#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1igw s THR 3 N 0.00 4.09 0.08 -0.18 2.01 -1.26 -4.87 115.64 115.52 1igw s THR 3 Ca 0.00 0.90 -0.33 0.00 0.31 0.00 0.00 61.69 62.58 1igw s THR 3 Cb 0.00 -3.50 -0.17 0.00 0.01 0.00 0.00 72.50 68.84 1igw s THR 3 CO 0.00 -0.67 1.62 -0.09 -0.69 0.00 0.00 174.62 174.78 1igw h ARG 4 N 0.25 -0.83 -0.65 4.92 2.43 -2.00 0.37 114.38 118.87 1igw h ARG 4 Ca -0.46 0.06 0.06 0.00 -0.81 0.00 0.00 59.98 58.83 1igw h ARG 4 Cb 1.21 0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 30.89 1igw h ARG 4 CO 0.59 -0.56 0.36 1.79 -1.51 0.00 0.00 179.97 180.64 1igw h THR 5 N -0.86 0.96 -0.75 0.20 1.35 -1.99 0.12 112.91 111.94 1igw h THR 5 Ca -0.07 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.56 1igw h THR 5 Cb 0.71 0.24 -0.04 0.00 -1.73 0.00 0.00 68.15 67.34 1igw h THR 5 CO 0.06 0.12 0.44 1.56 -0.25 0.00 0.00 175.52 177.45 1igw h GLN 6 N 0.66 1.02 -0.50 4.72 4.20 -1.88 -1.11 115.11 122.22 1igw h GLN 6 Ca 0.29 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.85 1igw h GLN 6 Cb 0.19 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1igw h GLN 6 CO -0.18 0.73 0.09 1.96 -0.67 0.00 0.00 178.83 180.76 1igw h GLN 7 N 1.02 0.77 -0.67 1.46 4.20 0.10 -1.56 115.11 120.43 1igw h GLN 7 Ca 0.27 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.74 1igw h GLN 7 Cb -0.02 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 1igw h GLN 7 CO -0.05 0.71 0.14 0.82 -0.67 0.00 0.00 178.83 179.78 1igw h ILE 8 N 0.74 1.26 -0.33 2.54 2.04 -0.01 -2.38 117.51 121.36 1igw h ILE 8 Ca 0.16 -0.99 -0.17 0.00 1.00 0.00 0.00 64.86 64.86 1igw h ILE 8 Cb 0.32 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1igw h ILE 8 CO 0.00 0.37 -0.47 -0.33 0.00 0.00 0.00 178.15 177.73 1igw h GLU 9 N 1.02 0.89 -0.34 2.37 5.08 -0.85 -1.19 114.58 121.56 1igw h GLU 9 Ca 0.21 -0.52 -0.03 0.00 -1.00 0.00 0.00 59.36 58.01 1igw h GLU 9 Cb 0.39 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1igw h GLU 9 CO 0.01 1.17 0.08 0.93 -1.00 0.00 0.00 179.01 180.19 1igw h GLU 10 N 0.69 0.50 -0.09 2.33 5.08 -1.19 -1.68 114.58 120.23 1igw h GLU 10 Ca 0.03 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1igw h GLU 10 Cb 1.07 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1igw h GLU 10 CO 0.11 0.47 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.35 1igw h LEU 11 N 0.49 0.31 -0.42 1.33 3.38 -1.15 -1.63 115.31 117.62 1igw h LEU 11 Ca 0.12 -0.56 0.05 0.00 0.09 0.00 0.00 57.88 57.59 1igw h LEU 11 Cb 0.21 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 1igw h LEU 11 CO -0.00 0.80 0.13 1.56 0.09 0.00 0.00 178.44 181.02 1igw h GLN 12 N -0.18 0.28 -0.73 1.13 4.20 -0.87 -1.82 115.11 117.12 1igw h GLN 12 Ca 0.00 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1igw h GLN 12 Cb 0.75 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.43 1igw h GLN 12 CO 0.04 0.19 0.40 0.87 -0.67 0.00 0.00 178.83 179.66 1igw h LYS 13 N 0.29 1.02 -0.05 1.46 1.57 -1.32 -2.58 116.57 116.95 1igw h LYS 13 Ca 0.20 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1igw h LYS 13 Cb 0.20 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1igw h LYS 13 CO -0.21 0.76 -0.23 1.49 -0.57 0.00 0.00 179.45 180.69 1igw h GLU 14 N 1.01 0.09 0.00 3.15 4.81 -0.69 -1.54 114.58 121.40 1igw h GLU 14 Ca 0.26 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1igw h GLU 14 Cb 0.03 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1igw h GLU 14 CO -0.04 0.32 0.00 0.91 -0.73 0.00 0.00 179.01 179.47 1igw n TRP 15 N -4.23 0.00 1.04 0.92 8.01 -0.74 -1.64 117.44 120.79 1igw n TRP 15 Ca -0.02 0.00 0.12 0.00 -1.31 0.00 0.00 57.50 56.29 1igw n TRP 15 Cb 0.31 -0.37 0.17 0.00 -2.01 0.00 0.00 31.31 29.40 1igw n TRP 15 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 1igw n THR 16 N -1.37 0.00 -2.02 -0.99 -2.24 -0.58 -4.75 114.28 102.33 1igw n THR 16 Ca 0.06 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.48 1igw n THR 16 Cb 0.15 0.52 0.01 0.00 -2.10 0.00 0.00 70.33 68.91 1igw n THR 16 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1igw s GLN 17 N -2.89 3.26 0.56 -0.78 -1.52 -0.65 -4.93 119.66 112.71 1igw s GLN 17 Ca 0.13 1.23 0.31 0.00 -1.95 0.00 0.00 55.36 55.08 1igw s GLN 17 Cb 0.17 -2.02 1.46 0.00 -0.22 0.00 0.00 33.01 32.41 1igw s GLN 17 CO 0.70 -0.86 1.86 -1.35 -0.25 0.00 0.00 175.29 175.39 1igw h PRO 18 N 0.40 0.00 -0.48 2.91 0.11 -1.92 -0.75 132.00 132.27 1igw h PRO 18 Ca -0.47 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.72 1igw h PRO 18 Cb 1.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1igw h PRO 18 CO 0.57 0.00 0.33 -0.09 -0.21 0.00 0.00 178.00 178.60 1igw h ARG 19 N 0.00 0.29 -0.55 1.05 9.65 -1.91 -2.73 114.38 120.18 1igw h ARG 19 Ca 0.37 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.23 1igw h ARG 19 Cb 1.64 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 30.15 1igw h ARG 19 CO -0.00 0.19 0.00 0.91 2.80 0.00 0.00 179.97 183.87 1igw n TRP 20 N -4.47 1.29 -1.84 2.20 7.02 -0.29 -4.98 117.44 116.39 1igw n TRP 20 Ca 0.07 -0.64 -0.42 0.00 -1.02 0.00 0.00 57.50 55.49 1igw n TRP 20 Cb 0.33 -0.23 -0.03 0.00 -2.42 0.00 0.00 31.31 28.96 1igw n TRP 20 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1igw s GLU 21 N -1.90 4.17 0.00 -0.99 2.02 -1.03 -2.21 118.70 118.76 1igw s GLU 21 Ca 0.46 2.46 0.00 0.00 0.02 0.00 0.00 54.97 57.91 1igw s GLU 21 Cb 0.31 -3.43 0.00 0.00 0.10 0.00 0.00 34.13 31.11 1igw s GLU 21 CO 0.21 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 175.16 1igw n GLY 22 N 4.02 1.35 3.71 -1.39 0.00 -1.26 -5.03 105.19 106.59 1igw n GLY 22 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1igw n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1igw s ILE 23 N -3.26 5.11 -0.02 -0.61 -1.09 -0.94 -4.61 121.20 115.79 1igw s ILE 23 Ca 0.00 1.15 -0.11 0.00 -2.23 0.00 0.00 60.65 59.47 1igw s ILE 23 Cb 0.00 -3.91 -0.05 0.00 -1.58 0.00 0.00 42.46 36.92 1igw s ILE 23 CO 0.00 0.26 0.31 -0.89 -1.23 0.00 0.00 174.94 173.39 1igw s THR 24 N 0.97 5.21 -0.18 2.92 2.01 0.42 -5.01 115.64 121.97 1igw s THR 24 Ca 0.30 0.50 -0.02 0.00 0.31 0.00 0.00 61.69 62.78 1igw s THR 24 Cb -0.16 -3.60 0.05 0.00 0.01 0.00 0.00 72.50 68.81 1igw s THR 24 CO 0.13 0.51 0.00 -0.13 -0.69 0.00 0.00 174.62 174.43 1igw s ARG 25 N -1.32 0.93 0.00 4.92 0.52 -1.26 -4.63 118.95 118.11 1igw s ARG 25 Ca 0.24 -0.46 0.00 0.00 -0.52 0.00 0.00 55.73 54.98 1igw s ARG 25 Cb -0.14 -2.04 0.00 0.00 0.52 0.00 0.00 34.95 33.29 1igw s ARG 25 CO 0.12 -0.56 0.41 -0.35 0.02 0.00 0.00 175.30 174.94 1igw n PRO 26 N 4.97 0.79 -4.23 3.54 -0.04 -1.26 -4.80 135.00 133.97 1igw n PRO 26 Ca -0.10 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.23 1igw n PRO 26 Cb 0.47 -1.38 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1igw n PRO 26 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1igw s TYR 27 N -1.03 1.27 0.36 0.54 -0.85 -1.26 -5.17 117.35 111.21 1igw s TYR 27 Ca 0.00 -1.36 0.06 0.00 -0.52 0.00 0.00 57.07 55.25 1igw s TYR 27 Cb 0.00 -0.64 -0.01 0.00 0.38 0.00 0.00 41.96 41.70 1igw s TYR 27 CO 0.00 -0.60 0.51 -1.54 -1.52 0.00 0.00 175.55 172.40 1igw s SER 28 N -3.20 5.92 0.24 -0.18 1.04 -1.26 -5.00 113.70 111.25 1igw s SER 28 Ca 0.39 -0.15 -0.06 0.00 0.48 0.00 0.00 55.95 56.60 1igw s SER 28 Cb 0.07 -1.21 0.23 0.00 0.10 0.00 0.00 66.02 65.21 1igw s SER 28 CO 0.13 -0.50 1.88 0.00 0.98 0.00 0.00 173.24 175.73 1igw h ALA 29 N 0.80 1.21 -0.98 5.32 0.00 -1.96 -1.53 119.26 122.11 1igw h ALA 29 Ca -0.45 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.41 1igw h ALA 29 Cb 1.26 -0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1igw h ALA 29 CO 0.53 0.67 0.64 1.49 0.00 0.00 0.00 179.25 182.57 1igw h GLU 30 N 1.30 1.12 -0.32 0.00 4.81 -1.95 -0.27 114.58 119.28 1igw h GLU 30 Ca 0.34 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.48 1igw h GLU 30 Cb -0.04 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 1igw h GLU 30 CO -0.06 0.74 0.12 -0.44 -0.73 0.00 0.00 179.01 178.64 1igw h ASP 31 N 1.15 0.44 -0.07 1.04 3.32 -1.69 -2.00 116.42 118.62 1igw h ASP 31 Ca 0.42 -0.17 0.02 0.00 0.02 0.00 0.00 57.03 57.32 1igw h ASP 31 Cb 0.17 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1igw h ASP 31 CO -0.17 0.49 -0.03 0.58 -1.72 0.00 0.00 179.24 178.40 1igw h VAL 32 N 0.36 0.91 -0.37 -1.35 2.07 -0.76 -2.98 116.25 114.13 1igw h VAL 32 Ca 0.10 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.59 1igw h VAL 32 Cb 0.19 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1igw h VAL 32 CO -0.01 0.00 0.10 0.58 0.02 0.00 0.00 177.57 178.26 1igw h VAL 33 N -0.02 1.17 0.00 2.57 2.07 -1.00 -2.44 116.25 118.60 1igw h VAL 33 Ca 0.04 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1igw h VAL 33 Cb 0.07 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1igw h VAL 33 CO -0.08 0.21 0.00 0.07 0.02 0.00 0.00 177.57 177.79 1igw h LYS 34 N 0.53 0.00 -0.02 1.57 2.10 -1.20 -2.70 116.57 116.85 1igw h LYS 34 Ca 0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 1igw h LYS 34 Cb 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 1igw h LYS 34 CO -0.00 0.00 -0.17 1.28 -2.00 0.00 0.00 179.45 178.55 1igw n LEU 35 N -2.93 1.82 -0.00 7.07 4.77 -0.92 -4.56 117.00 122.25 1igw n LEU 35 Ca 0.00 -0.60 -0.17 0.00 -0.03 0.00 0.00 56.01 55.21 1igw n LEU 35 Cb 0.24 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.19 1igw n LEU 35 CO 0.24 0.32 0.26 0.03 -1.33 0.00 0.00 177.39 176.91 1igw h ARG 36 N 2.58 0.46 0.00 3.23 3.08 -1.53 -3.51 114.38 118.69 1igw h ARG 36 Ca 0.00 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1igw h ARG 36 Cb 0.67 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.84 1igw h ARG 36 CO 0.00 1.11 0.00 0.41 -1.07 0.00 0.00 179.97 180.42 1igw n GLY 37 N 0.99 0.79 0.21 0.04 0.00 -1.26 -4.69 105.19 101.26 1igw n GLY 37 Ca -0.10 -2.08 0.12 0.00 0.00 0.00 0.00 46.02 43.96 1igw n GLY 37 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1igw h SER 38 N 0.00 0.00 -3.35 1.61 4.64 -1.98 -3.43 113.55 111.04 1igw h SER 38 Ca 0.00 -0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1igw h SER 38 Cb 0.00 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 61.75 1igw h SER 38 CO 0.00 0.00 -0.83 -0.69 -0.87 0.00 0.00 176.83 174.44 1igw s VAL 39 N -3.22 1.42 -0.30 0.95 1.01 -1.26 -4.83 120.40 114.18 1igw s VAL 39 Ca 0.07 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.44 1igw s VAL 39 Cb 0.06 -1.29 0.09 0.00 0.00 0.00 0.00 36.38 35.24 1igw s VAL 39 CO 0.68 0.42 0.02 0.21 0.00 0.00 0.00 175.10 176.43 1igw s ASN 40 N 0.74 4.32 0.40 3.32 3.04 -1.26 -5.08 114.94 120.41 1igw s ASN 40 Ca -0.12 -1.70 -0.26 0.00 0.04 0.00 0.00 52.86 50.82 1igw s ASN 40 Cb -0.16 -1.32 -0.11 0.00 -1.54 0.00 0.00 41.25 38.12 1igw s ASN 40 CO 0.03 -0.33 1.20 -2.65 -3.04 0.00 0.00 177.10 172.31 1igw n PRO 41 N 4.52 1.81 -2.39 0.43 -0.02 -1.26 -4.95 135.00 133.14 1igw n PRO 41 Ca -0.03 0.64 -0.37 0.00 -2.02 0.00 0.00 63.50 61.72 1igw n PRO 41 Cb 0.43 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 1igw n PRO 41 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1igw s GLU 42 N -2.06 4.03 -0.58 -0.52 0.41 -1.26 -4.98 118.70 113.74 1igw s GLU 42 Ca 0.60 1.69 0.06 0.00 -0.41 0.00 0.00 54.97 56.91 1igw s GLU 42 Cb -0.54 -2.56 0.24 0.00 -1.78 0.00 0.00 34.13 29.49 1igw s GLU 42 CO 0.59 -0.30 0.66 0.00 -0.49 0.00 0.00 175.26 175.73 1igw h THR 44 N 3.01 0.22 -0.50 0.00 2.02 -1.94 -2.26 112.91 113.45 1igw h THR 44 Ca 0.17 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.31 1igw h THR 44 Cb 0.73 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.33 1igw h THR 44 CO 0.73 0.00 0.16 -0.07 0.37 0.00 0.00 175.52 176.70 1igw h LEU 45 N -0.27 0.68 -0.54 2.58 3.38 -1.93 -2.33 115.31 116.88 1igw h LEU 45 Ca 0.16 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1igw h LEU 45 Cb 0.54 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1igw h LEU 45 CO -0.53 0.64 0.04 0.00 0.09 0.00 0.00 178.44 178.69 1igw h ALA 46 N 1.45 0.72 -0.08 1.53 0.00 -1.67 -0.46 119.26 120.74 1igw h ALA 46 Ca 0.17 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1igw h ALA 46 Cb 0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1igw h ALA 46 CO -0.01 0.50 0.05 1.96 0.00 0.00 0.00 179.25 181.75 1igw h GLN 47 N 0.80 0.11 -0.53 0.00 1.08 -1.18 -1.07 115.11 114.31 1igw h GLN 47 Ca 0.16 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.31 1igw h GLN 47 Cb 0.47 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.85 1igw h GLN 47 CO 0.02 0.12 0.18 -0.07 -0.95 0.00 0.00 178.83 178.13 1igw h LEU 48 N 0.07 0.76 -0.46 1.46 3.38 -1.37 -1.59 115.31 117.55 1igw h LEU 48 Ca 0.03 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1igw h LEU 48 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1igw h LEU 48 CO -0.01 0.75 0.18 1.23 0.09 0.00 0.00 178.44 180.69 1igw h GLY 49 N 0.73 0.73 0.91 0.83 0.00 -0.92 -1.73 103.07 103.62 1igw h GLY 49 Ca 0.17 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 1igw h GLY 49 CO -0.01 0.38 0.08 0.00 0.00 0.00 0.00 176.54 176.99 1igw h ALA 50 N 1.03 0.43 -0.62 3.60 0.00 -1.08 -0.83 119.26 121.79 1igw h ALA 50 Ca 0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1igw h ALA 50 Cb 0.20 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1igw h ALA 50 CO -0.01 0.09 0.31 0.00 0.00 0.00 0.00 179.25 179.64 1igw h ALA 51 N 0.92 0.79 -0.36 0.00 0.00 -1.26 -2.17 119.26 117.18 1igw h ALA 51 Ca 0.10 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 1igw h ALA 51 Cb 0.29 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1igw h ALA 51 CO 0.00 0.34 -0.39 -0.22 0.00 0.00 0.00 179.25 178.98 1igw h LYS 52 N 0.84 0.90 -0.69 0.00 3.64 -1.20 -2.25 116.57 117.81 1igw h LYS 52 Ca 0.21 -0.49 -0.07 0.00 -1.27 0.00 0.00 60.65 59.04 1igw h LYS 52 Cb 0.09 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1igw h LYS 52 CO -0.03 1.14 0.16 1.98 -2.27 0.00 0.00 179.45 180.43 1igw h MET 53 N 0.71 1.11 -0.10 1.90 4.05 -1.12 -1.26 114.93 120.23 1igw h MET 53 Ca 0.05 -0.27 -0.00 0.00 -0.28 0.00 0.00 59.70 59.20 1igw h MET 53 Cb 0.98 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.64 1igw h MET 53 CO 0.10 0.99 0.04 2.35 0.23 0.00 0.00 176.91 180.62 1igw h TRP 54 N 1.04 0.14 -0.97 1.39 2.91 -1.33 -1.95 115.95 117.19 1igw h TRP 54 Ca 0.22 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.23 1igw h TRP 54 Cb 0.38 -0.04 -0.05 0.00 -0.51 0.00 0.00 29.16 28.94 1igw h TRP 54 CO 0.03 0.23 0.63 0.00 -1.03 0.00 0.00 178.44 178.30 1igw h ARG 55 N 0.02 1.28 -0.04 2.65 3.08 -1.24 -1.88 114.38 118.24 1igw h ARG 55 Ca 0.03 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 1igw h ARG 55 Cb 0.14 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1igw h ARG 55 CO -0.00 0.85 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.43 1igw h LEU 56 N 1.31 0.06 0.00 3.04 3.38 -0.94 -2.03 115.31 120.14 1igw h LEU 56 Ca 0.35 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1igw h LEU 56 Cb -0.14 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1igw h LEU 56 CO -0.07 0.32 -0.15 -0.07 0.09 0.00 0.00 178.44 178.55 1igw h LEU 57 N 0.06 0.00 -4.34 1.67 3.38 -0.61 -3.00 115.31 112.47 1igw h LEU 57 Ca 0.01 -0.04 -0.59 0.00 0.09 0.00 0.00 57.88 57.35 1igw h LEU 57 Cb 0.48 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 40.82 1igw h LEU 57 CO 0.03 0.02 -0.68 1.41 0.09 0.00 0.00 178.44 179.32 1igw n HIS 58 N -2.34 3.24 0.00 1.13 8.25 -0.78 -4.93 115.22 119.78 1igw n HIS 58 Ca 0.05 -2.87 0.00 0.00 -0.26 0.00 0.00 57.72 54.64 1igw n HIS 58 Cb 0.45 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.36 1igw n HIS 58 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1igw n GLY 59 N -0.54 1.32 0.92 -1.41 0.00 -1.22 -4.96 105.19 99.31 1igw n GLY 59 Ca 0.41 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.55 1igw n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1igw n GLU 60 N -1.00 2.24 -1.27 1.61 1.02 -0.81 -4.97 120.64 117.46 1igw n GLU 60 Ca 0.00 -1.85 -0.31 0.00 -0.02 0.00 0.00 57.16 54.98 1igw n GLU 60 Cb 0.00 -1.46 0.09 0.00 -0.02 0.00 0.00 31.44 30.05 1igw n GLU 60 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1igw s SER 61 N -2.04 4.50 0.25 1.62 1.04 -1.13 -4.84 113.70 113.09 1igw s SER 61 Ca 0.27 1.83 0.00 0.00 0.48 0.00 0.00 55.95 58.54 1igw s SER 61 Cb 0.20 -2.52 0.30 0.00 0.10 0.00 0.00 66.02 64.09 1igw s SER 61 CO 0.32 -2.04 1.64 0.11 0.98 0.00 0.00 173.24 174.26 1igw h LYS 62 N -1.11 0.51 -0.21 4.02 1.57 -1.93 -3.32 116.57 116.11 1igw h LYS 62 Ca -0.44 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 1igw h LYS 62 Cb 1.23 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1igw h LYS 62 CO 0.51 0.79 0.00 1.63 -0.57 0.00 0.00 179.45 181.82 1igw n LYS 63 N -4.06 2.80 -0.24 3.15 5.02 -1.26 -4.96 118.16 118.61 1igw n LYS 63 Ca -0.01 -2.06 0.00 0.00 -2.02 0.00 0.00 58.31 54.22 1igw n LYS 63 Cb 0.48 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 1igw n LYS 63 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1igw n GLY 64 N -0.06 1.87 3.28 0.72 0.00 -1.25 -4.98 105.19 104.78 1igw n GLY 64 Ca 0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.98 1igw n GLY 64 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1igw s TYR 65 N -3.01 -0.25 -0.26 1.61 -0.85 -1.26 -4.89 117.35 108.44 1igw s TYR 65 Ca 0.00 0.36 -0.13 0.00 -0.52 0.00 0.00 57.07 56.79 1igw s TYR 65 Cb 0.00 0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.44 1igw s TYR 65 CO 0.00 -0.44 0.26 0.42 -1.52 0.00 0.00 175.55 174.27 1igw s ILE 66 N -1.47 5.26 -0.18 -3.49 1.01 -0.23 -4.76 121.20 117.34 1igw s ILE 66 Ca -0.12 0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.85 1igw s ILE 66 Cb -0.04 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 1igw s ILE 66 CO 0.04 0.23 -0.07 0.54 0.00 0.00 0.00 174.94 175.68 1igw s ASN 67 N 1.57 4.28 0.35 3.58 4.22 -1.26 -1.14 114.94 126.53 1igw s ASN 67 Ca 0.11 -0.33 0.09 0.00 -2.14 0.00 0.00 52.86 50.59 1igw s ASN 67 Cb -0.15 -1.70 -0.06 0.00 1.28 0.00 0.00 41.25 40.61 1igw s ASN 67 CO 0.09 0.07 -0.06 -0.44 -2.04 0.00 0.00 177.10 174.73 1igw s SER 68 N 0.95 3.87 -0.05 3.54 0.01 0.38 -4.64 113.70 117.75 1igw s SER 68 Ca -0.01 -1.15 0.02 0.00 1.31 0.00 0.00 55.95 56.12 1igw s SER 68 Cb -0.15 -0.40 0.01 0.00 0.21 0.00 0.00 66.02 65.69 1igw s SER 68 CO 0.00 -0.23 -0.11 -0.76 0.41 0.00 0.00 173.24 172.55 1igw s LEU 69 N -3.65 1.65 0.23 2.44 1.43 -1.26 -2.16 118.68 117.35 1igw s LEU 69 Ca 0.33 -0.26 -0.32 0.00 -1.03 0.00 0.00 54.13 52.86 1igw s LEU 69 Cb 0.02 -0.74 -0.12 0.00 0.03 0.00 0.00 46.19 45.38 1igw s LEU 69 CO 0.17 0.04 1.67 0.61 0.23 0.00 0.00 176.35 179.08 1igw n GLY 70 N 3.70 1.44 3.21 -3.19 0.00 -0.76 -3.72 105.19 105.87 1igw n GLY 70 Ca -0.22 0.58 -0.26 0.00 0.00 0.00 0.00 46.02 46.11 1igw n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1igw s ALA 71 N 0.81 1.65 -0.41 4.61 0.00 -0.43 -0.38 121.76 127.61 1igw s ALA 71 Ca 0.72 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.84 1igw s ALA 71 Cb -0.52 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.23 1igw s ALA 71 CO 0.37 0.40 0.59 1.47 0.00 0.00 0.00 175.76 178.59 1igw n LEU 72 N 2.48 1.25 -4.13 0.00 -0.00 -1.26 -4.43 117.00 110.90 1igw n LEU 72 Ca -0.15 -0.99 -0.12 0.00 -0.00 0.00 0.00 56.01 54.75 1igw n LEU 72 Cb 0.53 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.85 1igw n LEU 72 CO 0.24 0.28 -0.40 0.42 -0.00 0.00 0.00 177.39 177.93 1igw s THR 73 N -0.30 0.70 0.32 1.47 -4.23 -1.26 -4.93 115.64 107.40 1igw s THR 73 Ca 0.04 -1.58 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 1igw s THR 73 Cb 0.03 -1.25 0.25 0.00 1.34 0.00 0.00 72.50 72.86 1igw s THR 73 CO 0.04 -0.64 1.97 1.23 -0.54 0.00 0.00 174.62 176.69 1igw h GLY 74 N 3.61 1.00 0.99 3.99 0.00 -1.89 -2.63 103.07 108.15 1igw h GLY 74 Ca -0.36 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.57 1igw h GLY 74 CO 0.54 0.39 0.35 -1.33 0.00 0.00 0.00 176.54 176.48 1igw h GLY 75 N 0.98 0.89 0.78 4.60 0.00 -1.94 0.82 103.07 109.20 1igw h GLY 75 Ca 0.25 -0.39 0.04 0.00 0.00 0.00 0.00 47.33 47.23 1igw h GLY 75 CO -0.05 0.38 0.37 1.46 0.00 0.00 0.00 176.54 178.69 1igw h GLN 76 N 0.82 0.68 -0.83 4.80 4.20 -1.90 -0.68 115.11 122.20 1igw h GLN 76 Ca 0.22 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 1igw h GLN 76 Cb 0.01 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 1igw h GLN 76 CO -0.04 0.45 0.42 0.00 -0.67 0.00 0.00 178.83 179.00 1igw h ALA 77 N 1.30 1.06 -0.02 3.87 0.00 -1.05 -2.16 119.26 122.26 1igw h ALA 77 Ca 0.27 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1igw h ALA 77 Cb 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1igw h ALA 77 CO -0.14 0.60 -0.30 1.25 0.00 0.00 0.00 179.25 180.67 1igw h LEU 78 N 1.16 -0.90 -1.33 0.00 5.85 0.56 -0.73 115.31 119.92 1igw h LEU 78 Ca 0.29 0.12 0.06 0.00 0.84 0.00 0.00 57.88 59.19 1igw h LEU 78 Cb 0.08 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1igw h LEU 78 CO -0.04 -0.36 0.50 1.56 -0.34 0.00 0.00 178.44 179.76 1igw h GLN 79 N -0.44 0.79 -0.59 1.25 1.08 -0.94 -1.46 115.11 114.80 1igw h GLN 79 Ca 0.07 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.19 1igw h GLN 79 Cb 0.53 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.76 1igw h GLN 79 CO -0.27 0.53 0.24 1.96 -0.95 0.00 0.00 178.83 180.34 1igw h GLN 80 N 0.82 0.89 -0.82 1.46 4.20 -0.73 0.20 115.11 121.14 1igw h GLN 80 Ca 0.32 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 1igw h GLN 80 Cb 0.23 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.82 1igw h GLN 80 CO -0.11 0.75 0.41 0.00 -0.67 0.00 0.00 178.83 179.22 1igw h ALA 81 N 1.09 1.19 -0.15 3.87 0.00 -0.19 -1.48 119.26 123.59 1igw h ALA 81 Ca 0.20 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1igw h ALA 81 Cb 0.20 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1igw h ALA 81 CO -0.02 0.63 -0.45 0.87 0.00 0.00 0.00 179.25 180.28 1igw h LYS 82 N 1.15 0.36 0.00 0.00 1.57 -0.78 -3.01 116.57 115.87 1igw h LYS 82 Ca 0.28 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1igw h LYS 82 Cb 0.08 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1igw h LYS 82 CO -0.04 0.74 0.00 0.00 -0.57 0.00 0.00 179.45 179.58 1igw n ALA 83 N -2.48 2.36 0.00 3.86 0.00 0.01 -4.90 120.51 119.35 1igw n ALA 83 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1igw n ALA 83 Cb 0.52 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1igw n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1igw n GLY 84 N 1.26 0.66 3.75 0.00 0.00 -1.02 -5.07 105.19 104.77 1igw n GLY 84 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1igw n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1igw s ILE 85 N -2.00 2.28 -0.88 -0.61 -1.09 -0.59 -4.95 121.20 113.36 1igw s ILE 85 Ca 0.00 0.21 0.18 0.00 -2.23 0.00 0.00 60.65 58.82 1igw s ILE 85 Cb 0.00 -3.11 -0.20 0.00 -1.58 0.00 0.00 42.46 37.57 1igw s ILE 85 CO 0.00 -0.00 0.79 -0.62 -1.23 0.00 0.00 174.94 173.88 1igw n GLU 86 N -0.91 0.90 -3.73 2.79 1.02 -1.26 -4.63 120.64 114.81 1igw n GLU 86 Ca 0.10 -0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 57.09 1igw n GLU 86 Cb 0.46 -1.37 -0.09 0.00 -0.02 0.00 0.00 31.44 30.41 1igw n GLU 86 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1igw s ALA 87 N -2.74 -0.96 -0.16 0.62 0.00 -1.26 -4.18 121.76 113.08 1igw s ALA 87 Ca 0.07 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 52.83 1igw s ALA 87 Cb 0.14 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 1igw s ALA 87 CO 0.76 -0.22 0.14 0.08 0.00 0.00 0.00 175.76 176.52 1igw s VAL 88 N -0.34 5.45 -0.23 0.00 1.01 0.17 -4.59 120.40 121.86 1igw s VAL 88 Ca -0.05 0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.07 1igw s VAL 88 Cb -0.03 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.87 1igw s VAL 88 CO 0.02 0.52 0.08 -0.47 0.00 0.00 0.00 175.10 175.26 1igw s TYR 89 N -0.30 3.15 -0.43 5.22 5.04 -1.24 0.32 117.35 129.11 1igw s TYR 89 Ca 0.12 -0.19 -0.09 0.00 -2.44 0.00 0.00 57.07 54.47 1igw s TYR 89 Cb -0.12 -2.20 0.09 0.00 0.35 0.00 0.00 41.96 40.08 1igw s TYR 89 CO 0.01 -0.16 0.27 -1.17 -1.34 0.00 0.00 175.55 173.16 1igw s LEU 90 N 1.19 5.25 -0.00 6.97 0.20 0.13 -1.31 118.68 131.11 1igw s LEU 90 Ca 0.05 -1.59 -0.30 0.00 0.69 0.00 0.00 54.13 52.97 1igw s LEU 90 Cb -0.14 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.59 1igw s LEU 90 CO 0.04 -0.56 1.17 -0.55 -0.29 0.00 0.00 176.35 176.15 1igw s SER 91 N 2.20 7.11 0.28 3.68 0.15 -1.26 -2.86 113.70 122.99 1igw s SER 91 Ca 0.04 1.87 0.05 0.00 0.70 0.00 0.00 55.95 58.60 1igw s SER 91 Cb -0.24 -2.57 0.39 0.00 -1.71 0.00 0.00 66.02 61.90 1igw s SER 91 CO 0.01 -0.49 1.67 1.23 1.20 0.00 0.00 173.24 176.86 1igw h GLY 92 N 7.44 0.33 1.00 9.45 0.00 -1.94 -2.32 103.07 117.02 1igw h GLY 92 Ca -0.38 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 1igw h GLY 92 CO 0.83 0.29 0.42 -0.25 0.00 0.00 0.00 176.54 177.84 1igw h TRP 93 N 0.25 0.89 -0.48 5.60 7.01 -1.95 0.94 115.95 128.21 1igw h TRP 93 Ca 0.02 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.93 1igw h TRP 93 Cb 0.85 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 27.60 1igw h TRP 93 CO 0.02 0.60 -0.08 1.96 -2.79 0.00 0.00 178.44 178.14 1igw h GLN 94 N 0.93 0.85 -0.44 2.65 4.20 -1.84 -2.12 115.11 119.34 1igw h GLN 94 Ca 0.25 -0.28 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1igw h GLN 94 Cb -0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1igw h GLN 94 CO -0.05 0.91 0.11 0.28 -0.67 0.00 0.00 178.83 179.41 1igw h VAL 95 N 0.78 1.23 -0.41 -0.54 2.07 -0.92 -0.38 116.25 118.08 1igw h VAL 95 Ca 0.13 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1igw h VAL 95 Cb 0.58 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1igw h VAL 95 CO 0.04 0.29 0.14 0.00 0.02 0.00 0.00 177.57 178.05 1igw h ALA 96 N 0.97 1.47 0.02 1.67 0.00 -0.66 -1.06 119.26 121.67 1igw h ALA 96 Ca 0.14 -0.13 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 1igw h ALA 96 Cb 0.32 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1igw h ALA 96 CO 0.00 0.40 -1.24 0.00 0.00 0.00 0.00 179.25 178.41 1igw h ALA 97 N 1.57 0.44 0.00 0.00 0.00 -1.09 0.18 119.26 120.36 1igw h ALA 97 Ca 0.14 -1.07 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1igw h ALA 97 Cb 0.16 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1igw h ALA 97 CO -0.01 1.32 -0.07 -3.47 0.00 0.00 0.00 179.25 177.02 1igw n ASP 98 N -3.29 0.00 -2.69 0.00 2.03 -0.18 -4.45 116.55 107.97 1igw n ASP 98 Ca -0.06 -1.14 -0.05 0.00 0.52 0.00 0.00 54.79 54.06 1igw n ASP 98 Cb 0.98 -0.03 0.11 0.00 -0.72 0.00 0.00 41.12 41.47 1igw n ASP 98 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1igw n ALA 99 N 0.00 2.17 -2.52 -1.67 0.00 -0.45 -4.98 120.51 113.05 1igw n ALA 99 Ca 0.00 -1.38 -0.23 0.00 0.00 0.00 0.00 53.44 51.83 1igw n ALA 99 Cb 0.53 -0.91 -0.07 0.00 0.00 0.00 0.00 19.45 19.00 1igw n ALA 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1igw s ASN 100 N -1.46 4.61 0.00 0.00 2.20 -0.87 -4.79 114.94 114.63 1igw s ASN 100 Ca 0.17 -0.81 0.19 0.00 -0.94 0.00 0.00 52.86 51.47 1igw s ASN 100 Cb 0.42 -0.70 1.01 0.00 -2.00 0.00 0.00 41.25 39.98 1igw s ASN 100 CO -0.10 -0.29 1.56 0.18 -2.94 0.00 0.00 177.10 175.51 1igw n LEU 101 N -1.12 0.00 -0.38 3.54 4.77 -1.26 -1.97 117.00 120.58 1igw n LEU 101 Ca -0.03 0.19 0.13 0.00 -0.03 0.00 0.00 56.01 56.26 1igw n LEU 101 Cb 0.61 -0.19 0.30 0.00 -2.33 0.00 0.00 43.42 41.82 1igw n LEU 101 CO 0.43 -0.07 0.61 0.00 -1.33 0.00 0.00 177.39 177.02 1igw n ALA 102 N -1.19 3.07 -3.02 -1.18 0.00 -1.26 -4.94 120.51 111.99 1igw n ALA 102 Ca 0.11 -0.48 -0.22 0.00 0.00 0.00 0.00 53.44 52.85 1igw n ALA 102 Cb 0.12 -1.05 0.02 0.00 0.00 0.00 0.00 19.45 18.54 1igw n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1igw n ALA 103 N -0.28 -0.96 -2.29 0.00 0.00 -0.83 -4.98 120.51 111.17 1igw n ALA 103 Ca 0.13 0.22 -0.16 0.00 0.00 0.00 0.00 53.44 53.63 1igw n ALA 103 Cb 0.39 -3.39 -0.10 0.00 0.00 0.00 0.00 19.45 16.34 1igw n ALA 103 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1igw s SER 104 N -2.62 2.06 -0.30 0.00 0.01 -1.26 -5.07 113.70 106.52 1igw s SER 104 Ca 0.29 -1.05 -0.16 0.00 1.31 0.00 0.00 55.95 56.34 1igw s SER 104 Cb -0.13 -0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.02 1igw s SER 104 CO 0.36 -0.31 0.42 -0.32 0.41 0.00 0.00 173.24 173.80 1igw s MET 105 N -3.73 3.86 0.15 12.44 1.75 -1.26 -4.64 119.30 127.87 1igw s MET 105 Ca 0.20 -0.05 0.08 0.00 -1.25 0.00 0.00 55.69 54.67 1igw s MET 105 Cb 0.02 -3.72 -0.04 0.00 2.84 0.00 0.00 34.83 33.94 1igw s MET 105 CO 0.04 -0.41 -0.18 0.71 -0.65 0.00 0.00 175.02 174.53 1igw s TYR 106 N 2.16 1.76 0.90 4.11 4.12 0.64 -4.98 117.35 126.07 1igw s TYR 106 Ca 0.16 -0.47 -0.12 0.00 0.02 0.00 0.00 57.07 56.66 1igw s TYR 106 Cb -0.16 -0.90 0.13 0.00 -1.52 0.00 0.00 41.96 39.51 1igw s TYR 106 CO 0.11 0.28 1.12 -1.25 0.02 0.00 0.00 175.55 175.83 1igw s PRO 107 N -2.61 1.24 -1.46 -1.71 0.04 -1.26 -3.41 135.00 125.82 1igw s PRO 107 Ca 0.13 0.46 -0.14 0.00 0.04 0.00 0.00 61.00 61.49 1igw s PRO 107 Cb -0.06 -1.84 0.04 0.00 0.04 0.00 0.00 34.50 32.68 1igw s PRO 107 CO 0.06 -2.17 2.25 -3.47 0.04 0.00 0.00 177.00 173.70 1igw n ASP 108 N -3.78 4.05 -1.66 6.66 2.03 -1.26 -4.59 116.55 118.01 1igw n ASP 108 Ca 0.06 -2.84 -0.05 0.00 0.52 0.00 0.00 54.79 52.48 1igw n ASP 108 Cb 0.58 -1.65 0.08 0.00 -0.72 0.00 0.00 41.12 39.41 1igw n ASP 108 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1igw n GLN 109 N 5.97 2.00 -3.93 -0.67 6.02 -1.26 -4.98 117.38 120.52 1igw n GLN 109 Ca 0.53 -3.40 -0.25 0.00 -0.01 0.00 0.00 57.00 53.87 1igw n GLN 109 Cb 0.38 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 30.08 1igw n GLN 109 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1igw n SER 110 N -0.60 -0.50 0.02 1.08 7.64 -1.26 -4.10 113.62 115.90 1igw n SER 110 Ca 0.23 -0.98 0.03 0.00 1.01 0.00 0.00 58.87 59.15 1igw n SER 110 Cb 0.88 -3.16 -0.09 0.00 -1.01 0.00 0.00 64.21 60.83 1igw n SER 110 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1igw n LEU 111 N -4.39 0.56 -4.88 -3.43 4.77 -1.26 -4.92 117.00 103.45 1igw n LEU 111 Ca -0.30 0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 55.62 1igw n LEU 111 Cb 0.68 0.09 0.04 0.00 -2.33 0.00 0.00 43.42 41.90 1igw n LEU 111 CO 0.75 0.09 0.72 -0.72 -1.33 0.00 0.00 177.39 176.90 1igw s TYR 112 N -3.08 3.37 0.22 -1.77 -0.85 -1.26 -5.00 117.35 108.98 1igw s TYR 112 Ca -0.04 1.05 -0.31 0.00 -0.52 0.00 0.00 57.07 57.24 1igw s TYR 112 Cb 0.10 -2.98 -0.11 0.00 0.38 0.00 0.00 41.96 39.35 1igw s TYR 112 CO 0.83 -1.06 1.63 -2.14 -1.52 0.00 0.00 175.55 173.29 1igw s PRO 113 N -5.29 4.16 0.40 -3.49 0.02 -1.26 -4.87 135.00 124.67 1igw s PRO 113 Ca 0.57 2.52 0.20 0.00 0.02 0.00 0.00 61.00 64.30 1igw s PRO 113 Cb -0.11 -3.08 1.07 0.00 0.02 0.00 0.00 34.50 32.40 1igw s PRO 113 CO 0.51 -0.66 1.55 0.00 -0.33 0.00 0.00 177.00 178.07 1igw h ALA 114 N 6.20 1.17 -0.64 -1.55 0.00 -1.97 0.27 119.26 122.74 1igw h ALA 114 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1igw h ALA 114 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1igw h ALA 114 CO 0.89 -0.17 0.00 0.27 0.00 0.00 0.00 179.25 180.25 1igw n ASN 115 N -2.30 4.04 -0.11 0.00 2.04 -1.26 -4.48 115.26 113.19 1igw n ASN 115 Ca -0.01 -2.22 -0.13 0.00 -0.44 0.00 0.00 54.58 51.78 1igw n ASN 115 Cb 0.25 -0.51 -0.03 0.00 -2.53 0.00 0.00 39.78 36.97 1igw n ASN 115 CO 0.00 0.00 0.00 0.28 -0.44 0.00 0.00 177.26 177.10 1igw h SER 116 N 3.86 0.93 -0.26 0.53 0.02 -1.30 -2.93 113.55 114.40 1igw h SER 116 Ca 0.00 -0.46 -0.09 0.00 -0.84 0.00 0.00 61.79 60.40 1igw h SER 116 Cb 1.15 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.42 1igw h SER 116 CO 0.12 1.20 -0.18 0.58 -1.14 0.00 0.00 176.83 177.41 1igw h VAL 117 N 0.68 1.31 -0.40 2.27 2.07 -1.82 -2.79 116.25 117.56 1igw h VAL 117 Ca 0.06 -1.30 0.07 0.00 0.82 0.00 0.00 66.70 66.35 1igw h VAL 117 Cb 0.93 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1igw h VAL 117 CO 0.09 0.41 0.27 -0.65 0.02 0.00 0.00 177.57 177.71 1igw h PRO 118 N 0.30 0.23 -0.43 1.57 0.11 -1.86 -0.52 132.00 131.39 1igw h PRO 118 Ca 0.05 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.06 1igw h PRO 118 Cb 0.71 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1igw h PRO 118 CO 0.05 0.16 -0.09 0.00 -0.21 0.00 0.00 178.00 177.90 1igw h ALA 119 N 1.79 1.03 -0.02 -0.75 0.00 -1.30 -1.10 119.26 118.92 1igw h ALA 119 Ca 0.18 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 1igw h ALA 119 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1igw h ALA 119 CO -0.03 0.59 -0.83 0.28 0.00 0.00 0.00 179.25 179.25 1igw h VAL 120 N 0.69 1.44 -0.70 0.00 2.07 -1.00 -2.05 116.25 116.70 1igw h VAL 120 Ca 0.12 -2.43 0.02 0.00 0.82 0.00 0.00 66.70 65.23 1igw h VAL 120 Cb 0.56 2.34 -0.04 0.00 -1.52 0.00 0.00 31.29 32.63 1igw h VAL 120 CO 0.03 0.72 0.45 0.58 0.02 0.00 0.00 177.57 179.37 1igw h VAL 121 N 0.17 1.13 -0.59 2.57 2.07 -0.59 -0.83 116.25 120.16 1igw h VAL 121 Ca -0.04 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 1igw h VAL 121 Cb 1.44 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1igw h VAL 121 CO 0.13 0.16 0.25 -0.08 0.02 0.00 0.00 177.57 178.05 1igw h GLU 122 N 0.90 0.88 -0.55 1.57 4.81 -1.09 -1.57 114.58 119.52 1igw h GLU 122 Ca 0.27 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1igw h GLU 122 Cb -0.03 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 1igw h GLU 122 CO -0.09 0.75 0.28 0.00 -0.73 0.00 0.00 179.01 179.21 1igw h ARG 123 N 0.82 0.79 -0.14 1.92 3.08 -0.80 -0.66 114.38 119.39 1igw h ARG 123 Ca 0.20 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 1igw h ARG 123 Cb 0.19 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1igw h ARG 123 CO -0.02 0.63 0.06 0.82 -1.07 0.00 0.00 179.97 180.40 1igw h ILE 124 N 0.74 1.14 -0.26 2.04 2.04 -1.02 -0.89 117.51 121.30 1igw h ILE 124 Ca 0.19 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 1igw h ILE 124 Cb 0.10 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1igw h ILE 124 CO -0.03 0.13 0.01 0.78 0.00 0.00 0.00 178.15 179.04 1igw h ASN 125 N 0.09 0.35 0.10 1.72 2.35 -1.14 -1.59 115.58 117.46 1igw h ASN 125 Ca 0.05 -0.05 -0.16 0.00 -0.55 0.00 0.00 56.30 55.58 1igw h ASN 125 Cb 0.15 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1igw h ASN 125 CO -0.01 0.41 -0.59 0.78 -1.65 0.00 0.00 177.43 176.38 1igw h ASN 126 N 0.38 0.56 -0.45 5.81 2.35 -0.73 -1.21 115.58 122.28 1igw h ASN 126 Ca 0.09 -0.31 -0.11 0.00 -0.55 0.00 0.00 56.30 55.42 1igw h ASN 126 Cb 0.23 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1igw h ASN 126 CO 0.00 1.02 -0.12 0.74 -1.65 0.00 0.00 177.43 177.43 1igw h THR 127 N 0.37 1.26 -0.51 2.81 2.02 -0.67 -2.52 112.91 115.68 1igw h THR 127 Ca -0.00 -1.24 -0.11 0.00 0.77 0.00 0.00 66.41 65.83 1igw h THR 127 Cb 1.13 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 1igw h THR 127 CO 0.11 0.43 -0.12 -0.26 0.37 0.00 0.00 175.52 176.05 1igw h PHE 128 N 0.82 1.10 -0.51 3.16 0.05 -1.11 -1.98 116.94 118.48 1igw h PHE 128 Ca 0.13 -0.24 0.00 0.00 3.82 0.00 0.00 57.97 61.69 1igw h PHE 128 Cb 0.65 -0.27 -0.02 0.00 2.00 0.00 0.00 35.95 38.31 1igw h PHE 128 CO 0.04 1.04 0.33 0.00 -0.18 0.00 0.00 178.31 179.54 1igw h ARG 129 N 0.85 0.67 0.39 1.51 3.08 -1.09 -1.45 114.38 118.34 1igw h ARG 129 Ca 0.13 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1igw h ARG 129 Cb 0.68 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1igw h ARG 129 CO 0.05 0.46 -0.25 -0.09 -1.07 0.00 0.00 179.97 179.07 1igw h ARG 130 N 0.68 -0.59 -0.88 0.04 9.65 -1.30 0.98 114.38 122.96 1igw h ARG 130 Ca 0.18 0.04 0.12 0.00 -1.10 0.00 0.00 59.98 59.22 1igw h ARG 130 Cb -0.06 0.13 -0.08 0.00 -1.39 0.00 0.00 29.97 28.57 1igw h ARG 130 CO -0.04 -0.39 0.50 0.00 2.80 0.00 0.00 179.97 182.84 1igw h ALA 131 N -0.04 1.29 -0.62 2.80 0.00 -1.27 0.63 119.26 122.05 1igw h ALA 131 Ca -0.04 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1igw h ALA 131 Cb 0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1igw h ALA 131 CO 0.04 0.08 0.17 0.22 0.00 0.00 0.00 179.25 179.76 1igw h ASP 132 N 0.80 0.93 -0.58 0.00 3.58 -0.82 -2.22 116.42 118.10 1igw h ASP 132 Ca 0.44 -0.22 -0.08 0.00 0.42 0.00 0.00 57.03 57.59 1igw h ASP 132 Cb 0.48 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.26 1igw h ASP 132 CO -0.28 0.91 0.04 1.56 -2.88 0.00 0.00 179.24 178.59 1igw h GLN 133 N 0.90 1.01 -0.53 0.28 4.20 0.85 0.29 115.11 122.11 1igw h GLN 133 Ca 0.20 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1igw h GLN 133 Cb 0.33 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 1igw h GLN 133 CO -0.00 0.97 0.32 0.82 -0.67 0.00 0.00 178.83 180.27 1igw h ILE 134 N 0.94 1.16 -0.28 2.54 2.04 -0.80 0.98 117.51 124.09 1igw h ILE 134 Ca 0.18 -0.36 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1igw h ILE 134 Cb 0.48 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1igw h ILE 134 CO 0.02 0.17 -0.12 -0.61 0.00 0.00 0.00 178.15 177.61 1igw h GLN 135 N 0.72 0.57 -0.38 2.37 4.15 -1.18 -2.65 115.11 118.71 1igw h GLN 135 Ca 0.19 -0.24 -0.09 0.00 0.77 0.00 0.00 58.65 59.28 1igw h GLN 135 Cb -0.01 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 1igw h GLN 135 CO -0.04 0.80 -0.12 2.35 -1.93 0.00 0.00 178.83 179.89 1igw h TRP 136 N 0.31 0.85 0.00 3.99 2.91 -0.79 -2.69 115.95 120.53 1igw h TRP 136 Ca 0.06 -0.19 -0.04 0.00 1.13 0.00 0.00 58.89 59.85 1igw h TRP 136 Cb 0.62 -0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 29.06 1igw h TRP 136 CO 0.06 0.91 -0.18 0.66 -1.03 0.00 0.00 178.44 178.86 1igw h SER 137 N 0.55 0.00 -0.21 2.65 4.64 -0.82 -2.04 113.55 118.32 1igw h SER 137 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1igw h SER 137 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1igw h SER 137 CO 0.04 0.18 0.00 0.00 -0.87 0.00 0.00 176.83 176.18 1igw n ALA 138 N -2.38 2.48 0.00 5.18 0.00 -1.00 -4.93 120.51 119.86 1igw n ALA 138 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1igw n ALA 138 Cb 0.26 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1igw n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1igw n GLY 139 N 0.91 2.86 3.52 0.00 0.00 -0.77 -5.01 105.19 106.71 1igw n GLY 139 Ca 0.10 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 1igw n GLY 139 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1igw n ILE 140 N 0.00 0.04 -3.69 -0.61 5.41 -1.03 -4.93 119.36 114.55 1igw n ILE 140 Ca 0.00 -0.49 -0.20 0.00 1.00 0.00 0.00 62.75 63.06 1igw n ILE 140 Cb 0.00 -2.08 -0.02 0.00 -0.71 0.00 0.00 39.64 36.83 1igw n ILE 140 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1igw s GLU 141 N 7.75 3.05 -0.06 0.38 2.02 -1.26 -4.04 118.70 126.53 1igw s GLU 141 Ca 1.08 -1.05 -0.36 0.00 0.02 0.00 0.00 54.97 54.66 1igw s GLU 141 Cb -0.55 -2.72 -0.14 0.00 0.10 0.00 0.00 34.13 30.82 1igw s GLU 141 CO 0.37 0.15 1.71 -2.30 0.02 0.00 0.00 175.26 175.21 1igw n PRO 142 N -1.50 1.77 0.00 0.39 -0.02 -1.26 -1.21 135.00 133.17 1igw n PRO 142 Ca -0.02 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1igw n PRO 142 Cb 0.58 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 1igw n PRO 142 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1igw n GLY 143 N 3.90 0.61 3.77 -1.23 0.00 -1.26 -5.08 105.19 105.90 1igw n GLY 143 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1igw n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1igw s ASP 144 N -2.04 7.26 0.00 1.61 2.15 -0.35 -4.91 116.67 120.39 1igw s ASP 144 Ca 0.00 1.95 0.00 0.00 0.43 0.00 0.00 52.55 54.93 1igw s ASP 144 Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1igw s ASP 144 CO 0.00 -0.13 0.23 -2.65 -0.17 0.00 0.00 175.17 172.45 1igw n PRO 145 N 0.66 0.31 0.00 4.34 -0.02 -1.26 -1.63 135.00 137.39 1igw n PRO 145 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1igw n PRO 145 Cb 0.49 -1.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 1igw n PRO 145 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1igw n ARG 146 N -0.07 0.00 -2.34 -0.52 1.85 -1.26 -5.09 116.66 109.24 1igw n ARG 146 Ca 0.00 -0.08 -0.43 0.00 -1.00 0.00 0.00 57.85 56.34 1igw n ARG 146 Cb 0.04 -0.27 -0.02 0.00 -1.05 0.00 0.00 32.46 31.15 1igw n ARG 146 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 177.63 177.15 1igw s TYR 147 N 0.00 2.62 -0.20 2.89 5.04 -0.65 -5.02 117.35 122.04 1igw s TYR 147 Ca 0.00 0.83 -0.10 0.00 -2.44 0.00 0.00 57.07 55.36 1igw s TYR 147 Cb 0.00 -3.69 -0.05 0.00 0.35 0.00 0.00 41.96 38.57 1igw s TYR 147 CO 0.00 -2.11 0.13 0.08 -1.34 0.00 0.00 175.55 172.31 1igw s VAL 148 N 3.92 5.37 -0.70 3.14 1.01 -1.26 -4.88 120.40 127.01 1igw s VAL 148 Ca 0.59 0.18 -0.25 0.00 0.00 0.00 0.00 61.98 62.50 1igw s VAL 148 Cb -0.22 -3.46 0.05 0.00 0.00 0.00 0.00 36.38 32.75 1igw s VAL 148 CO 0.20 0.43 1.13 -0.62 0.00 0.00 0.00 175.10 176.23 1igw s ASP 149 N 0.42 6.17 0.37 3.32 2.15 -1.26 -4.88 116.67 122.96 1igw s ASP 149 Ca 0.08 -0.71 0.26 0.00 0.43 0.00 0.00 52.55 52.60 1igw s ASP 149 Cb -0.11 -2.49 0.73 0.00 -0.30 0.00 0.00 42.92 40.75 1igw s ASP 149 CO -0.01 -1.65 1.74 1.88 -0.17 0.00 0.00 175.17 176.96 1igw h TYR 150 N 9.80 0.00 -0.66 -5.34 -1.99 -1.94 -3.41 116.97 113.43 1igw h TYR 150 Ca -0.28 0.00 -0.69 0.00 2.00 0.00 0.00 58.73 59.76 1igw h TYR 150 Cb 1.06 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 39.72 1igw h TYR 150 CO 1.05 0.00 2.43 1.19 -0.00 0.00 0.00 178.16 182.83 1igw n PHE 151 N -2.75 4.38 -2.68 4.88 3.01 -1.26 -4.88 117.46 118.16 1igw n PHE 151 Ca 0.04 -2.88 -0.41 0.00 1.01 0.00 0.00 57.45 55.20 1igw n PHE 151 Cb 0.43 -2.61 -0.04 0.00 -0.01 0.00 0.00 39.48 37.24 1igw n PHE 151 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1igw s LEU 152 N 3.66 4.50 0.32 4.37 1.43 -1.26 -4.95 118.68 126.75 1igw s LEU 152 Ca 0.52 1.87 -0.29 0.00 -1.03 0.00 0.00 54.13 55.20 1igw s LEU 152 Cb 0.06 -3.59 -0.12 0.00 0.03 0.00 0.00 46.19 42.57 1igw s LEU 152 CO 0.04 -0.10 1.40 -2.65 0.23 0.00 0.00 176.35 175.27 1igw n PRO 153 N 2.66 2.31 -4.10 1.29 -0.02 -1.26 -4.67 135.00 131.21 1igw n PRO 153 Ca 0.02 0.81 -0.35 0.00 -2.02 0.00 0.00 63.50 61.97 1igw n PRO 153 Cb 0.48 -2.47 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 1igw n PRO 153 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1igw s ILE 154 N -0.69 4.23 -0.27 4.25 1.01 -1.26 -0.66 121.20 127.82 1igw s ILE 154 Ca 0.59 -0.22 -0.09 0.00 0.00 0.00 0.00 60.65 60.93 1igw s ILE 154 Cb -0.56 -2.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 1igw s ILE 154 CO 0.57 0.44 0.13 -0.69 0.00 0.00 0.00 174.94 175.40 1igw s VAL 155 N 0.73 4.76 0.09 2.92 1.01 0.15 -1.24 120.40 128.81 1igw s VAL 155 Ca 0.01 -0.05 0.10 0.00 0.00 0.00 0.00 61.98 62.04 1igw s VAL 155 Cb -0.14 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 1igw s VAL 155 CO 0.02 0.28 -0.25 0.00 0.00 0.00 0.00 175.10 175.15 1igw s ALA 156 N 1.68 2.17 -0.43 5.51 0.00 0.96 0.22 121.76 131.87 1igw s ALA 156 Ca 0.07 -1.31 -0.25 0.00 0.00 0.00 0.00 51.96 50.46 1igw s ALA 156 Cb -0.16 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.60 1igw s ALA 156 CO 0.07 0.49 0.90 0.34 0.00 0.00 0.00 175.76 177.56 1igw s ASP 157 N -1.63 6.54 -0.03 0.00 -1.08 -1.14 -1.66 116.67 117.67 1igw s ASP 157 Ca 0.11 0.24 0.19 0.00 -0.52 0.00 0.00 52.55 52.57 1igw s ASP 157 Cb -0.10 -2.44 0.60 0.00 -1.46 0.00 0.00 42.92 39.52 1igw s ASP 157 CO 0.04 -0.96 1.50 0.00 0.52 0.00 0.00 175.17 176.28 1igw n ALA 158 N 6.95 2.61 -0.30 3.66 0.00 -0.67 -4.72 120.51 128.03 1igw n ALA 158 Ca 0.06 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.26 1igw n ALA 158 Cb 0.48 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1igw n ALA 158 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1igw n GLU 159 N 1.28 0.00 -0.48 0.00 1.02 -1.23 0.15 120.64 121.38 1igw n GLU 159 Ca 0.22 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.45 1igw n GLU 159 Cb 0.64 0.00 0.29 0.00 -0.02 0.00 0.00 31.44 32.35 1igw n GLU 159 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1igw n ALA 160 N 10.17 2.89 -0.92 0.62 0.00 -1.26 -1.80 120.51 130.21 1igw n ALA 160 Ca 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 53.44 51.73 1igw n ALA 160 Cb 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1igw n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1igw n GLY 161 N 0.49 0.54 3.83 0.00 0.00 0.12 -4.35 105.19 105.82 1igw n GLY 161 Ca 0.21 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 1igw n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1igw n PHE 162 N -2.92 -2.04 0.00 1.61 3.01 -1.26 -3.19 117.46 112.67 1igw n PHE 162 Ca 0.00 0.86 0.00 0.00 1.01 0.00 0.00 57.45 59.32 1igw n PHE 162 Cb 0.00 -4.12 0.00 0.00 -0.01 0.00 0.00 39.48 35.35 1igw n PHE 162 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1igw n GLY 163 N -1.66 0.41 0.00 1.37 0.00 -1.26 -4.88 105.19 99.17 1igw n GLY 163 Ca -0.15 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1igw n GLY 163 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1igw n GLY 164 N 0.00 0.12 0.30 -0.02 0.00 -1.26 -4.87 105.19 99.46 1igw n GLY 164 Ca 0.00 -1.85 0.06 0.00 0.00 0.00 0.00 46.02 44.23 1igw n GLY 164 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1igw h VAL 165 N -0.53 1.06 -0.18 1.61 -1.51 -1.94 -2.26 116.25 112.50 1igw h VAL 165 Ca 0.00 -0.13 -0.20 0.00 -1.23 0.00 0.00 66.70 65.15 1igw h VAL 165 Cb 0.00 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 29.82 1igw h VAL 165 CO 0.00 0.07 -0.67 -0.07 -1.23 0.00 0.00 177.57 175.66 1igw h LEU 166 N 0.37 0.80 -1.15 4.19 3.38 -1.96 -1.53 115.31 119.40 1igw h LEU 166 Ca 0.11 -0.48 -0.07 0.00 0.09 0.00 0.00 57.88 57.53 1igw h LEU 166 Cb 0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1igw h LEU 166 CO -0.02 1.25 -0.20 0.78 0.09 0.00 0.00 178.44 180.34 1igw h ASN 167 N 0.50 0.34 -0.19 -0.43 2.35 -1.68 -0.22 115.58 116.25 1igw h ASN 167 Ca -0.02 -0.10 -0.17 0.00 -0.55 0.00 0.00 56.30 55.47 1igw h ASN 167 Cb 1.27 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 39.54 1igw h ASN 167 CO 0.13 0.56 -0.50 0.00 -1.65 0.00 0.00 177.43 175.98 1igw h ALA 168 N 1.48 0.60 -0.01 -0.83 0.00 -1.25 -0.26 119.26 118.99 1igw h ALA 168 Ca 0.06 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1igw h ALA 168 Cb 0.53 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1igw h ALA 168 CO 0.04 0.68 0.00 0.35 0.00 0.00 0.00 179.25 180.32 1igw h PHE 169 N 0.60 0.01 -0.29 0.00 3.57 -0.73 0.65 116.94 120.76 1igw h PHE 169 Ca 0.03 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 1igw h PHE 169 Cb 1.07 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 1igw h PHE 169 CO 0.06 0.00 -0.09 0.93 -2.23 0.00 0.00 178.31 176.99 1igw h GLU 170 N 0.01 0.48 -0.39 1.11 4.39 -0.98 -1.66 114.58 117.53 1igw h GLU 170 Ca 0.00 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 1igw h GLU 170 Cb -0.00 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1igw h GLU 170 CO -0.00 0.57 -0.13 1.25 -1.16 0.00 0.00 179.01 179.54 1igw h LEU 171 N 0.45 0.79 -0.58 1.33 6.46 -0.50 -2.12 115.31 121.14 1igw h LEU 171 Ca 0.09 -0.38 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 1igw h LEU 171 Cb 0.43 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 1igw h LEU 171 CO 0.02 0.99 0.37 -0.03 -0.62 0.00 0.00 178.44 179.16 1igw h MET 172 N 0.58 0.77 -0.52 1.25 4.05 -0.48 -0.89 114.93 119.70 1igw h MET 172 Ca 0.10 -0.06 0.06 0.00 -0.28 0.00 0.00 59.70 59.51 1igw h MET 172 Cb 0.66 -0.17 -0.05 0.00 -0.80 0.00 0.00 31.60 31.24 1igw h MET 172 CO 0.04 0.54 0.23 -0.22 0.23 0.00 0.00 176.91 177.73 1igw h LYS 173 N 0.78 0.43 -0.47 0.39 3.64 -1.11 -1.50 116.57 118.73 1igw h LYS 173 Ca 0.21 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1igw h LYS 173 Cb -0.05 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1igw h LYS 173 CO -0.04 0.28 0.31 0.00 -2.27 0.00 0.00 179.45 177.73 1igw h ALA 174 N 1.31 0.59 -0.28 5.00 0.00 -0.96 -0.05 119.26 124.88 1igw h ALA 174 Ca 0.24 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1igw h ALA 174 Cb 0.21 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1igw h ALA 174 CO -0.20 0.04 0.15 0.52 0.00 0.00 0.00 179.25 179.76 1igw h MET 175 N 0.63 0.31 -0.10 0.00 2.86 -0.53 -1.70 114.93 116.40 1igw h MET 175 Ca 0.17 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 1igw h MET 175 Cb -0.07 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.52 1igw h MET 175 CO -0.04 0.20 0.03 0.82 1.06 0.00 0.00 176.91 178.99 1igw h ILE 176 N 0.32 1.17 -0.58 -1.22 2.04 -0.85 0.53 117.51 118.91 1igw h ILE 176 Ca 0.11 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.47 1igw h ILE 176 Cb 0.01 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1igw h ILE 176 CO -0.06 0.15 0.38 -0.33 0.00 0.00 0.00 178.15 178.29 1igw h GLU 177 N -0.03 0.71 0.00 2.37 5.08 -0.94 -0.04 114.58 121.72 1igw h GLU 177 Ca 0.03 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1igw h GLU 177 Cb 0.21 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1igw h GLU 177 CO -0.00 0.47 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 1igw n ALA 178 N -2.46 2.16 -0.10 3.43 0.00 -0.65 -4.92 120.51 117.99 1igw n ALA 178 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1igw n ALA 178 Cb 0.10 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1igw n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1igw n GLY 179 N 1.10 1.59 3.79 0.00 0.00 -0.03 -4.16 105.19 107.48 1igw n GLY 179 Ca 0.06 -0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1igw n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1igw s ALA 180 N -2.00 2.94 -0.11 4.61 0.00 0.14 -4.32 121.76 123.03 1igw s ALA 180 Ca 0.00 0.68 0.13 0.00 0.00 0.00 0.00 51.96 52.77 1igw s ALA 180 Cb 0.00 -3.28 -0.24 0.00 0.00 0.00 0.00 23.12 19.61 1igw s ALA 180 CO 0.00 -0.33 0.41 0.00 0.00 0.00 0.00 175.76 175.84 1igw n ALA 181 N -0.63 1.46 -3.18 0.00 0.00 -0.37 -4.64 120.51 113.15 1igw n ALA 181 Ca 0.08 -0.97 -0.12 0.00 0.00 0.00 0.00 53.44 52.43 1igw n ALA 181 Cb 0.51 -0.58 -0.10 0.00 0.00 0.00 0.00 19.45 19.28 1igw n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1igw s ALA 182 N -2.56 -0.61 -0.00 0.00 0.00 -1.07 -1.37 121.76 116.15 1igw s ALA 182 Ca -0.09 0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.15 1igw s ALA 182 Cb 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 23.12 23.17 1igw s ALA 182 CO 0.81 -0.22 -0.05 0.08 0.00 0.00 0.00 175.76 176.39 1igw s VAL 183 N -1.05 0.39 -0.07 0.00 1.01 -0.60 -0.03 120.40 120.05 1igw s VAL 183 Ca -0.11 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1igw s VAL 183 Cb -0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 1igw s VAL 183 CO 0.03 0.11 -0.15 -1.38 0.00 0.00 0.00 175.10 173.71 1igw s HIS 184 N -0.10 2.70 0.02 5.22 -3.43 -0.66 -1.09 115.29 117.95 1igw s HIS 184 Ca 0.02 -0.36 0.07 0.00 -0.80 0.00 0.00 55.06 53.98 1igw s HIS 184 Cb -0.02 -1.69 -0.03 0.00 -1.43 0.00 0.00 32.58 29.41 1igw s HIS 184 CO -0.00 0.03 -0.18 -0.06 -2.00 0.00 0.00 174.74 172.52 1igw s PHE 185 N -0.35 2.57 0.31 0.38 0.40 -0.69 -1.67 117.98 118.93 1igw s PHE 185 Ca 0.03 -0.25 0.11 0.00 -0.60 0.00 0.00 56.93 56.22 1igw s PHE 185 Cb -0.12 -1.49 -0.06 0.00 0.51 0.00 0.00 43.02 41.85 1igw s PHE 185 CO 0.02 0.22 -0.14 -1.83 0.70 0.00 0.00 175.22 174.20 1igw s GLU 186 N -1.25 1.77 0.00 0.44 -1.05 -0.74 -0.06 118.70 117.81 1igw s GLU 186 Ca 0.14 -1.85 0.23 0.00 -0.15 0.00 0.00 54.97 53.34 1igw s GLU 186 Cb -0.10 -1.75 0.47 0.00 -0.44 0.00 0.00 34.13 32.31 1igw s GLU 186 CO 0.04 0.23 1.43 -0.40 0.95 0.00 0.00 175.26 177.50 1igw n ASP 187 N -0.72 3.28 -4.94 0.83 5.68 -0.98 -4.65 116.55 115.05 1igw n ASP 187 Ca -0.05 -1.97 -0.24 0.00 -0.50 0.00 0.00 54.79 52.03 1igw n ASP 187 Cb 0.62 -0.25 -0.00 0.00 -1.14 0.00 0.00 41.12 40.35 1igw n ASP 187 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1igw s GLN 188 N -1.51 3.36 -0.53 0.11 -2.07 -1.26 -1.83 119.66 115.94 1igw s GLN 188 Ca 0.38 -0.26 -0.04 0.00 -1.82 0.00 0.00 55.36 53.63 1igw s GLN 188 Cb 0.22 -2.56 0.14 0.00 -1.09 0.00 0.00 33.01 29.72 1igw s GLN 188 CO 0.31 -0.07 0.34 -1.17 -1.32 0.00 0.00 175.29 173.39 1igw s LEU 189 N -4.49 5.33 0.48 2.60 0.20 0.16 -4.78 118.68 118.18 1igw s LEU 189 Ca 0.44 -2.42 0.27 0.00 0.69 0.00 0.00 54.13 53.11 1igw s LEU 189 Cb -0.10 -1.87 1.16 0.00 -0.43 0.00 0.00 46.19 44.96 1igw s LEU 189 CO 0.39 -0.48 1.93 0.00 -0.29 0.00 0.00 176.35 177.90 1igw h ALA 190 N 7.60 1.08 0.00 5.97 0.00 -1.91 -3.02 119.26 128.99 1igw h ALA 190 Ca -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1igw h ALA 190 Cb 1.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1igw h ALA 190 CO 0.72 0.20 0.00 -1.13 0.00 0.00 0.00 179.25 179.04 1igw n SER 191 N -3.40 0.00 -0.78 0.00 3.41 -1.26 -3.14 113.62 108.45 1igw n SER 191 Ca -0.00 -0.82 0.05 0.00 -0.26 0.00 0.00 58.87 57.84 1igw n SER 191 Cb 0.35 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.41 1igw n SER 191 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1igw n VAL 192 N -0.93 1.18 -1.97 -3.33 0.31 -1.14 -5.01 118.33 107.45 1igw n VAL 192 Ca 0.15 -1.96 -0.40 0.00 -0.01 0.00 0.00 64.34 62.12 1igw n VAL 192 Cb 0.07 0.24 -0.03 0.00 -0.91 0.00 0.00 33.84 33.21 1igw n VAL 192 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1igw s LYS 193 N -1.75 2.79 0.62 5.55 1.02 -1.19 -4.83 119.74 121.95 1igw s LYS 193 Ca 0.31 0.97 -0.16 0.00 0.02 0.00 0.00 55.97 57.11 1igw s LYS 193 Cb 0.31 -4.35 -0.02 0.00 -0.52 0.00 0.00 37.83 33.25 1igw s LYS 193 CO -0.07 -2.52 1.10 -1.59 -0.92 0.00 0.00 175.35 171.34 1igw s LYS 194 N 6.75 3.03 -0.85 1.68 -2.85 -1.26 -4.93 119.74 121.31 1igw s LYS 194 Ca 0.75 1.37 -0.06 0.00 -1.00 0.00 0.00 55.97 57.02 1igw s LYS 194 Cb -0.16 -1.98 -0.09 0.00 -2.06 0.00 0.00 37.83 33.53 1igw s LYS 194 CO 0.25 -1.07 2.44 0.00 0.10 0.00 0.00 175.35 177.07 1igw n GLY 200 N 3.45 1.97 3.78 0.00 0.00 -1.26 -5.24 105.19 107.88 1igw n GLY 200 Ca 0.48 -2.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.10 1igw n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1igw s LYS 201 N 2.61 3.62 -0.14 1.61 1.02 -1.26 -4.66 119.74 122.54 1igw s LYS 201 Ca 0.00 1.64 0.01 0.00 0.02 0.00 0.00 55.97 57.65 1igw s LYS 201 Cb 0.00 -2.21 0.02 0.00 -0.52 0.00 0.00 37.83 35.12 1igw s LYS 201 CO 0.00 -0.64 -0.16 0.08 -0.92 0.00 0.00 175.35 173.71 1igw s VAL 202 N -1.69 1.67 0.55 3.17 1.01 -1.26 -3.59 120.40 120.25 1igw s VAL 202 Ca 0.67 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 1igw s VAL 202 Cb -0.25 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.60 1igw s VAL 202 CO 0.29 0.48 0.83 -0.76 0.00 0.00 0.00 175.10 175.94 1igw s LEU 203 N 1.22 3.36 0.24 3.92 1.43 -0.24 0.40 118.68 129.02 1igw s LEU 203 Ca -0.00 0.58 0.09 0.00 -1.03 0.00 0.00 54.13 53.77 1igw s LEU 203 Cb -0.14 -3.42 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 1igw s LEU 203 CO -0.07 -0.95 0.02 0.68 0.23 0.00 0.00 176.35 176.25 1igw s VAL 204 N -2.86 3.61 0.68 -1.59 -7.23 -0.76 -0.86 120.40 111.40 1igw s VAL 204 Ca 0.52 -1.75 -0.17 0.00 -1.81 0.00 0.00 61.98 58.78 1igw s VAL 204 Cb -0.10 -2.91 -0.06 0.00 0.56 0.00 0.00 36.38 33.87 1igw s VAL 204 CO 0.43 -0.31 0.49 -2.65 -0.31 0.00 0.00 175.10 172.75 1igw n PRO 205 N -0.74 0.36 -0.07 4.82 -0.02 -1.26 -4.78 135.00 133.30 1igw n PRO 205 Ca -0.07 0.16 -0.08 0.00 -2.02 0.00 0.00 63.50 61.48 1igw n PRO 205 Cb 0.58 -1.76 -0.01 0.00 -0.02 0.00 0.00 33.50 32.29 1igw n PRO 205 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1igw h THR 206 N -0.19 0.93 -0.66 3.45 2.02 -1.95 -1.87 112.91 114.64 1igw h THR 206 Ca -0.45 -0.07 0.09 0.00 0.77 0.00 0.00 66.41 66.74 1igw h THR 206 Cb 1.37 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 1igw h THR 206 CO 0.44 0.04 0.44 -0.61 0.37 0.00 0.00 175.52 176.19 1igw h GLN 207 N 0.22 0.54 -0.40 6.66 5.75 -1.97 -1.47 115.11 124.44 1igw h GLN 207 Ca 0.12 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.52 1igw h GLN 207 Cb 0.09 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 1igw h GLN 207 CO -0.12 0.36 -0.01 0.93 -2.65 0.00 0.00 178.83 177.33 1igw h GLU 208 N 0.55 0.71 -0.16 1.69 5.08 -1.68 -1.36 114.58 119.41 1igw h GLU 208 Ca 0.30 -0.23 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1igw h GLU 208 Cb 0.44 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1igw h GLU 208 CO -0.09 0.81 -0.22 0.00 -1.00 0.00 0.00 179.01 178.51 1igw h ALA 209 N 0.88 1.33 -0.19 3.43 0.00 -1.16 -2.50 119.26 121.04 1igw h ALA 209 Ca 0.11 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 1igw h ALA 209 Cb 0.50 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1igw h ALA 209 CO 0.02 0.45 -0.49 0.82 0.00 0.00 0.00 179.25 180.05 1igw h ILE 210 N 0.26 1.32 -0.29 0.00 2.04 -1.11 -2.78 117.51 116.94 1igw h ILE 210 Ca 0.04 -1.71 -0.04 0.00 1.00 0.00 0.00 64.86 64.16 1igw h ILE 210 Cb 0.53 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 1igw h ILE 210 CO 0.04 0.53 0.03 1.56 0.00 0.00 0.00 178.15 180.30 1igw h GLN 211 N 0.41 0.43 -0.21 2.37 4.20 -0.80 -1.46 115.11 120.06 1igw h GLN 211 Ca 0.02 -0.08 -0.18 0.00 0.06 0.00 0.00 58.65 58.48 1igw h GLN 211 Cb 1.01 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 1igw h GLN 211 CO 0.09 0.44 -0.59 0.87 -0.67 0.00 0.00 178.83 178.97 1igw h LYS 212 N 0.42 0.68 -0.63 1.46 1.57 -1.38 -1.00 116.57 117.69 1igw h LYS 212 Ca 0.10 -0.45 -0.07 0.00 -1.87 0.00 0.00 60.65 58.35 1igw h LYS 212 Cb 0.24 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1igw h LYS 212 CO 0.00 1.07 0.12 -0.07 -0.57 0.00 0.00 179.45 180.00 1igw h LEU 213 N 0.51 0.97 -0.31 2.94 3.38 -1.18 -1.53 115.31 120.09 1igw h LEU 213 Ca 0.00 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 1igw h LEU 213 Cb 1.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1igw h LEU 213 CO 0.12 0.96 0.00 0.58 0.09 0.00 0.00 178.44 180.19 1igw h VAL 214 N 0.97 1.26 -0.67 1.22 2.07 -1.14 -0.84 116.25 119.11 1igw h VAL 214 Ca 0.20 -0.94 0.02 0.00 0.82 0.00 0.00 66.70 66.80 1igw h VAL 214 Cb 0.40 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1igw h VAL 214 CO 0.01 0.31 0.42 0.00 0.02 0.00 0.00 177.57 178.33 1igw h ALA 215 N 0.84 0.86 -0.32 1.67 0.00 -1.05 -0.44 119.26 120.83 1igw h ALA 215 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1igw h ALA 215 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1igw h ALA 215 CO 0.02 0.20 0.14 0.00 0.00 0.00 0.00 179.25 179.60 1igw h ALA 216 N 1.28 0.42 -0.45 0.00 0.00 -1.12 -2.29 119.26 117.09 1igw h ALA 216 Ca 0.26 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1igw h ALA 216 Cb -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1igw h ALA 216 CO -0.09 -0.00 -0.11 -0.09 0.00 0.00 0.00 179.25 178.96 1igw h ARG 217 N 0.38 0.81 -0.28 0.00 2.43 -1.00 -2.22 114.38 114.50 1igw h ARG 217 Ca 0.11 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1igw h ARG 217 Cb 0.15 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1igw h ARG 217 CO -0.01 0.88 0.17 1.25 -1.51 0.00 0.00 179.97 180.75 1igw h LEU 218 N 0.73 0.33 -0.54 3.80 6.46 -0.87 0.13 115.31 125.35 1igw h LEU 218 Ca 0.12 -0.05 0.01 0.00 -0.12 0.00 0.00 57.88 57.84 1igw h LEU 218 Cb 0.60 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.41 1igw h LEU 218 CO 0.04 0.28 0.36 0.00 -0.62 0.00 0.00 178.44 178.49 1igw h ALA 220 N 1.21 0.56 -0.94 0.00 0.00 -0.98 -0.09 119.26 119.01 1igw h ALA 220 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1igw h ALA 220 Cb -0.07 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 1igw h ALA 220 CO -0.05 0.11 0.61 -0.44 0.00 0.00 0.00 179.25 179.48 1igw h ASP 221 N 0.57 1.10 -0.58 0.00 3.32 -0.38 0.11 116.42 120.56 1igw h ASP 221 Ca 0.15 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1igw h ASP 221 Cb 0.10 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1igw h ASP 221 CO -0.02 0.81 0.19 0.58 -1.72 0.00 0.00 179.24 179.08 1igw h VAL 222 N 1.29 1.24 0.00 -1.35 2.07 0.03 -2.65 116.25 116.87 1igw h VAL 222 Ca 0.34 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1igw h VAL 222 Cb -0.12 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1igw h VAL 222 CO -0.07 0.30 0.00 0.71 0.02 0.00 0.00 177.57 178.53 1igw h THR 223 N 0.82 0.00 0.00 2.57 1.35 -0.52 -3.46 112.91 113.67 1igw h THR 223 Ca 0.19 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1igw h THR 223 Cb 0.28 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 1igw h THR 223 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 1igw n GLY 224 N 0.34 0.45 3.58 5.82 0.00 -0.02 -4.94 105.19 110.43 1igw n GLY 224 Ca 0.02 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 1igw n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1igw s VAL 225 N -2.00 4.34 -0.31 1.61 1.01 -0.99 -5.01 120.40 119.05 1igw s VAL 225 Ca 0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 1igw s VAL 225 Cb 0.00 -2.92 -0.18 0.00 0.00 0.00 0.00 36.38 33.28 1igw s VAL 225 CO 0.00 0.50 3.37 -0.81 0.00 0.00 0.00 175.10 178.16 1igw n PRO 226 N 3.33 2.35 -1.73 2.72 -0.04 -1.26 -4.47 135.00 135.89 1igw n PRO 226 Ca -0.17 -1.44 -0.42 0.00 -0.04 0.00 0.00 63.50 61.43 1igw n PRO 226 Cb 0.53 -2.14 -0.01 0.00 -0.04 0.00 0.00 33.50 31.84 1igw n PRO 226 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1igw n THR 227 N 2.34 1.89 -2.61 0.52 -1.04 -1.26 -4.84 114.28 109.27 1igw n THR 227 Ca 0.49 -0.47 -0.41 0.00 -2.04 0.00 0.00 64.05 61.61 1igw n THR 227 Cb 0.76 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.48 1igw n THR 227 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1igw s LEU 228 N -1.34 4.47 -0.20 -4.42 1.02 -0.47 -4.98 118.68 112.76 1igw s LEU 228 Ca 0.56 1.92 -0.03 0.00 0.02 0.00 0.00 54.13 56.60 1igw s LEU 228 Cb -0.53 -3.59 -0.01 0.00 0.02 0.00 0.00 46.19 42.08 1igw s LEU 228 CO 0.61 -0.19 -0.06 -0.22 0.02 0.00 0.00 176.35 176.52 1igw s LEU 229 N 0.07 2.91 -0.28 1.79 0.20 -1.26 -1.56 118.68 120.55 1igw s LEU 229 Ca 0.50 -0.35 -0.08 0.00 0.69 0.00 0.00 54.13 54.89 1igw s LEU 229 Cb -0.26 -1.72 -0.01 0.00 -0.43 0.00 0.00 46.19 43.76 1igw s LEU 229 CO 0.32 0.03 0.11 -0.69 -0.29 0.00 0.00 176.35 175.82 1igw s VAL 230 N 1.16 4.39 -0.30 1.68 1.01 -0.25 -0.36 120.40 127.72 1igw s VAL 230 Ca 0.02 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 61.47 1igw s VAL 230 Cb -0.14 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.06 1igw s VAL 230 CO -0.01 0.19 0.55 0.00 0.00 0.00 0.00 175.10 175.83 1igw s ALA 231 N 1.60 3.54 -0.10 5.51 0.00 -0.30 -1.69 121.76 130.31 1igw s ALA 231 Ca 0.05 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 1igw s ALA 231 Cb -0.16 -2.99 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 1igw s ALA 231 CO 0.05 -0.99 -0.02 0.50 0.00 0.00 0.00 175.76 175.30 1igw s ARG 232 N 2.43 3.14 -0.07 0.00 3.52 0.92 -0.71 118.95 128.16 1igw s ARG 232 Ca 0.21 -0.46 0.04 0.00 -0.13 0.00 0.00 55.73 55.40 1igw s ARG 232 Cb -0.15 -2.80 -0.01 0.00 -1.56 0.00 0.00 34.95 30.43 1igw s ARG 232 CO 0.11 0.57 -0.21 -0.08 -0.81 0.00 0.00 175.30 174.89 1igw s THR 233 N -0.53 2.44 -1.43 4.11 -1.32 0.12 -2.31 115.64 116.73 1igw s THR 233 Ca 0.09 -0.92 0.17 0.00 -1.21 0.00 0.00 61.69 59.82 1igw s THR 233 Cb -0.12 -1.94 0.48 0.00 -1.51 0.00 0.00 72.50 69.41 1igw s THR 233 CO 0.02 0.56 1.40 0.47 -2.21 0.00 0.00 174.62 174.86 1igw n ASP 234 N 3.00 3.46 0.08 8.08 9.92 -1.26 -2.40 116.55 137.43 1igw n ASP 234 Ca -0.18 -2.01 0.06 0.00 -0.53 0.00 0.00 54.79 52.14 1igw n ASP 234 Cb 0.52 -0.36 0.31 0.00 -0.64 0.00 0.00 41.12 40.95 1igw n ASP 234 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1igw n ALA 235 N 1.07 1.17 0.06 2.24 0.00 -1.26 -2.34 120.51 121.46 1igw n ALA 235 Ca 0.18 0.08 -0.04 0.00 0.00 0.00 0.00 53.44 53.66 1igw n ALA 235 Cb 0.53 -1.19 0.18 0.00 0.00 0.00 0.00 19.45 18.97 1igw n ALA 235 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1igw h ASP 236 N 0.00 0.35 -0.00 0.00 -0.00 -1.83 -3.29 116.42 111.65 1igw h ASP 236 Ca 0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 57.03 56.87 1igw h ASP 236 Cb 0.07 -0.10 0.00 0.00 -0.00 0.00 0.00 39.33 39.30 1igw h ASP 236 CO 0.00 0.74 -0.19 0.00 -0.00 0.00 0.00 179.24 179.79 1igw n ALA 237 N -2.48 2.71 -2.63 -0.78 0.00 -1.04 -2.33 120.51 113.97 1igw n ALA 237 Ca -0.02 -0.32 -0.42 0.00 0.00 0.00 0.00 53.44 52.68 1igw n ALA 237 Cb 0.50 -0.24 -0.05 0.00 0.00 0.00 0.00 19.45 19.66 1igw n ALA 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1igw s ALA 238 N -1.24 3.58 -0.20 0.00 0.00 -0.99 -4.71 121.76 118.21 1igw s ALA 238 Ca 0.05 -0.31 0.16 0.00 0.00 0.00 0.00 51.96 51.85 1igw s ALA 238 Cb 0.05 -3.28 0.60 0.00 0.00 0.00 0.00 23.12 20.49 1igw s ALA 238 CO 0.20 -1.08 1.51 -0.40 0.00 0.00 0.00 175.76 175.99 1igw n ASP 239 N 6.11 4.28 -4.08 0.00 5.68 -1.25 -4.43 116.55 122.85 1igw n ASP 239 Ca 0.04 -3.03 -0.19 0.00 -0.50 0.00 0.00 54.79 51.11 1igw n ASP 239 Cb 0.48 -0.59 -0.14 0.00 -1.14 0.00 0.00 41.12 39.74 1igw n ASP 239 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1igw s LEU 240 N -2.84 2.11 0.06 -2.12 1.43 -1.24 -0.02 118.68 116.06 1igw s LEU 240 Ca 0.45 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 1igw s LEU 240 Cb 0.36 -0.51 -0.03 0.00 0.03 0.00 0.00 46.19 46.05 1igw s LEU 240 CO 0.10 0.05 -0.10 -0.51 0.23 0.00 0.00 176.35 176.11 1igw s ILE 241 N -0.62 0.80 0.23 -0.59 2.07 0.16 -1.07 121.20 122.18 1igw s ILE 241 Ca 0.01 -1.25 0.07 0.00 -1.41 0.00 0.00 60.65 58.08 1igw s ILE 241 Cb -0.06 -0.89 -0.07 0.00 0.13 0.00 0.00 42.46 41.57 1igw s ILE 241 CO 0.00 -0.35 1.53 0.71 -1.91 0.00 0.00 174.94 174.92 1igw h THR 242 N 4.28 1.46 -3.17 4.00 1.35 -1.30 -1.25 112.91 118.29 1igw h THR 242 Ca -0.38 -2.28 -0.03 0.00 -0.55 0.00 0.00 66.41 63.17 1igw h THR 242 Cb 1.20 2.22 -0.12 0.00 -1.73 0.00 0.00 68.15 69.72 1igw h THR 242 CO 0.42 0.66 0.09 -0.55 -0.25 0.00 0.00 175.52 175.90 1igw s SER 243 N -6.86 -0.42 -0.15 5.36 0.15 -1.26 -4.62 113.70 105.90 1igw s SER 243 Ca -0.02 -0.16 0.16 0.00 0.70 0.00 0.00 55.95 56.63 1igw s SER 243 Cb 0.12 0.55 0.68 0.00 -1.71 0.00 0.00 66.02 65.66 1igw s SER 243 CO 0.79 -0.94 1.60 -0.90 1.20 0.00 0.00 173.24 174.99 1igw n ASP 244 N -0.32 4.73 0.26 5.45 5.75 -1.26 -4.60 116.55 126.56 1igw n ASP 244 Ca -0.16 -2.66 0.16 0.00 -0.01 0.00 0.00 54.79 52.12 1igw n ASP 244 Cb 0.64 -0.57 0.88 0.00 -1.03 0.00 0.00 41.12 41.04 1igw n ASP 244 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1igw s ASP 246 N -6.01 6.26 0.34 0.00 -1.08 -1.26 -4.95 116.67 109.97 1igw s ASP 246 Ca -0.05 0.24 0.07 0.00 -0.52 0.00 0.00 52.55 52.29 1igw s ASP 246 Cb 0.15 -2.22 0.76 0.00 -1.46 0.00 0.00 42.92 40.16 1igw s ASP 246 CO 0.55 -0.22 1.87 -0.65 0.52 0.00 0.00 175.17 177.23 1igw h PRO 247 N 8.21 0.73 -0.31 4.34 0.11 -2.01 -0.64 132.00 142.43 1igw h PRO 247 Ca -0.31 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.84 1igw h PRO 247 Cb 1.16 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1igw h PRO 247 CO 0.66 0.49 0.31 -0.92 -0.21 0.00 0.00 178.00 178.32 1igw h TYR 248 N 0.76 0.00 -0.00 0.65 3.20 -1.96 -0.96 116.97 118.66 1igw h TYR 248 Ca 0.45 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.32 1igw h TYR 248 Cb 0.65 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.92 1igw h TYR 248 CO -0.00 0.00 -0.66 -0.25 -1.64 0.00 0.00 178.16 175.61 1igw n ASP 249 N -3.89 0.70 -0.33 -2.11 8.00 -0.25 -4.57 116.55 114.10 1igw n ASP 249 Ca 0.05 -0.53 0.22 0.00 0.71 0.00 0.00 54.79 55.24 1igw n ASP 249 Cb 0.46 0.50 0.44 0.00 -0.02 0.00 0.00 41.12 42.50 1igw n ASP 249 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1igw h SER 250 N 0.06 0.46 0.55 -2.24 4.64 -1.20 -0.91 113.55 114.91 1igw h SER 250 Ca 0.00 0.19 -0.01 0.00 -0.47 0.00 0.00 61.79 61.50 1igw h SER 250 Cb 0.50 0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1igw h SER 250 CO 0.00 -0.12 -0.04 1.05 -0.87 0.00 0.00 176.83 176.86 1igw h GLU 251 N 0.33 0.00 0.00 4.77 4.11 -1.80 -2.48 114.58 119.51 1igw h GLU 251 Ca 0.70 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.13 1igw h GLU 251 Cb 1.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.81 1igw h GLU 251 CO -0.60 0.04 -0.91 1.19 0.07 0.00 0.00 179.01 178.79 1igw n PHE 252 N -3.22 0.15 -2.74 2.06 3.01 -0.35 -4.85 117.46 111.53 1igw n PHE 252 Ca -0.01 0.04 -0.43 0.00 1.01 0.00 0.00 57.45 58.07 1igw n PHE 252 Cb 0.22 -0.31 -0.03 0.00 -0.01 0.00 0.00 39.48 39.35 1igw n PHE 252 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1igw s ILE 253 N -3.12 4.59 0.15 4.37 1.01 -0.93 -0.38 121.20 126.87 1igw s ILE 253 Ca 0.06 1.52 -0.02 0.00 0.00 0.00 0.00 60.65 62.22 1igw s ILE 253 Cb 0.15 -4.34 -0.16 0.00 0.01 0.00 0.00 42.46 38.12 1igw s ILE 253 CO 0.79 -0.44 1.34 0.71 0.00 0.00 0.00 174.94 177.35 1igw h THR 254 N 5.72 1.43 0.00 2.92 1.35 -1.78 -3.48 112.91 119.06 1igw h THR 254 Ca -0.22 -2.47 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 1igw h THR 254 Cb 1.07 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.89 1igw h THR 254 CO 0.99 0.73 0.00 0.61 -0.25 0.00 0.00 175.52 177.60 1igw n GLY 255 N 0.88 2.43 3.76 5.82 0.00 -1.26 -5.09 105.19 111.74 1igw n GLY 255 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 1igw n GLY 255 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1igw s GLU 256 N -0.17 3.52 0.02 1.61 0.41 -1.26 -4.93 118.70 117.89 1igw s GLU 256 Ca 0.00 2.00 0.03 0.00 -0.41 0.00 0.00 54.97 56.59 1igw s GLU 256 Cb 0.00 -2.37 -0.02 0.00 -1.78 0.00 0.00 34.13 29.96 1igw s GLU 256 CO 0.00 -0.81 -0.10 0.50 -0.49 0.00 0.00 175.26 174.35 1igw s ARG 257 N -2.75 0.74 0.73 1.61 3.52 -1.26 -1.78 118.95 119.76 1igw s ARG 257 Ca 0.66 -0.55 -0.01 0.00 -0.13 0.00 0.00 55.73 55.70 1igw s ARG 257 Cb -0.34 -0.69 0.13 0.00 -1.56 0.00 0.00 34.95 32.49 1igw s ARG 257 CO 0.41 0.17 1.01 0.95 -0.81 0.00 0.00 175.30 177.04 1igw s THR 258 N -0.66 2.11 0.38 4.11 -4.23 0.16 -4.93 115.64 112.58 1igw s THR 258 Ca 0.00 -0.58 0.26 0.00 -1.18 0.00 0.00 61.69 60.19 1igw s THR 258 Cb -0.06 -2.52 0.28 0.00 1.34 0.00 0.00 72.50 71.53 1igw s THR 258 CO 0.00 0.00 2.03 0.77 -0.54 0.00 0.00 174.62 176.88 1igw h SER 259 N -0.57 0.00 1.00 3.99 4.64 -2.02 -1.08 113.55 119.51 1igw h SER 259 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1igw h SER 259 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1igw h SER 259 CO 0.39 0.14 -0.18 -0.62 -0.87 0.00 0.00 176.83 175.70 1igw n GLU 260 N -3.64 0.10 -0.15 4.77 4.71 -1.26 -4.90 120.64 120.27 1igw n GLU 260 Ca -0.02 0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 1igw n GLU 260 Cb 0.27 -1.60 0.00 0.00 -1.01 0.00 0.00 31.44 29.10 1igw n GLU 260 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1igw n GLY 261 N 1.43 0.87 3.85 0.62 0.00 -0.41 -5.07 105.19 106.48 1igw n GLY 261 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1igw n GLY 261 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1igw s PHE 262 N -2.05 3.45 -0.16 1.61 2.99 -1.26 -4.72 117.98 117.84 1igw s PHE 262 Ca 0.00 1.36 -0.08 0.00 0.00 0.00 0.00 56.93 58.21 1igw s PHE 262 Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 43.02 40.28 1igw s PHE 262 CO 0.00 -0.28 0.10 -0.06 -0.00 0.00 0.00 175.22 174.98 1igw s PHE 263 N -2.53 3.40 0.43 0.36 0.40 -0.47 0.39 117.98 119.96 1igw s PHE 263 Ca 0.57 0.31 -0.23 0.00 -0.60 0.00 0.00 56.93 56.98 1igw s PHE 263 Cb -0.10 -2.03 -0.09 0.00 0.51 0.00 0.00 43.02 41.31 1igw s PHE 263 CO 0.30 0.41 1.06 1.03 0.70 0.00 0.00 175.22 178.72 1igw s ARG 264 N -0.19 4.03 0.22 0.44 0.52 -0.74 -0.66 118.95 122.57 1igw s ARG 264 Ca 0.09 1.50 0.01 0.00 -0.52 0.00 0.00 55.73 56.82 1igw s ARG 264 Cb -0.12 -2.42 -0.05 0.00 0.52 0.00 0.00 34.95 32.89 1igw s ARG 264 CO 0.01 -0.26 0.06 0.95 0.02 0.00 0.00 175.30 176.08 1igw s THR 265 N -1.72 0.58 -0.60 0.02 -4.23 0.97 -2.49 115.64 108.16 1igw s THR 265 Ca 0.61 -1.99 -0.22 0.00 -1.18 0.00 0.00 61.69 58.91 1igw s THR 265 Cb -0.21 -2.42 0.07 0.00 1.34 0.00 0.00 72.50 71.28 1igw s THR 265 CO 0.26 -0.20 0.86 -1.00 -0.54 0.00 0.00 174.62 174.01 1igw s HIS 266 N -3.73 2.81 0.60 3.99 3.76 0.48 -4.66 115.29 118.54 1igw s HIS 266 Ca 0.32 -0.52 -0.12 0.00 -0.15 0.00 0.00 55.06 54.59 1igw s HIS 266 Cb 0.07 -4.08 -0.05 0.00 1.11 0.00 0.00 32.58 29.63 1igw s HIS 266 CO 0.10 -1.44 1.02 0.00 -0.85 0.00 0.00 174.74 173.57 1igw s ALA 267 N 3.58 3.10 0.00 -1.40 0.00 -1.26 -4.54 121.76 121.24 1igw s ALA 267 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.12 1igw s ALA 267 Cb -0.18 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1igw s ALA 267 CO 0.11 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.68 1igw n GLY 268 N -2.53 0.49 0.26 0.00 0.00 -0.98 -4.87 105.19 97.56 1igw n GLY 268 Ca 0.06 -1.86 0.07 0.00 0.00 0.00 0.00 46.02 44.30 1igw n GLY 268 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1igw h ILE 269 N 0.00 1.02 -0.55 -0.61 2.10 -1.88 -0.33 117.51 117.26 1igw h ILE 269 Ca 0.00 -0.10 -0.09 0.00 1.08 0.00 0.00 64.86 65.75 1igw h ILE 269 Cb 0.00 1.04 -0.02 0.00 -1.09 0.00 0.00 36.82 36.75 1igw h ILE 269 CO 0.00 0.03 -0.01 -0.33 -1.08 0.00 0.00 178.15 176.76 1igw h GLU 270 N 0.01 0.94 -0.48 2.19 5.08 -1.93 0.18 114.58 120.57 1igw h GLU 270 Ca 0.00 -0.28 -0.10 0.00 -1.00 0.00 0.00 59.36 57.98 1igw h GLU 270 Cb 0.05 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1igw h GLU 270 CO 0.00 0.93 -0.10 0.37 -1.00 0.00 0.00 179.01 179.22 1igw h GLN 271 N 0.86 0.92 -0.84 2.33 4.15 -1.31 -2.64 115.11 118.57 1igw h GLN 271 Ca 0.16 -0.34 -0.01 0.00 0.77 0.00 0.00 58.65 59.22 1igw h GLN 271 Cb 0.52 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.11 1igw h GLN 271 CO 0.03 1.00 0.48 0.00 -1.93 0.00 0.00 178.83 178.40 1igw h ALA 272 N 0.89 1.26 -0.55 3.38 0.00 -1.08 -2.61 119.26 120.54 1igw h ALA 272 Ca 0.12 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1igw h ALA 272 Cb 0.65 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1igw h ALA 272 CO 0.04 0.61 -0.02 0.82 0.00 0.00 0.00 179.25 180.71 1igw h ILE 273 N 1.17 1.27 -0.21 0.00 2.04 -0.56 0.10 117.51 121.33 1igw h ILE 273 Ca 0.30 -1.14 -0.09 0.00 1.00 0.00 0.00 64.86 64.93 1igw h ILE 273 Cb -0.01 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1igw h ILE 273 CO -0.05 0.41 -0.27 0.77 0.00 0.00 0.00 178.15 179.00 1igw h SER 274 N 0.87 0.40 -0.18 1.72 4.64 -1.12 -0.86 113.55 119.02 1igw h SER 274 Ca 0.15 -0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.26 1igw h SER 274 Cb 0.56 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1igw h SER 274 CO 0.03 0.67 -0.19 0.03 -0.87 0.00 0.00 176.83 176.50 1igw h ARG 275 N 0.35 0.44 -0.60 4.77 2.47 -1.13 -2.01 114.38 118.67 1igw h ARG 275 Ca 0.05 -0.24 0.10 0.00 -1.26 0.00 0.00 59.98 58.63 1igw h ARG 275 Cb 0.66 0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.92 1igw h ARG 275 CO 0.05 0.81 0.20 0.78 0.56 0.00 0.00 179.97 182.37 1igw h GLY 276 N 0.10 0.81 1.01 0.04 0.00 -0.59 0.07 103.07 104.51 1igw h GLY 276 Ca 0.03 -0.09 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 1igw h GLY 276 CO 0.05 -0.04 -0.03 1.41 0.00 0.00 0.00 176.54 177.93 1igw h LEU 277 N 0.36 0.87 -0.89 3.11 3.38 -1.16 -1.61 115.31 119.36 1igw h LEU 277 Ca 0.30 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1igw h LEU 277 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1igw h LEU 277 CO -0.33 0.98 -0.05 0.00 0.09 0.00 0.00 178.44 179.13 1igw h ALA 278 N 0.92 1.07 0.00 1.53 0.00 -0.54 -3.20 119.26 119.04 1igw h ALA 278 Ca 0.13 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1igw h ALA 278 Cb 0.55 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1igw h ALA 278 CO 0.03 0.58 -0.64 1.88 0.00 0.00 0.00 179.25 181.10 1igw h TYR 279 N 0.71 0.00 -0.91 0.00 0.99 -0.88 -3.40 116.97 113.48 1igw h TYR 279 Ca 0.13 0.00 0.13 0.00 2.00 0.00 0.00 58.73 60.99 1igw h TYR 279 Cb 0.51 0.00 -0.14 0.00 1.00 0.00 0.00 36.73 38.10 1igw h TYR 279 CO 0.03 0.47 -0.40 0.00 -0.00 0.00 0.00 178.16 178.25 1igw n ALA 280 N -2.24 -0.23 0.34 3.88 0.00 -0.62 -0.72 120.51 120.91 1igw n ALA 280 Ca 0.00 0.88 0.08 0.00 0.00 0.00 0.00 53.44 54.40 1igw n ALA 280 Cb 0.73 -0.34 0.35 0.00 0.00 0.00 0.00 19.45 20.20 1igw n ALA 280 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1igw n PRO 281 N -5.29 0.08 0.00 0.00 -0.04 -1.26 -2.81 135.00 125.68 1igw n PRO 281 Ca 0.07 0.40 0.07 0.00 -0.04 0.00 0.00 63.50 64.00 1igw n PRO 281 Cb 0.33 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 1igw n PRO 281 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1igw n TYR 282 N -1.83 0.00 -4.30 0.54 4.02 0.10 0.16 117.16 115.85 1igw n TYR 282 Ca 0.02 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.71 1igw n TYR 282 Cb 0.14 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.35 1igw n TYR 282 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1igw s ALA 283 N -1.72 1.80 0.04 -0.72 0.00 -1.10 -4.88 121.76 115.19 1igw s ALA 283 Ca 0.13 -1.45 0.05 0.00 0.00 0.00 0.00 51.96 50.69 1igw s ALA 283 Cb 0.12 -0.12 -0.24 0.00 0.00 0.00 0.00 23.12 22.89 1igw s ALA 283 CO 0.35 0.14 0.99 -0.44 0.00 0.00 0.00 175.76 176.80 1igw h ASP 284 N 3.19 0.12 -4.57 0.00 3.32 -0.98 -3.47 116.42 114.03 1igw h ASP 284 Ca -0.40 -0.16 -0.28 0.00 0.02 0.00 0.00 57.03 56.21 1igw h ASP 284 Cb 1.20 -0.04 -0.23 0.00 0.22 0.00 0.00 39.33 40.49 1igw h ASP 284 CO 0.53 1.13 -0.74 -0.76 -1.72 0.00 0.00 179.24 177.69 1igw s LEU 285 N -6.62 2.20 -0.08 1.55 1.02 -1.00 -4.32 118.68 111.43 1igw s LEU 285 Ca -0.03 -0.44 0.04 0.00 0.02 0.00 0.00 54.13 53.71 1igw s LEU 285 Cb 0.08 -0.17 -0.01 0.00 0.02 0.00 0.00 46.19 46.11 1igw s LEU 285 CO 0.83 -0.15 -0.19 -0.69 0.02 0.00 0.00 176.35 176.18 1igw s VAL 286 N -1.09 2.60 -0.11 -1.59 1.01 -0.97 -1.15 120.40 119.12 1igw s VAL 286 Ca -0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1igw s VAL 286 Cb -0.08 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.32 1igw s VAL 286 CO 0.00 0.56 -0.02 0.86 0.00 0.00 0.00 175.10 176.51 1igw s TRP 287 N -0.12 0.99 -0.47 5.22 -0.00 0.11 -1.46 118.94 123.21 1igw s TRP 287 Ca -0.03 -0.47 -0.12 0.00 -0.00 0.00 0.00 56.10 55.48 1igw s TRP 287 Cb -0.14 -0.98 0.10 0.00 -0.00 0.00 0.00 33.47 32.45 1igw s TRP 287 CO 0.04 -0.43 0.36 0.00 -0.00 0.00 0.00 176.95 176.92 1igw n GLU 289 N 5.06 2.57 -4.01 0.00 0.00 -1.01 -4.76 120.64 118.50 1igw n GLU 289 Ca -0.11 0.91 -0.10 0.00 0.00 0.00 0.00 57.16 57.86 1igw n GLU 289 Cb 0.42 -2.63 -0.07 0.00 0.00 0.00 0.00 31.44 29.16 1igw n GLU 289 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 1igw s THR 290 N -0.64 0.05 -0.09 6.31 -4.23 -1.26 -4.78 115.64 110.99 1igw s THR 290 Ca 0.58 -1.49 0.09 0.00 -1.18 0.00 0.00 61.69 59.69 1igw s THR 290 Cb -0.51 -2.00 -0.12 0.00 1.34 0.00 0.00 72.50 71.21 1igw s THR 290 CO 0.57 -0.21 0.04 -1.54 -0.54 0.00 0.00 174.62 172.94 1igw n SER 291 N -0.25 2.56 -4.18 3.99 3.41 -1.26 -4.76 113.62 113.13 1igw n SER 291 Ca -0.05 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.30 1igw n SER 291 Cb 0.63 0.78 -0.16 0.00 -0.26 0.00 0.00 64.21 65.20 1igw n SER 291 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1igw s THR 292 N -2.26 1.49 -0.02 6.66 -4.23 -1.26 -5.04 115.64 110.98 1igw s THR 292 Ca -0.05 -0.80 -0.30 0.00 -1.18 0.00 0.00 61.69 59.37 1igw s THR 292 Cb 0.03 -1.25 -0.08 0.00 1.34 0.00 0.00 72.50 72.54 1igw s THR 292 CO 0.41 0.42 2.04 -2.16 -0.54 0.00 0.00 174.62 174.79 1igw s PRO 293 N -0.36 3.89 -0.33 3.99 0.04 -1.26 -4.93 135.00 136.04 1igw s PRO 293 Ca 0.05 2.48 0.01 0.00 0.04 0.00 0.00 61.00 63.58 1igw s PRO 293 Cb -0.08 -4.22 0.14 0.00 0.04 0.00 0.00 34.50 30.38 1igw s PRO 293 CO -0.00 -1.24 0.29 0.34 0.04 0.00 0.00 177.00 176.43 1igw s ASP 294 N 5.41 1.97 0.27 6.66 -1.08 -1.26 -5.03 116.67 123.61 1igw s ASP 294 Ca 0.92 -1.44 0.00 0.00 -0.52 0.00 0.00 52.55 51.51 1igw s ASP 294 Cb -0.40 0.24 0.55 0.00 -1.46 0.00 0.00 42.92 41.84 1igw s ASP 294 CO 0.40 -0.33 1.80 -0.07 0.52 0.00 0.00 175.17 177.50 1igw h LEU 295 N 7.55 0.76 -0.85 -1.34 3.38 -1.98 -0.81 115.31 122.01 1igw h LEU 295 Ca -0.03 0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1igw h LEU 295 Cb 1.04 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1igw h LEU 295 CO 0.28 0.37 -0.04 -0.08 0.09 0.00 0.00 178.44 179.06 1igw h GLU 296 N 0.83 0.81 -0.50 1.13 4.57 -1.98 0.28 114.58 119.71 1igw h GLU 296 Ca 0.48 -0.24 -0.09 0.00 -1.18 0.00 0.00 59.36 58.33 1igw h GLU 296 Cb 0.57 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 1igw h GLU 296 CO -0.30 0.84 -0.05 1.25 -1.18 0.00 0.00 179.01 179.57 1igw h LEU 297 N 0.75 0.91 -0.58 1.64 5.85 -1.83 0.12 115.31 122.18 1igw h LEU 297 Ca 0.14 -0.33 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1igw h LEU 297 Cb 0.51 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1igw h LEU 297 CO 0.03 1.03 0.29 0.00 -0.34 0.00 0.00 178.44 179.45 1igw h ALA 298 N 0.92 0.74 -0.71 1.25 0.00 -0.60 -0.43 119.26 120.43 1igw h ALA 298 Ca 0.14 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1igw h ALA 298 Cb 0.59 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1igw h ALA 298 CO 0.04 0.29 0.20 -0.09 0.00 0.00 0.00 179.25 179.69 1igw h ARG 299 N 0.78 1.11 -0.10 0.00 2.43 -0.20 -1.53 114.38 116.87 1igw h ARG 299 Ca 0.20 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1igw h ARG 299 Cb 0.10 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1igw h ARG 299 CO -0.03 0.96 -0.00 -0.09 -1.51 0.00 0.00 179.97 179.30 1igw h ARG 300 N 1.06 0.18 -0.61 0.20 2.43 -0.12 -0.38 114.38 117.15 1igw h ARG 300 Ca 0.23 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.38 1igw h ARG 300 Cb 0.32 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.81 1igw h ARG 300 CO -0.00 0.44 0.34 0.35 -1.51 0.00 0.00 179.97 179.59 1igw h PHE 301 N -0.10 0.63 -0.22 2.20 3.57 -1.01 -1.86 116.94 120.14 1igw h PHE 301 Ca 0.03 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1igw h PHE 301 Cb 0.37 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1igw h PHE 301 CO 0.04 0.33 0.07 0.00 -2.23 0.00 0.00 178.31 176.51 1igw h ALA 302 N 1.30 0.29 -0.99 2.41 0.00 -1.18 -1.73 119.26 119.36 1igw h ALA 302 Ca 0.26 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1igw h ALA 302 Cb 0.12 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1igw h ALA 302 CO -0.15 -0.08 0.65 1.96 0.00 0.00 0.00 179.25 181.63 1igw h GLN 303 N 0.19 1.22 -0.42 0.00 4.20 -0.87 -0.18 115.11 119.26 1igw h GLN 303 Ca 0.07 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 1igw h GLN 303 Cb 0.24 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1igw h GLN 303 CO -0.00 0.81 0.08 0.00 -0.67 0.00 0.00 178.83 179.05 1igw h ALA 304 N 1.42 0.55 0.12 3.87 0.00 -1.02 0.02 119.26 124.23 1igw h ALA 304 Ca 0.40 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1igw h ALA 304 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1igw h ALA 304 CO -0.12 0.25 -0.06 0.82 0.00 0.00 0.00 179.25 180.14 1igw h ILE 305 N 0.54 1.03 0.00 0.00 1.08 -1.02 -3.06 117.51 116.09 1igw h ILE 305 Ca 0.13 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 1igw h ILE 305 Cb 0.35 1.43 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1igw h ILE 305 CO 0.01 0.15 0.00 0.45 -0.69 0.00 0.00 178.15 178.07 1igw h HIS 306 N -0.46 0.00 -0.06 1.37 3.86 -0.92 0.26 115.15 119.20 1igw h HIS 306 Ca -0.02 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.13 1igw h HIS 306 Cb 0.37 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.83 1igw h HIS 306 CO 0.02 0.00 -0.26 0.00 0.86 0.00 0.00 177.93 178.55 1igw h ALA 307 N 2.03 1.45 0.00 2.45 0.00 -0.87 -2.76 119.26 121.56 1igw h ALA 307 Ca 0.00 -0.27 -0.29 0.00 0.00 0.00 0.00 54.91 54.35 1igw h ALA 307 Cb 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1igw h ALA 307 CO 0.00 0.40 -2.08 1.63 0.00 0.00 0.00 179.25 179.20 1igw n LYS 308 N -4.19 1.29 -3.64 0.00 4.76 -0.77 -4.79 118.16 110.82 1igw n LYS 308 Ca -0.02 0.01 -0.27 0.00 -2.87 0.00 0.00 58.31 55.16 1igw n LYS 308 Cb 0.34 -1.40 -0.11 0.00 -1.84 0.00 0.00 35.03 32.02 1igw n LYS 308 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1igw n TYR 309 N -2.66 1.40 -2.12 2.13 4.02 0.84 -5.10 117.16 115.67 1igw n TYR 309 Ca -0.27 -3.86 -0.41 0.00 -0.01 0.00 0.00 57.90 53.35 1igw n TYR 309 Cb 0.98 -0.24 -0.03 0.00 -0.02 0.00 0.00 39.34 40.04 1igw n TYR 309 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1igw s PRO 310 N -0.88 4.34 0.00 -0.72 0.04 -1.04 -2.39 135.00 134.36 1igw s PRO 310 Ca 0.29 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1igw s PRO 310 Cb 0.01 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.42 1igw s PRO 310 CO -0.17 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 176.99 1igw n GLY 311 N 1.89 3.34 3.68 0.56 0.00 -1.26 -5.01 105.19 108.38 1igw n GLY 311 Ca 0.05 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.50 1igw n GLY 311 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1igw n LYS 312 N -2.00 1.09 -2.46 1.61 3.00 -1.00 -4.91 118.16 113.50 1igw n LYS 312 Ca 0.00 0.40 -0.38 0.00 -0.00 0.00 0.00 58.31 58.33 1igw n LYS 312 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 35.03 32.93 1igw n LYS 312 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1igw s LEU 313 N 2.65 4.27 0.19 3.14 1.43 -1.26 -4.95 118.68 124.15 1igw s LEU 313 Ca 0.95 2.18 0.09 0.00 -1.03 0.00 0.00 54.13 56.32 1igw s LEU 313 Cb -1.06 -3.98 -0.04 0.00 0.03 0.00 0.00 46.19 41.13 1igw s LEU 313 CO 0.61 -0.44 -0.19 -0.76 0.23 0.00 0.00 176.35 175.80 1igw s LEU 314 N -2.26 2.47 0.06 1.79 1.43 -0.90 -2.28 118.68 118.99 1igw s LEU 314 Ca 0.54 -0.91 0.08 0.00 -1.03 0.00 0.00 54.13 52.81 1igw s LEU 314 Cb -0.27 -0.91 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 1igw s LEU 314 CO 0.34 -0.01 -0.18 0.00 0.23 0.00 0.00 176.35 176.72 1igw s ALA 315 N -2.17 2.60 -0.20 4.21 0.00 -0.53 -2.64 121.76 123.03 1igw s ALA 315 Ca 0.19 -1.23 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 1igw s ALA 315 Cb -0.05 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.41 1igw s ALA 315 CO 0.08 0.57 -0.01 -0.47 0.00 0.00 0.00 175.76 175.93 1igw s TYR 316 N -0.96 1.61 -0.03 0.00 5.04 0.32 -4.39 117.35 118.94 1igw s TYR 316 Ca 0.15 -1.17 -0.30 0.00 -2.44 0.00 0.00 57.07 53.31 1igw s TYR 316 Cb -0.10 -1.26 -0.05 0.00 0.35 0.00 0.00 41.96 40.90 1igw s TYR 316 CO 0.06 -0.66 1.36 1.21 -1.34 0.00 0.00 175.55 176.19 1igw s ASN 317 N 1.66 6.89 0.08 4.32 3.84 -1.26 -2.09 114.94 128.38 1igw s ASN 317 Ca -0.02 2.03 0.01 0.00 0.21 0.00 0.00 52.86 55.09 1igw s ASN 317 Cb -0.17 -2.56 0.01 0.00 -0.55 0.00 0.00 41.25 37.98 1igw s ASN 317 CO -0.07 -0.71 0.07 0.00 -2.79 0.00 0.00 177.10 173.60 1igw n SER 335 N -2.13 0.00 -0.00 0.00 3.41 -1.26 -4.81 113.62 108.83 1igw n SER 335 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1igw n SER 335 Cb 0.09 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 1igw n SER 335 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1igw h PHE 336 N 0.00 -0.92 -0.66 7.33 3.04 -2.06 -2.75 116.94 120.92 1igw h PHE 336 Ca 0.00 0.03 0.10 0.00 3.98 0.00 0.00 57.97 62.08 1igw h PHE 336 Cb 0.00 0.41 -0.04 0.00 2.56 0.00 0.00 35.95 38.88 1igw h PHE 336 CO 0.00 -0.31 0.44 1.96 -2.02 0.00 0.00 178.31 178.38 1igw h GLN 337 N -0.33 0.49 -0.34 1.11 4.20 -2.01 -2.77 115.11 115.47 1igw h GLN 337 Ca 0.02 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.53 1igw h GLN 337 Cb 0.39 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1igw h GLN 337 CO -0.24 0.33 -0.43 0.37 -0.67 0.00 0.00 178.83 178.18 1igw h GLN 338 N 0.51 0.87 -0.45 1.46 5.75 -1.92 -0.95 115.11 120.39 1igw h GLN 338 Ca 0.30 -0.48 -0.09 0.00 -0.15 0.00 0.00 58.65 58.23 1igw h GLN 338 Cb 0.51 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.07 1igw h GLN 338 CO -0.09 1.12 -0.07 1.96 -2.65 0.00 0.00 178.83 179.10 1igw h GLN 339 N 0.70 0.84 -0.33 1.69 4.20 -1.32 0.12 115.11 121.00 1igw h GLN 339 Ca 0.05 -0.30 0.05 0.00 0.06 0.00 0.00 58.65 58.50 1igw h GLN 339 Cb 1.02 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.69 1igw h GLN 339 CO 0.10 0.93 0.06 -0.07 -0.67 0.00 0.00 178.83 179.18 1igw h LEU 340 N 0.67 0.01 -0.64 1.46 3.38 -1.48 0.20 115.31 118.92 1igw h LEU 340 Ca 0.12 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.19 1igw h LEU 340 Cb 0.60 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.38 1igw h LEU 340 CO 0.04 0.04 0.37 -1.28 0.09 0.00 0.00 178.44 177.69 1igw h SER 341 N 0.18 0.56 -0.34 -0.43 0.87 -0.89 0.11 113.55 113.61 1igw h SER 341 Ca 0.16 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.73 1igw h SER 341 Cb 0.18 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 1igw h SER 341 CO -0.21 0.37 0.20 0.44 -0.53 0.00 0.00 176.83 177.11 1igw h ASP 342 N 0.69 0.44 0.93 6.23 3.32 0.10 -1.05 116.42 127.09 1igw h ASP 342 Ca 0.28 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1igw h ASP 342 Cb 0.12 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1igw h ASP 342 CO -0.15 0.35 0.00 0.23 -1.72 0.00 0.00 179.24 177.95 1igw n MET 343 N -4.44 0.10 0.00 3.56 2.81 0.52 -4.88 117.12 114.80 1igw n MET 343 Ca 0.02 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 56.12 1igw n MET 343 Cb 0.09 -1.65 0.00 0.00 -0.71 0.00 0.00 33.22 30.95 1igw n MET 343 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1igw n GLY 344 N 0.76 1.20 3.44 3.03 0.00 -0.40 -4.91 105.19 108.32 1igw n GLY 344 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1igw n GLY 344 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1igw n TYR 345 N -0.05 4.56 0.52 1.61 4.02 -0.31 -2.11 117.16 125.41 1igw n TYR 345 Ca 0.00 -2.97 0.13 0.00 -0.01 0.00 0.00 57.90 55.04 1igw n TYR 345 Cb 0.00 -2.50 0.32 0.00 -0.02 0.00 0.00 39.34 37.13 1igw n TYR 345 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1igw h LYS 346 N 7.24 0.00 -4.55 -0.72 1.79 -1.78 -3.31 116.57 115.24 1igw h LYS 346 Ca 0.43 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 58.26 1igw h LYS 346 Cb 0.84 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 31.10 1igw h LYS 346 CO 1.46 0.00 -0.77 0.12 -1.08 0.00 0.00 179.45 179.18 1igw s PHE 347 N -3.14 3.00 -0.01 -1.35 5.36 -1.19 -1.07 117.98 119.58 1igw s PHE 347 Ca 0.09 -2.28 0.06 0.00 -0.96 0.00 0.00 56.93 53.85 1igw s PHE 347 Cb 0.11 -2.06 -0.03 0.00 -0.34 0.00 0.00 43.02 40.70 1igw s PHE 347 CO 0.63 -0.86 -0.20 -0.65 -1.46 0.00 0.00 175.22 172.68 1igw s GLN 348 N 1.18 2.20 -0.06 10.12 -0.21 -0.29 -0.52 119.66 132.08 1igw s GLN 348 Ca -0.01 -0.88 -0.30 0.00 0.02 0.00 0.00 55.36 54.19 1igw s GLN 348 Cb -0.19 -2.18 0.09 0.00 1.00 0.00 0.00 33.01 31.73 1igw s GLN 348 CO -0.08 0.57 0.81 -0.59 -2.12 0.00 0.00 175.29 173.88 1igw s PHE 349 N -0.75 -0.51 -0.40 0.91 -0.12 -0.89 -0.47 117.98 115.76 1igw s PHE 349 Ca 0.12 0.76 -0.14 0.00 -0.05 0.00 0.00 56.93 57.61 1igw s PHE 349 Cb -0.10 0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.76 1igw s PHE 349 CO 0.01 -0.54 0.28 0.42 -0.05 0.00 0.00 175.22 175.35 1igw s ILE 350 N -1.68 5.16 0.24 -4.49 1.01 -0.92 -0.28 121.20 120.24 1igw s ILE 350 Ca -0.05 -0.63 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 1igw s ILE 350 Cb -0.00 -3.85 0.17 0.00 0.01 0.00 0.00 42.46 38.78 1igw s ILE 350 CO 0.02 -0.26 1.81 0.71 0.00 0.00 0.00 174.94 177.22 1igw h THR 351 N 5.65 1.25 -0.52 2.92 1.35 -1.89 -2.03 112.91 119.64 1igw h THR 351 Ca -0.27 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 1igw h THR 351 Cb 1.12 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 1igw h THR 351 CO 0.71 0.32 0.00 0.18 -0.25 0.00 0.00 175.52 176.48 1igw n LEU 352 N -4.28 5.26 -0.10 3.87 4.77 -1.26 -3.83 117.00 121.42 1igw n LEU 352 Ca 0.06 -2.90 -0.08 0.00 -0.03 0.00 0.00 56.01 53.06 1igw n LEU 352 Cb 0.19 -0.64 -0.01 0.00 -2.33 0.00 0.00 43.42 40.62 1igw n LEU 352 CO 0.40 0.66 1.01 0.00 -1.33 0.00 0.00 177.39 178.13 1igw h ALA 353 N 3.55 0.43 -0.60 -1.18 0.00 -1.78 -2.43 119.26 117.25 1igw h ALA 353 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1igw h ALA 353 Cb 1.82 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 1igw h ALA 353 CO 0.41 -0.11 0.34 0.78 0.00 0.00 0.00 179.25 180.67 1igw h GLY 354 N 0.45 0.86 1.41 0.00 0.00 -0.98 0.14 103.07 104.96 1igw h GLY 354 Ca 0.13 -0.25 -0.20 0.00 0.00 0.00 0.00 47.33 47.01 1igw h GLY 354 CO -0.03 0.18 -0.76 1.19 0.00 0.00 0.00 176.54 177.12 1igw h ILE 355 N 0.66 1.33 -0.46 2.60 2.10 -1.76 -0.95 117.51 121.05 1igw h ILE 355 Ca 0.26 -2.08 -0.04 0.00 1.08 0.00 0.00 64.86 64.08 1igw h ILE 355 Cb 0.10 2.06 -0.02 0.00 -1.09 0.00 0.00 36.82 37.87 1igw h ILE 355 CO -0.14 0.64 0.12 0.45 -1.08 0.00 0.00 178.15 178.14 1igw h HIS 356 N 0.39 0.75 -0.38 2.19 3.86 -1.21 -0.69 115.15 120.07 1igw h HIS 356 Ca -0.04 -0.09 0.04 0.00 -1.16 0.00 0.00 60.37 59.12 1igw h HIS 356 Cb 1.36 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 29.57 1igw h HIS 356 CO 0.06 0.69 0.14 1.03 0.86 0.00 0.00 177.93 180.71 1igw h SER 357 N 0.60 0.17 0.59 2.45 0.87 -0.62 -1.50 113.55 116.11 1igw h SER 357 Ca 0.14 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1igw h SER 357 Cb 0.30 0.02 0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1igw h SER 357 CO -0.00 0.13 -0.28 -0.03 -0.53 0.00 0.00 176.83 176.12 1igw h MET 358 N 0.30 -0.76 -0.78 2.24 -1.53 -0.89 -3.04 114.93 110.48 1igw h MET 358 Ca 0.17 0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.45 1igw h MET 358 Cb 0.14 0.17 -0.04 0.00 -0.55 0.00 0.00 31.60 31.32 1igw h MET 358 CO -0.16 -0.47 0.36 -1.49 0.14 0.00 0.00 176.91 175.28 1igw h TRP 359 N -1.16 1.12 0.63 1.39 4.06 -1.18 -1.68 115.95 119.13 1igw h TRP 359 Ca -0.08 -0.06 -0.03 0.00 2.06 0.00 0.00 58.89 60.78 1igw h TRP 359 Cb 0.64 -0.35 0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1igw h TRP 359 CO 0.00 0.82 -0.30 0.35 -3.56 0.00 0.00 178.44 175.75 1igw h PHE 360 N 1.11 -0.78 -0.21 0.49 3.57 -1.39 -1.10 116.94 118.62 1igw h PHE 360 Ca 0.27 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.76 1igw h PHE 360 Cb 0.13 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1igw h PHE 360 CO 0.01 -0.46 0.14 -0.91 -2.23 0.00 0.00 178.31 174.86 1igw h ASN 361 N -0.93 0.19 -0.34 0.41 2.35 -1.50 0.25 115.58 116.01 1igw h ASN 361 Ca -0.09 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.57 1igw h ASN 361 Cb 0.68 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1igw h ASN 361 CO 0.14 0.14 -0.12 -0.03 -1.65 0.00 0.00 177.43 175.91 1igw h MET 362 N 0.23 0.69 -0.08 0.81 4.05 -1.11 -2.01 114.93 117.51 1igw h MET 362 Ca 0.08 -0.28 -0.00 0.00 -0.28 0.00 0.00 59.70 59.22 1igw h MET 362 Cb 0.06 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.82 1igw h MET 362 CO -0.02 0.87 0.04 0.35 0.23 0.00 0.00 176.91 178.39 1igw h PHE 363 N 0.47 0.11 0.02 1.39 3.57 0.19 -0.88 116.94 121.81 1igw h PHE 363 Ca 0.08 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1igw h PHE 363 Cb 0.64 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 1igw h PHE 363 CO 0.05 0.18 -0.27 0.22 -2.23 0.00 0.00 178.31 176.26 1igw h ASP 364 N 0.02 -0.83 -0.33 0.41 3.58 -0.50 0.40 116.42 119.17 1igw h ASP 364 Ca 0.03 0.09 0.07 0.00 0.42 0.00 0.00 57.03 57.64 1igw h ASP 364 Cb 0.11 0.31 -0.08 0.00 1.72 0.00 0.00 39.33 41.39 1igw h ASP 364 CO -0.00 -0.27 -0.23 0.25 -2.88 0.00 0.00 179.24 176.10 1igw h LEU 365 N -0.36 -0.77 -0.84 2.28 6.46 -1.40 -2.50 115.31 118.18 1igw h LEU 365 Ca 0.00 0.15 -0.07 0.00 -0.12 0.00 0.00 57.88 57.84 1igw h LEU 365 Cb 0.37 0.38 -0.02 0.00 -0.73 0.00 0.00 40.66 40.66 1igw h LEU 365 CO -0.17 -0.26 0.05 0.00 -0.62 0.00 0.00 178.44 177.44 1igw h ALA 366 N 0.94 1.04 -0.22 1.25 0.00 -0.88 -1.47 119.26 119.92 1igw h ALA 366 Ca 0.17 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1igw h ALA 366 Cb 0.46 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1igw h ALA 366 CO -0.44 0.61 -0.09 -0.97 0.00 0.00 0.00 179.25 178.35 1igw h ASN 367 N 0.87 -0.31 -0.10 0.00 -1.24 0.24 -0.13 115.58 114.91 1igw h ASN 367 Ca 0.17 0.08 -0.02 0.00 0.71 0.00 0.00 56.30 57.24 1igw h ASN 367 Cb 0.43 0.18 -0.00 0.00 0.73 0.00 0.00 38.32 39.66 1igw h ASN 367 CO 0.02 -0.12 -0.01 0.00 -1.29 0.00 0.00 177.43 176.03 1igw h ALA 368 N 1.14 0.13 -0.59 1.57 0.00 -1.40 -3.25 119.26 116.86 1igw h ALA 368 Ca 0.12 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.93 1igw h ALA 368 Cb 0.23 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1igw h ALA 368 CO -0.26 -0.17 0.19 -0.92 0.00 0.00 0.00 179.25 178.10 1igw h TYR 369 N -0.12 0.33 -0.16 0.00 3.20 -1.05 -2.23 116.97 116.94 1igw h TYR 369 Ca 0.03 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.97 1igw h TYR 369 Cb 0.38 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1igw h TYR 369 CO 0.04 0.06 0.13 0.00 -1.64 0.00 0.00 178.16 176.75 1igw h ALA 370 N 1.43 2.03 -0.01 1.82 0.00 -1.05 -2.85 119.26 120.62 1igw h ALA 370 Ca 0.30 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.99 1igw h ALA 370 Cb 0.39 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1igw h ALA 370 CO -0.33 -0.21 -0.91 1.96 0.00 0.00 0.00 179.25 179.77 1igw h GLN 371 N 0.00 0.39 0.00 0.00 4.20 -1.47 -3.50 115.11 114.74 1igw h GLN 371 Ca 0.07 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.38 1igw h GLN 371 Cb 0.32 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1igw h GLN 371 CO -0.00 1.08 0.00 0.41 -0.67 0.00 0.00 178.83 179.65 1igw n GLY 372 N 0.89 1.44 3.47 3.46 0.00 -1.07 -5.02 105.19 108.35 1igw n GLY 372 Ca -0.06 -1.70 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 1igw n GLY 372 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1igw n GLU 373 N -1.74 -5.93 -0.34 1.61 1.02 -1.26 -4.69 120.64 109.31 1igw n GLU 373 Ca 0.00 0.76 -0.05 0.00 -0.02 0.00 0.00 57.16 57.85 1igw n GLU 373 Cb 0.00 -5.68 -0.00 0.00 -0.02 0.00 0.00 31.44 25.74 1igw n GLU 373 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1igw h GLY 374 N -1.96 -0.22 2.00 0.62 0.00 -1.89 -1.56 103.07 100.06 1igw h GLY 374 Ca -0.54 0.57 -0.08 0.00 0.00 0.00 0.00 47.33 47.28 1igw h GLY 374 CO 0.59 -0.15 -0.37 -0.33 0.00 0.00 0.00 176.54 176.28 1igw h MET 375 N -0.06 0.00 -0.46 4.80 2.86 -1.95 -2.86 114.93 117.25 1igw h MET 375 Ca 0.27 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.86 1igw h MET 375 Cb 0.55 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 1igw h MET 375 CO -0.89 0.37 0.12 -0.22 1.06 0.00 0.00 176.91 177.34 1igw h LYS 376 N 0.00 0.73 -0.41 1.72 3.64 -1.66 -1.53 116.57 119.05 1igw h LYS 376 Ca -0.00 -0.17 -0.10 0.00 -1.27 0.00 0.00 60.65 59.11 1igw h LYS 376 Cb 0.83 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1igw h LYS 376 CO 0.05 0.72 -0.14 0.45 -2.27 0.00 0.00 179.45 178.26 1igw h HIS 377 N 0.61 0.83 -0.52 1.91 3.86 -1.37 -2.08 115.15 118.37 1igw h HIS 377 Ca 0.14 -0.16 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 1igw h HIS 377 Cb 0.31 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 1igw h HIS 377 CO 0.02 0.84 -0.02 -0.92 0.86 0.00 0.00 177.93 178.71 1igw h TYR 378 N 0.67 0.98 -0.25 2.45 3.20 -1.27 -0.13 116.97 122.63 1igw h TYR 378 Ca 0.11 -0.16 -0.15 0.00 3.14 0.00 0.00 58.73 61.67 1igw h TYR 378 Cb 0.61 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1igw h TYR 378 CO 0.03 0.90 -0.45 0.28 -1.64 0.00 0.00 178.16 177.28 1igw h VAL 379 N 0.83 1.30 0.12 1.81 2.07 -1.13 -1.32 116.25 119.93 1igw h VAL 379 Ca 0.15 -1.65 -0.30 0.00 0.82 0.00 0.00 66.70 65.73 1igw h VAL 379 Cb 0.53 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1igw h VAL 379 CO 0.03 0.52 -1.47 -0.33 0.02 0.00 0.00 177.57 176.34 1igw h GLU 380 N 0.50 0.25 0.00 1.57 5.08 -1.21 0.27 114.58 121.04 1igw h GLU 380 Ca 0.03 -0.43 -0.17 0.00 -1.00 0.00 0.00 59.36 57.79 1igw h GLU 380 Cb 0.98 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 1igw h GLU 380 CO 0.09 1.13 -1.02 0.87 -1.00 0.00 0.00 179.01 179.08 1igw h LYS 381 N 0.07 0.00 0.00 2.33 1.57 -1.10 -3.41 116.57 116.03 1igw h LYS 381 Ca -0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1igw h LYS 381 Cb 2.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.32 1igw h LYS 381 CO 0.17 0.59 -0.04 0.28 -0.57 0.00 0.00 179.45 179.88 1igw n VAL 382 N -3.16 0.86 0.24 0.50 0.31 -0.55 -4.78 118.33 111.75 1igw n VAL 382 Ca -0.04 0.28 -0.17 0.00 -0.01 0.00 0.00 64.34 64.40 1igw n VAL 382 Cb 0.86 -1.30 -0.09 0.00 -0.91 0.00 0.00 33.84 32.40 1igw n VAL 382 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1igw h GLN 383 N 0.00 -0.88 -0.29 5.55 4.20 -1.33 -0.99 115.11 121.38 1igw h GLN 383 Ca 0.00 0.06 0.06 0.00 0.06 0.00 0.00 58.65 58.83 1igw h GLN 383 Cb 0.04 0.20 -0.08 0.00 0.30 0.00 0.00 27.48 27.94 1igw h GLN 383 CO 0.00 -0.58 -0.45 0.37 -0.67 0.00 0.00 178.83 177.49 1igw h GLN 384 N -0.91 -0.40 -0.96 1.46 4.15 -0.72 -1.51 115.11 116.22 1igw h GLN 384 Ca -0.05 0.03 0.12 0.00 0.77 0.00 0.00 58.65 59.52 1igw h GLN 384 Cb 0.81 0.09 -0.08 0.00 0.21 0.00 0.00 27.48 28.51 1igw h GLN 384 CO -0.11 -0.26 0.59 -1.35 -1.93 0.00 0.00 178.83 175.77 1igw h PRO 385 N -0.41 0.91 -0.63 -2.39 0.11 -1.78 -0.47 132.00 127.33 1igw h PRO 385 Ca 0.10 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.18 1igw h PRO 385 Cb 0.61 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.48 1igw h PRO 385 CO -0.51 0.60 0.39 0.93 -0.21 0.00 0.00 178.00 179.20 1igw h GLU 386 N 0.93 0.74 -0.67 1.05 5.08 -0.21 -0.23 114.58 121.27 1igw h GLU 386 Ca 0.48 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.83 1igw h GLU 386 Cb 0.49 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 1igw h GLU 386 CO -0.27 0.49 0.41 0.74 -1.00 0.00 0.00 179.01 179.38 1igw h PHE 387 N 0.76 0.77 0.00 4.33 0.05 -0.25 -0.32 116.94 122.29 1igw h PHE 387 Ca 0.25 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 62.01 1igw h PHE 387 Cb 0.02 -0.25 -0.01 0.00 2.00 0.00 0.00 35.95 37.71 1igw h PHE 387 CO -0.05 0.43 -0.27 0.00 -0.18 0.00 0.00 178.31 178.25 1igw h ALA 388 N 1.30 1.54 -0.22 2.45 0.00 -0.78 -2.68 119.26 120.87 1igw h ALA 388 Ca 0.27 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1igw h ALA 388 Cb 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1igw h ALA 388 CO -0.11 0.33 -0.21 0.00 0.00 0.00 0.00 179.25 179.26 1igw h ALA 389 N 1.73 1.25 -1.04 0.00 0.00 0.69 -3.19 119.26 118.69 1igw h ALA 389 Ca -0.00 -0.30 0.30 0.00 0.00 0.00 0.00 54.91 54.91 1igw h ALA 389 Cb 0.48 -0.11 -0.13 0.00 0.00 0.00 0.00 17.79 18.03 1igw h ALA 389 CO 0.03 0.49 0.62 0.00 0.00 0.00 0.00 179.25 180.40 1igw h ALA 390 N 1.44 2.03 0.00 0.00 0.00 -1.04 0.48 119.26 122.17 1igw h ALA 390 Ca 0.06 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1igw h ALA 390 Cb 0.56 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1igw h ALA 390 CO 0.04 -0.57 0.00 0.87 0.00 0.00 0.00 179.25 179.59 1igw h LYS 391 N 0.39 0.00 -0.42 0.00 1.57 -1.74 -2.61 116.57 113.75 1igw h LYS 391 Ca 0.70 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.48 1igw h LYS 391 Cb 1.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.92 1igw h LYS 391 CO -0.50 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.13 1igw n ASP 392 N -2.65 3.43 0.00 0.86 8.00 0.17 -4.92 116.55 121.43 1igw n ASP 392 Ca -0.00 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.53 1igw n ASP 392 Cb 0.18 -0.28 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 1igw n ASP 392 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1igw n GLY 393 N 1.39 0.77 3.69 0.44 0.00 -0.98 -4.95 105.19 105.54 1igw n GLY 393 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1igw n GLY 393 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1igw s TYR 394 N -2.00 3.35 -0.48 1.61 5.04 -1.18 -4.89 117.35 118.80 1igw s TYR 394 Ca 0.00 1.41 0.05 0.00 -2.44 0.00 0.00 57.07 56.08 1igw s TYR 394 Cb 0.00 -3.30 0.01 0.00 0.35 0.00 0.00 41.96 39.01 1igw s TYR 394 CO 0.00 -0.76 0.49 0.25 -1.34 0.00 0.00 175.55 174.19 1igw n THR 395 N 4.62 0.00 0.33 4.34 -2.24 -1.26 -3.86 114.28 116.21 1igw n THR 395 Ca 0.10 -0.46 0.03 0.00 -2.27 0.00 0.00 64.05 61.45 1igw n THR 395 Cb 0.47 1.07 0.18 0.00 -2.10 0.00 0.00 70.33 69.95 1igw n THR 395 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1igw n PHE 396 N -0.23 0.00 0.21 4.78 7.35 -1.26 -1.71 117.46 126.59 1igw n PHE 396 Ca 0.02 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.84 1igw n PHE 396 Cb 0.11 -0.28 0.73 0.00 0.35 0.00 0.00 39.48 40.39 1igw n PHE 396 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 1igw h VAL 397 N 0.00 0.77 -2.88 -2.13 -1.51 -1.91 -2.04 116.25 106.55 1igw h VAL 397 Ca 0.00 0.00 -0.78 0.00 -1.23 0.00 0.00 66.70 64.69 1igw h VAL 397 Cb 0.07 0.92 -0.30 0.00 -2.13 0.00 0.00 31.29 29.84 1igw h VAL 397 CO 0.00 0.00 0.55 -1.20 -1.23 0.00 0.00 177.57 175.69 1igw n SER 398 N -4.26 5.95 0.25 4.19 7.64 -0.69 -4.89 113.62 121.81 1igw n SER 398 Ca 0.00 -3.38 0.11 0.00 1.01 0.00 0.00 58.87 56.60 1igw n SER 398 Cb 0.23 -1.19 0.68 0.00 -1.01 0.00 0.00 64.21 62.92 1igw n SER 398 CO 0.00 0.00 0.00 1.12 -3.01 0.00 0.00 175.04 173.15 1igw h HIS 399 N 5.37 0.00 -0.24 1.43 -0.00 -1.60 -2.63 115.15 117.49 1igw h HIS 399 Ca 0.20 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.45 1igw h HIS 399 Cb 0.64 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.04 1igw h HIS 399 CO 0.95 0.12 -0.34 1.96 -0.00 0.00 0.00 177.93 180.62 1igw h GLN 400 N 0.00 0.51 0.02 5.12 1.08 -1.90 -3.07 115.11 116.87 1igw h GLN 400 Ca -0.00 -0.23 -0.25 0.00 -1.45 0.00 0.00 58.65 56.71 1igw h GLN 400 Cb 0.28 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1igw h GLN 400 CO 0.02 0.79 -1.03 1.96 -0.95 0.00 0.00 178.83 179.61 1igw h GLN 401 N 0.43 0.55 -0.67 1.46 7.50 -1.91 -1.45 115.11 121.03 1igw h GLN 401 Ca 0.05 -0.62 0.02 0.00 0.50 0.00 0.00 58.65 58.60 1igw h GLN 401 Cb 0.81 0.18 -0.04 0.00 0.05 0.00 0.00 27.48 28.48 1igw h GLN 401 CO 0.07 1.23 0.44 1.49 -1.50 0.00 0.00 178.83 180.56 1igw h GLU 402 N 0.30 0.81 -0.09 1.46 4.57 -1.40 -1.96 114.58 118.27 1igw h GLU 402 Ca -0.12 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.02 1igw h GLU 402 Cb 1.68 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 30.09 1igw h GLU 402 CO 0.19 0.54 0.00 1.55 -1.18 0.00 0.00 179.01 180.11 1igw n VAL 403 N -4.45 0.11 -0.29 0.32 3.14 -1.17 -4.89 118.33 111.10 1igw n VAL 403 Ca 0.08 -0.25 0.00 0.00 -2.96 0.00 0.00 64.34 61.21 1igw n VAL 403 Cb 0.10 0.25 0.00 0.00 -1.06 0.00 0.00 33.84 33.13 1igw n VAL 403 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1igw n GLY 404 N 1.09 0.82 0.31 7.55 0.00 -0.74 -4.99 105.19 109.23 1igw n GLY 404 Ca 0.17 -0.28 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1igw n GLY 404 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1igw h THR 405 N 0.00 1.13 -0.01 2.61 2.02 -1.43 -1.94 112.91 115.29 1igw h THR 405 Ca 0.00 -0.29 -0.17 0.00 0.77 0.00 0.00 66.41 66.72 1igw h THR 405 Cb 0.00 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 1igw h THR 405 CO 0.00 0.13 -0.77 1.23 0.37 0.00 0.00 175.52 176.48 1igw h GLY 406 N 0.63 0.07 0.50 2.16 0.00 -1.83 -1.44 103.07 103.17 1igw h GLY 406 Ca 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 1igw h GLY 406 CO -0.03 0.11 -0.06 -1.82 0.00 0.00 0.00 176.54 174.74 1igw h TYR 407 N 0.04 0.12 0.00 5.60 3.20 -1.73 -2.58 116.97 121.62 1igw h TYR 407 Ca -0.02 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.79 1igw h TYR 407 Cb 1.35 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.60 1igw h TYR 407 CO 0.01 0.64 -0.10 0.74 -1.64 0.00 0.00 178.16 177.81 1igw h PHE 408 N -0.44 0.00 -0.49 -3.82 -1.00 -1.39 -1.95 116.94 107.85 1igw h PHE 408 Ca 0.00 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.69 1igw h PHE 408 Cb 0.64 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.18 1igw h PHE 408 CO 0.12 0.10 -0.07 -0.44 -1.61 0.00 0.00 178.31 176.42 1igw h ASP 409 N 0.00 0.91 -0.61 2.17 3.32 -1.14 -1.28 116.42 119.78 1igw h ASP 409 Ca -0.00 -0.34 -0.06 0.00 0.02 0.00 0.00 57.03 56.65 1igw h ASP 409 Cb 0.52 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1igw h ASP 409 CO 0.01 1.03 0.15 0.11 -1.72 0.00 0.00 179.24 178.82 1igw h LYS 410 N 0.76 1.02 -0.18 3.56 1.57 -0.98 -0.76 116.57 121.56 1igw h LYS 410 Ca 0.13 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1igw h LYS 410 Cb 0.61 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 1igw h LYS 410 CO 0.04 0.91 0.08 0.28 -0.57 0.00 0.00 179.45 180.19 1igw h VAL 411 N 0.97 1.14 0.09 0.50 2.07 -1.00 -1.60 116.25 118.41 1igw h VAL 411 Ca 0.20 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.34 1igw h VAL 411 Cb 0.36 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1igw h VAL 411 CO 0.00 0.13 -0.18 0.74 0.02 0.00 0.00 177.57 178.28 1igw h THR 412 N 0.15 0.59 -0.80 2.57 2.02 -1.02 -1.70 112.91 114.72 1igw h THR 412 Ca 0.06 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.35 1igw h THR 412 Cb 0.13 0.59 -0.08 0.00 -1.74 0.00 0.00 68.15 67.05 1igw h THR 412 CO -0.01 0.00 0.44 0.74 0.37 0.00 0.00 175.52 177.06 1igw h THR 413 N -0.34 0.85 -0.27 3.16 2.02 -1.05 -1.02 112.91 116.25 1igw h THR 413 Ca 0.03 -0.24 -0.13 0.00 0.77 0.00 0.00 66.41 66.84 1igw h THR 413 Cb 0.36 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1igw h THR 413 CO -0.10 0.13 -0.35 0.40 0.37 0.00 0.00 175.52 175.96 1igw h ILE 414 N 0.71 1.29 -0.20 3.11 2.04 -1.04 -2.38 117.51 121.04 1igw h ILE 414 Ca 0.40 -1.49 -0.14 0.00 1.00 0.00 0.00 64.86 64.63 1igw h ILE 414 Cb 0.43 1.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1igw h ILE 414 CO -0.28 0.48 -0.40 0.40 0.00 0.00 0.00 178.15 178.35 1igw h ILE 415 N 0.51 1.32 -0.05 -0.67 2.04 -0.69 -3.15 117.51 116.82 1igw h ILE 415 Ca 0.05 -1.63 0.00 0.00 1.00 0.00 0.00 64.86 64.28 1igw h ILE 415 Cb 0.85 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 1igw h ILE 415 CO 0.07 0.51 0.00 0.00 0.00 0.00 0.00 178.15 178.73 1igw n GLN 416 N -4.24 1.21 0.00 2.37 6.02 -0.45 -5.11 117.38 117.18 1igw n GLN 416 Ca -0.06 -0.31 0.00 0.00 -0.01 0.00 0.00 57.00 56.62 1igw n GLN 416 Cb 0.54 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.52 1igw n GLN 416 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46