#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dbl n LEU 7 N 0.00 0.58 0.06 -0.35 0.00 -1.26 -2.47 117.00 113.56 3dbl n LEU 7 Ca 0.00 0.58 0.05 0.00 0.00 0.00 0.00 56.01 56.64 3dbl n LEU 7 Cb 0.00 -0.42 0.48 0.00 0.00 0.00 0.00 43.42 43.48 3dbl n LEU 7 CO 0.00 -0.23 1.14 0.25 0.00 0.00 0.00 177.39 178.55 3dbl h LEU 8 N 0.00 0.36 -0.07 -1.96 5.85 -2.07 -1.20 115.31 116.23 3dbl h LEU 8 Ca 0.00 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3dbl h LEU 8 Cb 0.58 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.52 3dbl h LEU 8 CO 0.00 0.26 0.02 0.50 -0.34 0.00 0.00 178.44 178.88 3dbl h LYS 9 N 0.42 0.10 -0.23 1.25 3.64 -1.94 -2.74 116.57 117.07 3dbl h LYS 9 Ca 0.11 -0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.54 3dbl h LYS 9 Cb -0.05 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3dbl h LYS 9 CO -0.02 0.25 0.17 1.49 -2.27 0.00 0.00 179.45 179.07 3dbl h GLU 10 N -0.07 0.00 -0.01 1.90 4.81 -1.35 -2.29 114.58 117.56 3dbl h GLU 10 Ca 0.02 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.08 3dbl h GLU 10 Cb 0.19 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3dbl h GLU 10 CO -0.00 0.00 -0.79 1.96 -0.73 0.00 0.00 179.01 179.45 3dbl h GLN 11 N 0.00 0.13 0.02 1.92 4.20 -1.19 -2.69 115.11 117.50 3dbl h GLN 11 Ca 0.11 -0.13 -0.22 0.00 0.06 0.00 0.00 58.65 58.47 3dbl h GLN 11 Cb 0.45 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3dbl h GLN 11 CO -0.00 0.85 -1.04 1.57 -0.67 0.00 0.00 178.83 179.54 3dbl h LYS 12 N 0.08 0.05 -0.59 1.46 2.10 -1.32 -3.27 116.57 115.08 3dbl h LYS 12 Ca -0.02 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 3dbl h LYS 12 Cb 1.38 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.74 3dbl h LYS 12 CO 0.11 1.03 0.00 0.66 -2.00 0.00 0.00 179.45 179.26 3dbl n TYR 13 N -3.39 0.96 -0.14 0.07 0.53 -0.96 -4.60 117.16 109.63 3dbl n TYR 13 Ca -0.02 -0.41 -0.04 0.00 -1.02 0.00 0.00 57.90 56.41 3dbl n TYR 13 Cb 0.95 -0.12 0.05 0.00 -1.03 0.00 0.00 39.34 39.19 3dbl n TYR 13 CO 0.00 0.00 0.00 0.22 -1.02 0.00 0.00 176.86 176.06 3dbl h ASP 14 N 3.10 0.15 0.26 7.72 1.82 -1.53 -1.90 116.42 126.05 3dbl h ASP 14 Ca 0.00 0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.68 3dbl h ASP 14 Cb 0.97 0.04 -0.00 0.00 0.68 0.00 0.00 39.33 41.02 3dbl h ASP 14 CO 0.10 0.12 -0.06 0.03 -1.61 0.00 0.00 179.24 177.82 3dbl h ARG 15 N 0.32 0.00 0.00 0.28 2.47 -1.88 -2.61 114.38 112.96 3dbl h ARG 15 Ca 0.21 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.90 3dbl h ARG 15 Cb 0.22 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.53 3dbl h ARG 15 CO -0.22 0.06 -1.92 0.00 0.56 0.00 0.00 179.97 178.44 3dbl n GLN 16 N -3.56 0.66 0.27 0.04 10.64 -1.07 -4.04 117.38 120.31 3dbl n GLN 16 Ca -0.02 -0.15 0.15 0.00 -1.83 0.00 0.00 57.00 55.15 3dbl n GLN 16 Cb 0.18 -1.55 0.68 0.00 -0.86 0.00 0.00 30.24 28.68 3dbl n GLN 16 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 3dbl h LEU 17 N 0.00 0.00 0.00 2.61 3.38 -0.96 0.20 115.31 120.54 3dbl h LEU 17 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3dbl h LEU 17 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3dbl h LEU 17 CO 0.00 0.09 0.00 0.54 0.09 0.00 0.00 178.44 179.16 3dbl n ARG 18 N -3.28 0.99 -0.05 1.13 1.74 -1.17 -1.32 116.66 114.70 3dbl n ARG 18 Ca -0.00 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.96 3dbl n ARG 18 Cb 0.31 -1.44 -0.04 0.00 -1.02 0.00 0.00 32.46 30.26 3dbl n ARG 18 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3dbl n LEU 19 N -0.94 0.93 -0.17 0.55 4.77 -0.00 -4.83 117.00 117.30 3dbl n LEU 19 Ca 0.21 0.16 0.02 0.00 -0.03 0.00 0.00 56.01 56.36 3dbl n LEU 19 Cb 0.10 -0.37 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 3dbl n LEU 19 CO 0.16 0.15 0.45 -2.67 -1.33 0.00 0.00 177.39 174.15 3dbl n TRP 20 N -3.59 0.09 -2.93 -1.77 2.14 -0.82 -5.12 117.44 105.44 3dbl n TRP 20 Ca -0.22 -0.31 0.07 0.00 2.07 0.00 0.00 57.50 59.11 3dbl n TRP 20 Cb 0.61 -0.03 -0.02 0.00 -0.81 0.00 0.00 31.31 31.07 3dbl n TRP 20 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3dbl n GLY 21 N -0.05 -1.63 0.20 -1.67 0.00 -0.43 -1.84 105.19 99.77 3dbl n GLY 21 Ca 0.03 -1.19 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 3dbl n GLY 21 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dbl h ASP 22 N -0.46 0.26 0.27 1.61 5.19 -1.96 -2.00 116.42 119.33 3dbl h ASP 22 Ca 0.01 -0.11 -0.26 0.00 -0.62 0.00 0.00 57.03 56.05 3dbl h ASP 22 Cb 0.45 -0.07 0.01 0.00 0.18 0.00 0.00 39.33 39.90 3dbl h ASP 22 CO 0.00 0.65 -1.06 1.12 -3.12 0.00 0.00 179.24 176.83 3dbl h HIS 23 N 0.21 0.76 -0.75 4.55 2.07 -1.98 -2.25 115.15 117.76 3dbl h HIS 23 Ca 0.02 -0.44 -0.04 0.00 -2.85 0.00 0.00 60.37 57.06 3dbl h HIS 23 Cb 0.83 -0.07 -0.03 0.00 2.57 0.00 0.00 27.41 30.70 3dbl h HIS 23 CO 0.02 1.28 0.33 0.78 -3.07 0.00 0.00 177.93 177.27 3dbl h GLY 24 N 0.93 1.19 1.46 6.13 0.00 -1.27 -1.54 103.07 109.98 3dbl h GLY 24 Ca -0.12 -0.62 -0.04 0.00 0.00 0.00 0.00 47.33 46.54 3dbl h GLY 24 CO 0.19 0.59 0.11 -1.61 0.00 0.00 0.00 176.54 175.82 3dbl h GLN 25 N 1.08 0.68 -0.60 4.80 5.75 -1.32 -2.18 115.11 123.32 3dbl h GLN 25 Ca 0.25 -0.12 -0.08 0.00 -0.15 0.00 0.00 58.65 58.55 3dbl h GLN 25 Cb 0.17 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 3dbl h GLN 25 CO -0.03 0.62 0.04 0.93 -2.65 0.00 0.00 178.83 177.75 3dbl h GLU 26 N 0.66 1.03 -0.46 1.69 5.08 -0.68 0.10 114.58 122.00 3dbl h GLU 26 Ca 0.15 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.17 3dbl h GLU 26 Cb 0.25 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3dbl h GLU 26 CO -0.00 0.99 0.14 0.00 -1.00 0.00 0.00 179.01 179.14 3dbl h ALA 27 N 1.00 0.61 -0.01 3.43 0.00 -1.07 -1.32 119.26 121.90 3dbl h ALA 27 Ca 0.18 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dbl h ALA 27 Cb 0.50 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3dbl h ALA 27 CO 0.02 0.26 0.00 1.25 0.00 0.00 0.00 179.25 180.79 3dbl h LEU 28 N 0.61 0.02 -0.93 0.00 5.85 -1.25 -2.35 115.31 117.26 3dbl h LEU 28 Ca 0.15 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.62 3dbl h LEU 28 Cb 0.27 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3dbl h LEU 28 CO -0.00 0.26 0.00 1.21 -0.34 0.00 0.00 178.44 179.57 3dbl n GLU 29 N -4.96 0.11 -0.05 1.25 2.13 0.34 -1.66 120.64 117.80 3dbl n GLU 29 Ca -0.08 0.56 0.05 0.00 0.66 0.00 0.00 57.16 58.35 3dbl n GLU 29 Cb 0.14 -1.82 0.07 0.00 0.27 0.00 0.00 31.44 30.11 3dbl n GLU 29 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3dbl n SER 30 N -2.04 2.14 -4.94 4.31 2.88 -0.51 -3.91 113.62 111.55 3dbl n SER 30 Ca -0.00 -1.60 -0.25 0.00 -1.33 0.00 0.00 58.87 55.68 3dbl n SER 30 Cb 0.06 -0.07 -0.02 0.00 -0.75 0.00 0.00 64.21 63.43 3dbl n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dbl s ALA 31 N -0.87 3.76 -0.14 -1.46 0.00 -0.82 -4.93 121.76 117.29 3dbl s ALA 31 Ca 0.14 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.25 3dbl s ALA 31 Cb 0.09 -2.06 0.02 0.00 0.00 0.00 0.00 23.12 21.17 3dbl s ALA 31 CO 0.13 0.19 -0.17 -1.58 0.00 0.00 0.00 175.76 174.33 3dbl s HIS 32 N -2.10 2.31 -0.06 0.00 2.46 -1.26 -2.32 115.29 114.33 3dbl s HIS 32 Ca 0.39 -1.21 0.01 0.00 0.47 0.00 0.00 55.06 54.72 3dbl s HIS 32 Cb -0.10 -1.64 -0.03 0.00 -0.13 0.00 0.00 32.58 30.68 3dbl s HIS 32 CO 0.32 -0.61 -0.06 0.08 -2.47 0.00 0.00 174.74 172.00 3dbl s VAL 33 N 1.12 3.78 -0.21 0.89 1.01 -0.50 -0.72 120.40 125.76 3dbl s VAL 33 Ca -0.02 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 3dbl s VAL 33 Cb -0.14 -2.57 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3dbl s VAL 33 CO -0.06 0.56 -0.05 0.00 0.00 0.00 0.00 175.10 175.56 3dbl s LEU 35 N 1.32 3.39 0.00 0.00 2.96 -0.04 -0.06 118.68 126.25 3dbl s LEU 35 Ca 0.04 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.84 3dbl s LEU 35 Cb -0.14 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.70 3dbl s LEU 35 CO -0.02 0.12 0.09 -0.38 -1.32 0.00 0.00 176.35 174.84 3dbl n ILE 36 N 3.85 0.00 -3.46 6.68 2.08 0.69 -1.22 119.36 127.98 3dbl n ILE 36 Ca -0.17 0.24 -0.38 0.00 0.56 0.00 0.00 62.75 63.00 3dbl n ILE 36 Cb 0.52 -0.55 -0.06 0.00 -0.75 0.00 0.00 39.64 38.80 3dbl n ILE 36 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 3dbl s ASN 37 N -1.31 6.79 -0.08 4.38 0.02 -1.26 -2.97 114.94 120.52 3dbl s ASN 37 Ca 0.00 0.94 -0.00 0.00 -1.02 0.00 0.00 52.86 52.78 3dbl s ASN 37 Cb 0.00 -2.26 0.06 0.00 0.02 0.00 0.00 41.25 39.07 3dbl s ASN 37 CO 0.00 0.26 1.97 0.00 0.02 0.00 0.00 177.10 179.35 3dbl n ALA 38 N 2.17 4.23 -1.63 0.60 0.00 -1.26 -3.84 120.51 120.78 3dbl n ALA 38 Ca -0.13 -0.42 -0.29 0.00 0.00 0.00 0.00 53.44 52.60 3dbl n ALA 38 Cb 0.52 -1.09 0.16 0.00 0.00 0.00 0.00 19.45 19.04 3dbl n ALA 38 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3dbl s THR 39 N -0.58 1.93 0.31 0.00 -4.23 -1.26 -4.60 115.64 107.21 3dbl s THR 39 Ca 0.08 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.65 3dbl s THR 39 Cb 0.06 -2.82 0.31 0.00 1.34 0.00 0.00 72.50 71.39 3dbl s THR 39 CO -0.00 0.00 1.79 0.00 -0.54 0.00 0.00 174.62 175.87 3dbl h ALA 40 N -1.66 1.71 0.36 3.99 0.00 -1.89 0.36 119.26 122.12 3dbl h ALA 40 Ca -0.47 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 3dbl h ALA 40 Cb 1.30 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3dbl h ALA 40 CO 0.51 -0.05 -0.17 1.15 0.00 0.00 0.00 179.25 180.68 3dbl h THR 41 N 0.76 0.65 -0.46 0.00 2.02 -1.90 -0.78 112.91 113.20 3dbl h THR 41 Ca 0.56 -0.34 0.04 0.00 0.77 0.00 0.00 66.41 67.44 3dbl h THR 41 Cb 0.87 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.06 3dbl h THR 41 CO -0.34 0.07 0.23 1.23 0.37 0.00 0.00 175.52 177.07 3dbl h GLY 42 N -0.68 0.64 0.50 2.16 0.00 -1.43 -1.32 103.07 102.93 3dbl h GLY 42 Ca -0.05 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.15 3dbl h GLY 42 CO 0.08 0.10 -0.27 -0.84 0.00 0.00 0.00 176.54 175.61 3dbl h THR 43 N 0.45 0.41 -0.76 4.70 2.02 -0.93 0.13 112.91 118.92 3dbl h THR 43 Ca 0.20 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.45 3dbl h THR 43 Cb 0.12 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 66.88 3dbl h THR 43 CO -0.15 0.00 0.45 -0.33 0.37 0.00 0.00 175.52 175.86 3dbl h GLU 44 N -0.46 0.79 -0.01 6.66 4.39 -0.83 0.38 114.58 125.49 3dbl h GLU 44 Ca 0.04 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 3dbl h GLU 44 Cb 0.50 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 3dbl h GLU 44 CO -0.17 0.52 0.00 0.82 -1.16 0.00 0.00 179.01 179.02 3dbl h ILE 45 N 0.81 1.14 -0.30 3.13 2.04 -0.84 -2.63 117.51 120.87 3dbl h ILE 45 Ca 0.34 -0.41 0.04 0.00 1.00 0.00 0.00 64.86 65.83 3dbl h ILE 45 Cb 0.21 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 3dbl h ILE 45 CO -0.19 0.11 0.21 0.25 0.00 0.00 0.00 178.15 178.53 3dbl h LEU 46 N -0.16 0.21 -0.28 1.44 5.85 -0.29 -2.00 115.31 120.09 3dbl h LEU 46 Ca 0.00 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3dbl h LEU 46 Cb 0.17 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3dbl h LEU 46 CO -0.00 0.15 0.10 0.50 -0.34 0.00 0.00 178.44 178.85 3dbl h LYS 47 N 0.25 0.42 0.00 1.25 3.11 -0.63 -1.99 116.57 118.98 3dbl h LYS 47 Ca 0.13 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 3dbl h LYS 47 Cb 0.21 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.37 3dbl h LYS 47 CO -0.02 0.46 0.00 0.09 -2.81 0.00 0.00 179.45 177.17 3dbl n ASN 48 N -4.74 0.00 -0.09 4.20 3.02 -0.76 -2.11 115.26 114.77 3dbl n ASN 48 Ca -0.02 -0.21 -0.13 0.00 -0.03 0.00 0.00 54.58 54.19 3dbl n ASN 48 Cb 0.14 -0.18 -0.09 0.00 -0.61 0.00 0.00 39.78 39.05 3dbl n ASN 48 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3dbl n LEU 49 N -1.18 2.98 -0.17 3.41 4.77 -1.09 -4.39 117.00 121.33 3dbl n LEU 49 Ca 0.11 -0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 55.88 3dbl n LEU 49 Cb 0.12 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 3dbl n LEU 49 CO 0.13 0.82 0.76 0.58 -1.33 0.00 0.00 177.39 178.35 3dbl h VAL 50 N -0.00 1.27 0.32 4.08 2.07 -1.26 -1.56 116.25 121.17 3dbl h VAL 50 Ca -0.42 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 65.91 3dbl h VAL 50 Cb 1.65 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3dbl h VAL 50 CO -0.07 0.41 -0.28 -0.07 0.02 0.00 0.00 177.57 177.58 3dbl h LEU 51 N 0.79 -0.75 -1.62 2.57 3.38 -1.67 -1.61 115.31 116.39 3dbl h LEU 51 Ca 0.13 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3dbl h LEU 51 Cb 0.61 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3dbl h LEU 51 CO 0.04 -0.42 0.00 1.55 0.09 0.00 0.00 178.44 179.70 3dbl h PRO 52 N -0.62 0.00 0.00 1.13 0.13 -1.75 -3.46 132.00 127.42 3dbl h PRO 52 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3dbl h PRO 52 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 3dbl h PRO 52 CO -0.03 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.15 3dbl n GLY 53 N -1.05 1.71 3.49 1.56 0.00 -0.61 -5.01 105.19 105.28 3dbl n GLY 53 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3dbl n GLY 53 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3dbl n ILE 54 N -0.38 2.07 0.30 -0.61 0.13 -0.61 -4.12 119.36 116.14 3dbl n ILE 54 Ca 0.00 -0.42 -0.16 0.00 -1.10 0.00 0.00 62.75 61.07 3dbl n ILE 54 Cb 0.00 -0.78 -0.08 0.00 -0.84 0.00 0.00 39.64 37.93 3dbl n ILE 54 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 3dbl h GLY 55 N -0.21 -0.79 -3.28 4.50 0.00 -1.25 -3.41 103.07 98.64 3dbl h GLY 55 Ca -0.46 0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 3dbl h GLY 55 CO 0.44 -0.29 0.13 -1.35 0.00 0.00 0.00 176.54 175.47 3dbl s SER 56 N -4.62 -0.50 0.18 0.19 1.04 -0.98 -2.47 113.70 106.54 3dbl s SER 56 Ca -0.16 0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.35 3dbl s SER 56 Cb 0.03 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 3dbl s SER 56 CO 0.57 -0.85 0.10 0.72 0.98 0.00 0.00 173.24 174.76 3dbl s PHE 57 N -3.14 1.08 -0.16 5.02 -0.12 0.24 -1.42 117.98 119.49 3dbl s PHE 57 Ca -0.02 -1.32 -0.07 0.00 -0.05 0.00 0.00 56.93 55.48 3dbl s PHE 57 Cb -0.00 -0.55 0.07 0.00 -0.63 0.00 0.00 43.02 41.90 3dbl s PHE 57 CO -0.07 -0.58 0.36 0.99 -0.05 0.00 0.00 175.22 175.87 3dbl s THR 58 N -4.09 -0.25 -0.10 -4.49 2.01 -0.39 -2.50 115.64 105.82 3dbl s THR 58 Ca 0.34 0.15 -0.04 0.00 0.31 0.00 0.00 61.69 62.45 3dbl s THR 58 Cb 0.07 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.99 3dbl s THR 58 CO 0.08 0.06 0.06 -0.63 -0.69 0.00 0.00 174.62 173.51 3dbl s ILE 59 N 1.85 4.79 -0.31 1.82 1.01 0.08 -0.86 121.20 129.59 3dbl s ILE 59 Ca -0.06 -0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.55 3dbl s ILE 59 Cb -0.10 -3.05 0.09 0.00 0.01 0.00 0.00 42.46 39.40 3dbl s ILE 59 CO -0.11 0.60 0.04 -0.63 0.00 0.00 0.00 174.94 174.84 3dbl s ILE 60 N -0.87 1.74 -0.08 2.92 1.01 -0.36 -0.40 121.20 125.16 3dbl s ILE 60 Ca 0.13 -1.83 -0.05 0.00 0.00 0.00 0.00 60.65 58.90 3dbl s ILE 60 Cb -0.12 -2.21 0.04 0.00 0.01 0.00 0.00 42.46 40.18 3dbl s ILE 60 CO 0.03 -0.50 0.19 -0.62 0.00 0.00 0.00 174.94 174.04 3dbl s ASP 61 N 1.21 -0.18 -0.01 3.58 -1.08 -0.81 -4.11 116.67 115.27 3dbl s ASP 61 Ca 0.06 0.40 0.17 0.00 -0.52 0.00 0.00 52.55 52.66 3dbl s ASP 61 Cb -0.19 0.31 -0.21 0.00 -1.46 0.00 0.00 42.92 41.38 3dbl s ASP 61 CO -0.12 -0.13 0.64 0.61 0.52 0.00 0.00 175.17 176.68 3dbl n GLY 62 N 3.90 -0.67 3.78 2.66 0.00 -1.14 -3.45 105.19 110.27 3dbl n GLY 62 Ca -0.22 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 3dbl n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dbl s ASN 63 N -2.99 5.52 0.26 1.61 0.01 -1.26 -4.86 114.94 113.23 3dbl s ASN 63 Ca 0.03 2.08 -0.08 0.00 -0.71 0.00 0.00 52.86 54.18 3dbl s ASN 63 Cb 0.12 -2.57 -0.06 0.00 0.41 0.00 0.00 41.25 39.15 3dbl s ASN 63 CO 0.71 -1.35 0.56 -1.10 -1.51 0.00 0.00 177.10 174.41 3dbl s GLN 64 N -3.63 3.73 -0.13 -0.60 -0.21 -1.26 -1.26 119.66 116.30 3dbl s GLN 64 Ca 0.70 0.18 -0.29 0.00 0.02 0.00 0.00 55.36 55.96 3dbl s GLN 64 Cb -0.22 -2.64 -0.02 0.00 1.00 0.00 0.00 33.01 31.13 3dbl s GLN 64 CO 0.33 0.27 1.30 0.08 -2.12 0.00 0.00 175.29 175.14 3dbl s VAL 65 N -1.93 4.19 0.54 1.09 1.01 0.42 -4.74 120.40 120.96 3dbl s VAL 65 Ca 0.46 1.45 0.05 0.00 0.00 0.00 0.00 61.98 63.94 3dbl s VAL 65 Cb -0.11 -3.94 0.05 0.00 0.00 0.00 0.00 36.38 32.38 3dbl s VAL 65 CO 0.25 -0.10 0.74 -0.94 0.00 0.00 0.00 175.10 175.05 3dbl s SER 66 N 2.02 5.24 0.18 3.32 1.04 -1.26 -0.31 113.70 123.92 3dbl s SER 66 Ca 0.57 -0.34 -0.17 0.00 0.48 0.00 0.00 55.95 56.48 3dbl s SER 66 Cb -0.24 -0.47 0.15 0.00 0.10 0.00 0.00 66.02 65.55 3dbl s SER 66 CO 0.18 -1.16 1.63 1.23 0.98 0.00 0.00 173.24 176.10 3dbl h GLY 67 N 0.19 0.19 2.00 7.32 0.00 -1.99 -1.37 103.07 109.42 3dbl h GLY 67 Ca -0.38 0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 3dbl h GLY 67 CO 0.46 -0.21 -0.12 1.05 0.00 0.00 0.00 176.54 177.72 3dbl h GLU 68 N -0.08 0.00 -0.35 4.80 4.11 -1.99 -2.43 114.58 118.64 3dbl h GLU 68 Ca 0.23 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.57 3dbl h GLU 68 Cb 0.45 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3dbl h GLU 68 CO -0.55 0.12 -0.18 -0.44 0.07 0.00 0.00 179.01 178.02 3dbl h ASP 69 N 0.00 0.65 1.37 3.06 3.32 -1.64 -2.35 116.42 120.83 3dbl h ASP 69 Ca -0.00 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.84 3dbl h ASP 69 Cb 0.68 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3dbl h ASP 69 CO 0.01 0.84 0.00 0.00 -1.72 0.00 0.00 179.24 178.38 3dbl h ALA 70 N 1.22 1.00 0.06 3.45 0.00 -0.92 -2.89 119.26 121.17 3dbl h ALA 70 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.70 3dbl h ALA 70 Cb 0.64 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3dbl h ALA 70 CO 0.05 0.00 -1.69 0.78 0.00 0.00 0.00 179.25 178.39 3dbl h GLY 71 N 3.06 0.13 -0.16 0.00 0.00 -1.15 -3.40 103.07 101.56 3dbl h GLY 71 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3dbl h GLY 71 CO 0.00 0.30 -0.61 1.16 0.00 0.00 0.00 176.54 177.39 3dbl n ASN 72 N -3.26 0.90 -4.79 0.19 2.04 -1.05 -4.96 115.26 104.33 3dbl n ASN 72 Ca -0.19 -0.95 -0.37 0.00 -0.44 0.00 0.00 54.58 52.63 3dbl n ASN 72 Cb 1.04 0.88 -0.07 0.00 -2.53 0.00 0.00 39.78 39.10 3dbl n ASN 72 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 3dbl s ASN 73 N -2.27 6.43 0.00 0.53 3.84 -1.09 -4.67 114.94 117.71 3dbl s ASN 73 Ca 0.07 0.51 0.27 0.00 0.21 0.00 0.00 52.86 53.92 3dbl s ASN 73 Cb 0.11 -2.14 0.84 0.00 -0.55 0.00 0.00 41.25 39.52 3dbl s ASN 73 CO 0.56 0.25 1.62 0.33 -2.79 0.00 0.00 177.10 177.07 3dbl n PHE 74 N 2.77 0.00 -1.61 0.43 7.35 -1.26 -3.99 117.46 121.15 3dbl n PHE 74 Ca -0.16 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.53 3dbl n PHE 74 Cb 0.53 -0.14 0.19 0.00 0.35 0.00 0.00 39.48 40.41 3dbl n PHE 74 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3dbl n PHE 75 N -0.73 0.60 -3.93 -5.13 3.01 -1.26 -4.97 117.46 105.04 3dbl n PHE 75 Ca 0.12 -1.63 -0.08 0.00 1.01 0.00 0.00 57.45 56.87 3dbl n PHE 75 Cb 0.33 -0.33 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 3dbl n PHE 75 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dbl s LEU 76 N -3.29 1.68 0.17 4.37 1.43 -1.26 -3.98 118.68 117.80 3dbl s LEU 76 Ca 0.41 -0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 52.70 3dbl s LEU 76 Cb 0.39 0.81 -0.03 0.00 0.03 0.00 0.00 46.19 47.38 3dbl s LEU 76 CO -0.04 -0.71 0.17 -1.10 0.23 0.00 0.00 176.35 174.90 3dbl s GLN 77 N -3.89 1.13 0.24 1.70 -0.21 -1.26 -4.93 119.66 112.44 3dbl s GLN 77 Ca 0.07 -1.43 -0.14 0.00 0.02 0.00 0.00 55.36 53.88 3dbl s GLN 77 Cb 0.06 0.30 0.31 0.00 1.00 0.00 0.00 33.01 34.68 3dbl s GLN 77 CO -0.09 -0.38 1.57 -0.09 -2.12 0.00 0.00 175.29 174.18 3dbl h ARG 78 N 2.65 -0.02 -0.28 2.91 1.12 -1.98 -0.01 114.38 118.77 3dbl h ARG 78 Ca -0.34 0.00 0.08 0.00 -1.11 0.00 0.00 59.98 58.62 3dbl h ARG 78 Cb 1.23 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 31.18 3dbl h ARG 78 CO 0.52 -0.02 0.63 0.66 -3.11 0.00 0.00 179.97 178.66 3dbl h SER 79 N -0.02 0.00 -0.58 -3.80 4.64 -2.00 -2.68 113.55 109.11 3dbl h SER 79 Ca 0.38 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.55 3dbl h SER 79 Cb 0.63 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.63 3dbl h SER 79 CO -0.92 0.00 0.15 -1.54 -0.87 0.00 0.00 176.83 173.65 3dbl n SER 80 N -3.10 4.44 -4.72 4.97 3.41 -0.02 -4.96 113.62 113.64 3dbl n SER 80 Ca 0.05 -3.23 -0.42 0.00 -0.26 0.00 0.00 58.87 55.02 3dbl n SER 80 Cb 0.75 -0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 3dbl n SER 80 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dbl s ILE 81 N -2.98 3.96 0.00 -1.33 1.01 -1.01 -2.74 121.20 118.10 3dbl s ILE 81 Ca 0.51 1.47 0.00 0.00 0.00 0.00 0.00 60.65 62.63 3dbl s ILE 81 Cb 0.42 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.95 3dbl s ILE 81 CO 0.11 0.15 0.00 0.61 0.00 0.00 0.00 174.94 175.81 3dbl n GLY 82 N 2.91 3.35 3.92 6.18 0.00 0.57 -4.92 105.19 117.21 3dbl n GLY 82 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 3dbl n GLY 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dbl s LYS 83 N -0.73 1.87 0.09 1.61 1.02 -1.11 -4.64 119.74 117.86 3dbl s LYS 83 Ca 0.00 -0.22 -0.31 0.00 0.02 0.00 0.00 55.97 55.46 3dbl s LYS 83 Cb 0.00 -2.07 -0.07 0.00 -0.52 0.00 0.00 37.83 35.17 3dbl s LYS 83 CO 0.00 -1.53 1.35 1.21 -0.92 0.00 0.00 175.35 175.46 3dbl s ASN 84 N -4.60 6.88 0.19 2.83 3.84 -1.26 -0.44 114.94 122.38 3dbl s ASN 84 Ca 0.63 2.24 -0.07 0.00 0.21 0.00 0.00 52.86 55.87 3dbl s ASN 84 Cb -0.09 -2.58 0.11 0.00 -0.55 0.00 0.00 41.25 38.13 3dbl s ASN 84 CO 0.47 -0.62 1.59 -0.09 -2.79 0.00 0.00 177.10 175.67 3dbl h ARG 85 N 6.89 0.86 -0.41 0.43 2.43 -1.46 -1.51 114.38 121.62 3dbl h ARG 85 Ca -0.42 -0.36 0.01 0.00 -0.81 0.00 0.00 59.98 58.40 3dbl h ARG 85 Cb 1.21 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 3dbl h ARG 85 CO 0.86 1.00 0.26 0.00 -1.51 0.00 0.00 179.97 180.58 3dbl h ALA 86 N 0.99 0.51 -0.21 2.80 0.00 -1.80 0.07 119.26 121.63 3dbl h ALA 86 Ca 0.10 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3dbl h ALA 86 Cb 0.77 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3dbl h ALA 86 CO 0.06 -0.05 -0.18 1.49 0.00 0.00 0.00 179.25 180.57 3dbl h GLU 87 N 0.53 0.50 -0.74 0.00 4.81 -1.87 -2.51 114.58 115.30 3dbl h GLU 87 Ca 0.15 -0.25 0.07 0.00 -0.13 0.00 0.00 59.36 59.20 3dbl h GLU 87 Cb -0.04 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.28 3dbl h GLU 87 CO -0.04 0.82 0.41 0.00 -0.73 0.00 0.00 179.01 179.47 3dbl h ALA 88 N 0.66 1.01 -0.32 2.92 0.00 -1.09 -2.59 119.26 119.85 3dbl h ALA 88 Ca 0.04 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 3dbl h ALA 88 Cb 0.72 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3dbl h ALA 88 CO 0.05 0.07 -0.42 0.00 0.00 0.00 0.00 179.25 178.95 3dbl h ALA 89 N 1.39 0.64 -0.67 0.00 0.00 -0.98 -3.30 119.26 116.33 3dbl h ALA 89 Ca 0.34 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3dbl h ALA 89 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3dbl h ALA 89 CO -0.21 0.67 0.12 1.98 0.00 0.00 0.00 179.25 181.81 3dbl h MET 90 N 0.66 1.11 -0.21 0.00 -1.53 -1.06 -1.73 114.93 112.17 3dbl h MET 90 Ca 0.05 -0.29 -0.02 0.00 -3.44 0.00 0.00 59.70 56.00 3dbl h MET 90 Cb 0.99 -0.13 -0.01 0.00 -0.55 0.00 0.00 31.60 31.90 3dbl h MET 90 CO 0.10 1.01 0.05 0.93 0.14 0.00 0.00 176.91 179.13 3dbl h GLU 91 N 1.04 0.29 0.14 0.39 5.08 -1.58 0.13 114.58 120.06 3dbl h GLU 91 Ca 0.21 -0.04 -0.29 0.00 -1.00 0.00 0.00 59.36 58.24 3dbl h GLU 91 Cb 0.43 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3dbl h GLU 91 CO 0.01 0.28 -1.38 0.74 -1.00 0.00 0.00 179.01 177.66 3dbl h PHE 92 N 0.30 0.53 -0.01 4.33 0.05 -1.61 -3.25 116.94 117.27 3dbl h PHE 92 Ca 0.07 -0.38 -0.01 0.00 3.82 0.00 0.00 57.97 61.47 3dbl h PHE 92 Cb 0.13 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 38.05 3dbl h PHE 92 CO 0.00 1.35 -0.03 -0.07 -0.18 0.00 0.00 178.31 179.38 3dbl h LEU 93 N 0.08 0.05 -0.91 1.54 3.38 -1.10 -3.15 115.31 115.21 3dbl h LEU 93 Ca -0.19 -0.58 0.21 0.00 0.09 0.00 0.00 57.88 57.41 3dbl h LEU 93 Cb 2.01 -0.02 -0.17 0.00 0.09 0.00 0.00 40.66 42.57 3dbl h LEU 93 CO 0.19 0.63 -0.13 1.67 0.09 0.00 0.00 178.44 180.89 3dbl n GLN 94 N -4.77 -0.08 -0.36 1.13 -0.06 0.42 0.68 117.38 114.34 3dbl n GLN 94 Ca -0.09 1.39 0.29 0.00 -2.00 0.00 0.00 57.00 56.60 3dbl n GLN 94 Cb 0.31 -2.14 0.59 0.00 -4.06 0.00 0.00 30.24 24.94 3dbl n GLN 94 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 3dbl h GLU 95 N 0.00 0.24 -0.20 3.69 5.08 -1.57 -2.61 114.58 119.21 3dbl h GLU 95 Ca 0.48 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.89 3dbl h GLU 95 Cb 0.86 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 3dbl h GLU 95 CO -0.90 0.16 0.18 -0.07 -1.00 0.00 0.00 179.01 177.38 3dbl h LEU 96 N 0.25 0.00 -6.16 1.33 3.38 0.11 -3.42 115.31 110.79 3dbl h LEU 96 Ca 0.66 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.81 3dbl h LEU 96 Cb 1.96 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 42.49 3dbl h LEU 96 CO -0.29 0.00 0.02 0.21 0.09 0.00 0.00 178.44 178.47 3dbl s ASN 97 N -6.09 -0.79 0.52 -0.43 3.84 -0.98 -4.84 114.94 106.16 3dbl s ASN 97 Ca -0.05 0.64 0.20 0.00 0.21 0.00 0.00 52.86 53.86 3dbl s ASN 97 Cb 0.16 1.72 1.36 0.00 -0.55 0.00 0.00 41.25 43.95 3dbl s ASN 97 CO 0.60 -0.15 2.14 0.77 -2.79 0.00 0.00 177.10 177.67 3dbl h SER 98 N 7.89 0.00 0.44 -4.21 4.64 -1.82 -2.54 113.55 117.95 3dbl h SER 98 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3dbl h SER 98 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3dbl h SER 98 CO 0.06 0.04 0.00 0.47 -0.87 0.00 0.00 176.83 176.53 3dbl n ASP 99 N -4.28 0.00 -4.82 4.97 10.43 -1.26 -4.73 116.55 116.85 3dbl n ASP 99 Ca -0.03 0.48 -0.37 0.00 2.57 0.00 0.00 54.79 57.44 3dbl n ASP 99 Cb 0.13 -0.49 -0.06 0.00 1.84 0.00 0.00 41.12 42.53 3dbl n ASP 99 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3dbl s VAL 100 N -2.98 5.24 -0.43 2.53 1.01 -0.96 -4.88 120.40 119.93 3dbl s VAL 100 Ca 0.07 0.58 -0.18 0.00 0.00 0.00 0.00 61.98 62.45 3dbl s VAL 100 Cb 0.08 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.89 3dbl s VAL 100 CO 0.24 0.55 0.50 -0.44 0.00 0.00 0.00 175.10 175.94 3dbl s SER 101 N -0.70 6.23 0.36 3.32 0.01 -1.03 -4.98 113.70 116.91 3dbl s SER 101 Ca 0.19 -0.58 -0.12 0.00 1.31 0.00 0.00 55.95 56.75 3dbl s SER 101 Cb -0.14 -2.25 -0.07 0.00 0.21 0.00 0.00 66.02 63.76 3dbl s SER 101 CO 0.08 -0.64 0.74 -0.83 0.41 0.00 0.00 173.24 173.00 3dbl s GLY 102 N 1.88 2.11 -0.23 3.44 0.00 -1.26 -0.59 107.32 112.66 3dbl s GLY 102 Ca 0.15 -0.12 -0.26 0.00 0.00 0.00 0.00 44.72 44.49 3dbl s GLY 102 CO 0.15 0.07 0.83 -0.56 0.00 0.00 0.00 173.10 173.60 3dbl s SER 103 N -2.78 -0.61 0.08 1.64 0.01 -1.04 -4.92 113.70 106.07 3dbl s SER 103 Ca 0.52 1.08 0.01 0.00 1.31 0.00 0.00 55.95 58.87 3dbl s SER 103 Cb -0.10 1.06 -0.04 0.00 0.21 0.00 0.00 66.02 67.15 3dbl s SER 103 CO 0.25 -0.28 -0.05 0.72 0.41 0.00 0.00 173.24 174.29 3dbl s PHE 104 N -0.01 0.75 -0.09 2.43 -0.12 -1.26 -0.74 117.98 118.93 3dbl s PHE 104 Ca -0.01 -0.95 -0.01 0.00 -0.05 0.00 0.00 56.93 55.91 3dbl s PHE 104 Cb -0.04 -0.46 0.03 0.00 -0.63 0.00 0.00 43.02 41.91 3dbl s PHE 104 CO 0.00 -0.23 -0.04 0.08 -0.05 0.00 0.00 175.22 174.98 3dbl s VAL 105 N -3.64 0.74 -0.15 -2.49 1.01 0.46 -4.91 120.40 111.42 3dbl s VAL 105 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.93 3dbl s VAL 105 Cb 0.06 -0.81 0.02 0.00 0.00 0.00 0.00 36.38 35.65 3dbl s VAL 105 CO -0.06 0.31 2.38 -0.62 0.00 0.00 0.00 175.10 177.11 3dbl n GLU 106 N 4.91 1.57 -4.27 2.72 1.02 -1.26 -1.92 120.64 123.42 3dbl n GLU 106 Ca -0.12 -0.91 -0.18 0.00 -0.02 0.00 0.00 57.16 55.93 3dbl n GLU 106 Cb 0.50 -1.49 -0.11 0.00 -0.02 0.00 0.00 31.44 30.33 3dbl n GLU 106 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3dbl s GLU 107 N -0.57 1.10 0.58 3.49 0.41 -1.22 -4.55 118.70 117.94 3dbl s GLU 107 Ca 0.28 -1.33 -0.16 0.00 -0.41 0.00 0.00 54.97 53.35 3dbl s GLU 107 Cb 0.17 -0.95 -0.04 0.00 -1.78 0.00 0.00 34.13 31.53 3dbl s GLU 107 CO -0.03 0.18 1.05 -1.54 -0.49 0.00 0.00 175.26 174.43 3dbl s SER 108 N -2.68 5.91 0.30 -0.19 1.04 -1.26 -2.88 113.70 113.93 3dbl s SER 108 Ca 0.13 1.77 -0.02 0.00 0.48 0.00 0.00 55.95 58.30 3dbl s SER 108 Cb -0.04 -2.53 0.45 0.00 0.10 0.00 0.00 66.02 64.01 3dbl s SER 108 CO 0.04 -1.08 1.96 1.55 0.98 0.00 0.00 173.24 176.69 3dbl h PRO 109 N 0.46 1.08 -0.76 4.02 0.13 -1.96 -1.64 132.00 133.33 3dbl h PRO 109 Ca -0.47 -0.06 0.06 0.00 -0.87 0.00 0.00 66.00 64.66 3dbl h PRO 109 Cb 1.21 -0.24 -0.06 0.00 0.13 0.00 0.00 31.00 32.04 3dbl h PRO 109 CO 0.58 0.71 0.45 0.93 -0.23 0.00 0.00 178.00 180.44 3dbl h GLU 110 N 1.11 0.79 -0.13 0.86 4.39 -1.97 -1.94 114.58 117.69 3dbl h GLU 110 Ca 0.31 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.91 3dbl h GLU 110 Cb -0.09 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.37 3dbl h GLU 110 CO -0.07 0.53 -0.18 -0.97 -1.16 0.00 0.00 179.01 177.15 3dbl h ASN 111 N 0.82 0.21 0.40 1.42 -0.73 -1.67 -2.77 115.58 113.27 3dbl h ASN 111 Ca 0.34 -0.05 -0.24 0.00 1.87 0.00 0.00 56.30 58.22 3dbl h ASN 111 Cb 0.19 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.73 3dbl h ASN 111 CO -0.18 0.41 -1.03 -0.07 -0.37 0.00 0.00 177.43 176.19 3dbl h LEU 112 N 0.21 0.52 -1.87 0.34 3.38 -1.25 -2.18 115.31 114.46 3dbl h LEU 112 Ca 0.04 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3dbl h LEU 112 Cb 0.45 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3dbl h LEU 112 CO 0.03 1.27 0.00 -0.07 0.09 0.00 0.00 178.44 179.76 3dbl h LEU 113 N 0.19 0.00 0.04 1.67 3.38 -1.10 0.13 115.31 119.62 3dbl h LEU 113 Ca -0.10 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.51 3dbl h LEU 113 Cb 1.69 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.40 3dbl h LEU 113 CO 0.18 0.00 -2.08 0.47 0.09 0.00 0.00 178.44 177.10 3dbl n ASP 114 N -2.66 1.99 -0.04 -0.43 8.00 -1.09 -4.47 116.55 117.85 3dbl n ASP 114 Ca -0.01 0.20 -0.18 0.00 0.71 0.00 0.00 54.79 55.50 3dbl n ASP 114 Cb 0.11 -0.76 -0.13 0.00 -0.02 0.00 0.00 41.12 40.31 3dbl n ASP 114 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3dbl n ASN 115 N -3.82 1.84 -3.17 -2.24 3.02 -0.83 -4.73 115.26 105.33 3dbl n ASN 115 Ca -0.41 0.11 -0.21 0.00 -0.03 0.00 0.00 54.58 54.04 3dbl n ASN 115 Cb 0.91 -0.55 -0.04 0.00 -0.61 0.00 0.00 39.78 39.49 3dbl n ASN 115 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3dbl n ASP 116 N -3.33 1.44 -0.30 6.41 -0.08 0.43 -4.96 116.55 116.16 3dbl n ASP 116 Ca -0.35 -3.07 0.26 0.00 -1.51 0.00 0.00 54.79 50.12 3dbl n ASP 116 Cb 1.04 -0.62 0.59 0.00 2.34 0.00 0.00 41.12 44.47 3dbl n ASP 116 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3dbl h PRO 117 N 3.32 0.25 0.00 -0.67 0.11 -1.71 0.24 132.00 133.54 3dbl h PRO 117 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3dbl h PRO 117 Cb 0.85 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.91 3dbl h PRO 117 CO 0.56 0.17 0.00 -1.13 -0.21 0.00 0.00 178.00 177.39 3dbl n SER 118 N -4.47 0.00 -0.31 -2.05 3.41 -1.26 -3.90 113.62 105.03 3dbl n SER 118 Ca 0.24 0.12 0.24 0.00 -0.26 0.00 0.00 58.87 59.21 3dbl n SER 118 Cb 0.95 -0.37 0.54 0.00 -0.26 0.00 0.00 64.21 65.07 3dbl n SER 118 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3dbl h PHE 119 N 0.00 0.57 0.00 7.33 3.57 -0.88 -0.94 116.94 126.58 3dbl h PHE 119 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3dbl h PHE 119 Cb 0.35 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3dbl h PHE 119 CO 0.00 0.06 0.00 1.19 -2.23 0.00 0.00 178.31 177.33 3dbl n PHE 120 N -4.57 0.00 0.30 0.41 3.01 -1.25 -3.53 117.46 111.83 3dbl n PHE 120 Ca 0.25 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.88 3dbl n PHE 120 Cb 0.90 -0.28 0.72 0.00 -0.01 0.00 0.00 39.48 40.82 3dbl n PHE 120 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dbl h ARG 122 N 0.00 0.00 -6.51 0.00 0.11 -1.78 -3.46 114.38 102.74 3dbl h ARG 122 Ca 0.00 0.00 -0.53 0.00 0.10 0.00 0.00 59.98 59.55 3dbl h ARG 122 Cb 0.42 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.47 3dbl h ARG 122 CO 0.00 0.00 -0.01 -0.06 0.10 0.00 0.00 179.97 180.00 3dbl s PHE 123 N -3.25 3.50 0.13 4.08 0.40 -1.07 -4.83 117.98 116.93 3dbl s PHE 123 Ca 0.07 1.11 -0.03 0.00 -0.60 0.00 0.00 56.93 57.48 3dbl s PHE 123 Cb 0.10 -2.43 -0.11 0.00 0.51 0.00 0.00 43.02 41.09 3dbl s PHE 123 CO 0.56 0.27 1.29 1.15 0.70 0.00 0.00 175.22 179.19 3dbl h THR 124 N 2.33 1.43 -2.75 0.64 2.02 -1.26 -3.47 112.91 111.85 3dbl h THR 124 Ca -0.48 -2.57 -0.09 0.00 0.77 0.00 0.00 66.41 64.04 3dbl h THR 124 Cb 1.18 2.51 -0.18 0.00 -1.74 0.00 0.00 68.15 69.92 3dbl h THR 124 CO 0.66 0.76 -0.08 -0.69 0.37 0.00 0.00 175.52 176.55 3dbl s VAL 125 N -3.16 0.04 -0.09 3.16 1.01 -1.25 -4.37 120.40 115.75 3dbl s VAL 125 Ca -0.05 -0.33 0.03 0.00 0.00 0.00 0.00 61.98 61.63 3dbl s VAL 125 Cb 0.09 -0.84 0.00 0.00 0.00 0.00 0.00 36.38 35.63 3dbl s VAL 125 CO 0.86 -0.18 -0.20 -0.69 0.00 0.00 0.00 175.10 174.89 3dbl s VAL 126 N -1.74 1.72 -0.22 2.92 1.01 -0.68 -2.25 120.40 121.16 3dbl s VAL 126 Ca -0.10 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.05 3dbl s VAL 126 Cb -0.02 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.87 3dbl s VAL 126 CO 0.03 0.49 -0.12 -0.69 0.00 0.00 0.00 175.10 174.81 3dbl s VAL 127 N 0.46 2.60 -0.09 2.92 1.01 0.91 -1.09 120.40 127.13 3dbl s VAL 127 Ca -0.17 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 60.86 3dbl s VAL 127 Cb -0.17 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 3dbl s VAL 127 CO 0.07 0.36 0.01 0.00 0.00 0.00 0.00 175.10 175.54 3dbl s ALA 128 N 1.33 3.31 0.03 5.51 0.00 -0.51 -0.22 121.76 131.21 3dbl s ALA 128 Ca 0.03 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.21 3dbl s ALA 128 Cb -0.15 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 3dbl s ALA 128 CO -0.08 0.59 -0.08 0.95 0.00 0.00 0.00 175.76 177.15 3dbl s THR 129 N -0.89 0.58 -1.40 0.00 -4.23 -1.26 -0.47 115.64 107.96 3dbl s THR 129 Ca 0.13 -0.85 -0.01 0.00 -1.18 0.00 0.00 61.69 59.79 3dbl s THR 129 Cb -0.11 -0.59 0.00 0.00 1.34 0.00 0.00 72.50 73.14 3dbl s THR 129 CO 0.02 -0.21 0.41 0.00 -0.54 0.00 0.00 174.62 174.31 3dbl n GLN 130 N 1.90 -3.07 -3.77 3.99 1.13 -1.00 -4.11 117.38 112.45 3dbl n GLN 130 Ca -0.20 0.39 -0.35 0.00 -1.94 0.00 0.00 57.00 54.90 3dbl n GLN 130 Cb 0.56 -4.44 -0.09 0.00 0.11 0.00 0.00 30.24 26.38 3dbl n GLN 130 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dbl s LEU 131 N -6.98 4.12 0.64 1.08 1.43 -1.26 -5.01 118.68 112.70 3dbl s LEU 131 Ca 0.02 0.18 -0.18 0.00 -1.03 0.00 0.00 54.13 53.13 3dbl s LEU 131 Cb -0.01 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 3dbl s LEU 131 CO 0.89 0.16 1.23 -2.16 0.23 0.00 0.00 176.35 176.71 3dbl s PRO 132 N 0.46 2.68 0.27 1.29 0.04 -1.26 -4.77 135.00 133.71 3dbl s PRO 132 Ca 0.07 1.87 -0.02 0.00 0.04 0.00 0.00 61.00 62.96 3dbl s PRO 132 Cb -0.12 -1.89 0.57 0.00 0.04 0.00 0.00 34.50 33.11 3dbl s PRO 132 CO -0.01 -1.45 1.41 -1.91 0.04 0.00 0.00 177.00 175.08 3dbl n GLU 133 N -1.93 -0.08 0.04 4.56 2.13 -1.26 -2.34 120.64 121.76 3dbl n GLU 133 Ca 0.14 1.37 -0.05 0.00 0.66 0.00 0.00 57.16 59.28 3dbl n GLU 133 Cb 0.49 -2.12 -0.03 0.00 0.27 0.00 0.00 31.44 30.05 3dbl n GLU 133 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3dbl h SER 134 N 0.00 -0.53 -0.94 4.31 0.87 -1.96 -2.47 113.55 112.83 3dbl h SER 134 Ca 0.50 0.06 0.20 0.00 -1.23 0.00 0.00 61.79 61.31 3dbl h SER 134 Cb 0.92 0.20 -0.08 0.00 -0.44 0.00 0.00 62.40 63.00 3dbl h SER 134 CO -0.88 -0.18 0.61 0.74 -0.53 0.00 0.00 176.83 176.58 3dbl h THR 135 N -0.25 0.70 0.47 2.23 2.02 -1.82 -2.16 112.91 114.10 3dbl h THR 135 Ca -0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 3dbl h THR 135 Cb 0.25 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 3dbl h THR 135 CO -0.10 0.10 -0.29 0.28 0.37 0.00 0.00 175.52 175.88 3dbl h SER 136 N 0.56 -0.73 -0.28 4.18 0.02 -1.26 0.56 113.55 116.60 3dbl h SER 136 Ca 0.51 0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.57 3dbl h SER 136 Cb 1.05 0.22 -0.07 0.00 0.14 0.00 0.00 62.40 63.74 3dbl h SER 136 CO -0.25 -0.46 -0.17 -0.07 -1.14 0.00 0.00 176.83 174.74 3dbl h LEU 137 N -0.73 -0.55 -0.15 5.07 3.38 -0.96 0.63 115.31 122.00 3dbl h LEU 137 Ca -0.05 0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.08 3dbl h LEU 137 Cb 0.60 0.29 -0.05 0.00 0.09 0.00 0.00 40.66 41.59 3dbl h LEU 137 CO 0.05 -0.21 -0.17 -0.09 0.09 0.00 0.00 178.44 178.12 3dbl h ARG 138 N -0.14 -0.20 0.09 1.13 9.65 -1.14 -1.70 114.38 122.07 3dbl h ARG 138 Ca 0.15 0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.04 3dbl h ARG 138 Cb 0.37 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 3dbl h ARG 138 CO -0.37 -0.13 -0.04 1.25 2.80 0.00 0.00 179.97 183.48 3dbl h LEU 139 N -0.20 -0.10 -0.78 3.80 5.85 0.88 -2.30 115.31 122.47 3dbl h LEU 139 Ca 0.10 -0.15 0.17 0.00 0.84 0.00 0.00 57.88 58.84 3dbl h LEU 139 Cb 0.35 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 41.30 3dbl h LEU 139 CO -0.27 0.09 0.25 0.00 -0.34 0.00 0.00 178.44 178.18 3dbl h ALA 140 N 0.61 1.08 0.25 1.25 0.00 0.37 -0.62 119.26 122.20 3dbl h ALA 140 Ca -0.01 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3dbl h ALA 140 Cb 0.24 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3dbl h ALA 140 CO 0.02 -0.30 -0.12 0.22 0.00 0.00 0.00 179.25 179.07 3dbl h ASP 141 N 0.34 -0.28 0.12 0.00 1.82 -1.18 0.56 116.42 117.79 3dbl h ASP 141 Ca 0.45 -0.19 0.02 0.00 -0.39 0.00 0.00 57.03 56.92 3dbl h ASP 141 Cb 0.76 0.07 -0.04 0.00 0.68 0.00 0.00 39.33 40.80 3dbl h ASP 141 CO -0.49 0.04 -0.32 0.58 -1.61 0.00 0.00 179.24 177.45 3dbl h VAL 142 N -0.63 0.32 -0.65 2.25 2.07 -0.97 -1.91 116.25 116.75 3dbl h VAL 142 Ca -0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.52 3dbl h VAL 142 Cb 0.45 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 3dbl h VAL 142 CO 0.06 0.00 0.43 -0.07 0.02 0.00 0.00 177.57 178.00 3dbl h LEU 143 N -0.54 0.67 -0.03 2.57 3.38 -1.16 -2.22 115.31 117.98 3dbl h LEU 143 Ca 0.03 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dbl h LEU 143 Cb 0.57 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3dbl h LEU 143 CO -0.19 0.47 0.02 -0.25 0.09 0.00 0.00 178.44 178.57 3dbl h TRP 144 N 0.78 0.04 -0.80 1.13 2.91 -0.26 0.10 115.95 119.86 3dbl h TRP 144 Ca 0.26 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.25 3dbl h TRP 144 Cb 0.05 -0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 28.65 3dbl h TRP 144 CO -0.00 0.09 0.38 -0.91 -1.03 0.00 0.00 178.44 176.97 3dbl h ASN 145 N -0.02 1.04 -0.07 2.65 2.35 -1.02 -0.33 115.58 120.19 3dbl h ASN 145 Ca 0.01 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 3dbl h ASN 145 Cb 0.06 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.16 3dbl h ASN 145 CO -0.00 0.88 0.00 -1.54 -1.65 0.00 0.00 177.43 175.12 3dbl n SER 146 N -4.31 0.63 -3.67 5.81 3.41 -0.87 -4.92 113.62 109.70 3dbl n SER 146 Ca 0.08 -1.57 -0.23 0.00 -0.26 0.00 0.00 58.87 56.89 3dbl n SER 146 Cb 0.14 -0.04 0.05 0.00 -0.26 0.00 0.00 64.21 64.10 3dbl n SER 146 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dbl n GLN 147 N -0.35 -5.83 -3.80 4.33 6.02 -0.13 -4.99 117.38 112.62 3dbl n GLN 147 Ca 0.14 0.69 -0.36 0.00 -0.01 0.00 0.00 57.00 57.46 3dbl n GLN 147 Cb 0.16 -5.49 -0.12 0.00 1.02 0.00 0.00 30.24 25.81 3dbl n GLN 147 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3dbl s ILE 148 N -3.48 4.45 0.22 5.09 -1.09 0.19 -5.02 121.20 121.57 3dbl s ILE 148 Ca 0.22 -0.13 -0.31 0.00 -2.23 0.00 0.00 60.65 58.20 3dbl s ILE 148 Cb -0.10 -3.07 -0.14 0.00 -1.58 0.00 0.00 42.46 37.56 3dbl s ILE 148 CO 0.79 0.35 1.27 -2.65 -1.23 0.00 0.00 174.94 173.47 3dbl n PRO 149 N 4.68 1.63 -4.55 2.79 -0.02 -1.26 -4.58 135.00 133.69 3dbl n PRO 149 Ca -0.16 0.58 -0.22 0.00 -2.02 0.00 0.00 63.50 61.68 3dbl n PRO 149 Cb 0.52 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.71 3dbl n PRO 149 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3dbl s LEU 150 N 0.30 2.10 -0.17 2.45 2.96 -0.77 -1.69 118.68 123.86 3dbl s LEU 150 Ca 0.69 -0.38 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 3dbl s LEU 150 Cb -0.73 -0.73 0.05 0.00 0.50 0.00 0.00 46.19 45.29 3dbl s LEU 150 CO 0.52 0.12 0.04 -0.22 -1.32 0.00 0.00 176.35 175.49 3dbl s LEU 151 N -0.77 0.96 -0.32 -0.68 2.96 -0.25 -0.02 118.68 120.57 3dbl s LEU 151 Ca 0.04 -0.67 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 3dbl s LEU 151 Cb -0.07 -0.52 -0.03 0.00 0.50 0.00 0.00 46.19 46.08 3dbl s LEU 151 CO 0.00 -0.30 0.23 -0.63 -1.32 0.00 0.00 176.35 174.34 3dbl s ILE 152 N 1.92 5.29 0.10 6.68 1.01 -0.38 -1.43 121.20 134.39 3dbl s ILE 152 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.68 3dbl s ILE 152 Cb -0.16 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.61 3dbl s ILE 152 CO -0.08 0.08 -0.12 0.00 0.00 0.00 0.00 174.94 174.82 3dbl s ARG 154 N -2.12 0.44 -0.14 0.00 3.52 0.68 -2.39 118.95 118.94 3dbl s ARG 154 Ca 0.20 0.81 -0.03 0.00 -0.13 0.00 0.00 55.73 56.58 3dbl s ARG 154 Cb -0.11 0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.27 3dbl s ARG 154 CO 0.12 -0.15 -0.03 0.99 -0.81 0.00 0.00 175.30 175.42 3dbl s THR 155 N 1.29 3.95 -0.23 4.11 2.01 -1.26 -0.95 115.64 124.56 3dbl s THR 155 Ca -0.09 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.54 3dbl s THR 155 Cb -0.07 -2.72 0.11 0.00 0.01 0.00 0.00 72.50 69.83 3dbl s THR 155 CO -0.12 0.51 0.27 -0.47 -0.69 0.00 0.00 174.62 174.13 3dbl s TYR 156 N 0.13 -0.44 0.00 4.92 5.04 -0.72 -4.80 117.35 121.48 3dbl s TYR 156 Ca -0.01 0.26 0.00 0.00 -2.44 0.00 0.00 57.07 54.89 3dbl s TYR 156 Cb -0.14 -0.30 0.00 0.00 0.35 0.00 0.00 41.96 41.87 3dbl s TYR 156 CO 0.03 -0.70 0.00 0.41 -1.34 0.00 0.00 175.55 173.94 3dbl n GLY 157 N 5.33 3.63 1.35 8.97 0.00 0.93 -0.17 105.19 125.23 3dbl n GLY 157 Ca -0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.05 3dbl n GLY 157 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dbl n LEU 158 N 0.00 3.96 -4.72 0.99 4.77 -1.26 -4.39 117.00 116.34 3dbl n LEU 158 Ca 0.00 -2.00 -0.35 0.00 -0.03 0.00 0.00 56.01 53.63 3dbl n LEU 158 Cb 0.00 -0.53 -0.09 0.00 -2.33 0.00 0.00 43.42 40.47 3dbl n LEU 158 CO 0.00 0.64 -0.25 -0.69 -1.33 0.00 0.00 177.39 175.76 3dbl s VAL 159 N -1.87 4.84 -0.11 4.08 1.01 0.76 -0.63 120.40 128.48 3dbl s VAL 159 Ca 0.40 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.37 3dbl s VAL 159 Cb 0.27 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 3dbl s VAL 159 CO 0.18 0.56 -0.20 -0.83 0.00 0.00 0.00 175.10 174.81 3dbl s GLY 160 N -0.46 1.41 -0.05 4.51 0.00 0.18 -1.75 107.32 111.17 3dbl s GLY 160 Ca 0.10 -0.94 0.02 0.00 0.00 0.00 0.00 44.72 43.90 3dbl s GLY 160 CO 0.02 -0.27 -0.11 -0.47 0.00 0.00 0.00 173.10 172.27 3dbl s TYR 161 N 0.36 1.30 -0.03 1.90 5.04 -0.13 -0.63 117.35 125.16 3dbl s TYR 161 Ca -0.16 -0.43 0.02 0.00 -2.44 0.00 0.00 57.07 54.07 3dbl s TYR 161 Cb -0.17 -0.95 0.01 0.00 0.35 0.00 0.00 41.96 41.19 3dbl s TYR 161 CO 0.07 -0.22 -0.08 -1.64 -1.34 0.00 0.00 175.55 172.35 3dbl s MET 162 N 0.52 0.92 -0.20 4.97 -1.94 -0.33 -0.23 119.30 123.02 3dbl s MET 162 Ca -0.11 -0.26 -0.01 0.00 -1.71 0.00 0.00 55.69 53.60 3dbl s MET 162 Cb -0.14 -0.86 0.06 0.00 2.01 0.00 0.00 34.83 35.90 3dbl s MET 162 CO 0.02 0.07 -0.00 0.50 -0.01 0.00 0.00 175.02 175.60 3dbl s ARG 163 N 0.33 1.02 0.19 2.03 3.00 0.08 -0.68 118.95 124.92 3dbl s ARG 163 Ca -0.05 -0.56 -0.15 0.00 -1.00 0.00 0.00 55.73 53.97 3dbl s ARG 163 Cb -0.10 -2.17 -0.07 0.00 0.00 0.00 0.00 34.95 32.61 3dbl s ARG 163 CO 0.01 -0.58 0.60 -1.50 0.00 0.00 0.00 175.30 173.82 3dbl s ILE 164 N 1.71 4.80 -0.33 4.11 2.07 -1.11 -1.25 121.20 131.20 3dbl s ILE 164 Ca -0.02 0.86 0.00 0.00 -1.41 0.00 0.00 60.65 60.09 3dbl s ILE 164 Cb -0.17 -3.72 0.14 0.00 0.13 0.00 0.00 42.46 38.83 3dbl s ILE 164 CO -0.07 0.13 0.27 -0.63 -1.91 0.00 0.00 174.94 172.73 3dbl s ILE 165 N -1.59 -0.18 -0.08 2.00 1.01 0.98 -4.89 121.20 118.44 3dbl s ILE 165 Ca 0.42 -1.00 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3dbl s ILE 165 Cb -0.14 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.42 3dbl s ILE 165 CO 0.20 -0.69 -0.09 -0.63 0.00 0.00 0.00 174.94 173.73 3dbl s ILE 166 N 1.71 1.00 0.09 2.92 1.01 -1.26 -1.84 121.20 124.84 3dbl s ILE 166 Ca 0.14 -0.35 -0.23 0.00 0.00 0.00 0.00 60.65 60.20 3dbl s ILE 166 Cb -0.17 -0.97 -0.13 0.00 0.01 0.00 0.00 42.46 41.19 3dbl s ILE 166 CO -0.16 0.34 1.72 0.50 0.00 0.00 0.00 174.94 177.34 3dbl h LYS 167 N 7.50 -0.08 -2.95 2.79 3.64 -1.90 -1.49 116.57 124.07 3dbl h LYS 167 Ca -0.31 0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 58.89 3dbl h LYS 167 Cb 1.16 0.02 -0.29 0.00 -0.41 0.00 0.00 32.23 32.70 3dbl h LYS 167 CO 0.44 -0.05 -0.45 -2.00 -2.27 0.00 0.00 179.45 175.12 3dbl s GLU 168 N -6.18 0.24 -0.31 1.90 2.12 -1.26 -3.30 118.70 111.90 3dbl s GLU 168 Ca -0.13 0.58 -0.01 0.00 0.36 0.00 0.00 54.97 55.76 3dbl s GLU 168 Cb 0.06 -0.10 0.10 0.00 0.26 0.00 0.00 34.13 34.46 3dbl s GLU 168 CO 0.66 -0.17 0.12 -1.58 -0.54 0.00 0.00 175.26 173.75 3dbl s HIS 169 N 1.32 1.37 -0.07 5.30 5.65 0.39 -4.99 115.29 124.25 3dbl s HIS 169 Ca -0.09 -1.58 -0.14 0.00 0.25 0.00 0.00 55.06 53.50 3dbl s HIS 169 Cb -0.10 -1.51 -0.05 0.00 -1.18 0.00 0.00 32.58 29.74 3dbl s HIS 169 CO -0.09 -0.86 0.35 -1.25 -0.65 0.00 0.00 174.74 172.24 3dbl s PRO 170 N 1.63 3.99 0.09 2.88 0.04 -1.26 -0.90 135.00 141.48 3dbl s PRO 170 Ca 0.10 0.27 0.05 0.00 0.04 0.00 0.00 61.00 61.46 3dbl s PRO 170 Cb -0.18 -3.30 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 3dbl s PRO 170 CO -0.25 0.52 -0.13 0.14 0.04 0.00 0.00 177.00 177.32 3dbl s VAL 171 N -0.46 1.11 -0.07 -0.36 -7.23 0.27 -4.99 120.40 108.67 3dbl s VAL 171 Ca 0.21 -1.50 -0.06 0.00 -1.81 0.00 0.00 61.98 58.82 3dbl s VAL 171 Cb -0.15 -1.26 -0.04 0.00 0.56 0.00 0.00 36.38 35.50 3dbl s VAL 171 CO 0.09 -0.37 -0.14 -0.38 -0.31 0.00 0.00 175.10 173.99 3dbl n ILE 172 N 0.89 0.89 -2.06 -0.62 5.41 -1.26 -1.72 119.36 120.89 3dbl n ILE 172 Ca -0.18 0.03 -0.42 0.00 1.00 0.00 0.00 62.75 63.18 3dbl n ILE 172 Cb 0.56 -1.74 -0.00 0.00 -0.71 0.00 0.00 39.64 37.74 3dbl n ILE 172 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3dbl n GLU 173 N -3.64 3.66 0.00 0.38 2.13 -1.26 -4.38 120.64 117.53 3dbl n GLU 173 Ca -0.15 -3.21 0.08 0.00 0.66 0.00 0.00 57.16 54.54 3dbl n GLU 173 Cb 0.47 -2.93 0.43 0.00 0.27 0.00 0.00 31.44 29.68 3dbl n GLU 173 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3dbl n SER 174 N 3.87 0.00 -3.86 4.31 3.41 -1.21 -4.22 113.62 115.91 3dbl n SER 174 Ca 0.50 -0.02 -0.29 0.00 -0.26 0.00 0.00 58.87 58.80 3dbl n SER 174 Cb 0.33 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 3dbl n SER 174 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3dbl n HIS 175 N -1.25 -1.72 -1.71 7.33 8.25 -1.26 -4.43 115.22 120.42 3dbl n HIS 175 Ca 0.08 0.61 -0.43 0.00 -0.26 0.00 0.00 57.72 57.72 3dbl n HIS 175 Cb 0.12 -3.60 -0.03 0.00 1.12 0.00 0.00 29.99 27.60 3dbl n HIS 175 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3dbl n PRO 176 N -4.36 2.68 -0.11 -0.41 -0.04 -1.26 -4.86 135.00 126.64 3dbl n PRO 176 Ca -0.23 0.97 -0.02 0.00 -0.04 0.00 0.00 63.50 64.18 3dbl n PRO 176 Cb 0.65 -2.80 0.23 0.00 -0.04 0.00 0.00 33.50 31.54 3dbl n PRO 176 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3dbl h ASP 177 N 6.57 0.71 -4.99 3.54 3.32 -2.05 -3.44 116.42 120.08 3dbl h ASP 177 Ca -0.43 -0.11 -0.17 0.00 0.02 0.00 0.00 57.03 56.34 3dbl h ASP 177 Cb 1.21 -0.18 -0.21 0.00 0.22 0.00 0.00 39.33 40.37 3dbl h ASP 177 CO 0.94 0.68 -0.68 0.20 -1.72 0.00 0.00 179.24 178.66 3dbl s ASN 178 N -6.59 0.23 -0.09 6.45 0.01 -1.26 -5.16 114.94 108.52 3dbl s ASN 178 Ca -0.09 -0.49 -0.30 0.00 -0.71 0.00 0.00 52.86 51.27 3dbl s ASN 178 Cb 0.16 0.11 0.12 0.00 0.41 0.00 0.00 41.25 42.05 3dbl s ASN 178 CO 0.79 -0.31 0.98 0.00 -1.51 0.00 0.00 177.10 177.04 3dbl s ALA 179 N -1.51 -1.90 0.29 0.60 0.00 -1.26 -5.14 121.76 112.83 3dbl s ALA 179 Ca -0.15 1.32 -0.29 0.00 0.00 0.00 0.00 51.96 52.83 3dbl s ALA 179 Cb -0.09 -0.11 -0.10 0.00 0.00 0.00 0.00 23.12 22.82 3dbl s ALA 179 CO -0.01 -0.53 1.13 -0.51 0.00 0.00 0.00 175.76 175.85 3dbl s LEU 180 N -1.90 4.53 0.85 0.00 1.43 -1.26 -5.01 118.68 117.33 3dbl s LEU 180 Ca 0.03 2.33 -0.11 0.00 -1.03 0.00 0.00 54.13 55.35 3dbl s LEU 180 Cb -0.01 -3.63 0.11 0.00 0.03 0.00 0.00 46.19 42.69 3dbl s LEU 180 CO -0.04 -0.20 1.10 -1.61 0.23 0.00 0.00 176.35 175.83 3dbl s GLU 181 N -1.48 1.57 -0.71 1.70 0.41 -1.26 -4.98 118.70 113.95 3dbl s GLU 181 Ca 0.45 1.20 0.01 0.00 -0.41 0.00 0.00 54.97 56.22 3dbl s GLU 181 Cb -0.33 -1.82 0.18 0.00 -1.78 0.00 0.00 34.13 30.38 3dbl s GLU 181 CO 0.43 -2.13 0.53 0.34 -0.49 0.00 0.00 175.26 173.93 3dbl s ASP 182 N -3.15 5.21 -0.11 -0.19 2.15 -1.26 -4.80 116.67 114.52 3dbl s ASP 182 Ca 0.63 -3.40 0.17 0.00 0.43 0.00 0.00 52.55 50.39 3dbl s ASP 182 Cb -0.19 -1.78 -0.24 0.00 -0.30 0.00 0.00 42.92 40.40 3dbl s ASP 182 CO 0.57 -0.22 0.33 0.18 -0.17 0.00 0.00 175.17 175.87 3dbl n LEU 183 N 2.69 0.27 -3.11 -1.34 4.77 -1.26 -4.62 117.00 114.41 3dbl n LEU 183 Ca 0.14 0.13 -0.16 0.00 -0.03 0.00 0.00 56.01 56.09 3dbl n LEU 183 Cb 0.36 0.32 0.08 0.00 -2.33 0.00 0.00 43.42 41.84 3dbl n LEU 183 CO 0.33 0.37 0.12 0.54 -1.33 0.00 0.00 177.39 177.41 3dbl n ARG 184 N -2.76 -5.93 0.14 3.23 5.12 -1.25 -4.91 116.66 110.30 3dbl n ARG 184 Ca -0.23 0.73 0.05 0.00 -1.93 0.00 0.00 57.85 56.46 3dbl n ARG 184 Cb 1.02 -5.40 0.04 0.00 -1.16 0.00 0.00 32.46 26.96 3dbl n ARG 184 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 3dbl h LEU 185 N -1.77 0.00 0.00 0.55 3.38 -1.82 -2.23 115.31 113.42 3dbl h LEU 185 Ca -0.50 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.35 3dbl h LEU 185 Cb 1.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 3dbl h LEU 185 CO 0.44 0.37 -0.89 -2.24 0.09 0.00 0.00 178.44 176.21 3dbl h ASP 186 N 0.00 0.00 -1.40 -0.43 2.03 -1.86 -3.38 116.42 111.39 3dbl h ASP 186 Ca -0.02 0.00 -0.41 0.00 -0.73 0.00 0.00 57.03 55.87 3dbl h ASP 186 Cb 1.30 0.00 -0.39 0.00 -0.83 0.00 0.00 39.33 39.42 3dbl h ASP 186 CO 0.04 0.47 -1.15 0.29 -1.03 0.00 0.00 179.24 177.86 3dbl n LYS 187 N -3.04 1.06 -1.46 4.15 5.02 -1.24 -5.13 118.16 117.52 3dbl n LYS 187 Ca -0.03 -3.23 -0.38 0.00 -2.02 0.00 0.00 58.31 52.65 3dbl n LYS 187 Cb 0.75 -1.42 0.03 0.00 -0.02 0.00 0.00 35.03 34.38 3dbl n LYS 187 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3dbl n PRO 188 N 0.09 0.51 -4.00 1.97 -0.04 -0.84 -4.93 135.00 127.76 3dbl n PRO 188 Ca 0.16 0.20 -0.22 0.00 -0.04 0.00 0.00 63.50 63.60 3dbl n PRO 188 Cb 0.74 -1.66 -0.03 0.00 -0.04 0.00 0.00 33.50 32.52 3dbl n PRO 188 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3dbl s PHE 189 N -1.70 3.38 0.00 0.54 -0.12 -1.26 -4.91 117.98 113.91 3dbl s PHE 189 Ca 0.68 -0.02 0.00 0.00 -0.05 0.00 0.00 56.93 57.54 3dbl s PHE 189 Cb -0.46 -1.55 0.00 0.00 -0.63 0.00 0.00 43.02 40.38 3dbl s PHE 189 CO 0.55 0.47 0.54 -0.35 -0.05 0.00 0.00 175.22 176.38 3dbl n PRO 190 N -1.19 0.00 -0.37 1.99 -0.04 -1.26 -0.88 135.00 133.24 3dbl n PRO 190 Ca -0.08 0.54 0.02 0.00 -0.04 0.00 0.00 63.50 63.93 3dbl n PRO 190 Cb 0.57 -0.94 0.08 0.00 -0.04 0.00 0.00 33.50 33.16 3dbl n PRO 190 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3dbl n GLU 191 N -1.57 -0.18 -0.31 0.54 4.71 -1.26 0.50 120.64 123.07 3dbl n GLU 191 Ca 0.00 1.53 0.08 0.00 -0.01 0.00 0.00 57.16 58.76 3dbl n GLU 191 Cb 0.00 -2.28 0.24 0.00 -1.01 0.00 0.00 31.44 28.39 3dbl n GLU 191 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 3dbl h LEU 192 N 0.00 0.65 -1.19 -4.62 5.85 -1.47 0.16 115.31 114.69 3dbl h LEU 192 Ca 0.39 0.08 0.02 0.00 0.84 0.00 0.00 57.88 59.21 3dbl h LEU 192 Cb 0.64 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 3dbl h LEU 192 CO -1.00 0.29 0.55 0.03 -0.34 0.00 0.00 178.44 177.98 3dbl h ARG 193 N 0.73 1.05 0.00 1.25 2.47 0.20 -2.79 114.38 117.29 3dbl h ARG 193 Ca 0.48 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 59.14 3dbl h ARG 193 Cb 0.63 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 3dbl h ARG 193 CO -0.34 0.69 0.00 0.39 0.56 0.00 0.00 179.97 181.28 3dbl n GLU 194 N -4.43 0.00 -0.63 0.04 1.02 0.49 -2.00 120.64 115.13 3dbl n GLU 194 Ca 0.10 0.43 0.49 0.00 -0.02 0.00 0.00 57.16 58.16 3dbl n GLU 194 Cb 0.07 -1.42 0.77 0.00 -0.02 0.00 0.00 31.44 30.84 3dbl n GLU 194 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 3dbl n HIS 195 N -1.78 0.23 0.04 -0.32 -0.00 -0.87 0.43 115.22 112.94 3dbl n HIS 195 Ca 0.00 0.23 -0.11 0.00 0.46 0.00 0.00 57.72 58.30 3dbl n HIS 195 Cb 0.00 -0.70 -0.08 0.00 -0.12 0.00 0.00 29.99 29.09 3dbl n HIS 195 CO 0.00 0.00 0.00 0.74 0.46 0.00 0.00 176.34 177.54 3dbl h PHE 196 N 0.00 -0.18 0.00 1.57 0.05 -1.36 -3.26 116.94 113.77 3dbl h PHE 196 Ca 0.91 -0.00 -0.01 0.00 3.82 0.00 0.00 57.97 62.69 3dbl h PHE 196 Cb 3.44 0.06 -0.00 0.00 2.00 0.00 0.00 35.95 41.45 3dbl h PHE 196 CO -0.00 0.28 -0.05 1.96 -0.18 0.00 0.00 178.31 180.32 3dbl h GLN 197 N -0.85 0.00 0.00 1.51 4.20 0.19 -2.20 115.11 117.95 3dbl h GLN 197 Ca -0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3dbl h GLN 197 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 3dbl h GLN 197 CO 0.03 0.05 0.00 0.45 -0.67 0.00 0.00 178.83 178.69 3dbl n SER 198 N -3.18 0.00 -4.63 1.46 2.88 0.17 -4.62 113.62 105.69 3dbl n SER 198 Ca 0.00 -0.13 -0.35 0.00 -1.33 0.00 0.00 58.87 57.07 3dbl n SER 198 Cb 0.32 -0.24 -0.10 0.00 -0.75 0.00 0.00 64.21 63.44 3dbl n SER 198 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3dbl s TYR 199 N -2.48 3.19 -0.29 0.66 1.51 -0.83 -5.04 117.35 114.08 3dbl s TYR 199 Ca 0.22 0.05 -0.10 0.00 -1.01 0.00 0.00 57.07 56.23 3dbl s TYR 199 Cb 0.14 -1.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 3dbl s TYR 199 CO 0.31 0.24 0.16 0.34 -1.11 0.00 0.00 175.55 175.49 3dbl s ASP 200 N -0.10 5.69 0.10 2.29 -1.08 -1.26 -5.00 116.67 117.31 3dbl s ASP 200 Ca 0.05 -0.24 -0.31 0.00 -0.52 0.00 0.00 52.55 51.54 3dbl s ASP 200 Cb -0.12 -2.04 -0.12 0.00 -1.46 0.00 0.00 42.92 39.17 3dbl s ASP 200 CO 0.02 -0.11 1.61 -0.07 0.52 0.00 0.00 175.17 177.14 3dbl h LEU 201 N 8.35 -0.97 0.00 -1.34 -0.00 -1.96 -3.37 115.31 116.02 3dbl h LEU 201 Ca -0.35 0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 3dbl h LEU 201 Cb 1.17 0.33 0.00 0.00 -0.00 0.00 0.00 40.66 42.17 3dbl h LEU 201 CO 0.58 -0.48 0.00 -0.90 -0.00 0.00 0.00 178.44 177.64 3dbl n ASP 202 N -5.45 0.00 -4.70 -0.43 5.75 -1.26 -5.08 116.55 105.37 3dbl n ASP 202 Ca -0.09 0.05 -0.42 0.00 -0.01 0.00 0.00 54.79 54.32 3dbl n ASP 202 Cb 0.36 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.42 3dbl n ASP 202 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 3dbl s HIS 203 N -0.10 3.43 0.00 2.11 0.00 -1.26 -5.09 115.29 114.37 3dbl s HIS 203 Ca 0.00 1.40 0.00 0.00 -3.00 0.00 0.00 55.06 53.46 3dbl s HIS 203 Cb 0.00 -3.33 0.00 0.00 -4.00 0.00 0.00 32.58 25.25 3dbl s HIS 203 CO 0.00 -0.88 0.00 0.39 -1.00 0.00 0.00 174.74 173.25 3dbl n GLU 205 N 4.39 2.54 0.11 -0.38 4.71 -1.26 -4.61 120.64 126.15 3dbl n GLU 205 Ca 0.09 0.00 -0.00 0.00 -0.01 0.00 0.00 57.16 57.23 3dbl n GLU 205 Cb 0.48 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.89 3dbl n GLU 205 CO 0.00 0.00 0.00 1.57 0.09 0.00 0.00 177.13 178.79 3dbl h LYS 206 N 0.00 0.00 -0.00 3.49 5.09 -2.01 -3.24 116.57 119.89 3dbl h LYS 206 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 3dbl h LYS 206 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 3dbl h LYS 206 CO 0.00 0.64 -0.05 0.36 -2.09 0.00 0.00 179.45 178.30 3dbl n LYS 207 N -3.25 0.85 -0.13 0.07 -0.00 -1.26 -3.86 118.16 110.58 3dbl n LYS 207 Ca 0.01 -0.23 -0.18 0.00 -0.00 0.00 0.00 58.31 57.91 3dbl n LYS 207 Cb 0.80 -1.50 -0.12 0.00 -0.00 0.00 0.00 35.03 34.22 3dbl n LYS 207 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3dbl n ASP 208 N -0.88 2.01 -0.11 -5.58 9.92 -1.23 -3.74 116.55 116.95 3dbl n ASP 208 Ca 0.17 -0.12 0.03 0.00 -0.53 0.00 0.00 54.79 54.34 3dbl n ASP 208 Cb 0.24 -0.42 0.34 0.00 -0.64 0.00 0.00 41.12 40.64 3dbl n ASP 208 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 3dbl h HIS 209 N -0.03 0.72 -0.13 1.24 2.76 -1.67 -1.55 115.15 116.50 3dbl h HIS 209 Ca -0.57 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.61 3dbl h HIS 209 Cb 1.87 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 30.59 3dbl h HIS 209 CO 0.03 0.45 0.00 -1.13 -1.30 0.00 0.00 177.93 175.97 3dbl n SER 210 N -4.45 2.74 -1.43 3.26 3.41 -1.25 -4.20 113.62 111.69 3dbl n SER 210 Ca 0.06 -1.89 -0.03 0.00 -0.26 0.00 0.00 58.87 56.75 3dbl n SER 210 Cb 0.06 -0.07 0.10 0.00 -0.26 0.00 0.00 64.21 64.04 3dbl n SER 210 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3dbl n HIS 211 N 1.09 0.86 -4.01 7.33 -0.00 -0.64 -4.54 115.22 115.31 3dbl n HIS 211 Ca 0.16 -1.56 -0.35 0.00 -0.00 0.00 0.00 57.72 55.97 3dbl n HIS 211 Cb 0.54 -0.25 -0.13 0.00 -0.00 0.00 0.00 29.99 30.14 3dbl n HIS 211 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3dbl s THR 212 N -3.00 3.69 -0.05 1.59 2.01 -0.85 -2.10 115.64 116.95 3dbl s THR 212 Ca 0.39 -0.39 -0.39 0.00 0.31 0.00 0.00 61.69 61.61 3dbl s THR 212 Cb 0.38 -2.68 -0.18 0.00 0.01 0.00 0.00 72.50 70.03 3dbl s THR 212 CO -0.06 0.42 1.34 -2.65 -0.69 0.00 0.00 174.62 172.98 3dbl n PRO 213 N 4.52 0.70 -0.11 4.92 -0.02 -1.26 -4.78 135.00 138.96 3dbl n PRO 213 Ca -0.18 0.25 0.23 0.00 -2.02 0.00 0.00 63.50 61.79 3dbl n PRO 213 Cb 0.51 -1.85 0.67 0.00 -0.02 0.00 0.00 33.50 32.82 3dbl n PRO 213 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3dbl h TRP 214 N 4.52 0.09 0.10 6.00 0.09 -1.83 -1.53 115.95 123.40 3dbl h TRP 214 Ca -0.48 0.00 0.02 0.00 0.09 0.00 0.00 58.89 58.52 3dbl h TRP 214 Cb 1.36 -0.03 -0.03 0.00 0.08 0.00 0.00 29.16 30.55 3dbl h TRP 214 CO 0.62 0.03 -0.23 0.82 0.09 0.00 0.00 178.44 179.77 3dbl h ILE 215 N 0.07 0.49 -0.48 0.12 2.04 -1.96 0.16 117.51 117.96 3dbl h ILE 215 Ca 0.36 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.27 3dbl h ILE 215 Cb 1.32 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3dbl h ILE 215 CO -0.03 0.00 0.20 0.58 0.00 0.00 0.00 178.15 178.90 3dbl h VAL 216 N -0.42 0.90 -0.10 1.67 2.07 -1.63 -0.91 116.25 117.83 3dbl h VAL 216 Ca 0.03 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.45 3dbl h VAL 216 Cb 0.44 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3dbl h VAL 216 CO -0.13 0.07 -0.15 0.40 0.02 0.00 0.00 177.57 177.77 3dbl h ILE 217 N 0.40 0.60 -0.46 4.57 2.04 -1.17 0.75 117.51 124.24 3dbl h ILE 217 Ca 0.22 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.09 3dbl h ILE 217 Cb 0.18 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 3dbl h ILE 217 CO -0.19 0.00 0.30 0.40 0.00 0.00 0.00 178.15 178.66 3dbl h ILE 218 N -0.21 1.09 -0.54 -0.67 2.04 -0.56 -1.32 117.51 117.33 3dbl h ILE 218 Ca 0.08 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.69 3dbl h ILE 218 Cb 0.32 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 3dbl h ILE 218 CO -0.22 0.11 0.12 0.00 0.00 0.00 0.00 178.15 178.16 3dbl h ALA 219 N 1.72 0.72 0.02 1.87 0.00 0.10 -0.17 119.26 123.53 3dbl h ALA 219 Ca 0.18 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dbl h ALA 219 Cb 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3dbl h ALA 219 CO -0.04 0.43 -0.02 0.87 0.00 0.00 0.00 179.25 180.48 3dbl h LYS 220 N 0.77 -0.04 0.00 0.00 6.56 0.25 0.13 116.57 124.24 3dbl h LYS 220 Ca 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.76 3dbl h LYS 220 Cb 0.36 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.03 3dbl h LYS 220 CO 0.00 -0.03 0.12 1.88 -2.06 0.00 0.00 179.45 179.36 3dbl h TYR 221 N -0.05 0.00 -0.22 -1.35 -1.99 -1.49 0.38 116.97 112.26 3dbl h TYR 221 Ca -0.00 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.67 3dbl h TYR 221 Cb 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.76 3dbl h TYR 221 CO -0.09 0.00 -0.08 1.25 -0.00 0.00 0.00 178.16 179.24 3dbl h LEU 222 N 0.00 0.45 -1.41 3.88 5.85 0.06 0.39 115.31 124.52 3dbl h LEU 222 Ca 0.00 -0.39 -0.05 0.00 0.84 0.00 0.00 57.88 58.28 3dbl h LEU 222 Cb 0.24 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3dbl h LEU 222 CO 0.00 0.74 -0.12 0.00 -0.34 0.00 0.00 178.44 178.72 3dbl h ALA 223 N 0.72 1.52 0.27 1.25 0.00 0.16 0.18 119.26 123.37 3dbl h ALA 223 Ca 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3dbl h ALA 223 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3dbl h ALA 223 CO 0.03 0.34 -0.13 0.37 0.00 0.00 0.00 179.25 179.86 3dbl h GLN 224 N 0.23 -0.35 -0.72 0.00 4.15 -0.79 -2.82 115.11 114.81 3dbl h GLN 224 Ca 0.05 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.50 3dbl h GLN 224 Cb 0.36 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.09 3dbl h GLN 224 CO 0.02 -0.04 0.48 2.35 -1.93 0.00 0.00 178.83 179.71 3dbl h TRP 225 N -0.98 0.90 0.00 3.99 2.91 -0.16 -0.71 115.95 121.91 3dbl h TRP 225 Ca -0.04 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.00 3dbl h TRP 225 Cb 0.47 -0.30 -0.00 0.00 -0.51 0.00 0.00 29.16 28.82 3dbl h TRP 225 CO 0.04 0.56 -0.01 -0.92 -1.03 0.00 0.00 178.44 177.09 3dbl h TYR 226 N 0.96 0.00 0.00 2.65 3.20 -0.69 -3.02 116.97 120.08 3dbl h TYR 226 Ca 0.26 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.02 3dbl h TYR 226 Cb -0.10 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 3dbl h TYR 226 CO -0.00 0.01 -0.75 0.77 -1.64 0.00 0.00 178.16 176.54 3dbl h SER 227 N 0.00 0.00 -0.04 -2.11 0.02 -0.87 0.12 113.55 110.67 3dbl h SER 227 Ca -0.00 -0.40 -0.02 0.00 -0.84 0.00 0.00 61.79 60.53 3dbl h SER 227 Cb 0.13 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 3dbl h SER 227 CO 0.00 1.13 0.03 -0.62 -1.14 0.00 0.00 176.83 176.23 3dbl n GLU 228 N -4.54 1.05 0.00 3.45 4.71 -0.98 -3.00 120.64 121.33 3dbl n GLU 228 Ca -0.19 -0.12 0.00 0.00 -0.01 0.00 0.00 57.16 56.84 3dbl n GLU 228 Cb 0.48 -1.05 0.00 0.00 -1.01 0.00 0.00 31.44 29.86 3dbl n GLU 228 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3dbl n THR 229 N 0.67 0.00 -2.08 2.62 -1.04 -1.15 -5.03 114.28 108.28 3dbl n THR 229 Ca 0.02 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.99 3dbl n THR 229 Cb 0.54 0.84 0.02 0.00 -1.82 0.00 0.00 70.33 69.91 3dbl n THR 229 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3dbl n ASN 230 N 0.00 -3.15 0.00 8.00 3.02 -1.16 -3.87 115.26 118.10 3dbl n ASN 230 Ca 0.00 -0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 3dbl n ASN 230 Cb 0.17 -1.88 0.00 0.00 -0.61 0.00 0.00 39.78 37.46 3dbl n ASN 230 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dbl n GLY 231 N -1.36 3.06 3.62 7.41 0.00 0.43 -5.01 105.19 113.34 3dbl n GLY 231 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 3dbl n GLY 231 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dbl n ARG 232 N -2.00 -0.48 -4.16 1.61 1.74 -1.25 -4.90 116.66 107.22 3dbl n ARG 232 Ca 0.00 -0.08 -0.16 0.00 -0.77 0.00 0.00 57.85 56.85 3dbl n ARG 232 Cb 0.00 -2.28 -0.13 0.00 -1.02 0.00 0.00 32.46 29.03 3dbl n ARG 232 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 3dbl s ILE 233 N -2.59 0.66 0.46 0.55 -4.36 -1.26 -3.86 121.20 110.80 3dbl s ILE 233 Ca 0.65 -0.86 -0.22 0.00 -0.26 0.00 0.00 60.65 59.97 3dbl s ILE 233 Cb -0.23 -0.65 -0.11 0.00 1.25 0.00 0.00 42.46 42.72 3dbl s ILE 233 CO 0.60 -0.16 0.67 -2.65 0.24 0.00 0.00 174.94 173.63 3dbl n PRO 234 N 1.92 0.75 0.11 0.37 -0.02 -1.26 -4.90 135.00 131.96 3dbl n PRO 234 Ca -0.19 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3dbl n PRO 234 Cb 0.55 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 3dbl n PRO 234 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3dbl n LYS 235 N 0.29 0.00 -0.45 -0.52 4.81 -1.26 -4.95 118.16 116.08 3dbl n LYS 235 Ca 0.11 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.26 3dbl n LYS 235 Cb 0.41 -0.02 0.27 0.00 0.02 0.00 0.00 35.03 35.71 3dbl n LYS 235 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3dbl s THR 236 N -1.74 1.66 -0.88 3.15 2.01 -1.26 -4.79 115.64 113.79 3dbl s THR 236 Ca 0.00 0.00 0.27 0.00 0.31 0.00 0.00 61.69 62.27 3dbl s THR 236 Cb 0.00 -2.05 0.21 0.00 0.01 0.00 0.00 72.50 70.66 3dbl s THR 236 CO 0.00 0.00 1.76 -1.22 -0.69 0.00 0.00 174.62 174.47 3dbl n TYR 237 N -5.28 0.35 -0.07 4.92 0.53 -1.26 -2.16 117.16 114.19 3dbl n TYR 237 Ca 0.07 0.10 -0.10 0.00 -1.02 0.00 0.00 57.90 56.95 3dbl n TYR 237 Cb 0.57 -0.63 -0.07 0.00 -1.03 0.00 0.00 39.34 38.18 3dbl n TYR 237 CO 0.00 0.00 0.00 -0.22 -1.02 0.00 0.00 176.86 175.62 3dbl h LYS 238 N 0.00 0.00 -0.89 -0.72 1.63 -1.98 -2.88 116.57 111.73 3dbl h LYS 238 Ca 0.00 0.00 0.18 0.00 -0.85 0.00 0.00 60.65 59.98 3dbl h LYS 238 Cb 0.60 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 32.12 3dbl h LYS 238 CO 0.00 0.54 0.45 0.93 -3.45 0.00 0.00 179.45 177.92 3dbl h GLU 239 N -1.00 0.56 -0.32 1.90 5.08 -1.90 0.12 114.58 119.02 3dbl h GLU 239 Ca -0.07 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3dbl h GLU 239 Cb 0.68 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 3dbl h GLU 239 CO -0.04 0.37 0.00 0.87 -1.00 0.00 0.00 179.01 179.21 3dbl h LYS 240 N 0.57 0.57 0.00 2.33 1.57 -1.56 0.12 116.57 120.17 3dbl h LYS 240 Ca 0.51 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3dbl h LYS 240 Cb 0.82 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 3dbl h LYS 240 CO -0.42 0.70 -0.02 1.49 -0.57 0.00 0.00 179.45 180.63 3dbl h GLU 241 N 0.37 0.00 0.12 3.15 4.57 -0.62 -1.11 114.58 121.06 3dbl h GLU 241 Ca 0.09 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 57.96 3dbl h GLU 241 Cb 0.44 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 3dbl h GLU 241 CO 0.02 0.02 -1.59 -0.44 -1.18 0.00 0.00 179.01 175.83 3dbl h ASP 242 N 0.00 0.41 0.08 1.04 3.45 -0.79 -3.16 116.42 117.46 3dbl h ASP 242 Ca -0.00 -0.60 -0.00 0.00 0.43 0.00 0.00 57.03 56.86 3dbl h ASP 242 Cb 0.04 -0.13 -0.00 0.00 -0.56 0.00 0.00 39.33 38.67 3dbl h ASP 242 CO 0.00 1.50 -0.02 0.15 -1.57 0.00 0.00 179.24 179.31 3dbl h PHE 243 N 0.07 0.00 -0.31 4.55 3.57 -0.15 -0.58 116.94 124.09 3dbl h PHE 243 Ca -0.27 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.08 3dbl h PHE 243 Cb 2.03 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.77 3dbl h PHE 243 CO 0.07 0.02 -0.39 0.00 -2.23 0.00 0.00 178.31 175.77 3dbl h ARG 244 N 0.00 0.81 0.00 1.11 3.08 -1.20 -3.12 114.38 115.06 3dbl h ARG 244 Ca -0.00 -0.46 -0.12 0.00 0.07 0.00 0.00 59.98 59.47 3dbl h ARG 244 Cb 0.06 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3dbl h ARG 244 CO 0.00 1.09 -0.56 -0.44 -1.07 0.00 0.00 179.97 178.99 3dbl h ASP 245 N 0.58 0.00 0.31 7.04 5.19 -1.21 -2.58 116.42 125.75 3dbl h ASP 245 Ca 0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 3dbl h ASP 245 Cb 0.99 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.50 3dbl h ASP 245 CO 0.09 0.56 0.00 -0.11 -3.12 0.00 0.00 179.24 176.67 3dbl n LEU 246 N -3.35 0.28 -0.10 1.55 7.94 -0.37 -2.04 117.00 120.91 3dbl n LEU 246 Ca 0.01 0.60 -0.13 0.00 -1.11 0.00 0.00 56.01 55.38 3dbl n LEU 246 Cb 0.71 -0.59 -0.12 0.00 0.53 0.00 0.00 43.42 43.95 3dbl n LEU 246 CO 0.41 -0.55 -1.16 -0.38 -1.11 0.00 0.00 177.39 174.60 3dbl n ILE 247 N -1.84 1.24 -0.24 1.96 5.41 -1.01 -4.43 119.36 120.46 3dbl n ILE 247 Ca 0.01 -0.59 -0.06 0.00 1.00 0.00 0.00 62.75 63.11 3dbl n ILE 247 Cb 0.11 -0.98 0.05 0.00 -0.71 0.00 0.00 39.64 38.10 3dbl n ILE 247 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 3dbl h ARG 248 N 0.00 0.92 0.00 0.38 3.08 -1.08 -2.62 114.38 115.06 3dbl h ARG 248 Ca -0.49 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.47 3dbl h ARG 248 Cb 1.90 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.76 3dbl h ARG 248 CO -0.04 0.66 0.00 1.04 -1.07 0.00 0.00 179.97 180.57 3dbl n GLN 249 N -4.55 0.00 -0.20 0.04 6.02 -0.87 -2.02 117.38 115.80 3dbl n GLN 249 Ca 0.05 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.07 3dbl n GLN 249 Cb 0.06 -1.00 0.04 0.00 1.02 0.00 0.00 30.24 30.36 3dbl n GLN 249 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dbl n GLY 250 N -0.13 1.22 3.64 1.08 0.00 -0.99 -5.04 105.19 104.98 3dbl n GLY 250 Ca 0.00 -0.29 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 3dbl n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dbl s ILE 251 N -0.89 3.73 0.00 -0.61 1.01 -0.86 -4.96 121.20 118.62 3dbl s ILE 251 Ca 0.08 0.85 0.00 0.00 0.00 0.00 0.00 60.65 61.58 3dbl s ILE 251 Cb 0.07 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.88 3dbl s ILE 251 CO 0.01 -0.20 0.00 -0.11 0.00 0.00 0.00 174.94 174.63 3dbl n LEU 252 N 7.84 0.00 -4.41 2.97 7.94 -1.26 -3.47 117.00 126.61 3dbl n LEU 252 Ca 0.18 0.00 -0.45 0.00 -1.11 0.00 0.00 56.01 54.63 3dbl n LEU 252 Cb 0.44 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.38 3dbl n LEU 252 CO 0.63 0.00 0.99 -0.54 -1.11 0.00 0.00 177.39 177.36 3dbl s LYS 253 N 0.00 3.91 -0.80 1.96 -0.14 -1.26 -5.16 119.74 118.25 3dbl s LYS 253 Ca 0.00 -2.49 -0.07 0.00 -1.36 0.00 0.00 55.97 52.05 3dbl s LYS 253 Cb 0.00 -4.81 -0.27 0.00 -1.68 0.00 0.00 37.83 31.07 3dbl s LYS 253 CO 0.00 -1.57 1.92 -2.30 -0.76 0.00 0.00 175.35 172.64 3dbl n PRO 259 N 4.94 0.00 0.00 -1.68 -0.02 -1.23 -5.17 135.00 131.85 3dbl n PRO 259 Ca 0.27 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3dbl n PRO 259 Cb 0.44 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.91 3dbl n PRO 259 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dbl n GLU 262 N 5.32 0.00 0.02 -0.52 4.71 -1.26 -5.18 120.64 123.73 3dbl n GLU 262 Ca 0.54 0.00 -0.12 0.00 -0.01 0.00 0.00 57.16 57.57 3dbl n GLU 262 Cb 0.21 0.00 -0.07 0.00 -1.01 0.00 0.00 31.44 30.57 3dbl n GLU 262 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 3dbl h GLU 263 N 0.00 0.02 0.00 3.49 4.39 -1.94 -2.55 114.58 117.99 3dbl h GLU 263 Ca 0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3dbl h GLU 263 Cb 0.00 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3dbl h GLU 263 CO 0.00 0.10 -0.03 -2.95 -1.16 0.00 0.00 179.01 174.97 3dbl h ASN 264 N -0.06 0.00 -0.04 1.42 -0.00 -1.86 -1.36 115.58 113.68 3dbl h ASN 264 Ca 0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 56.30 56.10 3dbl h ASN 264 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.41 3dbl h ASN 264 CO -0.00 0.03 -0.73 -0.26 -0.00 0.00 0.00 177.43 176.47 3dbl h PHE 265 N 0.00 0.91 0.00 4.14 -1.00 -1.77 -1.68 116.94 117.54 3dbl h PHE 265 Ca -0.00 -0.39 -0.06 0.00 2.81 0.00 0.00 57.97 60.33 3dbl h PHE 265 Cb 0.06 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 3dbl h PHE 265 CO 0.00 1.19 -0.28 1.49 -1.61 0.00 0.00 178.31 179.11 3dbl h GLU 266 N 0.47 0.00 0.12 1.51 4.57 -0.90 -2.61 114.58 117.75 3dbl h GLU 266 Ca -0.04 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3dbl h GLU 266 Cb 1.34 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.93 3dbl h GLU 266 CO 0.14 0.28 -0.06 0.93 -1.18 0.00 0.00 179.01 179.12 3dbl h GLU 267 N 0.00 -0.15 -1.25 1.92 5.08 -1.14 -2.71 114.58 116.33 3dbl h GLU 267 Ca -0.00 0.01 0.36 0.00 -1.00 0.00 0.00 59.36 58.73 3dbl h GLU 267 Cb 0.58 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.80 3dbl h GLU 267 CO 0.04 0.30 0.87 0.00 -1.00 0.00 0.00 179.01 179.22 3dbl h ALA 268 N 0.04 2.99 -0.09 3.43 0.00 -0.99 0.71 119.26 125.35 3dbl h ALA 268 Ca -0.02 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.68 3dbl h ALA 268 Cb 0.53 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3dbl h ALA 268 CO 0.03 -1.39 -0.78 0.82 0.00 0.00 0.00 179.25 177.92 3dbl h ILE 269 N 0.08 1.34 0.00 0.00 2.04 -1.28 -3.16 117.51 116.54 3dbl h ILE 269 Ca 0.63 -2.12 0.00 0.00 1.00 0.00 0.00 64.86 64.37 3dbl h ILE 269 Cb 2.29 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 40.48 3dbl h ILE 269 CO -0.10 0.65 0.00 0.29 0.00 0.00 0.00 178.15 178.99 3dbl n LYS 270 N -3.86 0.22 0.00 2.37 5.02 0.24 -3.34 118.16 118.80 3dbl n LYS 270 Ca -0.06 0.27 0.11 0.00 -2.02 0.00 0.00 58.31 56.61 3dbl n LYS 270 Cb 0.74 -1.80 0.07 0.00 -0.02 0.00 0.00 35.03 34.03 3dbl n LYS 270 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3dbl n ASN 271 N -2.18 1.06 0.05 4.39 3.02 -0.58 -3.90 115.26 117.12 3dbl n ASN 271 Ca 0.04 -0.87 0.06 0.00 -0.03 0.00 0.00 54.58 53.78 3dbl n ASN 271 Cb 0.35 0.57 0.49 0.00 -0.61 0.00 0.00 39.78 40.58 3dbl n ASN 271 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3dbl h VAL 272 N 0.63 1.06 -0.81 2.41 2.07 -1.56 1.02 116.25 121.07 3dbl h VAL 272 Ca 0.00 -0.14 0.15 0.00 0.82 0.00 0.00 66.70 67.53 3dbl h VAL 272 Cb 0.55 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 3dbl h VAL 272 CO 0.00 0.07 0.53 -1.13 0.02 0.00 0.00 177.57 177.07 3dbl h ASN 273 N 0.41 0.49 0.00 0.57 -1.24 -1.79 -3.33 115.58 110.69 3dbl h ASN 273 Ca 0.13 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.17 3dbl h ASN 273 Cb 0.02 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.00 3dbl h ASN 273 CO -0.03 0.25 0.00 0.35 -1.29 0.00 0.00 177.43 176.71 3dbl n THR 274 N -4.51 0.00 0.00 -3.57 -2.24 0.52 -4.84 114.28 99.65 3dbl n THR 274 Ca 0.16 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 3dbl n THR 274 Cb 0.51 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 3dbl n THR 274 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dbl n ALA 275 N -1.85 0.00 -0.60 6.98 0.00 0.32 -2.33 120.51 123.04 3dbl n ALA 275 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dbl n ALA 275 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3dbl n ALA 275 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dbl n LEU 276 N -2.60 0.00 -4.38 0.00 4.77 -1.25 -4.23 117.00 109.31 3dbl n LEU 276 Ca 0.00 0.70 -0.45 0.00 -0.03 0.00 0.00 56.01 56.23 3dbl n LEU 276 Cb 0.00 -0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 3dbl n LEU 276 CO 0.00 -0.20 0.20 0.21 -1.33 0.00 0.00 177.39 176.27 3dbl s ASN 277 N -2.39 6.18 -0.33 -1.43 3.04 -0.98 -4.03 114.94 114.99 3dbl s ASN 277 Ca 0.00 -1.39 0.16 0.00 0.04 0.00 0.00 52.86 51.67 3dbl s ASN 277 Cb 0.00 -2.24 0.43 0.00 -1.54 0.00 0.00 41.25 37.91 3dbl s ASN 277 CO 0.00 -0.85 0.90 0.35 -3.04 0.00 0.00 177.10 174.46 3dbl n THR 278 N 5.37 0.72 -3.44 -5.21 -2.24 -1.26 -4.98 114.28 103.24 3dbl n THR 278 Ca -0.11 -3.44 0.01 0.00 -2.27 0.00 0.00 64.05 58.24 3dbl n THR 278 Cb 0.43 0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 69.05 3dbl n THR 278 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3dbl s THR 279 N -2.97 -0.93 0.00 4.28 2.01 -1.26 -3.91 115.64 112.86 3dbl s THR 279 Ca 0.30 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.30 3dbl s THR 279 Cb 0.43 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.94 3dbl s THR 279 CO 0.01 0.00 0.00 1.67 -0.69 0.00 0.00 174.62 175.61 3dbl n GLN 280 N 5.40 0.00 -3.53 4.92 7.27 -1.26 -5.04 117.38 125.14 3dbl n GLN 280 Ca -0.08 0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.62 3dbl n GLN 280 Cb 0.50 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 33.07 3dbl n GLN 280 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 3dbl s ILE 281 N -2.00 5.29 0.27 1.69 1.01 -1.26 -4.90 121.20 121.30 3dbl s ILE 281 Ca 0.00 0.48 -0.31 0.00 0.00 0.00 0.00 60.65 60.82 3dbl s ILE 281 Cb 0.00 -3.62 -0.12 0.00 0.01 0.00 0.00 42.46 38.73 3dbl s ILE 281 CO 0.00 0.33 1.53 -2.65 0.00 0.00 0.00 174.94 174.15 3dbl n PRO 282 N 4.09 2.44 -0.26 2.79 -0.02 -1.26 -4.88 135.00 137.90 3dbl n PRO 282 Ca -0.12 0.87 0.07 0.00 -2.02 0.00 0.00 63.50 62.30 3dbl n PRO 282 Cb 0.52 -2.61 0.20 0.00 -0.02 0.00 0.00 33.50 31.59 3dbl n PRO 282 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3dbl h SER 283 N 4.62 0.07 -0.76 2.55 0.87 -1.98 -0.68 113.55 118.25 3dbl h SER 283 Ca -0.46 0.15 0.08 0.00 -1.23 0.00 0.00 61.79 60.33 3dbl h SER 283 Cb 1.24 0.19 -0.07 0.00 -0.44 0.00 0.00 62.40 63.32 3dbl h SER 283 CO 0.78 -0.03 0.43 0.77 -0.53 0.00 0.00 176.83 178.25 3dbl h SER 284 N 0.30 0.62 -0.14 6.23 4.64 -1.95 -0.80 113.55 122.45 3dbl h SER 284 Ca 0.44 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.79 3dbl h SER 284 Cb 0.77 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.77 3dbl h SER 284 CO -0.51 0.38 0.06 0.40 -0.87 0.00 0.00 176.83 176.29 3dbl h ILE 285 N 0.75 1.08 0.26 0.95 5.03 -1.44 -1.83 117.51 122.30 3dbl h ILE 285 Ca 0.35 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.86 3dbl h ILE 285 Cb 0.28 0.88 -0.02 0.00 -3.03 0.00 0.00 36.82 34.93 3dbl h ILE 285 CO -0.22 0.09 -0.23 -0.33 -0.68 0.00 0.00 178.15 176.78 3dbl h GLU 286 N 0.24 -0.49 -0.41 2.37 4.39 -0.86 -0.56 114.58 119.25 3dbl h GLU 286 Ca 0.06 0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.85 3dbl h GLU 286 Cb 0.06 0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.77 3dbl h GLU 286 CO -0.01 -0.33 0.11 -0.44 -1.16 0.00 0.00 179.01 177.18 3dbl h ASP 287 N -0.51 0.07 -0.06 1.42 3.32 -1.22 0.26 116.42 119.70 3dbl h ASP 287 Ca -0.01 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.13 3dbl h ASP 287 Cb 0.47 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 3dbl h ASP 287 CO -0.04 0.07 -0.12 0.40 -1.72 0.00 0.00 179.24 177.83 3dbl h ILE 288 N 0.25 0.67 -0.96 0.35 2.04 -1.12 0.33 117.51 119.07 3dbl h ILE 288 Ca 0.19 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.21 3dbl h ILE 288 Cb 0.21 0.67 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 3dbl h ILE 288 CO -0.23 0.00 0.61 -0.26 0.00 0.00 0.00 178.15 178.27 3dbl h PHE 289 N -0.18 0.95 -0.01 1.37 0.05 -0.15 -0.52 116.94 118.45 3dbl h PHE 289 Ca 0.07 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.88 3dbl h PHE 289 Cb 0.27 -0.29 0.00 0.00 2.00 0.00 0.00 35.95 37.93 3dbl h PHE 289 CO -0.21 0.30 -0.01 0.09 -0.18 0.00 0.00 178.31 178.30 3dbl n ASN 290 N -4.63 1.25 -4.78 2.17 3.02 0.84 -4.52 115.26 108.61 3dbl n ASN 290 Ca 0.20 -1.39 -0.37 0.00 -0.03 0.00 0.00 54.58 52.99 3dbl n ASN 290 Cb 0.50 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.63 3dbl n ASN 290 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dbl s ASP 291 N -2.03 6.93 0.17 6.41 -1.08 0.10 -4.91 116.67 122.26 3dbl s ASP 291 Ca 0.39 2.07 -0.17 0.00 -0.52 0.00 0.00 52.55 54.32 3dbl s ASP 291 Cb 0.21 -2.59 0.11 0.00 -1.46 0.00 0.00 42.92 39.19 3dbl s ASP 291 CO 0.35 -0.37 1.66 -0.78 0.52 0.00 0.00 175.17 176.55 3dbl h ASP 292 N 2.87 -0.42 -1.51 -0.34 1.82 -1.90 -0.66 116.42 116.28 3dbl h ASP 292 Ca -0.48 0.13 0.44 0.00 -0.39 0.00 0.00 57.03 56.74 3dbl h ASP 292 Cb 1.21 0.27 -0.08 0.00 0.68 0.00 0.00 39.33 41.42 3dbl h ASP 292 CO 0.64 -0.15 1.06 -0.09 -1.61 0.00 0.00 179.24 179.09 3dbl h ARG 293 N -0.01 0.04 0.15 0.28 9.65 -1.91 0.49 114.38 123.08 3dbl h ARG 293 Ca 0.21 -0.00 -0.28 0.00 -1.10 0.00 0.00 59.98 58.81 3dbl h ARG 293 Cb 0.32 -0.01 0.01 0.00 -1.39 0.00 0.00 29.97 28.91 3dbl h ARG 293 CO -0.45 0.03 -1.33 0.00 2.80 0.00 0.00 179.97 181.01 3dbl h ILE 295 N -0.19 1.28 -3.11 0.00 2.04 0.42 -3.40 117.51 114.56 3dbl h ILE 295 Ca -0.27 -1.36 -0.62 0.00 1.00 0.00 0.00 64.86 63.61 3dbl h ILE 295 Cb 1.85 1.67 -0.41 0.00 -0.74 0.00 0.00 36.82 39.18 3dbl h ILE 295 CO 0.13 0.40 -0.64 0.20 0.00 0.00 0.00 178.15 178.24 3dbl s ASN 296 N -6.90 4.29 0.39 1.72 0.01 -0.07 -5.09 114.94 109.29 3dbl s ASN 296 Ca -0.04 -3.42 -0.21 0.00 -0.71 0.00 0.00 52.86 48.49 3dbl s ASN 296 Cb 0.14 -1.48 -0.10 0.00 0.41 0.00 0.00 41.25 40.21 3dbl s ASN 296 CO 0.74 -0.15 0.91 0.27 -1.51 0.00 0.00 177.10 177.36 3dbl s ILE 297 N -0.80 4.42 0.37 0.60 -5.25 -1.26 -4.84 121.20 114.42 3dbl s ILE 297 Ca 0.22 1.44 -0.03 0.00 -0.99 0.00 0.00 60.65 61.30 3dbl s ILE 297 Cb -0.12 -3.66 0.01 0.00 2.95 0.00 0.00 42.46 41.64 3dbl s ILE 297 CO -0.10 -0.22 0.52 0.42 -1.79 0.00 0.00 174.94 173.77 3dbl s THR 298 N -2.06 0.00 0.47 8.37 -4.23 -1.26 -4.98 115.64 111.96 3dbl s THR 298 Ca 0.59 -1.54 0.33 0.00 -1.18 0.00 0.00 61.69 59.88 3dbl s THR 298 Cb -0.11 -2.72 0.35 0.00 1.34 0.00 0.00 72.50 71.37 3dbl s THR 298 CO 0.15 0.00 2.17 0.11 -0.54 0.00 0.00 174.62 176.51 3dbl h LYS 299 N 2.06 0.00 -0.16 3.99 1.57 -1.98 -2.35 116.57 119.70 3dbl h LYS 299 Ca -0.29 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.29 3dbl h LYS 299 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 3dbl h LYS 299 CO 0.39 0.05 -0.71 1.96 -0.57 0.00 0.00 179.45 180.57 3dbl h GLN 300 N 0.00 0.69 -6.15 3.15 1.08 -1.98 -3.45 115.11 108.46 3dbl h GLN 300 Ca -0.00 -0.53 -0.74 0.00 -1.45 0.00 0.00 58.65 55.92 3dbl h GLN 300 Cb 0.21 0.10 0.02 0.00 -0.05 0.00 0.00 27.48 27.76 3dbl h GLN 300 CO 0.01 1.15 0.79 2.41 -0.95 0.00 0.00 178.83 182.24 3dbl n THR 301 N -3.93 0.22 -1.64 -0.54 -1.04 -0.89 -4.94 114.28 101.53 3dbl n THR 301 Ca -0.06 -0.04 -0.29 0.00 -2.04 0.00 0.00 64.05 61.62 3dbl n THR 301 Cb 0.71 -1.07 0.13 0.00 -1.82 0.00 0.00 70.33 68.28 3dbl n THR 301 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3dbl s PRO 302 N 2.91 1.21 0.14 -2.82 0.04 -1.26 -4.83 135.00 130.39 3dbl s PRO 302 Ca 0.96 0.17 -0.27 0.00 0.04 0.00 0.00 61.00 61.90 3dbl s PRO 302 Cb -1.09 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 31.57 3dbl s PRO 302 CO 0.64 -2.13 1.59 0.77 0.04 0.00 0.00 177.00 177.91 3dbl h SER 303 N -1.44 -1.23 -0.95 6.66 0.02 -1.96 -2.67 113.55 111.99 3dbl h SER 303 Ca -0.49 0.18 0.29 0.00 -0.84 0.00 0.00 61.79 60.93 3dbl h SER 303 Cb 1.32 0.52 -0.17 0.00 0.14 0.00 0.00 62.40 64.22 3dbl h SER 303 CO 0.60 -0.38 0.23 0.15 -1.14 0.00 0.00 176.83 176.28 3dbl h PHE 304 N -0.40 0.32 -0.02 3.45 3.57 -1.98 0.82 116.94 122.69 3dbl h PHE 304 Ca 0.11 0.06 -0.18 0.00 3.53 0.00 0.00 57.97 61.48 3dbl h PHE 304 Cb 0.59 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 3dbl h PHE 304 CO -0.50 -0.34 -0.80 -1.49 -2.23 0.00 0.00 178.31 172.94 3dbl h TRP 305 N 0.10 0.33 0.07 0.41 4.06 -1.84 -0.78 115.95 118.30 3dbl h TRP 305 Ca 0.63 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 61.43 3dbl h TRP 305 Cb 1.40 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 29.51 3dbl h TRP 305 CO -0.29 0.93 -0.08 0.82 -3.56 0.00 0.00 178.44 176.26 3dbl h ILE 306 N 0.14 0.82 -0.34 1.49 1.08 -0.64 0.34 117.51 120.40 3dbl h ILE 306 Ca -0.03 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 3dbl h ILE 306 Cb 1.39 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 35.94 3dbl h ILE 306 CO 0.12 0.00 0.18 -0.07 -0.69 0.00 0.00 178.15 177.70 3dbl h LEU 307 N -0.17 0.42 -1.01 1.44 3.38 -1.30 -0.98 115.31 117.10 3dbl h LEU 307 Ca 0.01 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 57.97 3dbl h LEU 307 Cb 0.17 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.74 3dbl h LEU 307 CO -0.03 0.39 0.65 0.00 0.09 0.00 0.00 178.44 179.54 3dbl h ALA 308 N 1.05 1.44 -0.62 1.53 0.00 -0.83 0.19 119.26 122.02 3dbl h ALA 308 Ca 0.12 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 3dbl h ALA 308 Cb 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3dbl h ALA 308 CO -0.02 0.38 0.04 -0.09 0.00 0.00 0.00 179.25 179.57 3dbl h ARG 309 N 1.13 1.06 0.87 0.00 1.12 0.21 -1.37 114.38 117.40 3dbl h ARG 309 Ca 0.45 -0.31 -0.04 0.00 -1.11 0.00 0.00 59.98 58.97 3dbl h ARG 309 Cb 0.26 -0.11 0.01 0.00 -0.01 0.00 0.00 29.97 30.12 3dbl h ARG 309 CO -0.20 1.01 -0.42 0.00 -3.11 0.00 0.00 179.97 177.25 3dbl h ALA 310 N 1.06 -1.28 -0.91 2.80 0.00 0.13 -1.25 119.26 119.81 3dbl h ALA 310 Ca 0.18 -0.26 0.30 0.00 0.00 0.00 0.00 54.91 55.14 3dbl h ALA 310 Cb 0.50 0.45 -0.17 0.00 0.00 0.00 0.00 17.79 18.58 3dbl h ALA 310 CO 0.02 -1.20 0.21 1.28 0.00 0.00 0.00 179.25 179.57 3dbl n LEU 311 N -5.22 0.07 -0.10 0.00 7.99 0.55 0.92 117.00 121.22 3dbl n LEU 311 Ca -0.15 1.53 -0.11 0.00 -0.01 0.00 0.00 56.01 57.27 3dbl n LEU 311 Cb 0.46 -0.63 -0.03 0.00 -0.11 0.00 0.00 43.42 43.10 3dbl n LEU 311 CO 0.35 -1.61 0.79 0.50 -1.51 0.00 0.00 177.39 175.90 3dbl h LYS 312 N 0.00 0.50 -0.02 3.23 3.64 -0.82 -1.44 116.57 121.66 3dbl h LYS 312 Ca 0.64 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.85 3dbl h LYS 312 Cb 1.51 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.28 3dbl h LYS 312 CO -0.79 0.63 -0.07 0.93 -2.27 0.00 0.00 179.45 177.88 3dbl h GLU 313 N 0.31 0.03 -0.00 1.90 4.39 0.17 -2.08 114.58 119.30 3dbl h GLU 313 Ca 0.09 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 3dbl h GLU 313 Cb 0.39 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3dbl h GLU 313 CO 0.01 0.11 -0.06 0.35 -1.16 0.00 0.00 179.01 178.26 3dbl h PHE 314 N 0.03 0.07 -0.98 4.33 3.57 -0.85 -2.47 116.94 120.65 3dbl h PHE 314 Ca 0.01 -0.04 0.28 0.00 3.53 0.00 0.00 57.97 61.75 3dbl h PHE 314 Cb 0.15 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3dbl h PHE 314 CO 0.00 0.80 0.70 0.28 -2.23 0.00 0.00 178.31 177.87 3dbl h VAL 315 N -0.69 0.51 0.06 1.41 2.07 -0.78 0.22 116.25 119.05 3dbl h VAL 315 Ca -0.01 -0.00 -0.27 0.00 0.82 0.00 0.00 66.70 67.24 3dbl h VAL 315 Cb 0.82 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 3dbl h VAL 315 CO 0.01 0.00 -1.36 0.00 0.02 0.00 0.00 177.57 176.25 3dbl h ALA 316 N 1.51 0.38 -3.00 1.67 0.00 -1.34 -0.64 119.26 117.85 3dbl h ALA 316 Ca 0.47 -1.09 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3dbl h ALA 316 Cb 1.86 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.79 3dbl h ALA 316 CO -0.01 1.25 0.00 1.17 0.00 0.00 0.00 179.25 181.66 3dbl n LYS 317 N -3.35 0.00 0.00 0.00 4.81 0.70 -4.65 118.16 115.67 3dbl n LYS 317 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.34 3dbl n LYS 317 Cb 1.01 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.06 3dbl n LYS 317 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 3dbl n GLU 318 N 0.00 0.00 -0.01 1.64 0.00 -1.23 -0.93 120.64 120.11 3dbl n GLU 318 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.25 3dbl n GLU 318 Cb 0.00 -1.36 -0.14 0.00 0.00 0.00 0.00 31.44 29.93 3dbl n GLU 318 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3dbl n GLY 319 N -0.74 -0.85 3.41 -1.84 0.00 -0.70 -5.03 105.19 99.44 3dbl n GLY 319 Ca 0.00 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 3dbl n GLY 319 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dbl n GLN 320 N -2.09 -1.79 -0.89 1.61 6.02 -0.11 -2.77 117.38 117.37 3dbl n GLN 320 Ca -0.03 1.34 0.00 0.00 -0.01 0.00 0.00 57.00 58.31 3dbl n GLN 320 Cb 0.47 -3.37 0.00 0.00 1.02 0.00 0.00 30.24 28.36 3dbl n GLN 320 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dbl n GLY 321 N -0.94 0.47 3.13 1.08 0.00 -0.25 -4.98 105.19 103.70 3dbl n GLY 321 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 3dbl n GLY 321 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dbl s ASN 322 N -2.34 0.17 1.06 1.61 0.02 -1.11 -4.83 114.94 109.52 3dbl s ASN 322 Ca 0.00 -0.55 -0.13 0.00 -1.02 0.00 0.00 52.86 51.16 3dbl s ASN 322 Cb 0.00 0.24 0.23 0.00 0.02 0.00 0.00 41.25 41.74 3dbl s ASN 322 CO 0.00 -0.54 1.07 -0.76 0.02 0.00 0.00 177.10 176.89 3dbl s LEU 323 N -2.24 1.30 0.84 0.60 1.43 -1.26 -4.41 118.68 114.94 3dbl s LEU 323 Ca -0.03 1.32 -0.13 0.00 -1.03 0.00 0.00 54.13 54.26 3dbl s LEU 323 Cb 0.00 -3.40 0.09 0.00 0.03 0.00 0.00 46.19 42.91 3dbl s LEU 323 CO -0.05 -3.56 1.08 -2.65 0.23 0.00 0.00 176.35 171.40 3dbl n PRO 324 N -4.47 -0.02 -2.15 1.29 -0.02 -1.26 -4.89 135.00 123.48 3dbl n PRO 324 Ca 0.04 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.17 3dbl n PRO 324 Cb 0.56 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 3dbl n PRO 324 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3dbl s VAL 325 N -2.26 3.55 0.07 -1.45 1.01 -1.26 -4.92 120.40 115.13 3dbl s VAL 325 Ca 0.70 0.94 -0.20 0.00 0.00 0.00 0.00 61.98 63.43 3dbl s VAL 325 Cb -0.27 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 3dbl s VAL 325 CO 0.54 -0.00 1.32 -0.09 0.00 0.00 0.00 175.10 176.87 3dbl h ARG 326 N 7.98 -0.32 0.00 2.72 2.43 -1.84 -3.42 114.38 121.94 3dbl h ARG 326 Ca -0.39 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 3dbl h ARG 326 Cb 1.18 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3dbl h ARG 326 CO 0.91 -0.21 0.00 0.41 -1.51 0.00 0.00 179.97 179.57 3dbl n GLY 327 N -1.25 1.26 3.18 2.80 0.00 -1.26 -4.68 105.19 105.24 3dbl n GLY 327 Ca -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 3dbl n GLY 327 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dbl s THR 328 N -2.00 0.99 0.08 2.61 -4.23 -1.26 -3.77 115.64 108.05 3dbl s THR 328 Ca 0.00 -1.57 0.04 0.00 -1.18 0.00 0.00 61.69 58.98 3dbl s THR 328 Cb 0.00 -1.30 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 3dbl s THR 328 CO 0.00 -0.49 -0.11 0.27 -0.54 0.00 0.00 174.62 173.76 3dbl s ILE 329 N -2.19 0.89 0.33 2.99 -4.36 -1.26 -4.52 121.20 113.07 3dbl s ILE 329 Ca 0.04 -1.40 -0.28 0.00 -0.26 0.00 0.00 60.65 58.75 3dbl s ILE 329 Cb -0.04 -1.09 -0.10 0.00 1.25 0.00 0.00 42.46 42.48 3dbl s ILE 329 CO 0.01 -0.42 1.20 -2.16 0.24 0.00 0.00 174.94 173.81 3dbl s PRO 330 N -2.18 4.39 0.58 0.37 0.04 -1.26 -4.95 135.00 131.98 3dbl s PRO 330 Ca -0.01 1.98 -0.20 0.00 0.04 0.00 0.00 61.00 62.81 3dbl s PRO 330 Cb -0.07 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 3dbl s PRO 330 CO 0.01 -0.07 1.20 -3.47 0.04 0.00 0.00 177.00 174.70 3dbl n ASP 331 N 0.77 1.85 -4.00 6.66 2.03 -1.26 -5.01 116.55 117.60 3dbl n ASP 331 Ca 0.01 0.89 -0.08 0.00 0.52 0.00 0.00 54.79 56.12 3dbl n ASP 331 Cb 0.44 -1.50 -0.10 0.00 -0.72 0.00 0.00 41.12 39.24 3dbl n ASP 331 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3dbl s MET 332 N -2.91 0.53 -0.23 -0.67 -1.94 -1.26 -5.11 119.30 107.71 3dbl s MET 332 Ca 0.75 -0.90 -0.29 0.00 -1.71 0.00 0.00 55.69 53.54 3dbl s MET 332 Cb -0.42 0.19 -0.01 0.00 2.01 0.00 0.00 34.83 36.61 3dbl s MET 332 CO 0.47 -0.11 1.28 0.42 -0.01 0.00 0.00 175.02 177.07 3dbl s ILE 333 N -2.84 4.23 -0.01 2.53 1.01 -1.26 -4.91 121.20 119.94 3dbl s ILE 333 Ca -0.03 1.44 -0.15 0.00 0.00 0.00 0.00 60.65 61.91 3dbl s ILE 333 Cb 0.00 -4.07 0.05 0.00 0.01 0.00 0.00 42.46 38.45 3dbl s ILE 333 CO -0.06 -0.29 0.68 0.00 0.00 0.00 0.00 174.94 175.27 3dbl n ALA 334 N 7.07 -1.93 -1.82 9.38 0.00 -1.26 -4.36 120.51 127.60 3dbl n ALA 334 Ca 0.14 -0.42 -0.33 0.00 0.00 0.00 0.00 53.44 52.83 3dbl n ALA 334 Cb 0.46 0.08 -0.07 0.00 0.00 0.00 0.00 19.45 19.91 3dbl n ALA 334 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dbl s ASP 335 N -2.51 6.92 0.11 0.00 -1.08 -0.89 -4.92 116.67 114.29 3dbl s ASP 335 Ca 0.16 1.71 -0.32 0.00 -0.52 0.00 0.00 52.55 53.58 3dbl s ASP 335 Cb -0.00 -2.54 -0.12 0.00 -1.46 0.00 0.00 42.92 38.80 3dbl s ASP 335 CO -0.00 -0.37 1.59 0.28 0.52 0.00 0.00 175.17 177.19 3dbl h SER 336 N 1.94 -1.19 -0.25 -0.34 0.02 -2.00 -0.55 113.55 111.18 3dbl h SER 336 Ca -0.49 0.12 -0.04 0.00 -0.84 0.00 0.00 61.79 60.55 3dbl h SER 336 Cb 1.18 0.43 -0.02 0.00 0.14 0.00 0.00 62.40 64.13 3dbl h SER 336 CO 0.61 -0.51 0.05 1.23 -1.14 0.00 0.00 176.83 177.07 3dbl h GLY 337 N -0.71 0.54 1.02 -3.77 0.00 -1.99 -2.53 103.07 95.63 3dbl h GLY 337 Ca 0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 3dbl h GLY 337 CO -0.18 0.27 -0.29 0.50 0.00 0.00 0.00 176.54 176.84 3dbl h LYS 338 N 0.49 0.79 0.91 4.80 1.57 -1.86 -2.11 116.57 121.16 3dbl h LYS 338 Ca 0.11 -0.40 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 3dbl h LYS 338 Cb 0.24 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.57 3dbl h LYS 338 CO 0.00 1.03 -0.44 -0.92 -0.57 0.00 0.00 179.45 178.56 3dbl h TYR 339 N 0.57 -1.13 0.00 -1.35 3.20 -0.93 -2.12 116.97 115.21 3dbl h TYR 339 Ca 0.06 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3dbl h TYR 339 Cb 0.87 0.37 0.00 0.00 1.54 0.00 0.00 36.73 39.51 3dbl h TYR 339 CO 0.07 -0.70 0.15 0.82 -1.64 0.00 0.00 178.16 176.85 3dbl h ILE 340 N -1.28 0.00 0.13 1.81 2.04 -1.52 0.33 117.51 119.02 3dbl h ILE 340 Ca -0.12 0.00 -0.29 0.00 1.00 0.00 0.00 64.86 65.45 3dbl h ILE 340 Cb 0.93 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 3dbl h ILE 340 CO 0.20 0.00 -1.35 0.11 0.00 0.00 0.00 178.15 177.11 3dbl h LYS 341 N 0.00 0.28 0.05 2.37 1.57 -1.03 -2.13 116.57 117.68 3dbl h LYS 341 Ca 0.00 -0.48 -0.23 0.00 -1.87 0.00 0.00 60.65 58.07 3dbl h LYS 341 Cb 0.29 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3dbl h LYS 341 CO 0.00 1.20 -1.04 1.25 -0.57 0.00 0.00 179.45 180.29 3dbl h LEU 342 N 0.08 0.31 -0.53 2.94 5.85 -0.51 -2.91 115.31 120.55 3dbl h LEU 342 Ca -0.18 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3dbl h LEU 342 Cb 2.00 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.91 3dbl h LEU 342 CO 0.19 1.16 0.33 -0.61 -0.34 0.00 0.00 178.44 179.18 3dbl h GLN 343 N 0.09 0.71 0.00 1.25 4.15 -0.45 -2.25 115.11 118.61 3dbl h GLN 343 Ca -0.08 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.23 3dbl h GLN 343 Cb 1.73 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 29.25 3dbl h GLN 343 CO 0.16 0.49 -0.30 -0.91 -1.93 0.00 0.00 178.83 176.35 3dbl h ASN 344 N 0.71 0.00 -0.08 -0.69 4.21 -1.37 0.38 115.58 118.74 3dbl h ASN 344 Ca 0.19 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.73 3dbl h ASN 344 Cb -0.05 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.12 3dbl h ASN 344 CO -0.04 0.30 -0.09 0.58 -1.29 0.00 0.00 177.43 176.89 3dbl h VAL 345 N 0.00 0.75 0.16 2.81 2.07 -1.20 0.18 116.25 121.03 3dbl h VAL 345 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3dbl h VAL 345 Cb 0.69 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 3dbl h VAL 345 CO 0.04 0.00 -0.08 1.88 0.02 0.00 0.00 177.57 179.43 3dbl h TYR 346 N -0.11 -0.20 -1.15 1.57 -1.99 -1.45 -0.37 116.97 113.27 3dbl h TYR 346 Ca 0.06 -0.00 0.32 0.00 2.00 0.00 0.00 58.73 61.11 3dbl h TYR 346 Cb 0.20 0.07 -0.06 0.00 2.00 0.00 0.00 36.73 38.93 3dbl h TYR 346 CO -0.19 0.24 0.80 -0.09 -0.00 0.00 0.00 178.16 178.91 3dbl h ARG 347 N -0.80 0.11 0.13 4.88 2.43 -0.87 0.42 114.38 120.67 3dbl h ARG 347 Ca -0.02 -0.01 -0.35 0.00 -0.81 0.00 0.00 59.98 58.80 3dbl h ARG 347 Cb 0.53 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3dbl h ARG 347 CO 0.04 0.08 -1.84 0.93 -1.51 0.00 0.00 179.97 177.66 3dbl h GLU 348 N 0.12 0.26 -0.40 0.20 4.39 -0.93 -2.84 114.58 115.38 3dbl h GLU 348 Ca 0.58 -0.45 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 3dbl h GLU 348 Cb 2.05 0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 30.85 3dbl h GLU 348 CO -0.11 1.14 0.25 -0.22 -1.16 0.00 0.00 179.01 178.92 3dbl h LYS 349 N 0.07 0.54 0.57 2.33 1.63 0.66 -2.44 116.57 119.93 3dbl h LYS 349 Ca -0.36 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.37 3dbl h LYS 349 Cb 2.05 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 33.54 3dbl h LYS 349 CO 0.12 0.39 -0.51 0.00 -3.45 0.00 0.00 179.45 176.01 3dbl h ALA 350 N 1.12 -1.18 -0.28 5.00 0.00 -0.36 -0.68 119.26 122.88 3dbl h ALA 350 Ca 0.15 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.93 3dbl h ALA 350 Cb -0.02 0.71 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3dbl h ALA 350 CO -0.03 -1.20 0.54 -0.22 0.00 0.00 0.00 179.25 178.34 3dbl h LYS 351 N -1.05 0.00 0.20 0.00 3.64 -1.41 -0.96 116.57 116.98 3dbl h LYS 351 Ca -0.07 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3dbl h LYS 351 Cb 0.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3dbl h LYS 351 CO -0.03 0.00 -0.10 -0.22 -2.27 0.00 0.00 179.45 176.84 3dbl h LYS 352 N 0.00 -0.26 -0.89 1.90 3.64 -0.64 -2.71 116.57 117.61 3dbl h LYS 352 Ca 0.13 0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.69 3dbl h LYS 352 Cb 1.21 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 33.02 3dbl h LYS 352 CO -0.00 0.01 0.58 -0.44 -2.27 0.00 0.00 179.45 177.33 3dbl h ASP 353 N -1.01 0.59 0.17 4.20 5.19 -0.68 0.79 116.42 125.68 3dbl h ASP 353 Ca -0.03 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.40 3dbl h ASP 353 Cb 0.39 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 39.83 3dbl h ASP 353 CO 0.05 0.28 -0.12 0.00 -3.12 0.00 0.00 179.24 176.32 3dbl h ALA 354 N 1.61 1.64 -0.04 3.45 0.00 -1.28 0.18 119.26 124.81 3dbl h ALA 354 Ca 0.46 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 3dbl h ALA 354 Cb 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3dbl h ALA 354 CO -0.21 0.15 -0.18 0.00 0.00 0.00 0.00 179.25 179.01 3dbl h ALA 355 N 1.88 0.08 -0.31 0.00 0.00 0.91 -2.43 119.26 119.40 3dbl h ALA 355 Ca -0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 3dbl h ALA 355 Cb 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3dbl h ALA 355 CO 0.02 0.04 0.15 0.00 0.00 0.00 0.00 179.25 179.45 3dbl h ALA 356 N 0.40 0.39 -0.53 0.00 0.00 -0.62 -2.58 119.26 116.32 3dbl h ALA 356 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3dbl h ALA 356 Cb 0.83 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3dbl h ALA 356 CO 0.04 -0.05 0.33 0.28 0.00 0.00 0.00 179.25 179.85 3dbl h VAL 357 N 0.36 1.15 0.00 0.00 2.07 -0.75 -0.58 116.25 118.50 3dbl h VAL 357 Ca 0.11 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 3dbl h VAL 357 Cb 0.11 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3dbl h VAL 357 CO -0.01 0.15 -0.01 1.23 0.02 0.00 0.00 177.57 178.94 3dbl h GLY 358 N 0.75 0.00 0.42 2.17 0.00 -1.05 -2.70 103.07 102.66 3dbl h GLY 358 Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 3dbl h GLY 358 CO -0.04 0.00 -0.20 3.43 0.00 0.00 0.00 176.54 179.73 3dbl h ASN 359 N 0.00 -0.48 -1.05 0.19 -0.26 -0.82 -3.01 115.58 110.14 3dbl h ASN 359 Ca -0.00 0.02 0.28 0.00 -0.56 0.00 0.00 56.30 56.03 3dbl h ASN 359 Cb 0.39 0.12 -0.09 0.00 -1.06 0.00 0.00 38.32 37.68 3dbl h ASN 359 CO 0.00 -0.12 0.69 0.45 -1.06 0.00 0.00 177.43 177.39 3dbl h HIS 360 N -1.02 0.59 0.51 1.19 3.86 -1.44 -0.61 115.15 118.24 3dbl h HIS 360 Ca -0.06 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 3dbl h HIS 360 Cb 0.43 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.73 3dbl h HIS 360 CO 0.01 0.05 -0.31 0.28 0.86 0.00 0.00 177.93 178.82 3dbl h VAL 361 N 0.35 0.36 -0.90 2.45 2.07 -1.47 0.18 116.25 119.30 3dbl h VAL 361 Ca 0.60 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.19 3dbl h VAL 361 Cb 1.59 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 3dbl h VAL 361 CO -0.27 0.00 0.58 0.00 0.02 0.00 0.00 177.57 177.90 3dbl h ALA 362 N -0.35 1.54 0.33 1.67 0.00 -1.00 0.52 119.26 121.97 3dbl h ALA 362 Ca -0.06 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3dbl h ALA 362 Cb 0.64 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3dbl h ALA 362 CO 0.06 0.32 -0.16 0.87 0.00 0.00 0.00 179.25 180.34 3dbl h LYS 363 N 1.00 -0.43 -0.73 0.00 1.57 -1.06 0.10 116.57 117.02 3dbl h LYS 363 Ca 0.39 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 59.30 3dbl h LYS 363 Cb 0.23 0.10 -0.08 0.00 0.08 0.00 0.00 32.23 32.56 3dbl h LYS 363 CO -0.15 -0.17 0.35 -0.07 -0.57 0.00 0.00 179.45 178.84 3dbl h LEU 364 N -0.64 0.44 -1.07 2.94 4.07 0.08 0.99 115.31 122.11 3dbl h LEU 364 Ca -0.05 0.07 -0.03 0.00 0.08 0.00 0.00 57.88 57.96 3dbl h LEU 364 Cb 0.46 -0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.17 3dbl h LEU 364 CO 0.08 0.24 0.31 -0.07 -1.08 0.00 0.00 178.44 177.92 3dbl h LEU 365 N 0.58 0.88 -0.13 1.67 3.38 0.29 -2.46 115.31 119.52 3dbl h LEU 365 Ca 0.37 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 58.11 3dbl h LEU 365 Cb 0.42 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3dbl h LEU 365 CO -0.29 0.75 -0.40 1.56 0.09 0.00 0.00 178.44 180.16 3dbl h GLN 366 N 0.96 0.51 -0.57 1.13 4.20 0.47 0.22 115.11 122.03 3dbl h GLN 366 Ca 0.23 -0.36 0.07 0.00 0.06 0.00 0.00 58.65 58.65 3dbl h GLN 366 Cb 0.12 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3dbl h GLN 366 CO -0.03 0.98 0.38 0.66 -0.67 0.00 0.00 178.83 180.15 3dbl h SER 367 N 0.12 0.43 1.09 1.46 4.64 -0.71 0.26 113.55 120.84 3dbl h SER 367 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3dbl h SER 367 Cb 1.02 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 3dbl h SER 367 CO 0.08 0.28 -0.56 0.40 -0.87 0.00 0.00 176.83 176.17 3dbl h ILE 368 N 0.49 0.00 -3.09 0.95 2.04 -1.40 -3.49 117.51 113.01 3dbl h ILE 368 Ca 0.25 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 3dbl h ILE 368 Cb 0.35 1.30 0.03 0.00 -0.74 0.00 0.00 36.82 37.76 3dbl h ILE 368 CO -0.07 0.00 -0.11 0.61 0.00 0.00 0.00 178.15 178.58 3dbl n GLY 369 N 1.28 0.55 3.14 5.37 0.00 0.93 -4.65 105.19 111.80 3dbl n GLY 369 Ca 0.03 -0.23 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 3dbl n GLY 369 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dbl s GLN 370 N -3.48 0.74 -0.34 1.61 -0.21 0.50 -5.00 119.66 113.49 3dbl s GLN 370 Ca 0.04 -0.95 -0.31 0.00 0.02 0.00 0.00 55.36 54.17 3dbl s GLN 370 Cb -0.01 -0.61 -0.09 0.00 1.00 0.00 0.00 33.01 33.30 3dbl s GLN 370 CO 0.10 0.12 2.25 0.00 -2.12 0.00 0.00 175.29 175.65 3dbl n ALA 371 N 1.17 1.28 0.00 6.09 0.00 -1.26 -4.39 120.51 123.40 3dbl n ALA 371 Ca -0.20 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 52.99 3dbl n ALA 371 Cb 0.55 -2.76 0.00 0.00 0.00 0.00 0.00 19.45 17.25 3dbl n ALA 371 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dbl n PRO 372 N 8.52 0.00 -1.15 0.00 -0.02 -1.26 -0.53 135.00 140.57 3dbl n PRO 372 Ca 0.38 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.69 3dbl n PRO 372 Cb 0.34 -1.82 0.23 0.00 -0.02 0.00 0.00 33.50 32.23 3dbl n PRO 372 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dbl n GLU 373 N -0.92 2.80 0.00 -0.52 4.07 -1.26 -4.23 120.64 120.58 3dbl n GLU 373 Ca 0.00 -3.00 0.15 0.00 -0.06 0.00 0.00 57.16 54.24 3dbl n GLU 373 Cb 0.46 -2.19 0.72 0.00 -0.06 0.00 0.00 31.44 30.37 3dbl n GLU 373 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 3dbl n SER 374 N -0.76 0.02 -3.54 4.31 7.64 0.31 -4.48 113.62 117.12 3dbl n SER 374 Ca 0.52 -0.04 -0.27 0.00 1.01 0.00 0.00 58.87 60.10 3dbl n SER 374 Cb 1.56 -0.31 -0.15 0.00 -1.01 0.00 0.00 64.21 64.30 3dbl n SER 374 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3dbl s ILE 375 N -2.65 -0.11 1.47 0.44 1.09 -1.26 -5.03 121.20 115.14 3dbl s ILE 375 Ca 0.26 -0.61 -0.24 0.00 -1.10 0.00 0.00 60.65 58.95 3dbl s ILE 375 Cb 0.20 -0.90 0.38 0.00 -1.06 0.00 0.00 42.46 41.08 3dbl s ILE 375 CO 0.48 -0.61 0.91 -0.94 -0.10 0.00 0.00 174.94 174.67 3dbl s SER 376 N 2.13 -1.45 0.08 3.58 1.04 -1.26 -4.90 113.70 112.91 3dbl s SER 376 Ca 0.08 0.78 0.15 0.00 0.48 0.00 0.00 55.95 57.44 3dbl s SER 376 Cb -0.16 -1.07 -0.13 0.00 0.10 0.00 0.00 66.02 64.76 3dbl s SER 376 CO -0.31 -5.59 0.91 -0.08 0.98 0.00 0.00 173.24 169.14 3dbl h GLU 377 N -3.58 0.00 0.46 4.02 4.81 -1.99 -3.16 114.58 115.14 3dbl h GLU 377 Ca -0.40 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 3dbl h GLU 377 Cb 1.34 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.71 3dbl h GLU 377 CO 0.25 0.39 -0.41 0.87 -0.73 0.00 0.00 179.01 179.38 3dbl h LYS 378 N 0.00 -0.82 0.00 1.92 1.57 -1.99 0.40 116.57 117.65 3dbl h LYS 378 Ca -0.15 0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 3dbl h LYS 378 Cb 1.64 0.19 -0.00 0.00 0.08 0.00 0.00 32.23 34.14 3dbl h LYS 378 CO 0.06 -0.55 -0.01 1.05 -0.57 0.00 0.00 179.45 179.44 3dbl h GLU 379 N -0.85 0.00 0.07 3.15 4.11 -1.95 -1.36 114.58 117.75 3dbl h GLU 379 Ca -0.06 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.11 3dbl h GLU 379 Cb 0.72 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.98 3dbl h GLU 379 CO -0.02 0.01 -1.11 1.25 0.07 0.00 0.00 179.01 179.20 3dbl h LEU 380 N 0.00 0.56 -0.09 3.06 5.85 -1.22 -2.36 115.31 121.10 3dbl h LEU 380 Ca -0.00 -0.51 -0.05 0.00 0.84 0.00 0.00 57.88 58.16 3dbl h LEU 380 Cb 0.03 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 3dbl h LEU 380 CO 0.00 1.35 -0.13 0.11 -0.34 0.00 0.00 178.44 179.43 3dbl h LYS 381 N 0.18 0.26 0.00 1.25 1.57 0.79 -2.83 116.57 117.78 3dbl h LYS 381 Ca -0.12 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.48 3dbl h LYS 381 Cb 1.79 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 34.11 3dbl h LYS 381 CO 0.19 0.71 -0.15 1.25 -0.57 0.00 0.00 179.45 180.88 3dbl h LEU 382 N -0.18 0.00 -0.28 2.94 5.85 -1.38 -2.15 115.31 120.11 3dbl h LEU 382 Ca 0.01 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 3dbl h LEU 382 Cb 0.68 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3dbl h LEU 382 CO 0.03 0.15 0.03 0.25 -0.34 0.00 0.00 178.44 178.57 3dbl h LEU 383 N 0.00 0.45 -0.68 2.25 5.85 -1.32 -2.93 115.31 118.93 3dbl h LEU 383 Ca -0.00 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 3dbl h LEU 383 Cb 0.28 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 3dbl h LEU 383 CO 0.02 0.61 -0.16 0.00 -0.34 0.00 0.00 178.44 178.57 3dbl h SER 385 N 0.00 0.00 -0.19 0.00 0.02 -1.31 -3.27 113.55 108.80 3dbl h SER 385 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3dbl h SER 385 Cb 0.88 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.42 3dbl h SER 385 CO 0.02 0.61 0.00 0.59 -1.14 0.00 0.00 176.83 176.91 3dbl n ASN 386 N -3.62 2.87 -0.40 3.07 3.02 -1.12 -4.77 115.26 114.31 3dbl n ASN 386 Ca -0.01 -2.44 0.36 0.00 -0.03 0.00 0.00 54.58 52.47 3dbl n ASN 386 Cb 0.65 -0.29 0.71 0.00 -0.61 0.00 0.00 39.78 40.24 3dbl n ASN 386 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3dbl h SER 387 N 1.17 0.11 -0.28 6.41 4.64 -1.29 1.71 113.55 126.02 3dbl h SER 387 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3dbl h SER 387 Cb 0.91 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 3dbl h SER 387 CO 0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 3dbl n ALA 388 N -2.72 2.47 0.17 5.18 0.00 -1.26 -4.05 120.51 120.31 3dbl n ALA 388 Ca 0.30 -0.71 0.02 0.00 0.00 0.00 0.00 53.44 53.05 3dbl n ALA 388 Cb 1.34 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 19.81 3dbl n ALA 388 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3dbl n PHE 389 N 0.77 0.01 -1.70 0.00 0.99 0.58 -4.86 117.46 113.26 3dbl n PHE 389 Ca 0.17 -0.02 -0.40 0.00 -0.00 0.00 0.00 57.45 57.20 3dbl n PHE 389 Cb 0.42 -0.00 0.03 0.00 -1.00 0.00 0.00 39.48 38.93 3dbl n PHE 389 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 3dbl n LEU 390 N 0.23 4.31 -3.84 4.37 4.77 -1.05 -4.48 117.00 121.31 3dbl n LEU 390 Ca 0.03 1.03 -0.12 0.00 -0.03 0.00 0.00 56.01 56.91 3dbl n LEU 390 Cb 0.12 -1.50 -0.13 0.00 -2.33 0.00 0.00 43.42 39.58 3dbl n LEU 390 CO 0.03 -0.83 -0.29 -0.13 -1.33 0.00 0.00 177.39 174.83 3dbl s ARG 391 N -2.45 0.07 -0.10 3.23 1.81 -0.70 -4.81 118.95 116.00 3dbl s ARG 391 Ca 0.66 0.10 0.02 0.00 -1.72 0.00 0.00 55.73 54.78 3dbl s ARG 391 Cb -0.47 0.02 0.02 0.00 -0.45 0.00 0.00 34.95 34.07 3dbl s ARG 391 CO 0.54 -0.02 -0.13 0.08 -0.68 0.00 0.00 175.30 175.09 3dbl s VAL 392 N 0.09 1.34 -0.05 3.52 1.01 -1.26 0.96 120.40 126.00 3dbl s VAL 392 Ca -0.00 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.46 3dbl s VAL 392 Cb -0.01 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 3dbl s VAL 392 CO -0.00 0.41 -0.13 -0.69 0.00 0.00 0.00 175.10 174.69 3dbl s VAL 393 N 1.01 3.18 -0.04 2.92 1.01 -0.08 -4.97 120.40 123.44 3dbl s VAL 393 Ca -0.07 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3dbl s VAL 393 Cb -0.15 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.00 3dbl s VAL 393 CO -0.01 0.59 -0.01 -0.13 0.00 0.00 0.00 175.10 175.54 3dbl s ARG 394 N -0.75 0.47 -0.05 2.72 0.52 -1.26 -0.46 118.95 120.14 3dbl s ARG 394 Ca 0.12 0.04 -0.02 0.00 -0.52 0.00 0.00 55.73 55.35 3dbl s ARG 394 Cb -0.11 -0.63 -0.04 0.00 0.52 0.00 0.00 34.95 34.69 3dbl s ARG 394 CO 0.01 -0.14 0.06 0.00 0.02 0.00 0.00 175.30 175.24 3dbl s ARG 396 N -1.36 3.81 0.78 0.00 1.81 -1.26 -4.63 118.95 118.09 3dbl s ARG 396 Ca 0.19 1.82 -0.11 0.00 -1.72 0.00 0.00 55.73 55.91 3dbl s ARG 396 Cb -0.12 -2.47 0.06 0.00 -0.45 0.00 0.00 34.95 31.97 3dbl s ARG 396 CO 0.09 -0.52 1.09 -1.54 -0.68 0.00 0.00 175.30 173.73 3dbl s SER 397 N -1.27 4.50 0.23 0.23 1.04 -1.26 -4.88 113.70 112.30 3dbl s SER 397 Ca 0.62 1.75 -0.05 0.00 0.48 0.00 0.00 55.95 58.75 3dbl s SER 397 Cb -0.30 -2.47 0.23 0.00 0.10 0.00 0.00 66.02 63.59 3dbl s SER 397 CO 0.37 -2.03 1.72 0.25 0.98 0.00 0.00 173.24 174.53 3dbl h LEU 398 N -1.12 0.87 -0.50 2.42 5.85 -1.94 -2.49 115.31 118.41 3dbl h LEU 398 Ca -0.44 -0.22 0.10 0.00 0.84 0.00 0.00 57.88 58.15 3dbl h LEU 398 Cb 1.23 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.93 3dbl h LEU 398 CO 0.53 0.93 -0.24 0.00 -0.34 0.00 0.00 178.44 179.31 3dbl h ALA 399 N 1.16 0.10 -0.38 1.25 0.00 -1.92 -0.17 119.26 119.30 3dbl h ALA 399 Ca 0.16 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.26 3dbl h ALA 399 Cb 0.49 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3dbl h ALA 399 CO 0.02 -0.58 0.20 0.93 0.00 0.00 0.00 179.25 179.82 3dbl h GLU 400 N -0.13 0.39 -0.73 0.00 5.08 -1.82 0.62 114.58 117.99 3dbl h GLU 400 Ca 0.23 -0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.63 3dbl h GLU 400 Cb 0.49 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 3dbl h GLU 400 CO -0.58 0.26 0.42 1.49 -1.00 0.00 0.00 179.01 179.60 3dbl h GLU 401 N 0.41 0.74 0.00 2.33 4.81 -0.80 -2.78 114.58 119.28 3dbl h GLU 401 Ca 0.16 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 3dbl h GLU 401 Cb 0.05 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 3dbl h GLU 401 CO -0.10 0.49 -0.34 1.88 -0.73 0.00 0.00 179.01 180.21 3dbl h TYR 402 N 0.76 0.00 -3.76 0.92 -1.99 -0.68 -3.38 116.97 108.84 3dbl h TYR 402 Ca 0.33 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 60.52 3dbl h TYR 402 Cb 0.22 0.00 0.11 0.00 2.00 0.00 0.00 36.73 39.05 3dbl h TYR 402 CO -0.07 0.23 0.72 0.41 -0.00 0.00 0.00 178.16 179.46 3dbl n GLY 403 N 1.17 1.07 0.27 3.88 0.00 0.18 -4.88 105.19 106.88 3dbl n GLY 403 Ca 0.02 0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.49 3dbl n GLY 403 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dbl h LEU 404 N 2.95 0.00 0.00 0.99 3.38 -1.91 -1.89 115.31 118.83 3dbl h LEU 404 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3dbl h LEU 404 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3dbl h LEU 404 CO 0.64 0.09 -1.68 -0.67 0.09 0.00 0.00 178.44 176.91 3dbl n ASP 405 N -3.76 0.29 -0.43 -0.43 -0.08 -1.26 -4.46 116.55 106.42 3dbl n ASP 405 Ca -0.02 -0.21 0.07 0.00 -1.51 0.00 0.00 54.79 53.12 3dbl n ASP 405 Cb 0.19 1.64 0.03 0.00 2.34 0.00 0.00 41.12 45.32 3dbl n ASP 405 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3dbl n THR 406 N -2.10 0.00 -1.74 5.18 -2.24 -1.10 -5.00 114.28 107.28 3dbl n THR 406 Ca -0.02 -0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 3dbl n THR 406 Cb 0.51 1.22 -0.01 0.00 -2.10 0.00 0.00 70.33 69.95 3dbl n THR 406 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dbl n ILE 407 N 0.28 1.25 -1.57 2.28 3.06 -0.73 -4.68 119.36 119.24 3dbl n ILE 407 Ca 0.07 -0.31 -0.41 0.00 -2.50 0.00 0.00 62.75 59.60 3dbl n ILE 407 Cb 0.32 -1.89 -0.01 0.00 0.54 0.00 0.00 39.64 38.59 3dbl n ILE 407 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 3dbl n ASN 408 N 1.77 5.36 -0.35 9.51 2.85 -1.26 -4.78 115.26 128.36 3dbl n ASN 408 Ca 0.07 -2.75 0.13 0.00 -0.11 0.00 0.00 54.58 51.92 3dbl n ASN 408 Cb 0.36 -1.61 0.32 0.00 1.24 0.00 0.00 39.78 40.09 3dbl n ASN 408 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 3dbl h LYS 409 N 5.75 0.71 -0.50 1.20 1.57 -1.98 -2.03 116.57 121.30 3dbl h LYS 409 Ca 0.66 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.43 3dbl h LYS 409 Cb 0.52 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 3dbl h LYS 409 CO 1.86 0.47 0.28 -0.44 -0.57 0.00 0.00 179.45 181.04 3dbl h ASP 410 N 0.73 0.43 -0.50 0.86 3.32 -1.99 -0.70 116.42 118.57 3dbl h ASP 410 Ca 0.57 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.66 3dbl h ASP 410 Cb 0.90 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.35 3dbl h ASP 410 CO -0.39 0.30 0.33 -0.08 -1.72 0.00 0.00 179.24 177.68 3dbl h GLU 411 N 0.55 0.57 0.03 3.56 4.57 -1.76 -0.50 114.58 121.61 3dbl h GLU 411 Ca 0.21 -0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.26 3dbl h GLU 411 Cb 0.07 -0.13 0.01 0.00 -0.16 0.00 0.00 28.75 28.54 3dbl h GLU 411 CO -0.12 0.38 -0.40 0.82 -1.18 0.00 0.00 179.01 178.51 3dbl h ILE 412 N 0.59 1.56 -0.17 2.32 2.04 -1.31 -3.08 117.51 119.45 3dbl h ILE 412 Ca 0.20 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 63.89 3dbl h ILE 412 Cb 0.06 2.93 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 3dbl h ILE 412 CO -0.05 0.60 0.06 0.40 0.00 0.00 0.00 178.15 179.16 3dbl h ILE 413 N -0.48 1.16 0.26 -0.67 2.04 -0.89 -1.72 117.51 117.21 3dbl h ILE 413 Ca -0.06 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 3dbl h ILE 413 Cb 1.20 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 3dbl h ILE 413 CO 0.08 0.15 -0.21 0.28 0.00 0.00 0.00 178.15 178.45 3dbl h SER 414 N 0.11 -0.54 -0.58 1.72 0.02 -1.24 -2.64 113.55 110.39 3dbl h SER 414 Ca 0.06 0.04 0.11 0.00 -0.84 0.00 0.00 61.79 61.16 3dbl h SER 414 Cb 0.18 0.18 -0.09 0.00 0.14 0.00 0.00 62.40 62.81 3dbl h SER 414 CO -0.00 -0.32 0.09 0.28 -1.14 0.00 0.00 176.83 175.74 3dbl h SER 415 N -0.48 -0.07 0.00 3.07 0.02 -1.51 -1.25 113.55 113.34 3dbl h SER 415 Ca -0.01 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3dbl h SER 415 Cb 0.43 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.14 3dbl h SER 415 CO -0.02 -0.02 0.00 0.23 -1.14 0.00 0.00 176.83 175.88 3dbl n MET 416 N -5.16 0.03 0.06 3.45 2.00 -0.65 -2.90 117.12 113.95 3dbl n MET 416 Ca 0.08 0.05 0.08 0.00 0.00 0.00 0.00 57.70 57.91 3dbl n MET 416 Cb 0.31 -1.50 0.52 0.00 0.00 0.00 0.00 33.22 32.55 3dbl n MET 416 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3dbl h ASP 417 N 0.00 0.29 -3.53 7.83 3.32 -1.22 -3.29 116.42 119.82 3dbl h ASP 417 Ca 0.00 -0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.33 3dbl h ASP 417 Cb 0.00 -0.07 -0.24 0.00 0.22 0.00 0.00 39.33 39.25 3dbl h ASP 417 CO 0.00 0.20 -0.47 0.21 -1.72 0.00 0.00 179.24 177.46 3dbl s ASN 418 N -6.69 5.87 0.00 6.45 3.04 -1.14 -4.96 114.94 117.51 3dbl s ASN 418 Ca -0.07 -1.03 0.00 0.00 0.04 0.00 0.00 52.86 51.80 3dbl s ASN 418 Cb 0.18 -2.07 0.00 0.00 -1.54 0.00 0.00 41.25 37.82 3dbl s ASN 418 CO 0.72 -0.44 0.35 -0.81 -3.04 0.00 0.00 177.10 173.88 3dbl n PRO 419 N 5.05 0.00 -0.11 0.43 -0.04 -1.24 -1.23 135.00 137.86 3dbl n PRO 419 Ca -0.11 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.39 3dbl n PRO 419 Cb 0.46 -1.41 0.06 0.00 -0.04 0.00 0.00 33.50 32.57 3dbl n PRO 419 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3dbl n ASP 420 N -0.84 1.56 -4.77 3.54 8.00 -1.26 -4.80 116.55 117.99 3dbl n ASP 420 Ca 0.00 -2.31 -0.37 0.00 0.71 0.00 0.00 54.79 52.82 3dbl n ASP 420 Cb 0.00 -0.21 -0.01 0.00 -0.02 0.00 0.00 41.12 40.88 3dbl n ASP 420 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3dbl s ASN 421 N -1.63 6.15 0.64 -2.24 3.84 -0.37 -4.90 114.94 116.43 3dbl s ASN 421 Ca 0.13 2.27 0.35 0.00 0.21 0.00 0.00 52.86 55.82 3dbl s ASN 421 Cb 0.11 -2.60 1.94 0.00 -0.55 0.00 0.00 41.25 40.16 3dbl s ASN 421 CO 0.01 -0.93 2.16 1.05 -2.79 0.00 0.00 177.10 176.60 3dbl h GLU 422 N 1.96 0.00 0.00 0.43 9.09 -1.93 -1.43 114.58 122.69 3dbl h GLU 422 Ca -0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.92 3dbl h GLU 422 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 3dbl h GLU 422 CO 0.60 0.00 0.18 0.97 0.05 0.00 0.00 179.01 180.81 3dbl h ILE 423 N 0.00 0.00 -0.48 -1.06 6.09 -1.93 0.25 117.51 120.38 3dbl h ILE 423 Ca 0.03 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.51 3dbl h ILE 423 Cb 0.34 0.65 -0.02 0.00 0.47 0.00 0.00 36.82 38.26 3dbl h ILE 423 CO -0.00 0.00 0.26 0.58 -3.07 0.00 0.00 178.15 175.92 3dbl h VAL 424 N 0.00 1.17 -0.13 2.19 2.07 -1.62 -1.35 116.25 118.58 3dbl h VAL 424 Ca 0.00 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 3dbl h VAL 424 Cb 0.36 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3dbl h VAL 424 CO 0.00 0.18 -0.06 -0.07 0.02 0.00 0.00 177.57 177.64 3dbl h LEU 425 N 0.63 0.17 -0.00 2.57 3.38 -0.72 -0.34 115.31 121.00 3dbl h LEU 425 Ca 0.17 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dbl h LEU 425 Cb 0.05 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3dbl h LEU 425 CO -0.03 0.27 0.00 0.22 0.09 0.00 0.00 178.44 178.99 3dbl h TYR 426 N 0.19 0.01 -0.69 1.13 3.20 -1.14 -0.65 116.97 119.01 3dbl h TYR 426 Ca 0.04 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3dbl h TYR 426 Cb 0.24 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 3dbl h TYR 426 CO 0.00 0.15 0.43 -0.07 -1.64 0.00 0.00 178.16 177.03 3dbl h LEU 427 N -0.14 0.81 -1.50 2.82 3.38 -0.80 -1.65 115.31 118.23 3dbl h LEU 427 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3dbl h LEU 427 Cb 0.14 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3dbl h LEU 427 CO -0.00 0.61 0.24 0.24 0.09 0.00 0.00 178.44 179.62 3dbl h MET 428 N 0.93 0.57 0.00 1.13 2.86 -0.82 0.17 114.93 119.78 3dbl h MET 428 Ca 0.25 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.77 3dbl h MET 428 Cb -0.06 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 3dbl h MET 428 CO -0.05 0.42 -0.31 -0.07 1.06 0.00 0.00 176.91 177.96 3dbl h LEU 429 N 0.58 0.00 0.07 1.22 3.38 -0.23 0.11 115.31 120.44 3dbl h LEU 429 Ca 0.15 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.86 3dbl h LEU 429 Cb 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3dbl h LEU 429 CO -0.03 0.31 -1.27 0.03 0.09 0.00 0.00 178.44 177.58 3dbl h ARG 430 N 0.00 0.15 -0.07 1.13 2.47 -0.33 -1.63 114.38 116.09 3dbl h ARG 430 Ca -0.00 -0.25 -0.02 0.00 -1.26 0.00 0.00 59.98 58.45 3dbl h ARG 430 Cb 0.81 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 3dbl h ARG 430 CO 0.04 1.05 -0.02 0.00 0.56 0.00 0.00 179.97 181.60 3dbl h ALA 431 N 0.74 0.09 -0.23 0.04 0.00 -0.36 -1.76 119.26 117.79 3dbl h ALA 431 Ca -0.13 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.61 3dbl h ALA 431 Cb 1.92 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.65 3dbl h ALA 431 CO 0.16 -0.19 0.01 0.28 0.00 0.00 0.00 179.25 179.51 3dbl h VAL 432 N -0.21 0.85 -0.93 0.00 2.07 -0.84 0.14 116.25 117.34 3dbl h VAL 432 Ca 0.02 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.57 3dbl h VAL 432 Cb 0.42 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 3dbl h VAL 432 CO 0.01 0.02 0.60 0.44 0.02 0.00 0.00 177.57 178.66 3dbl h ASP 433 N 0.08 0.94 -0.06 0.57 3.45 -1.23 0.82 116.42 120.99 3dbl h ASP 433 Ca 0.11 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.57 3dbl h ASP 433 Cb 0.13 -0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 38.70 3dbl h ASP 433 CO -0.17 0.60 0.02 -0.09 -1.57 0.00 0.00 179.24 178.03 3dbl h ARG 434 N 1.07 0.09 -0.63 3.56 2.43 -0.43 -1.92 114.38 118.55 3dbl h ARG 434 Ca 0.40 -0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.67 3dbl h ARG 434 Cb 0.19 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.63 3dbl h ARG 434 CO -0.15 0.26 0.15 0.35 -1.51 0.00 0.00 179.97 179.07 3dbl h PHE 435 N -0.09 0.25 -0.80 2.20 3.57 0.30 0.73 116.94 123.09 3dbl h PHE 435 Ca 0.02 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.57 3dbl h PHE 435 Cb 0.20 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 3dbl h PHE 435 CO -0.01 -0.02 0.53 1.25 -2.23 0.00 0.00 178.31 177.83 3dbl h HIS 436 N 0.29 0.99 -0.13 0.41 2.76 -0.52 0.80 115.15 119.75 3dbl h HIS 436 Ca 0.34 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.49 3dbl h HIS 436 Cb 0.51 -0.33 -0.00 0.00 1.55 0.00 0.00 27.41 29.13 3dbl h HIS 436 CO -0.24 0.61 -0.09 -0.22 -1.30 0.00 0.00 177.93 176.70 3dbl h LYS 437 N 1.06 0.29 0.00 5.26 1.63 -0.25 0.52 116.57 125.09 3dbl h LYS 437 Ca 0.30 -0.14 -0.01 0.00 -0.85 0.00 0.00 60.65 59.95 3dbl h LYS 437 Cb -0.08 -0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.54 3dbl h LYS 437 CO -0.07 0.65 -0.05 0.37 -3.45 0.00 0.00 179.45 176.90 3dbl h GLN 438 N -0.07 0.00 -0.00 1.90 4.15 -0.32 -3.34 115.11 117.43 3dbl h GLN 438 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 3dbl h GLN 438 Cb 0.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.27 3dbl h GLN 438 CO 0.02 0.05 -0.12 1.04 -1.93 0.00 0.00 178.83 177.90 3dbl n GLN 439 N -3.13 6.03 -0.78 1.69 1.13 0.27 -5.00 117.38 117.59 3dbl n GLN 439 Ca 0.02 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 3dbl n GLN 439 Cb 0.46 -0.63 0.00 0.00 0.11 0.00 0.00 30.24 30.18 3dbl n GLN 439 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dbl n GLY 440 N 1.04 1.14 3.44 1.08 0.00 0.17 -4.95 105.19 107.11 3dbl n GLY 440 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3dbl n GLY 440 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dbl s ARG 441 N -0.11 1.26 0.50 1.61 1.70 -1.24 -5.02 118.95 117.65 3dbl s ARG 441 Ca 0.00 -0.87 -0.10 0.00 -0.47 0.00 0.00 55.73 54.29 3dbl s ARG 441 Cb 0.00 0.48 -0.05 0.00 -0.57 0.00 0.00 34.95 34.81 3dbl s ARG 441 CO 0.00 -0.52 0.88 0.71 -1.08 0.00 0.00 175.30 175.29 3dbl s TYR 442 N -3.87 3.54 0.39 5.89 1.51 -1.26 -3.96 117.35 119.59 3dbl s TYR 442 Ca 0.09 1.11 -0.25 0.00 -1.01 0.00 0.00 57.07 57.01 3dbl s TYR 442 Cb 0.00 -2.53 -0.09 0.00 -0.11 0.00 0.00 41.96 39.24 3dbl s TYR 442 CO -0.05 -0.35 1.10 -1.25 -1.11 0.00 0.00 175.55 173.90 3dbl s PRO 443 N -4.49 4.14 -1.43 -1.71 0.04 -1.26 -3.97 135.00 126.32 3dbl s PRO 443 Ca 0.52 1.67 0.00 0.00 0.04 0.00 0.00 61.00 63.23 3dbl s PRO 443 Cb -0.10 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.79 3dbl s PRO 443 CO 0.41 -0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.66 3dbl n GLY 444 N 0.54 1.38 0.27 0.56 0.00 -1.26 -4.12 105.19 102.56 3dbl n GLY 444 Ca 0.04 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.93 3dbl n GLY 444 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3dbl h VAL 445 N 0.00 0.73 -3.89 1.61 2.07 -1.80 -3.37 116.25 111.60 3dbl h VAL 445 Ca -0.27 -0.32 -0.68 0.00 0.82 0.00 0.00 66.70 66.24 3dbl h VAL 445 Cb 0.98 1.19 -0.29 0.00 -1.52 0.00 0.00 31.29 31.65 3dbl h VAL 445 CO 0.40 0.08 -0.84 -0.44 0.02 0.00 0.00 177.57 176.79 3dbl s SER 446 N -6.45 3.41 0.40 0.57 0.01 -1.26 -4.97 113.70 105.41 3dbl s SER 446 Ca -0.04 -0.42 0.22 0.00 1.31 0.00 0.00 55.95 57.02 3dbl s SER 446 Cb 0.15 -0.98 1.23 0.00 0.21 0.00 0.00 66.02 66.62 3dbl s SER 446 CO 0.61 0.25 1.69 0.78 0.41 0.00 0.00 173.24 176.98 3dbl h ASN 447 N 6.04 0.38 1.00 2.44 -0.26 -2.00 0.28 115.58 123.47 3dbl h ASN 447 Ca -0.33 0.13 -0.00 0.00 -0.56 0.00 0.00 56.30 55.53 3dbl h ASN 447 Cb 1.18 0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 38.52 3dbl h ASN 447 CO 0.49 -0.07 -0.02 0.10 -1.06 0.00 0.00 177.43 176.88 3dbl h TYR 448 N 0.26 0.00 0.00 1.19 -0.00 -1.95 -3.04 116.97 113.43 3dbl h TYR 448 Ca 0.71 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.44 3dbl h TYR 448 Cb 1.96 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.69 3dbl h TYR 448 CO -0.01 0.02 -0.75 1.96 -0.00 0.00 0.00 178.16 179.39 3dbl h GLN 449 N 0.00 0.00 -0.67 0.10 4.20 -0.79 -3.39 115.11 114.55 3dbl h GLN 449 Ca -0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 3dbl h GLN 449 Cb 0.52 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 3dbl h GLN 449 CO 0.00 0.00 0.26 0.28 -0.67 0.00 0.00 178.83 178.70 3dbl h VAL 450 N 0.00 0.73 0.54 -0.54 2.07 -1.44 0.13 116.25 117.73 3dbl h VAL 450 Ca 0.00 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3dbl h VAL 450 Cb 0.98 0.26 0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3dbl h VAL 450 CO 0.00 0.08 -0.26 -0.08 0.02 0.00 0.00 177.57 177.33 3dbl h GLU 451 N 0.43 -0.69 -0.81 1.57 4.81 -1.79 -2.84 114.58 115.27 3dbl h GLU 451 Ca 0.35 0.05 0.15 0.00 -0.13 0.00 0.00 59.36 59.77 3dbl h GLU 451 Cb 0.47 0.16 -0.09 0.00 0.63 0.00 0.00 28.75 29.91 3dbl h GLU 451 CO -0.34 -0.46 0.39 1.49 -0.73 0.00 0.00 179.01 179.35 3dbl h GLU 452 N -0.81 0.53 0.00 1.92 4.81 -1.79 -2.56 114.58 116.67 3dbl h GLU 452 Ca -0.07 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.07 3dbl h GLU 452 Cb 0.55 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 3dbl h GLU 452 CO 0.12 0.35 -0.24 -0.44 -0.73 0.00 0.00 179.01 178.07 3dbl h ASP 453 N 0.55 0.00 -0.79 1.04 3.32 -0.77 -3.25 116.42 116.52 3dbl h ASP 453 Ca 0.45 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.59 3dbl h ASP 453 Cb 0.65 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.13 3dbl h ASP 453 CO -0.38 0.24 0.44 0.40 -1.72 0.00 0.00 179.24 178.22 3dbl h ILE 454 N 0.00 0.89 -0.49 0.35 2.04 -1.20 0.20 117.51 119.32 3dbl h ILE 454 Ca -0.00 -0.25 -0.13 0.00 1.00 0.00 0.00 64.86 65.47 3dbl h ILE 454 Cb 0.51 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3dbl h ILE 454 CO 0.03 0.14 -0.21 1.23 0.00 0.00 0.00 178.15 179.34 3dbl h GLY 455 N 0.74 1.09 1.03 5.37 0.00 -1.73 -2.61 103.07 106.96 3dbl h GLY 455 Ca 0.38 -0.96 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 3dbl h GLY 455 CO -0.25 0.87 0.37 0.50 0.00 0.00 0.00 176.54 178.03 3dbl h LYS 456 N 0.86 1.14 -0.33 4.80 1.57 -1.45 -2.08 116.57 121.08 3dbl h LYS 456 Ca 0.11 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 3dbl h LYS 456 Cb 0.79 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 3dbl h LYS 456 CO 0.07 0.89 0.05 1.25 -0.57 0.00 0.00 179.45 181.13 3dbl h LEU 457 N 1.11 0.52 -0.66 2.94 5.85 -0.96 -2.32 115.31 121.80 3dbl h LEU 457 Ca 0.27 -0.26 0.12 0.00 0.84 0.00 0.00 57.88 58.84 3dbl h LEU 457 Cb 0.13 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 40.94 3dbl h LEU 457 CO -0.03 0.65 0.22 0.50 -0.34 0.00 0.00 178.44 179.44 3dbl h LYS 458 N 0.37 0.36 -0.42 1.25 1.63 -1.17 0.59 116.57 119.19 3dbl h LYS 458 Ca 0.10 -0.02 0.02 0.00 -0.85 0.00 0.00 60.65 59.90 3dbl h LYS 458 Cb 0.36 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.87 3dbl h LYS 458 CO 0.01 0.24 0.23 0.77 -3.45 0.00 0.00 179.45 177.24 3dbl h SER 459 N 0.37 0.36 -0.66 4.20 0.02 -1.13 -0.74 113.55 115.97 3dbl h SER 459 Ca 0.35 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.28 3dbl h SER 459 Cb 0.49 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 3dbl h SER 459 CO -0.37 0.26 0.30 0.00 -1.14 0.00 0.00 176.83 175.88 3dbl h LEU 461 N 0.97 -0.45 -2.05 0.00 5.85 -0.08 0.72 115.31 120.27 3dbl h LEU 461 Ca 0.23 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.95 3dbl h LEU 461 Cb 0.14 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.28 3dbl h LEU 461 CO -0.03 -0.28 0.02 0.74 -0.34 0.00 0.00 178.44 178.56 3dbl h THR 462 N -0.58 0.94 0.15 1.05 2.02 -0.96 -1.28 112.91 114.25 3dbl h THR 462 Ca -0.05 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 3dbl h THR 462 Cb 0.43 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 3dbl h THR 462 CO 0.09 0.00 -0.07 1.23 0.37 0.00 0.00 175.52 177.14 3dbl h GLY 463 N 0.00 -0.21 0.95 2.16 0.00 -0.26 0.67 103.07 106.38 3dbl h GLY 463 Ca 0.01 0.08 0.08 0.00 0.00 0.00 0.00 47.33 47.50 3dbl h GLY 463 CO -0.00 -0.07 0.50 -2.75 0.00 0.00 0.00 176.54 174.21 3dbl h PHE 464 N -0.53 0.77 0.13 5.60 3.57 -0.35 0.17 116.94 126.30 3dbl h PHE 464 Ca -0.02 0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.21 3dbl h PHE 464 Cb 0.41 -0.25 0.02 0.00 2.79 0.00 0.00 35.95 38.92 3dbl h PHE 464 CO 0.03 0.38 -1.24 -0.07 -2.23 0.00 0.00 178.31 175.18 3dbl h LEU 465 N 0.74 0.68 0.53 0.59 3.38 -1.12 -3.17 115.31 116.94 3dbl h LEU 465 Ca 0.34 -0.66 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 3dbl h LEU 465 Cb 0.35 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.89 3dbl h LEU 465 CO -0.12 1.49 -0.26 -0.61 0.09 0.00 0.00 178.44 179.04 3dbl h GLN 466 N 0.18 -0.69 -0.96 1.13 4.15 -0.44 -0.29 115.11 118.19 3dbl h GLN 466 Ca -0.17 0.05 0.29 0.00 0.77 0.00 0.00 58.65 59.59 3dbl h GLN 466 Cb 1.93 0.16 -0.15 0.00 0.21 0.00 0.00 27.48 29.63 3dbl h GLN 466 CO 0.22 -0.39 0.44 1.49 -1.93 0.00 0.00 178.83 178.66 3dbl h GLU 467 N -0.89 0.26 -0.25 1.69 4.81 -1.08 0.15 114.58 119.26 3dbl h GLU 467 Ca -0.07 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3dbl h GLU 467 Cb 0.61 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3dbl h GLU 467 CO 0.12 0.17 0.00 0.66 -0.73 0.00 0.00 179.01 179.23 3dbl n TYR 468 N -5.13 0.31 -3.52 0.92 4.02 -1.16 -4.97 117.16 107.64 3dbl n TYR 468 Ca 0.28 -0.16 -0.21 0.00 -0.01 0.00 0.00 57.90 57.80 3dbl n TYR 468 Cb 0.88 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 40.28 3dbl n TYR 468 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dbl n GLY 469 N 1.36 -0.46 3.46 2.72 0.00 0.52 -4.99 105.19 107.80 3dbl n GLY 469 Ca 0.18 0.19 -0.37 0.00 0.00 0.00 0.00 46.02 46.02 3dbl n GLY 469 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dbl s LEU 470 N -6.89 3.55 -0.64 0.99 1.43 -0.23 -5.04 118.68 111.85 3dbl s LEU 470 Ca 0.35 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 53.12 3dbl s LEU 470 Cb -0.15 -1.95 0.17 0.00 0.03 0.00 0.00 46.19 44.28 3dbl s LEU 470 CO 0.72 -0.05 0.56 -0.55 0.23 0.00 0.00 176.35 177.26 3dbl s SER 471 N 1.63 6.16 0.10 2.29 0.15 -1.26 -4.64 113.70 118.13 3dbl s SER 471 Ca 0.06 -2.31 0.03 0.00 0.70 0.00 0.00 55.95 54.44 3dbl s SER 471 Cb -0.15 -2.11 -0.04 0.00 -1.71 0.00 0.00 66.02 62.00 3dbl s SER 471 CO 0.05 -0.65 -0.09 0.68 1.20 0.00 0.00 173.24 174.43 3dbl s VAL 472 N 0.77 0.91 -0.31 4.45 -7.23 -1.26 -5.04 120.40 112.68 3dbl s VAL 472 Ca 0.11 -1.71 -0.11 0.00 -1.81 0.00 0.00 61.98 58.47 3dbl s VAL 472 Cb -0.20 -1.43 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 3dbl s VAL 472 CO -0.03 -0.62 0.18 -0.32 -0.31 0.00 0.00 175.10 174.00 3dbl s MET 473 N -3.00 3.47 -0.32 4.82 1.75 -1.26 -5.06 119.30 119.71 3dbl s MET 473 Ca 0.07 -0.64 -0.02 0.00 -1.25 0.00 0.00 55.69 53.85 3dbl s MET 473 Cb -0.01 -3.63 0.06 0.00 2.84 0.00 0.00 34.83 34.08 3dbl s MET 473 CO -0.01 -0.38 0.04 0.08 -0.65 0.00 0.00 175.02 174.10 3dbl s VAL 474 N 1.66 3.13 0.07 10.11 1.01 -1.26 -4.89 120.40 130.23 3dbl s VAL 474 Ca 0.05 -1.43 -0.37 0.00 0.00 0.00 0.00 61.98 60.24 3dbl s VAL 474 Cb -0.17 -2.84 -0.18 0.00 0.00 0.00 0.00 36.38 33.20 3dbl s VAL 474 CO 0.08 -0.18 1.14 0.29 0.00 0.00 0.00 175.10 176.42 3dbl n LYS 475 N 4.64 0.58 0.22 2.72 5.02 -1.26 -4.73 118.16 125.36 3dbl n LYS 475 Ca -0.12 0.21 0.14 0.00 -2.02 0.00 0.00 58.31 56.52 3dbl n LYS 475 Cb 0.43 -1.72 0.73 0.00 -0.02 0.00 0.00 35.03 34.45 3dbl n LYS 475 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3dbl h ASP 476 N 3.44 0.00 0.23 4.39 5.19 -2.02 0.25 116.42 127.90 3dbl h ASP 476 Ca -0.47 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.92 3dbl h ASP 476 Cb 1.38 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.89 3dbl h ASP 476 CO 0.70 0.00 -0.10 0.44 -3.12 0.00 0.00 179.24 177.16 3dbl h ASP 477 N 0.00 0.00 1.45 6.45 5.19 -2.01 -1.63 116.42 125.86 3dbl h ASP 477 Ca 0.00 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 3dbl h ASP 477 Cb 0.15 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.65 3dbl h ASP 477 CO 0.00 0.10 -0.48 1.88 -3.12 0.00 0.00 179.24 177.62 3dbl h TYR 478 N 0.00 0.00 -0.20 4.55 -1.99 -1.27 -2.94 116.97 115.12 3dbl h TYR 478 Ca -0.00 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.53 3dbl h TYR 478 Cb 0.24 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.97 3dbl h TYR 478 CO 0.00 0.48 -0.66 0.28 -0.00 0.00 0.00 178.16 178.26 3dbl h VAL 479 N 0.00 1.29 0.75 -2.88 2.07 -1.43 -2.26 116.25 113.78 3dbl h VAL 479 Ca -0.00 -1.88 -0.04 0.00 0.82 0.00 0.00 66.70 65.60 3dbl h VAL 479 Cb 1.33 1.83 0.01 0.00 -1.52 0.00 0.00 31.29 32.94 3dbl h VAL 479 CO 0.06 0.60 -0.36 0.45 0.02 0.00 0.00 177.57 178.34 3dbl h HIS 480 N 0.56 -0.93 -0.91 1.57 3.86 -1.53 -2.71 115.15 115.06 3dbl h HIS 480 Ca -0.02 -0.02 0.23 0.00 -1.16 0.00 0.00 60.37 59.40 3dbl h HIS 480 Cb 1.27 0.31 -0.13 0.00 1.06 0.00 0.00 27.41 29.92 3dbl h HIS 480 CO 0.07 -0.56 0.42 1.49 0.86 0.00 0.00 177.93 180.21 3dbl h GLU 481 N -1.12 0.39 0.00 2.45 4.57 -1.56 0.41 114.58 119.72 3dbl h GLU 481 Ca -0.10 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 57.99 3dbl h GLU 481 Cb 0.79 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 3dbl h GLU 481 CO 0.17 0.26 -0.31 0.74 -1.18 0.00 0.00 179.01 178.68 3dbl h PHE 482 N 0.40 0.00 0.14 0.92 -1.00 -1.34 -1.83 116.94 114.22 3dbl h PHE 482 Ca 0.58 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 61.08 3dbl h PHE 482 Cb 1.13 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.70 3dbl h PHE 482 CO -0.12 0.31 -1.25 0.00 -1.61 0.00 0.00 178.31 175.64 3dbl h ARG 484 N 0.11 1.11 -0.95 0.00 2.43 -0.38 -2.27 114.38 114.42 3dbl h ARG 484 Ca -0.15 -0.07 0.20 0.00 -0.81 0.00 0.00 59.98 59.15 3dbl h ARG 484 Cb 1.96 -0.25 -0.08 0.00 -0.42 0.00 0.00 29.97 31.18 3dbl h ARG 484 CO 0.21 0.73 0.61 1.88 -1.51 0.00 0.00 179.97 181.90 3dbl h TYR 485 N 1.14 0.75 -3.21 2.20 0.99 -1.33 -3.46 116.97 114.05 3dbl h TYR 485 Ca 0.36 0.02 -0.39 0.00 2.00 0.00 0.00 58.73 60.73 3dbl h TYR 485 Cb 0.01 -0.23 0.00 0.00 1.00 0.00 0.00 36.73 37.51 3dbl h TYR 485 CO -0.01 0.19 -0.52 0.41 -0.00 0.00 0.00 178.16 178.22 3dbl n GLY 486 N -1.44 -0.44 2.36 3.88 0.00 -0.85 -1.27 105.19 107.41 3dbl n GLY 486 Ca 0.21 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.05 3dbl n GLY 486 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dbl n ALA 487 N -2.40 -0.58 -1.61 4.61 0.00 -1.26 -4.52 120.51 114.76 3dbl n ALA 487 Ca -0.20 0.16 -0.35 0.00 0.00 0.00 0.00 53.44 53.06 3dbl n ALA 487 Cb 0.66 -1.72 0.04 0.00 0.00 0.00 0.00 19.45 18.43 3dbl n ALA 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dbl s ALA 488 N -2.64 2.47 -0.61 0.00 0.00 -0.40 -4.71 121.76 115.87 3dbl s ALA 488 Ca 0.00 0.81 0.06 0.00 0.00 0.00 0.00 51.96 52.83 3dbl s ALA 488 Cb 0.00 -3.40 0.27 0.00 0.00 0.00 0.00 23.12 19.99 3dbl s ALA 488 CO 0.00 -1.26 0.79 -1.91 0.00 0.00 0.00 175.76 173.38 3dbl n GLU 489 N -1.99 2.61 -1.66 0.00 2.13 -1.26 -0.05 120.64 120.41 3dbl n GLU 489 Ca 0.12 -4.64 -0.47 0.00 0.66 0.00 0.00 57.16 52.83 3dbl n GLU 489 Cb 0.51 -2.20 -0.04 0.00 0.27 0.00 0.00 31.44 29.97 3dbl n GLU 489 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3dbl n PRO 490 N 0.60 2.04 -0.19 5.31 -0.04 -1.26 -4.84 135.00 136.61 3dbl n PRO 490 Ca 0.30 0.74 -0.04 0.00 -0.04 0.00 0.00 63.50 64.46 3dbl n PRO 490 Cb 0.41 -2.51 0.03 0.00 -0.04 0.00 0.00 33.50 31.39 3dbl n PRO 490 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3dbl h HIS 491 N 6.42 -0.70 -0.91 0.54 2.76 -1.97 -1.32 115.15 119.96 3dbl h HIS 491 Ca -0.46 0.06 0.09 0.00 -2.20 0.00 0.00 60.37 57.87 3dbl h HIS 491 Cb 1.27 0.39 -0.07 0.00 1.55 0.00 0.00 27.41 30.55 3dbl h HIS 491 CO 0.67 -0.34 0.59 1.79 -1.30 0.00 0.00 177.93 179.34 3dbl h THR 492 N -0.12 0.98 -0.16 6.26 1.35 -1.94 0.53 112.91 119.82 3dbl h THR 492 Ca 0.25 -0.32 -0.12 0.00 -0.55 0.00 0.00 66.41 65.67 3dbl h THR 492 Cb 0.52 -0.03 -0.01 0.00 -1.73 0.00 0.00 68.15 66.90 3dbl h THR 492 CO -0.65 0.17 -0.43 0.40 -0.25 0.00 0.00 175.52 174.76 3dbl h ILE 493 N 0.93 1.31 -0.25 6.82 5.03 -1.61 -2.17 117.51 127.58 3dbl h ILE 493 Ca 0.42 -1.59 -0.14 0.00 -0.12 0.00 0.00 64.86 63.42 3dbl h ILE 493 Cb 0.37 1.66 -0.01 0.00 -3.03 0.00 0.00 36.82 35.82 3dbl h ILE 493 CO -0.18 0.49 -0.42 0.00 -0.68 0.00 0.00 178.15 177.36 3dbl h ALA 494 N 1.23 0.79 -0.97 1.87 0.00 -0.46 -2.78 119.26 118.95 3dbl h ALA 494 Ca 0.02 -0.45 0.07 0.00 0.00 0.00 0.00 54.91 54.55 3dbl h ALA 494 Cb 0.89 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 3dbl h ALA 494 CO 0.07 0.66 0.62 0.00 0.00 0.00 0.00 179.25 180.60 3dbl h ALA 495 N 1.03 1.34 0.70 0.00 0.00 0.44 0.17 119.26 122.95 3dbl h ALA 495 Ca 0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3dbl h ALA 495 Cb 0.94 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.45 3dbl h ALA 495 CO 0.08 0.40 -0.34 0.35 0.00 0.00 0.00 179.25 179.74 3dbl h PHE 496 N 1.12 -0.90 -0.99 0.00 3.57 -1.14 -2.35 116.94 116.25 3dbl h PHE 496 Ca 0.42 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.99 3dbl h PHE 496 Cb 0.18 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 39.14 3dbl h PHE 496 CO -0.01 -0.55 0.64 -0.07 -2.23 0.00 0.00 178.31 176.09 3dbl h LEU 497 N -0.95 0.98 -0.20 0.59 4.07 -1.25 -1.37 115.31 117.18 3dbl h LEU 497 Ca -0.09 0.02 0.05 0.00 0.08 0.00 0.00 57.88 57.94 3dbl h LEU 497 Cb 0.73 -0.18 -0.07 0.00 1.08 0.00 0.00 40.66 42.22 3dbl h LEU 497 CO 0.15 0.59 -0.35 1.23 -1.08 0.00 0.00 178.44 178.98 3dbl h GLY 498 N 1.09 -0.45 0.91 0.83 0.00 -0.35 0.25 103.07 105.35 3dbl h GLY 498 Ca 0.45 0.43 -0.04 0.00 0.00 0.00 0.00 47.33 48.17 3dbl h GLY 498 CO -0.20 -0.22 -0.39 -1.33 0.00 0.00 0.00 176.54 174.40 3dbl h GLY 499 N -0.38 -1.13 0.21 4.60 0.00 -0.81 0.54 103.07 106.10 3dbl h GLY 499 Ca 0.11 0.42 0.08 0.00 0.00 0.00 0.00 47.33 47.94 3dbl h GLY 499 CO -0.41 -0.41 -0.11 0.00 0.00 0.00 0.00 176.54 175.60 3dbl h ALA 500 N -1.07 0.22 0.15 3.60 0.00 -1.17 -2.28 119.26 118.70 3dbl h ALA 500 Ca -0.11 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dbl h ALA 500 Cb 0.84 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3dbl h ALA 500 CO 0.18 -0.47 -0.07 0.00 0.00 0.00 0.00 179.25 178.89 3dbl h ALA 501 N 1.34 -0.20 -0.48 0.00 0.00 -0.52 -2.60 119.26 116.81 3dbl h ALA 501 Ca 0.18 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.11 3dbl h ALA 501 Cb 0.30 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 3dbl h ALA 501 CO -0.40 -0.57 -0.04 0.00 0.00 0.00 0.00 179.25 178.24 3dbl h ALA 502 N 0.55 0.40 -0.41 0.00 0.00 -0.68 -1.35 119.26 117.76 3dbl h ALA 502 Ca -0.02 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.11 3dbl h ALA 502 Cb 0.23 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3dbl h ALA 502 CO 0.03 -0.41 0.09 0.37 0.00 0.00 0.00 179.25 179.33 3dbl h GLN 503 N 0.07 0.22 -0.05 0.00 5.75 -1.30 0.14 115.11 119.93 3dbl h GLN 503 Ca 0.24 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.74 3dbl h GLN 503 Cb 0.36 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 3dbl h GLN 503 CO -0.43 0.14 0.09 0.93 -2.65 0.00 0.00 178.83 176.91 3dbl h GLU 504 N 0.22 0.00 -0.06 1.69 4.39 -0.87 0.23 114.58 120.19 3dbl h GLU 504 Ca 0.20 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.70 3dbl h GLU 504 Cb 0.24 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.90 3dbl h GLU 504 CO -0.25 0.00 -0.74 0.28 -1.16 0.00 0.00 179.01 177.13 3dbl h VAL 505 N 0.00 1.34 -0.42 3.13 2.07 -0.09 -2.53 116.25 119.75 3dbl h VAL 505 Ca 0.02 -2.04 -0.06 0.00 0.82 0.00 0.00 66.70 65.44 3dbl h VAL 505 Cb 0.20 2.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 3dbl h VAL 505 CO -0.00 0.62 0.01 0.40 0.02 0.00 0.00 177.57 178.62 3dbl h ILE 506 N 0.24 1.22 -0.29 4.57 2.04 -0.39 0.58 117.51 125.48 3dbl h ILE 506 Ca -0.08 -0.88 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3dbl h ILE 506 Cb 1.41 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 3dbl h ILE 506 CO 0.15 0.31 0.11 0.11 0.00 0.00 0.00 178.15 178.83 3dbl h LYS 507 N 0.63 0.43 0.01 2.37 1.57 -1.00 -1.36 116.57 119.22 3dbl h LYS 507 Ca 0.13 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3dbl h LYS 507 Cb 0.38 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 3dbl h LYS 507 CO 0.01 0.45 -0.02 0.82 -0.57 0.00 0.00 179.45 180.14 3dbl h ILE 508 N 0.31 0.94 0.27 1.86 2.04 -0.92 0.11 117.51 122.13 3dbl h ILE 508 Ca 0.10 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 3dbl h ILE 508 Cb 0.19 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3dbl h ILE 508 CO -0.01 0.00 -0.13 0.40 0.00 0.00 0.00 178.15 178.41 3dbl h ILE 509 N -0.04 0.76 0.00 -0.67 2.04 -0.80 -3.04 117.51 115.75 3dbl h ILE 509 Ca 0.01 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.73 3dbl h ILE 509 Cb 0.05 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3dbl h ILE 509 CO -0.02 0.03 0.00 0.35 0.00 0.00 0.00 178.15 178.51 3dbl n THR 510 N -5.21 0.24 -2.47 -0.27 -2.24 -0.52 -4.82 114.28 98.99 3dbl n THR 510 Ca -0.10 0.01 -0.16 0.00 -2.27 0.00 0.00 64.05 61.53 3dbl n THR 510 Cb 0.19 -0.60 -0.01 0.00 -2.10 0.00 0.00 70.33 67.81 3dbl n THR 510 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3dbl n LYS 511 N -1.62 -2.14 -0.09 -0.78 5.02 0.38 -4.91 118.16 114.03 3dbl n LYS 511 Ca 0.06 0.75 -0.10 0.00 -2.02 0.00 0.00 58.31 57.01 3dbl n LYS 511 Cb 0.32 -5.39 -0.03 0.00 -0.02 0.00 0.00 35.03 29.91 3dbl n LYS 511 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3dbl n GLN 512 N -2.94 0.51 0.00 1.97 6.02 -1.16 -4.50 117.38 117.29 3dbl n GLN 512 Ca -0.18 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 3dbl n GLN 512 Cb 0.64 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.38 3dbl n GLN 512 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3dbl n PHE 513 N -4.49 0.00 -3.89 1.08 3.01 -1.26 -3.31 117.46 108.60 3dbl n PHE 513 Ca -0.15 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 57.95 3dbl n PHE 513 Cb 0.48 0.00 -0.14 0.00 -0.01 0.00 0.00 39.48 39.81 3dbl n PHE 513 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3dbl s VAL 514 N 1.69 3.58 0.93 -4.37 1.01 -1.26 -4.85 120.40 117.12 3dbl s VAL 514 Ca 0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.44 3dbl s VAL 514 Cb 0.00 -2.64 0.15 0.00 0.00 0.00 0.00 36.38 33.89 3dbl s VAL 514 CO 0.00 0.41 1.09 0.27 0.00 0.00 0.00 175.10 176.87 3dbl s ILE 515 N 1.47 2.53 0.62 2.22 -4.36 -1.26 -5.03 121.20 117.39 3dbl s ILE 515 Ca 0.06 0.17 -0.11 0.00 -0.26 0.00 0.00 60.65 60.51 3dbl s ILE 515 Cb -0.14 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.95 3dbl s ILE 515 CO -0.02 -0.23 1.03 0.72 0.24 0.00 0.00 174.94 176.69 3dbl s PHE 516 N -2.87 3.62 -0.11 1.37 -0.12 -1.26 -5.05 117.98 113.56 3dbl s PHE 516 Ca 0.64 1.30 -0.03 0.00 -0.05 0.00 0.00 56.93 58.78 3dbl s PHE 516 Cb -0.19 -2.72 -0.01 0.00 -0.63 0.00 0.00 43.02 39.46 3dbl s PHE 516 CO 0.58 -0.70 -0.07 -0.97 -0.05 0.00 0.00 175.22 174.01 3dbl h ASN 517 N -0.31 0.00 0.00 1.98 -0.00 -1.95 -3.47 115.58 111.83 3dbl h ASN 517 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.86 3dbl h ASN 517 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.51 3dbl h ASN 517 CO 0.62 0.55 0.00 0.59 -0.00 0.00 0.00 177.43 179.19 3dbl n ASN 518 N -4.45 0.00 -4.68 1.15 5.03 -0.92 -4.73 115.26 106.67 3dbl n ASN 518 Ca -0.03 0.00 -0.34 0.00 0.87 0.00 0.00 54.58 55.08 3dbl n ASN 518 Cb 0.10 0.00 -0.09 0.00 -1.02 0.00 0.00 39.78 38.77 3dbl n ASN 518 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3dbl s THR 519 N -0.17 4.23 -0.24 3.41 2.01 -0.62 -2.76 115.64 121.51 3dbl s THR 519 Ca 0.00 -0.38 0.02 0.00 0.31 0.00 0.00 61.69 61.64 3dbl s THR 519 Cb 0.00 -2.81 0.05 0.00 0.01 0.00 0.00 72.50 69.75 3dbl s THR 519 CO 0.00 0.53 -0.09 -0.47 -0.69 0.00 0.00 174.62 173.89 3dbl s TYR 520 N -0.95 2.79 -0.17 4.92 5.04 0.15 -1.49 117.35 127.63 3dbl s TYR 520 Ca 0.15 -1.96 -0.01 0.00 -2.44 0.00 0.00 57.07 52.81 3dbl s TYR 520 Cb -0.11 -1.75 -0.01 0.00 0.35 0.00 0.00 41.96 40.44 3dbl s TYR 520 CO 0.05 -0.82 -0.11 0.42 -1.34 0.00 0.00 175.55 173.76 3dbl s ILE 521 N 1.27 3.01 -0.08 3.14 1.01 -0.61 -1.18 121.20 127.76 3dbl s ILE 521 Ca -0.06 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.96 3dbl s ILE 521 Cb -0.19 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 3dbl s ILE 521 CO -0.06 0.49 -0.08 -0.47 0.00 0.00 0.00 174.94 174.82 3dbl s TYR 522 N 0.97 2.91 -0.27 3.97 5.04 0.19 -1.74 117.35 128.43 3dbl s TYR 522 Ca -0.02 -0.06 0.02 0.00 -2.44 0.00 0.00 57.07 54.58 3dbl s TYR 522 Cb -0.15 -1.73 0.07 0.00 0.35 0.00 0.00 41.96 40.50 3dbl s TYR 522 CO -0.01 0.25 -0.06 0.45 -1.34 0.00 0.00 175.55 174.84 3dbl s SER 523 N -0.63 4.32 0.22 4.32 0.15 -0.09 -0.65 113.70 121.35 3dbl s SER 523 Ca 0.09 -1.48 0.24 0.00 0.70 0.00 0.00 55.95 55.51 3dbl s SER 523 Cb -0.11 -1.43 0.92 0.00 -1.71 0.00 0.00 66.02 63.68 3dbl s SER 523 CO 0.02 -0.24 1.73 0.61 1.20 0.00 0.00 173.24 176.55 3dbl n GLY 524 N 4.48 -1.40 0.26 9.45 0.00 0.20 0.48 105.19 118.65 3dbl n GLY 524 Ca -0.10 0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3dbl n GLY 524 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3dbl h MET 525 N 0.00 0.00 0.00 1.61 2.86 -1.92 -3.26 114.93 114.22 3dbl h MET 525 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3dbl h MET 525 Cb 0.48 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 3dbl h MET 525 CO 0.00 0.13 0.00 -1.13 1.06 0.00 0.00 176.91 176.97 3dbl n SER 526 N -3.76 0.09 -3.19 1.22 3.41 -1.08 -5.04 113.62 105.28 3dbl n SER 526 Ca -0.02 -0.68 -0.15 0.00 -0.26 0.00 0.00 58.87 57.77 3dbl n SER 526 Cb 0.24 0.05 0.08 0.00 -0.26 0.00 0.00 64.21 64.32 3dbl n SER 526 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dbl n GLN 527 N -0.05 -4.39 -4.03 4.33 1.13 0.18 -5.03 117.38 109.51 3dbl n GLN 527 Ca 0.00 0.79 -0.09 0.00 -1.94 0.00 0.00 57.00 55.77 3dbl n GLN 527 Cb 0.14 -5.57 -0.11 0.00 0.11 0.00 0.00 30.24 24.81 3dbl n GLN 527 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3dbl s THR 528 N -3.34 0.22 0.04 5.09 -4.23 -0.98 -5.00 115.64 107.44 3dbl s THR 528 Ca 0.18 -1.28 -0.08 0.00 -1.18 0.00 0.00 61.69 59.33 3dbl s THR 528 Cb -0.02 -0.79 -0.00 0.00 1.34 0.00 0.00 72.50 73.03 3dbl s THR 528 CO 0.68 -0.68 0.16 -0.94 -0.54 0.00 0.00 174.62 173.30 3dbl s SER 529 N -2.04 0.08 0.05 3.99 1.04 -1.26 -0.91 113.70 114.64 3dbl s SER 529 Ca -0.06 -0.41 -0.10 0.00 0.48 0.00 0.00 55.95 55.85 3dbl s SER 529 Cb -0.03 0.26 0.01 0.00 0.10 0.00 0.00 66.02 66.36 3dbl s SER 529 CO -0.04 -0.53 0.21 0.00 0.98 0.00 0.00 173.24 173.86 3dbl s ALA 530 N -2.51 -0.39 -0.26 5.32 0.00 -0.71 -5.01 121.76 118.20 3dbl s ALA 530 Ca -0.06 -0.29 0.03 0.00 0.00 0.00 0.00 51.96 51.64 3dbl s ALA 530 Cb -0.01 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.49 3dbl s ALA 530 CO -0.04 -0.39 -0.10 0.99 0.00 0.00 0.00 175.76 176.22 3dbl s THR 531 N -2.76 2.05 0.49 0.00 2.01 -1.26 -1.57 115.64 114.60 3dbl s THR 531 Ca -0.04 -1.58 0.09 0.00 0.31 0.00 0.00 61.69 60.47 3dbl s THR 531 Cb -0.00 -2.20 0.04 0.00 0.01 0.00 0.00 72.50 70.35 3dbl s THR 531 CO -0.05 -0.06 0.65 -0.36 -0.69 0.00 0.00 174.62 174.12 3dbl s PHE 532 N 1.15 2.20 -0.52 4.92 0.40 -0.55 -4.92 117.98 120.66 3dbl s PHE 532 Ca -0.08 -0.55 0.07 0.00 -0.60 0.00 0.00 56.93 55.78 3dbl s PHE 532 Cb -0.20 -2.29 0.31 0.00 0.51 0.00 0.00 43.02 41.35 3dbl s PHE 532 CO -0.05 -0.72 0.79 0.94 0.70 0.00 0.00 175.22 176.88 3dbl n GLN 533 N -2.00 2.19 0.00 0.44 7.27 -1.26 -1.58 117.38 122.43 3dbl n GLN 533 Ca 0.11 -4.24 0.05 0.00 0.07 0.00 0.00 57.00 52.99 3dbl n GLN 533 Cb 0.60 -1.97 0.30 0.00 2.41 0.00 0.00 30.24 31.58 3dbl n GLN 533 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41