#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uor s SER 5 N 0.00 4.38 -0.26 4.39 1.04 -1.26 -4.76 113.70 117.23 1uor s SER 5 Ca 0.00 -1.10 -0.15 0.00 0.48 0.00 0.00 55.95 55.18 1uor s SER 5 Cb 0.00 -0.48 -0.14 0.00 0.10 0.00 0.00 66.02 65.50 1uor s SER 5 CO 0.00 -0.53 -0.18 -0.62 0.98 0.00 0.00 173.24 172.90 1uor n GLU 6 N -1.21 0.59 0.05 4.02 -0.58 -1.26 -4.45 120.64 117.80 1uor n GLU 6 Ca -0.01 0.35 -0.09 0.00 -0.42 0.00 0.00 57.16 56.98 1uor n GLU 6 Cb 0.65 -1.57 -0.05 0.00 -0.57 0.00 0.00 31.44 29.89 1uor n GLU 6 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1uor h VAL 7 N -0.94 0.00 0.00 2.62 2.07 -1.87 0.62 116.25 118.76 1uor h VAL 7 Ca -0.60 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 1uor h VAL 7 Cb 1.55 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1uor h VAL 7 CO -0.34 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.03 1uor h ALA 8 N -0.97 1.19 -0.35 1.67 0.00 -1.87 -1.73 119.26 117.20 1uor h ALA 8 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1uor h ALA 8 Cb 0.40 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1uor h ALA 8 CO -0.17 0.28 -0.14 1.25 0.00 0.00 0.00 179.25 180.46 1uor h HIS 9 N 0.00 0.82 -0.80 0.00 6.17 -1.14 0.54 115.15 120.73 1uor h HIS 9 Ca -0.00 -0.19 -0.03 0.00 0.71 0.00 0.00 60.37 60.86 1uor h HIS 9 Cb 0.57 -0.19 -0.04 0.00 2.52 0.00 0.00 27.41 30.27 1uor h HIS 9 CO 0.00 0.90 0.39 0.00 0.71 0.00 0.00 177.93 179.93 1uor h ARG 10 N 0.50 1.14 -0.54 5.26 -0.00 -0.54 -1.08 114.38 119.11 1uor h ARG 10 Ca 0.08 -0.16 0.11 0.00 -0.50 0.00 0.00 59.98 59.51 1uor h ARG 10 Cb 0.67 -0.21 -0.03 0.00 0.00 0.00 0.00 29.97 30.40 1uor h ARG 10 CO 0.05 0.87 0.37 0.35 0.00 0.00 0.00 179.97 181.61 1uor h PHE 11 N 1.13 0.29 -0.17 3.04 3.04 -0.30 -1.80 116.94 122.18 1uor h PHE 11 Ca 0.28 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.23 1uor h PHE 11 Cb 0.11 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.52 1uor h PHE 11 CO 0.01 0.14 0.00 1.63 -2.02 0.00 0.00 178.31 178.07 1uor n LYS 12 N -4.45 1.46 0.07 1.11 5.02 0.17 -3.38 118.16 118.16 1uor n LYS 12 Ca 0.09 -0.65 0.00 0.00 -2.02 0.00 0.00 58.31 55.73 1uor n LYS 12 Cb 0.41 -1.19 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1uor n LYS 12 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1uor n ASP 13 N 0.03 0.42 -0.52 4.39 9.92 -0.69 -4.85 116.55 125.26 1uor n ASP 13 Ca 0.06 0.23 0.00 0.00 -0.53 0.00 0.00 54.79 54.55 1uor n ASP 13 Cb 0.18 -0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.66 1uor n ASP 13 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1uor n LEU 14 N -3.34 0.92 0.00 0.64 -0.00 -1.15 -4.95 117.00 109.12 1uor n LEU 14 Ca 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 56.01 55.55 1uor n LEU 14 Cb 0.06 -0.43 0.00 0.00 -0.00 0.00 0.00 43.42 43.05 1uor n LEU 14 CO 0.00 0.22 0.00 0.61 -0.00 0.00 0.00 177.39 178.22 1uor n GLY 15 N 0.09 1.66 0.66 1.47 0.00 -1.22 -3.99 105.19 103.85 1uor n GLY 15 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 1uor n GLY 15 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uor n GLU 16 N 8.20 0.10 0.14 1.61 2.13 -1.26 -3.95 120.64 127.60 1uor n GLU 16 Ca 0.00 0.04 -0.15 0.00 0.66 0.00 0.00 57.16 57.71 1uor n GLU 16 Cb 0.00 -0.77 -0.08 0.00 0.27 0.00 0.00 31.44 30.86 1uor n GLU 16 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1uor h GLU 17 N -0.12 -0.69 0.00 5.31 4.81 -1.99 0.64 114.58 122.54 1uor h GLU 17 Ca -0.11 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1uor h GLU 17 Cb 1.11 0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1uor h GLU 17 CO -0.06 -0.46 0.00 0.09 -0.73 0.00 0.00 179.01 177.85 1uor n ASN 18 N -5.48 0.00 -0.08 1.04 3.02 -1.26 0.17 115.26 112.66 1uor n ASN 18 Ca -0.08 0.07 -0.20 0.00 -0.03 0.00 0.00 54.58 54.34 1uor n ASN 18 Cb 0.40 -0.25 -0.12 0.00 -0.61 0.00 0.00 39.78 39.19 1uor n ASN 18 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1uor h PHE 19 N 0.00 0.04 -0.90 3.10 3.04 -0.07 -0.53 116.94 121.63 1uor h PHE 19 Ca 0.00 -0.03 0.16 0.00 3.98 0.00 0.00 57.97 62.08 1uor h PHE 19 Cb 0.10 -0.00 -0.07 0.00 2.56 0.00 0.00 35.95 38.53 1uor h PHE 19 CO 0.00 1.35 0.58 0.87 -2.02 0.00 0.00 178.31 179.09 1uor h LYS 20 N -0.93 0.59 -0.02 1.11 1.57 0.40 -1.00 116.57 118.30 1uor h LYS 20 Ca -0.24 -0.04 -0.21 0.00 -1.87 0.00 0.00 60.65 58.29 1uor h LYS 20 Cb 1.26 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 1uor h LYS 20 CO -0.12 0.39 -0.88 0.00 -0.57 0.00 0.00 179.45 178.27 1uor h ALA 21 N 1.61 0.44 0.22 3.86 0.00 0.17 -2.30 119.26 123.26 1uor h ALA 21 Ca 0.46 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1uor h ALA 21 Cb 0.86 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1uor h ALA 21 CO -0.21 0.81 -0.11 -0.07 0.00 0.00 0.00 179.25 179.68 1uor h LEU 22 N 0.23 -0.25 -2.18 0.00 -0.00 -0.65 -3.33 115.31 109.13 1uor h LEU 22 Ca -0.06 0.01 0.02 0.00 -0.00 0.00 0.00 57.88 57.84 1uor h LEU 22 Cb 1.50 0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 42.23 1uor h LEU 22 CO 0.15 0.13 0.28 0.58 -0.00 0.00 0.00 178.44 179.58 1uor h VAL 23 N -0.92 0.08 0.00 1.22 2.07 -0.99 0.76 116.25 118.47 1uor h VAL 23 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1uor h VAL 23 Cb 0.23 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1uor h VAL 23 CO 0.05 0.00 0.00 -0.11 0.02 0.00 0.00 177.57 177.53 1uor n LEU 24 N -3.08 0.33 -0.28 2.57 0.00 -0.88 -1.61 117.00 114.05 1uor n LEU 24 Ca -0.01 0.66 0.08 0.00 0.00 0.00 0.00 56.01 56.74 1uor n LEU 24 Cb 0.35 -0.37 0.21 0.00 0.00 0.00 0.00 43.42 43.61 1uor n LEU 24 CO 0.17 -0.37 0.85 0.16 0.00 0.00 0.00 177.39 178.20 1uor h ILE 25 N 0.00 0.28 -0.33 1.96 3.07 0.41 0.42 117.51 123.33 1uor h ILE 25 Ca 0.00 -0.04 0.03 0.00 1.55 0.00 0.00 64.86 66.40 1uor h ILE 25 Cb 0.00 0.15 -0.04 0.00 -0.27 0.00 0.00 36.82 36.66 1uor h ILE 25 CO 0.00 0.02 -0.23 0.00 -1.05 0.00 0.00 178.15 176.89 1uor h ALA 26 N 1.77 -0.31 0.00 0.16 0.00 -1.43 0.66 119.26 120.12 1uor h ALA 26 Ca 0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1uor h ALA 26 Cb 0.90 1.07 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1uor h ALA 26 CO -0.71 -0.46 0.00 1.19 0.00 0.00 0.00 179.25 179.28 1uor n PHE 27 N -3.86 0.04 -0.22 0.00 3.72 0.13 -2.54 117.46 114.73 1uor n PHE 27 Ca 0.00 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1uor n PHE 27 Cb 0.11 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.12 1uor n PHE 27 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1uor n ALA 28 N -1.52 1.84 -0.08 4.37 0.00 0.18 -3.40 120.51 121.90 1uor n ALA 28 Ca 0.02 -0.70 -0.15 0.00 0.00 0.00 0.00 53.44 52.60 1uor n ALA 28 Cb 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.43 1uor n ALA 28 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1uor h GLN 29 N 0.00 0.00 -0.18 0.00 4.20 0.06 -3.32 115.11 115.87 1uor h GLN 29 Ca 0.00 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 1uor h GLN 29 Cb 0.42 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1uor h GLN 29 CO 0.00 0.92 -0.11 0.66 -0.67 0.00 0.00 178.83 179.63 1uor n TYR 30 N -4.56 -0.08 0.00 2.96 4.01 -1.05 -3.05 117.16 115.38 1uor n TYR 30 Ca -0.16 0.23 0.09 0.00 -0.16 0.00 0.00 57.90 57.90 1uor n TYR 30 Cb 0.51 -0.50 -0.14 0.00 -0.31 0.00 0.00 39.34 38.90 1uor n TYR 30 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1uor n LEU 31 N -3.39 0.17 0.00 7.72 4.77 -1.22 -4.39 117.00 120.66 1uor n LEU 31 Ca 0.00 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1uor n LEU 31 Cb 0.05 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1uor n LEU 31 CO -0.03 0.02 0.00 0.00 -1.33 0.00 0.00 177.39 176.05 1uor n GLN 32 N -2.39 -1.67 0.00 3.23 10.64 -1.17 -3.97 117.38 122.05 1uor n GLN 32 Ca -0.06 0.07 0.00 0.00 -1.83 0.00 0.00 57.00 55.18 1uor n GLN 32 Cb 0.63 -2.69 0.00 0.00 -0.86 0.00 0.00 30.24 27.32 1uor n GLN 32 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 1uor n GLN 33 N 0.22 0.45 -1.64 2.61 6.02 -1.26 -4.87 117.38 118.92 1uor n GLN 33 Ca 0.00 0.00 -0.47 0.00 -0.01 0.00 0.00 57.00 56.52 1uor n GLN 33 Cb 0.07 -0.70 -0.04 0.00 1.02 0.00 0.00 30.24 30.59 1uor n GLN 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uor n PRO 35 N 2.55 -1.35 0.41 0.00 -0.02 -1.26 -4.84 135.00 130.50 1uor n PRO 35 Ca 0.15 -0.39 -0.16 0.00 -2.02 0.00 0.00 63.50 61.08 1uor n PRO 35 Cb 0.27 -1.45 -0.08 0.00 -0.02 0.00 0.00 33.50 32.22 1uor n PRO 35 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1uor h PHE 36 N -1.98 -0.99 -0.95 6.00 3.57 -1.99 -3.31 116.94 117.29 1uor h PHE 36 Ca -0.41 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.08 1uor h PHE 36 Cb 1.17 0.33 -0.05 0.00 2.79 0.00 0.00 35.95 40.19 1uor h PHE 36 CO -0.80 -0.62 0.63 0.93 -2.23 0.00 0.00 178.31 176.23 1uor h GLU 37 N -1.29 1.25 -0.71 1.11 3.07 -1.98 0.30 114.58 116.33 1uor h GLU 37 Ca -0.11 -0.08 0.11 0.00 -0.50 0.00 0.00 59.36 58.79 1uor h GLU 37 Cb 0.82 -0.28 -0.12 0.00 -0.84 0.00 0.00 28.75 28.33 1uor h GLU 37 CO 0.18 0.83 -0.39 -0.44 -1.40 0.00 0.00 179.01 177.79 1uor h ASP 38 N 1.29 -1.38 -0.49 1.42 5.19 -1.95 0.30 116.42 120.81 1uor h ASP 38 Ca 0.35 0.26 0.03 0.00 -0.62 0.00 0.00 57.03 57.05 1uor h ASP 38 Cb -0.14 0.67 -0.03 0.00 0.18 0.00 0.00 39.33 40.01 1uor h ASP 38 CO -0.08 -0.31 0.28 0.45 -3.12 0.00 0.00 179.24 176.47 1uor h HIS 39 N -0.13 0.52 -0.07 4.55 3.86 -0.53 -2.85 115.15 120.50 1uor h HIS 39 Ca 0.24 0.02 -0.24 0.00 -1.16 0.00 0.00 60.37 59.23 1uor h HIS 39 Cb 0.56 -0.16 0.01 0.00 1.06 0.00 0.00 27.41 28.88 1uor h HIS 39 CO -0.74 0.29 -0.90 0.28 0.86 0.00 0.00 177.93 177.72 1uor h VAL 40 N 0.56 1.30 -0.45 2.45 2.07 -0.47 -1.66 116.25 120.05 1uor h VAL 40 Ca 0.20 -2.16 0.09 0.00 0.82 0.00 0.00 66.70 65.65 1uor h VAL 40 Cb 0.04 2.21 -0.09 0.00 -1.52 0.00 0.00 31.29 31.92 1uor h VAL 40 CO -0.10 0.67 -0.18 0.50 0.02 0.00 0.00 177.57 178.48 1uor h LYS 41 N 0.42 -0.08 -0.28 1.57 3.64 -0.41 0.59 116.57 122.03 1uor h LYS 41 Ca -0.08 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1uor h LYS 41 Cb 1.54 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.36 1uor h LYS 41 CO 0.18 -0.05 0.12 -0.07 -2.27 0.00 0.00 179.45 177.36 1uor h LEU 42 N -0.08 0.33 0.54 5.20 3.38 -1.37 0.15 115.31 123.47 1uor h LEU 42 Ca 0.22 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 1uor h LEU 42 Cb 0.41 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1uor h LEU 42 CO -0.51 0.30 -0.26 0.58 0.09 0.00 0.00 178.44 178.64 1uor h VAL 43 N 0.38 0.19 -1.09 1.22 2.07 -0.06 -2.75 116.25 116.21 1uor h VAL 43 Ca 0.10 -0.45 0.40 0.00 0.82 0.00 0.00 66.70 67.56 1uor h VAL 43 Cb 0.06 0.28 -0.13 0.00 -1.52 0.00 0.00 31.29 29.98 1uor h VAL 43 CO -0.01 0.03 0.67 0.59 0.02 0.00 0.00 177.57 178.87 1uor n ASN 44 N -5.28 0.22 -0.07 0.57 4.13 0.19 -0.30 115.26 114.72 1uor n ASN 44 Ca -0.10 1.27 -0.13 0.00 1.68 0.00 0.00 54.58 57.29 1uor n ASN 44 Cb 0.32 -0.62 -0.12 0.00 -1.54 0.00 0.00 39.78 37.81 1uor n ASN 44 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1uor h GLU 45 N 0.00 -0.00 -0.42 3.52 5.08 -1.18 -1.73 114.58 119.86 1uor h GLU 45 Ca 0.75 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 59.16 1uor h GLU 45 Cb 2.30 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 31.47 1uor h GLU 45 CO -0.48 0.95 -0.53 0.28 -1.00 0.00 0.00 179.01 178.22 1uor h VAL 46 N -1.00 0.00 -0.99 3.13 2.07 -0.35 -0.92 116.25 118.19 1uor h VAL 46 Ca -0.00 0.00 0.33 0.00 0.82 0.00 0.00 66.70 67.85 1uor h VAL 46 Cb 0.95 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.54 1uor h VAL 46 CO 0.00 0.00 0.26 0.74 0.02 0.00 0.00 177.57 178.59 1uor h THR 47 N -0.36 0.04 0.00 2.57 2.02 -1.10 -2.94 112.91 113.14 1uor h THR 47 Ca 0.07 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.24 1uor h THR 47 Cb 0.56 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1uor h THR 47 CO -0.58 0.01 0.00 -0.62 0.37 0.00 0.00 175.52 174.69 1uor n GLU 48 N -5.37 0.00 0.00 6.66 1.02 -0.35 -3.71 120.64 118.89 1uor n GLU 48 Ca 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1uor n GLU 48 Cb 0.97 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.39 1uor n GLU 48 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1uor n PHE 49 N 0.00 0.00 -0.21 -0.32 -0.00 -1.21 0.16 117.46 115.89 1uor n PHE 49 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1uor n PHE 49 Cb 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 39.48 39.55 1uor n PHE 49 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1uor h ALA 50 N 0.00 0.46 -0.43 3.13 0.00 -1.59 0.25 119.26 121.08 1uor h ALA 50 Ca 0.00 0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.19 1uor h ALA 50 Cb 0.00 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1uor h ALA 50 CO 0.00 -0.42 0.29 0.87 0.00 0.00 0.00 179.25 179.99 1uor h LYS 51 N 0.02 0.36 0.00 0.00 1.57 0.15 0.21 116.57 118.89 1uor h LYS 51 Ca 0.31 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.04 1uor h LYS 51 Cb 0.48 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 1uor h LYS 51 CO -0.62 0.24 -0.41 0.00 -0.57 0.00 0.00 179.45 178.08 1uor h THR 52 N 0.38 0.20 0.00 -0.16 1.03 -1.08 0.02 112.91 113.28 1uor h THR 52 Ca 0.18 -1.30 0.00 0.00 -0.01 0.00 0.00 66.41 65.29 1uor h THR 52 Cb 0.25 1.97 0.00 0.00 -1.07 0.00 0.00 68.15 69.31 1uor h THR 52 CO -0.04 0.11 -0.55 0.00 -0.01 0.00 0.00 175.52 175.03 1uor h VAL 54 N 0.00 0.64 -0.75 0.00 2.07 -0.32 -1.37 116.25 116.52 1uor h VAL 54 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1uor h VAL 54 Cb 0.93 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 1uor h VAL 54 CO 0.00 0.00 0.40 0.00 0.02 0.00 0.00 177.57 177.99 1uor h ALA 55 N 0.75 1.04 -0.99 1.67 0.00 -0.97 -3.41 119.26 117.35 1uor h ALA 55 Ca 0.06 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1uor h ALA 55 Cb 0.30 -0.08 -0.21 0.00 0.00 0.00 0.00 17.79 17.80 1uor h ALA 55 CO -0.16 0.01 -0.35 0.34 0.00 0.00 0.00 179.25 179.09 1uor s ASP 56 N -5.55 -1.58 0.12 0.00 2.15 -1.02 -5.01 116.67 105.78 1uor s ASP 56 Ca -0.13 0.31 -0.23 0.00 0.43 0.00 0.00 52.55 52.93 1uor s ASP 56 Cb 0.18 2.05 -0.05 0.00 -0.30 0.00 0.00 42.92 44.80 1uor s ASP 56 CO 0.77 -0.29 1.28 -0.62 -0.17 0.00 0.00 175.17 176.14 1uor n GLU 57 N 5.42 -0.32 0.00 4.34 -0.58 -0.54 -3.04 120.64 125.91 1uor n GLU 57 Ca 0.04 1.26 0.00 0.00 -0.42 0.00 0.00 57.16 58.04 1uor n GLU 57 Cb 0.54 -1.85 0.00 0.00 -0.57 0.00 0.00 31.44 29.55 1uor n GLU 57 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1uor n SER 58 N -4.73 0.00 -4.76 1.62 7.64 -1.26 -4.65 113.62 107.47 1uor n SER 58 Ca 0.01 0.36 -0.38 0.00 1.01 0.00 0.00 58.87 59.88 1uor n SER 58 Cb 0.19 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1uor n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uor s ALA 59 N -2.71 2.99 0.16 -0.43 0.00 -1.17 -4.89 121.76 115.72 1uor s ALA 59 Ca 0.00 1.09 -0.31 0.00 0.00 0.00 0.00 51.96 52.74 1uor s ALA 59 Cb 0.00 -3.45 -0.17 0.00 0.00 0.00 0.00 23.12 19.50 1uor s ALA 59 CO 0.00 -0.87 0.77 -1.91 0.00 0.00 0.00 175.76 173.75 1uor n GLU 60 N -0.49 0.28 -0.66 0.00 2.13 -1.26 -2.39 120.64 118.26 1uor n GLU 60 Ca 0.07 0.10 0.00 0.00 0.66 0.00 0.00 57.16 57.99 1uor n GLU 60 Cb 0.46 -1.31 0.00 0.00 0.27 0.00 0.00 31.44 30.86 1uor n GLU 60 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1uor n ASN 61 N 1.81 -1.28 -0.34 4.31 6.94 -1.26 -4.76 115.26 120.68 1uor n ASN 61 Ca 0.17 0.00 0.22 0.00 -0.02 0.00 0.00 54.58 54.95 1uor n ASN 61 Cb 0.22 -2.42 0.46 0.00 -2.36 0.00 0.00 39.78 35.68 1uor n ASN 61 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1uor n ASP 63 N -4.82 0.00 -4.72 0.00 9.92 -1.26 -4.61 116.55 111.06 1uor n ASP 63 Ca 0.28 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.12 1uor n ASP 63 Cb 0.88 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 41.35 1uor n ASP 63 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1uor n LYS 64 N -0.75 2.29 -2.64 -1.24 4.01 -0.81 -4.95 118.16 114.07 1uor n LYS 64 Ca 0.00 0.81 -0.42 0.00 -0.51 0.00 0.00 58.31 58.18 1uor n LYS 64 Cb 0.00 -2.44 -0.02 0.00 -0.51 0.00 0.00 35.03 32.06 1uor n LYS 64 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 1uor s SER 65 N -0.17 6.67 0.00 4.39 0.01 -1.26 -4.49 113.70 118.85 1uor s SER 65 Ca 0.56 -1.96 0.00 0.00 1.31 0.00 0.00 55.95 55.87 1uor s SER 65 Cb -0.55 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.14 1uor s SER 65 CO 0.61 -1.29 0.00 -0.11 0.41 0.00 0.00 173.24 172.86 1uor n LEU 66 N 8.23 0.00 -0.34 2.44 -0.00 -1.26 0.05 117.00 126.11 1uor n LEU 66 Ca 0.37 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.40 1uor n LEU 66 Cb 0.49 0.00 0.07 0.00 -0.00 0.00 0.00 43.42 43.97 1uor n LEU 66 CO 0.68 0.00 0.55 1.41 -0.00 0.00 0.00 177.39 180.03 1uor n HIS 67 N 0.00 0.12 -0.39 1.96 8.25 -1.26 0.68 115.22 124.58 1uor n HIS 67 Ca 0.00 1.12 0.36 0.00 -0.26 0.00 0.00 57.72 58.94 1uor n HIS 67 Cb 0.00 -0.90 0.71 0.00 1.12 0.00 0.00 29.99 30.92 1uor n HIS 67 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1uor h THR 68 N 0.00 0.34 0.00 1.59 2.02 -0.76 0.49 112.91 116.59 1uor h THR 68 Ca 0.36 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.51 1uor h THR 68 Cb 0.58 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1uor h THR 68 CO -0.91 0.01 0.00 -0.11 0.37 0.00 0.00 175.52 174.88 1uor n LEU 69 N -4.28 0.63 -0.14 2.58 -0.00 0.21 -1.94 117.00 114.06 1uor n LEU 69 Ca 0.30 0.38 -0.00 0.00 -0.00 0.00 0.00 56.01 56.68 1uor n LEU 69 Cb 1.32 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.75 1uor n LEU 69 CO 0.36 0.00 0.22 0.49 -0.00 0.00 0.00 177.39 178.46 1uor n PHE 70 N -0.48 0.01 -0.35 1.96 3.01 0.41 0.28 117.46 122.29 1uor n PHE 70 Ca 0.00 0.46 0.02 0.00 1.01 0.00 0.00 57.45 58.94 1uor n PHE 70 Cb 0.00 -0.64 0.16 0.00 -0.01 0.00 0.00 39.48 39.00 1uor n PHE 70 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1uor h GLY 71 N 0.00 1.45 -1.89 1.37 0.00 -0.22 0.29 103.07 104.07 1uor h GLY 71 Ca 0.13 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1uor h GLY 71 CO -0.37 0.31 0.00 1.22 0.00 0.00 0.00 176.54 177.70 1uor n ASP 72 N -4.55 2.94 -3.11 0.19 8.00 0.78 -3.82 116.55 116.98 1uor n ASP 72 Ca 0.14 -1.92 -0.21 0.00 0.71 0.00 0.00 54.79 53.52 1uor n ASP 72 Cb 0.18 -0.22 -0.05 0.00 -0.02 0.00 0.00 41.12 41.02 1uor n ASP 72 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1uor n LYS 73 N 1.15 0.74 0.08 -1.24 4.76 0.10 -4.81 118.16 118.95 1uor n LYS 73 Ca 0.18 -2.96 0.00 0.00 -2.87 0.00 0.00 58.31 52.66 1uor n LYS 73 Cb 0.52 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 1uor n LYS 73 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1uor n LEU 74 N 1.37 -1.49 -0.10 -0.35 0.00 -1.05 -4.60 117.00 110.78 1uor n LEU 74 Ca 0.19 0.57 0.23 0.00 0.00 0.00 0.00 56.01 57.00 1uor n LEU 74 Cb 0.56 1.66 0.68 0.00 0.00 0.00 0.00 43.42 46.32 1uor n LEU 74 CO 0.16 0.08 1.22 0.00 0.00 0.00 0.00 177.39 178.85 1uor n THR 76 N -4.35 0.00 1.02 0.00 -1.04 -1.26 -2.81 114.28 105.84 1uor n THR 76 Ca 0.14 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.26 1uor n THR 76 Cb 0.75 -0.75 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 1uor n THR 76 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1uor n VAL 77 N 0.00 0.00 0.42 12.58 3.14 -1.26 -2.07 118.33 131.15 1uor n VAL 77 Ca 0.00 -0.05 -0.18 0.00 -2.96 0.00 0.00 64.34 61.15 1uor n VAL 77 Cb 0.00 0.81 -0.09 0.00 -1.06 0.00 0.00 33.84 33.50 1uor n VAL 77 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1uor h ALA 78 N 3.20 -1.07 0.11 1.55 0.00 -1.77 -3.34 119.26 117.93 1uor h ALA 78 Ca 0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1uor h ALA 78 Cb 0.54 0.41 0.02 0.00 0.00 0.00 0.00 17.79 18.76 1uor h ALA 78 CO 0.00 -1.06 -0.72 1.15 0.00 0.00 0.00 179.25 178.62 1uor h THR 79 N -1.15 1.52 0.00 0.00 2.02 -1.38 -2.68 112.91 111.25 1uor h THR 79 Ca -0.11 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.63 1uor h THR 79 Cb 0.83 3.12 0.00 0.00 -1.74 0.00 0.00 68.15 70.36 1uor h THR 79 CO 0.18 0.69 0.00 0.17 0.37 0.00 0.00 175.52 176.93 1uor h LEU 80 N -0.38 0.00 -0.47 2.58 -0.00 -1.45 1.03 115.31 116.62 1uor h LEU 80 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.76 1uor h LEU 80 Cb 1.54 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.20 1uor h LEU 80 CO 0.14 0.00 0.00 -0.09 -0.00 0.00 0.00 178.44 178.49 1uor h ARG 81 N 0.00 0.00 -3.26 0.17 2.43 -1.66 -3.38 114.38 108.68 1uor h ARG 81 Ca 0.00 0.00 -0.75 0.00 -0.81 0.00 0.00 59.98 58.42 1uor h ARG 81 Cb 0.60 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 29.83 1uor h ARG 81 CO 0.00 0.00 0.21 -0.85 -1.51 0.00 0.00 179.97 177.82 1uor n GLU 82 N -2.64 3.25 -3.94 0.20 -0.00 0.36 -5.02 120.64 112.84 1uor n GLU 82 Ca 0.03 -4.50 -0.30 0.00 -0.00 0.00 0.00 57.16 52.39 1uor n GLU 82 Cb 0.38 -2.47 -0.14 0.00 -0.00 0.00 0.00 31.44 29.22 1uor n GLU 82 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 1uor s THR 83 N -1.66 2.46 0.00 3.84 -4.23 -1.22 -4.80 115.64 110.03 1uor s THR 83 Ca 0.30 -3.14 0.00 0.00 -1.18 0.00 0.00 61.69 57.67 1uor s THR 83 Cb -0.05 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.07 1uor s THR 83 CO -0.07 -0.78 0.00 0.00 -0.54 0.00 0.00 174.62 173.24 1uor n TYR 84 N 3.29 -0.19 0.00 3.99 4.19 -1.26 -5.12 117.16 122.06 1uor n TYR 84 Ca 0.05 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.26 1uor n TYR 84 Cb 0.34 0.26 0.00 0.00 0.49 0.00 0.00 39.34 40.42 1uor n TYR 84 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1uor n GLY 85 N 1.06 -0.02 1.40 2.98 0.00 -1.26 -5.08 105.19 104.26 1uor n GLY 85 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1uor n GLY 85 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1uor n GLU 86 N 0.00 0.00 -2.42 1.61 4.07 -1.26 -4.98 120.64 117.66 1uor n GLU 86 Ca 0.00 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 56.72 1uor n GLU 86 Cb 0.00 -0.05 -0.02 0.00 -0.06 0.00 0.00 31.44 31.30 1uor n GLU 86 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 1uor s MET 87 N -1.70 3.46 -1.05 5.31 -1.94 -1.26 -4.87 119.30 117.25 1uor s MET 87 Ca 0.00 -1.51 -0.23 0.00 -1.71 0.00 0.00 55.69 52.24 1uor s MET 87 Cb 0.00 -5.40 -0.13 0.00 2.01 0.00 0.00 34.83 31.31 1uor s MET 87 CO 0.00 -2.73 1.94 0.00 -0.01 0.00 0.00 175.02 174.22 1uor n ALA 88 N 10.29 1.88 0.00 3.03 0.00 -1.26 -4.86 120.51 129.59 1uor n ALA 88 Ca 0.44 -2.98 0.00 0.00 0.00 0.00 0.00 53.44 50.91 1uor n ALA 88 Cb 0.47 -3.51 0.00 0.00 0.00 0.00 0.00 19.45 16.42 1uor n ALA 88 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uor n ASP 89 N 13.52 0.00 -2.77 0.00 2.03 -1.26 -4.99 116.55 123.08 1uor n ASP 89 Ca 0.45 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.75 1uor n ASP 89 Cb 0.45 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.92 1uor n ASP 89 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1uor n ALA 92 N 0.21 0.00 -1.29 0.00 0.00 -1.26 -3.06 120.51 115.11 1uor n ALA 92 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 1uor n ALA 92 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.86 1uor n ALA 92 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uor n LYS 93 N 0.00 3.15 -1.89 0.00 4.76 -1.26 -4.89 118.16 118.03 1uor n LYS 93 Ca 0.00 -1.94 0.00 0.00 -2.87 0.00 0.00 58.31 53.50 1uor n LYS 93 Cb 0.00 -2.48 0.00 0.00 -1.84 0.00 0.00 35.03 30.71 1uor n LYS 93 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1uor n GLN 94 N 2.86 -0.35 -3.65 1.97 7.27 -1.17 -4.92 117.38 119.39 1uor n GLN 94 Ca 0.63 0.52 -0.11 0.00 0.07 0.00 0.00 57.00 58.11 1uor n GLN 94 Cb 0.48 -0.51 -0.08 0.00 2.41 0.00 0.00 30.24 32.54 1uor n GLN 94 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 1uor s GLU 95 N -0.36 0.70 0.00 3.69 -1.05 -1.26 -5.01 118.70 115.42 1uor s GLU 95 Ca 0.00 1.01 0.00 0.00 -0.15 0.00 0.00 54.97 55.83 1uor s GLU 95 Cb 0.00 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 1uor s GLU 95 CO 0.00 -0.12 0.00 -2.30 0.95 0.00 0.00 175.26 173.79 1uor n PRO 96 N 3.48 0.00 0.00 -4.83 -0.02 -1.26 -0.21 135.00 132.17 1uor n PRO 96 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1uor n PRO 96 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 1uor n PRO 96 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1uor n GLU 97 N 0.00 0.23 -0.09 -0.52 2.13 -1.26 -1.99 120.64 119.14 1uor n GLU 97 Ca 0.00 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.71 1uor n GLU 97 Cb 0.00 -1.32 -0.04 0.00 0.27 0.00 0.00 31.44 30.35 1uor n GLU 97 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1uor n ARG 98 N 0.77 0.50 -0.26 5.31 1.85 0.71 -4.12 116.66 121.42 1uor n ARG 98 Ca 0.00 0.45 0.06 0.00 -1.00 0.00 0.00 57.85 57.36 1uor n ARG 98 Cb 0.10 -1.63 0.20 0.00 -1.05 0.00 0.00 32.46 30.07 1uor n ARG 98 CO 0.00 0.00 0.00 -0.97 -0.01 0.00 0.00 177.63 176.65 1uor h ASN 99 N -1.00 0.09 0.00 2.89 -0.00 -1.57 -1.40 115.58 114.60 1uor h ASN 99 Ca -0.12 0.14 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 1uor h ASN 99 Cb 0.84 0.17 0.00 0.00 -0.00 0.00 0.00 38.32 39.33 1uor h ASN 99 CO -0.07 -0.01 0.00 -0.62 -0.00 0.00 0.00 177.43 176.73 1uor n GLU 100 N -5.12 0.00 -0.34 6.67 4.71 -1.26 0.29 120.64 125.60 1uor n GLU 100 Ca 0.15 0.15 0.17 0.00 -0.01 0.00 0.00 57.16 57.62 1uor n GLU 100 Cb 0.47 -1.05 0.37 0.00 -1.01 0.00 0.00 31.44 30.22 1uor n GLU 100 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uor n PHE 102 N -4.93 0.00 0.02 0.00 3.72 -1.25 -4.73 117.46 110.29 1uor n PHE 102 Ca 0.26 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.63 1uor n PHE 102 Cb 0.74 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.49 1uor n PHE 102 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1uor h LEU 103 N 0.00 0.47 -3.36 4.37 3.38 -1.44 -1.54 115.31 117.19 1uor h LEU 103 Ca 0.00 -0.16 -0.24 0.00 0.09 0.00 0.00 57.88 57.57 1uor h LEU 103 Cb 0.25 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 40.73 1uor h LEU 103 CO 0.00 0.72 0.30 1.67 0.09 0.00 0.00 178.44 181.23 1uor n GLN 104 N -4.12 2.90 -2.91 1.13 0.00 0.84 -4.33 117.38 110.89 1uor n GLN 104 Ca -0.00 -2.45 -0.22 0.00 -0.00 0.00 0.00 57.00 54.33 1uor n GLN 104 Cb 0.41 -2.01 -0.02 0.00 0.00 0.00 0.00 30.24 28.61 1uor n GLN 104 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1uor n HIS 105 N -0.25 2.28 0.00 3.69 8.25 -0.58 -4.86 115.22 123.75 1uor n HIS 105 Ca 0.37 -3.64 0.00 0.00 -0.26 0.00 0.00 57.72 54.19 1uor n HIS 105 Cb 1.26 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.98 1uor n HIS 105 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1uor n LYS 106 N -0.08 0.00 -1.38 -0.41 5.02 -1.26 -4.95 118.16 115.09 1uor n LYS 106 Ca 0.27 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.18 1uor n LYS 106 Cb 0.58 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.62 1uor n LYS 106 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1uor n ASP 107 N 0.00 -1.93 0.00 4.39 -0.08 -1.26 -5.05 116.55 112.62 1uor n ASP 107 Ca 0.00 0.70 0.00 0.00 -1.51 0.00 0.00 54.79 53.98 1uor n ASP 107 Cb 0.00 -1.07 0.00 0.00 2.34 0.00 0.00 41.12 42.39 1uor n ASP 107 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1uor n ASP 108 N 1.12 0.00 0.00 1.67 -0.08 -1.26 -4.70 116.55 113.30 1uor n ASP 108 Ca 0.10 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.38 1uor n ASP 108 Cb 0.48 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.94 1uor n ASP 108 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1uor n ASN 109 N 0.00 0.00 -0.45 1.67 4.05 -1.26 -2.93 115.26 116.34 1uor n ASN 109 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1uor n ASN 109 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1uor n ASN 109 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1uor n PRO 110 N 0.00 0.00 0.00 1.20 -0.02 -1.26 -3.56 135.00 131.35 1uor n PRO 110 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1uor n PRO 110 Cb 0.00 -0.12 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 1uor n PRO 110 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1uor n ASN 111 N 0.37 -0.10 0.00 2.55 2.04 -1.15 -5.06 115.26 113.91 1uor n ASN 111 Ca 0.00 -0.12 0.00 0.00 -0.44 0.00 0.00 54.58 54.02 1uor n ASN 111 Cb 0.02 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.27 1uor n ASN 111 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 1uor n LEU 112 N 0.00 0.00 -4.74 -4.53 4.77 -1.26 -4.92 117.00 106.32 1uor n LEU 112 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.64 1uor n LEU 112 Cb 0.00 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1uor n LEU 112 CO 0.00 0.00 0.79 -2.16 -1.33 0.00 0.00 177.39 174.69 1uor s PRO 113 N 3.17 2.42 0.00 3.23 0.05 -1.26 -4.83 135.00 137.78 1uor s PRO 113 Ca 0.00 1.69 0.00 0.00 0.05 0.00 0.00 61.00 62.74 1uor s PRO 113 Cb 0.00 -1.87 0.00 0.00 0.05 0.00 0.00 34.50 32.68 1uor s PRO 113 CO 0.00 -1.60 0.00 0.54 0.05 0.00 0.00 177.00 175.99 1uor n ARG 114 N -2.46 0.00 -0.35 4.56 1.74 -1.26 -4.98 116.66 113.91 1uor n ARG 114 Ca 0.13 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.23 1uor n ARG 114 Cb 0.50 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.03 1uor n ARG 114 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1uor h LEU 115 N 0.00 -1.13 0.00 0.55 6.46 -2.01 -3.42 115.31 115.75 1uor h LEU 115 Ca 0.00 0.29 -0.06 0.00 -0.12 0.00 0.00 57.88 58.00 1uor h LEU 115 Cb 0.00 0.66 0.03 0.00 -0.73 0.00 0.00 40.66 40.62 1uor h LEU 115 CO 0.00 -0.30 -0.03 1.33 -0.62 0.00 0.00 178.44 178.82 1uor n VAL 116 N -5.54 0.00 -3.41 1.05 0.24 -1.26 -5.07 118.33 104.34 1uor n VAL 116 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 1uor n VAL 116 Cb 0.44 -0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.66 1uor n VAL 116 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1uor n ARG 117 N -0.45 -0.53 -0.61 7.34 0.63 -1.26 -5.13 116.66 116.65 1uor n ARG 117 Ca 0.02 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.67 1uor n ARG 117 Cb 0.09 0.00 0.26 0.00 0.45 0.00 0.00 32.46 33.26 1uor n ARG 117 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1uor n PRO 118 N 0.00 -3.85 -0.42 -0.14 -0.04 -1.26 -5.13 135.00 124.16 1uor n PRO 118 Ca 0.00 -1.51 0.00 0.00 -0.04 0.00 0.00 63.50 61.95 1uor n PRO 118 Cb 0.00 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 1uor n PRO 118 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uor n GLU 119 N -5.10 0.00 -0.11 0.54 -0.58 -1.26 -5.09 120.64 109.05 1uor n GLU 119 Ca 0.14 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.85 1uor n GLU 119 Cb 0.56 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.40 1uor n GLU 119 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1uor n VAL 120 N 0.00 -0.17 -0.01 2.62 0.24 -1.26 -2.74 118.33 117.00 1uor n VAL 120 Ca 0.00 1.38 -0.01 0.00 -2.04 0.00 0.00 64.34 63.68 1uor n VAL 120 Cb 0.00 -1.78 -0.03 0.00 -1.47 0.00 0.00 33.84 30.56 1uor n VAL 120 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1uor n ASP 121 N -3.49 4.10 0.14 -1.34 5.68 -1.26 -4.83 116.55 115.56 1uor n ASP 121 Ca 0.01 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.41 1uor n ASP 121 Cb 0.07 0.79 0.06 0.00 -1.14 0.00 0.00 41.12 40.90 1uor n ASP 121 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 1uor h VAL 122 N 0.00 0.00 0.00 2.12 -1.51 -1.94 -3.32 116.25 111.60 1uor h VAL 122 Ca -0.07 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 64.41 1uor h VAL 122 Cb 0.87 1.66 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 1uor h VAL 122 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.34 1uor h MET 123 N 0.00 0.00 -6.01 5.19 -0.00 -1.88 -3.39 114.93 108.84 1uor h MET 123 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 59.70 59.18 1uor h MET 123 Cb 1.00 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.57 1uor h MET 123 CO 0.00 0.00 1.38 0.00 -0.00 0.00 0.00 176.91 178.29 1uor n THR 125 N 7.42 0.03 -2.79 0.00 -1.04 -1.26 -4.92 114.28 111.72 1uor n THR 125 Ca 0.24 -0.80 -0.43 0.00 -2.04 0.00 0.00 64.05 61.02 1uor n THR 125 Cb 0.51 0.89 0.01 0.00 -1.82 0.00 0.00 70.33 69.91 1uor n THR 125 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1uor n ALA 126 N -1.14 5.14 0.07 2.41 0.00 -1.26 -4.09 120.51 121.64 1uor n ALA 126 Ca -0.20 -4.61 0.00 0.00 0.00 0.00 0.00 53.44 48.64 1uor n ALA 126 Cb 0.84 -2.61 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1uor n ALA 126 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1uor n PHE 127 N 2.46 -0.86 -2.80 0.00 3.72 -1.26 -4.94 117.46 113.78 1uor n PHE 127 Ca 0.31 0.15 -0.01 0.00 -0.05 0.00 0.00 57.45 57.86 1uor n PHE 127 Cb 0.35 0.27 0.07 0.00 -0.94 0.00 0.00 39.48 39.23 1uor n PHE 127 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1uor n HIS 128 N -3.26 0.42 0.00 1.38 -0.00 -1.26 -5.05 115.22 107.45 1uor n HIS 128 Ca 0.00 -2.03 0.00 0.00 0.46 0.00 0.00 57.72 56.15 1uor n HIS 128 Cb 0.08 0.22 0.00 0.00 -0.12 0.00 0.00 29.99 30.18 1uor n HIS 128 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1uor n ASP 129 N -0.84 0.00 -0.05 0.26 5.68 -1.26 -5.00 116.55 115.34 1uor n ASP 129 Ca 0.01 0.00 0.01 0.00 -0.50 0.00 0.00 54.79 54.31 1uor n ASP 129 Cb 0.82 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.80 1uor n ASP 129 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1uor n ASN 130 N 0.00 0.65 -0.28 -1.12 0.23 -1.26 -4.05 115.26 109.42 1uor n ASN 130 Ca 0.00 -0.82 0.09 0.00 -0.53 0.00 0.00 54.58 53.32 1uor n ASN 130 Cb 0.00 0.50 0.22 0.00 -2.08 0.00 0.00 39.78 38.43 1uor n ASN 130 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1uor h GLU 131 N 0.24 0.15 -7.31 -3.83 3.07 -1.94 0.34 114.58 105.29 1uor h GLU 131 Ca 0.00 -0.01 -0.43 0.00 -0.50 0.00 0.00 59.36 58.42 1uor h GLU 131 Cb 0.08 -0.03 0.18 0.00 -0.84 0.00 0.00 28.75 28.14 1uor h GLU 131 CO 0.00 0.10 0.12 -1.21 -1.40 0.00 0.00 179.01 176.61 1uor s GLU 132 N -6.03 -0.62 0.00 2.33 0.41 -1.26 -1.94 118.70 111.59 1uor s GLU 132 Ca -0.13 0.33 0.00 0.00 -0.41 0.00 0.00 54.97 54.76 1uor s GLU 132 Cb 0.24 -1.63 0.00 0.00 -1.78 0.00 0.00 34.13 30.96 1uor s GLU 132 CO 0.76 -3.40 0.00 0.25 -0.49 0.00 0.00 175.26 172.39 1uor n THR 133 N -4.61 0.00 -0.20 3.63 -2.24 -1.26 -3.69 114.28 105.90 1uor n THR 133 Ca 0.08 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.80 1uor n THR 133 Cb 0.58 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.76 1uor n THR 133 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1uor n PHE 134 N 0.00 -0.21 0.28 4.78 7.35 -1.20 0.18 117.46 128.63 1uor n PHE 134 Ca 0.00 0.60 -0.16 0.00 -0.76 0.00 0.00 57.45 57.13 1uor n PHE 134 Cb 0.00 -0.49 -0.08 0.00 0.35 0.00 0.00 39.48 39.26 1uor n PHE 134 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1uor h LEU 135 N 0.00 -0.65 -1.70 -2.13 6.46 -0.39 -2.92 115.31 113.99 1uor h LEU 135 Ca 0.08 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1uor h LEU 135 Cb 0.20 0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1uor h LEU 135 CO -0.45 -0.43 0.00 0.29 -0.62 0.00 0.00 178.44 177.23 1uor n LYS 136 N -5.40 0.83 -0.70 1.25 5.02 0.48 -1.94 118.16 117.70 1uor n LYS 136 Ca -0.11 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.19 1uor n LYS 136 Cb 0.30 -1.18 0.27 0.00 -0.02 0.00 0.00 35.03 34.40 1uor n LYS 136 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1uor n LYS 137 N 0.43 3.54 -0.03 1.97 2.85 0.50 -4.32 118.16 123.10 1uor n LYS 137 Ca 0.00 -2.30 -0.05 0.00 -1.05 0.00 0.00 58.31 54.92 1uor n LYS 137 Cb 0.35 -2.03 -0.02 0.00 -0.65 0.00 0.00 35.03 32.68 1uor n LYS 137 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1uor n TYR 138 N 0.26 0.00 0.24 5.58 4.01 -0.82 -3.34 117.16 123.09 1uor n TYR 138 Ca 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.98 1uor n TYR 138 Cb 1.02 -0.19 0.00 0.00 -0.31 0.00 0.00 39.34 39.86 1uor n TYR 138 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1uor n LEU 139 N -3.03 0.48 0.00 7.72 7.94 -1.26 -0.41 117.00 128.44 1uor n LEU 139 Ca -0.10 -0.24 0.00 0.00 -1.11 0.00 0.00 56.01 54.56 1uor n LEU 139 Cb 0.58 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.41 1uor n LEU 139 CO 0.02 0.09 0.00 -1.22 -1.11 0.00 0.00 177.39 175.17 1uor n TYR 140 N 0.63 0.00 0.18 1.96 4.01 -1.26 -4.55 117.16 118.13 1uor n TYR 140 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1uor n TYR 140 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1uor n TYR 140 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1uor n GLU 141 N -0.84 0.18 0.00 -0.72 -0.58 -1.21 -1.79 120.64 115.67 1uor n GLU 141 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1uor n GLU 141 Cb 0.00 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 1uor n GLU 141 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16 1uor n ILE 142 N 0.57 0.00 -0.09 -3.67 0.13 -0.65 -4.70 119.36 110.94 1uor n ILE 142 Ca 0.00 0.00 -0.23 0.00 -1.10 0.00 0.00 62.75 61.42 1uor n ILE 142 Cb 0.06 0.00 -0.12 0.00 -0.84 0.00 0.00 39.64 38.74 1uor n ILE 142 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1uor n ALA 143 N 0.00 1.07 -1.88 1.51 0.00 0.45 -3.83 120.51 117.84 1uor n ALA 143 Ca 0.00 -0.82 -0.42 0.00 0.00 0.00 0.00 53.44 52.20 1uor n ALA 143 Cb 0.26 -0.30 -0.03 0.00 0.00 0.00 0.00 19.45 19.38 1uor n ALA 143 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1uor s ARG 144 N -2.49 4.18 -0.37 0.00 3.00 -0.74 -4.01 118.95 118.53 1uor s ARG 144 Ca -0.31 2.39 0.00 0.00 0.00 0.00 0.00 55.73 57.80 1uor s ARG 144 Cb 0.09 -3.69 0.00 0.00 0.00 0.00 0.00 34.95 31.35 1uor s ARG 144 CO 0.61 -0.78 0.00 2.89 0.00 0.00 0.00 175.30 178.01 1uor n ARG 145 N 5.95 -1.77 -2.70 3.54 1.85 -1.23 -4.56 116.66 117.73 1uor n ARG 145 Ca 0.17 0.39 -0.07 0.00 -1.00 0.00 0.00 57.85 57.34 1uor n ARG 145 Cb 0.40 -4.17 0.04 0.00 -1.05 0.00 0.00 32.46 27.68 1uor n ARG 145 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1uor n HIS 146 N -1.29 1.08 0.45 2.89 8.25 -1.26 -4.67 115.22 120.67 1uor n HIS 146 Ca -0.03 -2.61 0.05 0.00 -0.26 0.00 0.00 57.72 54.87 1uor n HIS 146 Cb 0.30 -0.29 0.26 0.00 1.12 0.00 0.00 29.99 31.38 1uor n HIS 146 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1uor n PRO 147 N -0.21 0.07 -0.02 -0.41 -0.02 -1.26 -2.10 135.00 131.05 1uor n PRO 147 Ca 0.08 0.25 0.07 0.00 -2.02 0.00 0.00 63.50 61.89 1uor n PRO 147 Cb 0.82 -1.50 -0.17 0.00 -0.02 0.00 0.00 33.50 32.63 1uor n PRO 147 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1uor n TYR 148 N -1.41 0.02 -0.69 6.00 4.02 -1.26 -4.79 117.16 119.04 1uor n TYR 148 Ca 0.04 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.69 1uor n TYR 148 Cb 0.11 -0.59 -0.02 0.00 -0.02 0.00 0.00 39.34 38.82 1uor n TYR 148 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1uor n PHE 149 N -2.35 -0.18 -2.77 -0.72 -0.00 -0.89 -4.67 117.46 105.87 1uor n PHE 149 Ca -0.09 0.48 -0.44 0.00 -0.00 0.00 0.00 57.45 57.40 1uor n PHE 149 Cb 0.67 -0.96 0.00 0.00 -0.00 0.00 0.00 39.48 39.19 1uor n PHE 149 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 1uor n TYR 150 N 0.07 4.70 0.00 -5.13 9.36 -1.26 -4.92 117.16 119.99 1uor n TYR 150 Ca 0.09 -3.17 0.00 0.00 3.32 0.00 0.00 57.90 58.14 1uor n TYR 150 Cb 0.11 -2.30 0.00 0.00 -0.63 0.00 0.00 39.34 36.53 1uor n TYR 150 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1uor n ALA 151 N 6.23 0.00 0.18 2.98 0.00 -1.26 -0.53 120.51 128.11 1uor n ALA 151 Ca 0.41 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.99 1uor n ALA 151 Cb 0.43 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.62 1uor n ALA 151 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1uor h PRO 152 N 0.00 0.00 0.00 0.00 0.13 -1.96 0.61 132.00 130.79 1uor h PRO 152 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 1uor h PRO 152 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1uor h PRO 152 CO 0.00 0.00 -0.37 0.93 -0.23 0.00 0.00 178.00 178.33 1uor h GLU 153 N 0.00 0.00 -0.34 0.86 4.39 -1.20 0.21 114.58 118.50 1uor h GLU 153 Ca 0.09 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.68 1uor h GLU 153 Cb 0.40 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1uor h GLU 153 CO -0.00 0.37 -0.21 -0.07 -1.16 0.00 0.00 179.01 177.94 1uor h LEU 154 N 0.00 0.78 -1.79 1.33 3.38 0.33 0.67 115.31 120.01 1uor h LEU 154 Ca -0.00 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.55 1uor h LEU 154 Cb 0.83 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1uor h LEU 154 CO 0.05 1.03 0.16 -0.07 0.09 0.00 0.00 178.44 179.70 1uor h LEU 155 N 0.53 0.25 -0.14 1.67 3.38 -0.55 0.84 115.31 121.29 1uor h LEU 155 Ca 0.07 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.84 1uor h LEU 155 Cb 0.76 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1uor h LEU 155 CO 0.06 0.18 -0.94 0.15 0.09 0.00 0.00 178.44 177.97 1uor h PHE 156 N 0.29 0.05 -0.36 1.13 3.57 -0.45 -3.12 116.94 118.05 1uor h PHE 156 Ca 0.09 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1uor h PHE 156 Cb 0.00 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1uor h PHE 156 CO -0.00 0.95 0.00 1.19 -2.23 0.00 0.00 178.31 178.22 1uor n PHE 157 N -3.46 0.62 -0.09 0.41 3.72 0.23 -3.73 117.46 115.16 1uor n PHE 157 Ca -0.01 -0.28 -0.14 0.00 -0.05 0.00 0.00 57.45 56.97 1uor n PHE 157 Cb 0.88 -0.07 -0.06 0.00 -0.94 0.00 0.00 39.48 39.29 1uor n PHE 157 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1uor n ALA 158 N 0.55 0.72 -0.32 4.37 0.00 0.27 -4.07 120.51 122.02 1uor n ALA 158 Ca 0.13 -0.58 0.12 0.00 0.00 0.00 0.00 53.44 53.11 1uor n ALA 158 Cb 0.41 -0.17 0.30 0.00 0.00 0.00 0.00 19.45 19.99 1uor n ALA 158 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1uor h LYS 159 N -1.00 0.57 -1.77 0.00 6.56 -1.70 0.18 116.57 119.40 1uor h LYS 159 Ca -0.21 -0.03 -0.28 0.00 -1.06 0.00 0.00 60.65 59.06 1uor h LYS 159 Cb 0.99 -0.13 -0.11 0.00 -0.57 0.00 0.00 32.23 32.41 1uor h LYS 159 CO -0.13 0.37 0.23 0.54 -2.06 0.00 0.00 179.45 178.41 1uor n ARG 160 N -4.90 1.80 0.00 3.15 5.12 -1.24 0.13 116.66 120.71 1uor n ARG 160 Ca 0.22 -1.36 0.00 0.00 -1.93 0.00 0.00 57.85 54.78 1uor n ARG 160 Cb 0.59 -1.65 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 1uor n ARG 160 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1uor n TYR 161 N 0.94 -0.01 0.00 -1.55 9.36 0.40 -4.89 117.16 121.41 1uor n TYR 161 Ca 0.30 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.52 1uor n TYR 161 Cb 0.60 0.04 0.00 0.00 -0.63 0.00 0.00 39.34 39.34 1uor n TYR 161 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 1uor n LYS 162 N -1.57 0.00 -0.28 2.98 0.00 0.49 -2.71 118.16 117.07 1uor n LYS 162 Ca 0.00 0.02 0.24 0.00 0.00 0.00 0.00 58.31 58.57 1uor n LYS 162 Cb 0.00 -0.94 0.42 0.00 0.00 0.00 0.00 35.03 34.50 1uor n LYS 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uor n ALA 163 N -0.81 0.83 0.17 3.14 0.00 0.35 0.53 120.51 124.71 1uor n ALA 163 Ca 0.00 0.56 -0.07 0.00 0.00 0.00 0.00 53.44 53.93 1uor n ALA 163 Cb 0.00 -0.66 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 1uor n ALA 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor h ALA 164 N 1.03 -1.00 -0.83 0.00 0.00 -1.71 -3.08 119.26 113.67 1uor h ALA 164 Ca 0.55 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.57 1uor h ALA 164 Cb 1.72 0.17 -0.14 0.00 0.00 0.00 0.00 17.79 19.54 1uor h ALA 164 CO -0.32 -0.97 0.14 0.74 0.00 0.00 0.00 179.25 178.85 1uor h PHE 165 N -0.47 0.18 0.00 0.00 -1.00 0.29 -1.13 116.94 114.81 1uor h PHE 165 Ca -0.04 0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1uor h PHE 165 Cb 0.33 0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.94 1uor h PHE 165 CO 0.13 -0.22 0.00 2.41 -1.61 0.00 0.00 178.31 179.02 1uor n THR 166 N -5.28 0.45 0.06 -1.55 -1.04 -0.27 -1.90 114.28 104.76 1uor n THR 166 Ca 0.18 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 1uor n THR 166 Cb 0.59 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 1uor n THR 166 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1uor n GLU 167 N 0.97 0.00 -3.32 -2.82 2.13 -0.47 -4.90 120.64 112.22 1uor n GLU 167 Ca 0.00 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.53 1uor n GLU 167 Cb 0.19 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.84 1uor n GLU 167 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1uor n GLN 170 N -2.93 0.00 0.18 0.00 -0.06 -1.19 0.58 117.38 113.96 1uor n GLN 170 Ca -0.01 0.00 0.13 0.00 -2.00 0.00 0.00 57.00 55.11 1uor n GLN 170 Cb 0.66 0.00 0.28 0.00 -4.06 0.00 0.00 30.24 27.13 1uor n GLN 170 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1uor h ALA 171 N -2.87 1.00 -0.56 1.69 0.00 -1.93 -3.03 119.26 113.55 1uor h ALA 171 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1uor h ALA 171 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1uor h ALA 171 CO 0.00 0.00 0.09 0.00 0.00 0.00 0.00 179.25 179.34 1uor n ALA 172 N -1.97 3.96 -2.41 0.00 0.00 -1.25 -4.88 120.51 113.96 1uor n ALA 172 Ca 0.04 -1.81 -0.14 0.00 0.00 0.00 0.00 53.44 51.54 1uor n ALA 172 Cb 0.48 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1uor n ALA 172 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1uor n ASP 173 N 0.31 -4.30 0.00 0.00 9.92 -1.14 0.28 116.55 121.61 1uor n ASP 173 Ca 0.29 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.70 1uor n ASP 173 Cb 1.15 -3.64 0.00 0.00 -0.64 0.00 0.00 41.12 37.99 1uor n ASP 173 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1uor n LYS 174 N -2.83 0.00 0.00 -1.24 -0.00 0.20 -4.83 118.16 109.46 1uor n LYS 174 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.14 1uor n LYS 174 Cb 0.62 -3.40 0.00 0.00 -0.00 0.00 0.00 35.03 32.26 1uor n LYS 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uor n ALA 175 N 0.90 -0.02 -0.12 0.58 0.00 0.79 -2.95 120.51 119.68 1uor n ALA 175 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 1uor n ALA 175 Cb 0.00 0.25 -0.08 0.00 0.00 0.00 0.00 19.45 19.62 1uor n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor n ALA 176 N -1.36 1.17 0.03 0.00 0.00 -1.24 -3.15 120.51 115.96 1uor n ALA 176 Ca 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 53.44 52.46 1uor n ALA 176 Cb 0.00 0.12 0.10 0.00 0.00 0.00 0.00 19.45 19.67 1uor n ALA 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor n LEU 178 N -1.59 0.00 0.00 0.00 0.00 -1.15 -4.82 117.00 109.44 1uor n LEU 178 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1uor n LEU 178 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.47 1uor n LEU 178 CO 0.02 0.00 0.33 0.00 0.00 0.00 0.00 177.39 177.73 1uor n LEU 179 N -1.28 0.00 -0.27 -1.96 -0.00 -1.19 -0.41 117.00 111.90 1uor n LEU 179 Ca 0.00 0.16 0.15 0.00 -0.00 0.00 0.00 56.01 56.31 1uor n LEU 179 Cb 0.00 -0.16 0.71 0.00 -0.00 0.00 0.00 43.42 43.97 1uor n LEU 179 CO 0.00 -0.16 0.97 -0.81 -0.00 0.00 0.00 177.39 177.40 1uor n PRO 180 N -1.15 1.37 -0.33 1.47 -0.04 -1.25 -1.01 135.00 134.06 1uor n PRO 180 Ca 0.00 -0.54 0.11 0.00 -0.04 0.00 0.00 63.50 63.02 1uor n PRO 180 Cb 0.00 -1.49 0.29 0.00 -0.04 0.00 0.00 33.50 32.26 1uor n PRO 180 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1uor n LYS 181 N -0.34 2.51 0.00 0.54 5.02 0.45 -3.96 118.16 122.39 1uor n LYS 181 Ca 0.21 -2.35 0.00 0.00 -2.02 0.00 0.00 58.31 54.15 1uor n LYS 181 Cb 0.25 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1uor n LYS 181 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1uor n LEU 182 N 1.42 1.21 0.00 -0.35 7.99 -0.26 -4.10 117.00 122.92 1uor n LEU 182 Ca 0.22 -1.21 0.00 0.00 -0.01 0.00 0.00 56.01 55.00 1uor n LEU 182 Cb 0.55 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.86 1uor n LEU 182 CO 0.15 0.30 0.00 0.47 -1.51 0.00 0.00 177.39 176.80 1uor n ASP 183 N -0.21 0.00 -0.15 -1.43 8.00 -0.18 -4.70 116.55 117.88 1uor n ASP 183 Ca 0.00 0.12 -0.11 0.00 0.71 0.00 0.00 54.79 55.52 1uor n ASP 183 Cb 0.19 -0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 40.93 1uor n ASP 183 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1uor h GLU 184 N 0.00 -0.25 -1.57 -1.24 4.81 -1.83 -1.62 114.58 112.88 1uor h GLU 184 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1uor h GLU 184 Cb 0.00 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1uor h GLU 184 CO 0.00 -0.17 0.00 1.28 -0.73 0.00 0.00 179.01 179.39 1uor n LEU 185 N -4.79 2.12 -0.04 1.64 4.32 -1.26 -1.86 117.00 117.12 1uor n LEU 185 Ca -0.02 -1.02 -0.06 0.00 -0.02 0.00 0.00 56.01 54.89 1uor n LEU 185 Cb 0.26 -0.39 -0.04 0.00 -1.62 0.00 0.00 43.42 41.63 1uor n LEU 185 CO -0.02 0.37 -0.79 -2.11 -1.22 0.00 0.00 177.39 173.63 1uor n ARG 186 N 0.97 0.34 -0.20 3.23 1.85 -0.61 -4.24 116.66 118.01 1uor n ARG 186 Ca 0.00 0.05 -0.04 0.00 -1.00 0.00 0.00 57.85 56.86 1uor n ARG 186 Cb 0.29 -1.18 0.14 0.00 -1.05 0.00 0.00 32.46 30.67 1uor n ARG 186 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1uor h ASP 187 N 0.00 0.91 0.37 2.89 3.32 -1.51 -2.40 116.42 120.00 1uor h ASP 187 Ca -0.20 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.70 1uor h ASP 187 Cb 1.31 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1uor h ASP 187 CO -0.03 0.85 0.00 1.21 -1.72 0.00 0.00 179.24 179.55 1uor n GLU 188 N -4.27 0.20 -0.08 3.56 2.13 -1.18 0.14 120.64 121.13 1uor n GLU 188 Ca 0.05 0.14 -0.10 0.00 0.66 0.00 0.00 57.16 57.91 1uor n GLU 188 Cb 0.21 -1.50 -0.05 0.00 0.27 0.00 0.00 31.44 30.37 1uor n GLU 188 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1uor h GLY 189 N 2.84 0.00 -0.17 8.31 0.00 -1.63 -3.33 103.07 109.10 1uor h GLY 189 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 1uor h GLY 189 CO 0.00 0.00 0.18 0.50 0.00 0.00 0.00 176.54 177.22 1uor h LYS 190 N -1.00 0.24 0.07 4.80 1.57 -1.13 -2.11 116.57 119.01 1uor h LYS 190 Ca -0.12 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1uor h LYS 190 Cb 0.75 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1uor h LYS 190 CO -0.07 0.16 -0.09 0.00 -0.57 0.00 0.00 179.45 178.88 1uor h ALA 191 N 1.65 -0.78 0.00 3.86 0.00 0.11 0.29 119.26 124.40 1uor h ALA 191 Ca 0.44 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.27 1uor h ALA 191 Cb 0.79 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1uor h ALA 191 CO -0.55 -0.79 -0.26 1.03 0.00 0.00 0.00 179.25 178.68 1uor h SER 192 N -0.17 0.00 0.63 0.00 0.87 -1.66 1.85 113.55 115.08 1uor h SER 192 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1uor h SER 192 Cb 0.15 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1uor h SER 192 CO -0.02 0.26 0.00 -1.54 -0.53 0.00 0.00 176.83 175.00 1uor n SER 193 N -4.16 0.19 -0.01 6.23 3.41 -0.69 -0.65 113.62 117.94 1uor n SER 193 Ca -0.02 0.54 -0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1uor n SER 193 Cb 0.32 -0.58 -0.02 0.00 -0.26 0.00 0.00 64.21 63.67 1uor n SER 193 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uor n ALA 194 N -1.57 2.00 1.50 7.33 0.00 0.51 -4.14 120.51 126.13 1uor n ALA 194 Ca 0.04 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.49 1uor n ALA 194 Cb 0.21 0.09 0.73 0.00 0.00 0.00 0.00 19.45 20.48 1uor n ALA 194 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uor n LYS 195 N -1.89 0.67 -0.09 0.00 5.02 0.60 -3.68 118.16 118.80 1uor n LYS 195 Ca -0.02 0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 1uor n LYS 195 Cb 0.38 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.83 1uor n LYS 195 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1uor n GLN 196 N -1.09 0.40 -0.40 1.97 -0.06 0.18 -4.51 117.38 113.87 1uor n GLN 196 Ca 0.17 0.17 0.39 0.00 -2.00 0.00 0.00 57.00 55.73 1uor n GLN 196 Cb 0.13 -1.18 0.76 0.00 -4.06 0.00 0.00 30.24 25.89 1uor n GLN 196 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 1uor h ARG 197 N -0.69 0.00 0.00 3.69 9.65 -1.72 2.72 114.38 128.03 1uor h ARG 197 Ca -0.38 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.50 1uor h ARG 197 Cb 1.27 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.85 1uor h ARG 197 CO -0.23 0.00 0.00 -0.11 2.80 0.00 0.00 179.97 182.43 1uor n LEU 198 N -4.04 0.00 -0.06 3.80 0.00 -1.26 -0.07 117.00 115.36 1uor n LEU 198 Ca 0.29 0.96 0.25 0.00 0.00 0.00 0.00 56.01 57.51 1uor n LEU 198 Cb 1.43 -0.46 0.65 0.00 0.00 0.00 0.00 43.42 45.05 1uor n LEU 198 CO 0.40 -0.46 1.23 0.11 0.00 0.00 0.00 177.39 178.67 1uor h LYS 199 N 0.00 0.00 0.15 1.96 1.57 0.46 0.97 116.57 121.67 1uor h LYS 199 Ca 0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1uor h LYS 199 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1uor h LYS 199 CO 0.00 0.00 -1.28 0.00 -0.57 0.00 0.00 179.45 177.60 1uor h ALA 201 N 0.03 0.48 -0.70 0.00 0.00 0.43 1.48 119.26 120.99 1uor h ALA 201 Ca -0.26 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.74 1uor h ALA 201 Cb 1.81 -0.04 -0.10 0.00 0.00 0.00 0.00 17.79 19.47 1uor h ALA 201 CO 0.12 -0.19 -0.54 0.77 0.00 0.00 0.00 179.25 179.42 1uor h SER 202 N 0.37 -1.90 0.42 0.00 0.02 -0.41 -1.03 113.55 111.04 1uor h SER 202 Ca 0.17 0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 61.38 1uor h SER 202 Cb 0.10 0.82 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 1uor h SER 202 CO -0.14 -0.28 -0.34 0.25 -1.14 0.00 0.00 176.83 175.18 1uor h LEU 203 N -0.15 -0.92 -2.06 5.07 7.12 0.21 -2.99 115.31 121.58 1uor h LEU 203 Ca 0.11 0.07 -0.05 0.00 0.13 0.00 0.00 57.88 58.14 1uor h LEU 203 Cb 0.45 0.29 -0.10 0.00 -0.53 0.00 0.00 40.66 40.78 1uor h LEU 203 CO -0.74 -0.48 -0.53 0.00 -0.13 0.00 0.00 178.44 176.56 1uor n GLN 204 N -4.49 0.00 0.00 1.25 6.02 -0.62 -1.70 117.38 117.83 1uor n GLN 204 Ca -0.09 -1.06 0.12 0.00 -0.01 0.00 0.00 57.00 55.95 1uor n GLN 204 Cb 0.33 -0.24 0.14 0.00 1.02 0.00 0.00 30.24 31.48 1uor n GLN 204 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1uor n LYS 205 N 0.11 0.87 -4.19 -1.09 3.00 -1.21 -4.96 118.16 110.68 1uor n LYS 205 Ca -0.00 -0.64 -0.11 0.00 -0.00 0.00 0.00 58.31 57.55 1uor n LYS 205 Cb 0.77 -1.49 -0.10 0.00 0.00 0.00 0.00 35.03 34.21 1uor n LYS 205 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 1uor s PHE 206 N -2.58 1.08 0.30 5.64 5.36 -0.39 -4.96 117.98 122.42 1uor s PHE 206 Ca 0.19 -1.31 -0.29 0.00 -0.96 0.00 0.00 56.93 54.56 1uor s PHE 206 Cb 0.18 -0.55 -0.13 0.00 -0.34 0.00 0.00 43.02 42.18 1uor s PHE 206 CO 0.59 -0.57 1.21 0.41 -1.46 0.00 0.00 175.22 175.40 1uor n GLY 207 N -0.22 0.31 0.26 13.12 0.00 -1.24 -4.10 105.19 113.33 1uor n GLY 207 Ca -0.01 0.36 0.11 0.00 0.00 0.00 0.00 46.02 46.48 1uor n GLY 207 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1uor h GLU 208 N 2.68 0.00 -0.64 1.61 -0.00 -1.53 -2.88 114.58 113.82 1uor h GLU 208 Ca -0.44 0.00 -0.03 0.00 -0.00 0.00 0.00 59.36 58.89 1uor h GLU 208 Cb 1.30 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 30.02 1uor h GLU 208 CO 0.64 0.09 0.26 -0.09 -0.00 0.00 0.00 179.01 179.92 1uor h ARG 209 N 0.00 0.93 -0.00 1.06 1.12 -1.89 -3.11 114.38 112.49 1uor h ARG 209 Ca -0.00 -0.15 0.03 0.00 -1.11 0.00 0.00 59.98 58.75 1uor h ARG 209 Cb 0.20 -0.16 -0.05 0.00 -0.01 0.00 0.00 29.97 29.95 1uor h ARG 209 CO 0.01 0.76 -0.35 0.00 -3.11 0.00 0.00 179.97 177.28 1uor h ALA 210 N 1.36 -0.52 -0.96 2.80 0.00 -1.85 -2.67 119.26 117.43 1uor h ALA 210 Ca 0.22 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.31 1uor h ALA 210 Cb 0.17 0.61 -0.18 0.00 0.00 0.00 0.00 17.79 18.39 1uor h ALA 210 CO -0.02 -0.87 -0.21 0.35 0.00 0.00 0.00 179.25 178.51 1uor h PHE 211 N -0.50 -0.45 -0.50 0.00 3.57 -1.70 1.08 116.94 118.44 1uor h PHE 211 Ca 0.06 0.08 0.07 0.00 3.53 0.00 0.00 57.97 61.71 1uor h PHE 211 Cb 0.59 0.35 -0.09 0.00 2.79 0.00 0.00 35.95 39.58 1uor h PHE 211 CO -0.37 -0.41 -0.51 0.87 -2.23 0.00 0.00 178.31 175.66 1uor h LYS 212 N 0.00 -0.30 -0.48 1.11 6.56 -1.63 0.78 116.57 122.62 1uor h LYS 212 Ca 0.48 0.02 0.10 0.00 -1.06 0.00 0.00 60.65 60.18 1uor h LYS 212 Cb 0.76 0.07 -0.03 0.00 -0.57 0.00 0.00 32.23 32.46 1uor h LYS 212 CO -0.97 -0.20 0.33 0.00 -2.06 0.00 0.00 179.45 176.54 1uor h ALA 213 N 0.26 2.15 0.25 3.86 0.00 0.11 0.70 119.26 126.59 1uor h ALA 213 Ca 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1uor h ALA 213 Cb 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1uor h ALA 213 CO -0.65 -0.27 -0.12 2.35 0.00 0.00 0.00 179.25 180.56 1uor h TRP 214 N 0.22 -0.31 0.00 0.00 7.01 0.14 -2.40 115.95 120.61 1uor h TRP 214 Ca 0.22 -0.01 -0.23 0.00 2.11 0.00 0.00 58.89 60.98 1uor h TRP 214 Cb 0.58 0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.71 1uor h TRP 214 CO -0.00 -0.10 -1.24 0.00 -2.79 0.00 0.00 178.44 174.32 1uor h ALA 215 N 0.23 0.53 -0.02 2.65 0.00 0.35 -1.82 119.26 121.19 1uor h ALA 215 Ca -0.03 -1.08 -0.07 0.00 0.00 0.00 0.00 54.91 53.73 1uor h ALA 215 Cb 0.36 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1uor h ALA 215 CO 0.06 1.32 -0.31 0.28 0.00 0.00 0.00 179.25 180.60 1uor h VAL 216 N 0.00 1.23 -0.72 0.00 2.07 0.09 0.80 116.25 119.72 1uor h VAL 216 Ca -0.11 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.26 1uor h VAL 216 Cb 1.83 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.13 1uor h VAL 216 CO 0.11 0.31 0.22 0.00 0.02 0.00 0.00 177.57 178.23 1uor h ALA 217 N 1.66 0.94 0.04 1.67 0.00 -1.25 -3.36 119.26 118.96 1uor h ALA 217 Ca 0.00 -0.22 -0.33 0.00 0.00 0.00 0.00 54.91 54.36 1uor h ALA 217 Cb 0.56 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1uor h ALA 217 CO 0.04 0.62 -1.82 -2.13 0.00 0.00 0.00 179.25 175.96 1uor n ARG 218 N -4.28 0.63 0.09 0.00 0.63 0.35 -3.17 116.66 110.91 1uor n ARG 218 Ca 0.05 0.39 0.10 0.00 -0.92 0.00 0.00 57.85 57.47 1uor n ARG 218 Cb 0.23 -1.67 0.42 0.00 0.45 0.00 0.00 32.46 31.89 1uor n ARG 218 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1uor n LEU 219 N -4.02 0.43 0.08 6.15 4.77 0.25 -1.56 117.00 123.09 1uor n LEU 219 Ca -0.38 0.62 0.12 0.00 -0.03 0.00 0.00 56.01 56.34 1uor n LEU 219 Cb 0.85 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 1uor n LEU 219 CO 0.23 -0.53 0.08 -1.20 -1.33 0.00 0.00 177.39 174.64 1uor n SER 220 N -1.99 0.75 0.13 -1.43 7.64 -1.26 -0.18 113.62 117.29 1uor n SER 220 Ca 0.02 0.19 0.13 0.00 1.01 0.00 0.00 58.87 60.22 1uor n SER 220 Cb 0.17 0.47 0.40 0.00 -1.01 0.00 0.00 64.21 64.23 1uor n SER 220 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1uor h GLN 221 N 0.00 0.00 0.00 1.43 4.15 -1.24 -3.15 115.11 116.30 1uor h GLN 221 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1uor h GLN 221 Cb 0.90 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.59 1uor h GLN 221 CO 0.00 0.00 -0.94 0.54 -1.93 0.00 0.00 178.83 176.50 1uor n ARG 222 N -2.39 3.24 -2.54 1.69 1.74 -1.18 -4.75 116.66 112.47 1uor n ARG 222 Ca 0.05 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.81 1uor n ARG 222 Cb 0.41 -0.97 -0.00 0.00 -1.02 0.00 0.00 32.46 30.87 1uor n ARG 222 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1uor n PHE 223 N -1.99 3.43 -0.53 -1.55 3.01 0.75 -2.11 117.46 118.48 1uor n PHE 223 Ca 0.00 -3.14 -0.02 0.00 1.01 0.00 0.00 57.45 55.30 1uor n PHE 223 Cb 0.47 -0.58 -0.03 0.00 -0.01 0.00 0.00 39.48 39.33 1uor n PHE 223 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1uor n PRO 224 N -0.36 1.06 0.00 -1.08 -0.04 -1.19 0.09 135.00 133.48 1uor n PRO 224 Ca 0.41 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 1uor n PRO 224 Cb 0.44 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 1uor n PRO 224 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1uor n LYS 225 N 1.74 2.92 -1.65 0.54 2.85 -1.26 -1.14 118.16 122.16 1uor n LYS 225 Ca 0.07 0.00 -0.64 0.00 -1.05 0.00 0.00 58.31 56.70 1uor n LYS 225 Cb 0.52 -0.24 -0.10 0.00 -0.65 0.00 0.00 35.03 34.56 1uor n LYS 225 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1uor n ALA 226 N 0.00 -0.72 -1.56 0.58 0.00 0.11 -4.87 120.51 114.05 1uor n ALA 226 Ca 0.00 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.50 1uor n ALA 226 Cb 0.00 -2.04 0.05 0.00 0.00 0.00 0.00 19.45 17.45 1uor n ALA 226 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1uor s GLU 227 N 3.77 2.79 0.46 0.00 0.41 -1.26 -4.74 118.70 120.12 1uor s GLU 227 Ca 1.06 1.57 0.24 0.00 -0.41 0.00 0.00 54.97 57.43 1uor s GLU 227 Cb -1.37 -1.93 1.25 0.00 -1.78 0.00 0.00 34.13 30.29 1uor s GLU 227 CO 0.74 -1.29 1.82 0.35 -0.49 0.00 0.00 175.26 176.40 1uor h PHE 228 N 0.30 0.38 -0.21 1.61 3.57 -2.00 0.13 116.94 120.73 1uor h PHE 228 Ca -0.48 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.05 1uor h PHE 228 Cb 1.27 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.86 1uor h PHE 228 CO 0.51 0.06 -0.20 0.00 -2.23 0.00 0.00 178.31 176.46 1uor h ALA 229 N 1.57 -0.38 0.00 2.41 0.00 -1.97 -3.17 119.26 117.72 1uor h ALA 229 Ca 0.52 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.42 1uor h ALA 229 Cb 1.57 0.94 -0.00 0.00 0.00 0.00 0.00 17.79 20.30 1uor h ALA 229 CO -0.16 -0.49 -0.12 1.49 0.00 0.00 0.00 179.25 179.97 1uor h GLU 230 N -0.10 0.00 -0.07 0.00 4.57 -1.11 0.79 114.58 118.66 1uor h GLU 230 Ca 0.03 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.11 1uor h GLU 230 Cb 0.19 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1uor h GLU 230 CO -0.24 0.12 -0.42 0.28 -1.18 0.00 0.00 179.01 177.56 1uor h VAL 231 N 0.00 1.31 -0.31 0.32 2.07 -1.50 -3.02 116.25 115.13 1uor h VAL 231 Ca -0.00 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 65.91 1uor h VAL 231 Cb 0.83 1.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 1uor h VAL 231 CO 0.02 0.45 0.10 -1.20 0.02 0.00 0.00 177.57 176.95 1uor n SER 232 N -4.02 3.13 -1.79 0.57 7.64 0.27 -0.48 113.62 118.94 1uor n SER 232 Ca -0.02 -2.50 0.02 0.00 1.01 0.00 0.00 58.87 57.39 1uor n SER 232 Cb 0.48 -0.60 0.05 0.00 -1.01 0.00 0.00 64.21 63.12 1uor n SER 232 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1uor n LYS 233 N 0.11 0.79 0.00 1.43 4.81 -1.14 -4.51 118.16 119.64 1uor n LYS 233 Ca 0.17 -2.63 0.00 0.00 -0.87 0.00 0.00 58.31 54.97 1uor n LYS 233 Cb 0.78 -0.70 0.00 0.00 0.02 0.00 0.00 35.03 35.13 1uor n LYS 233 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1uor n LEU 234 N -0.01 0.86 0.13 3.14 4.77 0.37 -4.68 117.00 121.57 1uor n LEU 234 Ca 0.09 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.15 1uor n LEU 234 Cb 1.00 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.13 1uor n LEU 234 CO 0.01 0.14 0.26 1.62 -1.33 0.00 0.00 177.39 178.09 1uor h VAL 235 N 0.00 0.22 0.00 4.08 3.04 -1.28 -2.25 116.25 120.07 1uor h VAL 235 Ca 0.00 -1.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.32 1uor h VAL 235 Cb 0.36 1.88 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1uor h VAL 235 CO 0.00 0.13 0.00 0.71 -1.01 0.00 0.00 177.57 177.40 1uor h THR 236 N 0.00 0.00 -0.01 3.17 1.35 -1.79 -2.80 112.91 112.83 1uor h THR 236 Ca -0.03 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1uor h THR 236 Cb 1.16 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1uor h THR 236 CO 0.02 0.00 -0.41 0.47 -0.25 0.00 0.00 175.52 175.35 1uor n ASP 237 N -2.88 1.94 -0.04 5.36 8.00 -1.17 -4.02 116.55 123.73 1uor n ASP 237 Ca 0.04 -1.47 -0.05 0.00 0.71 0.00 0.00 54.79 54.01 1uor n ASP 237 Cb 0.46 0.45 -0.04 0.00 -0.02 0.00 0.00 41.12 41.97 1uor n ASP 237 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1uor n LEU 238 N 0.00 2.20 0.00 0.64 7.94 -0.86 -4.14 117.00 122.79 1uor n LEU 238 Ca 0.09 -0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.95 1uor n LEU 238 Cb 0.43 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 44.20 1uor n LEU 238 CO 0.25 0.52 0.48 0.41 -1.11 0.00 0.00 177.39 177.95 1uor n THR 239 N -2.63 0.00 -0.25 1.96 -1.04 -1.06 -0.87 114.28 110.40 1uor n THR 239 Ca -0.15 1.47 -0.00 0.00 -2.04 0.00 0.00 64.05 63.33 1uor n THR 239 Cb 0.68 -2.11 0.03 0.00 -1.82 0.00 0.00 70.33 67.11 1uor n THR 239 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1uor n LYS 240 N -2.59 -0.15 0.00 -2.82 4.81 -1.26 0.10 118.16 116.26 1uor n LYS 240 Ca 0.00 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.45 1uor n LYS 240 Cb 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.55 1uor n LYS 240 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1uor n VAL 241 N -4.97 0.00 -0.20 3.15 0.31 -1.19 -2.79 118.33 112.64 1uor n VAL 241 Ca 0.07 1.40 0.11 0.00 -0.01 0.00 0.00 64.34 65.90 1uor n VAL 241 Cb 0.27 -2.27 0.41 0.00 -0.91 0.00 0.00 33.84 31.33 1uor n VAL 241 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1uor h HIS 242 N 0.00 0.69 -0.32 3.52 3.86 0.27 0.16 115.15 123.33 1uor h HIS 242 Ca 0.00 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.28 1uor h HIS 242 Cb 0.00 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.20 1uor h HIS 242 CO -0.06 0.31 0.06 1.79 0.86 0.00 0.00 177.93 180.89 1uor h THR 243 N 0.63 0.84 0.91 2.45 1.35 -0.63 -2.14 112.91 116.32 1uor h THR 243 Ca 0.37 -0.06 -0.04 0.00 -0.55 0.00 0.00 66.41 66.12 1uor h THR 243 Cb 0.56 0.65 0.01 0.00 -1.73 0.00 0.00 68.15 67.63 1uor h THR 243 CO -0.14 0.03 -0.43 -0.33 -0.25 0.00 0.00 175.52 174.40 1uor h GLU 244 N 0.17 -1.17 0.00 4.72 5.08 -0.50 0.79 114.58 123.68 1uor h GLU 244 Ca 0.15 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1uor h GLU 244 Cb 0.17 0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1uor h GLU 244 CO -0.20 -0.78 0.16 0.00 -1.00 0.00 0.00 179.01 177.18 1uor n HIS 247 N -3.74 0.00 0.00 0.00 -0.00 0.26 -4.85 115.22 106.89 1uor n HIS 247 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.29 1uor n HIS 247 Cb 0.85 -0.20 0.00 0.00 -0.00 0.00 0.00 29.99 30.64 1uor n HIS 247 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1uor n GLY 248 N 0.23 3.18 3.56 -1.41 0.00 -0.59 -5.01 105.19 105.15 1uor n GLY 248 Ca 0.10 -0.78 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 1uor n GLY 248 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1uor s ASP 249 N 0.00 6.23 0.00 1.61 -4.77 -1.20 -4.83 116.67 113.71 1uor s ASP 249 Ca 0.00 -0.94 0.00 0.00 -3.30 0.00 0.00 52.55 48.31 1uor s ASP 249 Cb 0.00 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.27 1uor s ASP 249 CO 0.00 -1.75 0.00 0.18 0.70 0.00 0.00 175.17 174.30 1uor n LEU 250 N 9.57 0.00 0.00 2.11 4.32 -1.26 -3.72 117.00 128.03 1uor n LEU 250 Ca 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.21 1uor n LEU 250 Cb 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1uor n LEU 250 CO 0.68 0.00 0.00 0.18 -1.22 0.00 0.00 177.39 177.03 1uor n LEU 251 N 0.00 0.00 -0.03 2.23 4.32 -1.26 0.27 117.00 122.53 1uor n LEU 251 Ca 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.91 1uor n LEU 251 Cb 0.00 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 1uor n LEU 251 CO 0.00 0.00 0.75 -0.33 -1.22 0.00 0.00 177.39 176.59 1uor h GLU 252 N 0.00 -0.17 0.00 3.23 3.07 -2.01 -3.00 114.58 115.70 1uor h GLU 252 Ca 0.00 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1uor h GLU 252 Cb 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1uor h GLU 252 CO 0.00 -0.11 0.00 0.00 -1.40 0.00 0.00 179.01 177.50 1uor h ALA 254 N -0.70 1.88 -0.03 0.00 0.00 -1.70 1.27 119.26 119.98 1uor h ALA 254 Ca 0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1uor h ALA 254 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1uor h ALA 254 CO 0.00 -0.01 -0.61 0.22 0.00 0.00 0.00 179.25 178.84 1uor h ASP 255 N 0.00 0.59 -0.13 0.00 3.58 -1.19 -3.35 116.42 115.92 1uor h ASP 255 Ca 0.00 -0.72 -0.00 0.00 0.42 0.00 0.00 57.03 56.73 1uor h ASP 255 Cb 0.02 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 1uor h ASP 255 CO -0.00 1.23 0.08 0.44 -2.88 0.00 0.00 179.24 178.11 1uor h ASP 256 N 0.00 0.15 0.00 2.28 3.32 0.52 0.97 116.42 123.67 1uor h ASP 256 Ca -0.07 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1uor h ASP 256 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1uor h ASP 256 CO 0.12 0.16 0.00 -1.14 -1.72 0.00 0.00 179.24 176.66 1uor n ARG 257 N -4.97 0.14 0.00 3.56 0.63 -0.21 0.30 116.66 116.11 1uor n ARG 257 Ca -0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.88 1uor n ARG 257 Cb 0.05 -1.00 0.00 0.00 0.45 0.00 0.00 32.46 31.96 1uor n ARG 257 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1uor n ALA 258 N -0.47 1.76 0.00 5.13 0.00 -0.16 -2.41 120.51 124.37 1uor n ALA 258 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1uor n ALA 258 Cb 0.00 0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1uor n ALA 258 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uor n ASP 259 N -1.69 0.00 0.00 0.00 -0.08 0.17 -0.95 116.55 114.00 1uor n ASP 259 Ca 0.00 0.34 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 1uor n ASP 259 Cb 0.33 -0.34 0.00 0.00 2.34 0.00 0.00 41.12 43.45 1uor n ASP 259 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1uor n LEU 260 N -1.32 0.00 -0.51 -2.67 0.00 0.87 -4.78 117.00 108.59 1uor n LEU 260 Ca 0.00 0.00 0.40 0.00 0.00 0.00 0.00 56.01 56.41 1uor n LEU 260 Cb 0.07 0.00 0.61 0.00 0.00 0.00 0.00 43.42 44.10 1uor n LEU 260 CO 0.00 0.00 1.19 0.00 0.00 0.00 0.00 177.39 178.58 1uor n ALA 261 N -1.61 1.42 -0.82 1.96 0.00 -1.01 0.32 120.51 120.77 1uor n ALA 261 Ca 0.00 0.49 -0.12 0.00 0.00 0.00 0.00 53.44 53.81 1uor n ALA 261 Cb 0.00 -0.85 0.01 0.00 0.00 0.00 0.00 19.45 18.61 1uor n ALA 261 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uor n LYS 262 N -3.44 1.61 0.13 0.00 4.76 -0.13 -0.44 118.16 120.65 1uor n LYS 262 Ca 0.33 -1.11 0.00 0.00 -2.87 0.00 0.00 58.31 54.66 1uor n LYS 262 Cb 1.59 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 33.30 1uor n LYS 262 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1uor n TYR 263 N 0.83 -2.31 -0.32 2.13 9.36 0.95 -4.77 117.16 123.04 1uor n TYR 263 Ca 0.23 0.44 -0.04 0.00 3.32 0.00 0.00 57.90 61.84 1uor n TYR 263 Cb 0.57 0.73 -0.02 0.00 -0.63 0.00 0.00 39.34 39.99 1uor n TYR 263 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 1uor n ILE 264 N -3.33 -0.48 -0.80 2.97 5.41 -1.20 -0.43 119.36 121.51 1uor n ILE 264 Ca 0.00 1.91 0.00 0.00 1.00 0.00 0.00 62.75 65.66 1uor n ILE 264 Cb 0.00 -2.45 0.33 0.00 -0.71 0.00 0.00 39.64 36.81 1uor n ILE 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1uor n GLU 266 N 0.24 1.64 -0.00 0.00 1.02 0.43 -4.63 120.64 119.34 1uor n GLU 266 Ca 0.32 -0.05 0.08 0.00 -0.02 0.00 0.00 57.16 57.49 1uor n GLU 266 Cb 1.22 -1.23 -0.11 0.00 -0.02 0.00 0.00 31.44 31.30 1uor n GLU 266 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1uor n ASN 267 N -1.58 0.86 0.00 1.62 4.13 -0.66 -4.86 115.26 114.76 1uor n ASN 267 Ca 0.01 -0.62 0.00 0.00 1.68 0.00 0.00 54.58 55.65 1uor n ASN 267 Cb 0.28 1.25 0.00 0.00 -1.54 0.00 0.00 39.78 39.77 1uor n ASN 267 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1uor n GLN 268 N -1.63 0.00 0.06 3.52 6.02 -0.72 -1.09 117.38 123.54 1uor n GLN 268 Ca 0.01 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.05 1uor n GLN 268 Cb 0.33 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.54 1uor n GLN 268 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1uor n ASP 269 N 0.00 0.86 -0.22 1.08 5.75 -1.26 -3.07 116.55 119.69 1uor n ASP 269 Ca 0.00 0.36 0.02 0.00 -0.01 0.00 0.00 54.79 55.16 1uor n ASP 269 Cb 0.00 0.28 0.05 0.00 -1.03 0.00 0.00 41.12 40.42 1uor n ASP 269 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1uor n SER 270 N -2.80 0.63 0.04 -1.12 3.41 -0.25 -4.61 113.62 108.93 1uor n SER 270 Ca -0.05 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.55 1uor n SER 270 Cb 0.71 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1uor n SER 270 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1uor n ILE 271 N -0.16 0.24 -2.72 -1.33 5.41 -1.22 -4.62 119.36 114.95 1uor n ILE 271 Ca 0.04 0.08 -0.08 0.00 1.00 0.00 0.00 62.75 63.79 1uor n ILE 271 Cb 0.10 -0.68 0.09 0.00 -0.71 0.00 0.00 39.64 38.44 1uor n ILE 271 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1uor n SER 272 N -2.92 -2.30 0.00 4.38 2.88 -1.17 -3.71 113.62 110.78 1uor n SER 272 Ca 0.00 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.14 1uor n SER 272 Cb 0.00 1.81 0.00 0.00 -0.75 0.00 0.00 64.21 65.27 1uor n SER 272 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uor n SER 273 N 0.62 0.00 0.00 -3.46 2.88 -1.24 -3.25 113.62 109.17 1uor n SER 273 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1uor n SER 273 Cb 0.69 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.15 1uor n SER 273 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1uor n LYS 274 N 0.00 0.00 -1.36 -1.46 4.76 -1.26 -2.87 118.16 115.97 1uor n LYS 274 Ca 0.00 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 1uor n LYS 274 Cb 0.00 -1.41 0.04 0.00 -1.84 0.00 0.00 35.03 31.82 1uor n LYS 274 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1uor n LEU 275 N -0.75 7.16 0.00 -0.35 4.32 -1.20 -4.45 117.00 121.72 1uor n LEU 275 Ca 0.00 -4.11 0.00 0.00 -0.02 0.00 0.00 56.01 51.88 1uor n LEU 275 Cb 0.00 -1.06 0.00 0.00 -1.62 0.00 0.00 43.42 40.74 1uor n LEU 275 CO 0.00 1.51 0.22 2.29 -1.22 0.00 0.00 177.39 180.18 1uor n LYS 276 N -0.22 0.00 -0.08 3.23 -0.00 -1.14 -4.43 118.16 115.52 1uor n LYS 276 Ca 0.50 0.25 -0.02 0.00 -0.00 0.00 0.00 58.31 59.05 1uor n LYS 276 Cb 0.54 -1.04 -0.02 0.00 -0.00 0.00 0.00 35.03 34.51 1uor n LYS 276 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1uor n GLU 277 N -1.26 -0.08 -1.97 -1.58 -0.58 -1.26 -1.10 120.64 112.81 1uor n GLU 277 Ca 0.00 0.35 -0.41 0.00 -0.42 0.00 0.00 57.16 56.68 1uor n GLU 277 Cb 0.00 -0.52 -0.00 0.00 -0.57 0.00 0.00 31.44 30.35 1uor n GLU 277 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1uor n GLU 280 N 0.00 4.36 -3.44 0.00 -0.58 0.21 -4.98 120.64 116.21 1uor n GLU 280 Ca 0.00 -4.37 -0.08 0.00 -0.42 0.00 0.00 57.16 52.29 1uor n GLU 280 Cb 0.00 -2.38 -0.08 0.00 -0.57 0.00 0.00 31.44 28.41 1uor n GLU 280 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1uor s LYS 281 N -4.13 0.36 -0.08 3.49 1.02 -1.22 -4.94 119.74 114.23 1uor s LYS 281 Ca 0.44 0.75 -0.08 0.00 0.02 0.00 0.00 55.97 57.11 1uor s LYS 281 Cb 0.28 -0.11 -0.03 0.00 -0.52 0.00 0.00 37.83 37.44 1uor s LYS 281 CO -0.21 -0.50 0.28 -0.35 -0.92 0.00 0.00 175.35 173.64 1uor n PRO 282 N 5.38 0.00 0.00 -1.68 -0.04 -1.26 -3.30 135.00 134.10 1uor n PRO 282 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1uor n PRO 282 Cb 0.50 -0.24 0.00 0.00 -0.04 0.00 0.00 33.50 33.72 1uor n PRO 282 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1uor n LEU 283 N 0.75 0.00 0.00 1.53 7.94 -1.26 -0.97 117.00 124.99 1uor n LEU 283 Ca 0.06 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 1uor n LEU 283 Cb -0.01 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.94 1uor n LEU 283 CO 0.15 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.61 1uor n LEU 284 N 0.00 0.00 0.24 -1.96 4.77 -1.26 0.23 117.00 119.02 1uor n LEU 284 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 1uor n LEU 284 Cb 0.00 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 41.60 1uor n LEU 284 CO 0.00 0.00 0.87 -0.33 -1.33 0.00 0.00 177.39 176.60 1uor h GLU 285 N 0.00 0.00 -0.18 3.23 5.08 -1.29 0.03 114.58 121.45 1uor h GLU 285 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1uor h GLU 285 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1uor h GLU 285 CO 0.00 0.12 -0.13 0.87 -1.00 0.00 0.00 179.01 178.87 1uor h LYS 286 N 0.00 -0.03 -0.41 2.33 1.57 0.29 -2.04 116.57 118.27 1uor h LYS 286 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1uor h LYS 286 Cb 0.69 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1uor h LYS 286 CO 0.02 -0.02 0.00 0.43 -0.57 0.00 0.00 179.45 179.30 1uor n SER 287 N -3.45 0.41 -2.82 0.86 7.64 -0.00 0.42 113.62 116.69 1uor n SER 287 Ca -0.00 -1.16 -0.00 0.00 1.01 0.00 0.00 58.87 58.71 1uor n SER 287 Cb 0.07 -0.21 0.06 0.00 -1.01 0.00 0.00 64.21 63.12 1uor n SER 287 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1uor n HIS 288 N 0.01 0.92 -0.02 1.43 -0.00 -0.95 -3.83 115.22 112.77 1uor n HIS 288 Ca 0.00 -2.12 -0.06 0.00 -0.00 0.00 0.00 57.72 55.54 1uor n HIS 288 Cb 0.10 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.99 30.02 1uor n HIS 288 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1uor h ILE 290 N -0.24 0.80 -2.86 0.00 2.04 -1.70 -2.95 117.51 112.59 1uor h ILE 290 Ca -0.14 0.00 -0.48 0.00 1.00 0.00 0.00 64.86 65.24 1uor h ILE 290 Cb 0.98 0.80 0.23 0.00 -0.74 0.00 0.00 36.82 38.08 1uor h ILE 290 CO -0.08 0.00 -0.72 0.00 0.00 0.00 0.00 178.15 177.34 1uor n ALA 291 N -2.29 -3.36 -1.15 1.87 0.00 -1.25 -4.43 120.51 109.89 1uor n ALA 291 Ca -0.06 -1.04 -0.25 0.00 0.00 0.00 0.00 53.44 52.09 1uor n ALA 291 Cb 0.13 -1.70 -0.12 0.00 0.00 0.00 0.00 19.45 17.76 1uor n ALA 291 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uor n GLU 292 N -2.46 0.05 -3.27 0.00 1.02 -1.26 -4.28 120.64 110.44 1uor n GLU 292 Ca 0.03 -1.39 -0.25 0.00 -0.02 0.00 0.00 57.16 55.54 1uor n GLU 292 Cb 0.58 -3.31 -0.08 0.00 -0.02 0.00 0.00 31.44 28.61 1uor n GLU 292 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1uor n VAL 293 N 8.17 -0.93 -3.73 2.62 0.31 -1.12 -5.01 118.33 118.64 1uor n VAL 293 Ca 0.42 -3.70 -0.28 0.00 -0.01 0.00 0.00 64.34 60.78 1uor n VAL 293 Cb 0.45 -1.76 -0.11 0.00 -0.91 0.00 0.00 33.84 31.51 1uor n VAL 293 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1uor n GLU 294 N 2.07 1.95 -1.55 5.55 -0.58 -1.23 -4.50 120.64 122.34 1uor n GLU 294 Ca 0.25 -4.47 -0.50 0.00 -0.42 0.00 0.00 57.16 52.02 1uor n GLU 294 Cb 0.51 -2.23 -0.06 0.00 -0.57 0.00 0.00 31.44 29.09 1uor n GLU 294 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1uor n ASN 295 N 1.66 2.63 -4.67 1.62 4.05 -1.26 -4.81 115.26 114.49 1uor n ASN 295 Ca 0.23 0.59 -0.38 0.00 0.45 0.00 0.00 54.58 55.47 1uor n ASN 295 Cb 0.38 -1.32 0.06 0.00 1.23 0.00 0.00 39.78 40.13 1uor n ASN 295 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1uor n ASP 296 N 8.89 1.43 -3.94 1.20 9.92 -1.26 -4.94 116.55 127.85 1uor n ASP 296 Ca 0.34 0.83 -0.43 0.00 -0.53 0.00 0.00 54.79 55.00 1uor n ASP 296 Cb 0.26 -1.47 0.01 0.00 -0.64 0.00 0.00 41.12 39.28 1uor n ASP 296 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1uor n GLU 297 N -1.31 3.84 -1.23 -1.24 2.13 -0.89 -4.97 120.64 116.98 1uor n GLU 297 Ca 0.14 -3.83 -0.39 0.00 0.66 0.00 0.00 57.16 53.74 1uor n GLU 297 Cb 0.47 -2.81 0.02 0.00 0.27 0.00 0.00 31.44 29.38 1uor n GLU 297 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1uor n MET 298 N 3.24 0.02 -0.12 5.31 0.00 -1.26 -4.35 117.12 119.96 1uor n MET 298 Ca 0.36 0.01 -0.18 0.00 0.00 0.00 0.00 57.70 57.89 1uor n MET 298 Cb 0.36 -1.04 -0.11 0.00 0.00 0.00 0.00 33.22 32.42 1uor n MET 298 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1uor n PRO 299 N 1.53 0.61 -3.43 3.17 -0.05 -1.26 -5.10 135.00 130.47 1uor n PRO 299 Ca 0.07 0.15 0.00 0.00 -0.05 0.00 0.00 63.50 63.67 1uor n PRO 299 Cb 0.48 -1.49 0.00 0.00 -0.05 0.00 0.00 33.50 32.45 1uor n PRO 299 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1uor n ALA 300 N -3.30 0.00 0.15 0.55 0.00 -1.26 -4.72 120.51 111.93 1uor n ALA 300 Ca -0.44 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.08 1uor n ALA 300 Cb 0.96 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.84 1uor n ALA 300 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uor n ASP 301 N 0.69 0.41 -2.94 0.00 2.03 -0.29 -4.83 116.55 111.62 1uor n ASP 301 Ca 0.00 0.64 -0.10 0.00 0.52 0.00 0.00 54.79 55.84 1uor n ASP 301 Cb 0.00 -0.64 0.01 0.00 -0.72 0.00 0.00 41.12 39.77 1uor n ASP 301 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 1uor s LEU 302 N -4.18 0.27 -0.04 -2.67 0.05 -1.26 -4.97 118.68 105.89 1uor s LEU 302 Ca -0.02 -1.26 -0.13 0.00 0.05 0.00 0.00 54.13 52.77 1uor s LEU 302 Cb 0.05 2.52 -0.32 0.00 -2.05 0.00 0.00 46.19 46.39 1uor s LEU 302 CO 0.14 -1.62 0.73 1.55 -0.55 0.00 0.00 176.35 176.61 1uor h PRO 303 N 2.02 0.42 -4.99 1.48 0.14 -2.03 -3.49 132.00 125.55 1uor h PRO 303 Ca -0.32 -0.72 -0.03 0.00 0.14 0.00 0.00 66.00 65.08 1uor h PRO 303 Cb 1.25 0.27 -0.02 0.00 0.14 0.00 0.00 31.00 32.64 1uor h PRO 303 CO 0.41 1.34 -0.04 0.43 0.14 0.00 0.00 178.00 180.28 1uor n SER 304 N -3.65 -1.01 0.00 1.44 7.64 -1.26 -4.76 113.62 112.02 1uor n SER 304 Ca -0.23 0.41 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1uor n SER 304 Cb 1.07 -1.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1uor n SER 304 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1uor n LEU 305 N -2.50 0.00 -4.25 -3.43 4.77 -1.26 -4.60 117.00 105.73 1uor n LEU 305 Ca 0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 1uor n LEU 305 Cb 0.48 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.47 1uor n LEU 305 CO 0.04 0.00 -0.41 0.00 -1.33 0.00 0.00 177.39 175.70 1uor s ALA 306 N 0.00 1.46 -0.87 -1.18 0.00 -1.26 -5.08 121.76 114.83 1uor s ALA 306 Ca 0.00 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.46 1uor s ALA 306 Cb 0.00 0.08 0.29 0.00 0.00 0.00 0.00 23.12 23.48 1uor s ALA 306 CO 0.00 -0.11 1.17 0.00 0.00 0.00 0.00 175.76 176.82 1uor n ALA 307 N -0.21 4.74 -2.22 0.00 0.00 -1.26 -4.78 120.51 116.79 1uor n ALA 307 Ca -0.10 -4.79 -0.26 0.00 0.00 0.00 0.00 53.44 48.30 1uor n ALA 307 Cb 0.61 -1.67 0.01 0.00 0.00 0.00 0.00 19.45 18.40 1uor n ALA 307 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1uor n ASP 308 N 0.99 4.91 -0.06 0.00 8.00 -1.26 -4.09 116.55 125.05 1uor n ASP 308 Ca 0.29 -3.74 -0.03 0.00 0.71 0.00 0.00 54.79 52.02 1uor n ASP 308 Cb 0.36 -0.42 -0.12 0.00 -0.02 0.00 0.00 41.12 40.93 1uor n ASP 308 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1uor n PHE 309 N -0.60 0.00 0.60 1.24 7.35 -1.26 -4.28 117.46 120.50 1uor n PHE 309 Ca 0.42 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 57.15 1uor n PHE 309 Cb 0.81 -0.63 0.15 0.00 0.35 0.00 0.00 39.48 40.16 1uor n PHE 309 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1uor n VAL 310 N -2.42 0.80 0.00 -2.13 0.24 -1.26 -4.89 118.33 108.67 1uor n VAL 310 Ca -0.19 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.62 1uor n VAL 310 Cb 0.83 -0.13 0.00 0.00 -1.47 0.00 0.00 33.84 33.08 1uor n VAL 310 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1uor n GLU 311 N 0.31 0.00 -0.15 7.34 0.00 -1.26 -4.99 120.64 121.90 1uor n GLU 311 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 57.16 57.16 1uor n GLU 311 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.87 1uor n GLU 311 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1uor n SER 312 N 0.00 0.23 -3.73 4.31 7.64 -1.26 -4.75 113.62 116.06 1uor n SER 312 Ca 0.00 -2.05 -0.14 0.00 1.01 0.00 0.00 58.87 57.69 1uor n SER 312 Cb 0.00 -0.48 -0.07 0.00 -1.01 0.00 0.00 64.21 62.65 1uor n SER 312 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1uor s LYS 313 N 5.32 1.57 -0.58 1.43 2.47 -1.26 -4.95 119.74 123.75 1uor s LYS 313 Ca 0.17 -1.68 0.04 0.00 -1.56 0.00 0.00 55.97 52.94 1uor s LYS 313 Cb 0.04 0.36 0.15 0.00 -1.46 0.00 0.00 37.83 36.92 1uor s LYS 313 CO 0.09 -0.60 0.35 0.34 0.16 0.00 0.00 175.35 175.69 1uor s ASP 314 N -3.20 4.31 -0.42 1.43 2.15 -1.26 -4.83 116.67 114.85 1uor s ASP 314 Ca 0.34 -3.31 0.07 0.00 0.43 0.00 0.00 52.55 50.09 1uor s ASP 314 Cb 0.03 -1.51 0.24 0.00 -0.30 0.00 0.00 42.92 41.37 1uor s ASP 314 CO 0.17 -0.17 0.60 1.33 -0.17 0.00 0.00 175.17 176.93 1uor n VAL 315 N 2.70 -0.56 0.00 1.11 0.24 -1.26 -4.94 118.33 115.62 1uor n VAL 315 Ca 0.12 -3.27 0.00 0.00 -2.04 0.00 0.00 64.34 59.16 1uor n VAL 315 Cb 0.34 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.69 1uor n VAL 315 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uor h LYS 317 N 0.00 0.10 -0.97 0.00 1.57 -1.88 -3.41 116.57 111.99 1uor h LYS 317 Ca 0.00 -0.18 0.33 0.00 -1.87 0.00 0.00 60.65 58.93 1uor h LYS 317 Cb 0.00 0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.28 1uor h LYS 317 CO 0.00 1.09 0.63 -1.71 -0.57 0.00 0.00 179.45 178.88 1uor n ASN 318 N -4.11 0.13 -1.29 0.86 5.15 -1.26 0.41 115.26 115.15 1uor n ASN 318 Ca -0.31 0.93 -0.06 0.00 -0.60 0.00 0.00 54.58 54.54 1uor n ASN 318 Cb 0.81 -0.46 0.12 0.00 -0.53 0.00 0.00 39.78 39.72 1uor n ASN 318 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1uor n TYR 319 N -4.00 1.09 -2.70 1.20 9.36 -1.26 -4.67 117.16 116.18 1uor n TYR 319 Ca 0.28 -1.74 -0.07 0.00 3.32 0.00 0.00 57.90 59.68 1uor n TYR 319 Cb 1.09 -0.28 0.11 0.00 -0.63 0.00 0.00 39.34 39.63 1uor n TYR 319 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1uor n ALA 320 N -0.85 1.35 0.04 2.98 0.00 1.37 -4.77 120.51 120.62 1uor n ALA 320 Ca 0.27 -1.48 0.05 0.00 0.00 0.00 0.00 53.44 52.28 1uor n ALA 320 Cb 0.83 -1.00 0.11 0.00 0.00 0.00 0.00 19.45 19.39 1uor n ALA 320 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uor n GLU 321 N -0.50 2.08 -3.15 0.00 4.71 -1.20 -4.70 120.64 117.88 1uor n GLU 321 Ca -0.01 -1.73 -0.45 0.00 -0.01 0.00 0.00 57.16 54.95 1uor n GLU 321 Cb 0.84 -1.24 -0.04 0.00 -1.01 0.00 0.00 31.44 29.98 1uor n GLU 321 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uor s ALA 322 N -0.96 3.48 0.02 0.62 0.00 -1.26 -4.95 121.76 118.71 1uor s ALA 322 Ca 0.19 -2.34 -0.07 0.00 0.00 0.00 0.00 51.96 49.74 1uor s ALA 322 Cb 0.11 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1uor s ALA 322 CO 0.15 -2.29 1.11 -0.22 0.00 0.00 0.00 175.76 174.50 1uor h LYS 323 N 9.08 -0.20 -0.42 0.00 3.64 -1.99 -3.02 116.57 123.66 1uor h LYS 323 Ca -0.27 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1uor h LYS 323 Cb 1.09 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.90 1uor h LYS 323 CO 1.08 -0.13 0.13 -0.44 -2.27 0.00 0.00 179.45 177.81 1uor h ASP 324 N -0.21 0.11 1.65 4.20 3.32 -2.00 -1.67 116.42 121.82 1uor h ASP 324 Ca -0.01 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1uor h ASP 324 Cb 0.18 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1uor h ASP 324 CO -0.01 0.09 -0.22 -0.37 -1.72 0.00 0.00 179.24 177.01 1uor h VAL 325 N 0.28 0.00 0.44 -1.35 -1.51 -1.98 -1.64 116.25 110.49 1uor h VAL 325 Ca 0.20 -0.87 -0.02 0.00 -1.23 0.00 0.00 66.70 64.77 1uor h VAL 325 Cb 0.21 1.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.13 1uor h VAL 325 CO -0.22 0.00 -0.21 0.15 -1.23 0.00 0.00 177.57 176.06 1uor h PHE 326 N 0.00 -0.55 -0.71 5.19 3.57 -1.16 0.15 116.94 123.43 1uor h PHE 326 Ca 0.00 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.56 1uor h PHE 326 Cb 0.94 0.18 -0.06 0.00 2.79 0.00 0.00 35.95 39.80 1uor h PHE 326 CO 0.00 -0.23 0.38 -0.07 -2.23 0.00 0.00 178.31 176.16 1uor h LEU 327 N -0.87 0.54 -1.36 0.59 -0.00 -1.55 0.26 115.31 112.92 1uor h LEU 327 Ca -0.06 0.04 0.10 0.00 -0.00 0.00 0.00 57.88 57.96 1uor h LEU 327 Cb 0.57 -0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 41.12 1uor h LEU 327 CO 0.10 0.32 0.52 1.23 -0.00 0.00 0.00 178.44 180.61 1uor h GLY 328 N 0.67 1.02 1.02 0.83 0.00 -1.10 0.30 103.07 105.82 1uor h GLY 328 Ca 0.33 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1uor h GLY 328 CO -0.23 0.17 -0.86 1.98 0.00 0.00 0.00 176.54 177.60 1uor h MET 329 N 0.71 0.00 0.00 4.80 1.85 0.82 -0.72 114.93 122.39 1uor h MET 329 Ca 0.37 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.46 1uor h MET 329 Cb 0.47 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.50 1uor h MET 329 CO -0.14 0.00 0.00 0.34 -0.40 0.00 0.00 176.91 176.71 1uor n PHE 330 N -2.40 0.00 -0.04 1.39 7.35 0.75 -2.86 117.46 121.64 1uor n PHE 330 Ca 0.01 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.69 1uor n PHE 330 Cb 0.50 -0.01 -0.01 0.00 0.35 0.00 0.00 39.48 40.31 1uor n PHE 330 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1uor n LEU 331 N -0.53 -0.09 -0.03 -2.13 7.94 0.92 -0.03 117.00 123.05 1uor n LEU 331 Ca 0.00 0.35 -0.09 0.00 -1.11 0.00 0.00 56.01 55.16 1uor n LEU 331 Cb 0.00 -0.12 -0.03 0.00 0.53 0.00 0.00 43.42 43.81 1uor n LEU 331 CO 0.00 -0.22 0.68 0.22 -1.11 0.00 0.00 177.39 176.96 1uor h TYR 332 N 0.00 -0.70 -0.13 1.96 3.20 -1.29 2.43 116.97 122.44 1uor h TYR 332 Ca 0.01 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 61.79 1uor h TYR 332 Cb 0.04 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1uor h TYR 332 CO -0.27 -0.34 -0.49 0.93 -1.64 0.00 0.00 178.16 176.35 1uor h GLU 333 N -0.29 0.34 -0.39 1.82 4.39 -0.30 0.27 114.58 120.41 1uor h GLU 333 Ca 0.12 -0.19 -0.11 0.00 0.34 0.00 0.00 59.36 59.52 1uor h GLU 333 Cb 0.48 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1uor h GLU 333 CO -0.37 0.76 -0.21 -0.92 -1.16 0.00 0.00 179.01 177.11 1uor h TYR 334 N 0.27 0.86 -0.29 4.33 5.03 0.47 -3.08 116.97 124.56 1uor h TYR 334 Ca 0.01 -0.19 -0.01 0.00 2.58 0.00 0.00 58.73 61.12 1uor h TYR 334 Cb 0.96 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 39.02 1uor h TYR 334 CO 0.02 0.90 0.14 0.00 -1.32 0.00 0.00 178.16 177.91 1uor h ALA 335 N 1.10 0.37 -0.78 1.82 0.00 0.48 -2.73 119.26 119.52 1uor h ALA 335 Ca 0.10 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.06 1uor h ALA 335 Cb 0.71 -0.11 -0.14 0.00 0.00 0.00 0.00 17.79 18.25 1uor h ALA 335 CO 0.05 -0.08 -0.28 0.00 0.00 0.00 0.00 179.25 178.94 1uor h ARG 336 N 0.33 -0.05 -0.67 0.00 2.47 -0.40 -2.42 114.38 113.63 1uor h ARG 336 Ca 0.10 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 1uor h ARG 336 Cb 0.10 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 1uor h ARG 336 CO -0.01 -0.03 0.00 2.89 0.56 0.00 0.00 179.97 183.37 1uor n ARG 337 N -5.49 3.60 -3.14 0.04 1.85 -1.03 -4.51 116.66 107.98 1uor n ARG 337 Ca 0.09 -2.25 -0.17 0.00 -1.00 0.00 0.00 57.85 54.52 1uor n ARG 337 Cb 0.39 -1.96 -0.02 0.00 -1.05 0.00 0.00 32.46 29.82 1uor n ARG 337 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1uor n HIS 338 N 0.56 -0.16 0.66 2.89 8.25 -0.91 -4.80 115.22 121.71 1uor n HIS 338 Ca 0.20 -3.63 0.06 0.00 -0.26 0.00 0.00 57.72 54.09 1uor n HIS 338 Cb 0.87 -0.21 0.34 0.00 1.12 0.00 0.00 29.99 32.10 1uor n HIS 338 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1uor n PRO 339 N 0.36 0.25 -0.15 -0.41 -0.02 -1.26 -2.42 135.00 131.35 1uor n PRO 339 Ca 0.23 0.12 0.11 0.00 -2.02 0.00 0.00 63.50 61.93 1uor n PRO 339 Cb 0.66 -1.50 0.18 0.00 -0.02 0.00 0.00 33.50 32.82 1uor n PRO 339 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1uor n ASP 340 N -1.20 3.26 -4.20 2.55 5.75 -1.26 -4.70 116.55 116.75 1uor n ASP 340 Ca 0.07 -1.95 -0.25 0.00 -0.01 0.00 0.00 54.79 52.65 1uor n ASP 340 Cb 0.08 -0.19 -0.15 0.00 -1.03 0.00 0.00 41.12 39.83 1uor n ASP 340 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1uor s TYR 341 N -1.48 1.64 0.38 2.11 2.02 -1.02 -4.66 117.35 116.34 1uor s TYR 341 Ca 0.34 -0.34 -0.25 0.00 -0.37 0.00 0.00 57.07 56.45 1uor s TYR 341 Cb 0.21 -1.01 -0.09 0.00 -0.40 0.00 0.00 41.96 40.67 1uor s TYR 341 CO 0.29 0.03 1.07 -1.54 -1.57 0.00 0.00 175.55 173.83 1uor s SER 342 N -0.86 6.79 0.12 2.29 1.04 -1.26 -4.79 113.70 117.04 1uor s SER 342 Ca 0.06 2.11 -0.33 0.00 0.48 0.00 0.00 55.95 58.27 1uor s SER 342 Cb -0.08 -2.59 -0.12 0.00 0.10 0.00 0.00 66.02 63.33 1uor s SER 342 CO 0.01 -0.47 1.56 1.62 0.98 0.00 0.00 173.24 176.93 1uor h VAL 343 N 2.32 0.02 -1.30 5.02 3.04 -1.93 0.27 116.25 123.68 1uor h VAL 343 Ca -0.48 0.00 0.38 0.00 -1.01 0.00 0.00 66.70 65.59 1uor h VAL 343 Cb 1.22 0.02 -0.08 0.00 -2.01 0.00 0.00 31.29 30.44 1uor h VAL 343 CO 0.63 0.00 0.89 0.58 -1.01 0.00 0.00 177.57 178.66 1uor h VAL 344 N -0.57 0.31 0.44 1.51 2.07 -1.95 0.88 116.25 118.94 1uor h VAL 344 Ca 0.04 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1uor h VAL 344 Cb 0.68 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1uor h VAL 344 CO -0.43 0.02 -0.21 0.25 0.02 0.00 0.00 177.57 177.22 1uor h LEU 345 N 0.12 -0.50 -2.13 2.57 7.12 -0.86 -3.22 115.31 118.40 1uor h LEU 345 Ca 0.69 -0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.74 1uor h LEU 345 Cb 2.37 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 42.62 1uor h LEU 345 CO -0.17 -0.07 0.29 -0.07 -0.13 0.00 0.00 178.44 178.29 1uor h LEU 346 N -1.12 0.00 -0.80 2.25 4.07 0.18 1.04 115.31 120.93 1uor h LEU 346 Ca -0.06 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.78 1uor h LEU 346 Cb 0.50 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.22 1uor h LEU 346 CO 0.10 0.00 -0.57 0.25 -1.08 0.00 0.00 178.44 177.14 1uor h LEU 347 N 0.00 0.00 -0.91 1.67 7.12 -0.83 -0.53 115.31 121.82 1uor h LEU 347 Ca 0.12 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 58.04 1uor h LEU 347 Cb 0.71 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.82 1uor h LEU 347 CO -0.00 0.57 -0.20 0.03 -0.13 0.00 0.00 178.44 178.70 1uor h ARG 348 N 0.00 0.57 0.00 1.25 3.08 0.11 -2.28 114.38 117.11 1uor h ARG 348 Ca -0.01 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 59.84 1uor h ARG 348 Cb 1.06 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1uor h ARG 348 CO 0.07 0.74 0.00 -0.07 -1.07 0.00 0.00 179.97 179.64 1uor h LEU 349 N 0.51 0.00 -1.54 3.04 3.38 -1.09 -2.29 115.31 117.32 1uor h LEU 349 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1uor h LEU 349 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1uor h LEU 349 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1uor n ALA 350 N -1.99 2.50 0.07 1.53 0.00 -0.25 -2.37 120.51 120.00 1uor n ALA 350 Ca 0.02 -0.65 0.01 0.00 0.00 0.00 0.00 53.44 52.83 1uor n ALA 350 Cb 0.35 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.82 1uor n ALA 350 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uor n LYS 351 N 0.79 0.31 0.00 0.00 4.01 -0.89 -4.03 118.16 118.36 1uor n LYS 351 Ca 0.17 -0.91 0.07 0.00 -0.51 0.00 0.00 58.31 57.13 1uor n LYS 351 Cb 0.46 -1.05 -0.07 0.00 -0.51 0.00 0.00 35.03 33.86 1uor n LYS 351 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1uor n THR 352 N 0.04 0.00 0.00 -0.18 -1.04 -0.88 -3.15 114.28 109.07 1uor n THR 352 Ca 0.02 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1uor n THR 352 Cb 0.12 1.03 0.00 0.00 -1.82 0.00 0.00 70.33 69.66 1uor n THR 352 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1uor n TYR 353 N -1.15 0.00 -0.34 -1.42 9.36 -1.00 -3.90 117.16 118.71 1uor n TYR 353 Ca 0.03 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.38 1uor n TYR 353 Cb 0.23 -0.15 0.26 0.00 -0.63 0.00 0.00 39.34 39.05 1uor n TYR 353 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1uor h GLU 354 N 0.00 0.01 0.39 2.98 4.81 -1.74 0.28 114.58 121.30 1uor h GLU 354 Ca 0.00 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1uor h GLU 354 Cb 0.00 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1uor h GLU 354 CO 0.00 0.01 -0.19 1.15 -0.73 0.00 0.00 179.01 179.25 1uor h THR 355 N 0.01 0.00 -0.31 0.32 2.02 -1.80 -3.27 112.91 109.88 1uor h THR 355 Ca 0.57 -0.11 0.07 0.00 0.77 0.00 0.00 66.41 67.71 1uor h THR 355 Cb 1.12 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.45 1uor h THR 355 CO -0.94 0.00 -0.23 0.74 0.37 0.00 0.00 175.52 175.47 1uor h THR 356 N -0.62 0.40 0.00 3.16 2.02 -0.66 1.02 112.91 118.22 1uor h THR 356 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1uor h THR 356 Cb 0.40 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1uor h THR 356 CO 0.09 0.00 0.09 -0.07 0.37 0.00 0.00 175.52 176.00 1uor h LEU 357 N -0.20 0.00 0.00 2.58 4.07 -1.20 1.44 115.31 121.99 1uor h LEU 357 Ca 0.16 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.88 1uor h LEU 357 Cb 0.45 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 1uor h LEU 357 CO -0.43 0.00 -1.95 -0.62 -1.08 0.00 0.00 178.44 174.36 1uor n GLU 358 N -2.26 0.66 0.33 1.13 4.71 0.32 -1.49 120.64 124.04 1uor n GLU 358 Ca -0.01 0.06 0.20 0.00 -0.01 0.00 0.00 57.16 57.40 1uor n GLU 358 Cb 0.13 -1.64 1.13 0.00 -1.01 0.00 0.00 31.44 30.05 1uor n GLU 358 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 1uor h LYS 359 N 0.00 0.00 0.00 3.49 1.79 0.47 -3.36 116.57 118.96 1uor h LYS 359 Ca -0.31 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 57.97 1uor h LYS 359 Cb 1.81 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 32.31 1uor h LYS 359 CO 0.04 0.00 -0.29 0.00 -1.08 0.00 0.00 179.45 178.12 1uor n ALA 362 N -1.50 0.00 -2.88 0.00 0.00 -1.26 -4.83 120.51 110.04 1uor n ALA 362 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.12 1uor n ALA 362 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.70 1uor n ALA 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor s ALA 363 N -4.00 3.88 -0.73 0.00 0.00 -1.26 -4.86 121.76 114.79 1uor s ALA 363 Ca 0.00 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.21 1uor s ALA 363 Cb 0.00 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.21 1uor s ALA 363 CO 0.00 0.69 0.63 0.00 0.00 0.00 0.00 175.76 177.08 1uor n ALA 364 N 1.37 -1.63 -0.86 0.00 0.00 -1.26 -4.85 120.51 113.29 1uor n ALA 364 Ca -0.15 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 52.99 1uor n ALA 364 Cb 0.53 -3.15 0.10 0.00 0.00 0.00 0.00 19.45 16.93 1uor n ALA 364 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1uor n ASP 365 N -2.55 -3.33 0.00 0.00 5.68 -1.26 -5.06 116.55 110.03 1uor n ASP 365 Ca -0.10 0.10 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1uor n ASP 365 Cb 0.59 -0.88 0.00 0.00 -1.14 0.00 0.00 41.12 39.69 1uor n ASP 365 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 1uor n PRO 366 N 0.13 0.00 0.04 0.11 -0.04 -1.26 -5.06 135.00 128.92 1uor n PRO 366 Ca 0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.46 1uor n PRO 366 Cb 0.61 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.99 1uor n PRO 366 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1uor h HIS 367 N 0.00 0.00 -0.52 0.54 3.86 -1.97 -3.37 115.15 113.69 1uor h HIS 367 Ca 0.00 0.00 0.15 0.00 -1.16 0.00 0.00 60.37 59.36 1uor h HIS 367 Cb 0.00 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1uor h HIS 367 CO 0.00 0.65 0.54 0.93 0.86 0.00 0.00 177.93 180.92 1uor h GLU 368 N 0.00 0.00 -0.36 2.45 4.39 -1.97 -1.70 114.58 117.40 1uor h GLU 368 Ca -0.16 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.60 1uor h GLU 368 Cb 1.64 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 30.20 1uor h GLU 368 CO 0.06 0.00 -0.50 0.00 -1.16 0.00 0.00 179.01 177.41 1uor n TYR 370 N -5.40 0.01 -1.72 0.00 0.18 -0.65 -4.67 117.16 104.90 1uor n TYR 370 Ca -0.03 -0.01 -0.42 0.00 1.88 0.00 0.00 57.90 59.32 1uor n TYR 370 Cb 0.35 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.28 1uor n TYR 370 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1uor s ALA 371 N -1.99 3.24 -0.85 -3.48 0.00 0.38 -2.88 121.76 116.18 1uor s ALA 371 Ca 0.40 1.00 -0.22 0.00 0.00 0.00 0.00 51.96 53.15 1uor s ALA 371 Cb 0.19 -3.92 0.03 0.00 0.00 0.00 0.00 23.12 19.42 1uor s ALA 371 CO 0.32 -2.05 0.50 1.63 0.00 0.00 0.00 175.76 176.15 1uor n LYS 372 N 7.97 -0.55 -0.35 0.00 5.02 -1.26 -4.79 118.16 124.21 1uor n LYS 372 Ca 0.23 0.02 0.26 0.00 -2.02 0.00 0.00 58.31 56.80 1uor n LYS 372 Cb 0.43 -1.58 0.50 0.00 -0.02 0.00 0.00 35.03 34.36 1uor n LYS 372 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1uor h VAL 373 N -0.98 0.29 -0.79 -0.18 -1.51 -1.80 0.17 116.25 111.45 1uor h VAL 373 Ca -0.53 -0.10 0.23 0.00 -1.23 0.00 0.00 66.70 65.07 1uor h VAL 373 Cb 1.05 -0.03 -0.03 0.00 -2.13 0.00 0.00 31.29 30.15 1uor h VAL 373 CO 0.37 0.05 0.94 -0.26 -1.23 0.00 0.00 177.57 177.44 1uor h PHE 374 N 0.29 0.00 -0.54 5.19 -1.00 -1.86 0.81 116.94 119.83 1uor h PHE 374 Ca 0.74 0.00 -0.39 0.00 2.81 0.00 0.00 57.97 61.12 1uor h PHE 374 Cb 1.79 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 41.00 1uor h PHE 374 CO -0.01 0.00 -0.81 -0.25 -1.61 0.00 0.00 178.31 175.63 1uor n ASP 375 N -3.37 3.75 0.00 2.17 9.92 0.58 -4.15 116.55 125.45 1uor n ASP 375 Ca 0.17 -3.48 0.00 0.00 -0.53 0.00 0.00 54.79 50.95 1uor n ASP 375 Cb 1.20 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 41.29 1uor n ASP 375 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1uor n GLU 376 N -0.72 0.00 -0.02 -1.24 -0.00 0.24 -4.88 120.64 114.01 1uor n GLU 376 Ca 0.33 -0.13 -0.13 0.00 -0.00 0.00 0.00 57.16 57.24 1uor n GLU 376 Cb 0.90 -0.40 -0.07 0.00 -0.00 0.00 0.00 31.44 31.88 1uor n GLU 376 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.13 177.87 1uor h PHE 377 N 0.00 -1.33 0.00 -1.84 0.04 -0.37 -3.33 116.94 110.10 1uor h PHE 377 Ca 0.00 0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1uor h PHE 377 Cb 0.66 0.61 0.00 0.00 2.20 0.00 0.00 35.95 39.42 1uor h PHE 377 CO 0.00 -0.49 0.77 -0.22 -0.60 0.00 0.00 178.31 177.77 1uor h LYS 378 N -0.49 0.00 0.47 1.51 3.64 -1.79 0.17 116.57 120.07 1uor h LYS 378 Ca 0.07 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1uor h LYS 378 Cb 0.64 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1uor h LYS 378 CO -0.44 0.00 -0.36 -1.35 -2.27 0.00 0.00 179.45 175.03 1uor h PRO 379 N 0.00 -0.79 -2.21 1.90 0.10 -1.97 -3.00 132.00 126.04 1uor h PRO 379 Ca 0.00 0.05 -0.17 0.00 0.10 0.00 0.00 66.00 65.99 1uor h PRO 379 Cb 1.54 0.18 -0.06 0.00 0.10 0.00 0.00 31.00 32.77 1uor h PRO 379 CO 0.00 -0.52 -0.13 1.47 0.10 0.00 0.00 178.00 178.91 1uor n LEU 380 N -5.48 4.37 0.00 2.35 -0.00 0.60 -0.61 117.00 118.23 1uor n LEU 380 Ca -0.11 -2.73 0.00 0.00 -0.00 0.00 0.00 56.01 53.17 1uor n LEU 380 Cb 0.38 -1.17 0.00 0.00 -0.00 0.00 0.00 43.42 42.63 1uor n LEU 380 CO 0.31 1.31 0.00 0.52 -0.00 0.00 0.00 177.39 179.53 1uor n VAL 381 N 2.62 0.00 -0.07 1.47 0.31 -1.23 -4.86 118.33 116.56 1uor n VAL 381 Ca 0.36 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.54 1uor n VAL 381 Cb 0.74 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.54 1uor n VAL 381 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1uor h GLU 382 N 0.00 0.00 -0.68 5.55 4.39 -0.71 -3.35 114.58 119.78 1uor h GLU 382 Ca 0.00 -0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.83 1uor h GLU 382 Cb 0.00 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 1uor h GLU 382 CO 0.00 1.00 0.20 1.49 -1.16 0.00 0.00 179.01 180.54 1uor h GLU 383 N -1.00 0.32 0.00 2.33 4.57 -1.86 0.12 114.58 119.07 1uor h GLU 383 Ca -0.05 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1uor h GLU 383 Cb 1.05 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.57 1uor h GLU 383 CO -0.03 0.21 0.00 -0.35 -1.18 0.00 0.00 179.01 177.66 1uor n PRO 384 N -5.08 0.00 -0.36 0.92 -0.04 -1.26 0.22 135.00 129.39 1uor n PRO 384 Ca 0.12 0.42 0.28 0.00 -0.04 0.00 0.00 63.50 64.27 1uor n PRO 384 Cb 0.37 -1.30 0.43 0.00 -0.04 0.00 0.00 33.50 32.96 1uor n PRO 384 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1uor n GLN 385 N -1.59 0.00 -0.06 0.54 6.02 -0.62 0.25 117.38 121.93 1uor n GLN 385 Ca 0.00 0.58 -0.04 0.00 -0.01 0.00 0.00 57.00 57.54 1uor n GLN 385 Cb 0.00 -1.36 -0.01 0.00 1.02 0.00 0.00 30.24 29.89 1uor n GLN 385 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 1uor h ASN 386 N 0.00 0.00 -0.99 1.08 4.21 -0.71 -3.43 115.58 115.74 1uor h ASN 386 Ca 0.49 0.00 0.37 0.00 1.21 0.00 0.00 56.30 58.37 1uor h ASN 386 Cb 2.01 0.00 -0.17 0.00 -1.12 0.00 0.00 38.32 39.05 1uor h ASN 386 CO -0.01 0.60 0.48 0.25 -1.29 0.00 0.00 177.43 177.46 1uor h LEU 387 N -0.80 0.27 -0.54 1.61 5.85 0.42 1.23 115.31 123.35 1uor h LEU 387 Ca 0.00 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1uor h LEU 387 Cb 0.40 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1uor h LEU 387 CO 0.00 -0.33 0.00 -0.38 -0.34 0.00 0.00 178.44 177.39 1uor n ILE 388 N -5.22 0.00 -0.02 4.05 2.08 -1.02 0.90 119.36 120.12 1uor n ILE 388 Ca 0.34 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.63 1uor n ILE 388 Cb 1.11 -0.24 -0.01 0.00 -0.75 0.00 0.00 39.64 39.75 1uor n ILE 388 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 1uor n LYS 389 N -0.04 0.15 -0.13 0.38 4.81 0.42 -2.54 118.16 121.21 1uor n LYS 389 Ca 0.00 0.26 -0.01 0.00 -0.87 0.00 0.00 58.31 57.69 1uor n LYS 389 Cb 0.04 -0.98 0.03 0.00 0.02 0.00 0.00 35.03 34.15 1uor n LYS 389 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 1uor n GLN 390 N -3.03 1.30 0.00 1.64 -0.06 -0.47 0.64 117.38 117.40 1uor n GLN 390 Ca -0.03 -0.36 0.00 0.00 -2.00 0.00 0.00 57.00 54.61 1uor n GLN 390 Cb 0.10 -1.35 0.00 0.00 -4.06 0.00 0.00 30.24 24.93 1uor n GLN 390 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1uor n ASN 391 N 0.20 0.00 -1.62 1.69 5.03 0.26 -4.87 115.26 115.95 1uor n ASN 391 Ca 0.05 0.01 -0.04 0.00 0.87 0.00 0.00 54.58 55.47 1uor n ASN 391 Cb 0.51 -0.04 -0.02 0.00 -1.02 0.00 0.00 39.78 39.21 1uor n ASN 391 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1uor n GLU 393 N 1.47 0.00 -0.43 0.00 2.13 0.21 -4.25 120.64 119.77 1uor n GLU 393 Ca 0.09 0.00 0.37 0.00 0.66 0.00 0.00 57.16 58.28 1uor n GLU 393 Cb 0.56 -0.15 0.69 0.00 0.27 0.00 0.00 31.44 32.81 1uor n GLU 393 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1uor h LEU 394 N 0.00 0.15 0.00 4.31 7.12 -1.70 -0.59 115.31 124.60 1uor h LEU 394 Ca 0.00 0.05 -0.00 0.00 0.13 0.00 0.00 57.88 58.06 1uor h LEU 394 Cb 0.28 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.45 1uor h LEU 394 CO 0.00 -0.03 -0.08 -0.26 -0.13 0.00 0.00 178.44 177.94 1uor h PHE 395 N 0.10 0.00 0.00 1.25 0.04 -1.82 -3.28 116.94 113.23 1uor h PHE 395 Ca 0.71 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.48 1uor h PHE 395 Cb 2.49 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.64 1uor h PHE 395 CO -0.00 0.13 0.00 -1.91 -0.60 0.00 0.00 178.31 175.93 1uor n GLU 396 N -4.74 0.00 -2.41 1.51 2.13 -0.23 0.14 120.64 117.04 1uor n GLU 396 Ca -0.02 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.37 1uor n GLU 396 Cb 0.09 -0.22 0.01 0.00 0.27 0.00 0.00 31.44 31.59 1uor n GLU 396 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1uor n GLN 397 N 0.00 3.75 0.00 5.31 7.27 -1.21 -3.74 117.38 128.75 1uor n GLN 397 Ca 0.00 -3.65 0.00 0.00 0.07 0.00 0.00 57.00 53.42 1uor n GLN 397 Cb 0.00 -2.87 0.00 0.00 2.41 0.00 0.00 30.24 29.78 1uor n GLN 397 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1uor n LEU 398 N 3.50 0.00 0.00 1.69 7.94 0.89 -4.83 117.00 126.19 1uor n LEU 398 Ca 0.38 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.28 1uor n LEU 398 Cb 0.36 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.31 1uor n LEU 398 CO 0.81 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.70 1uor n GLY 399 N 0.00 2.57 0.00 -3.96 0.00 0.38 -4.37 105.19 99.81 1uor n GLY 399 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1uor n GLY 399 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uor n GLU 400 N 0.00 0.00 0.00 1.61 4.71 -1.26 -3.71 120.64 121.99 1uor n GLU 400 Ca 0.00 0.37 0.03 0.00 -0.01 0.00 0.00 57.16 57.55 1uor n GLU 400 Cb 0.00 -1.26 -0.02 0.00 -1.01 0.00 0.00 31.44 29.15 1uor n GLU 400 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 1uor n TYR 401 N -1.45 0.00 0.00 -0.32 4.19 -1.26 -3.84 117.16 114.48 1uor n TYR 401 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1uor n TYR 401 Cb 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 1uor n TYR 401 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1uor n LYS 402 N -0.73 0.00 -2.05 2.98 3.00 -1.26 -4.57 118.16 115.53 1uor n LYS 402 Ca 0.02 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.96 1uor n LYS 402 Cb 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 35.03 34.93 1uor n LYS 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1uor n PHE 403 N 0.00 2.49 0.18 5.64 3.01 -1.25 -3.05 117.46 124.47 1uor n PHE 403 Ca 0.00 -2.46 0.06 0.00 1.01 0.00 0.00 57.45 56.06 1uor n PHE 403 Cb 0.00 -1.44 0.23 0.00 -0.01 0.00 0.00 39.48 38.25 1uor n PHE 403 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 1uor h GLN 404 N 3.85 0.00 -1.99 -1.08 3.07 -1.66 -3.29 115.11 114.01 1uor h GLN 404 Ca 0.57 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 59.15 1uor h GLN 404 Cb 0.35 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.85 1uor h GLN 404 CO 1.25 0.34 -0.22 0.27 0.09 0.00 0.00 178.83 180.56 1uor n ASN 405 N -3.30 5.36 -0.12 0.06 2.04 -1.17 -2.83 115.26 115.30 1uor n ASN 405 Ca 0.01 -2.51 -0.17 0.00 -0.44 0.00 0.00 54.58 51.47 1uor n ASN 405 Cb 0.58 -1.32 -0.11 0.00 -2.53 0.00 0.00 39.78 36.41 1uor n ASN 405 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1uor n ALA 406 N 2.09 1.50 0.27 -2.53 0.00 -1.24 -4.34 120.51 116.26 1uor n ALA 406 Ca 0.31 -0.99 0.16 0.00 0.00 0.00 0.00 53.44 52.93 1uor n ALA 406 Cb 0.78 -0.02 0.68 0.00 0.00 0.00 0.00 19.45 20.89 1uor n ALA 406 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1uor h LEU 407 N -0.06 0.00 0.22 0.00 3.38 -1.82 0.37 115.31 117.41 1uor h LEU 407 Ca -0.52 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 1uor h LEU 407 Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 1uor h LEU 407 CO -0.10 0.04 -0.11 -0.07 0.09 0.00 0.00 178.44 178.30 1uor h LEU 408 N 0.00 -0.26 -1.00 1.67 3.38 -1.80 -0.12 115.31 117.19 1uor h LEU 408 Ca -0.00 0.01 0.32 0.00 0.09 0.00 0.00 57.88 58.30 1uor h LEU 408 Cb 0.52 0.07 -0.18 0.00 0.09 0.00 0.00 40.66 41.15 1uor h LEU 408 CO 0.01 -0.18 0.21 0.58 0.09 0.00 0.00 178.44 179.14 1uor h VAL 409 N -0.30 0.01 0.75 1.22 2.07 -1.59 1.37 116.25 119.78 1uor h VAL 409 Ca -0.03 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 1uor h VAL 409 Cb 0.23 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.01 1uor h VAL 409 CO 0.05 0.00 -0.36 0.03 0.02 0.00 0.00 177.57 177.31 1uor h ARG 410 N 0.01 -0.97 -0.11 1.57 3.08 -0.96 -3.04 114.38 113.96 1uor h ARG 410 Ca 0.69 0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.77 1uor h ARG 410 Cb 1.59 0.22 -0.00 0.00 0.08 0.00 0.00 29.97 31.85 1uor h ARG 410 CO -0.87 -0.65 -0.05 1.88 -1.07 0.00 0.00 179.97 179.21 1uor h TYR 411 N -1.13 0.26 -0.13 3.04 -1.99 0.14 -0.80 116.97 116.36 1uor h TYR 411 Ca -0.10 -0.06 0.04 0.00 2.00 0.00 0.00 58.73 60.60 1uor h TYR 411 Cb 0.77 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 39.44 1uor h TYR 411 CO 0.03 0.58 0.45 1.15 -0.00 0.00 0.00 178.16 180.36 1uor h THR 412 N -0.13 0.09 0.00 -2.88 2.02 0.15 0.66 112.91 112.83 1uor h THR 412 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1uor h THR 412 Cb 0.51 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1uor h THR 412 CO 0.02 0.00 -0.29 0.11 0.37 0.00 0.00 175.52 175.73 1uor h LYS 413 N 0.00 0.00 0.00 6.66 1.57 -1.11 -3.32 116.57 120.36 1uor h LYS 413 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1uor h LYS 413 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1uor h LYS 413 CO -0.00 0.00 0.00 0.36 -0.57 0.00 0.00 179.45 179.24 1uor n LYS 414 N -3.82 0.16 -3.00 3.15 2.85 -0.42 -3.55 118.16 113.52 1uor n LYS 414 Ca -0.04 0.43 -0.14 0.00 -1.05 0.00 0.00 58.31 57.51 1uor n LYS 414 Cb 0.15 -1.82 -0.03 0.00 -0.65 0.00 0.00 35.03 32.68 1uor n LYS 414 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1uor n VAL 415 N -2.12 -0.46 -1.33 0.58 3.14 0.15 -3.59 118.33 114.68 1uor n VAL 415 Ca 0.02 -2.18 -0.24 0.00 -2.96 0.00 0.00 64.34 58.98 1uor n VAL 415 Cb 0.19 -0.09 0.15 0.00 -1.06 0.00 0.00 33.84 33.03 1uor n VAL 415 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1uor n PRO 416 N 2.53 2.38 0.00 1.45 -0.04 -1.23 -4.09 135.00 135.99 1uor n PRO 416 Ca 0.21 -3.18 0.00 0.00 -0.04 0.00 0.00 63.50 60.49 1uor n PRO 416 Cb 0.54 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 1uor n PRO 416 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1uor n GLN 417 N -1.06 3.46 -1.26 0.54 3.00 -1.26 -5.02 117.38 115.78 1uor n GLN 417 Ca 0.56 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 57.19 1uor n GLN 417 Cb 1.25 -0.57 0.08 0.00 0.00 0.00 0.00 30.24 31.01 1uor n GLN 417 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1uor n VAL 418 N -0.84 2.04 -2.05 5.09 0.31 -1.26 -4.80 118.33 116.82 1uor n VAL 418 Ca 0.00 -0.37 -0.40 0.00 -0.01 0.00 0.00 64.34 63.57 1uor n VAL 418 Cb 0.00 -0.88 -0.01 0.00 -0.91 0.00 0.00 33.84 32.05 1uor n VAL 418 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1uor s SER 419 N -1.59 6.40 0.23 4.52 0.01 -1.26 -4.74 113.70 117.26 1uor s SER 419 Ca 0.68 2.68 -0.08 0.00 1.31 0.00 0.00 55.95 60.54 1uor s SER 419 Cb -0.34 -2.64 0.37 0.00 0.21 0.00 0.00 66.02 63.62 1uor s SER 419 CO 0.55 -0.79 1.69 0.74 0.41 0.00 0.00 173.24 175.84 1uor h THR 420 N 2.60 0.56 0.09 1.44 2.02 -1.99 1.34 112.91 118.97 1uor h THR 420 Ca -0.50 -0.09 0.01 0.00 0.77 0.00 0.00 66.41 66.61 1uor h THR 420 Cb 1.24 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1uor h THR 420 CO 0.63 0.05 -0.14 1.55 0.37 0.00 0.00 175.52 177.97 1uor h PRO 421 N 0.25 -0.28 0.00 6.66 0.13 -1.97 -1.12 132.00 135.67 1uor h PRO 421 Ca 0.36 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.51 1uor h PRO 421 Cb 0.58 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1uor h PRO 421 CO -0.47 -0.19 0.00 2.41 -0.23 0.00 0.00 178.00 179.53 1uor n THR 422 N -5.27 0.74 -0.00 1.56 -1.04 0.43 0.26 114.28 110.95 1uor n THR 422 Ca -0.07 0.18 -0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1uor n THR 422 Cb 0.19 -1.04 -0.00 0.00 -1.82 0.00 0.00 70.33 67.65 1uor n THR 422 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1uor h LEU 423 N 0.00 0.00 0.00 -4.42 -0.00 -0.31 -3.39 115.31 107.19 1uor h LEU 423 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1uor h LEU 423 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.73 1uor h LEU 423 CO 0.00 0.00 0.12 0.52 -0.00 0.00 0.00 178.44 179.08 1uor n VAL 424 N -2.12 1.21 -0.04 1.22 0.31 0.73 0.16 118.33 119.79 1uor n VAL 424 Ca -0.00 0.42 -0.16 0.00 -0.01 0.00 0.00 64.34 64.59 1uor n VAL 424 Cb 0.00 -1.42 -0.13 0.00 -0.91 0.00 0.00 33.84 31.38 1uor n VAL 424 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1uor h GLU 425 N 0.00 0.07 0.44 5.55 4.22 0.10 -3.36 114.58 121.60 1uor h GLU 425 Ca 0.00 -0.12 -0.02 0.00 0.08 0.00 0.00 59.36 59.30 1uor h GLU 425 Cb 0.24 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1uor h GLU 425 CO 0.00 1.06 -0.21 0.28 -2.18 0.00 0.00 179.01 177.96 1uor h VAL 426 N -0.85 0.15 -0.79 0.32 2.07 0.14 -2.29 116.25 115.00 1uor h VAL 426 Ca -0.06 -0.59 0.12 0.00 0.82 0.00 0.00 66.70 66.99 1uor h VAL 426 Cb 1.18 0.23 -0.12 0.00 -1.52 0.00 0.00 31.29 31.06 1uor h VAL 426 CO 0.02 0.03 -0.32 -1.20 0.02 0.00 0.00 177.57 176.13 1uor n SER 427 N -5.17 -0.54 -0.01 0.57 7.64 0.11 0.10 113.62 116.32 1uor n SER 427 Ca -0.08 1.38 -0.18 0.00 1.01 0.00 0.00 58.87 61.00 1uor n SER 427 Cb 0.26 -0.30 -0.08 0.00 -1.01 0.00 0.00 64.21 63.07 1uor n SER 427 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1uor h ARG 428 N 0.00 0.71 0.50 1.43 0.11 -1.71 -1.79 114.38 113.63 1uor h ARG 428 Ca 0.26 -0.62 -0.02 0.00 0.10 0.00 0.00 59.98 59.71 1uor h ARG 428 Cb 0.46 0.14 -0.02 0.00 1.11 0.00 0.00 29.97 31.66 1uor h ARG 428 CO -0.78 1.23 -0.46 -0.91 0.10 0.00 0.00 179.97 179.15 1uor h ASN 429 N 0.41 -1.25 0.42 0.08 -0.26 0.13 0.36 115.58 115.45 1uor h ASN 429 Ca -0.06 0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.77 1uor h ASN 429 Cb 1.41 0.41 0.00 0.00 -1.06 0.00 0.00 38.32 39.08 1uor h ASN 429 CO 0.16 -0.62 0.00 0.00 -1.06 0.00 0.00 177.43 175.90 1uor n LEU 430 N -5.25 0.15 0.34 1.61 -0.00 0.15 0.13 117.00 114.13 1uor n LEU 430 Ca -0.11 0.55 -0.18 0.00 -0.00 0.00 0.00 56.01 56.26 1uor n LEU 430 Cb 0.43 -0.53 -0.10 0.00 -0.00 0.00 0.00 43.42 43.22 1uor n LEU 430 CO 0.25 -0.40 0.55 1.23 -0.00 0.00 0.00 177.39 179.03 1uor h GLY 431 N 1.83 -1.22 -0.06 1.47 0.00 -0.09 -3.33 103.07 101.68 1uor h GLY 431 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1uor h GLY 431 CO 0.00 -0.39 0.00 0.28 0.00 0.00 0.00 176.54 176.43 1uor n LYS 432 N -5.57 0.00 -0.01 4.80 5.02 0.35 -1.17 118.16 121.58 1uor n LYS 432 Ca -0.13 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 55.99 1uor n LYS 432 Cb 0.46 -1.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.35 1uor n LYS 432 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1uor h VAL 433 N 0.00 1.56 -0.80 -0.18 2.07 -1.67 -3.09 116.25 114.14 1uor h VAL 433 Ca 0.00 -2.20 0.19 0.00 0.82 0.00 0.00 66.70 65.51 1uor h VAL 433 Cb 0.00 2.96 -0.14 0.00 -1.52 0.00 0.00 31.29 32.59 1uor h VAL 433 CO 0.00 0.61 0.06 1.23 0.02 0.00 0.00 177.57 179.49 1uor h GLY 434 N -0.47 0.99 0.00 2.17 0.00 -1.40 -2.17 103.07 102.18 1uor h GLY 434 Ca -0.06 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1uor h GLY 434 CO 0.08 -0.32 0.00 1.44 0.00 0.00 0.00 176.54 177.75 1uor n SER 435 N -5.32 0.00 -0.88 0.19 7.64 -1.25 -2.74 113.62 111.26 1uor n SER 435 Ca 0.16 0.72 0.00 0.00 1.01 0.00 0.00 58.87 60.76 1uor n SER 435 Cb 0.54 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1uor n SER 435 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1uor n LYS 436 N -1.56 0.85 0.00 1.43 4.81 -0.93 -3.49 118.16 119.27 1uor n LYS 436 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1uor n LYS 436 Cb 0.00 -1.16 0.00 0.00 0.02 0.00 0.00 35.03 33.89 1uor n LYS 436 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1uor n LYS 439 N -4.89 2.95 0.00 0.00 5.02 -1.23 -2.67 118.16 117.34 1uor n LYS 439 Ca 0.02 -1.88 0.00 0.00 -2.02 0.00 0.00 58.31 54.43 1uor n LYS 439 Cb 0.09 -2.66 0.00 0.00 -0.02 0.00 0.00 35.03 32.44 1uor n LYS 439 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1uor n HIS 440 N 3.99 0.00 0.00 2.13 -0.00 -1.11 -4.99 115.22 115.24 1uor n HIS 440 Ca 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.35 1uor n HIS 440 Cb 0.19 0.06 0.00 0.00 -0.00 0.00 0.00 29.99 30.24 1uor n HIS 440 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1uor n PRO 441 N 0.00 2.93 0.00 1.57 -0.04 -1.09 -4.32 135.00 134.06 1uor n PRO 441 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1uor n PRO 441 Cb 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.55 1uor n PRO 441 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uor n GLU 442 N 0.00 0.00 0.35 0.54 4.71 -1.26 -2.80 120.64 122.18 1uor n GLU 442 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.16 56.99 1uor n GLU 442 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 31.44 30.35 1uor n GLU 442 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uor h ALA 443 N 0.00 -1.21 -1.15 0.62 0.00 -1.93 -3.37 119.26 112.22 1uor h ALA 443 Ca 0.00 -0.20 0.33 0.00 0.00 0.00 0.00 54.91 55.04 1uor h ALA 443 Cb 0.00 0.49 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1uor h ALA 443 CO 0.00 -1.17 1.13 0.87 0.00 0.00 0.00 179.25 180.08 1uor h LYS 444 N -0.97 0.00 0.00 0.00 6.56 -1.84 -0.69 116.57 119.64 1uor h LYS 444 Ca -0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.50 1uor h LYS 444 Cb 0.77 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.43 1uor h LYS 444 CO 0.10 0.00 0.00 -2.13 -2.06 0.00 0.00 179.45 175.36 1uor n ARG 445 N -3.51 0.00 -0.19 3.15 0.63 -1.12 -3.84 116.66 111.78 1uor n ARG 445 Ca 0.25 0.45 -0.04 0.00 -0.92 0.00 0.00 57.85 57.59 1uor n ARG 445 Cb 1.48 -1.22 0.06 0.00 0.45 0.00 0.00 32.46 33.24 1uor n ARG 445 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 1uor h MET 446 N 0.00 0.60 -1.06 -0.14 4.05 -1.36 -0.94 114.93 116.08 1uor h MET 446 Ca 0.00 -0.04 0.28 0.00 -0.28 0.00 0.00 59.70 59.67 1uor h MET 446 Cb 0.00 -0.14 -0.08 0.00 -0.80 0.00 0.00 31.60 30.59 1uor h MET 446 CO 0.00 0.40 0.71 -1.35 0.23 0.00 0.00 176.91 176.90 1uor h PRO 447 N 0.62 0.25 -0.13 0.39 0.11 -1.73 0.36 132.00 131.87 1uor h PRO 447 Ca 0.24 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.19 1uor h PRO 447 Cb 0.09 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.15 1uor h PRO 447 CO -0.14 0.16 -0.49 0.00 -0.21 0.00 0.00 178.00 177.33 1uor n ALA 449 N -2.54 4.29 -0.08 0.00 0.00 0.12 0.71 120.51 123.02 1uor n ALA 449 Ca -0.07 -0.51 -0.14 0.00 0.00 0.00 0.00 53.44 52.72 1uor n ALA 449 Cb 0.59 -0.65 -0.11 0.00 0.00 0.00 0.00 19.45 19.28 1uor n ALA 449 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1uor h GLU 450 N 0.00 0.00 -0.80 0.00 4.81 -1.63 -3.33 114.58 113.63 1uor h GLU 450 Ca 0.00 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.33 1uor h GLU 450 Cb 0.44 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 29.70 1uor h GLU 450 CO 0.00 0.84 -0.50 -0.44 -0.73 0.00 0.00 179.01 178.18 1uor h ASP 451 N -1.00 -1.77 0.90 1.04 3.32 -1.66 0.59 116.42 117.84 1uor h ASP 451 Ca -0.08 0.29 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1uor h ASP 451 Cb 0.93 0.81 0.01 0.00 0.22 0.00 0.00 39.33 41.30 1uor h ASP 451 CO -0.05 -0.30 -0.44 0.22 -1.72 0.00 0.00 179.24 176.95 1uor h TYR 452 N -0.12 -1.16 -1.00 4.55 5.03 0.07 -1.17 116.97 123.18 1uor h TYR 452 Ca 0.20 -0.03 0.38 0.00 2.58 0.00 0.00 58.73 61.86 1uor h TYR 452 Cb 0.52 0.39 -0.18 0.00 1.55 0.00 0.00 36.73 39.01 1uor h TYR 452 CO -0.86 -0.71 0.42 -0.07 -1.32 0.00 0.00 178.16 175.62 1uor h LEU 453 N -1.23 0.15 -0.84 2.82 3.38 -1.58 0.25 115.31 118.25 1uor h LEU 453 Ca -0.12 0.26 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1uor h LEU 453 Cb 0.95 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 1uor h LEU 453 CO 0.20 -0.39 0.30 0.28 0.09 0.00 0.00 178.44 178.91 1uor h SER 454 N 0.03 1.06 -0.10 -0.43 0.02 0.12 -1.28 113.55 112.97 1uor h SER 454 Ca 0.78 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 61.56 1uor h SER 454 Cb 1.96 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 64.21 1uor h SER 454 CO -0.79 0.95 0.06 0.58 -1.14 0.00 0.00 176.83 176.49 1uor h VAL 455 N 1.12 1.06 0.11 2.27 2.07 0.60 -3.10 116.25 120.38 1uor h VAL 455 Ca 0.26 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 1uor h VAL 455 Cb 0.22 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1uor h VAL 455 CO -0.02 0.05 -0.05 0.58 0.02 0.00 0.00 177.57 178.15 1uor h VAL 456 N 0.11 0.98 -1.22 2.57 2.07 -0.53 0.13 116.25 120.35 1uor h VAL 456 Ca 0.04 -0.35 0.35 0.00 0.82 0.00 0.00 66.70 67.56 1uor h VAL 456 Cb 0.03 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.95 1uor h VAL 456 CO -0.01 0.08 0.89 -0.07 0.02 0.00 0.00 177.57 178.49 1uor h LEU 457 N -0.31 0.00 0.02 2.57 4.07 -1.47 0.29 115.31 120.48 1uor h LEU 457 Ca -0.02 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.76 1uor h LEU 457 Cb 0.25 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.01 1uor h LEU 457 CO 0.03 0.00 -0.73 -1.13 -1.08 0.00 0.00 178.44 175.52 1uor h ASN 458 N 0.00 0.61 -0.46 -0.43 -1.24 -0.73 0.34 115.58 113.67 1uor h ASN 458 Ca 0.58 -0.78 0.09 0.00 0.71 0.00 0.00 56.30 56.89 1uor h ASN 458 Cb 2.35 -0.19 -0.10 0.00 0.73 0.00 0.00 38.32 41.11 1uor h ASN 458 CO -0.01 1.31 -0.32 -0.61 -1.29 0.00 0.00 177.43 176.52 1uor h GLN 459 N -0.03 -0.21 -0.86 6.67 5.75 0.68 0.30 115.11 127.41 1uor h GLN 459 Ca -0.10 0.01 0.20 0.00 -0.15 0.00 0.00 58.65 58.62 1uor h GLN 459 Cb 1.45 0.05 -0.16 0.00 1.07 0.00 0.00 27.48 29.89 1uor h GLN 459 CO 0.14 -0.14 -0.04 1.25 -2.65 0.00 0.00 178.83 177.39 1uor h LEU 460 N -0.22 -0.50 -0.08 -2.39 5.85 -0.38 0.16 115.31 117.75 1uor h LEU 460 Ca 0.19 0.24 -0.18 0.00 0.84 0.00 0.00 57.88 58.97 1uor h LEU 460 Cb 0.54 0.44 0.01 0.00 0.37 0.00 0.00 40.66 42.02 1uor h LEU 460 CO -0.58 -0.26 -0.67 0.00 -0.34 0.00 0.00 178.44 176.59 1uor h VAL 462 N 0.21 1.36 0.00 0.00 -1.51 -0.02 -3.13 116.25 113.16 1uor h VAL 462 Ca -0.06 -2.04 0.00 0.00 -1.23 0.00 0.00 66.70 63.37 1uor h VAL 462 Cb 1.32 2.38 0.00 0.00 -2.13 0.00 0.00 31.29 32.87 1uor h VAL 462 CO 0.14 0.61 0.00 -0.11 -1.23 0.00 0.00 177.57 176.98 1uor n LEU 463 N -4.11 0.00 -3.75 4.19 7.94 0.51 -4.20 117.00 117.59 1uor n LEU 463 Ca -0.10 0.61 -0.34 0.00 -1.11 0.00 0.00 56.01 55.07 1uor n LEU 463 Cb 0.71 -0.22 -0.04 0.00 0.53 0.00 0.00 43.42 44.39 1uor n LEU 463 CO 0.49 -0.22 0.51 1.57 -1.11 0.00 0.00 177.39 178.63 1uor n HIS 464 N -1.97 3.22 -0.10 1.96 -0.00 -1.16 -4.05 115.22 113.13 1uor n HIS 464 Ca 0.00 -3.57 -0.14 0.00 0.46 0.00 0.00 57.72 54.46 1uor n HIS 464 Cb 0.00 -0.91 -0.06 0.00 -0.12 0.00 0.00 29.99 28.91 1uor n HIS 464 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1uor n GLU 465 N 1.25 0.52 0.00 1.57 1.02 -1.21 -4.80 120.64 119.00 1uor n GLU 465 Ca 0.27 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.81 1uor n GLU 465 Cb 0.37 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1uor n GLU 465 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1uor n LYS 466 N -4.46 0.00 -4.34 3.49 4.81 -1.26 -2.50 118.16 113.91 1uor n LYS 466 Ca -0.24 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 56.86 1uor n LYS 466 Cb 0.55 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.50 1uor n LYS 466 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1uor s THR 467 N -1.27 4.29 -0.18 3.15 2.01 -1.26 -5.11 115.64 117.27 1uor s THR 467 Ca 0.00 -0.24 -0.08 0.00 0.31 0.00 0.00 61.69 61.68 1uor s THR 467 Cb 0.00 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1uor s THR 467 CO 0.00 0.57 0.07 -2.84 -0.69 0.00 0.00 174.62 171.73 1uor s PRO 468 N -0.54 3.96 0.00 4.92 0.02 -1.04 -4.82 135.00 137.51 1uor s PRO 468 Ca 0.09 -0.32 0.00 0.00 0.02 0.00 0.00 61.00 60.79 1uor s PRO 468 Cb -0.12 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.17 1uor s PRO 468 CO 0.02 0.31 0.00 1.33 -0.33 0.00 0.00 177.00 178.33 1uor n VAL 469 N 3.43 0.00 -2.42 3.83 0.24 -1.26 -5.03 118.33 117.12 1uor n VAL 469 Ca -0.17 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.71 1uor n VAL 469 Cb 0.52 -0.01 -0.02 0.00 -1.47 0.00 0.00 33.84 32.86 1uor n VAL 469 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1uor s SER 470 N 0.87 6.36 0.63 -1.34 0.15 -1.26 -4.82 113.70 114.28 1uor s SER 470 Ca 0.00 0.62 0.27 0.00 0.70 0.00 0.00 55.95 57.55 1uor s SER 470 Cb 0.00 -2.54 1.41 0.00 -1.71 0.00 0.00 66.02 63.18 1uor s SER 470 CO 0.00 -1.46 1.81 0.44 1.20 0.00 0.00 173.24 175.24 1uor h ASP 471 N 10.45 0.00 0.17 5.45 5.19 -1.98 1.56 116.42 137.26 1uor h ASP 471 Ca -0.26 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.14 1uor h ASP 471 Cb 1.09 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.60 1uor h ASP 471 CO 1.12 0.00 -0.08 0.03 -3.12 0.00 0.00 179.24 177.19 1uor h ARG 472 N 0.00 -0.22 -0.50 3.56 2.47 -1.99 0.90 114.38 118.61 1uor h ARG 472 Ca 0.12 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.89 1uor h ARG 472 Cb 1.11 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.45 1uor h ARG 472 CO -0.00 0.10 0.33 0.28 0.56 0.00 0.00 179.97 181.24 1uor h VAL 473 N -0.56 1.07 -0.56 2.04 2.07 0.17 0.80 116.25 121.28 1uor h VAL 473 Ca -0.02 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.34 1uor h VAL 473 Cb 0.42 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 1uor h VAL 473 CO 0.04 0.11 0.30 0.74 0.02 0.00 0.00 177.57 178.78 1uor h THR 474 N 0.58 0.98 -0.19 2.57 2.02 -0.43 -2.88 112.91 115.56 1uor h THR 474 Ca 0.20 -0.20 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 1uor h THR 474 Cb 0.07 0.34 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1uor h THR 474 CO -0.05 0.11 -0.23 0.11 0.37 0.00 0.00 175.52 175.82 1uor h LYS 475 N 0.58 0.49 0.00 6.66 6.56 0.31 -2.47 116.57 128.70 1uor h LYS 475 Ca 0.24 -0.28 -0.14 0.00 -1.06 0.00 0.00 60.65 59.42 1uor h LYS 475 Cb 0.13 0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 1uor h LYS 475 CO -0.15 0.86 -0.67 0.00 -2.06 0.00 0.00 179.45 177.43 1uor h THR 478 N -0.54 0.58 -0.57 0.00 1.03 -1.43 -3.27 112.91 108.71 1uor h THR 478 Ca -0.05 0.00 0.06 0.00 -0.01 0.00 0.00 66.41 66.41 1uor h THR 478 Cb 0.35 0.58 -0.05 0.00 -1.07 0.00 0.00 68.15 67.95 1uor h THR 478 CO 0.08 0.00 0.28 -0.33 -0.01 0.00 0.00 175.52 175.53 1uor h GLU 479 N -0.50 0.51 -3.13 0.00 4.39 -1.18 -3.43 114.58 111.24 1uor h GLU 479 Ca -0.03 -0.03 -0.13 0.00 0.34 0.00 0.00 59.36 59.51 1uor h GLU 479 Cb 0.42 -0.11 -0.22 0.00 -0.10 0.00 0.00 28.75 28.73 1uor h GLU 479 CO 0.02 0.34 -0.35 0.45 -1.16 0.00 0.00 179.01 178.31 1uor s SER 480 N -5.50 -0.18 0.01 1.42 0.15 -1.23 -5.00 113.70 103.37 1uor s SER 480 Ca -0.13 0.18 -0.25 0.00 0.70 0.00 0.00 55.95 56.45 1uor s SER 480 Cb 0.15 0.38 -0.16 0.00 -1.71 0.00 0.00 66.02 64.68 1uor s SER 480 CO 0.74 -0.32 1.24 0.25 1.20 0.00 0.00 173.24 176.35 1uor h LEU 481 N 4.52 -0.41 -0.78 3.45 5.85 -1.84 -3.34 115.31 122.77 1uor h LEU 481 Ca -0.29 -0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.23 1uor h LEU 481 Cb 1.18 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1uor h LEU 481 CO 0.38 -0.05 -0.27 0.58 -0.34 0.00 0.00 178.44 178.74 1uor h VAL 482 N -0.80 0.58 -0.93 1.05 2.07 -1.94 -2.80 116.25 113.48 1uor h VAL 482 Ca -0.05 -1.36 -0.55 0.00 0.82 0.00 0.00 66.70 65.57 1uor h VAL 482 Cb 0.52 1.93 -0.29 0.00 -1.52 0.00 0.00 31.29 31.94 1uor h VAL 482 CO 0.08 0.26 0.60 0.59 0.02 0.00 0.00 177.57 179.13 1uor n ASN 483 N -3.33 5.07 0.08 0.57 4.13 -1.26 -4.67 115.26 115.85 1uor n ASN 483 Ca 0.01 -3.70 -0.07 0.00 1.68 0.00 0.00 54.58 52.50 1uor n ASN 483 Cb 0.51 -0.85 -0.05 0.00 -1.54 0.00 0.00 39.78 37.85 1uor n ASN 483 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1uor h ARG 484 N 1.40 -0.29 -0.00 3.52 3.08 -1.61 -3.18 114.38 117.30 1uor h ARG 484 Ca 0.58 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.65 1uor h ARG 484 Cb 1.98 0.07 0.00 0.00 0.08 0.00 0.00 29.97 32.09 1uor h ARG 484 CO 1.20 -0.03 -0.12 -2.13 -1.07 0.00 0.00 179.97 177.81 1uor n ARG 485 N -4.97 0.67 -0.68 0.04 0.00 -1.26 0.23 116.66 110.69 1uor n ARG 485 Ca -0.06 -0.24 0.05 0.00 -0.00 0.00 0.00 57.85 57.60 1uor n ARG 485 Cb 0.19 -1.49 0.31 0.00 0.00 0.00 0.00 32.46 31.47 1uor n ARG 485 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1uor n PRO 486 N -0.95 3.94 -0.00 -0.14 -0.04 -1.26 -4.33 135.00 132.23 1uor n PRO 486 Ca 0.14 -2.38 -0.00 0.00 -0.04 0.00 0.00 63.50 61.22 1uor n PRO 486 Cb 0.28 -2.08 -0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1uor n PRO 486 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uor h PHE 488 N -0.01 -0.57 -0.25 0.00 -1.00 -1.81 0.41 116.94 113.71 1uor h PHE 488 Ca 0.00 0.08 0.06 0.00 2.81 0.00 0.00 57.97 60.92 1uor h PHE 488 Cb 0.01 0.38 -0.07 0.00 3.61 0.00 0.00 35.95 39.88 1uor h PHE 488 CO -0.00 -0.38 -0.30 0.77 -1.61 0.00 0.00 178.31 176.79 1uor h SER 489 N -0.01 -0.96 -0.59 2.17 0.02 -1.80 -3.18 113.55 109.21 1uor h SER 489 Ca 0.40 0.16 -0.72 0.00 -0.84 0.00 0.00 61.79 60.79 1uor h SER 489 Cb 0.63 0.43 -0.07 0.00 0.14 0.00 0.00 62.40 63.53 1uor h SER 489 CO -0.90 -0.32 2.85 0.00 -1.14 0.00 0.00 176.83 177.32 1uor n ALA 490 N -2.88 6.14 -3.66 3.77 0.00 0.15 -4.70 120.51 119.32 1uor n ALA 490 Ca -0.01 -3.97 -0.05 0.00 0.00 0.00 0.00 53.44 49.41 1uor n ALA 490 Cb 0.32 -3.22 -0.07 0.00 0.00 0.00 0.00 19.45 16.48 1uor n ALA 490 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1uor s LEU 491 N 0.38 -0.86 0.00 0.00 2.96 -1.20 -4.90 118.68 115.06 1uor s LEU 491 Ca 0.51 1.31 0.01 0.00 -0.22 0.00 0.00 54.13 55.73 1uor s LEU 491 Cb 0.14 1.90 0.06 0.00 0.50 0.00 0.00 46.19 48.79 1uor s LEU 491 CO -0.06 -0.22 0.41 -0.62 -1.32 0.00 0.00 176.35 174.54 1uor n GLU 492 N 5.18 0.40 -1.60 1.98 -0.58 -1.26 -4.99 120.64 119.77 1uor n GLU 492 Ca -0.13 -1.18 -0.44 0.00 -0.42 0.00 0.00 57.16 54.99 1uor n GLU 492 Cb 0.51 -0.25 -0.04 0.00 -0.57 0.00 0.00 31.44 31.09 1uor n GLU 492 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1uor n VAL 493 N -1.93 0.41 -2.25 2.62 0.31 -1.26 -4.57 118.33 111.66 1uor n VAL 493 Ca 0.07 -0.36 -0.33 0.00 -0.01 0.00 0.00 64.34 63.71 1uor n VAL 493 Cb 0.25 -2.37 -0.04 0.00 -0.91 0.00 0.00 33.84 30.77 1uor n VAL 493 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1uor s ASP 494 N 7.28 5.68 0.00 4.52 1.11 -1.24 -4.72 116.67 129.30 1uor s ASP 494 Ca 0.99 -1.50 0.00 0.00 0.18 0.00 0.00 52.55 52.23 1uor s ASP 494 Cb -0.44 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 40.98 1uor s ASP 494 CO 0.39 -2.33 0.72 -0.62 1.18 0.00 0.00 175.17 174.51 1uor n GLU 495 N 8.58 0.00 -0.43 8.23 1.02 -1.26 -2.62 120.64 134.15 1uor n GLU 495 Ca 0.42 0.22 0.35 0.00 -0.02 0.00 0.00 57.16 58.12 1uor n GLU 495 Cb 0.47 -1.50 0.53 0.00 -0.02 0.00 0.00 31.44 30.92 1uor n GLU 495 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1uor n THR 496 N -1.22 0.00 0.00 2.62 -2.24 -1.26 -4.51 114.28 107.67 1uor n THR 496 Ca 0.00 1.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.83 1uor n THR 496 Cb 0.00 -1.78 0.00 0.00 -2.10 0.00 0.00 70.33 66.45 1uor n THR 496 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uor n TYR 497 N -3.23 0.00 0.00 4.78 9.36 -1.08 -4.88 117.16 122.11 1uor n TYR 497 Ca 0.29 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.51 1uor n TYR 497 Cb 1.40 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 40.11 1uor n TYR 497 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1uor n VAL 498 N 0.00 0.00 0.00 2.97 0.31 -1.26 -4.77 118.33 115.57 1uor n VAL 498 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1uor n VAL 498 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1uor n VAL 498 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1uor n PRO 499 N 13.77 0.00 -2.95 5.55 -0.02 -1.26 -4.63 135.00 145.46 1uor n PRO 499 Ca 0.00 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.28 1uor n PRO 499 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1uor n PRO 499 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1uor n LYS 500 N 0.00 -3.31 0.00 -0.52 4.81 -1.26 -4.64 118.16 113.24 1uor n LYS 500 Ca 0.00 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 58.09 1uor n LYS 500 Cb 0.00 -5.36 0.00 0.00 0.02 0.00 0.00 35.03 29.69 1uor n LYS 500 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1uor n GLU 501 N -3.48 0.00 -3.87 1.64 4.07 -1.04 -4.54 120.64 113.42 1uor n GLU 501 Ca -0.09 0.00 -0.35 0.00 -0.06 0.00 0.00 57.16 56.66 1uor n GLU 501 Cb 0.59 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.89 1uor n GLU 501 CO 0.00 0.00 0.00 -0.06 -0.06 0.00 0.00 177.13 177.01 1uor s PHE 502 N 0.00 3.38 -0.20 4.31 0.40 -1.26 -2.81 117.98 121.80 1uor s PHE 502 Ca 0.00 0.27 -0.01 0.00 -0.60 0.00 0.00 56.93 56.60 1uor s PHE 502 Cb 0.00 -2.08 0.00 0.00 0.51 0.00 0.00 43.02 41.45 1uor s PHE 502 CO 0.00 0.33 0.17 0.09 0.70 0.00 0.00 175.22 176.51 1uor n ASN 503 N 3.22 -2.39 -4.45 1.36 3.02 -1.26 -4.94 115.26 109.82 1uor n ASN 503 Ca -0.17 -0.09 -0.44 0.00 -0.03 0.00 0.00 54.58 53.85 1uor n ASN 503 Cb 0.53 -1.22 -0.00 0.00 -0.61 0.00 0.00 39.78 38.47 1uor n ASN 503 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uor s ALA 504 N -3.05 4.10 0.00 5.41 0.00 -1.26 -4.90 121.76 122.06 1uor s ALA 504 Ca 0.05 -3.43 -0.00 0.00 0.00 0.00 0.00 51.96 48.58 1uor s ALA 504 Cb -0.02 -4.04 -0.01 0.00 0.00 0.00 0.00 23.12 19.04 1uor s ALA 504 CO 0.12 -2.69 2.07 -1.91 0.00 0.00 0.00 175.76 173.34 1uor n GLU 505 N 5.23 1.04 -2.64 0.00 4.07 -1.26 -2.04 120.64 125.05 1uor n GLU 505 Ca 0.35 -0.05 -0.36 0.00 -0.06 0.00 0.00 57.16 57.04 1uor n GLU 505 Cb 0.42 -1.05 0.00 0.00 -0.06 0.00 0.00 31.44 30.75 1uor n GLU 505 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1uor n THR 506 N 1.55 4.61 0.00 6.31 -1.04 -1.26 -4.83 114.28 119.62 1uor n THR 506 Ca 0.02 -5.59 0.00 0.00 -2.04 0.00 0.00 64.05 56.44 1uor n THR 506 Cb 0.52 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 1uor n THR 506 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1uor n PHE 507 N -0.21 0.00 -3.12 -1.42 -0.00 -0.86 -4.97 117.46 106.88 1uor n PHE 507 Ca 0.42 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.43 1uor n PHE 507 Cb 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 39.48 39.80 1uor n PHE 507 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1uor s THR 508 N 0.32 5.34 -2.00 -2.13 2.01 -1.26 -4.84 115.64 113.08 1uor s THR 508 Ca 0.00 -2.60 0.02 0.00 0.31 0.00 0.00 61.69 59.42 1uor s THR 508 Cb 0.00 -4.72 0.07 0.00 0.01 0.00 0.00 72.50 67.86 1uor s THR 508 CO 0.00 -1.37 0.45 2.22 -0.69 0.00 0.00 174.62 175.23 1uor n PHE 509 N 4.72 0.00 0.00 4.92 1.16 -1.26 -4.81 117.46 122.19 1uor n PHE 509 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.84 1uor n PHE 509 Cb 0.44 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.31 1uor n PHE 509 CO 0.00 0.00 0.00 1.58 -1.87 0.00 0.00 176.76 176.47 1uor n HIS 510 N -0.75 0.00 -2.13 2.97 -0.00 -1.26 -4.87 115.22 109.18 1uor n HIS 510 Ca 0.02 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.70 1uor n HIS 510 Cb 0.01 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.02 1uor n HIS 510 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1uor n ALA 511 N 0.00 -0.76 -3.28 1.57 0.00 -1.26 -3.61 120.51 113.17 1uor n ALA 511 Ca 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 1uor n ALA 511 Cb 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.00 1uor n ALA 511 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uor n ASP 512 N -1.74 0.14 -0.21 0.00 2.03 -1.26 -4.75 116.55 110.76 1uor n ASP 512 Ca -0.04 -0.49 0.01 0.00 0.52 0.00 0.00 54.79 54.78 1uor n ASP 512 Cb 0.54 -0.61 0.09 0.00 -0.72 0.00 0.00 41.12 40.41 1uor n ASP 512 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1uor h ILE 513 N 0.04 0.42 -0.64 5.18 2.04 -1.89 0.50 117.51 123.17 1uor h ILE 513 Ca -0.26 -0.02 -0.60 0.00 1.00 0.00 0.00 64.86 64.98 1uor h ILE 513 Cb 0.54 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1uor h ILE 513 CO 0.26 0.01 1.54 0.00 0.00 0.00 0.00 178.15 179.96 1uor n THR 515 N 7.29 -0.57 0.26 0.00 -2.24 -1.26 -4.64 114.28 113.12 1uor n THR 515 Ca 0.51 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 62.13 1uor n THR 515 Cb 0.17 -1.64 -0.08 0.00 -2.10 0.00 0.00 70.33 66.68 1uor n THR 515 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1uor h LEU 516 N -0.07 -0.55 -8.97 3.22 3.38 0.87 -3.49 115.31 109.70 1uor h LEU 516 Ca -0.28 -0.06 -0.68 0.00 0.09 0.00 0.00 57.88 56.95 1uor h LEU 516 Cb 1.20 0.14 -0.21 0.00 0.09 0.00 0.00 40.66 41.88 1uor h LEU 516 CO 0.33 -0.27 -0.83 -0.94 0.09 0.00 0.00 178.44 176.83 1uor s SER 517 N -4.74 3.64 0.21 -0.43 1.04 -0.65 -5.05 113.70 107.73 1uor s SER 517 Ca -0.15 -0.57 -0.00 0.00 0.48 0.00 0.00 55.95 55.70 1uor s SER 517 Cb 0.03 -0.45 -0.04 0.00 0.10 0.00 0.00 66.02 65.65 1uor s SER 517 CO 0.57 0.21 0.10 -1.61 0.98 0.00 0.00 173.24 173.49 1uor s GLU 518 N -1.83 1.23 0.13 4.02 2.02 -1.26 -4.75 118.70 118.27 1uor s GLU 518 Ca 0.15 -1.65 0.00 0.00 0.02 0.00 0.00 54.97 53.50 1uor s GLU 518 Cb -0.10 0.07 0.00 0.00 0.10 0.00 0.00 34.13 34.19 1uor s GLU 518 CO 0.07 -0.33 0.00 1.17 0.02 0.00 0.00 175.26 176.19 1uor n LYS 519 N -0.31 -5.55 0.22 1.61 4.81 -1.26 -3.95 118.16 113.73 1uor n LYS 519 Ca 0.00 3.96 0.06 0.00 -0.87 0.00 0.00 58.31 61.47 1uor n LYS 519 Cb 0.66 -4.56 0.34 0.00 0.02 0.00 0.00 35.03 31.50 1uor n LYS 519 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1uor h GLU 520 N 4.39 0.00 -0.47 1.64 4.39 -1.95 2.95 114.58 125.52 1uor h GLU 520 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1uor h GLU 520 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1uor h GLU 520 CO 0.00 0.00 0.14 0.00 -1.16 0.00 0.00 179.01 177.99 1uor h ARG 521 N 0.00 0.70 0.00 2.33 2.47 -1.98 0.55 114.38 118.45 1uor h ARG 521 Ca 0.00 -0.12 -0.19 0.00 -1.26 0.00 0.00 59.98 58.41 1uor h ARG 521 Cb 0.95 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 29.12 1uor h ARG 521 CO 0.00 0.62 -1.71 1.04 0.56 0.00 0.00 179.97 180.48 1uor n GLN 522 N -4.32 0.64 -0.06 0.04 6.02 0.96 -3.24 117.38 117.42 1uor n GLN 522 Ca 0.03 0.13 -0.11 0.00 -0.01 0.00 0.00 57.00 57.03 1uor n GLN 522 Cb 0.19 -1.71 -0.10 0.00 1.02 0.00 0.00 30.24 29.63 1uor n GLN 522 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1uor h ILE 523 N 0.00 1.44 0.78 5.09 2.04 -0.49 -3.37 117.51 123.00 1uor h ILE 523 Ca -0.23 -2.03 -0.04 0.00 1.00 0.00 0.00 64.86 63.57 1uor h ILE 523 Cb 1.67 2.70 0.01 0.00 -0.74 0.00 0.00 36.82 40.46 1uor h ILE 523 CO 0.04 0.48 -0.37 0.50 0.00 0.00 0.00 178.15 178.79 1uor h LYS 524 N -0.97 -1.01 -0.44 2.37 3.64 -0.09 -2.69 116.57 117.38 1uor h LYS 524 Ca -0.00 0.07 0.17 0.00 -1.27 0.00 0.00 60.65 59.62 1uor h LYS 524 Cb 0.79 0.23 -0.08 0.00 -0.41 0.00 0.00 32.23 32.76 1uor h LYS 524 CO 0.00 -0.67 0.19 1.17 -2.27 0.00 0.00 179.45 177.87 1uor n LYS 525 N -5.15 -0.03 0.06 1.90 0.00 -1.20 0.30 118.16 114.04 1uor n LYS 525 Ca -0.13 0.61 -0.03 0.00 0.00 0.00 0.00 58.31 58.76 1uor n LYS 525 Cb 0.41 -1.07 -0.02 0.00 0.00 0.00 0.00 35.03 34.36 1uor n LYS 525 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 1uor h GLN 526 N 0.00 -0.21 -1.14 1.64 1.08 -1.70 0.91 115.11 115.68 1uor h GLN 526 Ca 0.35 0.01 0.42 0.00 -1.45 0.00 0.00 58.65 57.98 1uor h GLN 526 Cb 0.89 0.05 -0.14 0.00 -0.05 0.00 0.00 27.48 28.22 1uor h GLN 526 CO -0.35 -0.14 0.70 2.41 -0.95 0.00 0.00 178.83 180.49 1uor n THR 527 N -4.23 -0.29 0.07 -0.54 -1.04 0.88 0.24 114.28 109.36 1uor n THR 527 Ca -0.03 1.75 -0.21 0.00 -2.04 0.00 0.00 64.05 63.52 1uor n THR 527 Cb 0.09 -2.86 -0.15 0.00 -1.82 0.00 0.00 70.33 65.59 1uor n THR 527 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1uor h ALA 528 N 1.62 -0.10 0.00 2.41 0.00 -0.23 -3.10 119.26 119.87 1uor h ALA 528 Ca 0.80 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uor h ALA 528 Cb 2.42 0.11 0.00 0.00 0.00 0.00 0.00 17.79 20.32 1uor h ALA 528 CO -0.54 0.45 0.21 1.28 0.00 0.00 0.00 179.25 180.65 1uor n LEU 529 N -4.04 0.18 -0.09 0.00 4.32 0.66 0.29 117.00 118.32 1uor n LEU 529 Ca -0.14 0.45 -0.14 0.00 -0.02 0.00 0.00 56.01 56.16 1uor n LEU 529 Cb 0.88 -0.44 -0.04 0.00 -1.62 0.00 0.00 43.42 42.20 1uor n LEU 529 CO 0.51 -0.51 0.51 0.58 -1.22 0.00 0.00 177.39 177.26 1uor h VAL 530 N 0.00 1.29 0.02 4.08 2.07 -0.83 -3.39 116.25 119.49 1uor h VAL 530 Ca 0.00 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 65.94 1uor h VAL 530 Cb 0.42 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1uor h VAL 530 CO 0.00 0.52 -0.09 -0.08 0.02 0.00 0.00 177.57 177.93 1uor h GLU 531 N 0.59 -0.12 -0.47 1.57 4.81 0.41 -0.60 114.58 120.77 1uor h GLU 531 Ca 0.04 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1uor h GLU 531 Cb 0.99 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.35 1uor h GLU 531 CO 0.09 -0.08 -0.28 1.28 -0.73 0.00 0.00 179.01 179.29 1uor n LEU 532 N -2.97 -0.50 0.00 1.64 4.32 -1.26 -0.81 117.00 117.42 1uor n LEU 532 Ca -0.01 1.11 0.10 0.00 -0.02 0.00 0.00 56.01 57.19 1uor n LEU 532 Cb 0.07 -0.24 0.52 0.00 -1.62 0.00 0.00 43.42 42.14 1uor n LEU 532 CO 0.03 -0.82 0.83 1.33 -1.22 0.00 0.00 177.39 177.53 1uor n VAL 533 N -4.13 0.37 1.38 4.08 0.24 -1.11 0.12 118.33 119.30 1uor n VAL 533 Ca 0.01 0.09 0.14 0.00 -2.04 0.00 0.00 64.34 62.54 1uor n VAL 533 Cb 0.12 -0.75 0.47 0.00 -1.47 0.00 0.00 33.84 32.22 1uor n VAL 533 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1uor n LYS 534 N -1.30 1.19 -3.43 7.34 -0.00 0.01 -4.33 118.16 117.63 1uor n LYS 534 Ca 0.09 -0.67 -0.20 0.00 -0.00 0.00 0.00 58.31 57.54 1uor n LYS 534 Cb 0.17 -1.49 -0.11 0.00 -0.00 0.00 0.00 35.03 33.61 1uor n LYS 534 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 1uor s HIS 535 N -2.27 -0.27 0.00 5.58 -3.43 0.32 -4.72 115.29 110.50 1uor s HIS 535 Ca 0.31 -0.35 0.00 0.00 -0.80 0.00 0.00 55.06 54.22 1uor s HIS 535 Cb 0.20 -0.57 0.00 0.00 -1.43 0.00 0.00 32.58 30.78 1uor s HIS 535 CO 0.43 -0.90 0.00 1.63 -2.00 0.00 0.00 174.74 173.90 1uor n LYS 536 N 5.28 0.00 -3.12 -0.38 5.02 -1.23 -4.81 118.16 118.92 1uor n LYS 536 Ca -0.03 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.95 1uor n LYS 536 Cb 0.45 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.41 1uor n LYS 536 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1uor s PRO 537 N 0.00 3.88 0.00 1.97 0.04 -1.12 -2.49 135.00 137.28 1uor s PRO 537 Ca 0.00 0.49 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1uor s PRO 537 Cb 0.00 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1uor s PRO 537 CO 0.00 0.14 0.00 1.17 0.04 0.00 0.00 177.00 178.35 1uor n LYS 538 N -0.62 -0.58 -0.08 4.56 3.00 -1.26 -4.79 118.16 118.38 1uor n LYS 538 Ca 0.02 0.56 -0.06 0.00 -0.00 0.00 0.00 58.31 58.83 1uor n LYS 538 Cb 0.53 -0.38 -0.00 0.00 0.00 0.00 0.00 35.03 35.18 1uor n LYS 538 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uor h ALA 539 N 3.36 0.16 -2.50 3.14 0.00 -1.93 -3.42 119.26 118.07 1uor h ALA 539 Ca 0.00 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1uor h ALA 539 Cb 0.02 0.28 -0.20 0.00 0.00 0.00 0.00 17.79 17.89 1uor h ALA 539 CO 0.00 -0.49 -0.24 -0.08 0.00 0.00 0.00 179.25 178.44 1uor s THR 540 N -6.20 0.05 0.10 0.00 -1.32 -1.26 -4.60 115.64 102.41 1uor s THR 540 Ca -0.14 -0.41 -0.09 0.00 -1.21 0.00 0.00 61.69 59.84 1uor s THR 540 Cb 0.13 -0.64 -0.00 0.00 -1.51 0.00 0.00 72.50 70.48 1uor s THR 540 CO 0.70 -0.23 0.21 -0.54 -2.21 0.00 0.00 174.62 172.55 1uor s LYS 541 N -1.23 0.91 0.00 7.08 -0.14 -1.26 -5.17 119.74 119.92 1uor s LYS 541 Ca -0.13 -1.00 0.00 0.00 -1.36 0.00 0.00 55.97 53.49 1uor s LYS 541 Cb -0.05 0.35 0.00 0.00 -1.68 0.00 0.00 37.83 36.45 1uor s LYS 541 CO 0.04 -0.30 0.00 -1.91 -0.76 0.00 0.00 175.35 172.43 1uor n GLU 542 N -0.09 2.72 -0.04 1.68 4.07 -1.26 -4.80 120.64 122.92 1uor n GLU 542 Ca -0.14 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.97 1uor n GLU 542 Cb 0.63 0.00 0.01 0.00 -0.06 0.00 0.00 31.44 32.01 1uor n GLU 542 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1uor n GLN 543 N 0.00 -0.02 0.00 5.31 0.00 -1.26 -3.40 117.38 118.02 1uor n GLN 543 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 57.00 57.15 1uor n GLN 543 Cb 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 30.24 30.01 1uor n GLN 543 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1uor n LEU 544 N -4.15 0.00 -0.57 2.61 7.99 -1.26 -3.47 117.00 118.15 1uor n LEU 544 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 1uor n LEU 544 Cb 0.04 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 1uor n LEU 544 CO -0.01 0.00 0.20 2.29 -1.51 0.00 0.00 177.39 178.36 1uor n LYS 545 N -1.28 0.69 0.00 3.23 0.00 -1.22 -1.27 118.16 118.32 1uor n LYS 545 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.35 1uor n LYS 545 Cb 0.00 -1.32 -0.02 0.00 -0.00 0.00 0.00 35.03 33.69 1uor n LYS 545 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1uor n ALA 546 N 0.23 2.87 0.84 0.58 0.00 -1.23 -3.81 120.51 119.99 1uor n ALA 546 Ca 0.00 -0.31 0.08 0.00 0.00 0.00 0.00 53.44 53.21 1uor n ALA 546 Cb 0.20 -0.28 0.44 0.00 0.00 0.00 0.00 19.45 19.81 1uor n ALA 546 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1uor n VAL 547 N -0.74 0.44 0.00 0.00 3.14 -0.40 -3.67 118.33 117.11 1uor n VAL 547 Ca 0.02 0.11 0.00 0.00 -2.96 0.00 0.00 64.34 61.51 1uor n VAL 547 Cb 0.15 -0.83 0.00 0.00 -1.06 0.00 0.00 33.84 32.10 1uor n VAL 547 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 1uor n MET 548 N -1.25 0.00 0.00 1.45 2.00 -1.25 -3.67 117.12 114.40 1uor n MET 548 Ca 0.09 0.36 0.00 0.00 0.00 0.00 0.00 57.70 58.15 1uor n MET 548 Cb 0.13 -0.85 0.00 0.00 0.00 0.00 0.00 33.22 32.50 1uor n MET 548 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1uor n ASP 549 N -1.90 1.13 0.00 7.83 9.92 -1.24 0.35 116.55 132.64 1uor n ASP 549 Ca 0.00 -1.07 0.00 0.00 -0.53 0.00 0.00 54.79 53.19 1uor n ASP 549 Cb 0.00 -0.27 0.00 0.00 -0.64 0.00 0.00 41.12 40.21 1uor n ASP 549 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1uor n ASP 550 N 0.52 3.83 0.00 -2.24 9.92 -1.24 -3.98 116.55 123.36 1uor n ASP 550 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1uor n ASP 550 Cb 0.21 0.06 0.01 0.00 -0.64 0.00 0.00 41.12 40.76 1uor n ASP 550 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1uor n PHE 551 N -2.35 0.00 -2.61 1.24 3.01 0.15 0.18 117.46 117.08 1uor n PHE 551 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 1uor n PHE 551 Cb 0.46 -0.39 0.03 0.00 -0.01 0.00 0.00 39.48 39.57 1uor n PHE 551 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1uor n ALA 552 N -1.39 3.78 -0.06 4.37 0.00 0.15 -4.55 120.51 122.81 1uor n ALA 552 Ca 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 53.44 50.05 1uor n ALA 552 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1uor n ALA 552 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor n ALA 553 N -0.26 0.64 0.33 0.00 0.00 0.48 -4.59 120.51 117.12 1uor n ALA 553 Ca 0.18 -0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.74 1uor n ALA 553 Cb 0.79 0.00 0.38 0.00 0.00 0.00 0.00 19.45 20.62 1uor n ALA 553 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1uor h PHE 554 N 0.00 0.00 -0.75 0.00 3.57 -1.01 -3.29 116.94 115.46 1uor h PHE 554 Ca 0.00 0.00 0.22 0.00 3.53 0.00 0.00 57.97 61.72 1uor h PHE 554 Cb 0.03 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 1uor h PHE 554 CO 0.00 0.00 0.82 1.55 -2.23 0.00 0.00 178.31 178.45 1uor n VAL 555 N -2.85 0.00 0.00 1.41 3.14 -1.26 -1.73 118.33 117.03 1uor n VAL 555 Ca 0.03 0.84 0.00 0.00 -2.96 0.00 0.00 64.34 62.25 1uor n VAL 555 Cb 0.42 -1.49 0.00 0.00 -1.06 0.00 0.00 33.84 31.71 1uor n VAL 555 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1uor n GLU 556 N -2.64 0.00 0.00 1.45 4.71 -1.24 -4.60 120.64 118.32 1uor n GLU 556 Ca 0.17 0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.34 1uor n GLU 556 Cb 1.04 -0.29 0.00 0.00 -1.01 0.00 0.00 31.44 31.19 1uor n GLU 556 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1uor n LYS 557 N -1.15 0.00 -0.45 3.49 5.02 -0.72 0.25 118.16 124.60 1uor n LYS 557 Ca 0.00 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 1uor n LYS 557 Cb 0.00 -0.99 0.26 0.00 -0.02 0.00 0.00 35.03 34.29 1uor n LYS 557 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uor s LYS 560 N -3.97 0.76 -0.41 0.00 1.02 -1.26 -4.94 119.74 110.95 1uor s LYS 560 Ca 0.43 -0.49 -0.21 0.00 0.02 0.00 0.00 55.97 55.73 1uor s LYS 560 Cb 0.23 0.22 0.03 0.00 -0.52 0.00 0.00 37.83 37.79 1uor s LYS 560 CO -0.14 -0.36 0.54 0.00 -0.92 0.00 0.00 175.35 174.47 1uor n ALA 561 N -0.77 -2.80 -2.81 5.17 0.00 -1.26 -4.58 120.51 113.46 1uor n ALA 561 Ca -0.00 0.82 -0.04 0.00 0.00 0.00 0.00 53.44 54.22 1uor n ALA 561 Cb 0.59 -2.95 0.00 0.00 0.00 0.00 0.00 19.45 17.09 1uor n ALA 561 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1uor n ASP 562 N -0.10 -7.34 0.00 0.00 2.03 -1.26 -4.97 116.55 104.91 1uor n ASP 562 Ca 0.04 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.59 1uor n ASP 562 Cb 0.49 -4.96 0.00 0.00 -0.72 0.00 0.00 41.12 35.93 1uor n ASP 562 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1uor n ASP 563 N -0.95 0.00 0.00 1.67 5.75 -1.26 -4.48 116.55 117.29 1uor n ASP 563 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.84 1uor n ASP 563 Cb 0.45 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 1uor n ASP 563 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1uor n LYS 564 N 0.00 0.00 0.00 0.11 4.76 -1.26 -3.52 118.16 118.25 1uor n LYS 564 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1uor n LYS 564 Cb 0.00 -0.78 0.00 0.00 -1.84 0.00 0.00 35.03 32.41 1uor n LYS 564 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1uor n GLU 565 N 0.78 0.20 0.00 1.97 0.00 -1.26 -4.88 120.64 117.45 1uor n GLU 565 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.15 1uor n GLU 565 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 31.44 31.27 1uor n GLU 565 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1uor n THR 566 N -0.03 0.00 -2.62 3.84 -1.04 -1.23 -3.75 114.28 109.45 1uor n THR 566 Ca 0.00 0.81 -0.42 0.00 -2.04 0.00 0.00 64.05 62.40 1uor n THR 566 Cb 0.07 -1.62 -0.02 0.00 -1.82 0.00 0.00 70.33 66.94 1uor n THR 566 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1uor n PHE 568 N 8.40 0.00 0.12 0.00 7.35 -1.26 -4.42 117.46 127.66 1uor n PHE 568 Ca 0.35 0.00 -0.23 0.00 -0.76 0.00 0.00 57.45 56.81 1uor n PHE 568 Cb 0.50 0.00 -0.15 0.00 0.35 0.00 0.00 39.48 40.17 1uor n PHE 568 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1uor h ALA 569 N 0.00 -0.05 -0.66 3.13 0.00 -1.64 -3.35 119.26 116.69 1uor h ALA 569 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.97 1uor h ALA 569 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1uor h ALA 569 CO 0.00 0.82 0.00 0.39 0.00 0.00 0.00 179.25 180.46 1uor n GLU 570 N -3.66 0.00 -0.24 0.00 1.02 -1.20 -3.05 120.64 113.51 1uor n GLU 570 Ca -0.18 0.39 -0.06 0.00 -0.02 0.00 0.00 57.16 57.29 1uor n GLU 570 Cb 1.09 -1.18 -0.06 0.00 -0.02 0.00 0.00 31.44 31.28 1uor n GLU 570 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1uor n GLU 571 N -1.67 -0.25 -0.32 3.49 -0.58 -1.26 -0.46 120.64 119.59 1uor n GLU 571 Ca 0.00 0.87 0.15 0.00 -0.42 0.00 0.00 57.16 57.76 1uor n GLU 571 Cb 0.00 -1.29 0.38 0.00 -0.57 0.00 0.00 31.44 29.96 1uor n GLU 571 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1uor h GLY 572 N 0.00 1.48 0.30 0.62 0.00 -1.68 3.83 103.07 107.61 1uor h GLY 572 Ca 0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1uor h GLY 572 CO -0.53 -0.03 -0.14 0.50 0.00 0.00 0.00 176.54 176.34 1uor h LYS 573 N 0.67 -0.38 -0.45 4.80 1.79 -1.33 -3.25 116.57 118.41 1uor h LYS 573 Ca 0.54 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 59.04 1uor h LYS 573 Cb 0.96 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1uor h LYS 573 CO -0.31 -0.26 0.00 0.36 -1.08 0.00 0.00 179.45 178.17 1uor n LYS 574 N -3.91 0.86 0.00 3.15 2.85 0.75 0.84 118.16 122.70 1uor n LYS 574 Ca -0.05 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.21 1uor n LYS 574 Cb 0.16 -1.23 0.00 0.00 -0.65 0.00 0.00 35.03 33.31 1uor n LYS 574 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1uor n LEU 575 N -0.20 0.00 -0.11 -5.58 7.94 1.10 -4.41 117.00 115.74 1uor n LEU 575 Ca 0.00 -0.02 -0.15 0.00 -1.11 0.00 0.00 56.01 54.73 1uor n LEU 575 Cb 0.11 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.96 1uor n LEU 575 CO 0.00 0.00 -1.20 0.52 -1.11 0.00 0.00 177.39 175.60 1uor n VAL 576 N -0.31 1.23 -0.17 1.96 0.31 -1.02 -3.92 118.33 116.41 1uor n VAL 576 Ca 0.00 -0.47 0.14 0.00 -0.01 0.00 0.00 64.34 64.00 1uor n VAL 576 Cb 0.00 -1.25 0.48 0.00 -0.91 0.00 0.00 33.84 32.17 1uor n VAL 576 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1uor h ALA 577 N 0.01 2.06 -0.00 3.52 0.00 0.35 -0.24 119.26 124.96 1uor h ALA 577 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1uor h ALA 577 Cb 1.75 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1uor h ALA 577 CO -0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 179.25 178.88 1uor n ALA 578 N -2.51 2.66 -1.96 0.00 0.00 -1.25 -4.84 120.51 112.61 1uor n ALA 578 Ca 0.14 -0.23 -0.27 0.00 0.00 0.00 0.00 53.44 53.07 1uor n ALA 578 Cb 0.49 -1.40 0.16 0.00 0.00 0.00 0.00 19.45 18.70 1uor n ALA 578 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1uor s SER 579 N -2.36 3.53 0.00 0.00 0.01 -0.10 -4.47 113.70 110.31 1uor s SER 579 Ca 0.34 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.53 1uor s SER 579 Cb 0.21 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.37 1uor s SER 579 CO 0.44 -2.44 0.00 1.67 0.41 0.00 0.00 173.24 173.32 1uor n GLN 580 N -3.40 0.00 -3.37 12.44 -0.06 -1.26 -4.33 117.38 117.39 1uor n GLN 580 Ca 0.16 0.00 -0.40 0.00 -2.00 0.00 0.00 57.00 54.76 1uor n GLN 580 Cb 0.60 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.75 1uor n GLN 580 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1uor n ALA 581 N 0.04 4.30 0.00 1.69 0.00 -1.26 -4.20 120.51 121.08 1uor n ALA 581 Ca 0.00 -4.69 0.00 0.00 0.00 0.00 0.00 53.44 48.75 1uor n ALA 581 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.39 1uor n ALA 581 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uor n ALA 582 N 2.09 0.00 -0.14 0.00 0.00 -1.26 -5.21 120.51 115.99 1uor n ALA 582 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1uor n ALA 582 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1uor n ALA 582 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78