#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rac s ASN 2 N 0.00 5.98 0.58 0.00 2.20 -0.02 -4.96 114.94 118.73 1rac s ASN 2 Ca 0.00 1.88 0.28 0.00 -0.94 0.00 0.00 52.86 54.08 1rac s ASN 2 Cb 0.00 -2.55 1.76 0.00 -2.00 0.00 0.00 41.25 38.47 1rac s ASN 2 CO 0.00 -1.03 2.24 1.55 -2.94 0.00 0.00 177.10 176.92 1rac h PRO 3 N 0.88 0.00 -0.01 3.55 0.13 -1.94 -0.46 132.00 134.15 1rac h PRO 3 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1rac h PRO 3 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1rac h PRO 3 CO 0.58 0.01 -0.26 1.28 -0.23 0.00 0.00 178.00 179.38 1rac n LEU 4 N -3.90 0.87 -4.68 1.56 4.77 -1.26 -4.85 117.00 109.51 1rac n LEU 4 Ca -0.03 -0.19 -0.50 0.00 -0.03 0.00 0.00 56.01 55.27 1rac n LEU 4 Cb 0.09 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1rac n LEU 4 CO 0.28 0.17 1.37 0.00 -1.33 0.00 0.00 177.39 177.88 1rac n TYR 5 N -0.80 2.21 -3.03 -1.77 9.36 -0.18 -1.10 117.16 121.85 1rac n TYR 5 Ca 0.12 0.19 -0.22 0.00 3.32 0.00 0.00 57.90 61.31 1rac n TYR 5 Cb 0.34 -2.58 0.02 0.00 -0.63 0.00 0.00 39.34 36.48 1rac n TYR 5 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 1rac n GLN 6 N 5.57 -4.12 -3.38 2.98 7.27 -0.46 -5.01 117.38 120.25 1rac n GLN 6 Ca 0.22 0.78 -0.24 0.00 0.07 0.00 0.00 57.00 57.83 1rac n GLN 6 Cb 0.25 -5.58 -0.01 0.00 2.41 0.00 0.00 30.24 27.31 1rac n GLN 6 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1rac s LYS 7 N -5.70 3.50 -0.24 3.69 1.02 -0.26 -4.80 119.74 116.95 1rac s LYS 7 Ca 0.29 -0.31 -0.18 0.00 0.02 0.00 0.00 55.97 55.79 1rac s LYS 7 Cb -0.14 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.48 1rac s LYS 7 CO 0.36 0.16 0.51 -1.01 -0.92 0.00 0.00 175.35 174.44 1rac s HIS 8 N -2.29 3.31 -0.88 3.18 3.76 -1.26 -4.56 115.29 116.55 1rac s HIS 8 Ca 0.40 0.67 -0.17 0.00 -0.15 0.00 0.00 55.06 55.82 1rac s HIS 8 Cb -0.10 -2.69 0.17 0.00 1.11 0.00 0.00 32.58 31.07 1rac s HIS 8 CO 0.36 -0.20 0.96 0.42 -0.85 0.00 0.00 174.74 175.43 1rac s ILE 9 N 2.02 5.10 -0.15 0.60 -1.09 -0.85 -4.75 121.20 122.09 1rac s ILE 9 Ca 0.22 -1.93 -0.02 0.00 -2.23 0.00 0.00 60.65 56.69 1rac s ILE 9 Cb -0.15 -4.64 -0.09 0.00 -1.58 0.00 0.00 42.46 36.00 1rac s ILE 9 CO 0.09 -1.30 -0.16 -0.38 -1.23 0.00 0.00 174.94 171.97 1rac n ILE 10 N 4.86 0.87 -4.02 2.92 5.41 -1.26 -0.85 119.36 127.29 1rac n ILE 10 Ca 0.19 -0.30 -0.10 0.00 1.00 0.00 0.00 62.75 63.54 1rac n ILE 10 Cb 0.48 -1.26 -0.11 0.00 -0.71 0.00 0.00 39.64 38.04 1rac n ILE 10 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1rac s SER 11 N -5.78 0.44 0.22 4.38 0.15 -1.26 -4.66 113.70 107.18 1rac s SER 11 Ca -0.21 -0.59 0.04 0.00 0.70 0.00 0.00 55.95 55.90 1rac s SER 11 Cb 0.06 0.10 0.18 0.00 -1.71 0.00 0.00 66.02 64.65 1rac s SER 11 CO 0.33 -0.32 1.51 -0.29 1.20 0.00 0.00 173.24 175.67 1rac h ILE 12 N 4.38 1.43 0.00 6.45 6.09 -1.95 -2.35 117.51 131.56 1rac h ILE 12 Ca -0.33 -2.19 0.00 0.00 -1.37 0.00 0.00 64.86 60.97 1rac h ILE 12 Cb 1.20 2.15 0.00 0.00 0.47 0.00 0.00 36.82 40.64 1rac h ILE 12 CO 0.45 0.64 0.09 0.59 -3.07 0.00 0.00 178.15 176.85 1rac n ASN 13 N -3.80 0.48 0.00 2.19 4.13 -1.26 -1.19 115.26 115.81 1rac n ASN 13 Ca -0.03 0.69 0.10 0.00 1.68 0.00 0.00 54.58 57.03 1rac n ASN 13 Cb 0.67 -0.72 -0.07 0.00 -1.54 0.00 0.00 39.78 38.12 1rac n ASN 13 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1rac n ASP 14 N -2.17 0.88 -4.71 6.41 8.00 -0.88 -4.90 116.55 119.18 1rac n ASP 14 Ca -0.01 -0.84 -0.35 0.00 0.71 0.00 0.00 54.79 54.30 1rac n ASP 14 Cb 0.12 0.95 -0.09 0.00 -0.02 0.00 0.00 41.12 42.08 1rac n ASP 14 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rac s LEU 15 N -3.09 3.99 0.82 0.64 1.43 -0.33 -5.05 118.68 117.09 1rac s LEU 15 Ca 0.08 0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 53.31 1rac s LEU 15 Cb 0.16 -2.00 0.16 0.00 0.03 0.00 0.00 46.19 44.55 1rac s LEU 15 CO 0.85 0.25 1.13 -0.94 0.23 0.00 0.00 176.35 177.87 1rac s SER 16 N -0.07 3.81 0.18 2.29 1.04 -1.26 -4.89 113.70 114.80 1rac s SER 16 Ca 0.08 -0.14 -0.12 0.00 0.48 0.00 0.00 55.95 56.25 1rac s SER 16 Cb -0.12 -0.09 0.09 0.00 0.10 0.00 0.00 66.02 66.00 1rac s SER 16 CO 0.01 -2.24 1.77 -0.09 0.98 0.00 0.00 173.24 173.66 1rac h ARG 17 N -1.00 0.88 -0.53 4.02 2.43 -1.98 -0.01 114.38 118.20 1rac h ARG 17 Ca -0.39 -0.13 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 1rac h ARG 17 Cb 1.25 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 1rac h ARG 17 CO 0.38 0.71 -0.01 -0.44 -1.51 0.00 0.00 179.97 179.10 1rac h ASP 18 N 0.84 0.87 -0.37 -3.80 3.32 -1.98 0.37 116.42 115.67 1rac h ASP 18 Ca 0.21 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 1rac h ASP 18 Cb 0.11 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1rac h ASP 18 CO -0.03 0.94 0.14 0.44 -1.72 0.00 0.00 179.24 179.02 1rac h ASP 19 N 0.83 0.51 -0.28 6.45 3.32 -1.67 -0.70 116.42 124.88 1rac h ASP 19 Ca 0.15 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1rac h ASP 19 Cb 0.51 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1rac h ASP 19 CO 0.03 0.54 0.19 -0.07 -1.72 0.00 0.00 179.24 178.20 1rac h LEU 20 N 0.44 0.33 -0.61 1.55 3.38 -0.04 -1.99 115.31 118.37 1rac h LEU 20 Ca 0.12 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1rac h LEU 20 Cb 0.19 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1rac h LEU 20 CO -0.01 0.24 0.15 0.78 0.09 0.00 0.00 178.44 179.68 1rac h ASN 21 N 0.38 0.92 -0.61 -0.43 4.21 -0.82 -0.81 115.58 118.43 1rac h ASN 21 Ca 0.10 -0.23 0.04 0.00 1.21 0.00 0.00 56.30 57.42 1rac h ASN 21 Cb -0.04 -0.24 -0.05 0.00 -1.12 0.00 0.00 38.32 36.87 1rac h ASN 21 CO -0.02 0.91 0.35 0.25 -1.29 0.00 0.00 177.43 177.63 1rac h LEU 22 N 0.88 0.55 -0.44 1.61 5.85 -0.58 0.54 115.31 123.73 1rac h LEU 22 Ca 0.19 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 1rac h LEU 22 Cb 0.35 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1rac h LEU 22 CO 0.00 0.37 0.03 0.58 -0.34 0.00 0.00 178.44 179.08 1rac h VAL 23 N 0.68 1.26 0.00 1.05 2.07 -1.16 -2.14 116.25 118.00 1rac h VAL 23 Ca 0.26 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.80 1rac h VAL 23 Cb 0.10 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1rac h VAL 23 CO -0.14 0.34 0.00 -0.07 0.02 0.00 0.00 177.57 177.72 1rac h LEU 24 N 0.60 0.00 0.00 2.57 4.07 0.39 -1.20 115.31 121.74 1rac h LEU 24 Ca 0.13 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.84 1rac h LEU 24 Cb 0.45 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.15 1rac h LEU 24 CO 0.02 0.00 -1.27 0.00 -1.08 0.00 0.00 178.44 176.11 1rac h ALA 25 N 2.08 0.50 -0.23 1.53 0.00 -0.66 -3.20 119.26 119.29 1rac h ALA 25 Ca 0.00 -1.12 -0.20 0.00 0.00 0.00 0.00 54.91 53.60 1rac h ALA 25 Cb 0.67 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1rac h ALA 25 CO 0.00 1.37 -0.63 1.15 0.00 0.00 0.00 179.25 181.14 1rac h THR 26 N 0.00 1.28 -0.87 0.00 2.02 -0.72 -2.53 112.91 112.10 1rac h THR 26 Ca -0.12 -1.83 0.06 0.00 0.77 0.00 0.00 66.41 65.29 1rac h THR 26 Cb 1.87 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 69.99 1rac h THR 26 CO 0.11 0.59 0.57 0.00 0.37 0.00 0.00 175.52 177.16 1rac h ALA 27 N 0.68 1.52 -0.33 6.16 0.00 -1.33 -1.09 119.26 124.88 1rac h ALA 27 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1rac h ALA 27 Cb 1.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1rac h ALA 27 CO 0.13 0.36 -0.14 0.00 0.00 0.00 0.00 179.25 179.60 1rac h ALA 28 N 1.52 0.46 0.12 0.00 0.00 -1.52 -0.27 119.26 119.56 1rac h ALA 28 Ca 0.37 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1rac h ALA 28 Cb 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1rac h ALA 28 CO -0.13 0.35 -0.06 0.87 0.00 0.00 0.00 179.25 180.29 1rac h LYS 29 N 0.45 -0.16 -0.51 0.00 1.57 -0.94 -1.08 116.57 115.91 1rac h LYS 29 Ca 0.08 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.98 1rac h LYS 29 Cb 0.66 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 1rac h LYS 29 CO 0.04 0.12 0.35 -0.07 -0.57 0.00 0.00 179.45 179.32 1rac h LEU 30 N -0.43 0.17 -0.27 2.94 3.38 -1.20 0.34 115.31 120.24 1rac h LEU 30 Ca -0.02 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1rac h LEU 30 Cb 0.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1rac h LEU 30 CO 0.03 0.10 -0.75 0.50 0.09 0.00 0.00 178.44 178.41 1rac h LYS 31 N 0.19 0.64 0.03 1.13 3.64 -0.97 -3.26 116.57 117.97 1rac h LYS 31 Ca 0.24 -0.52 -0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1rac h LYS 31 Cb 0.69 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1rac h LYS 31 CO -0.04 1.14 -0.01 0.00 -2.27 0.00 0.00 179.45 178.26 1rac h ALA 32 N 0.72 -0.04 -3.70 5.00 0.00 0.80 -3.43 119.26 118.61 1rac h ALA 32 Ca -0.04 -0.28 -0.67 0.00 0.00 0.00 0.00 54.91 53.92 1rac h ALA 32 Cb 1.35 0.02 -0.36 0.00 0.00 0.00 0.00 17.79 18.80 1rac h ALA 32 CO 0.14 -0.06 -0.75 1.21 0.00 0.00 0.00 179.25 179.80 1rac s ASN 33 N -5.85 4.67 0.36 0.00 2.47 0.83 -5.09 114.94 112.32 1rac s ASN 33 Ca -0.11 -1.47 -0.24 0.00 0.42 0.00 0.00 52.86 51.46 1rac s ASN 33 Cb -0.01 -1.63 -0.14 0.00 -1.45 0.00 0.00 41.25 38.02 1rac s ASN 33 CO 0.42 -0.25 0.57 -2.65 -3.72 0.00 0.00 177.10 171.46 1rac n PRO 34 N 4.48 0.53 -3.36 0.43 -0.02 -1.23 -4.36 135.00 131.47 1rac n PRO 34 Ca -0.11 0.19 -0.26 0.00 -2.02 0.00 0.00 63.50 61.30 1rac n PRO 34 Cb 0.42 -1.41 -0.08 0.00 -0.02 0.00 0.00 33.50 32.41 1rac n PRO 34 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1rac n GLN 35 N 0.77 1.43 0.00 -0.52 1.13 -1.26 -4.97 117.38 113.96 1rac n GLN 35 Ca 0.12 -3.87 0.12 0.00 -1.94 0.00 0.00 57.00 51.43 1rac n GLN 35 Cb 0.36 -1.75 0.69 0.00 0.11 0.00 0.00 30.24 29.65 1rac n GLN 35 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1rac n PRO 36 N 1.41 0.82 -0.08 -1.09 -0.04 -1.26 -1.66 135.00 133.11 1rac n PRO 36 Ca 0.25 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.72 1rac n PRO 36 Cb 0.46 -1.44 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 1rac n PRO 36 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1rac n GLU 37 N -0.94 1.14 -0.33 0.54 1.02 -1.25 -3.08 120.64 117.75 1rac n GLU 37 Ca 0.17 -1.15 -0.02 0.00 -0.02 0.00 0.00 57.16 56.15 1rac n GLU 37 Cb 0.08 -0.78 0.11 0.00 -0.02 0.00 0.00 31.44 30.82 1rac n GLU 37 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1rac h LEU 38 N 0.00 0.98 -3.79 -4.62 5.85 -1.22 -2.22 115.31 110.29 1rac h LEU 38 Ca 0.00 -0.01 -0.40 0.00 0.84 0.00 0.00 57.88 58.31 1rac h LEU 38 Cb 0.89 -0.23 -0.24 0.00 0.37 0.00 0.00 40.66 41.46 1rac h LEU 38 CO 0.00 0.68 0.41 0.18 -0.34 0.00 0.00 178.44 179.37 1rac n LEU 39 N -4.51 5.91 -4.62 2.25 4.77 0.20 -5.00 117.00 116.01 1rac n LEU 39 Ca 0.11 -3.64 -0.43 0.00 -0.03 0.00 0.00 56.01 52.02 1rac n LEU 39 Cb 0.07 -0.77 -0.00 0.00 -2.33 0.00 0.00 43.42 40.38 1rac n LEU 39 CO 0.35 1.10 0.64 1.17 -1.33 0.00 0.00 177.39 179.32 1rac n LYS 40 N -1.09 1.50 -0.30 3.23 4.81 -0.84 -1.55 118.16 123.93 1rac n LYS 40 Ca 0.51 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 58.48 1rac n LYS 40 Cb 1.47 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 34.48 1rac n LYS 40 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1rac n HIS 41 N -0.12 0.00 -2.81 5.64 8.25 -1.26 -4.98 115.22 119.94 1rac n HIS 41 Ca 0.08 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.17 1rac n HIS 41 Cb 0.36 -0.54 -0.06 0.00 1.12 0.00 0.00 29.99 30.87 1rac n HIS 41 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1rac s LYS 42 N -0.17 4.61 -0.05 -0.41 -0.14 -0.60 -4.99 119.74 118.00 1rac s LYS 42 Ca 0.00 1.32 0.06 0.00 -1.36 0.00 0.00 55.97 55.99 1rac s LYS 42 Cb 0.00 -2.93 -0.02 0.00 -1.68 0.00 0.00 37.83 33.21 1rac s LYS 42 CO 0.00 0.35 -0.23 0.08 -0.76 0.00 0.00 175.35 174.79 1rac s VAL 43 N -1.50 2.29 0.05 3.17 1.01 -1.26 -2.22 120.40 121.95 1rac s VAL 43 Ca 0.47 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1rac s VAL 43 Cb -0.20 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 1rac s VAL 43 CO 0.25 0.58 -0.23 -0.63 0.00 0.00 0.00 175.10 175.07 1rac s ILE 44 N -0.41 1.85 -0.15 2.22 1.01 0.16 -1.36 121.20 124.51 1rac s ILE 44 Ca 0.04 -1.31 -0.12 0.00 0.00 0.00 0.00 60.65 59.26 1rac s ILE 44 Cb -0.12 -1.60 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 1rac s ILE 44 CO 0.01 0.23 0.25 0.00 0.00 0.00 0.00 174.94 175.43 1rac s ALA 45 N -0.84 3.65 -0.80 9.38 0.00 -0.77 -1.80 121.76 130.58 1rac s ALA 45 Ca 0.09 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.52 1rac s ALA 45 Cb -0.09 -2.29 0.20 0.00 0.00 0.00 0.00 23.12 20.93 1rac s ALA 45 CO 0.02 0.19 0.66 0.45 0.00 0.00 0.00 175.76 177.09 1rac s SER 46 N 0.17 5.74 -0.58 0.00 0.15 -0.64 -0.75 113.70 117.79 1rac s SER 46 Ca 0.15 -3.43 -0.24 0.00 0.70 0.00 0.00 55.95 53.12 1rac s SER 46 Cb -0.13 -1.89 0.05 0.00 -1.71 0.00 0.00 66.02 62.34 1rac s SER 46 CO 0.03 -0.25 0.98 0.00 1.20 0.00 0.00 173.24 175.20 1rac s PHE 48 N 4.11 3.49 -0.40 0.00 0.40 -0.32 -1.67 117.98 123.59 1rac s PHE 48 Ca 0.30 -2.78 0.27 0.00 -0.60 0.00 0.00 56.93 54.11 1rac s PHE 48 Cb -0.13 -3.07 0.94 0.00 0.51 0.00 0.00 43.02 41.27 1rac s PHE 48 CO 0.18 -0.88 1.78 0.74 0.70 0.00 0.00 175.22 177.73 1rac h PHE 49 N 7.35 0.00 -4.15 0.36 -1.00 -1.56 -2.27 116.94 115.68 1rac h PHE 49 Ca -0.07 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.04 1rac h PHE 49 Cb 0.98 0.00 -0.31 0.00 3.61 0.00 0.00 35.95 40.23 1rac h PHE 49 CO 0.57 0.00 -0.88 -2.00 -1.61 0.00 0.00 178.31 174.39 1rac s GLU 50 N -3.33 2.33 0.40 1.51 2.12 -1.26 -3.83 118.70 116.66 1rac s GLU 50 Ca 0.06 -0.87 -0.24 0.00 0.36 0.00 0.00 54.97 54.27 1rac s GLU 50 Cb 0.09 -2.05 -0.09 0.00 0.26 0.00 0.00 34.13 32.35 1rac s GLU 50 CO 0.52 0.41 1.09 0.00 -0.54 0.00 0.00 175.26 176.73 1rac s ALA 51 N -0.25 3.09 -0.35 6.30 0.00 -1.23 -4.71 121.76 124.61 1rac s ALA 51 Ca -0.00 0.78 0.05 0.00 0.00 0.00 0.00 51.96 52.78 1rac s ALA 51 Cb -0.12 -3.31 0.17 0.00 0.00 0.00 0.00 23.12 19.86 1rac s ALA 51 CO 0.02 -0.33 0.49 0.45 0.00 0.00 0.00 175.76 176.39 1rac s SER 52 N -1.45 -0.19 0.15 0.00 0.15 -1.26 -5.07 113.70 106.04 1rac s SER 52 Ca 0.58 -0.77 -0.16 0.00 0.70 0.00 0.00 55.95 56.29 1rac s SER 52 Cb -0.25 1.31 0.03 0.00 -1.71 0.00 0.00 66.02 65.41 1rac s SER 52 CO 0.31 -0.27 1.78 0.74 1.20 0.00 0.00 173.24 177.00 1rac h THR 53 N 5.49 1.00 0.35 6.45 2.02 -1.98 -1.56 112.91 124.69 1rac h THR 53 Ca 0.00 -0.14 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1rac h THR 53 Cb 1.13 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 1rac h THR 53 CO 0.18 0.07 -0.38 0.03 0.37 0.00 0.00 175.52 175.80 1rac h ARG 54 N 0.40 -0.74 -0.56 6.66 2.47 -1.99 0.27 114.38 120.89 1rac h ARG 54 Ca 0.15 0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.84 1rac h ARG 54 Cb 0.04 0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 1rac h ARG 54 CO -0.09 -0.49 0.02 1.15 0.56 0.00 0.00 179.97 181.12 1rac h THR 55 N -0.76 1.26 -0.02 2.04 2.02 -1.96 -2.63 112.91 112.85 1rac h THR 55 Ca -0.02 -1.09 -0.00 0.00 0.77 0.00 0.00 66.41 66.07 1rac h THR 55 Cb 0.69 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1rac h THR 55 CO -0.08 0.39 0.01 -0.09 0.37 0.00 0.00 175.52 176.12 1rac h ARG 56 N 0.86 0.03 -0.64 6.66 2.43 -1.16 -1.72 114.38 120.84 1rac h ARG 56 Ca 0.16 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1rac h ARG 56 Cb 0.51 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 1rac h ARG 56 CO 0.02 0.18 0.38 -0.07 -1.51 0.00 0.00 179.97 178.97 1rac h LEU 57 N -0.12 0.77 -0.27 3.80 3.38 -0.79 0.11 115.31 122.19 1rac h LEU 57 Ca 0.01 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 1rac h LEU 57 Cb 0.16 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1rac h LEU 57 CO -0.00 0.59 -0.61 -1.28 0.09 0.00 0.00 178.44 177.23 1rac h SER 58 N 0.88 0.97 0.03 -0.43 0.87 -1.30 -1.40 113.55 113.17 1rac h SER 58 Ca 0.23 -0.55 -0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1rac h SER 58 Cb -0.03 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 61.65 1rac h SER 58 CO -0.04 1.35 -0.01 -0.26 -0.53 0.00 0.00 176.83 177.33 1rac h PHE 59 N 0.64 -0.03 -0.13 2.24 0.04 -0.87 -0.58 116.94 118.25 1rac h PHE 59 Ca -0.00 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 1rac h PHE 59 Cb 1.23 0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.37 1rac h PHE 59 CO 0.08 0.28 -0.19 0.93 -0.60 0.00 0.00 178.31 178.80 1rac h GLU 60 N -0.34 0.21 -0.09 1.51 5.08 -0.92 -1.30 114.58 118.73 1rac h GLU 60 Ca -0.00 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1rac h GLU 60 Cb 0.32 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1rac h GLU 60 CO 0.01 0.40 -0.05 1.15 -1.00 0.00 0.00 179.01 179.52 1rac h THR 61 N 0.20 1.33 -0.60 1.13 2.02 -1.11 0.14 112.91 116.02 1rac h THR 61 Ca 0.04 -1.08 0.12 0.00 0.77 0.00 0.00 66.41 66.26 1rac h THR 61 Cb 0.46 1.86 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 1rac h THR 61 CO 0.03 0.30 0.41 0.28 0.37 0.00 0.00 175.52 176.91 1rac h SER 62 N -0.18 0.26 -0.14 4.18 0.02 -0.04 0.29 113.55 117.93 1rac h SER 62 Ca 0.02 0.01 -0.22 0.00 -0.84 0.00 0.00 61.79 60.76 1rac h SER 62 Cb 0.50 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.01 1rac h SER 62 CO 0.01 0.15 -0.78 0.24 -1.14 0.00 0.00 176.83 175.31 1rac h MET 63 N 0.29 0.77 -0.45 3.45 2.07 -0.89 -3.17 114.93 117.00 1rac h MET 63 Ca 0.28 -0.65 -0.13 0.00 -2.07 0.00 0.00 59.70 57.14 1rac h MET 63 Cb 0.72 0.14 -0.01 0.00 -1.87 0.00 0.00 31.60 30.58 1rac h MET 63 CO -0.06 1.25 -0.23 0.45 1.07 0.00 0.00 176.91 179.39 1rac h HIS 64 N 0.50 1.07 0.00 -0.22 3.86 0.18 -1.24 115.15 119.30 1rac h HIS 64 Ca -0.06 -0.26 0.00 0.00 -1.16 0.00 0.00 60.37 58.89 1rac h HIS 64 Cb 1.41 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.63 1rac h HIS 64 CO 0.09 1.06 0.00 0.54 0.86 0.00 0.00 177.93 180.48 1rac n ARG 65 N -4.11 0.50 -0.03 2.45 1.74 0.75 -0.54 116.66 117.42 1rac n ARG 65 Ca -0.00 0.03 0.02 0.00 -0.77 0.00 0.00 57.85 57.13 1rac n ARG 65 Cb 0.46 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.44 1rac n ARG 65 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1rac n LEU 66 N -1.07 1.84 0.00 0.55 4.77 -1.14 -3.99 117.00 117.95 1rac n LEU 66 Ca 0.13 -1.43 0.00 0.00 -0.03 0.00 0.00 56.01 54.67 1rac n LEU 66 Cb 0.08 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1rac n LEU 66 CO 0.11 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1rac n GLY 67 N 0.13 0.87 3.92 -0.72 0.00 0.30 -0.62 105.19 109.06 1rac n GLY 67 Ca 0.04 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1rac n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rac s ALA 68 N -2.00 3.51 0.22 4.61 0.00 -0.49 -3.74 121.76 123.87 1rac s ALA 68 Ca 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 1rac s ALA 68 Cb 0.00 -2.41 -0.07 0.00 0.00 0.00 0.00 23.12 20.63 1rac s ALA 68 CO 0.00 -0.19 0.58 -1.12 0.00 0.00 0.00 175.76 175.03 1rac s SER 69 N -4.00 6.70 -0.10 0.00 0.01 -0.94 -4.41 113.70 110.96 1rac s SER 69 Ca 0.45 1.02 0.03 0.00 1.31 0.00 0.00 55.95 58.75 1rac s SER 69 Cb -0.10 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.87 1rac s SER 69 CO 0.41 -0.05 -0.19 -0.69 0.41 0.00 0.00 173.24 173.13 1rac s VAL 70 N -1.76 1.72 0.25 3.43 1.01 -1.26 0.36 120.40 124.16 1rac s VAL 70 Ca 0.46 -0.80 0.12 0.00 0.00 0.00 0.00 61.98 61.76 1rac s VAL 70 Cb -0.12 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 1rac s VAL 70 CO 0.20 0.48 -0.20 0.68 0.00 0.00 0.00 175.10 176.27 1rac s VAL 71 N 0.69 2.53 -4.92 2.92 -7.23 -0.75 -4.94 120.40 108.71 1rac s VAL 71 Ca -0.12 -2.25 0.00 0.00 -1.81 0.00 0.00 61.98 57.80 1rac s VAL 71 Cb -0.16 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.48 1rac s VAL 71 CO 0.03 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 1rac n GLY 72 N -0.37 -2.82 3.14 2.32 0.00 -1.26 -1.62 105.19 104.59 1rac n GLY 72 Ca -0.07 -1.32 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 1rac n GLY 72 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1rac s PHE 73 N -2.07 0.00 -0.04 1.61 -0.71 -1.02 -4.95 117.98 110.81 1rac s PHE 73 Ca 0.00 -0.08 0.03 0.00 -1.04 0.00 0.00 56.93 55.84 1rac s PHE 73 Cb 0.00 -0.02 -0.03 0.00 -1.21 0.00 0.00 43.02 41.76 1rac s PHE 73 CO 0.00 -0.33 -0.13 -1.54 -1.34 0.00 0.00 175.22 171.88 1rac s SER 74 N -1.49 4.18 0.00 1.98 1.04 -1.26 -1.18 113.70 116.97 1rac s SER 74 Ca -0.13 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1rac s SER 74 Cb -0.06 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.16 1rac s SER 74 CO 0.01 0.33 0.00 -0.67 0.98 0.00 0.00 173.24 173.90 1rac n ASP 75 N 2.13 0.41 -4.01 7.02 2.03 -0.85 -4.70 116.55 118.58 1rac n ASP 75 Ca -0.17 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.82 1rac n ASP 75 Cb 0.52 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.91 1rac n ASP 75 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1rac n SER 76 N 0.00 -1.82 -2.65 1.67 7.64 -1.25 -3.52 113.62 113.69 1rac n SER 76 Ca 0.00 -1.13 -0.03 0.00 1.01 0.00 0.00 58.87 58.72 1rac n SER 76 Cb 0.00 -2.51 -0.02 0.00 -1.01 0.00 0.00 64.21 60.67 1rac n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rac n ALA 77 N -4.54 -2.79 -0.07 -0.43 0.00 -1.26 -4.91 120.51 106.52 1rac n ALA 77 Ca -0.23 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1rac n ALA 77 Cb 0.64 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1rac n ALA 77 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rac n ASN 78 N -0.45 0.00 -4.55 0.00 4.05 -1.26 -4.84 115.26 108.21 1rac n ASN 78 Ca -0.29 0.00 -0.32 0.00 0.45 0.00 0.00 54.58 54.42 1rac n ASN 78 Cb 0.63 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 41.60 1rac n ASN 78 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1rac s THR 79 N -0.07 3.20 0.00 -0.44 -4.23 -1.26 -4.79 115.64 108.04 1rac s THR 79 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 1rac s THR 79 Cb 0.00 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.34 1rac s THR 79 CO 0.00 -0.48 0.00 -1.20 -0.54 0.00 0.00 174.62 172.40 1rac n SER 80 N 14.93 0.00 -4.88 3.99 7.64 -1.26 -4.84 113.62 129.20 1rac n SER 80 Ca 0.33 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.88 1rac n SER 80 Cb 0.51 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.66 1rac n SER 80 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 1rac s LEU 81 N 0.00 4.28 0.00 -3.43 2.34 -1.26 -3.29 118.68 117.31 1rac s LEU 81 Ca 0.00 0.71 0.00 0.00 0.06 0.00 0.00 54.13 54.90 1rac s LEU 81 Cb 0.00 -3.27 0.00 0.00 -0.56 0.00 0.00 46.19 42.36 1rac s LEU 81 CO 0.00 0.07 0.00 0.61 -1.06 0.00 0.00 176.35 175.97 1rac n GLY 82 N 0.32 1.11 3.86 -3.48 0.00 -1.26 -5.08 105.19 100.67 1rac n GLY 82 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1rac n GLY 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rac s LYS 83 N -0.68 3.73 0.00 1.61 3.01 -1.21 -4.09 119.74 122.12 1rac s LYS 83 Ca 0.00 0.74 0.00 0.00 -1.01 0.00 0.00 55.97 55.70 1rac s LYS 83 Cb 0.00 -2.16 0.00 0.00 -1.01 0.00 0.00 37.83 34.66 1rac s LYS 83 CO 0.00 -0.38 0.00 1.63 0.51 0.00 0.00 175.35 177.11 1rac n LYS 84 N -2.17 0.00 0.00 1.68 4.01 -1.26 -2.27 118.16 118.15 1rac n LYS 84 Ca 0.05 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.85 1rac n LYS 84 Cb 0.54 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.06 1rac n LYS 84 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rac n GLY 85 N 0.00 0.00 3.63 0.72 0.00 -1.26 -5.10 105.19 103.18 1rac n GLY 85 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1rac n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rac s GLU 86 N 0.00 3.60 0.70 1.61 2.12 -0.96 -4.94 118.70 120.83 1rac s GLU 86 Ca 0.00 2.14 -0.16 0.00 0.36 0.00 0.00 54.97 57.31 1rac s GLU 86 Cb 0.00 -4.24 0.01 0.00 0.26 0.00 0.00 34.13 30.17 1rac s GLU 86 CO 0.00 -1.56 1.14 0.25 -0.54 0.00 0.00 175.26 174.55 1rac n THR 87 N 6.75 3.56 -0.09 -1.70 -2.24 -1.26 -4.55 114.28 114.76 1rac n THR 87 Ca 0.24 -0.40 0.01 0.00 -2.27 0.00 0.00 64.05 61.64 1rac n THR 87 Cb 0.44 -1.28 0.31 0.00 -2.10 0.00 0.00 70.33 67.70 1rac n THR 87 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1rac h LEU 88 N -0.04 0.64 -0.46 3.22 5.85 -2.00 -2.20 115.31 120.32 1rac h LEU 88 Ca -0.49 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.25 1rac h LEU 88 Cb 1.33 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 1rac h LEU 88 CO 0.49 0.53 0.16 0.00 -0.34 0.00 0.00 178.44 179.28 1rac h ALA 89 N 1.57 0.55 -0.19 1.25 0.00 -1.94 -1.75 119.26 118.76 1rac h ALA 89 Ca 0.19 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1rac h ALA 89 Cb 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1rac h ALA 89 CO -0.03 -0.24 -0.12 -0.44 0.00 0.00 0.00 179.25 178.43 1rac h ASP 90 N 0.32 0.28 0.03 0.00 3.32 -1.86 -0.53 116.42 117.98 1rac h ASP 90 Ca 0.22 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 1rac h ASP 90 Cb 0.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1rac h ASP 90 CO -0.23 0.43 -0.01 0.74 -1.72 0.00 0.00 179.24 178.45 1rac h THR 91 N 0.28 1.16 -0.12 0.35 2.02 -0.73 -1.15 112.91 114.72 1rac h THR 91 Ca 0.06 -0.58 -0.09 0.00 0.77 0.00 0.00 66.41 66.57 1rac h THR 91 Cb 0.39 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 1rac h THR 91 CO 0.02 0.15 -0.35 0.40 0.37 0.00 0.00 175.52 176.11 1rac h ILE 92 N -0.29 1.28 0.00 3.11 1.08 -1.28 0.35 117.51 121.77 1rac h ILE 92 Ca -0.00 -1.36 -0.08 0.00 -0.39 0.00 0.00 64.86 63.03 1rac h ILE 92 Cb 0.27 1.58 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 1rac h ILE 92 CO 0.01 0.41 -0.36 0.28 -0.69 0.00 0.00 178.15 177.80 1rac h SER 93 N 0.21 0.00 0.09 1.72 0.02 -0.98 -0.35 113.55 114.26 1rac h SER 93 Ca 0.03 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.71 1rac h SER 93 Cb 0.72 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1rac h SER 93 CO 0.05 0.36 -1.40 0.58 -1.14 0.00 0.00 176.83 175.29 1rac h VAL 94 N 0.00 0.99 -0.95 2.27 2.07 0.38 -3.34 116.25 117.67 1rac h VAL 94 Ca -0.00 -2.35 0.11 0.00 0.82 0.00 0.00 66.70 65.27 1rac h VAL 94 Cb 0.70 2.63 -0.07 0.00 -1.52 0.00 0.00 31.29 33.03 1rac h VAL 94 CO 0.05 0.65 0.61 0.40 0.02 0.00 0.00 177.57 179.30 1rac h ILE 95 N -0.41 0.95 0.00 4.57 2.04 -0.41 -0.69 117.51 123.56 1rac h ILE 95 Ca -0.31 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.22 1rac h ILE 95 Cb 1.68 -0.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1rac h ILE 95 CO 0.01 0.17 0.02 -0.24 0.00 0.00 0.00 178.15 178.11 1rac n SER 96 N -4.56 0.40 -0.19 1.72 2.88 -0.14 -2.12 113.62 111.61 1rac n SER 96 Ca 0.17 0.68 0.13 0.00 -1.33 0.00 0.00 58.87 58.53 1rac n SER 96 Cb 0.32 -0.73 0.69 0.00 -0.75 0.00 0.00 64.21 63.75 1rac n SER 96 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1rac n THR 97 N -2.04 0.02 -1.73 2.46 -1.04 -0.27 -4.45 114.28 107.24 1rac n THR 97 Ca -0.01 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 1rac n THR 97 Cb 0.04 -0.10 0.00 0.00 -1.82 0.00 0.00 70.33 68.45 1rac n THR 97 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rac n TYR 98 N -0.51 0.00 -4.38 -1.42 0.18 -0.90 -5.12 117.16 105.01 1rac n TYR 98 Ca 0.20 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.74 1rac n TYR 98 Cb 0.19 0.07 -0.09 0.00 -0.38 0.00 0.00 39.34 39.13 1rac n TYR 98 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 1rac s VAL 99 N 0.00 2.91 -0.61 -3.48 -7.23 -1.23 -4.92 120.40 105.85 1rac s VAL 99 Ca 0.00 -2.13 0.23 0.00 -1.81 0.00 0.00 61.98 58.27 1rac s VAL 99 Cb 0.00 -2.53 -0.15 0.00 0.56 0.00 0.00 36.38 34.27 1rac s VAL 99 CO 0.00 -0.35 0.96 0.47 -0.31 0.00 0.00 175.10 175.87 1rac n ASP 100 N -0.62 0.60 -3.53 4.85 8.00 -0.46 -4.91 116.55 120.48 1rac n ASP 100 Ca -0.07 -0.29 -0.16 0.00 0.71 0.00 0.00 54.79 54.99 1rac n ASP 100 Cb 0.59 0.93 -0.06 0.00 -0.02 0.00 0.00 41.12 42.56 1rac n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rac s ALA 101 N -3.20 -1.80 -0.18 2.24 0.00 -1.26 -4.22 121.76 113.33 1rac s ALA 101 Ca 0.03 1.36 -0.02 0.00 0.00 0.00 0.00 51.96 53.33 1rac s ALA 101 Cb 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 1rac s ALA 101 CO 0.82 -0.37 -0.09 0.42 0.00 0.00 0.00 175.76 176.54 1rac s ILE 102 N -1.24 3.08 -0.16 0.00 1.01 -0.47 -1.85 121.20 121.57 1rac s ILE 102 Ca -0.09 -0.61 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 1rac s ILE 102 Cb -0.00 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1rac s ILE 102 CO 0.07 0.47 0.06 -0.69 0.00 0.00 0.00 174.94 174.86 1rac s VAL 103 N 1.07 4.81 -0.03 2.92 1.01 0.07 -1.17 120.40 129.08 1rac s VAL 103 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 1rac s VAL 103 Cb -0.15 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.11 1rac s VAL 103 CO -0.02 0.50 0.14 0.00 0.00 0.00 0.00 175.10 175.72 1rac s MET 104 N 0.01 0.30 0.05 2.72 0.00 -0.93 -1.52 119.30 119.93 1rac s MET 104 Ca 0.06 -0.07 0.08 0.00 0.00 0.00 0.00 55.69 55.76 1rac s MET 104 Cb -0.12 0.13 -0.03 0.00 0.00 0.00 0.00 34.83 34.81 1rac s MET 104 CO 0.01 -0.06 -0.22 0.50 0.00 0.00 0.00 175.02 175.25 1rac s ARG 105 N -0.57 1.93 -0.03 3.16 3.52 -0.67 -0.72 118.95 125.57 1rac s ARG 105 Ca -0.07 -1.05 -0.15 0.00 -0.13 0.00 0.00 55.73 54.34 1rac s ARG 105 Cb -0.04 -2.09 0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1rac s ARG 105 CO 0.01 0.52 0.32 -1.58 -0.81 0.00 0.00 175.30 173.76 1rac s HIS 106 N -0.88 -0.22 -0.22 5.12 2.46 -0.56 -1.58 115.29 119.41 1rac s HIS 106 Ca 0.13 0.38 0.28 0.00 0.47 0.00 0.00 55.06 56.32 1rac s HIS 106 Cb -0.10 0.10 0.99 0.00 -0.13 0.00 0.00 32.58 33.44 1rac s HIS 106 CO 0.04 -0.36 1.82 -1.00 -2.47 0.00 0.00 174.74 172.77 1rac h PRO 107 N 4.13 0.00 -6.21 2.88 0.13 -1.89 -2.74 132.00 128.30 1rac h PRO 107 Ca -0.29 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.27 1rac h PRO 107 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1rac h PRO 107 CO 0.38 0.00 -0.29 -0.65 -0.23 0.00 0.00 178.00 177.21 1rac s GLN 108 N -3.43 3.62 0.20 0.86 -0.21 -1.26 -3.49 119.66 115.95 1rac s GLN 108 Ca 0.04 -0.08 -0.29 0.00 0.02 0.00 0.00 55.36 55.05 1rac s GLN 108 Cb 0.08 -2.82 -0.08 0.00 1.00 0.00 0.00 33.01 31.19 1rac s GLN 108 CO 0.55 0.44 0.92 -1.21 -2.12 0.00 0.00 175.29 173.87 1rac s GLU 109 N -2.78 4.79 0.00 2.91 8.01 -1.26 -3.47 118.70 126.90 1rac s GLU 109 Ca 0.41 1.44 0.00 0.00 0.01 0.00 0.00 54.97 56.84 1rac s GLU 109 Cb -0.12 -3.30 0.00 0.00 -4.31 0.00 0.00 34.13 26.40 1rac s GLU 109 CO 0.25 0.46 0.00 0.41 0.01 0.00 0.00 175.26 176.39 1rac n GLY 110 N 1.67 0.37 0.23 -1.39 0.00 -1.26 -4.97 105.19 99.85 1rac n GLY 110 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.02 1rac n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rac h ALA 111 N 0.00 1.43 -0.17 4.61 0.00 -1.92 -1.83 119.26 121.38 1rac h ALA 111 Ca 0.00 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.47 1rac h ALA 111 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1rac h ALA 111 CO 0.00 0.40 -0.67 0.00 0.00 0.00 0.00 179.25 178.98 1rac h ALA 112 N 1.60 0.51 -0.58 0.00 0.00 -1.93 -1.92 119.26 116.93 1rac h ALA 112 Ca 0.04 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 1rac h ALA 112 Cb 0.47 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1rac h ALA 112 CO 0.03 0.70 0.06 -0.09 0.00 0.00 0.00 179.25 179.96 1rac h ARG 113 N 0.47 0.99 -0.70 0.00 2.43 -1.86 -0.65 114.38 115.05 1rac h ARG 113 Ca -0.02 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 58.85 1rac h ARG 113 Cb 1.26 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 1rac h ARG 113 CO 0.13 0.95 0.38 1.25 -1.51 0.00 0.00 179.97 181.17 1rac h LEU 114 N 0.88 0.86 -1.38 3.80 6.46 -1.21 -2.67 115.31 122.07 1rac h LEU 114 Ca 0.17 -0.07 0.07 0.00 -0.12 0.00 0.00 57.88 57.93 1rac h LEU 114 Cb 0.47 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.13 1rac h LEU 114 CO 0.02 0.70 0.48 0.00 -0.62 0.00 0.00 178.44 179.01 1rac h ALA 115 N 1.44 1.71 -0.18 1.25 0.00 -0.31 -0.03 119.26 123.15 1rac h ALA 115 Ca 0.25 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.19 1rac h ALA 115 Cb 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1rac h ALA 115 CO -0.04 0.17 0.18 1.15 0.00 0.00 0.00 179.25 180.71 1rac h THR 116 N 0.75 0.54 0.00 0.00 2.02 -1.08 -0.09 112.91 115.05 1rac h THR 116 Ca 0.32 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.50 1rac h THR 116 Cb 0.27 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1rac h THR 116 CO -0.11 0.00 0.00 -0.33 0.37 0.00 0.00 175.52 175.45 1rac h GLU 117 N 0.00 0.00 -0.00 6.66 5.08 -1.06 -3.33 114.58 121.93 1rac h GLU 117 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1rac h GLU 117 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1rac h GLU 117 CO -0.00 0.00 -0.15 1.19 -1.00 0.00 0.00 179.01 179.05 1rac n PHE 118 N -2.46 0.00 1.62 4.33 3.72 -0.09 -4.74 117.46 119.85 1rac n PHE 118 Ca 0.05 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.58 1rac n PHE 118 Cb 0.44 0.00 0.61 0.00 -0.94 0.00 0.00 39.48 39.59 1rac n PHE 118 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1rac n SER 119 N -0.96 1.01 0.00 4.37 3.41 -0.94 -4.35 113.62 116.15 1rac n SER 119 Ca 0.01 -1.40 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1rac n SER 119 Cb 0.06 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1rac n SER 119 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rac n GLY 120 N 1.09 2.19 0.83 5.00 0.00 -1.26 -1.73 105.19 111.31 1rac n GLY 120 Ca 0.19 0.24 0.09 0.00 0.00 0.00 0.00 46.02 46.54 1rac n GLY 120 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rac n ASN 121 N 10.90 3.77 -4.60 1.61 3.02 -1.26 -4.89 115.26 123.81 1rac n ASN 121 Ca 0.00 -3.03 -0.38 0.00 -0.03 0.00 0.00 54.58 51.14 1rac n ASN 121 Cb 0.00 -0.54 -0.10 0.00 -0.61 0.00 0.00 39.78 38.53 1rac n ASN 121 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1rac s VAL 122 N -2.84 5.28 0.39 2.41 1.01 -0.71 -5.04 120.40 120.91 1rac s VAL 122 Ca 0.42 0.27 -0.26 0.00 0.00 0.00 0.00 61.98 62.40 1rac s VAL 122 Cb 0.34 -3.57 -0.11 0.00 0.00 0.00 0.00 36.38 33.04 1rac s VAL 122 CO 0.08 0.24 1.20 -2.65 0.00 0.00 0.00 175.10 173.97 1rac n PRO 123 N 5.03 1.80 -4.09 2.72 -0.02 -1.26 -4.79 135.00 134.39 1rac n PRO 123 Ca -0.13 0.64 -0.34 0.00 -2.02 0.00 0.00 63.50 61.65 1rac n PRO 123 Cb 0.52 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.60 1rac n PRO 123 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1rac s VAL 124 N -1.18 3.14 -0.13 -1.45 1.01 -1.26 -1.37 120.40 119.16 1rac s VAL 124 Ca 0.60 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1rac s VAL 124 Cb -0.55 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1rac s VAL 124 CO 0.59 0.46 -0.13 -0.76 0.00 0.00 0.00 175.10 175.25 1rac s LEU 125 N 1.24 2.71 -0.13 3.92 1.43 -0.32 -2.00 118.68 125.53 1rac s LEU 125 Ca 0.03 -0.32 -0.19 0.00 -1.03 0.00 0.00 54.13 52.62 1rac s LEU 125 Cb -0.14 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 1rac s LEU 125 CO -0.03 0.17 0.51 0.21 0.23 0.00 0.00 176.35 177.44 1rac s ASN 126 N 0.30 6.69 0.00 2.29 2.47 -0.03 -2.19 114.94 124.48 1rac s ASN 126 Ca -0.10 0.82 0.13 0.00 0.42 0.00 0.00 52.86 54.13 1rac s ASN 126 Cb -0.16 -2.30 0.30 0.00 -1.45 0.00 0.00 41.25 37.65 1rac s ASN 126 CO 0.06 -0.05 1.21 0.00 -3.72 0.00 0.00 177.10 174.60 1rac n ALA 127 N 3.93 2.29 0.00 1.71 0.00 0.11 -4.29 120.51 124.24 1rac n ALA 127 Ca -0.06 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1rac n ALA 127 Cb 0.51 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1rac n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rac n GLY 128 N 0.75 3.70 2.76 0.00 0.00 -1.24 -4.76 105.19 106.41 1rac n GLY 128 Ca 0.13 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 1rac n GLY 128 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1rac s ASP 129 N 0.00 4.01 0.65 1.61 -4.77 -0.82 -1.50 116.67 115.85 1rac s ASP 129 Ca 0.00 -1.97 0.00 0.00 -3.30 0.00 0.00 52.55 47.28 1rac s ASP 129 Cb 0.00 -1.00 0.00 0.00 -1.09 0.00 0.00 42.92 40.83 1rac s ASP 129 CO 0.00 -0.37 0.00 0.61 0.70 0.00 0.00 175.17 176.11 1rac n GLY 130 N 4.43 1.80 0.81 2.12 0.00 -1.03 -0.94 105.19 112.38 1rac n GLY 130 Ca 0.02 -0.44 -0.00 0.00 0.00 0.00 0.00 46.02 45.59 1rac n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1rac n SER 131 N -1.41 2.02 0.00 1.61 3.41 -1.26 -4.63 113.62 113.35 1rac n SER 131 Ca 0.00 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 1rac n SER 131 Cb 0.00 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.42 1rac n SER 131 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1rac n ASN 132 N 0.14 0.00 -4.51 4.04 5.15 -0.11 -4.88 115.26 115.10 1rac n ASN 132 Ca 0.04 0.00 -0.24 0.00 -0.60 0.00 0.00 54.58 53.78 1rac n ASN 132 Cb 0.45 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.59 1rac n ASN 132 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1rac s GLN 133 N 0.00 1.73 -0.46 1.20 -1.52 -1.25 -4.95 119.66 114.41 1rac s GLN 133 Ca 0.00 -1.93 0.06 0.00 -1.95 0.00 0.00 55.36 51.55 1rac s GLN 133 Cb 0.00 -1.34 0.29 0.00 -0.22 0.00 0.00 33.01 31.75 1rac s GLN 133 CO 0.00 -0.01 1.00 1.58 -0.25 0.00 0.00 175.29 177.61 1rac n HIS 134 N -0.75 -2.73 -0.06 0.91 -0.00 -1.26 -1.95 115.22 109.38 1rac n HIS 134 Ca -0.05 -2.18 0.10 0.00 -0.00 0.00 0.00 57.72 55.60 1rac n HIS 134 Cb 0.65 1.40 0.49 0.00 -0.00 0.00 0.00 29.99 32.54 1rac n HIS 134 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1rac h PRO 135 N 3.36 0.41 0.00 1.57 0.11 -1.83 -0.76 132.00 134.85 1rac h PRO 135 Ca -0.10 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 65.89 1rac h PRO 135 Cb 1.06 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1rac h PRO 135 CO 0.23 0.27 -0.46 0.00 -0.21 0.00 0.00 178.00 177.83 1rac h THR 136 N 0.42 0.84 -0.24 -1.15 1.03 -1.95 0.91 112.91 112.77 1rac h THR 136 Ca 0.24 -2.03 -0.18 0.00 -0.01 0.00 0.00 66.41 64.44 1rac h THR 136 Cb 0.42 2.30 0.00 0.00 -1.07 0.00 0.00 68.15 69.80 1rac h THR 136 CO -0.06 0.45 -0.54 -0.61 -0.01 0.00 0.00 175.52 174.75 1rac h GLN 137 N 0.00 0.79 -0.51 0.00 5.75 -1.51 -2.26 115.11 117.36 1rac h GLN 137 Ca -0.00 -0.53 -0.05 0.00 -0.15 0.00 0.00 58.65 57.92 1rac h GLN 137 Cb 1.26 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.86 1rac h GLN 137 CO 0.06 1.15 0.11 1.15 -2.65 0.00 0.00 178.83 178.65 1rac h THR 138 N 0.53 1.22 -0.25 2.39 2.02 -1.31 -1.62 112.91 115.89 1rac h THR 138 Ca 0.00 -0.80 -0.04 0.00 0.77 0.00 0.00 66.41 66.34 1rac h THR 138 Cb 1.15 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 1rac h THR 138 CO 0.12 0.30 -0.01 -0.07 0.37 0.00 0.00 175.52 176.23 1rac h LEU 139 N 0.75 0.43 -1.25 2.58 3.38 -0.76 -0.74 115.31 119.70 1rac h LEU 139 Ca 0.17 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 1rac h LEU 139 Cb 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1rac h LEU 139 CO -0.00 0.64 -0.33 0.17 0.09 0.00 0.00 178.44 179.01 1rac h LEU 140 N 0.21 0.07 0.34 1.67 8.10 -1.16 -1.24 115.31 123.30 1rac h LEU 140 Ca 0.07 -0.02 -0.02 0.00 0.11 0.00 0.00 57.88 58.02 1rac h LEU 140 Cb 0.43 -0.02 0.00 0.00 -0.44 0.00 0.00 40.66 40.63 1rac h LEU 140 CO 0.01 0.40 -0.17 0.44 -4.11 0.00 0.00 178.44 175.02 1rac h ASP 141 N 0.06 -0.39 -0.87 0.17 3.32 -1.09 -0.99 116.42 116.63 1rac h ASP 141 Ca 0.01 -0.15 0.14 0.00 0.02 0.00 0.00 57.03 57.04 1rac h ASP 141 Cb 0.62 0.10 -0.09 0.00 0.22 0.00 0.00 39.33 40.18 1rac h ASP 141 CO 0.05 -0.03 0.47 -0.07 -1.72 0.00 0.00 179.24 177.94 1rac h LEU 142 N -0.80 0.61 -1.01 1.55 3.38 -1.06 0.22 115.31 118.21 1rac h LEU 142 Ca -0.05 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1rac h LEU 142 Cb 0.52 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 1rac h LEU 142 CO 0.08 0.28 0.37 0.15 0.09 0.00 0.00 178.44 179.40 1rac h PHE 143 N 0.69 1.07 0.00 1.13 3.57 -0.90 0.33 116.94 122.83 1rac h PHE 143 Ca 0.47 -0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.83 1rac h PHE 143 Cb 0.61 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1rac h PHE 143 CO -0.07 0.77 -0.43 1.15 -2.23 0.00 0.00 178.31 177.49 1rac h THR 144 N 1.07 1.02 -0.03 4.41 2.02 0.73 -0.35 112.91 121.79 1rac h THR 144 Ca 0.26 -1.66 -0.09 0.00 0.77 0.00 0.00 66.41 65.69 1rac h THR 144 Cb 0.09 1.98 0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1rac h THR 144 CO -0.04 0.43 -0.33 0.40 0.37 0.00 0.00 175.52 176.35 1rac h ILE 145 N 0.00 1.47 0.32 3.11 2.04 -0.05 -2.66 117.51 121.74 1rac h ILE 145 Ca -0.00 -1.86 -0.01 0.00 1.00 0.00 0.00 64.86 63.98 1rac h ILE 145 Cb 0.94 2.55 -0.00 0.00 -0.74 0.00 0.00 36.82 39.57 1rac h ILE 145 CO 0.06 0.52 -0.18 -0.61 0.00 0.00 0.00 178.15 177.94 1rac h GLN 146 N -0.30 -0.45 -1.00 2.37 4.15 -0.81 0.22 115.11 119.29 1rac h GLN 146 Ca -0.03 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.47 1rac h GLN 146 Cb 1.03 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 28.76 1rac h GLN 146 CO 0.07 -0.30 0.65 1.49 -1.93 0.00 0.00 178.83 178.80 1rac h GLU 147 N -0.47 1.18 0.00 1.69 4.81 -1.18 0.16 114.58 120.77 1rac h GLU 147 Ca -0.04 -0.07 -0.25 0.00 -0.13 0.00 0.00 59.36 58.88 1rac h GLU 147 Cb 0.38 -0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1rac h GLU 147 CO 0.04 0.78 -1.46 1.79 -0.73 0.00 0.00 179.01 179.43 1rac h THR 148 N 1.21 0.97 -0.01 0.32 1.35 -1.19 -3.36 112.91 112.20 1rac h THR 148 Ca 0.42 -2.71 0.00 0.00 -0.55 0.00 0.00 66.41 63.57 1rac h THR 148 Cb 0.10 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.96 1rac h THR 148 CO -0.15 0.55 -0.67 0.00 -0.25 0.00 0.00 175.52 175.00 1rac n GLN 149 N -3.09 0.79 0.00 4.72 1.13 0.74 -4.98 117.38 116.68 1rac n GLN 149 Ca -0.11 -0.63 0.00 0.00 -1.94 0.00 0.00 57.00 54.31 1rac n GLN 149 Cb 0.98 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.85 1rac n GLN 149 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rac n GLY 150 N 1.45 2.75 3.55 1.08 0.00 0.55 -4.94 105.19 109.62 1rac n GLY 150 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1rac n GLY 150 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rac s ARG 151 N 0.00 1.54 -0.03 1.61 1.70 -1.24 -4.95 118.95 117.59 1rac s ARG 151 Ca 0.00 -1.32 0.04 0.00 -0.47 0.00 0.00 55.73 53.98 1rac s ARG 151 Cb 0.00 0.45 0.06 0.00 -0.57 0.00 0.00 34.95 34.89 1rac s ARG 151 CO 0.00 -0.63 0.98 1.28 -1.08 0.00 0.00 175.30 175.85 1rac n LEU 152 N -0.38 1.78 -4.15 -1.89 4.32 -1.26 -4.00 117.00 111.42 1rac n LEU 152 Ca -0.01 -1.97 -0.10 0.00 -0.02 0.00 0.00 56.01 53.91 1rac n LEU 152 Cb 0.62 -0.09 -0.10 0.00 -1.62 0.00 0.00 43.42 42.23 1rac n LEU 152 CO 0.24 0.48 -0.38 1.51 -1.22 0.00 0.00 177.39 178.02 1rac s ASP 153 N -1.28 0.99 -1.52 -1.43 1.47 -1.26 -4.59 116.67 109.05 1rac s ASP 153 Ca 0.07 -1.01 -0.04 0.00 1.18 0.00 0.00 52.55 52.75 1rac s ASP 153 Cb 0.06 0.12 0.00 0.00 -0.34 0.00 0.00 42.92 42.76 1rac s ASP 153 CO 0.01 -0.50 0.48 0.59 0.68 0.00 0.00 175.17 176.42 1rac n ASN 154 N -0.02 -5.88 -4.90 2.11 4.13 0.82 -4.93 115.26 106.59 1rac n ASN 154 Ca -0.12 -0.23 -0.32 0.00 1.68 0.00 0.00 54.58 55.59 1rac n ASN 154 Cb 0.61 -4.74 -0.04 0.00 -1.54 0.00 0.00 39.78 34.07 1rac n ASN 154 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1rac s LEU 155 N -6.24 4.32 -0.43 3.41 1.43 -1.26 -4.89 118.68 115.02 1rac s LEU 155 Ca 0.24 0.46 -0.08 0.00 -1.03 0.00 0.00 54.13 53.72 1rac s LEU 155 Cb -0.10 -3.09 0.09 0.00 0.03 0.00 0.00 46.19 43.11 1rac s LEU 155 CO 0.29 0.12 0.27 -1.00 0.23 0.00 0.00 176.35 176.26 1rac s HIS 156 N -1.55 3.39 -0.19 0.29 3.76 -1.26 -0.23 115.29 119.49 1rac s HIS 156 Ca 0.37 -1.73 -0.02 0.00 -0.15 0.00 0.00 55.06 53.52 1rac s HIS 156 Cb -0.13 -3.10 -0.01 0.00 1.11 0.00 0.00 32.58 30.46 1rac s HIS 156 CO 0.25 -0.90 -0.08 0.08 -0.85 0.00 0.00 174.74 173.24 1rac s VAL 157 N 1.37 3.23 -0.15 -0.90 1.01 -0.52 -1.14 120.40 123.30 1rac s VAL 157 Ca 0.04 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.38 1rac s VAL 157 Cb -0.24 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1rac s VAL 157 CO 0.01 0.47 0.11 0.00 0.00 0.00 0.00 175.10 175.68 1rac s ALA 158 N 1.07 3.70 -0.14 5.51 0.00 0.17 -1.98 121.76 130.10 1rac s ALA 158 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.30 1rac s ALA 158 Cb -0.15 -1.97 0.01 0.00 0.00 0.00 0.00 23.12 21.01 1rac s ALA 158 CO -0.01 0.42 -0.21 -1.64 0.00 0.00 0.00 175.76 174.31 1rac s MET 159 N -0.41 2.96 -0.08 0.00 1.00 0.35 -0.61 119.30 122.51 1rac s MET 159 Ca 0.11 -0.83 0.04 0.00 0.00 0.00 0.00 55.69 55.00 1rac s MET 159 Cb -0.12 -2.41 0.00 0.00 0.00 0.00 0.00 34.83 32.31 1rac s MET 159 CO 0.02 -0.04 -0.20 0.08 0.00 0.00 0.00 175.02 174.88 1rac s VAL 160 N 0.87 1.73 0.00 -6.03 1.01 -0.29 -1.18 120.40 116.51 1rac s VAL 160 Ca -0.06 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1rac s VAL 160 Cb -0.15 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.71 1rac s VAL 160 CO -0.03 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1rac n GLY 161 N 3.57 0.33 3.47 4.51 0.00 -0.83 -0.69 105.19 115.55 1rac n GLY 161 Ca -0.20 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.06 1rac n GLY 161 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rac s ASP 162 N -4.00 6.12 -0.01 1.61 2.15 -1.26 -4.28 116.67 117.00 1rac s ASP 162 Ca 0.00 -0.82 0.21 0.00 0.43 0.00 0.00 52.55 52.37 1rac s ASP 162 Cb 0.00 -2.17 -0.26 0.00 -0.30 0.00 0.00 42.92 40.20 1rac s ASP 162 CO 0.00 -0.45 0.76 0.18 -0.17 0.00 0.00 175.17 175.48 1rac n LEU 163 N 5.23 0.62 0.02 -1.34 4.77 0.10 -3.61 117.00 122.79 1rac n LEU 163 Ca -0.11 -0.30 -0.18 0.00 -0.03 0.00 0.00 56.01 55.39 1rac n LEU 163 Cb 0.47 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.44 1rac n LEU 163 CO 0.41 0.15 0.18 0.50 -1.33 0.00 0.00 177.39 177.30 1rac h LYS 164 N 0.00 0.37 -0.02 3.23 3.64 0.19 -3.37 116.57 120.62 1rac h LYS 164 Ca 0.00 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1rac h LYS 164 Cb 0.69 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1rac h LYS 164 CO 0.00 1.15 -0.19 0.66 -2.27 0.00 0.00 179.45 178.80 1rac n TYR 165 N -4.18 0.00 -2.48 1.91 4.01 -1.26 -4.82 117.16 110.33 1rac n TYR 165 Ca -0.12 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.22 1rac n TYR 165 Cb 0.73 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.73 1rac n TYR 165 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1rac s GLY 166 N -1.68 0.83 0.46 2.72 0.00 -1.24 -4.88 107.32 103.53 1rac s GLY 166 Ca 0.16 -1.40 0.22 0.00 0.00 0.00 0.00 44.72 43.70 1rac s GLY 166 CO 0.32 2.76 1.88 -0.09 0.00 0.00 0.00 173.10 177.97 1rac h ARG 167 N 10.61 0.26 0.04 2.90 2.43 -1.90 -2.66 114.38 126.07 1rac h ARG 167 Ca -0.21 -0.02 -0.23 0.00 -0.81 0.00 0.00 59.98 58.72 1rac h ARG 167 Cb 1.06 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1rac h ARG 167 CO 1.29 0.17 -1.01 1.79 -1.51 0.00 0.00 179.97 180.70 1rac h THR 168 N 0.27 1.52 -0.02 0.20 1.35 -1.93 -2.84 112.91 111.46 1rac h THR 168 Ca 0.43 -2.84 -0.09 0.00 -0.55 0.00 0.00 66.41 63.36 1rac h THR 168 Cb 1.26 2.66 -0.01 0.00 -1.73 0.00 0.00 68.15 70.33 1rac h THR 168 CO -0.12 0.83 -0.41 -0.37 -0.25 0.00 0.00 175.52 175.21 1rac h VAL 169 N 0.10 1.30 -0.13 6.82 -1.51 -1.85 -2.19 116.25 118.78 1rac h VAL 169 Ca -0.07 -1.42 -0.07 0.00 -1.23 0.00 0.00 66.70 63.92 1rac h VAL 169 Cb 1.69 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 32.59 1rac h VAL 169 CO 0.16 0.41 -0.18 0.45 -1.23 0.00 0.00 177.57 177.18 1rac h HIS 170 N 0.04 0.43 -0.18 5.19 3.86 -1.51 -2.60 115.15 120.37 1rac h HIS 170 Ca 0.00 -0.14 -0.11 0.00 -1.16 0.00 0.00 60.37 58.96 1rac h HIS 170 Cb 0.74 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 1rac h HIS 170 CO 0.00 0.79 -0.37 0.77 0.86 0.00 0.00 177.93 179.98 1rac h SER 171 N -0.05 0.40 0.42 2.45 0.02 -1.46 -2.95 113.55 112.39 1rac h SER 171 Ca 0.01 -0.16 -0.14 0.00 -0.84 0.00 0.00 61.79 60.67 1rac h SER 171 Cb 0.74 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 1rac h SER 171 CO 0.04 0.74 -0.59 0.25 -1.14 0.00 0.00 176.83 176.13 1rac h LEU 172 N 0.33 0.19 -0.73 5.07 5.85 -1.31 -0.69 115.31 124.01 1rac h LEU 172 Ca 0.04 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.58 1rac h LEU 172 Cb 0.80 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1rac h LEU 172 CO 0.06 0.73 0.14 0.74 -0.34 0.00 0.00 178.44 179.78 1rac h THR 173 N 0.12 1.26 -0.28 1.05 2.02 -1.43 0.16 112.91 115.82 1rac h THR 173 Ca -0.00 -1.00 -0.10 0.00 0.77 0.00 0.00 66.41 66.07 1rac h THR 173 Cb 1.07 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1rac h THR 173 CO 0.09 0.38 -0.25 1.56 0.37 0.00 0.00 175.52 177.67 1rac h GLN 174 N 1.05 0.55 0.02 6.66 4.20 -1.20 -1.86 115.11 124.52 1rac h GLN 174 Ca 0.21 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rac h GLN 174 Cb 0.40 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1rac h GLN 174 CO 0.01 0.75 -0.01 0.00 -0.67 0.00 0.00 178.83 178.91 1rac h ALA 175 N 1.25 -0.03 0.00 3.87 0.00 -0.85 -3.20 119.26 120.30 1rac h ALA 175 Ca 0.07 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1rac h ALA 175 Cb 0.69 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1rac h ALA 175 CO 0.05 -0.16 -0.00 -0.07 0.00 0.00 0.00 179.25 179.07 1rac h LEU 176 N -0.74 0.00 -0.03 0.00 3.38 -0.70 0.24 115.31 117.46 1rac h LEU 176 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rac h LEU 176 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1rac h LEU 176 CO 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.51 1rac n ALA 177 N -2.12 2.53 0.47 1.53 0.00 -0.70 -2.66 120.51 119.56 1rac n ALA 177 Ca -0.03 -0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.38 1rac n ALA 177 Cb 0.10 -1.45 0.43 0.00 0.00 0.00 0.00 19.45 18.53 1rac n ALA 177 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1rac h LYS 178 N 0.08 0.00 -5.87 0.00 1.57 -0.57 -3.46 116.57 108.32 1rac h LYS 178 Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 1rac h LYS 178 Cb 0.35 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.60 1rac h LYS 178 CO 0.00 0.00 -0.33 -0.06 -0.57 0.00 0.00 179.45 178.49 1rac s PHE 179 N -3.24 1.73 -0.01 -1.35 0.08 -1.09 -4.88 117.98 109.22 1rac s PHE 179 Ca 0.07 -0.83 -0.02 0.00 0.12 0.00 0.00 56.93 56.28 1rac s PHE 179 Cb 0.10 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.61 1rac s PHE 179 CO 0.53 -0.37 0.12 -0.51 -0.10 0.00 0.00 175.22 174.89 1rac s ASP 180 N -4.22 5.96 -0.85 1.36 1.01 -1.26 -4.64 116.67 114.03 1rac s ASP 180 Ca 0.32 0.24 0.00 0.00 0.71 0.00 0.00 52.55 53.82 1rac s ASP 180 Cb -0.02 -1.78 0.00 0.00 1.01 0.00 0.00 42.92 42.13 1rac s ASP 180 CO 0.20 0.28 0.00 0.61 0.21 0.00 0.00 175.17 176.47 1rac n GLY 181 N 1.16 0.82 3.80 0.21 0.00 -1.26 -0.12 105.19 109.79 1rac n GLY 181 Ca -0.13 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 1rac n GLY 181 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rac s ASN 182 N -2.35 6.34 -0.11 1.61 0.01 -1.26 -4.01 114.94 115.17 1rac s ASN 182 Ca 0.00 1.94 0.02 0.00 -0.71 0.00 0.00 52.86 54.11 1rac s ASN 182 Cb 0.00 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 39.11 1rac s ASN 182 CO 0.00 -0.78 -0.18 -0.13 -1.51 0.00 0.00 177.10 174.50 1rac s ARG 183 N -3.21 2.52 -0.11 -0.60 0.52 0.68 -4.17 118.95 114.58 1rac s ARG 183 Ca 0.67 -0.67 -0.04 0.00 -0.52 0.00 0.00 55.73 55.16 1rac s ARG 183 Cb -0.17 -2.07 -0.04 0.00 0.52 0.00 0.00 34.95 33.20 1rac s ARG 183 CO 0.20 -0.01 0.06 -0.06 0.02 0.00 0.00 175.30 175.50 1rac s PHE 184 N 0.84 3.32 -0.18 -0.53 0.08 -0.65 -1.44 117.98 119.42 1rac s PHE 184 Ca -0.09 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.25 1rac s PHE 184 Cb -0.15 -1.89 0.01 0.00 -0.57 0.00 0.00 43.02 40.42 1rac s PHE 184 CO -0.00 0.51 -0.17 0.71 -0.10 0.00 0.00 175.22 176.17 1rac s TYR 185 N -0.73 2.81 -0.15 0.36 2.02 -0.84 -0.61 117.35 120.21 1rac s TYR 185 Ca 0.12 -1.47 -0.06 0.00 -0.37 0.00 0.00 57.07 55.30 1rac s TYR 185 Cb -0.12 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.46 1rac s TYR 185 CO 0.03 -0.73 0.05 -0.06 -1.57 0.00 0.00 175.55 173.26 1rac s PHE 186 N 1.28 3.26 -0.27 2.71 0.08 0.33 -0.49 117.98 124.88 1rac s PHE 186 Ca 0.04 0.14 -0.02 0.00 0.12 0.00 0.00 56.93 57.21 1rac s PHE 186 Cb -0.13 -1.98 0.09 0.00 -0.57 0.00 0.00 43.02 40.42 1rac s PHE 186 CO -0.10 0.30 0.08 0.42 -0.10 0.00 0.00 175.22 175.82 1rac s ILE 187 N -0.15 0.64 -0.01 0.64 1.01 -0.33 -1.64 121.20 121.36 1rac s ILE 187 Ca 0.07 -1.02 -0.08 0.00 0.00 0.00 0.00 60.65 59.61 1rac s ILE 187 Cb -0.12 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 41.00 1rac s ILE 187 CO 0.01 -0.51 0.17 0.00 0.00 0.00 0.00 174.94 174.62 1rac s ALA 188 N 1.76 -0.42 0.83 9.38 0.00 -1.26 -1.96 121.76 130.09 1rac s ALA 188 Ca 0.06 0.06 -0.13 0.00 0.00 0.00 0.00 51.96 51.95 1rac s ALA 188 Cb -0.17 0.03 0.10 0.00 0.00 0.00 0.00 23.12 23.07 1rac s ALA 188 CO -0.21 -0.19 1.19 -2.14 0.00 0.00 0.00 175.76 174.41 1rac s PRO 189 N -1.10 1.51 0.23 0.00 0.02 -1.26 -4.81 135.00 129.59 1rac s PRO 189 Ca -0.12 1.72 -0.07 0.00 0.02 0.00 0.00 61.00 62.55 1rac s PRO 189 Cb -0.06 -1.77 0.26 0.00 0.02 0.00 0.00 34.50 32.96 1rac s PRO 189 CO 0.02 -2.30 1.86 -0.44 -0.33 0.00 0.00 177.00 175.81 1rac h ASP 190 N -1.09 0.85 0.85 2.53 3.32 -1.99 0.93 116.42 121.82 1rac h ASP 190 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1rac h ASP 190 Cb 1.29 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1rac h ASP 190 CO 0.45 0.57 0.00 0.00 -1.72 0.00 0.00 179.24 178.55 1rac h ALA 191 N 1.36 1.00 -0.22 3.45 0.00 -2.00 -3.26 119.26 119.58 1rac h ALA 191 Ca 0.34 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 1rac h ALA 191 Cb 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1rac h ALA 191 CO -0.13 0.00 -0.04 1.28 0.00 0.00 0.00 179.25 180.36 1rac n LEU 192 N -2.62 3.61 -4.49 0.00 4.77 0.30 -4.91 117.00 113.67 1rac n LEU 192 Ca 0.01 -3.26 -0.37 0.00 -0.03 0.00 0.00 56.01 52.36 1rac n LEU 192 Cb 0.26 -0.55 0.05 0.00 -2.33 0.00 0.00 43.42 40.85 1rac n LEU 192 CO 0.23 0.86 0.13 0.00 -1.33 0.00 0.00 177.39 177.27 1rac n ALA 193 N -0.88 -1.08 -2.03 -1.18 0.00 -1.10 0.53 120.51 114.77 1rac n ALA 193 Ca 0.23 -0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 1rac n ALA 193 Cb 0.87 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1rac n ALA 193 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1rac s MET 194 N -2.39 4.10 0.49 0.00 1.75 -1.26 -2.98 119.30 119.01 1rac s MET 194 Ca 0.69 2.08 -0.22 0.00 -1.25 0.00 0.00 55.69 56.99 1rac s MET 194 Cb -0.41 -3.99 -0.08 0.00 2.84 0.00 0.00 34.83 33.19 1rac s MET 194 CO 0.54 -0.94 1.08 -0.35 -0.65 0.00 0.00 175.02 174.71 1rac n PRO 195 N 7.23 1.37 -0.31 4.11 -0.04 -1.26 -4.78 135.00 141.32 1rac n PRO 195 Ca 0.18 0.50 0.15 0.00 -0.04 0.00 0.00 63.50 64.28 1rac n PRO 195 Cb 0.43 -2.21 0.32 0.00 -0.04 0.00 0.00 33.50 32.00 1rac n PRO 195 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1rac h GLN 196 N 1.31 0.21 0.00 0.54 1.08 -1.98 -0.68 115.11 115.58 1rac h GLN 196 Ca -0.47 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 56.71 1rac h GLN 196 Cb 1.33 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.71 1rac h GLN 196 CO 0.56 0.14 -0.05 0.10 -0.95 0.00 0.00 178.83 178.62 1rac h TYR 197 N 0.21 0.00 0.01 2.96 -0.00 -1.99 0.42 116.97 118.59 1rac h TYR 197 Ca 0.58 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 59.31 1rac h TYR 197 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.94 1rac h TYR 197 CO -0.24 0.05 -0.00 0.82 -0.00 0.00 0.00 178.16 178.80 1rac h ILE 198 N 0.00 1.57 -0.43 -0.90 1.08 -1.50 -2.71 117.51 114.63 1rac h ILE 198 Ca -0.00 -2.10 0.00 0.00 -0.39 0.00 0.00 64.86 62.37 1rac h ILE 198 Cb 0.18 2.92 -0.02 0.00 -3.07 0.00 0.00 36.82 36.83 1rac h ILE 198 CO 0.01 0.52 0.27 -0.07 -0.69 0.00 0.00 178.15 178.18 1rac h LEU 199 N -0.96 0.50 -0.33 1.44 3.38 -0.64 -1.07 115.31 117.63 1rac h LEU 199 Ca -0.00 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.00 1rac h LEU 199 Cb 0.85 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.42 1rac h LEU 199 CO 0.00 0.39 -0.05 0.44 0.09 0.00 0.00 178.44 179.31 1rac h ASP 200 N 0.57 -0.25 -0.75 -0.43 3.32 -0.34 -0.07 116.42 118.48 1rac h ASP 200 Ca 0.15 0.09 0.09 0.00 0.02 0.00 0.00 57.03 57.38 1rac h ASP 200 Cb -0.03 0.18 -0.07 0.00 0.22 0.00 0.00 39.33 39.63 1rac h ASP 200 CO -0.03 -0.08 0.41 -0.03 -1.72 0.00 0.00 179.24 177.78 1rac h MET 201 N 0.03 0.68 -0.18 3.56 4.05 -1.11 -1.53 114.93 120.43 1rac h MET 201 Ca 0.16 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.52 1rac h MET 201 Cb 0.24 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1rac h MET 201 CO -0.32 0.45 0.05 -0.07 0.23 0.00 0.00 176.91 177.25 1rac h LEU 202 N 0.70 0.26 -0.30 3.39 3.38 -0.32 -2.78 115.31 119.64 1rac h LEU 202 Ca 0.36 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 58.17 1rac h LEU 202 Cb 0.32 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 1rac h LEU 202 CO -0.24 0.41 -0.04 0.44 0.09 0.00 0.00 178.44 179.10 1rac h ASP 203 N 0.10 -0.20 0.04 -0.43 3.32 -0.78 -1.08 116.42 117.40 1rac h ASP 203 Ca 0.06 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1rac h ASP 203 Cb 0.25 0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1rac h ASP 203 CO -0.00 -0.06 -0.01 -0.08 -1.72 0.00 0.00 179.24 177.36 1rac h GLU 204 N 0.04 0.00 -0.40 3.56 4.22 -1.15 0.99 114.58 121.84 1rac h GLU 204 Ca 0.14 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.58 1rac h GLU 204 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1rac h GLU 204 CO -0.27 0.01 0.00 1.63 -2.18 0.00 0.00 179.01 178.20 1rac n LYS 205 N -3.68 2.35 -1.61 1.92 4.01 -0.44 -4.93 118.16 115.78 1rac n LYS 205 Ca -0.03 -2.05 -0.07 0.00 -0.51 0.00 0.00 58.31 55.65 1rac n LYS 205 Cb 0.10 -1.48 -0.02 0.00 -0.51 0.00 0.00 35.03 33.11 1rac n LYS 205 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rac n GLY 206 N 1.43 0.57 3.82 0.72 0.00 0.34 -5.00 105.19 107.08 1rac n GLY 206 Ca 0.19 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1rac n GLY 206 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rac s ILE 207 N -2.31 4.98 0.13 -0.61 1.01 -0.99 -5.04 121.20 118.38 1rac s ILE 207 Ca 0.00 0.94 -0.30 0.00 0.00 0.00 0.00 60.65 61.29 1rac s ILE 207 Cb 0.00 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.64 1rac s ILE 207 CO 0.00 0.54 1.09 0.00 0.00 0.00 0.00 174.94 176.57 1rac s ALA 208 N -0.86 3.34 0.06 9.38 0.00 -1.26 -4.49 121.76 127.92 1rac s ALA 208 Ca 0.25 0.76 -0.10 0.00 0.00 0.00 0.00 51.96 52.88 1rac s ALA 208 Cb -0.17 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1rac s ALA 208 CO 0.14 -0.23 0.21 1.67 0.00 0.00 0.00 175.76 177.56 1rac s TRP 209 N 0.13 0.06 0.12 0.00 1.48 -1.26 -1.63 118.94 117.84 1rac s TRP 209 Ca 0.51 -0.33 -0.13 0.00 -1.06 0.00 0.00 56.10 55.10 1rac s TRP 209 Cb -0.28 -0.02 0.02 0.00 -1.16 0.00 0.00 33.47 32.03 1rac s TRP 209 CO 0.33 -0.48 0.32 -1.54 -4.06 0.00 0.00 176.95 171.52 1rac s SER 210 N -2.32 -0.07 -0.14 -2.66 1.04 0.22 -4.94 113.70 104.82 1rac s SER 210 Ca -0.02 -0.52 -0.07 0.00 0.48 0.00 0.00 55.95 55.82 1rac s SER 210 Cb 0.01 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1rac s SER 210 CO -0.06 -0.83 0.10 -0.76 0.98 0.00 0.00 173.24 172.67 1rac s LEU 211 N -2.85 4.08 0.06 2.42 1.02 -1.26 -0.51 118.68 121.64 1rac s LEU 211 Ca 0.06 0.28 0.02 0.00 0.02 0.00 0.00 54.13 54.51 1rac s LEU 211 Cb 0.03 -2.01 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 1rac s LEU 211 CO -0.09 0.31 -0.07 -1.00 0.02 0.00 0.00 176.35 175.51 1rac s HIS 212 N -0.41 0.71 -1.89 0.29 3.76 -0.65 -4.92 115.29 112.18 1rac s HIS 212 Ca 0.11 -0.66 0.19 0.00 -0.15 0.00 0.00 55.06 54.55 1rac s HIS 212 Cb -0.12 -0.43 0.43 0.00 1.11 0.00 0.00 32.58 33.57 1rac s HIS 212 CO 0.02 -0.12 1.36 -1.13 -0.85 0.00 0.00 174.74 174.01 1rac n SER 213 N 0.93 3.35 -3.76 1.40 3.41 -1.26 -4.26 113.62 113.42 1rac n SER 213 Ca -0.19 -1.95 -0.13 0.00 -0.26 0.00 0.00 58.87 56.34 1rac n SER 213 Cb 0.57 -0.29 -0.11 0.00 -0.26 0.00 0.00 64.21 64.12 1rac n SER 213 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1rac s SER 214 N -1.19 -0.34 0.34 4.04 0.15 -1.26 -4.99 113.70 110.44 1rac s SER 214 Ca 0.36 0.66 0.02 0.00 0.70 0.00 0.00 55.95 57.69 1rac s SER 214 Cb 0.20 0.67 0.60 0.00 -1.71 0.00 0.00 66.02 65.78 1rac s SER 214 CO 0.27 -0.12 1.96 0.40 1.20 0.00 0.00 173.24 176.95 1rac h ILE 215 N 4.62 1.18 -0.74 6.45 1.08 -1.92 -2.83 117.51 125.34 1rac h ILE 215 Ca -0.26 -0.45 0.17 0.00 -0.39 0.00 0.00 64.86 63.92 1rac h ILE 215 Cb 1.19 0.43 -0.04 0.00 -3.07 0.00 0.00 36.82 35.32 1rac h ILE 215 CO 0.30 0.20 0.50 -0.08 -0.69 0.00 0.00 178.15 178.38 1rac h GLU 216 N 0.78 0.27 0.00 2.37 4.81 -1.94 0.28 114.58 121.15 1rac h GLU 216 Ca 0.20 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1rac h GLU 216 Cb 0.04 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1rac h GLU 216 CO -0.03 0.18 0.00 0.93 -0.73 0.00 0.00 179.01 179.36 1rac h GLU 217 N 0.28 0.00 0.00 1.92 5.08 -1.92 -3.35 114.58 116.59 1rac h GLU 217 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1rac h GLU 217 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1rac h GLU 217 CO -0.09 0.00 0.00 1.55 -1.00 0.00 0.00 179.01 179.47 1rac n VAL 218 N -2.53 0.00 -0.30 3.13 3.14 0.83 -4.85 118.33 117.75 1rac n VAL 218 Ca 0.01 -0.15 -0.01 0.00 -2.96 0.00 0.00 64.34 61.23 1rac n VAL 218 Cb 0.23 1.18 0.05 0.00 -1.06 0.00 0.00 33.84 34.24 1rac n VAL 218 CO 0.00 0.00 0.00 -0.03 -6.46 0.00 0.00 176.83 170.34 1rac h MET 219 N 0.00 -0.05 -1.16 1.45 -1.53 -1.21 -1.14 114.93 111.28 1rac h MET 219 Ca 0.00 0.00 0.33 0.00 -3.44 0.00 0.00 59.70 56.59 1rac h MET 219 Cb 0.09 0.01 -0.07 0.00 -0.55 0.00 0.00 31.60 31.09 1rac h MET 219 CO 0.00 -0.04 0.81 0.00 0.14 0.00 0.00 176.91 177.82 1rac h ALA 220 N 1.41 2.86 -0.17 0.39 0.00 -1.86 -1.12 119.26 120.77 1rac h ALA 220 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1rac h ALA 220 Cb 0.59 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1rac h ALA 220 CO -0.85 -1.23 0.00 0.39 0.00 0.00 0.00 179.25 177.56 1rac n GLU 221 N -4.33 2.05 -3.90 0.00 -0.58 -0.43 -4.58 120.64 108.87 1rac n GLU 221 Ca 0.26 -1.90 -0.36 0.00 -0.42 0.00 0.00 57.16 54.74 1rac n GLU 221 Cb 1.16 -1.42 -0.06 0.00 -0.57 0.00 0.00 31.44 30.56 1rac n GLU 221 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1rac s VAL 222 N -1.53 5.46 -0.25 2.62 1.01 -0.42 -4.73 120.40 122.56 1rac s VAL 222 Ca 0.28 0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.28 1rac s VAL 222 Cb 0.18 -3.42 -0.12 0.00 0.00 0.00 0.00 36.38 33.02 1rac s VAL 222 CO 0.26 0.54 -0.29 0.47 0.00 0.00 0.00 175.10 176.09 1rac n ASP 223 N 1.72 1.89 -3.99 3.32 8.00 -0.29 -4.50 116.55 122.70 1rac n ASP 223 Ca -0.18 0.17 -0.25 0.00 0.71 0.00 0.00 54.79 55.25 1rac n ASP 223 Cb 0.54 -0.62 -0.17 0.00 -0.02 0.00 0.00 41.12 40.85 1rac n ASP 223 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rac s ILE 224 N -2.46 1.05 -0.42 0.53 -1.09 -1.12 -1.59 121.20 116.09 1rac s ILE 224 Ca -0.34 -0.40 -0.04 0.00 -2.23 0.00 0.00 60.65 57.64 1rac s ILE 224 Cb 0.12 -0.99 0.11 0.00 -1.58 0.00 0.00 42.46 40.12 1rac s ILE 224 CO 0.47 0.34 0.23 -0.22 -1.23 0.00 0.00 174.94 174.53 1rac s LEU 225 N 0.90 5.31 -0.42 2.97 2.96 0.00 -0.65 118.68 129.75 1rac s LEU 225 Ca -0.10 -2.04 -0.16 0.00 -0.22 0.00 0.00 54.13 51.61 1rac s LEU 225 Cb -0.15 -1.85 0.02 0.00 0.50 0.00 0.00 46.19 44.71 1rac s LEU 225 CO 0.01 -0.56 0.37 -0.47 -1.32 0.00 0.00 176.35 174.38 1rac s TYR 226 N 1.13 3.21 0.18 5.38 6.14 0.22 -2.31 117.35 131.30 1rac s TYR 226 Ca 0.08 -0.51 -0.11 0.00 0.64 0.00 0.00 57.07 57.17 1rac s TYR 226 Cb -0.23 -2.75 -0.07 0.00 0.42 0.00 0.00 41.96 39.33 1rac s TYR 226 CO -0.04 -0.65 0.51 -1.64 0.64 0.00 0.00 175.55 174.37 1rac s MET 227 N 1.88 3.83 0.18 4.97 -1.94 -0.84 -1.14 119.30 126.24 1rac s MET 227 Ca 0.08 0.29 0.07 0.00 -1.71 0.00 0.00 55.69 54.42 1rac s MET 227 Cb -0.18 -2.79 -0.04 0.00 2.01 0.00 0.00 34.83 33.82 1rac s MET 227 CO 0.11 0.41 -0.14 0.99 -0.01 0.00 0.00 175.02 176.38 1rac s THR 228 N -1.64 1.59 0.08 2.05 2.01 0.13 -4.46 115.64 115.39 1rac s THR 228 Ca 0.42 -2.08 -0.15 0.00 0.31 0.00 0.00 61.69 60.20 1rac s THR 228 Cb -0.13 -1.91 -0.06 0.00 0.01 0.00 0.00 72.50 70.41 1rac s THR 228 CO 0.20 -0.56 0.49 0.00 -0.69 0.00 0.00 174.62 174.06 1rac s ARG 229 N -3.41 3.97 -0.11 4.92 1.70 -1.26 -4.47 118.95 120.29 1rac s ARG 229 Ca 0.19 0.46 -0.14 0.00 -0.47 0.00 0.00 55.73 55.78 1rac s ARG 229 Cb -0.01 -3.08 -0.05 0.00 -0.57 0.00 0.00 34.95 31.24 1rac s ARG 229 CO 0.05 0.58 0.32 0.08 -1.08 0.00 0.00 175.30 175.25 1rac s VAL 230 N -1.28 5.25 -0.21 4.99 1.01 -1.26 -4.35 120.40 124.55 1rac s VAL 230 Ca 0.31 0.62 -0.16 0.00 0.00 0.00 0.00 61.98 62.75 1rac s VAL 230 Cb -0.16 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1rac s VAL 230 CO 0.17 0.46 0.41 -1.10 0.00 0.00 0.00 175.10 175.04 1rac s GLN 231 N -0.13 4.16 0.00 2.72 1.11 -1.26 -4.96 119.66 121.30 1rac s GLN 231 Ca 0.19 0.20 0.07 0.00 0.01 0.00 0.00 55.36 55.83 1rac s GLN 231 Cb -0.14 -3.55 0.42 0.00 -1.01 0.00 0.00 33.01 28.73 1rac s GLN 231 CO 0.07 -0.07 0.87 0.36 0.01 0.00 0.00 175.29 176.53 1rac n LYS 232 N 4.59 0.23 0.13 2.91 2.85 -1.26 -1.02 118.16 126.58 1rac n LYS 232 Ca -0.08 0.00 -0.00 0.00 -1.05 0.00 0.00 58.31 57.18 1rac n LYS 232 Cb 0.51 -1.48 0.06 0.00 -0.65 0.00 0.00 35.03 33.47 1rac n LYS 232 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1rac h GLU 233 N 0.00 0.00 0.00 -1.58 5.08 -1.95 -3.23 114.58 112.90 1rac h GLU 233 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1rac h GLU 233 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1rac h GLU 233 CO 0.00 0.64 0.00 0.54 -1.00 0.00 0.00 179.01 179.19 1rac n ARG 234 N -3.39 0.16 -2.05 2.33 5.12 -0.18 -4.78 116.66 113.86 1rac n ARG 234 Ca 0.01 0.15 -0.01 0.00 -1.93 0.00 0.00 57.85 56.07 1rac n ARG 234 Cb 0.74 -1.50 -0.00 0.00 -1.16 0.00 0.00 32.46 30.53 1rac n ARG 234 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1rac n LEU 235 N -1.36 0.00 -4.79 0.55 4.77 -1.22 -5.05 117.00 109.90 1rac n LEU 235 Ca 0.07 -0.13 -0.22 0.00 -0.03 0.00 0.00 56.01 55.70 1rac n LEU 235 Cb 0.16 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.28 1rac n LEU 235 CO 0.14 -0.02 -0.15 1.51 -1.33 0.00 0.00 177.39 177.54 1rac s ASP 236 N -1.10 5.04 0.27 -1.43 -4.77 -1.26 -4.94 116.67 108.48 1rac s ASP 236 Ca 0.02 -0.58 -0.07 0.00 -3.30 0.00 0.00 52.55 48.62 1rac s ASP 236 Cb 0.00 -0.93 0.46 0.00 -1.09 0.00 0.00 42.92 41.37 1rac s ASP 236 CO 0.01 -0.26 1.50 -2.65 0.70 0.00 0.00 175.17 174.46 1rac n PRO 237 N -1.23 -0.09 0.19 2.11 -0.02 -1.26 -0.72 135.00 133.98 1rac n PRO 237 Ca -0.03 1.49 0.13 0.00 -2.02 0.00 0.00 63.50 63.07 1rac n PRO 237 Cb 0.60 -2.24 0.33 0.00 -0.02 0.00 0.00 33.50 32.17 1rac n PRO 237 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1rac h SER 238 N 0.00 0.00 0.15 2.55 0.02 -1.97 -2.27 113.55 112.03 1rac h SER 238 Ca 0.47 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 61.17 1rac h SER 238 Cb 0.74 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.30 1rac h SER 238 CO -0.98 0.00 -1.19 -0.08 -1.14 0.00 0.00 176.83 173.44 1rac h GLU 239 N 0.00 0.33 0.16 3.45 4.81 -1.29 -2.26 114.58 119.78 1rac h GLU 239 Ca 0.00 -0.56 0.01 0.00 -0.13 0.00 0.00 59.36 58.68 1rac h GLU 239 Cb 0.82 0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 1rac h GLU 239 CO 0.00 1.27 -0.21 -0.92 -0.73 0.00 0.00 179.01 178.41 1rac h TYR 240 N -0.24 -0.57 0.00 0.92 3.20 -1.09 -1.80 116.97 117.40 1rac h TYR 240 Ca -0.23 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.62 1rac h TYR 240 Cb 1.80 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 40.29 1rac h TYR 240 CO 0.16 -0.31 -0.12 0.00 -1.64 0.00 0.00 178.16 176.24 1rac h ALA 241 N 0.32 1.00 -2.27 1.82 0.00 -1.54 -1.45 119.26 117.14 1rac h ALA 241 Ca 0.01 -0.11 -0.44 0.00 0.00 0.00 0.00 54.91 54.37 1rac h ALA 241 Cb 0.43 -0.02 0.16 0.00 0.00 0.00 0.00 17.79 18.36 1rac h ALA 241 CO -0.08 0.15 0.22 1.21 0.00 0.00 0.00 179.25 180.75 1rac s ASN 242 N -6.01 2.34 0.44 0.00 3.84 -0.68 -4.42 114.94 110.47 1rac s ASN 242 Ca 0.02 0.89 0.00 0.00 0.21 0.00 0.00 52.86 53.97 1rac s ASN 242 Cb 0.09 -1.36 0.00 0.00 -0.55 0.00 0.00 41.25 39.43 1rac s ASN 242 CO 0.61 -3.27 0.75 0.55 -2.79 0.00 0.00 177.10 172.94 1rac n VAL 243 N -4.23 0.00 0.06 -5.21 3.14 -1.26 0.33 118.33 111.16 1rac n VAL 243 Ca 0.08 0.75 -0.04 0.00 -2.96 0.00 0.00 64.34 62.17 1rac n VAL 243 Cb 0.59 -1.56 0.18 0.00 -1.06 0.00 0.00 33.84 31.99 1rac n VAL 243 CO 0.00 0.00 0.00 0.11 -6.46 0.00 0.00 176.83 170.48 1rac h LYS 244 N 0.00 0.33 0.00 1.45 1.57 -1.82 -3.30 116.57 114.81 1rac h LYS 244 Ca 0.00 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1rac h LYS 244 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1rac h LYS 244 CO 0.00 0.70 0.00 0.00 -0.57 0.00 0.00 179.45 179.58 1rac n ALA 245 N -2.48 1.49 -2.89 3.86 0.00 0.15 -4.31 120.51 116.32 1rac n ALA 245 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 1rac n ALA 245 Cb 0.50 -0.99 0.01 0.00 0.00 0.00 0.00 19.45 18.97 1rac n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1rac n GLN 246 N -0.58 4.42 -2.75 0.00 3.00 -1.24 -4.28 117.38 115.93 1rac n GLN 246 Ca 0.00 -4.42 -0.22 0.00 -0.01 0.00 0.00 57.00 52.35 1rac n GLN 246 Cb 0.00 -2.56 -0.01 0.00 0.00 0.00 0.00 30.24 27.67 1rac n GLN 246 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1rac n PHE 247 N 1.59 2.58 -4.99 1.08 3.01 -1.26 -4.94 117.46 114.53 1rac n PHE 247 Ca 0.29 -3.39 -0.30 0.00 1.01 0.00 0.00 57.45 55.05 1rac n PHE 247 Cb 0.33 -0.31 -0.17 0.00 -0.01 0.00 0.00 39.48 39.32 1rac n PHE 247 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1rac s VAL 248 N -4.24 1.81 -0.05 -4.37 0.11 -1.26 -4.72 120.40 107.67 1rac s VAL 248 Ca 0.42 -0.87 -0.13 0.00 -2.93 0.00 0.00 61.98 58.48 1rac s VAL 248 Cb 0.37 -1.58 -0.05 0.00 -1.53 0.00 0.00 36.38 33.59 1rac s VAL 248 CO -0.11 0.50 0.33 -0.22 -3.33 0.00 0.00 175.10 172.27 1rac s LEU 249 N 0.49 4.42 0.25 2.54 2.96 0.62 -4.97 118.68 124.99 1rac s LEU 249 Ca -0.16 0.78 0.07 0.00 -0.22 0.00 0.00 54.13 54.59 1rac s LEU 249 Cb -0.17 -2.43 -0.05 0.00 0.50 0.00 0.00 46.19 44.04 1rac s LEU 249 CO 0.06 0.32 -0.08 -0.13 -1.32 0.00 0.00 176.35 175.20 1rac s ARG 250 N -0.85 1.47 0.31 1.98 0.52 -1.26 -0.66 118.95 120.45 1rac s ARG 250 Ca 0.21 -1.72 -0.00 0.00 -0.52 0.00 0.00 55.73 53.69 1rac s ARG 250 Cb -0.15 -1.10 0.48 0.00 0.52 0.00 0.00 34.95 34.70 1rac s ARG 250 CO 0.10 0.07 1.92 0.00 0.02 0.00 0.00 175.30 177.40 1rac h ALA 251 N 2.37 1.36 -0.85 2.13 0.00 -1.87 -2.97 119.26 119.43 1rac h ALA 251 Ca -0.39 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 54.54 1rac h ALA 251 Cb 1.23 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 1rac h ALA 251 CO 0.65 0.50 0.56 0.66 0.00 0.00 0.00 179.25 181.62 1rac h SER 252 N 0.89 0.59 1.04 0.00 4.64 -1.96 -1.13 113.55 117.62 1rac h SER 252 Ca 0.22 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1rac h SER 252 Cb 0.08 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1rac h SER 252 CO -0.03 0.30 0.00 0.44 -0.87 0.00 0.00 176.83 176.67 1rac h ASP 253 N 0.63 0.00 0.88 4.97 3.32 -1.94 -2.55 116.42 121.73 1rac h ASP 253 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1rac h ASP 253 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 1rac h ASP 253 CO -0.18 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.52 1rac n LEU 254 N -3.08 0.00 -0.00 1.55 4.77 -0.43 -4.27 117.00 115.54 1rac n LEU 254 Ca 0.01 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.46 1rac n LEU 254 Cb 0.31 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1rac n LEU 254 CO 0.27 -0.03 0.01 1.57 -1.33 0.00 0.00 177.39 177.88 1rac n HIS 255 N -1.47 0.00 -1.56 -1.77 -0.00 -0.96 0.34 115.22 109.80 1rac n HIS 255 Ca 0.07 0.02 -0.04 0.00 0.46 0.00 0.00 57.72 58.23 1rac n HIS 255 Cb 0.30 -0.51 0.18 0.00 -0.12 0.00 0.00 29.99 29.85 1rac n HIS 255 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 1rac n ASN 256 N -4.02 2.63 -4.82 0.26 2.04 -1.26 -5.02 115.26 105.06 1rac n ASN 256 Ca 0.00 -3.83 -0.33 0.00 -0.44 0.00 0.00 54.58 49.98 1rac n ASN 256 Cb 0.01 -0.59 -0.07 0.00 -2.53 0.00 0.00 39.78 36.60 1rac n ASN 256 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1rac s ALA 257 N -3.31 3.07 0.70 -2.53 0.00 0.15 -4.36 121.76 115.49 1rac s ALA 257 Ca 0.44 0.37 -0.16 0.00 0.00 0.00 0.00 51.96 52.60 1rac s ALA 257 Cb 0.40 -3.11 0.01 0.00 0.00 0.00 0.00 23.12 20.41 1rac s ALA 257 CO -0.02 0.15 1.09 1.63 0.00 0.00 0.00 175.76 178.61 1rac n LYS 258 N -0.61 0.66 0.09 0.00 5.02 -1.26 -4.84 118.16 117.23 1rac n LYS 258 Ca 0.07 0.28 0.09 0.00 -2.02 0.00 0.00 58.31 56.73 1rac n LYS 258 Cb 0.54 -2.33 0.41 0.00 -0.02 0.00 0.00 35.03 33.62 1rac n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rac n ALA 259 N -2.39 1.41 0.56 7.82 0.00 -1.26 -1.84 120.51 124.82 1rac n ALA 259 Ca 0.14 0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.74 1rac n ALA 259 Cb 0.49 -1.28 0.10 0.00 0.00 0.00 0.00 19.45 18.75 1rac n ALA 259 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1rac n ASN 260 N -1.98 2.58 -4.77 0.00 0.23 -1.26 -5.00 115.26 105.06 1rac n ASN 260 Ca 0.01 -1.76 -0.40 0.00 -0.53 0.00 0.00 54.58 51.90 1rac n ASN 260 Cb 0.14 -0.05 -0.01 0.00 -2.08 0.00 0.00 39.78 37.77 1rac n ASN 260 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 1rac s MET 261 N -1.36 4.13 0.04 -3.83 1.75 -0.76 -4.90 119.30 114.37 1rac s MET 261 Ca 0.22 2.26 0.05 0.00 -1.25 0.00 0.00 55.69 56.97 1rac s MET 261 Cb 0.15 -2.91 -0.02 0.00 2.84 0.00 0.00 34.83 34.88 1rac s MET 261 CO 0.22 -0.39 -0.13 0.15 -0.65 0.00 0.00 175.02 174.21 1rac s LYS 262 N -2.05 0.90 -0.23 4.11 -0.14 -0.62 -4.54 119.74 117.18 1rac s LYS 262 Ca 0.53 -0.74 -0.07 0.00 -1.36 0.00 0.00 55.97 54.33 1rac s LYS 262 Cb -0.40 -0.89 -0.03 0.00 -1.68 0.00 0.00 37.83 34.82 1rac s LYS 262 CO 0.53 0.22 0.06 0.08 -0.76 0.00 0.00 175.35 175.48 1rac s VAL 263 N -0.85 4.33 0.12 3.17 1.01 -0.16 -0.82 120.40 127.21 1rac s VAL 263 Ca 0.01 -0.17 0.10 0.00 0.00 0.00 0.00 61.98 61.92 1rac s VAL 263 Cb -0.08 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 1rac s VAL 263 CO 0.01 0.38 -0.26 -0.76 0.00 0.00 0.00 175.10 174.47 1rac s LEU 264 N 1.27 2.31 -0.30 3.92 1.02 -0.98 -1.08 118.68 124.84 1rac s LEU 264 Ca 0.05 -0.73 -0.12 0.00 0.02 0.00 0.00 54.13 53.34 1rac s LEU 264 Cb -0.15 -1.17 0.14 0.00 0.02 0.00 0.00 46.19 45.04 1rac s LEU 264 CO 0.03 0.17 0.79 -2.28 0.02 0.00 0.00 176.35 175.08 1rac s HIS 265 N -1.06 -1.07 0.61 0.29 2.46 -1.26 -1.98 115.29 113.27 1rac s HIS 265 Ca 0.13 1.86 0.28 0.00 0.47 0.00 0.00 55.06 57.80 1rac s HIS 265 Cb -0.10 0.64 1.47 0.00 -0.13 0.00 0.00 32.58 34.46 1rac s HIS 265 CO 0.06 -0.53 1.87 -1.00 -2.47 0.00 0.00 174.74 172.66 1rac h PRO 266 N 7.78 0.00 -1.01 2.88 0.13 -1.94 -3.46 132.00 136.38 1rac h PRO 266 Ca -0.17 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.01 1rac h PRO 266 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1rac h PRO 266 CO 0.09 0.00 -0.32 1.28 -0.23 0.00 0.00 178.00 178.83 1rac n LEU 267 N -3.52 -0.37 -4.74 1.56 4.77 -1.26 -5.00 117.00 108.44 1rac n LEU 267 Ca 0.07 0.73 -0.41 0.00 -0.03 0.00 0.00 56.01 56.37 1rac n LEU 267 Cb 0.64 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 1rac n LEU 267 CO 0.24 -0.42 0.96 -2.84 -1.33 0.00 0.00 177.39 174.00 1rac s PRO 268 N -3.85 4.41 -0.17 3.23 0.02 -1.26 -5.08 135.00 132.30 1rac s PRO 268 Ca 0.00 2.05 -0.16 0.00 0.02 0.00 0.00 61.00 62.91 1rac s PRO 268 Cb 0.00 -3.18 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 1rac s PRO 268 CO 0.00 -0.19 0.40 0.50 -0.33 0.00 0.00 177.00 177.38 1rac s ARG 269 N -0.53 4.23 -0.08 5.54 3.00 -1.26 -4.76 118.95 125.08 1rac s ARG 269 Ca 0.54 0.24 -0.11 0.00 -1.00 0.00 0.00 55.73 55.40 1rac s ARG 269 Cb -0.36 -3.49 -0.04 0.00 0.00 0.00 0.00 34.95 31.05 1rac s ARG 269 CO 0.41 0.06 -0.22 0.28 0.00 0.00 0.00 175.30 175.83 1rac n VAL 270 N 4.04 1.35 0.00 7.11 0.31 -1.26 -4.98 118.33 124.90 1rac n VAL 270 Ca -0.09 0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1rac n VAL 270 Cb 0.51 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.41 1rac n VAL 270 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1rac n ASP 271 N -4.06 0.46 0.02 4.52 5.68 -1.26 -4.80 116.55 117.11 1rac n ASP 271 Ca -0.11 -0.10 0.01 0.00 -0.50 0.00 0.00 54.79 54.09 1rac n ASP 271 Cb 0.37 0.29 0.06 0.00 -1.14 0.00 0.00 41.12 40.70 1rac n ASP 271 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1rac n GLU 272 N -0.34 0.02 -3.80 0.11 0.00 -1.26 -4.08 120.64 111.29 1rac n GLU 272 Ca 0.00 0.39 -0.23 0.00 0.00 0.00 0.00 57.16 57.32 1rac n GLU 272 Cb 0.00 -1.71 -0.17 0.00 0.00 0.00 0.00 31.44 29.56 1rac n GLU 272 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1rac s ILE 273 N -2.81 0.45 0.27 3.84 1.01 -1.26 -0.28 121.20 122.42 1rac s ILE 273 Ca -0.00 0.07 -0.28 0.00 0.00 0.00 0.00 60.65 60.44 1rac s ILE 273 Cb 0.01 -0.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.80 1rac s ILE 273 CO 0.02 0.27 0.93 0.00 0.00 0.00 0.00 174.94 176.16 1rac s ALA 274 N 1.89 3.29 0.60 9.38 0.00 0.16 -4.93 121.76 132.15 1rac s ALA 274 Ca 0.04 0.57 0.30 0.00 0.00 0.00 0.00 51.96 52.87 1rac s ALA 274 Cb -0.12 -3.19 1.06 0.00 0.00 0.00 0.00 23.12 20.87 1rac s ALA 274 CO -0.05 0.20 1.36 1.15 0.00 0.00 0.00 175.76 178.42 1rac h THR 275 N 2.93 0.01 0.00 0.00 2.02 -1.93 -0.48 112.91 115.46 1rac h THR 275 Ca -0.46 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1rac h THR 275 Cb 1.20 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1rac h THR 275 CO 0.67 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.66 1rac n ASP 276 N -3.37 0.00 -0.00 4.18 5.75 -1.26 -2.93 116.55 118.92 1rac n ASP 276 Ca 0.26 0.45 -0.18 0.00 -0.01 0.00 0.00 54.79 55.31 1rac n ASP 276 Cb 1.59 -0.48 -0.09 0.00 -1.03 0.00 0.00 41.12 41.10 1rac n ASP 276 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1rac h VAL 277 N 0.00 1.33 -1.36 2.12 2.07 -1.42 -3.15 116.25 115.84 1rac h VAL 277 Ca 0.00 -2.03 0.48 0.00 0.82 0.00 0.00 66.70 65.96 1rac h VAL 277 Cb 0.45 2.27 -0.14 0.00 -1.52 0.00 0.00 31.29 32.35 1rac h VAL 277 CO 0.00 0.62 0.87 0.47 0.02 0.00 0.00 177.57 179.55 1rac n ASP 278 N -4.05 0.22 0.05 0.57 9.92 -1.15 -0.88 116.55 121.24 1rac n ASP 278 Ca -0.09 1.41 0.12 0.00 -0.53 0.00 0.00 54.79 55.70 1rac n ASP 278 Cb 0.73 -0.69 0.49 0.00 -0.64 0.00 0.00 41.12 41.01 1rac n ASP 278 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1rac n LYS 279 N -4.76 0.10 -2.66 -1.24 4.76 -1.19 -4.75 118.16 108.43 1rac n LYS 279 Ca 0.40 0.16 -0.31 0.00 -2.87 0.00 0.00 58.31 55.70 1rac n LYS 279 Cb 1.56 -1.64 -0.03 0.00 -1.84 0.00 0.00 35.03 33.08 1rac n LYS 279 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1rac s THR 280 N -3.07 4.72 0.46 -0.18 2.01 -0.05 -4.96 115.64 114.57 1rac s THR 280 Ca 0.11 0.77 0.31 0.00 0.31 0.00 0.00 61.69 63.18 1rac s THR 280 Cb 0.14 -3.75 0.31 0.00 0.01 0.00 0.00 72.50 69.22 1rac s THR 280 CO 0.49 -0.63 1.94 -0.65 -0.69 0.00 0.00 174.62 175.08 1rac h PRO 281 N 1.00 0.00 0.00 4.92 0.11 -1.88 -3.01 132.00 133.14 1rac h PRO 281 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1rac h PRO 281 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1rac h PRO 281 CO 0.63 0.00 -0.45 0.45 -0.21 0.00 0.00 178.00 178.42 1rac h HIS 282 N 0.00 0.00 -2.97 0.65 3.86 -1.89 -3.45 115.15 111.35 1rac h HIS 282 Ca 0.00 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 1rac h HIS 282 Cb 0.36 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.79 1rac h HIS 282 CO 0.00 0.00 1.04 0.00 0.86 0.00 0.00 177.93 179.83 1rac s ALA 283 N -3.20 3.33 -0.07 2.45 0.00 -1.14 -0.99 121.76 122.15 1rac s ALA 283 Ca 0.06 0.28 0.10 0.00 0.00 0.00 0.00 51.96 52.40 1rac s ALA 283 Cb 0.11 -3.80 0.15 0.00 0.00 0.00 0.00 23.12 19.57 1rac s ALA 283 CO 0.70 -1.83 1.06 1.87 0.00 0.00 0.00 175.76 177.56 1rac n TRP 284 N 7.96 0.00 -0.01 0.00 -0.00 -0.24 -4.80 117.44 120.35 1rac n TRP 284 Ca 0.16 -0.53 -0.02 0.00 -0.00 0.00 0.00 57.50 57.11 1rac n TRP 284 Cb 0.46 -0.10 0.25 0.00 -0.00 0.00 0.00 31.31 31.91 1rac n TRP 284 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 1rac h TYR 285 N 0.00 0.57 0.14 5.87 -0.00 -1.84 -0.75 116.97 120.96 1rac h TYR 285 Ca 0.00 -0.08 -0.30 0.00 -0.00 0.00 0.00 58.73 58.34 1rac h TYR 285 Cb 1.15 -0.16 0.00 0.00 -0.00 0.00 0.00 36.73 37.73 1rac h TYR 285 CO 0.04 0.62 -1.47 0.74 -0.00 0.00 0.00 178.16 178.09 1rac h PHE 286 N 0.50 0.53 0.00 0.10 0.04 -1.91 -2.51 116.94 113.68 1rac h PHE 286 Ca 0.09 -0.39 -0.02 0.00 2.80 0.00 0.00 57.97 60.45 1rac h PHE 286 Cb 0.47 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 1rac h PHE 286 CO 0.02 1.39 -0.11 1.96 -0.60 0.00 0.00 178.31 180.97 1rac h GLN 287 N 0.08 0.00 0.30 1.51 7.50 -1.87 -1.76 115.11 120.87 1rac h GLN 287 Ca -0.22 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 58.91 1rac h GLN 287 Cb 2.03 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.56 1rac h GLN 287 CO 0.18 0.11 -0.15 0.37 -1.50 0.00 0.00 178.83 177.85 1rac h GLN 288 N 0.00 -0.39 -1.01 1.46 4.15 -1.06 -2.41 115.11 115.85 1rac h GLN 288 Ca -0.00 0.03 0.24 0.00 0.77 0.00 0.00 58.65 59.68 1rac h GLN 288 Cb 0.23 0.09 -0.10 0.00 0.21 0.00 0.00 27.48 27.91 1rac h GLN 288 CO 0.01 -0.05 0.63 0.00 -1.93 0.00 0.00 178.83 177.49 1rac h ALA 289 N -0.39 1.99 -0.45 3.38 0.00 -0.95 -0.47 119.26 122.37 1rac h ALA 289 Ca -0.04 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1rac h ALA 289 Cb 0.52 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1rac h ALA 289 CO 0.07 -0.39 -0.02 0.78 0.00 0.00 0.00 179.25 179.69 1rac h GLY 290 N 0.53 0.79 2.00 0.00 0.00 -1.32 -2.54 103.07 102.54 1rac h GLY 290 Ca 0.59 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 1rac h GLY 290 CO -0.35 0.49 -0.02 3.43 0.00 0.00 0.00 176.54 180.10 1rac h ASN 291 N 0.69 0.00 -0.10 0.19 2.35 -0.55 -2.53 115.58 115.63 1rac h ASN 291 Ca 0.13 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.91 1rac h ASN 291 Cb 0.45 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.81 1rac h ASN 291 CO 0.02 0.02 0.12 1.23 -1.65 0.00 0.00 177.43 177.16 1rac h GLY 292 N 0.78 0.00 0.85 2.83 0.00 -1.30 -1.84 103.07 104.39 1rac h GLY 292 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1rac h GLY 292 CO 0.00 0.00 -0.05 -2.22 0.00 0.00 0.00 176.54 174.27 1rac h ILE 293 N 0.00 1.28 0.06 2.60 1.08 -1.61 -0.88 117.51 120.02 1rac h ILE 293 Ca 0.05 -1.04 -0.08 0.00 -0.39 0.00 0.00 64.86 63.40 1rac h ILE 293 Cb 0.28 1.44 0.01 0.00 -3.07 0.00 0.00 36.82 35.48 1rac h ILE 293 CO -0.00 0.33 -0.34 -0.26 -0.69 0.00 0.00 178.15 177.19 1rac h PHE 294 N 0.24 0.23 -0.86 1.37 0.04 -1.52 -1.53 116.94 114.91 1rac h PHE 294 Ca 0.07 -0.17 0.09 0.00 2.80 0.00 0.00 57.97 60.76 1rac h PHE 294 Cb 0.51 -0.01 -0.07 0.00 2.20 0.00 0.00 35.95 38.58 1rac h PHE 294 CO 0.05 1.12 0.52 0.00 -0.60 0.00 0.00 178.31 179.39 1rac h ALA 295 N 0.05 1.22 -0.23 2.45 0.00 -1.49 -0.19 119.26 121.06 1rac h ALA 295 Ca -0.06 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 1rac h ALA 295 Cb 1.25 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1rac h ALA 295 CO 0.06 0.18 -0.52 0.00 0.00 0.00 0.00 179.25 178.98 1rac h ARG 296 N 0.89 0.67 -0.67 0.00 2.47 -1.19 -2.96 114.38 113.58 1rac h ARG 296 Ca 0.40 -0.40 0.04 0.00 -1.26 0.00 0.00 59.98 58.76 1rac h ARG 296 Cb 0.31 0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 28.62 1rac h ARG 296 CO -0.22 1.02 0.41 1.96 0.56 0.00 0.00 179.97 183.70 1rac h GLN 297 N 0.52 0.76 -0.91 0.04 4.20 -0.68 -2.55 115.11 116.48 1rac h GLN 297 Ca 0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1rac h GLN 297 Cb 1.08 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.64 1rac h GLN 297 CO 0.10 0.50 0.58 0.00 -0.67 0.00 0.00 178.83 179.35 1rac h ALA 298 N 1.31 1.30 -0.26 3.87 0.00 -0.92 0.37 119.26 124.93 1rac h ALA 298 Ca 0.28 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1rac h ALA 298 Cb 0.07 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1rac h ALA 298 CO -0.13 0.62 -0.12 1.25 0.00 0.00 0.00 179.25 180.87 1rac h LEU 299 N 1.25 0.55 -0.83 0.00 5.85 -1.35 0.65 115.31 121.43 1rac h LEU 299 Ca 0.33 -0.41 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1rac h LEU 299 Cb -0.10 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 1rac h LEU 299 CO -0.07 0.84 0.27 -0.07 -0.34 0.00 0.00 178.44 179.07 1rac h LEU 300 N 0.27 1.06 0.80 2.25 3.38 -1.30 -0.70 115.31 121.06 1rac h LEU 300 Ca 0.06 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1rac h LEU 300 Cb 0.63 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.11 1rac h LEU 300 CO 0.04 0.95 -0.38 0.00 0.09 0.00 0.00 178.44 179.14 1rac h ALA 301 N 1.19 -1.07 -0.54 1.53 0.00 -0.68 -2.17 119.26 117.51 1rac h ALA 301 Ca 0.25 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1rac h ALA 301 Cb 0.25 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1rac h ALA 301 CO -0.02 -1.02 0.37 -0.07 0.00 0.00 0.00 179.25 178.51 1rac h LEU 302 N -1.23 0.32 0.07 0.00 3.38 -0.80 -1.05 115.31 115.99 1rac h LEU 302 Ca -0.11 0.01 -0.27 0.00 0.09 0.00 0.00 57.88 57.60 1rac h LEU 302 Cb 0.83 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1rac h LEU 302 CO 0.18 0.20 -1.34 0.58 0.09 0.00 0.00 178.44 178.15 1rac h VAL 303 N 0.36 1.35 0.00 1.22 2.07 -1.07 -3.26 116.25 116.92 1rac h VAL 303 Ca 0.25 -3.03 0.00 0.00 0.82 0.00 0.00 66.70 64.74 1rac h VAL 303 Cb 0.50 2.77 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1rac h VAL 303 CO -0.06 0.83 -1.24 0.18 0.02 0.00 0.00 177.57 177.31 1rac n LEU 304 N -3.38 0.55 -4.47 2.57 4.77 -0.82 -1.35 117.00 114.87 1rac n LEU 304 Ca -0.10 0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.54 1rac n LEU 304 Cb 1.01 -0.06 -0.10 0.00 -2.33 0.00 0.00 43.42 41.93 1rac n LEU 304 CO 0.49 -0.03 -0.08 0.20 -1.33 0.00 0.00 177.39 176.64 1rac s ASN 305 N -4.47 6.09 0.18 -1.43 -0.87 -0.43 -4.97 114.94 109.04 1rac s ASN 305 Ca -0.00 -0.83 -0.25 0.00 -1.57 0.00 0.00 52.86 50.22 1rac s ASN 305 Cb 0.13 -2.15 0.07 0.00 -0.02 0.00 0.00 41.25 39.28 1rac s ASN 305 CO 0.82 -0.41 1.56 0.03 -2.57 0.00 0.00 177.10 176.53 1rac h ARG 306 N 8.60 -0.12 -5.86 -0.60 2.47 -1.89 -3.42 114.38 113.56 1rac h ARG 306 Ca -0.28 0.01 -0.52 0.00 -1.26 0.00 0.00 59.98 57.93 1rac h ARG 306 Cb 1.13 0.03 -0.23 0.00 -1.65 0.00 0.00 29.97 29.24 1rac h ARG 306 CO 0.71 -0.08 -0.82 -0.51 0.56 0.00 0.00 179.97 179.84 1rac s ASP 307 N -5.28 2.23 -0.10 7.04 1.01 -1.26 -0.84 116.67 119.47 1rac s ASP 307 Ca -0.14 -0.59 -0.01 0.00 0.71 0.00 0.00 52.55 52.53 1rac s ASP 307 Cb 0.15 -0.14 0.03 0.00 1.01 0.00 0.00 42.92 43.96 1rac s ASP 307 CO 0.67 0.06 -0.05 -0.22 0.21 0.00 0.00 175.17 175.84 1rac s LEU 308 N -1.53 1.00 -0.26 1.23 2.96 -1.26 -5.03 118.68 115.78 1rac s LEU 308 Ca 0.05 -0.22 -0.11 0.00 -0.22 0.00 0.00 54.13 53.62 1rac s LEU 308 Cb -0.09 -0.69 -0.05 0.00 0.50 0.00 0.00 46.19 45.85 1rac s LEU 308 CO 0.03 -0.14 0.18 -0.69 -1.32 0.00 0.00 176.35 174.40 1rac s VAL 309 N 1.75 5.34 -2.47 1.68 1.01 -1.26 -5.13 120.40 121.31 1rac s VAL 309 Ca 0.04 0.18 0.28 0.00 0.00 0.00 0.00 61.98 62.49 1rac s VAL 309 Cb -0.13 -3.52 0.57 0.00 0.00 0.00 0.00 36.38 33.31 1rac s VAL 309 CO -0.07 0.30 1.77 0.00 0.00 0.00 0.00 175.10 177.11