87 2cqs n ASN 452 Ca -0.08 0.23 -0.43 0.00 1.68 0.00 0.00 54.58 55.98 2cqs n ASN 452 Cb 0.57 -3.13 -0.02 0.00 -1.54 0.00 0.00 39.78 35.67 2cqs n ASN 452 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2cqs s GLU 453 N -4.61 3.61 0.20 3.52 0.41 -0.44 -4.98 118.70 116.41 2cqs s GLU 453 Ca 0.00 0.87 -0.32 0.00 -0.41 0.00 0.00 54.97 55.10 2cqs s GLU 453 Cb 0.00 -4.00 -0.12 0.00 -1.78 0.00 0.00 34.13 28.23 2cqs s GLU 453 CO 0.00 -1.52 1.69 -2.30 -0.49 0.00 0.00 175.26 172.63 2cqs n PRO 454 N 8.02 2.63 -0.60 0.39 -0.02 -1.26 -1.55 135.00 142.61 2cqs n PRO 454 Ca 0.16 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 2cqs n PRO 454 Cb 0.48 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 2cqs n PRO 454 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cqs n GLY 455 N 3.84 0.78 0.96 -1.23 0.00 -1.26 -4.91 105.19 103.37 2cqs n GLY 455 Ca 0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 2cqs n GLY 455 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqs n SER 456 N 0.00 3.17 -4.66 1.61 3.41 -0.59 -5.03 113.62 111.53 2cqs n SER 456 Ca 0.00 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.28 2cqs n SER 456 Cb 0.00 -0.23 0.01 0.00 -0.26 0.00 0.00 64.21 63.73 2cqs n SER 456 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2cqs n GLU 457 N 1.17 1.69 -3.88 4.33 4.71 -1.26 -4.31 120.64 123.09 2cqs n GLU 457 Ca 0.16 0.60 -0.10 0.00 -0.01 0.00 0.00 57.16 57.82 2cqs n GLU 457 Cb 0.52 -2.24 -0.09 0.00 -1.01 0.00 0.00 31.44 28.63 2cqs n GLU 457 CO 0.00 0.00 0.00 0.14 0.09 0.00 0.00 177.13 177.36 2cqs s VAL 458 N -1.22 0.12 0.52 2.62 -7.23 -0.57 -4.80 120.40 109.84 2cqs s VAL 458 Ca 0.62 -1.01 -0.21 0.00 -1.81 0.00 0.00 61.98 59.56 2cqs s VAL 458 Cb -0.53 -0.97 -0.08 0.00 0.56 0.00 0.00 36.38 35.36 2cqs s VAL 458 CO 0.58 -0.56 0.96 -2.65 -0.31 0.00 0.00 175.10 173.12 2cqs n PRO 459 N 0.62 1.10 -0.26 4.82 -0.02 -1.26 0.06 135.00 140.06 2cqs n PRO 459 Ca -0.18 0.41 0.07 0.00 -2.02 0.00 0.00 63.50 61.77 2cqs n PRO 459 Cb 0.59 -2.10 0.20 0.00 -0.02 0.00 0.00 33.50 32.18 2cqs n PRO 459 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2cqs h LEU 460 N 0.96 0.21 -1.03 2.45 6.46 -0.35 0.63 115.31 124.64 2cqs h LEU 460 Ca -0.47 0.13 0.16 0.00 -0.12 0.00 0.00 57.88 57.58 2cqs h LEU 460 Cb 1.35 0.13 -0.10 0.00 -0.73 0.00 0.00 40.66 41.31 2cqs h LEU 460 CO 0.53 0.05 0.62 0.15 -0.62 0.00 0.00 178.44 179.17 2cqs h PHE 461 N 0.39 1.09 -0.31 1.25 3.04 -1.52 0.17 116.94 121.03 2cqs h PHE 461 Ca 0.44 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.41 2cqs h PHE 461 Cb 0.72 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.87 2cqs h PHE 461 CO -0.19 0.32 0.14 1.49 -2.02 0.00 0.00 178.31 178.05 2cqs h GLU 462 N 0.85 0.43 -0.70 1.11 4.57 -1.14 -0.82 114.58 118.88 2cqs h GLU 462 Ca 0.54 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.66 2cqs h GLU 462 Cb 0.74 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 29.21 2cqs h GLU 462 CO -0.33 0.35 0.35 0.45 -1.18 0.00 0.00 179.01 178.64 2cqs h HIS 463 N 0.43 1.00 -0.46 0.92 3.86 -0.56 -1.35 115.15 118.99 2cqs h HIS 463 Ca 0.11 -0.04 -0.05 0.00 -1.16 0.00 0.00 60.37 59.23 2cqs h HIS 463 Cb 0.07 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.20 2cqs h HIS 463 CO 0.00 0.74 0.07 -0.07 0.86 0.00 0.00 177.93 179.53 2cqs h LEU 464 N 0.97 0.66 -0.89 2.43 3.38 -0.86 -0.72 115.31 120.27 2cqs h LEU 464 Ca 0.24 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2cqs h LEU 464 Cb 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2cqs h LEU 464 CO -0.03 0.68 -0.24 0.71 0.09 0.00 0.00 178.44 179.65 2cqs h THR 465 N 0.68 1.27 -0.48 0.22 1.35 -0.73 0.55 112.91 115.76 2cqs h THR 465 Ca 0.15 -1.28 -0.06 0.00 -0.55 0.00 0.00 66.41 64.67 2cqs h THR 465 Cb 0.31 1.32 -0.02 0.00 -1.73 0.00 0.00 68.15 68.03 2cqs h THR 465 CO 0.00 0.41 0.06 0.03 -0.25 0.00 0.00 175.52 175.78 2cqs h ARG 466 N 0.48 0.81 -0.01 4.72 2.47 -0.31 0.96 114.38 123.51 2cqs h ARG 466 Ca 0.07 -0.23 -0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2cqs h ARG 466 Cb 0.68 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.91 2cqs h ARG 466 CO 0.05 0.83 0.00 0.77 0.56 0.00 0.00 179.97 182.18 2cqs h SER 467 N 0.68 0.01 -0.09 7.04 0.02 -0.74 -0.39 113.55 120.07 2cqs h SER 467 Ca 0.14 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2cqs h SER 467 Cb 0.42 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 2cqs h SER 467 CO 0.01 0.06 0.06 0.15 -1.14 0.00 0.00 176.83 175.98 2cqs h PHE 468 N -0.05 0.12 -0.20 3.45 3.04 -0.74 -2.74 116.94 119.82 2cqs h PHE 468 Ca 0.00 0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.91 2cqs h PHE 468 Cb 0.06 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 2cqs h PHE 468 CO -0.06 0.08 -0.07 1.96 -2.02 0.00 0.00 178.31 178.20 2cqs h GLN 469 N 0.12 0.31 -0.61 1.11 1.08 -0.74 -2.44 115.11 113.94 2cqs h GLN 469 Ca 0.03 -0.06 0.06 0.00 -1.45 0.00 0.00 58.65 57.23 2cqs h GLN 469 Cb -0.01 -0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.32 2cqs h GLN 469 CO -0.01 0.40 0.32 0.35 -0.95 0.00 0.00 178.83 178.94 2cqs h PHE 470 N 0.30 0.58 -0.29 2.96 3.04 -0.75 0.93 116.94 123.70 2cqs h PHE 470 Ca 0.06 0.02 -0.18 0.00 3.98 0.00 0.00 57.97 61.86 2cqs h PHE 470 Cb 0.33 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.66 2cqs h PHE 470 CO 0.01 0.27 -0.52 1.15 -2.02 0.00 0.00 178.31 177.19 2cqs h THR 471 N 0.59 1.28 -0.42 4.41 2.02 -1.42 -2.87 112.91 116.49 2cqs h THR 471 Ca 0.27 -1.71 0.00 0.00 0.77 0.00 0.00 66.41 65.75 2cqs h THR 471 Cb 0.19 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 2cqs h THR 471 CO -0.19 0.56 0.28 0.58 0.37 0.00 0.00 175.52 177.12 2cqs h VAL 472 N 0.65 1.11 -0.20 3.16 2.07 -0.95 -2.44 116.25 119.64 2cqs h VAL 472 Ca 0.02 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 2cqs h VAL 472 Cb 1.12 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2cqs h VAL 472 CO 0.12 0.10 0.01 0.00 0.02 0.00 0.00 177.57 177.82 2cqs n GLN 473 N -4.79 2.30 -2.88 1.57 6.02 0.27 -4.15 117.38 115.72 2cqs n GLN 473 Ca 0.01 -1.08 -0.12 0.00 -0.01 0.00 0.00 57.00 55.80 2cqs n GLN 473 Cb 0.02 -1.75 0.03 0.00 1.02 0.00 0.00 30.24 29.56 2cqs n GLN 473 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2cqs n ASN 474 N 0.20 0.14 -4.69 1.08 3.02 -0.92 -5.02 115.26 109.07 2cqs n ASN 474 Ca 0.10 -2.95 -0.28 0.00 -0.03 0.00 0.00 54.58 51.42 2cqs n ASN 474 Cb 0.59 0.05 -0.08 0.00 -0.61 0.00 0.00 39.78 39.73 2cqs n ASN 474 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2cqs s ARG 475 N -1.86 2.52 0.00 3.52 0.52 -1.25 0.11 118.95 122.51 2cqs s ARG 475 Ca 0.30 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 2cqs s ARG 475 Cb 0.38 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 33.37 2cqs s ARG 475 CO -0.04 0.50 0.00 0.41 0.02 0.00 0.00 175.30 176.20 2cqs n GLY 476 N 0.25 0.33 0.31 -3.53 0.00 0.27 -4.75 105.19 98.07 2cqs n GLY 476 Ca -0.10 -1.87 0.18 0.00 0.00 0.00 0.00 46.02 44.23 2cqs n GLY 476 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqs h PRO 477 N 0.00 0.00 -0.07 1.61 0.13 -1.86 -0.88 132.00 130.92 2cqs h PRO 477 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2cqs h PRO 477 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2cqs h PRO 477 CO 0.00 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.49 2cqs n HIS 478 N -3.54 0.08 -0.82 1.56 8.25 -1.26 -4.91 115.22 114.58 2cqs n HIS 478 Ca -0.03 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2cqs n HIS 478 Cb 0.08 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.19 2cqs n HIS 478 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cqs n GLY 479 N 1.24 0.66 3.88 -1.41 0.00 -0.34 -4.80 105.19 104.42 2cqs n GLY 479 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2cqs n GLY 479 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cqs s LEU 480 N 0.00 4.33 0.29 0.99 1.43 -1.26 -4.71 118.68 119.74 2cqs s LEU 480 Ca 0.00 0.68 -0.30 0.00 -1.03 0.00 0.00 54.13 53.49 2cqs s LEU 480 Cb 0.00 -3.03 -0.13 0.00 0.03 0.00 0.00 46.19 43.07 2cqs s LEU 480 CO 0.00 0.15 1.38 -2.65 0.23 0.00 0.00 176.35 175.46 2cqs n PRO 481 N 0.69 2.14 -2.19 1.29 -0.02 -1.26 0.96 135.00 136.60 2cqs n PRO 481 Ca -0.07 0.76 -0.41 0.00 -2.02 0.00 0.00 63.50 61.76 2cqs n PRO 481 Cb 0.52 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 2cqs n PRO 481 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2cqs s LEU 482 N -0.41 4.45 0.08 2.45 1.43 0.12 -0.84 118.68 125.96 2cqs s LEU 482 Ca 0.63 2.59 -0.08 0.00 -1.03 0.00 0.00 54.13 56.23 2cqs s LEU 482 Cb -0.60 -3.64 -0.26 0.00 0.03 0.00 0.00 46.19 41.72 2cqs s LEU 482 CO 0.55 -0.45 1.14 -0.29 0.23 0.00 0.00 176.35 177.53 2cqs h ILE 483 N 3.09 1.41 0.00 -0.59 2.10 -1.77 -3.44 117.51 118.31 2cqs h ILE 483 Ca -0.48 -2.78 0.00 0.00 1.08 0.00 0.00 64.86 62.68 2cqs h ILE 483 Cb 1.22 2.82 0.00 0.00 -1.09 0.00 0.00 36.82 39.77 2cqs h ILE 483 CO 0.66 0.82 0.00 0.61 -1.08 0.00 0.00 178.15 179.17 2cqs n GLY 484 N 1.42 0.86 0.25 8.18 0.00 -1.26 -3.25 105.19 111.39 2cqs n GLY 484 Ca -0.10 -0.79 0.03 0.00 0.00 0.00 0.00 46.02 45.16 2cqs n GLY 484 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2cqs h ARG 485 N 0.00 0.20 0.00 1.61 9.65 -0.99 -3.41 114.38 121.43 2cqs h ARG 485 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2cqs h ARG 485 Cb 0.00 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 2cqs h ARG 485 CO 0.00 0.13 0.00 0.00 2.80 0.00 0.00 179.97 182.90 2cqs n ALA 486 N -2.72 0.00 -1.96 2.80 0.00 -1.20 -4.27 120.51 113.16 2cqs n ALA 486 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2cqs n ALA 486 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2cqs n ALA 486 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2cqs n ASP 487 N 0.00 0.00 -0.34 0.00 3.85 -1.26 -2.89 116.55 115.91 2cqs n ASP 487 Ca 0.00 0.00 0.14 0.00 -0.71 0.00 0.00 54.79 54.22 2cqs n ASP 487 Cb 0.00 0.00 0.35 0.00 -1.35 0.00 0.00 41.12 40.12 2cqs n ASP 487 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 2cqs h TRP 488 N 0.00 1.00 -2.91 2.11 7.01 -1.97 -3.34 115.95 117.84 2cqs h TRP 488 Ca 0.00 0.03 -0.55 0.00 2.11 0.00 0.00 58.89 60.48 2cqs h TRP 488 Cb 0.00 -0.30 -0.07 0.00 -2.10 0.00 0.00 29.16 26.69 2cqs h TRP 488 CO 0.00 0.24 1.06 1.21 -2.79 0.00 0.00 178.44 178.15 2cqs s ASN 489 N -5.46 6.24 0.64 2.65 3.84 -1.26 -4.88 114.94 116.70 2cqs s ASN 489 Ca -0.11 0.17 0.40 0.00 0.21 0.00 0.00 52.86 53.53 2cqs s ASN 489 Cb 0.24 -2.55 2.22 0.00 -0.55 0.00 0.00 41.25 40.61 2cqs s ASN 489 CO 0.80 -1.64 2.32 0.44 -2.79 0.00 0.00 177.10 176.23 2cqs h ASP 490 N 10.47 0.00 -0.21 -4.21 3.45 -1.95 -2.57 116.42 121.39 2cqs h ASP 490 Ca -0.26 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.20 2cqs h ASP 490 Cb 1.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.85 2cqs h ASP 490 CO 1.19 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 178.86 2cqs s LEU 492 N -1.69 5.92 -0.53 0.00 2.96 -0.97 -0.74 118.68 123.63 2cqs s LEU 492 Ca 0.35 -3.19 -0.10 0.00 -0.22 0.00 0.00 54.13 50.97 2cqs s LEU 492 Cb 0.21 -2.28 0.13 0.00 0.50 0.00 0.00 46.19 44.75 2cqs s LEU 492 CO 0.30 -0.52 0.42 0.20 -1.32 0.00 0.00 176.35 175.44 2cqs s ASN 493 N 2.05 5.86 0.00 3.68 -0.87 -0.67 -4.32 114.94 120.67 2cqs s ASN 493 Ca 0.33 -2.03 0.27 0.00 -1.57 0.00 0.00 52.86 49.86 2cqs s ASN 493 Cb -0.07 -2.05 0.90 0.00 -0.02 0.00 0.00 41.25 40.00 2cqs s ASN 493 CO -0.06 -0.69 1.65 0.18 -2.57 0.00 0.00 177.10 175.61 2cqs n LEU 494 N 4.78 0.94 -1.73 0.60 4.77 -1.26 -2.50 117.00 122.60 2cqs n LEU 494 Ca -0.06 -0.22 -0.18 0.00 -0.03 0.00 0.00 56.01 55.52 2cqs n LEU 494 Cb 0.41 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.44 2cqs n LEU 494 CO 0.43 0.17 0.25 0.59 -1.33 0.00 0.00 177.39 177.51 2cqs n ASN 495 N -0.64 4.30 -0.01 -1.43 3.02 -1.26 -3.95 115.26 115.30 2cqs n ASN 495 Ca 0.13 -3.78 -0.01 0.00 -0.03 0.00 0.00 54.58 50.89 2cqs n ASN 495 Cb 0.33 -0.39 -0.00 0.00 -0.61 0.00 0.00 39.78 39.10 2cqs n ASN 495 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2cqs n PHE 497 N -2.79 -1.85 -3.40 0.00 3.01 -1.24 -4.62 117.46 106.57 2cqs n PHE 497 Ca -0.01 0.57 -0.38 0.00 1.01 0.00 0.00 57.45 58.64 2cqs n PHE 497 Cb 0.05 -3.63 -0.06 0.00 -0.01 0.00 0.00 39.48 35.84 2cqs n PHE 497 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2cqs s SER 498 N -3.80 6.80 0.00 4.37 0.15 -1.26 -4.93 113.70 115.03 2cqs s SER 498 Ca 0.30 0.95 0.00 0.00 0.70 0.00 0.00 55.95 57.90 2cqs s SER 498 Cb -0.11 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2cqs s SER 498 CO 0.86 0.20 0.67 0.35 1.20 0.00 0.00 173.24 176.52 2cqs n THR 499 N 2.50 0.44 -3.25 6.45 -2.24 -1.26 -4.99 114.28 111.93 2cqs n THR 499 Ca -0.11 -0.59 -0.42 0.00 -2.27 0.00 0.00 64.05 60.66 2cqs n THR 499 Cb 0.52 0.88 -0.08 0.00 -2.10 0.00 0.00 70.33 69.55 2cqs n THR 499 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2cqs s THR 500 N -0.44 5.01 0.60 4.28 2.01 -1.26 -5.06 115.64 120.78 2cqs s THR 500 Ca 0.00 0.02 -0.18 0.00 0.31 0.00 0.00 61.69 61.84 2cqs s THR 500 Cb 0.00 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2cqs s THR 500 CO 0.00 -0.36 1.17 -2.16 -0.69 0.00 0.00 174.62 172.58 2cqs s PRO 501 N 2.36 2.99 0.00 4.92 0.04 -1.26 -3.54 135.00 140.51 2cqs s PRO 501 Ca 0.17 1.70 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2cqs s PRO 501 Cb -0.16 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2cqs s PRO 501 CO 0.15 -1.16 0.00 0.41 0.04 0.00 0.00 177.00 176.43 2cqs n GLY 502 N 0.25 2.86 3.64 0.56 0.00 -1.26 -4.98 105.19 106.26 2cqs n GLY 502 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2cqs n GLY 502 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cqs s GLU 503 N 0.00 4.14 0.15 1.61 2.12 -1.23 -5.01 118.70 120.48 2cqs s GLU 503 Ca 0.00 0.58 -0.34 0.00 0.36 0.00 0.00 54.97 55.57 2cqs s GLU 503 Cb 0.00 -3.63 -0.15 0.00 0.26 0.00 0.00 34.13 30.61 2cqs s GLU 503 CO 0.00 -0.37 1.49 0.45 -0.54 0.00 0.00 175.26 176.28 2cqs n SER 504 N 5.56 2.64 0.19 -1.70 2.88 -1.26 -4.84 113.62 117.09 2cqs n SER 504 Ca -0.00 1.10 0.03 0.00 -1.33 0.00 0.00 58.87 58.67 2cqs n SER 504 Cb 0.49 -1.36 0.39 0.00 -0.75 0.00 0.00 64.21 62.98 2cqs n SER 504 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 2cqs h PHE 505 N 5.33 0.00 -0.36 0.66 -1.00 -1.95 0.23 116.94 119.85 2cqs h PHE 505 Ca -0.46 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.26 2cqs h PHE 505 Cb 1.28 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.82 2cqs h PHE 505 CO 0.61 0.34 -0.06 1.96 -1.61 0.00 0.00 178.31 179.55 2cqs h GLN 506 N 0.00 0.60 0.00 1.51 1.08 -1.89 -3.31 115.11 113.11 2cqs h GLN 506 Ca -0.00 -0.16 -0.01 0.00 -1.45 0.00 0.00 58.65 57.02 2cqs h GLN 506 Cb 0.61 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2cqs h GLN 506 CO 0.04 0.67 -1.56 0.25 -0.95 0.00 0.00 178.83 177.28 2cqs n THR 507 N -4.22 0.05 -1.73 -0.54 -2.24 -1.06 -3.45 114.28 101.08 2cqs n THR 507 Ca 0.01 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 2cqs n THR 507 Cb 0.30 0.16 -0.00 0.00 -2.10 0.00 0.00 70.33 68.69 2cqs n THR 507 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2cqs n THR 508 N -1.95 1.93 -1.68 4.28 5.66 0.79 -4.89 114.28 118.43 2cqs n THR 508 Ca -0.03 -0.48 -0.43 0.00 -3.05 0.00 0.00 64.05 60.05 2cqs n THR 508 Cb 0.35 -1.77 -0.01 0.00 -1.55 0.00 0.00 70.33 67.35 2cqs n THR 508 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 2cqs n GLU 509 N 0.60 1.99 -3.99 1.09 2.13 -1.26 -4.97 120.64 116.23 2cqs n GLU 509 Ca 0.03 0.70 -0.22 0.00 0.66 0.00 0.00 57.16 58.34 2cqs n GLU 509 Cb 0.37 -2.25 -0.02 0.00 0.27 0.00 0.00 31.44 29.80 2cqs n GLU 509 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 2cqs s ASN 510 N -0.30 6.20 0.03 4.31 -0.87 -1.26 -4.91 114.94 118.14 2cqs s ASN 510 Ca 0.57 0.03 -0.25 0.00 -1.57 0.00 0.00 52.86 51.64 2cqs s ASN 510 Cb -0.60 -1.79 -0.05 0.00 -0.02 0.00 0.00 41.25 38.79 2cqs s ASN 510 CO 0.61 -0.05 0.78 -1.10 -2.57 0.00 0.00 177.10 174.77 2cqs s GLN 511 N -3.88 4.51 0.86 -0.60 -1.52 -0.13 -5.03 119.66 113.86 2cqs s GLN 511 Ca 0.34 1.09 -0.12 0.00 -1.95 0.00 0.00 55.36 54.72 2cqs s GLN 511 Cb -0.09 -3.38 0.10 0.00 -0.22 0.00 0.00 33.01 29.42 2cqs s GLN 511 CO 0.28 0.23 1.12 0.00 -0.25 0.00 0.00 175.29 176.67 2cqs s ALA 512 N 0.13 2.02 0.00 6.09 0.00 -1.26 -4.89 121.76 123.85 2cqs s ALA 512 Ca 0.40 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.97 2cqs s ALA 512 Cb -0.20 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2cqs s ALA 512 CO 0.23 -2.01 0.00 0.41 0.00 0.00 0.00 175.76 174.39 2cqs n GLY 513 N -2.20 -1.35 0.32 0.00 0.00 -1.26 -5.08 105.19 95.62 2cqs n GLY 513 Ca 0.07 -1.28 0.04 0.00 0.00 0.00 0.00 46.02 44.85 2cqs n GLY 513 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cqs n GLY 514 N 0.00 -1.99 0.73 -0.02 0.00 -1.26 -4.80 105.19 97.84 2cqs n GLY 514 Ca 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 46.02 44.66 2cqs n GLY 514 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2cqs n VAL 515 N -2.72 1.29 -1.68 1.61 0.24 -0.99 -5.07 118.33 111.01 2cqs n VAL 515 Ca -0.01 -2.07 -0.45 0.00 -2.04 0.00 0.00 64.34 59.77 2cqs n VAL 515 Cb 0.15 0.18 -0.04 0.00 -1.47 0.00 0.00 33.84 32.66 2cqs n VAL 515 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cqs n ALA 516 N -0.61 1.46 -2.45 2.33 0.00 -1.19 -4.75 120.51 115.30 2cqs n ALA 516 Ca 0.13 0.32 -0.23 0.00 0.00 0.00 0.00 53.44 53.66 2cqs n ALA 516 Cb 0.80 -2.51 -0.11 0.00 0.00 0.00 0.00 19.45 17.63 2cqs n ALA 516 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2cqs s GLU 517 N 2.97 1.31 -0.17 0.00 2.02 0.42 -2.47 118.70 122.78 2cqs s GLU 517 Ca 0.86 -1.42 0.00 0.00 0.02 0.00 0.00 54.97 54.43 2cqs s GLU 517 Cb -0.60 -1.40 0.01 0.00 0.10 0.00 0.00 34.13 32.23 2cqs s GLU 517 CO 0.43 0.29 -0.17 0.45 0.02 0.00 0.00 175.26 176.28 2cqs s SER 518 N -2.66 3.46 0.30 -0.19 0.15 -0.02 -1.07 113.70 113.67 2cqs s SER 518 Ca 0.16 -0.55 0.13 0.00 0.70 0.00 0.00 55.95 56.39 2cqs s SER 518 Cb -0.06 -1.54 0.44 0.00 -1.71 0.00 0.00 66.02 63.15 2cqs s SER 518 CO 0.07 0.04 1.64 0.58 1.20 0.00 0.00 173.24 176.77 2cqs h VAL 519 N 5.80 1.29 -0.14 4.45 2.07 -1.72 -2.90 116.25 125.10 2cqs h VAL 519 Ca -0.39 -1.96 -0.02 0.00 0.82 0.00 0.00 66.70 65.16 2cqs h VAL 519 Cb 1.17 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 2cqs h VAL 519 CO 0.60 0.54 0.03 0.15 0.02 0.00 0.00 177.57 178.90 2cqs h PHE 520 N 0.00 0.25 -0.14 1.57 3.04 -1.87 -2.09 116.94 117.70 2cqs h PHE 520 Ca -0.01 -0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.89 2cqs h PHE 520 Cb 1.04 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.47 2cqs h PHE 520 CO 0.00 0.41 -0.01 0.82 -2.02 0.00 0.00 178.31 177.51 2cqs h ILE 521 N 0.02 1.11 -0.04 1.41 2.04 -1.92 0.70 117.51 120.83 2cqs h ILE 521 Ca 0.04 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 2cqs h ILE 521 Cb 0.29 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2cqs h ILE 521 CO 0.00 0.14 0.03 0.00 0.00 0.00 0.00 178.15 178.32 2cqs h ALA 522 N 1.79 0.06 -0.55 1.87 0.00 -1.27 0.47 119.26 121.62 2cqs h ALA 522 Ca 0.05 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2cqs h ALA 522 Cb 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2cqs h ALA 522 CO 0.00 -0.42 0.20 0.00 0.00 0.00 0.00 179.25 179.03 2cqs h ALA 523 N 0.97 0.72 -0.86 0.00 0.00 -0.69 -0.89 119.26 118.52 2cqs h ALA 523 Ca 0.02 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2cqs h ALA 523 Cb 0.04 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 2cqs h ALA 523 CO -0.00 0.36 0.56 0.37 0.00 0.00 0.00 179.25 180.53 2cqs h GLN 524 N 0.76 1.08 -0.62 0.00 4.15 -0.53 -0.32 115.11 119.63 2cqs h GLN 524 Ca 0.18 -0.06 -0.09 0.00 0.77 0.00 0.00 58.65 59.44 2cqs h GLN 524 Cb 0.24 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2cqs h GLN 524 CO -0.01 0.71 0.02 0.35 -1.93 0.00 0.00 178.83 177.97 2cqs h PHE 525 N 1.11 1.18 -0.33 3.99 3.04 0.40 -0.48 116.94 125.84 2cqs h PHE 525 Ca 0.33 -0.20 -0.04 0.00 3.98 0.00 0.00 57.97 62.04 2cqs h PHE 525 Cb -0.05 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.14 2cqs h PHE 525 CO -0.02 1.03 0.06 0.28 -2.02 0.00 0.00 178.31 177.64 2cqs h VAL 526 N 0.99 1.23 0.73 1.41 2.07 -0.56 0.79 116.25 122.91 2cqs h VAL 526 Ca 0.18 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 2cqs h VAL 526 Cb 0.54 1.13 0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2cqs h VAL 526 CO 0.03 0.27 -0.35 0.25 0.02 0.00 0.00 177.57 177.79 2cqs h LEU 527 N 0.38 -0.83 0.00 2.57 5.85 -0.92 -3.06 115.31 119.30 2cqs h LEU 527 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2cqs h LEU 527 Cb 0.34 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.59 2cqs h LEU 527 CO 0.01 -0.50 -0.14 -1.22 -0.34 0.00 0.00 178.44 176.25 2cqs n TYR 528 N -5.46 0.65 0.03 1.25 0.53 -0.20 -3.20 117.16 110.76 2cqs n TYR 528 Ca -0.13 0.19 -0.07 0.00 -1.02 0.00 0.00 57.90 56.87 2cqs n TYR 528 Cb 0.40 -0.78 0.11 0.00 -1.03 0.00 0.00 39.34 38.05 2cqs n TYR 528 CO 0.00 0.00 0.00 0.78 -1.02 0.00 0.00 176.86 176.62 2cqs h GLY 529 N 4.63 0.49 1.15 2.72 0.00 0.57 -2.12 103.07 110.51 2cqs h GLY 529 Ca 0.00 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 2cqs h GLY 529 CO 0.00 0.48 0.05 0.00 0.00 0.00 0.00 176.54 177.07 2cqs h ALA 530 N 1.12 0.93 -0.65 3.60 0.00 -1.49 -1.24 119.26 121.52 2cqs h ALA 530 Ca 0.02 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 2cqs h ALA 530 Cb 0.98 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2cqs h ALA 530 CO 0.09 0.65 0.08 0.93 0.00 0.00 0.00 179.25 181.00 2cqs h GLU 531 N 0.96 1.08 -0.21 0.00 4.39 -1.56 -0.97 114.58 118.28 2cqs h GLU 531 Ca 0.18 -0.30 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2cqs h GLU 531 Cb 0.49 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2cqs h GLU 531 CO 0.02 1.01 0.11 -0.92 -1.16 0.00 0.00 179.01 178.06 2cqs h TYR 532 N 1.01 0.29 -0.55 4.33 3.20 -1.06 0.44 116.97 124.62 2cqs h TYR 532 Ca 0.20 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.15 2cqs h TYR 532 Cb 0.46 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 38.57 2cqs h TYR 532 CO 0.03 0.28 0.15 0.00 -1.64 0.00 0.00 178.16 176.98 2cqs h ALA 533 N 0.99 0.67 -0.43 1.82 0.00 -0.95 0.24 119.26 121.60 2cqs h ALA 533 Ca 0.07 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2cqs h ALA 533 Cb 0.09 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2cqs h ALA 533 CO -0.01 -0.26 0.23 1.15 0.00 0.00 0.00 179.25 180.36 2cqs h THR 534 N 0.31 1.17 -0.54 0.00 2.02 -0.77 -0.40 112.91 114.70 2cqs h THR 534 Ca 0.28 -0.44 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 2cqs h THR 534 Cb 0.37 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2cqs h THR 534 CO -0.33 0.18 0.12 -0.07 0.37 0.00 0.00 175.52 175.79 2cqs h LEU 535 N 0.56 0.78 -0.56 2.58 3.38 0.16 -1.43 115.31 120.78 2cqs h LEU 535 Ca 0.15 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 2cqs h LEU 535 Cb 0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2cqs h LEU 535 CO -0.02 0.77 -0.21 0.00 0.09 0.00 0.00 178.44 179.07 2cqs h ALA 536 N 1.33 0.75 -0.33 1.53 0.00 -0.16 -2.02 119.26 120.37 2cqs h ALA 536 Ca 0.17 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2cqs h ALA 536 Cb 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2cqs h ALA 536 CO 0.00 0.66 0.08 1.49 0.00 0.00 0.00 179.25 181.48 2cqs h GLU 537 N 0.81 0.53 0.00 0.00 4.57 -0.70 0.44 114.58 120.22 2cqs h GLU 537 Ca 0.11 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 2cqs h GLU 537 Cb 0.77 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.29 2cqs h GLU 537 CO 0.06 0.59 -0.13 0.00 -1.18 0.00 0.00 179.01 178.35 2cqs h ARG 538 N 0.37 0.00 -0.00 1.92 2.47 -1.20 -0.77 114.38 117.18 2cqs h ARG 538 Ca 0.10 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 2cqs h ARG 538 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 2cqs h ARG 538 CO 0.00 0.13 -0.03 0.54 0.56 0.00 0.00 179.97 181.17 2cqs n ARG 539 N -3.92 0.74 -0.65 0.04 5.12 -0.77 -4.89 116.66 112.33 2cqs n ARG 539 Ca -0.02 -0.12 0.00 0.00 -1.93 0.00 0.00 57.85 55.78 2cqs n ARG 539 Cb 0.22 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.02 2cqs n ARG 539 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cqs n GLY 540 N 1.19 0.62 2.96 -0.13 0.00 -0.29 -4.99 105.19 104.56 2cqs n GLY 540 Ca 0.17 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 2cqs n GLY 540 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cqs n LEU 541 N 0.00 6.53 -0.01 0.99 4.32 0.10 -4.87 117.00 124.07 2cqs n LEU 541 Ca 0.00 -5.19 -0.09 0.00 -0.02 0.00 0.00 56.01 50.71 2cqs n LEU 541 Cb 0.00 -1.28 -0.03 0.00 -1.62 0.00 0.00 43.42 40.49 2cqs n LEU 541 CO 0.00 1.70 0.77 0.00 -1.22 0.00 0.00 177.39 178.64 2cqs h ALA 542 N 5.36 -0.04 -0.44 -1.18 0.00 -1.86 0.61 119.26 121.72 2cqs h ALA 542 Ca 0.24 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2cqs h ALA 542 Cb 0.59 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2cqs h ALA 542 CO 1.35 -0.59 0.25 -0.44 0.00 0.00 0.00 179.25 179.83 2cqs h ASP 543 N -0.16 0.53 -0.46 0.00 3.45 -1.97 0.34 116.42 118.16 2cqs h ASP 543 Ca 0.10 -0.07 0.03 0.00 0.43 0.00 0.00 57.03 57.52 2cqs h ASP 543 Cb 0.30 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 38.90 2cqs h ASP 543 CO -0.24 0.45 0.24 0.58 -1.57 0.00 0.00 179.24 178.70 2cqs h VAL 544 N 0.57 0.98 -0.22 -1.35 2.07 -1.88 0.12 116.25 116.54 2cqs h VAL 544 Ca 0.15 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2cqs h VAL 544 Cb 0.02 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2cqs h VAL 544 CO -0.03 0.09 0.13 0.00 0.02 0.00 0.00 177.57 177.77 2cqs h ALA 545 N 1.24 0.27 -0.22 1.67 0.00 -0.50 0.16 119.26 121.89 2cqs h ALA 545 Ca 0.20 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.10 2cqs h ALA 545 Cb 0.09 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2cqs h ALA 545 CO -0.13 -0.21 -0.00 1.15 0.00 0.00 0.00 179.25 180.06 2cqs h THR 546 N 0.25 0.84 -0.14 0.00 2.02 -0.46 -0.96 112.91 114.46 2cqs h THR 546 Ca 0.08 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 67.25 2cqs h THR 546 Cb 0.04 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2cqs h THR 546 CO -0.01 0.01 0.02 -0.08 0.37 0.00 0.00 175.52 175.83 2cqs h GLU 547 N 0.07 0.08 -0.78 6.66 4.81 -0.48 -2.41 114.58 122.53 2cqs h GLU 547 Ca 0.10 -0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.44 2cqs h GLU 547 Cb 0.13 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.41 2cqs h GLU 547 CO -0.18 0.05 0.40 0.00 -0.73 0.00 0.00 179.01 178.56 2cqs h ALA 548 N 1.10 1.11 0.00 2.92 0.00 -0.15 -0.82 119.26 123.42 2cqs h ALA 548 Ca 0.06 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2cqs h ALA 548 Cb 0.06 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2cqs h ALA 548 CO -0.09 -0.03 -0.32 0.00 0.00 0.00 0.00 179.25 178.82 2cqs h ARG 549 N 0.65 0.00 -0.13 0.00 3.08 -0.87 -1.63 114.38 115.48 2cqs h ARG 549 Ca 0.39 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 2cqs h ARG 549 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 2cqs h ARG 549 CO -0.29 0.32 0.00 -0.22 -1.07 0.00 0.00 179.97 178.71 2cqs h LYS 550 N 0.00 0.23 -0.70 0.04 3.64 -0.68 -0.91 116.57 118.19 2cqs h LYS 550 Ca -0.00 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2cqs h LYS 550 Cb 0.64 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 2cqs h LYS 550 CO 0.04 0.45 0.40 1.88 -2.27 0.00 0.00 179.45 179.96 2cqs h TYR 551 N -0.03 0.93 -0.29 1.91 0.99 -1.18 -0.89 116.97 118.42 2cqs h TYR 551 Ca 0.04 -0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.78 2cqs h TYR 551 Cb 0.35 -0.30 -0.03 0.00 1.00 0.00 0.00 36.73 37.75 2cqs h TYR 551 CO 0.03 0.64 0.11 0.28 -0.00 0.00 0.00 178.16 179.22 2cqs h VAL 552 N 0.95 0.94 -0.53 -2.88 2.07 -1.13 -0.44 116.25 115.22 2cqs h VAL 552 Ca 0.25 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.67 2cqs h VAL 552 Cb -0.00 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2cqs h VAL 552 CO -0.04 0.04 0.26 0.44 0.02 0.00 0.00 177.57 178.29 2cqs h ASP 553 N 0.24 0.67 -0.15 0.57 3.32 -0.76 -1.67 116.42 118.64 2cqs h ASP 553 Ca 0.12 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2cqs h ASP 553 Cb 0.08 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2cqs h ASP 553 CO -0.12 0.57 0.01 -0.33 -1.72 0.00 0.00 179.24 177.65 2cqs h GLU 554 N 0.75 0.27 -0.30 3.56 5.08 -0.28 -1.62 114.58 122.04 2cqs h GLU 554 Ca 0.19 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2cqs h GLU 554 Cb 0.07 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2cqs h GLU 554 CO -0.03 0.47 0.11 0.28 -1.00 0.00 0.00 179.01 178.85 2cqs h VAL 555 N 0.02 1.19 -0.23 3.13 2.07 -0.84 -0.94 116.25 120.65 2cqs h VAL 555 Ca 0.04 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 2cqs h VAL 555 Cb 0.35 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2cqs h VAL 555 CO 0.01 0.20 -0.08 0.08 0.02 0.00 0.00 177.57 177.80 2cqs h ARG 556 N 0.33 0.35 -0.67 1.57 0.11 -1.33 -1.05 114.38 113.69 2cqs h ARG 556 Ca 0.10 -0.08 -0.07 0.00 0.10 0.00 0.00 59.98 60.03 2cqs h ARG 556 Cb 0.21 -0.05 -0.03 0.00 1.11 0.00 0.00 29.97 31.21 2cqs h ARG 556 CO -0.01 0.45 0.14 0.00 0.10 0.00 0.00 179.97 180.65 2cqs h ALA 557 N 1.59 0.88 -0.70 0.08 0.00 -0.91 -2.49 119.26 117.71 2cqs h ALA 557 Ca 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2cqs h ALA 557 Cb 0.36 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2cqs h ALA 557 CO 0.02 0.62 0.24 0.00 0.00 0.00 0.00 179.25 180.13 2cqs h ALA 558 N 1.06 1.11 -0.31 0.00 0.00 0.01 -0.16 119.26 120.98 2cqs h ALA 558 Ca 0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2cqs h ALA 558 Cb 0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2cqs h ALA 558 CO 0.01 0.62 0.19 0.28 0.00 0.00 0.00 179.25 180.34 2cqs h VAL 559 N 1.02 1.11 -0.21 0.00 2.07 -0.88 0.99 116.25 120.35 2cqs h VAL 559 Ca 0.23 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.39 2cqs h VAL 559 Cb 0.25 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2cqs h VAL 559 CO -0.01 0.10 -0.36 -0.07 0.02 0.00 0.00 177.57 177.26 2cqs h LEU 560 N 0.40 0.46 0.06 2.57 3.38 -1.20 0.47 115.31 121.45 2cqs h LEU 560 Ca 0.11 -0.18 -0.30 0.00 0.09 0.00 0.00 57.88 57.60 2cqs h LEU 560 Cb 0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2cqs h LEU 560 CO -0.02 0.78 -1.61 -0.08 0.09 0.00 0.00 178.44 177.60 2cqs h GLU 561 N 0.38 0.12 0.00 1.13 4.81 -0.69 -3.40 114.58 116.93 2cqs h GLU 561 Ca 0.04 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 2cqs h GLU 561 Cb 0.80 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.26 2cqs h GLU 561 CO 0.06 0.87 0.00 0.72 -0.73 0.00 0.00 179.01 179.93 2cqs n HIS 562 N -3.28 0.00 -0.95 0.92 8.25 0.34 -4.74 115.22 115.76 2cqs n HIS 562 Ca -0.17 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.38 2cqs n HIS 562 Cb 1.03 0.00 0.24 0.00 1.12 0.00 0.00 29.99 32.39 2cqs n HIS 562 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cqs n GLY 563 N 0.32 4.04 3.37 -1.41 0.00 0.16 -4.94 105.19 106.74 2cqs n GLY 563 Ca 0.00 -1.01 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 2cqs n GLY 563 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2cqs s TRP 564 N -2.73 2.87 -0.29 1.61 -0.11 -1.12 -0.07 118.94 119.10 2cqs s TRP 564 Ca 0.40 -0.66 0.22 0.00 1.22 0.00 0.00 56.10 57.28 2cqs s TRP 564 Cb 0.32 -1.91 -0.12 0.00 -1.50 0.00 0.00 33.47 30.26 2cqs s TRP 564 CO 0.09 -0.25 0.83 -3.47 -4.62 0.00 0.00 176.95 169.52 2cqs n ASP 565 N 3.77 0.48 0.00 5.86 2.03 -0.28 -4.82 116.55 123.58 2cqs n ASP 565 Ca -0.18 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.14 2cqs n ASP 565 Cb 0.52 1.13 0.00 0.00 -0.72 0.00 0.00 41.12 42.06 2cqs n ASP 565 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cqs n GLY 566 N 1.27 3.55 0.00 0.27 0.00 -1.26 -4.83 105.19 104.20 2cqs n GLY 566 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2cqs n GLY 566 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2cqs n GLN 567 N 0.00 1.16 -3.70 1.61 1.13 -1.26 -5.02 117.38 111.30 2cqs n GLN 567 Ca 0.00 -0.96 -0.02 0.00 -1.94 0.00 0.00 57.00 54.08 2cqs n GLN 567 Cb 0.00 -0.91 -0.01 0.00 0.11 0.00 0.00 30.24 29.43 2cqs n GLN 567 CO 0.00 0.00 0.00 1.67 -1.44 0.00 0.00 177.06 177.29 2cqs s TRP 568 N -0.49 -0.10 0.33 1.08 -2.14 -1.26 -3.10 118.94 113.26 2cqs s TRP 568 Ca 0.00 -0.13 -0.25 0.00 2.66 0.00 0.00 56.10 58.38 2cqs s TRP 568 Cb 0.00 0.60 -0.10 0.00 -3.10 0.00 0.00 33.47 30.87 2cqs s TRP 568 CO 0.00 -0.63 0.94 -0.06 -2.66 0.00 0.00 176.95 174.55 2cqs s PHE 569 N -2.98 3.65 0.58 1.66 0.08 -1.26 -1.13 117.98 118.59 2cqs s PHE 569 Ca 0.13 1.76 -0.17 0.00 0.12 0.00 0.00 56.93 58.77 2cqs s PHE 569 Cb 0.01 -2.91 -0.04 0.00 -0.57 0.00 0.00 43.02 39.51 2cqs s PHE 569 CO -0.00 0.18 1.08 -1.17 -0.10 0.00 0.00 175.22 175.21 2cqs s LEU 570 N -2.17 3.57 -0.07 -0.37 2.96 0.90 -4.73 118.68 118.77 2cqs s LEU 570 Ca 0.51 1.94 0.01 0.00 -0.22 0.00 0.00 54.13 56.37 2cqs s LEU 570 Cb -0.18 -4.55 -0.25 0.00 0.50 0.00 0.00 46.19 41.71 2cqs s LEU 570 CO 0.23 -1.23 0.56 -0.09 -1.32 0.00 0.00 176.35 174.49 2cqs h ARG 571 N 0.64 0.17 0.00 1.98 9.65 -1.06 -3.43 114.38 122.33 2cqs h ARG 571 Ca -0.48 -0.29 0.00 0.00 -1.10 0.00 0.00 59.98 58.11 2cqs h ARG 571 Cb 1.23 0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.92 2cqs h ARG 571 CO 0.57 0.95 0.00 0.00 2.80 0.00 0.00 179.97 184.28 2cqs n ALA 572 N -2.79 0.00 -3.68 2.80 0.00 -0.94 -2.20 120.51 113.70 2cqs n ALA 572 Ca -0.24 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.89 2cqs n ALA 572 Cb 1.05 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 20.33 2cqs n ALA 572 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2cqs s TYR 573 N -2.10 2.36 1.11 0.00 1.51 -0.24 0.11 117.35 120.11 2cqs s TYR 573 Ca 0.00 -1.17 -0.19 0.00 -1.01 0.00 0.00 57.07 54.70 2cqs s TYR 573 Cb 0.00 -1.65 0.27 0.00 -0.11 0.00 0.00 41.96 40.48 2cqs s TYR 573 CO 0.00 -0.56 1.00 -0.40 -1.11 0.00 0.00 175.55 174.47 2cqs n ASP 574 N 4.16 -1.93 -0.16 2.29 3.85 0.98 -0.44 116.55 125.31 2cqs n ASP 574 Ca -0.19 -1.12 0.19 0.00 -0.71 0.00 0.00 54.79 52.95 2cqs n ASP 574 Cb 0.51 -0.91 0.56 0.00 -1.35 0.00 0.00 41.12 39.93 2cqs n ASP 574 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.20 176.41 2cqs h TYR 575 N -2.59 0.38 0.00 2.11 5.03 -1.87 -0.16 116.97 119.87 2cqs h TYR 575 Ca -0.37 0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.95 2cqs h TYR 575 Cb 1.14 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 39.30 2cqs h TYR 575 CO 0.00 0.13 -0.18 0.66 -1.32 0.00 0.00 178.16 177.45 2cqs n TYR 576 N -4.45 0.55 -0.06 -3.82 4.01 -1.26 -2.35 117.16 109.78 2cqs n TYR 576 Ca 0.16 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 58.06 2cqs n TYR 576 Cb 0.64 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 2cqs n TYR 576 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2cqs n GLY 577 N 1.38 0.84 3.85 2.72 0.00 -0.08 -4.95 105.19 108.95 2cqs n GLY 577 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 2cqs n GLY 577 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cqs s ASN 578 N -2.29 6.80 0.29 1.61 0.02 -1.26 -4.76 114.94 115.36 2cqs s ASN 578 Ca 0.00 1.30 -0.29 0.00 -1.02 0.00 0.00 52.86 52.86 2cqs s ASN 578 Cb 0.00 -2.38 -0.10 0.00 0.02 0.00 0.00 41.25 38.79 2cqs s ASN 578 CO 0.00 -0.20 1.11 -2.16 0.02 0.00 0.00 177.10 175.87 2cqs s PRO 579 N -2.93 4.57 -0.13 -0.60 0.04 -1.26 -0.01 135.00 134.68 2cqs s PRO 579 Ca 0.54 1.81 -0.00 0.00 0.04 0.00 0.00 61.00 63.38 2cqs s PRO 579 Cb -0.11 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.30 2cqs s PRO 579 CO 0.17 0.15 -0.13 0.08 0.04 0.00 0.00 177.00 177.31 2cqs s VAL 580 N -1.21 3.03 0.00 -0.36 1.01 0.31 -4.67 120.40 118.52 2cqs s VAL 580 Ca 0.46 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2cqs s VAL 580 Cb -0.32 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.79 2cqs s VAL 580 CO 0.41 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.64 2cqs n GLY 581 N 3.52 0.65 3.44 4.51 0.00 -1.23 -0.69 105.19 115.38 2cqs n GLY 581 Ca -0.18 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 2cqs n GLY 581 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2cqs s THR 582 N -2.64 2.39 -1.17 2.61 -1.32 -0.97 -4.10 115.64 110.44 2cqs s THR 582 Ca 0.00 -2.16 0.17 0.00 -1.21 0.00 0.00 61.69 58.49 2cqs s THR 582 Cb 0.00 -2.18 0.21 0.00 -1.51 0.00 0.00 72.50 69.01 2cqs s THR 582 CO 0.00 -0.22 1.53 -0.67 -2.21 0.00 0.00 174.62 173.06 2cqs n ASP 583 N -0.04 0.00 0.24 8.08 4.64 -1.26 -2.52 116.55 125.69 2cqs n ASP 583 Ca -0.10 0.31 0.16 0.00 -1.38 0.00 0.00 54.79 53.78 2cqs n ASP 583 Cb 0.57 -0.41 0.61 0.00 -1.04 0.00 0.00 41.12 40.85 2cqs n ASP 583 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2cqs h ALA 584 N 2.68 1.00 -2.69 -1.67 0.00 -1.95 -3.44 119.26 113.20 2cqs h ALA 584 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2cqs h ALA 584 Cb 0.24 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2cqs h ALA 584 CO 0.00 0.00 -0.49 0.15 0.00 0.00 0.00 179.25 178.91 2cqs s LYS 585 N -3.56 3.37 0.28 0.00 -0.14 -1.05 -5.03 119.74 113.61 2cqs s LYS 585 Ca 0.02 -0.58 0.12 0.00 -1.36 0.00 0.00 55.97 54.17 2cqs s LYS 585 Cb 0.09 -2.95 0.34 0.00 -1.68 0.00 0.00 37.83 33.63 2cqs s LYS 585 CO 0.53 0.54 1.59 -1.00 -0.76 0.00 0.00 175.35 176.25 2cqs h PRO 586 N 2.46 0.00 -5.39 -1.68 0.13 -1.88 -3.43 132.00 122.21 2cqs h PRO 586 Ca -0.47 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.24 2cqs h PRO 586 Cb 1.18 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.12 2cqs h PRO 586 CO 0.70 0.61 -0.76 -1.21 -0.23 0.00 0.00 178.00 177.11 2cqs s GLU 587 N -3.48 0.97 -1.11 0.86 2.02 -1.26 -4.60 118.70 112.11 2cqs s GLU 587 Ca -0.01 -1.17 -0.06 0.00 0.02 0.00 0.00 54.97 53.75 2cqs s GLU 587 Cb 0.12 -0.87 0.01 0.00 0.10 0.00 0.00 34.13 33.48 2cqs s GLU 587 CO 0.75 0.17 0.82 0.41 0.02 0.00 0.00 175.26 177.43 2cqs n GLY 588 N 0.70 -0.23 0.17 -1.39 0.00 0.11 -4.80 105.19 99.75 2cqs n GLY 588 Ca -0.17 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2cqs n GLY 588 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cqs h LYS 589 N -1.86 0.51 -4.24 1.61 1.57 -1.34 -3.27 116.57 109.54 2cqs h LYS 589 Ca -0.44 -0.07 -0.47 0.00 -1.87 0.00 0.00 60.65 57.80 2cqs h LYS 589 Cb 1.29 -0.09 -0.35 0.00 0.08 0.00 0.00 32.23 33.16 2cqs h LYS 589 CO 0.44 0.44 -0.79 -1.50 -0.57 0.00 0.00 179.45 177.47 2cqs s ILE 590 N -5.77 0.85 -0.05 1.86 2.07 -0.97 -2.30 121.20 116.88 2cqs s ILE 590 Ca -0.13 -0.27 -0.01 0.00 -1.41 0.00 0.00 60.65 58.83 2cqs s ILE 590 Cb 0.10 -0.83 -0.03 0.00 0.13 0.00 0.00 42.46 41.82 2cqs s ILE 590 CO 0.73 0.30 0.02 0.26 -1.91 0.00 0.00 174.94 174.34 2cqs s TRP 591 N 1.04 3.16 0.15 3.50 0.52 -1.26 -2.05 118.94 124.00 2cqs s TRP 591 Ca -0.08 0.17 -0.03 0.00 0.02 0.00 0.00 56.10 56.18 2cqs s TRP 591 Cb -0.14 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.41 2cqs s TRP 591 CO -0.00 0.48 1.38 0.97 0.02 0.00 0.00 176.95 179.80 2cqs h ILE 592 N 3.86 1.38 -0.26 2.03 2.10 -0.92 -3.39 117.51 122.32 2cqs h ILE 592 Ca -0.50 -2.25 0.03 0.00 1.08 0.00 0.00 64.86 63.22 2cqs h ILE 592 Cb 1.19 2.22 -0.06 0.00 -1.09 0.00 0.00 36.82 39.08 2cqs h ILE 592 CO 0.56 0.68 -0.44 -0.33 -1.08 0.00 0.00 178.15 177.53 2cqs h GLU 593 N 0.27 -0.35 0.00 2.19 3.07 -1.92 -2.12 114.58 115.72 2cqs h GLU 593 Ca -0.05 0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 2cqs h GLU 593 Cb 1.41 0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 29.40 2cqs h GLU 593 CO 0.14 -0.24 -0.16 -1.00 -1.40 0.00 0.00 179.01 176.35 2cqs h PRO 594 N -0.37 0.00 -0.16 2.33 0.13 -1.89 -1.37 132.00 130.67 2cqs h PRO 594 Ca 0.05 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2cqs h PRO 594 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 2cqs h PRO 594 CO -0.44 0.16 0.09 1.96 -0.23 0.00 0.00 178.00 179.54 2cqs h GLN 595 N 0.00 0.22 -0.04 0.86 1.08 -1.58 0.14 115.11 115.79 2cqs h GLN 595 Ca -0.00 -0.03 -0.08 0.00 -1.45 0.00 0.00 58.65 57.09 2cqs h GLN 595 Cb 0.33 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.72 2cqs h GLN 595 CO 0.02 0.23 -0.30 0.78 -0.95 0.00 0.00 178.83 178.61 2cqs h GLY 596 N 0.15 0.31 1.83 3.46 0.00 -1.20 -3.19 103.07 104.42 2cqs h GLY 596 Ca 0.06 -0.46 -0.15 0.00 0.00 0.00 0.00 47.33 46.78 2cqs h GLY 596 CO -0.01 0.41 -0.62 -2.75 0.00 0.00 0.00 176.54 173.56 2cqs h PHE 597 N -0.27 0.23 -0.44 5.60 3.04 -1.26 -1.66 116.94 122.17 2cqs h PHE 597 Ca -0.03 -0.09 -0.10 0.00 3.98 0.00 0.00 57.97 61.74 2cqs h PHE 597 Cb 0.98 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.44 2cqs h PHE 597 CO 0.14 0.75 -0.10 0.00 -2.02 0.00 0.00 178.31 177.09 2cqs h ALA 598 N 1.23 0.61 -0.11 2.41 0.00 -0.84 -1.80 119.26 120.76 2cqs h ALA 598 Ca -0.01 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.44 2cqs h ALA 598 Cb 1.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2cqs h ALA 598 CO 0.09 0.49 -0.51 0.28 0.00 0.00 0.00 179.25 179.60 2cqs h VAL 599 N 0.68 1.34 -0.30 0.00 2.07 -1.53 -0.23 116.25 118.28 2cqs h VAL 599 Ca 0.11 -1.76 -0.04 0.00 0.82 0.00 0.00 66.70 65.83 2cqs h VAL 599 Cb 0.63 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 2cqs h VAL 599 CO 0.04 0.53 0.00 0.24 0.02 0.00 0.00 177.57 178.41 2cqs h MET 600 N 0.24 0.45 0.00 1.57 2.07 -1.09 0.13 114.93 118.31 2cqs h MET 600 Ca 0.01 -0.09 0.00 0.00 -2.07 0.00 0.00 59.70 57.55 2cqs h MET 600 Cb 0.99 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 30.64 2cqs h MET 600 CO 0.08 0.48 0.00 0.00 1.07 0.00 0.00 176.91 178.54 2cqs n ALA 601 N -2.48 2.33 -0.62 6.32 0.00 -0.69 -4.90 120.51 120.47 2cqs n ALA 601 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2cqs n ALA 601 Cb 0.22 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.22 2cqs n ALA 601 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqs n GLY 602 N 1.20 0.74 3.67 0.00 0.00 0.46 -4.80 105.19 106.46 2cqs n GLY 602 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2cqs n GLY 602 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cqs s ILE 603 N -2.52 3.93 0.00 -0.61 1.01 -0.14 -3.06 121.20 119.81 2cqs s ILE 603 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 60.65 61.84 2cqs s ILE 603 Cb 0.00 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.71 2cqs s ILE 603 CO 0.00 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.48 2cqs n GLY 604 N 3.76 0.61 3.74 6.18 0.00 -1.26 -4.25 105.19 113.96 2cqs n GLY 604 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2cqs n GLY 604 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cqs s VAL 605 N -2.09 4.02 0.00 1.61 1.01 -1.17 -0.87 120.40 122.90 2cqs s VAL 605 Ca 0.00 1.73 0.00 0.00 0.00 0.00 0.00 61.98 63.71 2cqs s VAL 605 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.27 2cqs s VAL 605 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2cqs n GLY 606 N 2.09 3.33 0.29 4.51 0.00 -1.26 -4.98 105.19 109.16 2cqs n GLY 606 Ca 0.03 -1.86 -0.04 0.00 0.00 0.00 0.00 46.02 44.14 2cqs n GLY 606 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2cqs h GLU 607 N 0.00 0.94 0.00 1.61 5.08 -1.96 -3.48 114.58 116.77 2cqs h GLU 607 Ca 0.00 -0.06 0.34 0.00 -1.00 0.00 0.00 59.36 58.64 2cqs h GLU 607 Cb 0.00 -0.21 -0.06 0.00 0.50 0.00 0.00 28.75 28.98 2cqs h GLU 607 CO 0.00 0.62 0.88 0.41 -1.00 0.00 0.00 179.01 179.91 2cqs n GLY 608 N -1.30 0.22 0.17 -3.84 0.00 -1.26 -5.00 105.19 94.18 2cqs n GLY 608 Ca 0.08 -1.03 0.12 0.00 0.00 0.00 0.00 46.02 45.18 2cqs n GLY 608 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqs h PRO 609 N 0.00 0.00 -0.02 1.61 0.13 -1.79 -0.61 132.00 131.32 2cqs h PRO 609 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2cqs h PRO 609 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2cqs h PRO 609 CO 0.29 0.00 -0.04 -3.47 -0.23 0.00 0.00 178.00 174.56 2cqs n ASP 610 N -2.31 2.37 -4.37 1.44 2.03 -1.26 -4.69 116.55 109.76 2cqs n ASP 610 Ca -0.01 -1.77 -0.43 0.00 0.52 0.00 0.00 54.79 53.10 2cqs n ASP 610 Cb 0.05 0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 2cqs n ASP 610 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2cqs n ASP 611 N 0.81 4.92 0.00 1.67 -0.08 -0.24 -4.80 116.55 118.83 2cqs n ASP 611 Ca 0.15 -2.95 0.00 0.00 -1.51 0.00 0.00 54.79 50.49 2cqs n ASP 611 Cb 0.50 -1.65 0.02 0.00 2.34 0.00 0.00 41.12 42.32 2cqs n ASP 611 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2cqs n ALA 612 N 6.79 1.52 0.87 -1.67 0.00 -1.26 -1.53 120.51 125.22 2cqs n ALA 612 Ca 0.44 -0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.97 2cqs n ALA 612 Cb 0.43 -1.01 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 2cqs n ALA 612 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2cqs n ASP 613 N -1.00 1.22 -4.74 0.00 9.92 -1.26 -4.62 116.55 116.06 2cqs n ASP 613 Ca 0.00 -1.11 -0.41 0.00 -0.53 0.00 0.00 54.79 52.75 2cqs n ASP 613 Cb 0.00 0.81 -0.04 0.00 -0.64 0.00 0.00 41.12 41.25 2cqs n ASP 613 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cqs s ALA 614 N -2.54 3.39 0.17 2.24 0.00 -0.58 -4.94 121.76 119.50 2cqs s ALA 614 Ca 0.10 0.85 -0.16 0.00 0.00 0.00 0.00 51.96 52.75 2cqs s ALA 614 Cb 0.15 -3.35 0.11 0.00 0.00 0.00 0.00 23.12 20.03 2cqs s ALA 614 CO 0.66 -0.20 1.68 -1.35 0.00 0.00 0.00 175.76 176.54 2cqs h PRO 615 N 4.71 0.03 -0.68 0.00 0.11 -1.86 -1.63 132.00 132.69 2cqs h PRO 615 Ca -0.45 -0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.80 2cqs h PRO 615 Cb 1.21 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.21 2cqs h PRO 615 CO 0.71 0.02 0.12 0.00 -0.21 0.00 0.00 178.00 178.64 2cqs h ALA 616 N 1.40 0.81 -0.43 -0.75 0.00 -1.22 0.26 119.26 119.31 2cqs h ALA 616 Ca 0.20 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 2cqs h ALA 616 Cb 0.30 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2cqs h ALA 616 CO -0.40 -0.35 0.01 0.28 0.00 0.00 0.00 179.25 178.79 2cqs h VAL 617 N 0.22 1.26 -0.24 0.00 2.07 -1.59 -1.09 116.25 116.88 2cqs h VAL 617 Ca 0.37 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 2cqs h VAL 617 Cb 0.61 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 2cqs h VAL 617 CO -0.50 0.35 0.15 0.11 0.02 0.00 0.00 177.57 177.70 2cqs h LYS 618 N 0.60 0.33 0.22 1.57 1.57 -0.35 0.53 116.57 121.04 2cqs h LYS 618 Ca 0.12 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2cqs h LYS 618 Cb 0.48 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2cqs h LYS 618 CO 0.02 0.25 -0.19 0.00 -0.57 0.00 0.00 179.45 178.96 2cqs h ALA 619 N 1.06 -0.41 -0.26 3.86 0.00 -0.42 0.56 119.26 123.66 2cqs h ALA 619 Ca 0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2cqs h ALA 619 Cb 0.01 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2cqs h ALA 619 CO -0.02 -0.75 0.08 -0.07 0.00 0.00 0.00 179.25 178.49 2cqs h LEU 620 N -0.43 0.32 -0.59 0.00 3.38 -1.09 0.11 115.31 117.01 2cqs h LEU 620 Ca -0.01 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.80 2cqs h LEU 620 Cb 0.39 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2cqs h LEU 620 CO -0.03 0.32 -0.27 0.44 0.09 0.00 0.00 178.44 178.99 2cqs h ASP 621 N 0.36 0.86 -0.55 -0.43 3.45 -0.36 -0.81 116.42 118.94 2cqs h ASP 621 Ca 0.09 -0.34 -0.11 0.00 0.43 0.00 0.00 57.03 57.10 2cqs h ASP 621 Cb 0.12 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.63 2cqs h ASP 621 CO -0.01 1.08 -0.09 0.28 -1.57 0.00 0.00 179.24 178.93 2cqs h SER 622 N 0.71 1.03 -0.21 6.45 0.02 0.28 -2.09 113.55 119.75 2cqs h SER 622 Ca 0.09 -0.35 0.03 0.00 -0.84 0.00 0.00 61.79 60.72 2cqs h SER 622 Cb 0.82 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.05 2cqs h SER 622 CO 0.07 1.13 0.03 0.58 -1.14 0.00 0.00 176.83 177.51 2cqs h VAL 623 N 0.91 0.90 -0.26 2.27 2.07 -0.51 0.26 116.25 121.88 2cqs h VAL 623 Ca 0.14 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.66 2cqs h VAL 623 Cb 0.66 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 2cqs h VAL 623 CO 0.05 0.02 0.07 -1.13 0.02 0.00 0.00 177.57 176.60 2cqs h ASN 624 N 0.11 0.06 -0.08 0.57 -1.24 -0.96 0.02 115.58 114.07 2cqs h ASN 624 Ca 0.10 0.03 -0.04 0.00 0.71 0.00 0.00 56.30 57.10 2cqs h ASN 624 Cb 0.10 0.04 -0.00 0.00 0.73 0.00 0.00 38.32 39.18 2cqs h ASN 624 CO -0.13 0.06 -0.09 -0.08 -1.29 0.00 0.00 177.43 175.90 2cqs h GLU 625 N 0.18 0.20 0.00 6.67 4.57 -1.17 -2.94 114.58 122.08 2cqs h GLU 625 Ca 0.12 -0.11 -0.22 0.00 -1.18 0.00 0.00 59.36 57.97 2cqs h GLU 625 Cb 0.10 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 2cqs h GLU 625 CO -0.14 0.65 -1.56 -1.33 -1.18 0.00 0.00 179.01 175.45 2cqs n MET 626 N -4.68 0.63 0.00 1.92 2.81 0.06 -4.43 117.12 113.43 2cqs n MET 626 Ca -0.07 0.25 0.07 0.00 -1.81 0.00 0.00 57.70 56.13 2cqs n MET 626 Cb 0.33 -1.79 -0.06 0.00 -0.71 0.00 0.00 33.22 30.98 2cqs n MET 626 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 2cqs n LEU 627 N -2.94 0.80 -4.73 4.03 4.77 -0.02 -4.79 117.00 114.11 2cqs n LEU 627 Ca -0.13 -0.55 -0.41 0.00 -0.03 0.00 0.00 56.01 54.89 2cqs n LEU 627 Cb 0.93 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.98 2cqs n LEU 627 CO 0.44 0.18 0.79 -0.83 -1.33 0.00 0.00 177.39 176.65 2cqs s GLY 628 N -2.19 2.80 0.09 -0.72 0.00 -1.11 -1.21 107.32 104.99 2cqs s GLY 628 Ca 0.06 0.80 -0.03 0.00 0.00 0.00 0.00 44.72 45.55 2cqs s GLY 628 CO 0.52 1.70 0.06 -0.51 0.00 0.00 0.00 173.10 174.87 2cqs s THR 629 N -0.02 0.15 -0.63 0.90 -4.23 -0.55 -4.97 115.64 106.29 2cqs s THR 629 Ca 0.50 -1.72 0.16 0.00 -1.18 0.00 0.00 61.69 59.46 2cqs s THR 629 Cb -0.29 -1.71 0.16 0.00 1.34 0.00 0.00 72.50 72.00 2cqs s THR 629 CO 0.34 -0.69 1.49 -0.81 -0.54 0.00 0.00 174.62 174.41 2cqs n PRO 630 N -0.02 0.10 0.00 3.99 -0.04 -1.26 -2.12 135.00 135.65 2cqs n PRO 630 Ca -0.10 0.46 0.11 0.00 -0.04 0.00 0.00 63.50 63.92 2cqs n PRO 630 Cb 0.62 -1.73 0.07 0.00 -0.04 0.00 0.00 33.50 32.42 2cqs n PRO 630 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2cqs n HIS 631 N -1.92 0.00 0.00 0.54 8.25 -1.26 -4.81 115.22 116.01 2cqs n HIS 631 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2cqs n HIS 631 Cb 0.12 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.23 2cqs n HIS 631 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cqs n GLY 632 N 1.31 0.90 3.46 -1.41 0.00 -0.90 -4.40 105.19 104.16 2cqs n GLY 632 Ca 0.12 -1.95 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 2cqs n GLY 632 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cqs s LEU 633 N 0.00 3.40 0.61 0.99 1.43 -1.26 -1.49 118.68 122.37 2cqs s LEU 633 Ca 0.00 -0.18 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 2cqs s LEU 633 Cb 0.00 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 2cqs s LEU 633 CO 0.00 0.02 1.11 0.68 0.23 0.00 0.00 176.35 178.40 2cqs s VAL 634 N 1.25 3.27 0.11 -1.59 -7.23 -0.35 -4.28 120.40 111.59 2cqs s VAL 634 Ca 0.04 0.66 -0.21 0.00 -1.81 0.00 0.00 61.98 60.67 2cqs s VAL 634 Cb -0.15 -3.19 -0.09 0.00 0.56 0.00 0.00 36.38 33.51 2cqs s VAL 634 CO 0.02 -0.30 1.77 0.25 -0.31 0.00 0.00 175.10 176.53 2cqs h LEU 635 N 0.48 0.16 -8.00 1.32 6.46 -1.45 -3.43 115.31 110.85 2cqs h LEU 635 Ca -0.48 -0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.21 2cqs h LEU 635 Cb 1.25 -0.04 -0.11 0.00 -0.73 0.00 0.00 40.66 41.03 2cqs h LEU 635 CO 0.55 0.12 -0.18 0.00 -0.62 0.00 0.00 178.44 178.32 2cqs s GLN 636 N -6.18 1.31 -0.15 1.25 0.00 -1.26 -0.28 119.66 114.35 2cqs s GLN 636 Ca -0.13 -1.11 -0.11 0.00 -0.00 0.00 0.00 55.36 54.01 2cqs s GLN 636 Cb 0.08 0.44 0.05 0.00 0.00 0.00 0.00 33.01 33.57 2cqs s GLN 636 CO 0.68 -0.52 0.38 -0.47 0.00 0.00 0.00 175.29 175.36 2cqs s TYR 637 N -3.95 -0.48 0.66 9.60 5.04 -0.87 -4.26 117.35 123.09 2cqs s TYR 637 Ca 0.16 1.10 -0.11 0.00 -2.44 0.00 0.00 57.07 55.79 2cqs s TYR 637 Cb 0.01 0.18 -0.01 0.00 0.35 0.00 0.00 41.96 42.50 2cqs s TYR 637 CO 0.01 -0.26 1.06 -2.14 -1.34 0.00 0.00 175.55 172.88 2cqs s PRO 638 N 0.75 3.16 0.54 4.97 0.02 -1.26 -1.18 135.00 142.00 2cqs s PRO 638 Ca -0.04 0.55 -0.19 0.00 0.02 0.00 0.00 61.00 61.34 2cqs s PRO 638 Cb -0.06 -2.06 -0.06 0.00 0.02 0.00 0.00 34.50 32.35 2cqs s PRO 638 CO -0.05 -0.83 1.09 0.00 -0.33 0.00 0.00 177.00 176.88 2cqs s ALA 639 N -3.27 2.74 0.12 -1.55 0.00 -1.26 0.10 121.76 118.63 2cqs s ALA 639 Ca 0.57 0.69 -0.31 0.00 0.00 0.00 0.00 51.96 52.91 2cqs s ALA 639 Cb -0.11 -3.31 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 2cqs s ALA 639 CO 0.52 -0.66 1.29 0.71 0.00 0.00 0.00 175.76 177.62 2cqs s TYR 640 N -1.95 3.34 -1.60 0.00 2.02 -1.26 -4.71 117.35 113.19 2cqs s TYR 640 Ca 0.70 1.17 0.20 0.00 -0.37 0.00 0.00 57.07 58.77 2cqs s TYR 640 Cb -0.20 -3.55 -0.06 0.00 -0.40 0.00 0.00 41.96 37.75 2cqs s TYR 640 CO 0.27 -1.77 0.96 0.25 -1.57 0.00 0.00 175.55 173.68 2cqs n THR 641 N 3.59 0.00 -3.98 -0.71 -2.24 -1.26 -4.44 114.28 105.23 2cqs n THR 641 Ca 0.09 -0.22 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 2cqs n THR 641 Cb 0.44 1.17 -0.10 0.00 -2.10 0.00 0.00 70.33 69.74 2cqs n THR 641 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cqs s THR 642 N -2.43 0.13 0.10 4.28 -4.23 -1.26 -5.06 115.64 107.17 2cqs s THR 642 Ca 0.14 -1.09 -0.31 0.00 -1.18 0.00 0.00 61.69 59.25 2cqs s THR 642 Cb 0.16 -0.62 -0.10 0.00 1.34 0.00 0.00 72.50 73.28 2cqs s THR 642 CO 0.59 -0.60 1.86 -0.47 -0.54 0.00 0.00 174.62 175.46 2cqs s TYR 643 N -2.11 1.93 -0.62 3.99 6.04 -1.26 -4.91 117.35 120.40 2cqs s TYR 643 Ca -0.10 -0.12 -0.07 0.00 0.04 0.00 0.00 57.07 56.82 2cqs s TYR 643 Cb -0.05 -4.19 0.16 0.00 -1.04 0.00 0.00 41.96 36.84 2cqs s TYR 643 CO -0.03 -5.01 0.48 -0.65 -1.54 0.00 0.00 175.55 168.80 2cqs s GLN 644 N 3.20 2.75 0.44 4.97 -1.52 -1.26 -4.97 119.66 123.27 2cqs s GLN 644 Ca 0.83 -2.26 0.19 0.00 -1.95 0.00 0.00 55.36 52.16 2cqs s GLN 644 Cb -0.45 -3.94 1.14 0.00 -0.22 0.00 0.00 33.01 29.54 2cqs s GLN 644 CO 0.37 -1.20 1.89 0.97 -0.25 0.00 0.00 175.29 177.07 2cqs h ILE 645 N 5.46 0.71 0.00 1.08 2.10 -1.92 -0.42 117.51 124.52 2cqs h ILE 645 Ca -0.05 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.78 2cqs h ILE 645 Cb 1.01 0.35 0.00 0.00 -1.09 0.00 0.00 36.82 37.09 2cqs h ILE 645 CO 0.76 0.06 0.00 -1.84 -1.08 0.00 0.00 178.15 176.06 2cqs n GLU 646 N -4.46 0.32 0.00 2.19 0.00 -1.26 -3.31 120.64 114.12 2cqs n GLU 646 Ca 0.17 0.05 0.08 0.00 0.00 0.00 0.00 57.16 57.46 2cqs n GLU 646 Cb 0.66 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.52 2cqs n GLU 646 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2cqs n LEU 647 N -1.30 0.93 0.00 -1.84 4.77 -0.17 -4.26 117.00 115.13 2cqs n LEU 647 Ca 0.11 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 2cqs n LEU 647 Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2cqs n LEU 647 CO 0.19 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2cqs n GLY 648 N 1.37 0.46 0.22 -0.72 0.00 -1.04 -1.66 105.19 103.81 2cqs n GLY 648 Ca 0.04 -1.01 -0.01 0.00 0.00 0.00 0.00 46.02 45.04 2cqs n GLY 648 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2cqs h GLU 649 N 0.00 0.31 -0.88 1.61 4.81 -1.82 -3.36 114.58 115.25 2cqs h GLU 649 Ca 0.00 -0.11 0.16 0.00 -0.13 0.00 0.00 59.36 59.28 2cqs h GLU 649 Cb 0.00 -0.02 -0.16 0.00 0.63 0.00 0.00 28.75 29.20 2cqs h GLU 649 CO 0.00 0.57 -0.28 -0.24 -0.73 0.00 0.00 179.01 178.34 2cqs h VAL 650 N 0.27 0.09 0.00 0.32 3.04 -1.11 0.74 116.25 119.60 2cqs h VAL 650 Ca 0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.73 2cqs h VAL 650 Cb 0.66 0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.02 2cqs h VAL 650 CO 0.05 0.00 0.00 -1.54 -1.01 0.00 0.00 177.57 175.07 2cqs n SER 651 N -5.53 0.00 0.22 3.17 3.41 -1.26 -3.26 113.62 110.37 2cqs n SER 651 Ca 0.12 -1.16 0.12 0.00 -0.26 0.00 0.00 58.87 57.68 2cqs n SER 651 Cb 0.43 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.54 2cqs n SER 651 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2cqs h THR 652 N 0.00 0.00 -3.65 6.66 1.35 -1.07 -3.40 112.91 112.80 2cqs h THR 652 Ca 0.00 -1.01 -0.51 0.00 -0.55 0.00 0.00 66.41 64.35 2cqs h THR 652 Cb 0.00 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 2cqs h THR 652 CO 0.00 0.00 0.32 -0.31 -0.25 0.00 0.00 175.52 175.29 2cqs s TYR 653 N -3.21 3.91 0.52 4.73 1.51 -1.20 -5.01 117.35 118.60 2cqs s TYR 653 Ca 0.07 1.83 -0.22 0.00 -1.01 0.00 0.00 57.07 57.73 2cqs s TYR 653 Cb 0.05 -2.97 -0.05 0.00 -0.11 0.00 0.00 41.96 38.88 2cqs s TYR 653 CO 0.67 0.38 1.34 -2.14 -1.11 0.00 0.00 175.55 174.69 2cqs s PRO 654 N -0.74 3.28 0.14 -1.71 0.02 -1.26 -4.85 135.00 129.87 2cqs s PRO 654 Ca 0.42 2.19 -0.34 0.00 0.02 0.00 0.00 61.00 63.29 2cqs s PRO 654 Cb -0.25 -2.32 -0.16 0.00 0.02 0.00 0.00 34.50 31.80 2cqs s PRO 654 CO 0.30 -1.07 1.21 -2.30 -0.33 0.00 0.00 177.00 174.81 2cqs n PRO 655 N -0.87 1.10 -0.17 5.54 -0.02 -1.26 -2.65 135.00 136.67 2cqs n PRO 655 Ca 0.09 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2cqs n PRO 655 Cb 0.45 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 2cqs n PRO 655 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cqs n GLY 656 N 2.16 0.66 3.30 -1.23 0.00 0.30 -3.81 105.19 106.56 2cqs n GLY 656 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2cqs n GLY 656 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cqs s TYR 657 N -2.42 2.16 0.00 1.61 1.51 -1.08 -0.39 117.35 118.74 2cqs s TYR 657 Ca 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.66 2cqs s TYR 657 Cb 0.00 -1.33 0.00 0.00 -0.11 0.00 0.00 41.96 40.52 2cqs s TYR 657 CO 0.00 0.06 0.00 1.63 -1.11 0.00 0.00 175.55 176.13 2cqs n LYS 658 N 2.05 0.00 0.00 -0.62 4.76 -1.26 -2.04 118.16 121.05 2cqs n LYS 658 Ca -0.16 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.36 2cqs n LYS 658 Cb 0.52 0.00 0.43 0.00 -1.84 0.00 0.00 35.03 34.14 2cqs n LYS 658 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2cqs n GLU 659 N 14.00 0.29 -3.53 1.97 4.71 -1.26 -1.72 120.64 135.10 2cqs n GLU 659 Ca 0.00 0.11 -0.35 0.00 -0.01 0.00 0.00 57.16 56.91 2cqs n GLU 659 Cb 0.00 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 28.87 2cqs n GLU 659 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2cqs n ASN 660 N -1.23 4.37 0.00 1.62 4.05 -0.87 -4.70 115.26 118.50 2cqs n ASN 660 Ca 0.09 -3.24 0.00 0.00 0.45 0.00 0.00 54.58 51.88 2cqs n ASN 660 Cb 0.12 -0.99 0.00 0.00 1.23 0.00 0.00 39.78 40.13 2cqs n ASN 660 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2cqs n GLY 661 N 1.87 0.75 3.90 8.20 0.00 -1.26 -0.54 105.19 118.12 2cqs n GLY 661 Ca 0.24 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.98 2cqs n GLY 661 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cqs s GLY 662 N -1.51 1.57 -0.72 -0.02 0.00 -0.70 -3.80 107.32 102.14 2cqs s GLY 662 Ca 0.00 -0.48 -0.22 0.00 0.00 0.00 0.00 44.72 44.02 2cqs s GLY 662 CO 0.00 -0.24 1.03 -0.42 0.00 0.00 0.00 173.10 173.47 2cqs s ILE 663 N -2.96 4.34 -1.14 0.90 1.01 0.16 -1.33 121.20 122.18 2cqs s ILE 663 Ca 0.52 -0.52 -0.16 0.00 0.00 0.00 0.00 60.65 60.48 2cqs s ILE 663 Cb -0.11 -4.73 0.14 0.00 0.01 0.00 0.00 42.46 37.78 2cqs s ILE 663 CO 0.47 -1.51 1.40 0.12 0.00 0.00 0.00 174.94 175.42 2cqs s PHE 664 N 3.98 3.25 0.35 3.97 5.36 -1.26 -1.54 117.98 132.09 2cqs s PHE 664 Ca 0.25 -1.80 0.25 0.00 -0.96 0.00 0.00 56.93 54.68 2cqs s PHE 664 Cb -0.14 -4.39 1.21 0.00 -0.34 0.00 0.00 43.02 39.36 2cqs s PHE 664 CO 0.07 -1.51 1.28 0.00 -1.46 0.00 0.00 175.22 173.60 2cqs h HIS 666 N 0.00 1.04 -0.01 0.00 6.17 -1.87 -0.95 115.15 119.54 2cqs h HIS 666 Ca 0.72 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.83 2cqs h HIS 666 Cb 2.26 -0.31 0.00 0.00 2.52 0.00 0.00 27.41 31.89 2cqs h HIS 666 CO -0.01 0.15 -0.20 0.27 0.71 0.00 0.00 177.93 178.85 2cqs n ASN 667 N -4.83 0.91 -0.13 3.26 0.23 -0.49 -4.11 115.26 110.09 2cqs n ASN 667 Ca 0.25 -0.84 -0.08 0.00 -0.53 0.00 0.00 54.58 53.38 2cqs n ASN 667 Cb 0.66 0.07 0.08 0.00 -2.08 0.00 0.00 39.78 38.51 2cqs n ASN 667 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2cqs h ASN 668 N 1.11 0.88 0.28 0.53 4.21 -1.30 -2.84 115.58 118.44 2cqs h ASN 668 Ca 0.00 -0.28 -0.01 0.00 1.21 0.00 0.00 56.30 57.22 2cqs h ASN 668 Cb 0.47 -0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 37.43 2cqs h ASN 668 CO 0.00 1.01 -0.04 -0.65 -1.29 0.00 0.00 177.43 176.46 2cqs h PRO 669 N 0.79 0.00 -0.40 0.81 0.11 -1.71 -1.38 132.00 130.22 2cqs h PRO 669 Ca 0.13 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.11 2cqs h PRO 669 Cb 0.64 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 2cqs h PRO 669 CO 0.04 0.04 -0.27 -1.49 -0.21 0.00 0.00 178.00 176.11 2cqs h TRP 670 N 0.00 0.97 -0.07 0.65 6.55 -1.75 0.44 115.95 122.74 2cqs h TRP 670 Ca -0.00 -0.24 -0.17 0.00 0.95 0.00 0.00 58.89 59.43 2cqs h TRP 670 Cb 0.19 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.26 2cqs h TRP 670 CO 0.00 1.01 -0.68 0.28 -1.05 0.00 0.00 178.44 178.01 2cqs h VAL 671 N 0.72 1.39 0.11 1.49 2.07 -1.37 -0.54 116.25 120.11 2cqs h VAL 671 Ca 0.09 -2.10 -0.01 0.00 0.82 0.00 0.00 66.70 65.50 2cqs h VAL 671 Cb 0.82 2.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 2cqs h VAL 671 CO 0.07 0.62 -0.05 0.40 0.02 0.00 0.00 177.57 178.63 2cqs h ILE 672 N 0.22 0.98 -0.67 4.57 2.04 -0.96 -0.58 117.51 123.12 2cqs h ILE 672 Ca -0.02 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2cqs h ILE 672 Cb 1.22 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 2cqs h ILE 672 CO 0.11 0.08 0.38 0.40 0.00 0.00 0.00 178.15 179.12 2cqs h ILE 673 N -0.29 1.21 -0.76 -0.67 2.04 -0.88 -2.29 117.51 115.86 2cqs h ILE 673 Ca -0.01 -0.51 0.06 0.00 1.00 0.00 0.00 64.86 65.39 2cqs h ILE 673 Cb 0.24 0.32 -0.06 0.00 -0.74 0.00 0.00 36.82 36.59 2cqs h ILE 673 CO 0.02 0.22 0.46 0.00 0.00 0.00 0.00 178.15 178.85 2cqs h ALA 674 N 1.19 1.03 -0.47 1.87 0.00 -0.91 -0.61 119.26 121.36 2cqs h ALA 674 Ca 0.24 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2cqs h ALA 674 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2cqs h ALA 674 CO -0.04 0.18 0.13 0.93 0.00 0.00 0.00 179.25 180.45 2cqs h GLU 675 N 0.84 0.70 -0.05 0.00 4.39 -0.57 -1.28 114.58 118.62 2cqs h GLU 675 Ca 0.33 -0.12 -0.13 0.00 0.34 0.00 0.00 59.36 59.77 2cqs h GLU 675 Cb 0.15 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2cqs h GLU 675 CO -0.17 0.62 -0.58 1.79 -1.16 0.00 0.00 179.01 179.52 2cqs h THR 676 N 0.68 1.39 -0.58 1.13 1.35 -0.80 0.23 112.91 116.32 2cqs h THR 676 Ca 0.16 -1.94 -0.04 0.00 -0.55 0.00 0.00 66.41 64.04 2cqs h THR 676 Cb 0.23 2.00 -0.03 0.00 -1.73 0.00 0.00 68.15 68.62 2cqs h THR 676 CO -0.01 0.57 0.21 0.58 -0.25 0.00 0.00 175.52 176.62 2cqs h VAL 677 N 0.12 1.23 -0.00 6.82 2.07 -0.05 -2.23 116.25 124.20 2cqs h VAL 677 Ca -0.00 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2cqs h VAL 677 Cb 1.05 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2cqs h VAL 677 CO 0.08 0.29 -0.01 1.33 0.02 0.00 0.00 177.57 179.28 2cqs n VAL 678 N -4.45 0.00 -1.45 2.57 0.24 -0.67 -4.91 118.33 109.65 2cqs n VAL 678 Ca 0.03 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 2cqs n VAL 678 Cb 0.18 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 2cqs n VAL 678 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cqs n GLY 679 N 1.09 0.80 2.66 7.63 0.00 -0.84 -2.53 105.19 114.00 2cqs n GLY 679 Ca 0.21 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.30 2cqs n GLY 679 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqs n ARG 680 N -1.04 2.94 -0.16 1.61 1.74 0.77 -0.70 116.66 121.81 2cqs n ARG 680 Ca 0.00 -4.76 0.09 0.00 -0.77 0.00 0.00 57.85 52.41 2cqs n ARG 680 Cb 0.36 -2.26 0.40 0.00 -1.02 0.00 0.00 32.46 29.94 2cqs n ARG 680 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2cqs h GLY 681 N 3.70 0.87 0.99 -0.13 0.00 -1.75 -2.19 103.07 104.54 2cqs h GLY 681 Ca 0.18 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.25 2cqs h GLY 681 CO 0.85 0.17 0.36 0.00 0.00 0.00 0.00 176.54 177.92 2cqs h ALA 682 N 1.63 0.71 -0.25 3.60 0.00 -1.86 -0.60 119.26 122.49 2cqs h ALA 682 Ca 0.32 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 2cqs h ALA 682 Cb 0.41 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2cqs h ALA 682 CO -0.11 0.13 -0.51 0.37 0.00 0.00 0.00 179.25 179.14 2cqs h GLN 683 N 0.74 0.71 -0.38 0.00 4.15 -1.78 -2.17 115.11 116.39 2cqs h GLN 683 Ca 0.21 -0.43 -0.01 0.00 0.77 0.00 0.00 58.65 59.19 2cqs h GLN 683 Cb -0.07 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 2cqs h GLN 683 CO -0.05 1.05 0.21 0.00 -1.93 0.00 0.00 178.83 178.10 2cqs h ALA 684 N 0.87 0.48 -0.46 3.38 0.00 -1.10 -1.55 119.26 120.89 2cqs h ALA 684 Ca 0.02 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2cqs h ALA 684 Cb 1.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2cqs h ALA 684 CO 0.10 0.01 0.06 0.35 0.00 0.00 0.00 179.25 179.77 2cqs h PHE 685 N 0.48 0.75 0.04 0.00 3.57 -1.08 -1.73 116.94 118.97 2cqs h PHE 685 Ca 0.13 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.56 2cqs h PHE 685 Cb 0.05 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 2cqs h PHE 685 CO -0.03 0.67 -0.09 0.22 -2.23 0.00 0.00 178.31 176.86 2cqs h ASP 686 N 0.69 -0.24 -0.81 0.41 3.58 -0.90 -0.86 116.42 118.28 2cqs h ASP 686 Ca 0.15 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2cqs h ASP 686 Cb 0.34 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.45 2cqs h ASP 686 CO 0.01 -0.13 0.52 1.88 -2.88 0.00 0.00 179.24 178.63 2cqs h TYR 687 N -0.17 1.05 -0.34 0.28 0.05 -0.95 -2.22 116.97 114.66 2cqs h TYR 687 Ca 0.02 0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.83 2cqs h TYR 687 Cb 0.19 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.56 2cqs h TYR 687 CO -0.13 0.68 0.21 -0.92 -1.05 0.00 0.00 178.16 176.94 2cqs h TYR 688 N 1.11 0.39 -0.34 4.88 3.20 -0.79 -2.86 116.97 122.56 2cqs h TYR 688 Ca 0.30 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.11 2cqs h TYR 688 Cb -0.09 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 2cqs h TYR 688 CO 0.00 0.23 -0.08 0.87 -1.64 0.00 0.00 178.16 177.54 2cqs h LYS 689 N 0.42 0.57 -0.42 1.82 1.57 -0.66 -2.47 116.57 117.39 2cqs h LYS 689 Ca 0.13 -0.16 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 2cqs h LYS 689 Cb -0.01 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 2cqs h LYS 689 CO -0.06 0.65 0.28 0.00 -0.57 0.00 0.00 179.45 179.76 2cqs h ARG 690 N 0.53 0.40 -0.01 3.15 3.08 -1.17 -3.11 114.38 117.25 2cqs h ARG 690 Ca 0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2cqs h ARG 690 Cb 0.47 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2cqs h ARG 690 CO 0.03 0.26 -0.28 0.44 -1.07 0.00 0.00 179.97 179.35 2cqs n ILE 691 N -4.48 0.00 -2.69 2.04 -5.35 -1.17 -4.48 119.36 103.24 2cqs n ILE 691 Ca 0.05 -0.36 -0.42 0.00 -0.27 0.00 0.00 62.75 61.75 2cqs n ILE 691 Cb 0.19 1.12 -0.03 0.00 -1.74 0.00 0.00 39.64 39.18 2cqs n ILE 691 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 2cqs s THR 692 N -1.58 4.71 0.19 7.28 2.01 -0.94 -4.90 115.64 122.40 2cqs s THR 692 Ca 0.09 2.01 -0.25 0.00 0.31 0.00 0.00 61.69 63.85 2cqs s THR 692 Cb 0.09 -4.29 0.07 0.00 0.01 0.00 0.00 72.50 68.39 2cqs s THR 692 CO 0.32 0.19 1.55 -0.65 -0.69 0.00 0.00 174.62 175.34 2cqs h PRO 693 N 6.53 -0.08 -0.11 4.92 0.11 -1.85 -1.36 132.00 140.16 2cqs h PRO 693 Ca -0.41 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.73 2cqs h PRO 693 Cb 1.22 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2cqs h PRO 693 CO 0.75 -0.05 0.12 0.00 -0.21 0.00 0.00 178.00 178.61 2cqs h ALA 694 N 0.84 1.75 0.00 -0.75 0.00 -1.88 -1.11 119.26 118.11 2cqs h ALA 694 Ca 0.23 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2cqs h ALA 694 Cb 0.53 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2cqs h ALA 694 CO -0.87 -0.18 -0.99 1.88 0.00 0.00 0.00 179.25 179.09 2cqs h TYR 695 N 0.00 0.00 -0.02 0.00 0.05 -1.55 -3.33 116.97 112.11 2cqs h TYR 695 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2cqs h TYR 695 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2cqs h TYR 695 CO 0.00 0.09 -0.13 0.54 -1.05 0.00 0.00 178.16 177.61 2cqs n ARG 696 N -2.75 1.82 -0.22 4.88 1.74 -0.52 -4.40 116.66 117.21 2cqs n ARG 696 Ca -0.01 -1.41 0.05 0.00 -0.77 0.00 0.00 57.85 55.71 2cqs n ARG 696 Cb 0.59 -1.47 0.31 0.00 -1.02 0.00 0.00 32.46 30.87 2cqs n ARG 696 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2cqs h GLU 697 N 3.45 0.83 0.00 5.56 4.81 -1.41 -1.55 114.58 126.27 2cqs h GLU 697 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2cqs h GLU 697 Cb 0.81 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.00 2cqs h GLU 697 CO 0.00 0.55 0.00 -0.25 -0.73 0.00 0.00 179.01 178.58 2cqs n ASP 698 N -4.48 0.00 -2.16 1.04 8.00 -1.26 -1.98 116.55 115.71 2cqs n ASP 698 Ca 0.11 0.49 -0.22 0.00 0.71 0.00 0.00 54.79 55.89 2cqs n ASP 698 Cb 0.21 -0.49 0.02 0.00 -0.02 0.00 0.00 41.12 40.83 2cqs n ASP 698 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2cqs n ILE 699 N -1.49 2.36 0.08 0.53 -5.35 -0.58 -2.94 119.36 111.96 2cqs n ILE 699 Ca 0.03 -4.14 0.16 0.00 -0.27 0.00 0.00 62.75 58.53 2cqs n ILE 699 Cb 0.13 -0.88 0.67 0.00 -1.74 0.00 0.00 39.64 37.82 2cqs n ILE 699 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2cqs h SER 700 N 2.28 0.01 1.11 7.28 0.02 -1.22 0.22 113.55 123.25 2cqs h SER 700 Ca 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2cqs h SER 700 Cb 1.44 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.98 2cqs h SER 700 CO 0.71 0.01 0.00 -2.24 -1.14 0.00 0.00 176.83 174.16 2cqs h ASP 701 N 0.01 0.00 0.00 3.07 2.03 -1.87 0.44 116.42 120.10 2cqs h ASP 701 Ca 0.17 0.00 -0.34 0.00 -0.73 0.00 0.00 57.03 56.14 2cqs h ASP 701 Cb 0.68 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 39.13 2cqs h ASP 701 CO -0.00 0.00 -1.84 0.41 -1.03 0.00 0.00 179.24 176.77 2cqs n THR 702 N -2.70 1.54 -0.31 1.15 -1.04 0.65 -4.36 114.28 109.21 2cqs n THR 702 Ca 0.02 -0.21 -0.04 0.00 -2.04 0.00 0.00 64.05 61.78 2cqs n THR 702 Cb 0.32 -1.95 0.08 0.00 -1.82 0.00 0.00 70.33 66.96 2cqs n THR 702 CO 0.00 0.00 0.00 -0.74 -0.64 0.00 0.00 175.07 173.69 2cqs h HIS 703 N -0.94 1.14 0.00 -1.42 6.17 -1.25 -3.30 115.15 115.55 2cqs h HIS 703 Ca -0.50 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 60.56 2cqs h HIS 703 Cb 1.47 -0.37 0.00 0.00 2.52 0.00 0.00 27.41 31.03 2cqs h HIS 703 CO 0.02 0.77 0.00 1.63 0.71 0.00 0.00 177.93 181.06 2cqs n LYS 704 N -4.41 0.00 -0.63 5.26 5.02 0.14 -1.82 118.16 121.72 2cqs n LYS 704 Ca 0.09 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.32 2cqs n LYS 704 Cb 0.07 -0.12 0.04 0.00 -0.02 0.00 0.00 35.03 35.00 2cqs n LYS 704 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2cqs n LEU 705 N 0.00 0.00 -4.66 -0.35 4.32 -1.26 -3.64 117.00 111.41 2cqs n LEU 705 Ca 0.00 -0.38 -0.50 0.00 -0.02 0.00 0.00 56.01 55.12 2cqs n LEU 705 Cb 0.00 -0.20 -0.05 0.00 -1.62 0.00 0.00 43.42 41.55 2cqs n LEU 705 CO 0.00 -0.68 1.20 -0.62 -1.22 0.00 0.00 177.39 176.06 2cqs n GLU 706 N -1.56 1.75 -0.02 3.23 4.71 -1.26 -4.86 120.64 122.63 2cqs n GLU 706 Ca 0.04 0.64 0.10 0.00 -0.01 0.00 0.00 57.16 57.92 2cqs n GLU 706 Cb 0.13 -2.37 0.51 0.00 -1.01 0.00 0.00 31.44 28.69 2cqs n GLU 706 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2cqs n PRO 707 N 4.12 1.22 0.00 3.49 -0.04 -1.26 -3.68 135.00 138.84 2cqs n PRO 707 Ca 0.20 -0.33 0.04 0.00 -0.04 0.00 0.00 63.50 63.37 2cqs n PRO 707 Cb 0.24 -1.33 0.03 0.00 -0.04 0.00 0.00 33.50 32.40 2cqs n PRO 707 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2cqs n TYR 708 N -0.46 0.00 -4.05 0.54 0.18 -1.26 -3.97 117.16 108.13 2cqs n TYR 708 Ca 0.15 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.84 2cqs n TYR 708 Cb 0.14 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.00 2cqs n TYR 708 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 2cqs s VAL 709 N -0.68 0.25 0.56 -3.48 -7.23 -1.24 -4.81 120.40 103.78 2cqs s VAL 709 Ca 0.08 -1.38 -0.17 0.00 -1.81 0.00 0.00 61.98 58.71 2cqs s VAL 709 Cb 0.06 -0.92 -0.05 0.00 0.56 0.00 0.00 36.38 36.03 2cqs s VAL 709 CO 0.10 -0.72 1.05 -0.31 -0.31 0.00 0.00 175.10 174.92 2cqs s TYR 710 N -2.62 2.99 0.26 2.82 1.51 -1.26 -4.76 117.35 116.29 2cqs s TYR 710 Ca -0.04 1.53 0.11 0.00 -1.01 0.00 0.00 57.07 57.66 2cqs s TYR 710 Cb -0.02 -3.03 -0.05 0.00 -0.11 0.00 0.00 41.96 38.76 2cqs s TYR 710 CO -0.05 -1.04 -0.14 0.00 -1.11 0.00 0.00 175.55 173.21 2cqs s ALA 711 N -2.30 2.86 0.14 3.71 0.00 -1.26 -1.79 121.76 123.12 2cqs s ALA 711 Ca 0.65 -1.76 -0.13 0.00 0.00 0.00 0.00 51.96 50.72 2cqs s ALA 711 Cb -0.16 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.52 2cqs s ALA 711 CO 0.32 0.31 1.58 0.37 0.00 0.00 0.00 175.76 178.34 2cqs h GLN 712 N 2.31 0.85 -3.02 0.00 4.15 -0.93 -3.43 115.11 115.05 2cqs h GLN 712 Ca -0.42 -0.29 -0.14 0.00 0.77 0.00 0.00 58.65 58.57 2cqs h GLN 712 Cb 1.25 -0.07 -0.24 0.00 0.21 0.00 0.00 27.48 28.63 2cqs h GLN 712 CO 0.58 0.91 -0.35 0.00 -1.93 0.00 0.00 178.83 178.04 2cqs s MET 713 N -4.95 0.41 -0.13 1.69 0.23 -1.17 -2.09 119.30 113.28 2cqs s MET 713 Ca -0.12 0.30 0.01 0.00 -1.03 0.00 0.00 55.69 54.85 2cqs s MET 713 Cb 0.11 0.19 -0.01 0.00 -1.53 0.00 0.00 34.83 33.60 2cqs s MET 713 CO 0.82 -0.07 -0.17 0.42 -2.03 0.00 0.00 175.02 174.00 2cqs s ILE 714 N -0.11 2.62 0.20 3.16 1.01 -0.59 -1.07 121.20 126.42 2cqs s ILE 714 Ca -0.03 -0.81 -0.32 0.00 0.00 0.00 0.00 60.65 59.50 2cqs s ILE 714 Cb -0.03 -2.08 -0.15 0.00 0.01 0.00 0.00 42.46 40.22 2cqs s ILE 714 CO 0.01 0.53 1.22 0.00 0.00 0.00 0.00 174.94 176.70 2cqs n ALA 715 N 3.69 -0.16 -1.64 9.38 0.00 -0.03 -0.67 120.51 131.08 2cqs n ALA 715 Ca -0.19 0.44 -0.14 0.00 0.00 0.00 0.00 53.44 53.55 2cqs n ALA 715 Cb 0.52 -2.10 0.13 0.00 0.00 0.00 0.00 19.45 18.01 2cqs n ALA 715 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqs n GLY 716 N 1.98 -1.29 0.25 0.00 0.00 0.48 -0.97 105.19 105.63 2cqs n GLY 716 Ca 0.13 -1.71 0.08 0.00 0.00 0.00 0.00 46.02 44.53 2cqs n GLY 716 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2cqs h LYS 717 N 0.00 0.00 -0.00 1.61 2.10 -1.88 -2.19 116.57 116.20 2cqs h LYS 717 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 2cqs h LYS 717 Cb 0.78 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.11 2cqs h LYS 717 CO 0.20 0.11 -0.08 0.39 -2.00 0.00 0.00 179.45 178.07 2cqs n GLU 718 N -4.20 0.89 -3.53 0.07 1.02 -1.26 -4.86 120.64 108.76 2cqs n GLU 718 Ca -0.03 -0.32 -0.35 0.00 -0.02 0.00 0.00 57.16 56.45 2cqs n GLU 718 Cb 0.19 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.06 2cqs n GLU 718 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cqs s ALA 719 N -2.33 3.70 0.41 0.62 0.00 -0.82 -4.53 121.76 118.81 2cqs s ALA 719 Ca 0.33 -0.32 0.12 0.00 0.00 0.00 0.00 51.96 52.09 2cqs s ALA 719 Cb 0.20 -2.32 0.88 0.00 0.00 0.00 0.00 23.12 21.88 2cqs s ALA 719 CO 0.44 0.54 1.95 0.28 0.00 0.00 0.00 175.76 178.97 2cqs h VAL 720 N 2.92 1.16 -0.66 0.00 2.07 -1.86 -2.26 116.25 117.62 2cqs h VAL 720 Ca -0.49 -0.71 -0.26 0.00 0.82 0.00 0.00 66.70 66.06 2cqs h VAL 720 Cb 1.20 1.27 -0.15 0.00 -1.52 0.00 0.00 31.29 32.08 2cqs h VAL 720 CO 0.66 0.21 0.33 0.54 0.02 0.00 0.00 177.57 179.33 2cqs n ARG 721 N -4.30 2.71 -1.57 1.57 1.74 -1.26 -5.01 116.66 110.55 2cqs n ARG 721 Ca -0.01 -2.38 -0.61 0.00 -0.77 0.00 0.00 57.85 54.07 2cqs n ARG 721 Cb 0.26 -1.98 -0.09 0.00 -1.02 0.00 0.00 32.46 29.63 2cqs n ARG 721 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2cqs n ALA 722 N -0.33 -2.91 0.00 7.54 0.00 -0.85 -0.97 120.51 122.99 2cqs n ALA 722 Ca 0.38 0.56 0.00 0.00 0.00 0.00 0.00 53.44 54.38 2cqs n ALA 722 Cb 1.26 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 18.91 2cqs n ALA 722 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqs n GLY 723 N 2.28 1.89 3.71 0.00 0.00 -0.14 -4.93 105.19 108.00 2cqs n GLY 723 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 2cqs n GLY 723 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqs s GLU 724 N -0.80 4.42 0.36 1.61 2.02 -0.15 -3.82 118.70 122.35 2cqs s GLU 724 Ca 0.00 0.92 -0.02 0.00 0.02 0.00 0.00 54.97 55.89 2cqs s GLU 724 Cb 0.00 -3.47 -0.04 0.00 0.10 0.00 0.00 34.13 30.72 2cqs s GLU 724 CO 0.00 0.00 0.60 0.00 0.02 0.00 0.00 175.26 175.89 2cqs s ALA 725 N 1.01 3.61 0.06 5.21 0.00 -0.76 -0.85 121.76 130.04 2cqs s ALA 725 Ca 0.38 -0.73 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 2cqs s ALA 725 Cb -0.18 -2.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.65 2cqs s ALA 725 CO 0.18 -0.03 0.07 0.15 0.00 0.00 0.00 175.76 176.12 2cqs s LYS 726 N -4.22 0.67 -1.06 0.00 1.02 -0.24 -4.71 119.74 111.20 2cqs s LYS 726 Ca 0.43 -1.02 -0.09 0.00 0.02 0.00 0.00 55.97 55.31 2cqs s LYS 726 Cb -0.10 0.26 -0.06 0.00 -0.52 0.00 0.00 37.83 37.41 2cqs s LYS 726 CO 0.37 -0.17 0.89 0.09 -0.92 0.00 0.00 175.35 175.61 2cqs n ASN 727 N 0.23 -6.42 -4.81 2.83 5.03 -1.26 -3.04 115.26 107.82 2cqs n ASN 727 Ca -0.16 -0.76 -0.29 0.00 0.87 0.00 0.00 54.58 54.24 2cqs n ASN 727 Cb 0.61 -4.86 0.11 0.00 -1.02 0.00 0.00 39.78 34.62 2cqs n ASN 727 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2cqs s SER 728 N -3.40 3.97 0.00 6.41 1.04 -1.26 -0.65 113.70 119.81 2cqs s SER 728 Ca 0.46 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.94 2cqs s SER 728 Cb -0.08 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.37 2cqs s SER 728 CO 0.76 -2.27 0.00 0.79 0.98 0.00 0.00 173.24 173.50 2cqs n TRP 729 N -3.59 0.00 -2.80 5.02 7.02 -0.74 -4.82 117.44 117.53 2cqs n TRP 729 Ca 0.07 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.12 2cqs n TRP 729 Cb 0.58 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.44 2cqs n TRP 729 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2cqs s LEU 730 N 0.00 4.16 -0.20 -0.99 1.43 -1.26 -4.82 118.68 117.00 2cqs s LEU 730 Ca 0.00 -0.93 -0.27 0.00 -1.03 0.00 0.00 54.13 51.89 2cqs s LEU 730 Cb 0.00 -2.45 0.10 0.00 0.03 0.00 0.00 46.19 43.87 2cqs s LEU 730 CO 0.00 -1.51 0.86 0.28 0.23 0.00 0.00 176.35 176.21 2cqs s THR 731 N 4.35 0.00 -1.07 5.49 -1.32 -1.26 -4.72 115.64 117.11 2cqs s THR 731 Ca 0.25 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.81 2cqs s THR 731 Cb -0.14 -1.00 0.07 0.00 -1.51 0.00 0.00 72.50 69.92 2cqs s THR 731 CO 0.10 0.00 1.22 0.61 -2.21 0.00 0.00 174.62 174.34 2cqs n GLY 732 N 1.74 -0.72 0.36 6.08 0.00 -1.26 -2.42 105.19 108.97 2cqs n GLY 732 Ca -0.14 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 45.95 2cqs n GLY 732 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2cqs h THR 733 N 0.00 0.92 0.38 2.61 2.02 -1.88 -1.26 112.91 115.70 2cqs h THR 733 Ca 0.00 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 2cqs h THR 733 Cb 0.12 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 2cqs h THR 733 CO 0.00 0.13 -0.18 0.00 0.37 0.00 0.00 175.52 175.83 2cqs h ALA 734 N 1.61 -0.51 -0.12 6.16 0.00 -1.84 -0.38 119.26 124.18 2cqs h ALA 734 Ca 0.37 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2cqs h ALA 734 Cb 0.52 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2cqs h ALA 734 CO -0.15 -0.69 0.07 0.00 0.00 0.00 0.00 179.25 178.49 2cqs h ALA 735 N -0.17 0.15 -0.62 0.00 0.00 -1.69 -1.56 119.26 115.36 2cqs h ALA 735 Ca -0.05 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2cqs h ALA 735 Cb 0.50 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2cqs h ALA 735 CO 0.09 -0.34 0.14 -1.49 0.00 0.00 0.00 179.25 177.65 2cqs h TRP 736 N 0.13 1.02 -0.09 0.00 4.06 -1.27 -0.72 115.95 119.08 2cqs h TRP 736 Ca 0.04 -0.11 -0.12 0.00 2.06 0.00 0.00 58.89 60.76 2cqs h TRP 736 Cb 0.02 -0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 27.88 2cqs h TRP 736 CO -0.06 0.84 -0.49 -0.91 -3.56 0.00 0.00 178.44 174.26 2cqs h ASN 737 N 0.93 0.25 -0.30 -3.49 4.21 -0.97 -0.06 115.58 116.15 2cqs h ASN 737 Ca 0.20 -0.12 -0.14 0.00 1.21 0.00 0.00 56.30 57.44 2cqs h ASN 737 Cb 0.34 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 2cqs h ASN 737 CO 0.00 0.71 -0.34 0.15 -1.29 0.00 0.00 177.43 176.65 2cqs h PHE 738 N 0.19 0.99 -0.44 1.19 3.57 -0.85 -0.15 116.94 121.44 2cqs h PHE 738 Ca 0.01 -0.28 -0.01 0.00 3.53 0.00 0.00 57.97 61.22 2cqs h PHE 738 Cb 0.94 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 2cqs h PHE 738 CO 0.02 1.06 0.24 0.28 -2.23 0.00 0.00 178.31 177.68 2cqs h VAL 739 N 0.70 1.16 0.34 1.41 2.07 -0.84 -0.60 116.25 120.49 2cqs h VAL 739 Ca 0.07 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2cqs h VAL 739 Cb 0.90 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2cqs h VAL 739 CO 0.08 0.17 -0.16 0.00 0.02 0.00 0.00 177.57 177.68 2cqs h ALA 740 N 1.09 -0.46 -0.12 1.67 0.00 -0.72 -0.53 119.26 120.18 2cqs h ALA 740 Ca 0.16 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2cqs h ALA 740 Cb 0.06 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2cqs h ALA 740 CO -0.02 -0.74 -0.22 -0.24 0.00 0.00 0.00 179.25 178.03 2cqs h VAL 741 N -0.50 1.38 -0.16 0.00 3.04 -1.00 0.31 116.25 119.31 2cqs h VAL 741 Ca -0.05 -1.48 -0.22 0.00 -1.01 0.00 0.00 66.70 63.94 2cqs h VAL 741 Cb 0.38 2.05 0.01 0.00 -2.01 0.00 0.00 31.29 31.72 2cqs h VAL 741 CO 0.08 0.43 -0.77 0.77 -1.01 0.00 0.00 177.57 177.07 2cqs h SER 742 N -0.06 0.94 0.16 3.17 4.64 -1.19 0.22 113.55 121.43 2cqs h SER 742 Ca 0.01 -0.61 -0.34 0.00 -0.47 0.00 0.00 61.79 60.38 2cqs h SER 742 Cb 0.80 -0.28 -0.06 0.00 -0.31 0.00 0.00 62.40 62.55 2cqs h SER 742 CO 0.05 1.41 -2.17 0.00 -0.87 0.00 0.00 176.83 175.25 2cqs n GLN 743 N -3.94 0.67 -0.05 4.77 6.02 -0.21 -2.05 117.38 122.59 2cqs n GLN 743 Ca -0.07 0.09 -0.07 0.00 -0.01 0.00 0.00 57.00 56.93 2cqs n GLN 743 Cb 0.74 -1.61 -0.05 0.00 1.02 0.00 0.00 30.24 30.34 2cqs n GLN 743 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2cqs n TYR 744 N -2.84 0.00 0.04 1.08 4.01 -0.54 -3.14 117.16 115.77 2cqs n TYR 744 Ca -0.27 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.43 2cqs n TYR 744 Cb 1.12 -0.43 -0.02 0.00 -0.31 0.00 0.00 39.34 39.71 2cqs n TYR 744 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2cqs h LEU 745 N 0.00 -0.17 -1.32 7.72 3.38 -0.46 -3.25 115.31 121.19 2cqs h LEU 745 Ca -0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2cqs h LEU 745 Cb 1.40 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2cqs h LEU 745 CO -0.03 0.30 0.00 -0.07 0.09 0.00 0.00 178.44 178.73 2cqs h LEU 746 N -1.06 0.00 0.34 1.67 3.38 -0.76 -2.32 115.31 116.56 2cqs h LEU 746 Ca -0.02 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 2cqs h LEU 746 Cb 0.16 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 2cqs h LEU 746 CO 0.03 0.00 -0.13 0.61 0.09 0.00 0.00 178.44 179.04 2cqs n GLY 747 N 0.13 0.92 3.33 0.83 0.00 -1.23 -4.17 105.19 105.00 2cqs n GLY 747 Ca 0.01 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 2cqs n GLY 747 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cqs s VAL 748 N -2.20 4.84 -0.02 1.61 1.01 -0.87 0.90 120.40 125.66 2cqs s VAL 748 Ca 0.00 -1.25 0.01 0.00 0.00 0.00 0.00 61.98 60.74 2cqs s VAL 748 Cb 0.00 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.45 2cqs s VAL 748 CO 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 175.10 174.48 2cqs s ARG 749 N 1.55 0.49 0.28 2.72 1.70 -0.42 -3.84 118.95 121.43 2cqs s ARG 749 Ca 0.04 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.94 2cqs s ARG 749 Cb -0.24 -0.54 -0.10 0.00 -0.57 0.00 0.00 34.95 33.49 2cqs s ARG 749 CO 0.04 -0.03 1.26 -2.14 -1.08 0.00 0.00 175.30 173.35 2cqs s PRO 750 N 0.57 4.43 0.51 3.89 0.02 -1.26 -0.58 135.00 142.57 2cqs s PRO 750 Ca -0.06 2.07 0.01 0.00 0.02 0.00 0.00 61.00 63.03 2cqs s PRO 750 Cb -0.10 -3.14 -0.00 0.00 0.02 0.00 0.00 34.50 31.28 2cqs s PRO 750 CO -0.01 -0.11 0.03 -3.47 -0.33 0.00 0.00 177.00 173.11 2cqs n ASP 751 N 1.45 3.04 -0.15 2.53 -0.08 -0.09 -4.79 116.55 118.45 2cqs n ASP 751 Ca 0.02 -3.29 -0.08 0.00 -1.51 0.00 0.00 54.79 49.92 2cqs n ASP 751 Cb 0.43 0.50 0.01 0.00 2.34 0.00 0.00 41.12 44.39 2cqs n ASP 751 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 2cqs h TYR 752 N 1.35 0.63 -0.00 -0.67 0.05 -1.91 -3.34 116.97 113.08 2cqs h TYR 752 Ca -0.42 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.34 2cqs h TYR 752 Cb 1.31 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.85 2cqs h TYR 752 CO 0.00 0.48 -0.15 -0.25 -1.05 0.00 0.00 178.16 177.19 2cqs n ASP 753 N -4.68 0.75 -3.92 3.88 8.00 -1.26 -4.93 116.55 114.39 2cqs n ASP 753 Ca 0.01 -0.88 -0.08 0.00 0.71 0.00 0.00 54.79 54.55 2cqs n ASP 753 Cb 0.09 0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 41.75 2cqs n ASP 753 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2cqs s GLY 754 N -1.11 0.24 -0.32 0.44 0.00 -1.25 -2.48 107.32 102.83 2cqs s GLY 754 Ca 0.04 -0.60 -0.12 0.00 0.00 0.00 0.00 44.72 44.04 2cqs s GLY 754 CO 0.16 -0.39 0.23 -2.27 0.00 0.00 0.00 173.10 170.84 2cqs s LEU 755 N -2.97 4.38 0.21 0.66 2.96 0.69 -0.92 118.68 123.71 2cqs s LEU 755 Ca 0.17 -0.30 -0.30 0.00 -0.22 0.00 0.00 54.13 53.48 2cqs s LEU 755 Cb -0.03 -2.14 -0.08 0.00 0.50 0.00 0.00 46.19 44.44 2cqs s LEU 755 CO 0.07 -0.19 0.98 -0.69 -1.32 0.00 0.00 176.35 175.21 2cqs s VAL 756 N 1.74 4.05 -0.40 1.68 1.01 0.25 -0.90 120.40 127.82 2cqs s VAL 756 Ca 0.06 1.95 0.02 0.00 0.00 0.00 0.00 61.98 64.01 2cqs s VAL 756 Cb -0.17 -4.24 0.12 0.00 0.00 0.00 0.00 36.38 32.09 2cqs s VAL 756 CO 0.11 0.42 0.18 -0.69 0.00 0.00 0.00 175.10 175.12 2cqs s VAL 757 N -0.86 1.38 -0.50 2.92 1.01 0.22 -1.30 120.40 123.27 2cqs s VAL 757 Ca 0.43 -2.23 0.07 0.00 0.00 0.00 0.00 61.98 60.26 2cqs s VAL 757 Cb -0.27 -1.99 0.26 0.00 0.00 0.00 0.00 36.38 34.38 2cqs s VAL 757 CO 0.33 -0.80 0.64 -0.67 0.00 0.00 0.00 175.10 174.61 2cqs n ASP 758 N 3.97 1.83 -4.67 3.32 2.03 0.26 -4.80 116.55 118.49 2cqs n ASP 758 Ca 0.05 -3.06 -0.43 0.00 0.52 0.00 0.00 54.79 51.87 2cqs n ASP 758 Cb 0.37 -0.65 -0.01 0.00 -0.72 0.00 0.00 41.12 40.11 2cqs n ASP 758 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2cqs n PRO 759 N 1.04 1.92 -2.73 -0.67 -0.02 -1.26 -4.33 135.00 128.94 2cqs n PRO 759 Ca 0.25 0.67 -0.07 0.00 -2.02 0.00 0.00 63.50 62.34 2cqs n PRO 759 Cb 0.48 -2.21 0.05 0.00 -0.02 0.00 0.00 33.50 31.80 2cqs n PRO 759 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 2cqs n GLN 760 N 0.75 0.64 0.00 -0.52 -0.06 -0.87 -4.61 117.38 112.71 2cqs n GLN 760 Ca 0.07 -1.56 0.00 0.00 -2.00 0.00 0.00 57.00 53.51 2cqs n GLN 760 Cb 0.34 -1.23 0.00 0.00 -4.06 0.00 0.00 30.24 25.29 2cqs n GLN 760 CO 0.00 0.00 0.00 1.51 -0.20 0.00 0.00 177.06 178.37 2cqs n ILE 761 N 1.74 0.00 0.00 1.69 3.06 -1.23 -4.33 119.36 120.29 2cqs n ILE 761 Ca 0.08 -0.42 0.00 0.00 -2.50 0.00 0.00 62.75 59.92 2cqs n ILE 761 Cb 0.64 1.07 0.00 0.00 0.54 0.00 0.00 39.64 41.89 2cqs n ILE 761 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2cqs n GLY 762 N 0.48 -0.61 0.00 4.50 0.00 -1.25 -4.15 105.19 104.15 2cqs n GLY 762 Ca 0.00 -1.74 0.09 0.00 0.00 0.00 0.00 46.02 44.36 2cqs n GLY 762 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqs n PRO 763 N -0.65 0.09 0.22 1.61 -0.04 -1.25 -3.50 135.00 131.48 2cqs n PRO 763 Ca 0.00 0.17 0.15 0.00 -0.04 0.00 0.00 63.50 63.78 2cqs n PRO 763 Cb 0.00 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 32.48 2cqs n PRO 763 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2cqs h ASP 764 N 0.00 0.00 -2.63 3.54 3.32 -1.93 -3.32 116.42 115.40 2cqs h ASP 764 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2cqs h ASP 764 Cb 0.25 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.39 2cqs h ASP 764 CO 0.00 0.00 -0.70 0.52 -1.72 0.00 0.00 179.24 177.34 2cqs n VAL 765 N -2.86 1.09 0.17 -1.35 0.31 -1.23 -4.91 118.33 109.56 2cqs n VAL 765 Ca 0.02 -4.62 0.04 0.00 -0.01 0.00 0.00 64.34 59.77 2cqs n VAL 765 Cb 0.35 -2.05 0.44 0.00 -0.91 0.00 0.00 33.84 31.67 2cqs n VAL 765 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2cqs h PRO 766 N 4.99 0.10 -2.88 5.55 0.13 -1.75 -3.43 132.00 134.71 2cqs h PRO 766 Ca 0.18 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 65.14 2cqs h PRO 766 Cb 0.77 -0.01 -0.26 0.00 0.13 0.00 0.00 31.00 31.63 2cqs h PRO 766 CO 0.66 0.29 -0.34 -1.54 -0.23 0.00 0.00 178.00 176.84 2cqs s SER 767 N -6.94 -0.37 0.06 1.44 1.04 -1.26 -0.51 113.70 107.15 2cqs s SER 767 Ca -0.04 0.70 -0.27 0.00 0.48 0.00 0.00 55.95 56.82 2cqs s SER 767 Cb 0.15 0.67 0.09 0.00 0.10 0.00 0.00 66.02 67.03 2cqs s SER 767 CO 0.72 -0.14 0.87 -0.72 0.98 0.00 0.00 173.24 174.95 2cqs s TYR 768 N 0.55 -0.31 -0.05 5.02 -0.85 -1.03 -3.83 117.35 116.85 2cqs s TYR 768 Ca -0.03 0.12 0.02 0.00 -0.52 0.00 0.00 57.07 56.66 2cqs s TYR 768 Cb -0.05 0.57 0.01 0.00 0.38 0.00 0.00 41.96 42.88 2cqs s TYR 768 CO -0.03 -0.66 -0.10 0.99 -1.52 0.00 0.00 175.55 174.22 2cqs s THR 769 N -3.25 0.95 -0.14 -3.49 2.01 -0.05 -0.60 115.64 111.07 2cqs s THR 769 Ca 0.06 -0.39 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 2cqs s THR 769 Cb -0.01 -0.88 -0.02 0.00 0.01 0.00 0.00 72.50 71.60 2cqs s THR 769 CO -0.06 0.31 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.39 2cqs s VAL 770 N 0.58 3.37 -0.34 3.82 1.01 0.07 -0.86 120.40 128.06 2cqs s VAL 770 Ca -0.11 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 2cqs s VAL 770 Cb -0.14 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.82 2cqs s VAL 770 CO 0.02 0.52 0.14 -0.89 0.00 0.00 0.00 175.10 174.89 2cqs s THR 771 N 0.30 4.24 -0.13 3.92 2.01 -0.38 -0.36 115.64 125.25 2cqs s THR 771 Ca -0.08 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.12 2cqs s THR 771 Cb -0.15 -3.30 0.02 0.00 0.01 0.00 0.00 72.50 69.08 2cqs s THR 771 CO 0.05 -0.09 -0.13 -0.60 -0.69 0.00 0.00 174.62 173.16 2cqs s ARG 772 N 1.52 2.10 -0.29 4.92 6.06 -0.39 -2.20 118.95 130.67 2cqs s ARG 772 Ca 0.02 -0.49 -0.17 0.00 -2.50 0.00 0.00 55.73 52.59 2cqs s ARG 772 Cb -0.18 -1.95 -0.02 0.00 0.06 0.00 0.00 34.95 32.85 2cqs s ARG 772 CO 0.05 -0.22 0.49 0.08 -2.50 0.00 0.00 175.30 173.20 2cqs s VAL 773 N 1.47 5.07 -0.02 7.11 1.01 -0.07 -0.30 120.40 134.67 2cqs s VAL 773 Ca 0.03 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.70 2cqs s VAL 773 Cb -0.13 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.42 2cqs s VAL 773 CO -0.09 0.02 -0.01 0.00 0.00 0.00 0.00 175.10 175.01 2cqs s ALA 774 N 2.30 0.29 -1.52 5.51 0.00 0.34 -4.85 121.76 123.82 2cqs s ALA 774 Ca 0.19 0.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.10 2cqs s ALA 774 Cb -0.16 -0.21 0.07 0.00 0.00 0.00 0.00 23.12 22.83 2cqs s ALA 774 CO 0.10 -0.01 0.75 0.54 0.00 0.00 0.00 175.76 177.14 2cqs n ARG 775 N 3.66 -4.22 -0.88 0.00 5.12 -1.26 -1.14 116.66 117.94 2cqs n ARG 775 Ca -0.21 0.49 0.00 0.00 -1.93 0.00 0.00 57.85 56.20 2cqs n ARG 775 Cb 0.54 -5.10 0.00 0.00 -1.16 0.00 0.00 32.46 26.74 2cqs n ARG 775 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cqs n GLY 776 N -1.67 0.61 3.48 -0.13 0.00 -1.26 -4.20 105.19 102.02 2cqs n GLY 776 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 2cqs n GLY 776 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqs s ALA 777 N -2.75 2.66 -0.20 4.61 0.00 -0.29 -0.89 121.76 124.91 2cqs s ALA 777 Ca 0.00 -1.49 -0.08 0.00 0.00 0.00 0.00 51.96 50.38 2cqs s ALA 777 Cb 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 2cqs s ALA 777 CO 0.00 0.50 0.09 0.99 0.00 0.00 0.00 175.76 177.34 2cqs s THR 778 N -1.45 5.01 -0.30 0.00 2.01 -0.50 -0.50 115.64 119.91 2cqs s THR 778 Ca 0.20 0.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.21 2cqs s THR 778 Cb -0.09 -3.28 0.03 0.00 0.01 0.00 0.00 72.50 69.18 2cqs s THR 778 CO 0.11 0.44 0.03 -0.31 -0.69 0.00 0.00 174.62 174.20 2cqs s TYR 779 N 0.48 3.20 -0.51 4.92 2.02 0.59 -0.29 117.35 127.75 2cqs s TYR 779 Ca 0.05 -1.50 -0.19 0.00 -0.37 0.00 0.00 57.07 55.06 2cqs s TYR 779 Cb -0.12 -2.17 0.06 0.00 -0.40 0.00 0.00 41.96 39.33 2cqs s TYR 779 CO 0.00 -0.72 0.62 -1.21 -1.57 0.00 0.00 175.55 172.67 2cqs s GLU 780 N 1.36 3.11 -0.41 -0.62 0.41 0.15 -1.26 118.70 121.44 2cqs s GLU 780 Ca -0.02 -0.94 -0.12 0.00 -0.41 0.00 0.00 54.97 53.48 2cqs s GLU 780 Cb -0.18 -4.11 0.05 0.00 -1.78 0.00 0.00 34.13 28.10 2cqs s GLU 780 CO 0.00 -1.23 0.26 0.42 -0.49 0.00 0.00 175.26 174.23 2cqs s ILE 781 N 2.57 4.67 -0.27 -1.63 1.01 0.52 -0.79 121.20 127.27 2cqs s ILE 781 Ca 0.14 -1.03 -0.14 0.00 0.00 0.00 0.00 60.65 59.63 2cqs s ILE 781 Cb -0.20 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 2cqs s ILE 781 CO 0.11 -0.38 0.31 -0.89 0.00 0.00 0.00 174.94 174.09 2cqs s THR 782 N 1.55 5.22 -0.10 2.92 2.01 0.20 -0.76 115.64 126.68 2cqs s THR 782 Ca 0.03 0.44 0.01 0.00 0.31 0.00 0.00 61.69 62.48 2cqs s THR 782 Cb -0.21 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 2cqs s THR 782 CO 0.06 0.19 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.35 2cqs s VAL 783 N 1.95 3.06 -0.30 3.82 1.01 0.23 0.13 120.40 130.30 2cqs s VAL 783 Ca 0.12 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2cqs s VAL 783 Cb -0.16 -2.25 0.07 0.00 0.00 0.00 0.00 36.38 34.04 2cqs s VAL 783 CO 0.10 0.55 -0.03 -0.89 0.00 0.00 0.00 175.10 174.83 2cqs s THR 784 N -0.02 2.40 -0.19 3.92 2.01 -0.50 -2.46 115.64 120.81 2cqs s THR 784 Ca -0.03 -1.81 -0.01 0.00 0.31 0.00 0.00 61.69 60.15 2cqs s THR 784 Cb -0.14 -2.52 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2cqs s THR 784 CO 0.04 -0.23 -0.14 0.21 -0.69 0.00 0.00 174.62 173.81 2cqs s ASN 785 N 1.12 3.65 0.21 3.53 2.47 0.33 -0.89 114.94 125.37 2cqs s ASN 785 Ca -0.02 -0.52 0.12 0.00 0.42 0.00 0.00 52.86 52.86 2cqs s ASN 785 Cb -0.20 -1.59 -0.02 0.00 -1.45 0.00 0.00 41.25 37.99 2cqs s ASN 785 CO -0.05 0.01 1.39 0.77 -3.72 0.00 0.00 177.10 175.50 2cqs h SER 786 N 7.85 0.00 0.00 -4.21 4.64 -1.26 -3.38 113.55 117.18 2cqs h SER 786 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2cqs h SER 786 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2cqs h SER 786 CO 0.61 0.71 0.00 0.61 -0.87 0.00 0.00 176.83 177.89 2cqs n GLY 787 N 1.23 0.66 3.71 -0.77 0.00 -1.26 -4.34 105.19 104.41 2cqs n GLY 787 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2cqs n GLY 787 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqs s ALA 788 N -2.71 3.79 0.45 4.61 0.00 -1.26 -3.94 121.76 122.70 2cqs s ALA 788 Ca 0.00 1.39 -0.23 0.00 0.00 0.00 0.00 51.96 53.12 2cqs s ALA 788 Cb 0.00 -3.66 -0.10 0.00 0.00 0.00 0.00 23.12 19.36 2cqs s ALA 788 CO 0.00 -0.90 1.01 -0.35 0.00 0.00 0.00 175.76 175.52 2cqs n PRO 789 N 4.41 1.32 0.00 0.00 -0.04 -1.26 -1.15 135.00 138.27 2cqs n PRO 789 Ca 0.15 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 2cqs n PRO 789 Cb 0.38 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.77 2cqs n PRO 789 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2cqs n GLY 790 N 1.19 1.98 3.68 0.55 0.00 0.12 -4.95 105.19 107.77 2cqs n GLY 790 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2cqs n GLY 790 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqs s ALA 791 N -1.74 3.60 0.23 4.61 0.00 -0.30 -5.01 121.76 123.15 2cqs s ALA 791 Ca 0.00 0.86 0.09 0.00 0.00 0.00 0.00 51.96 52.91 2cqs s ALA 791 Cb 0.00 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 2cqs s ALA 791 CO 0.00 -1.03 -0.01 0.50 0.00 0.00 0.00 175.76 175.23 2cqs s ARG 792 N 2.78 2.31 0.47 0.00 6.06 -1.26 -4.91 118.95 124.41 2cqs s ARG 792 Ca 0.65 -1.32 -0.20 0.00 -2.50 0.00 0.00 55.73 52.37 2cqs s ARG 792 Cb -0.31 -2.22 -0.09 0.00 0.06 0.00 0.00 34.95 32.39 2cqs s ARG 792 CO 0.26 0.40 0.99 0.00 -2.50 0.00 0.00 175.30 174.45 2cqs s ALA 793 N -2.10 2.96 -0.00 6.12 0.00 -1.26 -4.68 121.76 122.79 2cqs s ALA 793 Ca 0.30 0.44 0.08 0.00 0.00 0.00 0.00 51.96 52.78 2cqs s ALA 793 Cb -0.07 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 2cqs s ALA 793 CO 0.19 -0.15 -0.24 -1.54 0.00 0.00 0.00 175.76 174.01 2cqs s SER 794 N -2.28 3.23 0.19 0.00 1.04 -0.38 -4.80 113.70 110.71 2cqs s SER 794 Ca 0.64 -0.47 0.10 0.00 0.48 0.00 0.00 55.95 56.69 2cqs s SER 794 Cb -0.12 -0.39 -0.04 0.00 0.10 0.00 0.00 66.02 65.56 2cqs s SER 794 CO 0.20 0.30 -0.14 -0.76 0.98 0.00 0.00 173.24 173.82 2cqs s LEU 795 N -0.84 2.78 -0.03 2.42 1.43 -1.26 -1.94 118.68 121.24 2cqs s LEU 795 Ca 0.11 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 2cqs s LEU 795 Cb -0.10 -1.47 0.03 0.00 0.03 0.00 0.00 46.19 44.68 2cqs s LEU 795 CO 0.00 0.10 0.01 0.28 0.23 0.00 0.00 176.35 176.98 2cqs s THR 796 N -1.76 0.10 -0.09 5.49 -1.32 -0.88 -1.72 115.64 115.45 2cqs s THR 796 Ca 0.24 0.14 0.04 0.00 -1.21 0.00 0.00 61.69 60.90 2cqs s THR 796 Cb -0.08 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.70 2cqs s THR 796 CO 0.14 0.13 -0.23 -0.69 -2.21 0.00 0.00 174.62 171.76 2cqs s VAL 797 N 1.09 1.97 -1.63 5.08 1.01 0.14 -0.92 120.40 127.13 2cqs s VAL 797 Ca -0.09 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 2cqs s VAL 797 Cb -0.13 -1.70 0.07 0.00 0.00 0.00 0.00 36.38 34.62 2cqs s VAL 797 CO -0.02 0.54 0.27 0.47 0.00 0.00 0.00 175.10 176.35 2cqs n ASP 798 N 3.49 -0.24 0.00 3.32 8.00 -0.73 -0.49 116.55 129.91 2cqs n ASP 798 Ca -0.19 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.09 2cqs n ASP 798 Cb 0.53 -1.88 0.00 0.00 -0.02 0.00 0.00 41.12 39.74 2cqs n ASP 798 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2cqs n GLY 799 N -2.04 3.20 3.53 0.44 0.00 -1.26 -5.03 105.19 104.03 2cqs n GLY 799 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2cqs n GLY 799 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqs s ALA 800 N -1.88 2.94 0.52 4.61 0.00 0.36 -5.08 121.76 123.23 2cqs s ALA 800 Ca 0.00 -0.87 -0.21 0.00 0.00 0.00 0.00 51.96 50.88 2cqs s ALA 800 Cb 0.00 -1.33 -0.06 0.00 0.00 0.00 0.00 23.12 21.73 2cqs s ALA 800 CO 0.00 0.41 1.20 -1.25 0.00 0.00 0.00 175.76 176.12 2cqs s PRO 801 N -0.26 3.41 0.34 0.00 0.04 -1.26 0.23 135.00 137.50 2cqs s PRO 801 Ca 0.04 1.84 0.08 0.00 0.04 0.00 0.00 61.00 63.00 2cqs s PRO 801 Cb -0.13 -2.21 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 2cqs s PRO 801 CO 0.03 -0.85 -0.05 0.14 0.04 0.00 0.00 177.00 176.30 2cqs s VAL 802 N -1.55 1.94 -0.17 -0.36 -7.23 -0.70 -4.82 120.40 107.51 2cqs s VAL 802 Ca 0.69 -2.12 -0.19 0.00 -1.81 0.00 0.00 61.98 58.55 2cqs s VAL 802 Cb -0.30 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.92 2cqs s VAL 802 CO 0.35 -0.16 0.54 -1.81 -0.31 0.00 0.00 175.10 173.71 2cqs s ASP 803 N -3.58 6.65 0.03 4.85 -0.00 -1.26 -4.52 116.67 118.84 2cqs s ASP 803 Ca 0.33 0.78 0.00 0.00 -0.00 0.00 0.00 52.55 53.66 2cqs s ASP 803 Cb 0.05 -2.31 0.00 0.00 -0.00 0.00 0.00 42.92 40.66 2cqs s ASP 803 CO 0.16 -0.14 0.00 0.61 -0.00 0.00 0.00 175.17 175.79 2cqs n GLY 804 N 3.64 -1.54 0.07 0.21 0.00 -1.26 -4.48 105.19 101.82 2cqs n GLY 804 Ca -0.04 -1.32 0.09 0.00 0.00 0.00 0.00 46.02 44.75 2cqs n GLY 804 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqs n ARG 805 N -0.01 1.51 -3.88 1.61 1.74 -1.26 -4.24 116.66 112.13 2cqs n ARG 805 Ca 0.00 -2.45 -0.35 0.00 -0.77 0.00 0.00 57.85 54.28 2cqs n ARG 805 Cb 0.00 -1.44 -0.14 0.00 -1.02 0.00 0.00 32.46 29.86 2cqs n ARG 805 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2cqs s THR 806 N -2.65 3.30 -0.48 0.55 2.01 -1.26 -0.61 115.64 116.50 2cqs s THR 806 Ca 0.28 -0.89 -0.20 0.00 0.31 0.00 0.00 61.69 61.20 2cqs s THR 806 Cb 0.25 -2.68 0.04 0.00 0.01 0.00 0.00 72.50 70.12 2cqs s THR 806 CO 0.03 0.16 0.64 -0.69 -0.69 0.00 0.00 174.62 174.06 2cqs s VAL 807 N 1.39 4.84 0.25 3.82 1.01 -0.08 -4.83 120.40 126.79 2cqs s VAL 807 Ca 0.01 -0.24 -0.31 0.00 0.00 0.00 0.00 61.98 61.45 2cqs s VAL 807 Cb -0.17 -4.27 -0.14 0.00 0.00 0.00 0.00 36.38 31.81 2cqs s VAL 807 CO -0.02 -0.73 1.32 -0.81 0.00 0.00 0.00 175.10 174.86 2cqs n PRO 808 N 6.25 1.85 -1.66 2.72 -0.04 -1.26 -0.22 135.00 142.64 2cqs n PRO 808 Ca -0.04 0.66 -0.50 0.00 -0.04 0.00 0.00 63.50 63.57 2cqs n PRO 808 Cb 0.46 -2.25 -0.05 0.00 -0.04 0.00 0.00 33.50 31.62 2cqs n PRO 808 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2cqs n TYR 809 N 1.48 2.06 -2.01 0.54 4.01 -1.04 -4.80 117.16 117.40 2cqs n TYR 809 Ca 0.11 0.34 -0.30 0.00 -0.16 0.00 0.00 57.90 57.89 2cqs n TYR 809 Cb 0.31 -2.51 0.02 0.00 -0.31 0.00 0.00 39.34 36.85 2cqs n TYR 809 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2cqs s ALA 810 N 2.21 3.09 0.70 -0.72 0.00 -1.26 -5.03 121.76 120.76 2cqs s ALA 810 Ca 0.88 -0.27 -0.15 0.00 0.00 0.00 0.00 51.96 52.42 2cqs s ALA 810 Cb -0.83 -2.96 0.02 0.00 0.00 0.00 0.00 23.12 19.35 2cqs s ALA 810 CO 0.49 -0.79 1.19 -1.25 0.00 0.00 0.00 175.76 175.40 2cqs s PRO 811 N -5.16 2.37 0.47 0.00 0.04 -1.26 -4.76 135.00 126.70 2cqs s PRO 811 Ca 0.55 1.69 -0.24 0.00 0.04 0.00 0.00 61.00 63.04 2cqs s PRO 811 Cb -0.11 -1.87 -0.08 0.00 0.04 0.00 0.00 34.50 32.48 2cqs s PRO 811 CO 0.51 -1.64 1.25 0.00 0.04 0.00 0.00 177.00 177.17 2cqs n ALA 812 N -2.53 1.23 0.00 8.56 0.00 -1.26 -2.55 120.51 123.95 2cqs n ALA 812 Ca 0.13 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2cqs n ALA 812 Cb 0.51 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.69 2cqs n ALA 812 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqs n GLY 813 N 0.86 2.02 3.92 0.00 0.00 -0.07 -4.92 105.19 106.99 2cqs n GLY 813 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2cqs n GLY 813 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqs s SER 814 N -2.29 6.02 -0.18 1.61 1.04 -1.06 -4.92 113.70 113.92 2cqs s SER 814 Ca 0.00 0.69 0.01 0.00 0.48 0.00 0.00 55.95 57.13 2cqs s SER 814 Cb 0.00 -1.95 0.03 0.00 0.10 0.00 0.00 66.02 64.20 2cqs s SER 814 CO 0.00 -0.69 -0.15 -0.89 0.98 0.00 0.00 173.24 172.49 2cqs s THR 815 N -2.72 1.82 -0.20 2.02 2.01 -1.26 -1.41 115.64 115.91 2cqs s THR 815 Ca 0.48 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 61.52 2cqs s THR 815 Cb -0.10 -1.73 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 2cqs s THR 815 CO 0.43 0.40 0.03 -0.69 -0.69 0.00 0.00 174.62 174.09 2cqs s VAL 816 N 1.37 4.32 -0.42 3.82 1.01 0.61 -4.99 120.40 126.12 2cqs s VAL 816 Ca 0.03 -0.19 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 2cqs s VAL 816 Cb -0.14 -2.96 0.05 0.00 0.00 0.00 0.00 36.38 33.33 2cqs s VAL 816 CO -0.11 0.43 0.30 -0.13 0.00 0.00 0.00 175.10 175.59 2cqs s ARG 817 N 0.80 2.87 -0.24 2.72 0.52 -1.26 -0.68 118.95 123.68 2cqs s ARG 817 Ca 0.02 -1.22 -0.10 0.00 -0.52 0.00 0.00 55.73 53.91 2cqs s ARG 817 Cb -0.14 -3.93 -0.05 0.00 0.52 0.00 0.00 34.95 31.35 2cqs s ARG 817 CO 0.02 -0.86 0.15 0.08 0.02 0.00 0.00 175.30 174.70 2cqs s VAL 818 N 1.59 5.24 -0.26 3.52 1.01 0.03 -1.77 120.40 129.75 2cqs s VAL 818 Ca 0.04 0.14 -0.08 0.00 0.00 0.00 0.00 61.98 62.07 2cqs s VAL 818 Cb -0.21 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2cqs s VAL 818 CO 0.07 0.35 0.10 -0.70 0.00 0.00 0.00 175.10 174.92 2cqs s GLU 819 N 1.05 3.62 -0.12 2.72 2.56 -0.10 -0.63 118.70 127.80 2cqs s GLU 819 Ca 0.07 -0.51 -0.01 0.00 0.00 0.00 0.00 54.97 54.51 2cqs s GLU 819 Cb -0.14 -3.40 -0.03 0.00 2.00 0.00 0.00 34.13 32.57 2cqs s GLU 819 CO 0.04 -0.23 -0.07 0.08 -0.56 0.00 0.00 175.26 174.52 2cqs s VAL 820 N 1.63 3.66 -0.17 3.70 1.01 0.12 -2.08 120.40 128.27 2cqs s VAL 820 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2cqs s VAL 820 Cb -0.16 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.70 2cqs s VAL 820 CO 0.05 0.53 -0.12 -0.89 0.00 0.00 0.00 175.10 174.67 2cqs s THR 821 N -0.03 1.56 -0.66 3.92 2.01 -0.82 -1.41 115.64 120.21 2cqs s THR 821 Ca -0.00 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.28 2cqs s THR 821 Cb -0.13 -1.55 0.04 0.00 0.01 0.00 0.00 72.50 70.87 2cqs s THR 821 CO 0.03 0.32 0.67 0.52 -0.69 0.00 0.00 174.62 175.47