#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 3.37 0.09 3.15 -4.23 -1.26 -4.85 115.64 111.91 1igw s THR 3 Ca 0.00 0.53 -0.32 0.00 -1.18 0.00 0.00 61.69 60.71 1igw s THR 3 Cb 0.00 -3.04 -0.15 0.00 1.34 0.00 0.00 72.50 70.65 1igw s THR 3 CO 0.00 -0.50 1.60 -0.09 -0.54 0.00 0.00 174.62 175.09 1igw h ARG 4 N -0.58 -0.80 -0.99 3.99 2.43 -1.99 -0.10 114.38 116.33 1igw h ARG 4 Ca -0.45 0.05 0.17 0.00 -0.81 0.00 0.00 59.98 58.95 1igw h ARG 4 Cb 1.23 0.18 -0.10 0.00 -0.42 0.00 0.00 29.97 30.87 1igw h ARG 4 CO 0.53 -0.53 0.62 1.79 -1.51 0.00 0.00 179.97 180.86 1igw h THR 5 N -0.83 0.77 -0.70 0.20 1.35 -1.99 0.52 112.91 112.23 1igw h THR 5 Ca -0.04 -0.28 -0.05 0.00 -0.55 0.00 0.00 66.41 65.49 1igw h THR 5 Cb 0.72 -0.10 -0.03 0.00 -1.73 0.00 0.00 68.15 67.01 1igw h THR 5 CO -0.02 0.15 0.24 1.56 -0.25 0.00 0.00 175.52 177.19 1igw h GLN 6 N 0.80 1.06 -0.36 4.72 4.20 -1.74 -1.41 115.11 122.39 1igw h GLN 6 Ca 0.55 -0.20 -0.12 0.00 0.06 0.00 0.00 58.65 58.93 1igw h GLN 6 Cb 0.80 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1igw h GLN 6 CO -0.33 0.89 -0.26 1.96 -0.67 0.00 0.00 178.83 180.42 1igw h GLN 7 N 1.02 0.73 -0.26 1.46 4.20 0.18 -1.72 115.11 120.72 1igw h GLN 7 Ca 0.23 -0.31 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1igw h GLN 7 Cb 0.26 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1igw h GLN 7 CO -0.01 0.91 0.11 0.82 -0.67 0.00 0.00 178.83 179.99 1igw h ILE 8 N 0.63 1.17 -0.72 2.54 2.04 -0.39 -2.33 117.51 120.44 1igw h ILE 8 Ca 0.08 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 1igw h ILE 8 Cb 0.77 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 1igw h ILE 8 CO 0.06 0.17 0.29 -0.33 0.00 0.00 0.00 178.15 178.34 1igw h GLU 9 N 0.27 1.07 -0.38 2.37 5.08 -1.18 -1.62 114.58 120.19 1igw h GLU 9 Ca 0.09 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 1igw h GLU 9 Cb 0.17 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1igw h GLU 9 CO -0.01 0.88 0.00 0.93 -1.00 0.00 0.00 179.01 179.81 1igw h GLU 10 N 1.03 0.60 -0.03 2.33 5.08 -1.17 -2.45 114.58 119.98 1igw h GLU 10 Ca 0.24 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1igw h GLU 10 Cb 0.20 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1igw h GLU 10 CO -0.02 0.62 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.51 1igw h LEU 11 N 0.57 0.07 -0.93 1.33 3.38 -1.05 -1.73 115.31 116.97 1igw h LEU 11 Ca 0.12 -0.50 0.20 0.00 0.09 0.00 0.00 57.88 57.79 1igw h LEU 11 Cb 0.36 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 1igw h LEU 11 CO 0.01 0.55 0.49 1.56 0.09 0.00 0.00 178.44 181.15 1igw h GLN 12 N -0.41 0.56 -0.24 1.13 4.20 -1.18 0.12 115.11 119.28 1igw h GLN 12 Ca 0.00 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.52 1igw h GLN 12 Cb 0.53 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 1igw h GLN 12 CO 0.01 0.37 -0.51 0.87 -0.67 0.00 0.00 178.83 178.90 1igw h LYS 13 N 0.58 0.69 -0.23 1.46 1.57 -1.42 -3.16 116.57 116.07 1igw h LYS 13 Ca 0.55 -0.42 -0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1igw h LYS 13 Cb 0.94 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1igw h LYS 13 CO -0.44 1.03 -0.22 1.49 -0.57 0.00 0.00 179.45 180.75 1igw h GLU 14 N 0.54 0.42 0.00 3.15 4.81 0.12 -2.62 114.58 120.99 1igw h GLU 14 Ca 0.02 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1igw h GLU 14 Cb 1.08 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1igw h GLU 14 CO 0.10 0.62 0.00 0.91 -0.73 0.00 0.00 179.01 179.91 1igw n TRP 15 N -4.15 0.00 1.00 0.92 8.01 -0.32 -1.75 117.44 121.15 1igw n TRP 15 Ca -0.00 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.29 1igw n TRP 15 Cb 0.37 -0.15 0.00 0.00 -2.01 0.00 0.00 31.31 29.52 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 -1.15 0.00 -1.38 -0.99 -2.24 -0.99 -4.74 114.28 102.79 1igw n THR 16 Ca 0.12 -0.01 -0.32 0.00 -2.27 0.00 0.00 64.05 61.56 1igw n THR 16 Cb 0.11 0.78 0.08 0.00 -2.10 0.00 0.00 70.33 69.21 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 -2.97 2.30 0.57 -0.78 -1.52 -0.72 -4.93 119.66 111.61 1igw s GLN 17 Ca 0.10 1.32 0.26 0.00 -1.95 0.00 0.00 55.36 55.09 1igw s GLN 17 Cb 0.17 -1.89 1.63 0.00 -0.22 0.00 0.00 33.01 32.69 1igw s GLN 17 CO 0.80 -1.63 2.19 -1.35 -0.25 0.00 0.00 175.29 175.05 1igw h PRO 18 N -0.77 0.00 -0.64 2.91 0.11 -1.92 -1.97 132.00 129.72 1igw h PRO 18 Ca -0.45 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.72 1igw h PRO 18 Cb 1.24 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 1igw h PRO 18 CO 0.51 0.00 0.43 -0.09 -0.21 0.00 0.00 178.00 178.64 1igw h ARG 19 N 0.00 0.62 -0.64 1.05 9.65 -1.91 -2.53 114.38 120.63 1igw h ARG 19 Ca 0.03 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1igw h ARG 19 Cb 0.15 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 1igw h ARG 19 CO -0.00 0.41 0.00 0.91 2.80 0.00 0.00 179.97 184.09 1igw n TRP 20 N -4.48 1.62 -2.04 2.20 7.02 -0.74 -4.96 117.44 116.06 1igw n TRP 20 Ca 0.09 -0.60 -0.42 0.00 -1.02 0.00 0.00 57.50 55.55 1igw n TRP 20 Cb 0.23 -0.35 -0.03 0.00 -2.42 0.00 0.00 31.31 28.75 1igw n TRP 20 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 1igw s GLU 21 N -2.19 4.21 0.00 -0.99 2.12 -0.96 -1.98 118.70 118.91 1igw s GLU 21 Ca 0.48 2.17 0.00 0.00 0.36 0.00 0.00 54.97 57.98 1igw s GLU 21 Cb 0.34 -3.79 0.00 0.00 0.26 0.00 0.00 34.13 30.93 1igw s GLU 21 CO 0.19 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.56 1igw n GLY 22 N 3.99 0.64 3.70 -1.50 0.00 -1.26 -5.05 105.19 105.70 1igw n GLY 22 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.08 5.15 -0.15 -0.61 -1.09 -0.84 -4.64 121.20 116.95 1igw s ILE 23 Ca 0.00 0.09 -0.08 0.00 -2.23 0.00 0.00 60.65 58.44 1igw s ILE 23 Cb 0.00 -3.33 -0.04 0.00 -1.58 0.00 0.00 42.46 37.50 1igw s ILE 23 CO 0.00 0.46 0.13 -0.89 -1.23 0.00 0.00 174.94 173.41 1igw s THR 24 N 0.31 5.42 -0.18 2.92 2.01 0.18 -5.03 115.64 121.27 1igw s THR 24 Ca 0.06 0.18 -0.00 0.00 0.31 0.00 0.00 61.69 62.24 1igw s THR 24 Cb -0.12 -3.40 0.04 0.00 0.01 0.00 0.00 72.50 69.04 1igw s THR 24 CO -0.01 0.56 -0.06 -0.13 -0.69 0.00 0.00 174.62 174.29 1igw s ARG 25 N -0.55 1.54 0.00 4.92 0.52 -1.26 -4.70 118.95 119.42 1igw s ARG 25 Ca 0.12 -0.61 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 1igw s ARG 25 Cb -0.12 -2.13 0.00 0.00 0.52 0.00 0.00 34.95 33.22 1igw s ARG 25 CO 0.02 -0.45 0.56 -0.35 0.02 0.00 0.00 175.30 175.09 1igw n PRO 26 N 4.83 0.97 -4.22 3.54 -0.04 -1.26 -4.81 135.00 134.01 1igw n PRO 26 Ca -0.12 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.21 1igw n PRO 26 Cb 0.47 -1.42 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 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 -1.14 1.14 0.49 0.54 -0.85 -1.26 -5.17 117.35 111.09 1igw s TYR 27 Ca 0.00 -1.20 0.08 0.00 -0.52 0.00 0.00 57.07 55.43 1igw s TYR 27 Cb 0.00 -0.63 0.04 0.00 0.38 0.00 0.00 41.96 41.75 1igw s TYR 27 CO 0.00 -0.43 0.66 -1.54 -1.52 0.00 0.00 175.55 172.72 1igw s SER 28 N -3.15 5.42 0.29 -0.18 1.04 -1.26 -5.00 113.70 110.86 1igw s SER 28 Ca 0.30 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.21 1igw s SER 28 Cb 0.07 -0.35 0.45 0.00 0.10 0.00 0.00 66.02 66.29 1igw s SER 28 CO 0.07 -1.00 1.81 0.00 0.98 0.00 0.00 173.24 175.10 1igw h ALA 29 N 0.43 1.22 -0.05 5.32 0.00 -1.97 -1.69 119.26 122.52 1igw h ALA 29 Ca -0.37 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.23 1igw h ALA 29 Cb 1.28 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1igw h ALA 29 CO 0.44 0.52 -0.32 1.49 0.00 0.00 0.00 179.25 181.37 1igw h GLU 30 N 0.63 0.09 -0.44 0.00 4.81 -1.95 -1.09 114.58 116.63 1igw h GLU 30 Ca 0.13 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.25 1igw h GLU 30 Cb 0.40 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 1igw h GLU 30 CO 0.02 0.40 -0.03 -0.44 -0.73 0.00 0.00 179.01 178.23 1igw h ASP 31 N 0.08 0.79 0.34 1.04 3.32 -1.71 -2.44 116.42 117.84 1igw h ASP 31 Ca 0.01 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 1igw h ASP 31 Cb 0.61 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1igw h ASP 31 CO 0.04 0.92 -0.16 0.58 -1.72 0.00 0.00 179.24 178.90 1igw h VAL 32 N 0.64 0.68 0.00 -1.35 2.07 -1.12 -3.13 116.25 114.04 1igw h VAL 32 Ca 0.12 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 1igw h VAL 32 Cb 0.53 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1igw h VAL 32 CO 0.03 0.06 -0.05 0.58 0.02 0.00 0.00 177.57 178.21 1igw h VAL 33 N -0.62 0.48 0.00 2.57 2.07 -1.24 -1.45 116.25 118.06 1igw h VAL 33 Ca -0.05 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1igw h VAL 33 Cb 0.45 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1igw h VAL 33 CO 0.08 0.05 0.00 0.07 0.02 0.00 0.00 177.57 177.78 1igw h LYS 34 N 0.00 0.00 -0.01 1.57 2.10 -1.38 -3.15 116.57 115.70 1igw h LYS 34 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1igw h LYS 34 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1igw h LYS 34 CO 0.01 0.00 -0.29 1.28 -2.00 0.00 0.00 179.45 178.45 1igw n LEU 35 N -2.43 1.47 0.08 7.07 4.77 -0.55 -4.56 117.00 122.85 1igw n LEU 35 Ca 0.05 -0.47 -0.16 0.00 -0.03 0.00 0.00 56.01 55.40 1igw n LEU 35 Cb 0.41 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1igw n LEU 35 CO 0.29 0.27 0.08 0.03 -1.33 0.00 0.00 177.39 176.74 1igw h ARG 36 N 1.85 0.42 0.00 3.23 3.08 -1.59 -3.51 114.38 117.86 1igw h ARG 36 Ca 0.00 -0.52 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1igw h ARG 36 Cb 0.61 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1igw h ARG 36 CO 0.00 1.18 0.00 0.41 -1.07 0.00 0.00 179.97 180.49 1igw n GLY 37 N 1.16 0.14 0.15 0.04 0.00 -1.26 -4.64 105.19 100.78 1igw n GLY 37 Ca -0.08 -1.84 0.13 0.00 0.00 0.00 0.00 46.02 44.22 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 -3.28 1.61 4.64 -1.98 -3.43 113.55 111.11 1igw h SER 38 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1igw h SER 38 Cb 0.00 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 61.74 1igw h SER 38 CO 0.00 0.00 -0.81 -0.69 -0.87 0.00 0.00 176.83 174.46 1igw s VAL 39 N -3.14 1.12 -0.30 0.95 1.01 -1.26 -4.93 120.40 113.84 1igw s VAL 39 Ca 0.09 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1igw s VAL 39 Cb 0.10 -1.08 0.08 0.00 0.00 0.00 0.00 36.38 35.48 1igw s VAL 39 CO 0.62 0.37 -0.01 0.21 0.00 0.00 0.00 175.10 176.29 1igw s ASN 40 N 1.22 4.56 0.34 3.32 3.04 -1.26 -5.10 114.94 121.05 1igw s ASN 40 Ca -0.04 -1.81 -0.29 0.00 0.04 0.00 0.00 52.86 50.76 1igw s ASN 40 Cb -0.14 -1.53 -0.11 0.00 -1.54 0.00 0.00 41.25 37.93 1igw s ASN 40 CO -0.03 -0.31 1.54 -2.84 -3.04 0.00 0.00 177.10 172.41 1igw s PRO 41 N 1.04 4.12 0.38 0.43 0.02 -1.26 -4.96 135.00 134.77 1igw s PRO 41 Ca 0.03 2.57 -0.26 0.00 0.02 0.00 0.00 61.00 63.36 1igw s PRO 41 Cb -0.19 -2.99 -0.09 0.00 0.02 0.00 0.00 34.50 31.24 1igw s PRO 41 CO -0.08 -0.58 1.22 -1.21 -0.33 0.00 0.00 177.00 176.02 1igw s GLU 42 N -1.35 4.12 -0.67 5.54 0.41 -1.26 -4.98 118.70 120.51 1igw s GLU 42 Ca 0.58 1.97 0.05 0.00 -0.41 0.00 0.00 54.97 57.16 1igw s GLU 42 Cb -0.47 -2.79 0.19 0.00 -1.78 0.00 0.00 34.13 29.28 1igw s GLU 42 CO 0.56 -0.30 0.56 0.00 -0.49 0.00 0.00 175.26 175.59 1igw h THR 44 N 4.02 0.64 -0.37 0.00 2.02 -1.94 -2.16 112.91 115.11 1igw h THR 44 Ca 0.17 -0.01 -0.07 0.00 0.77 0.00 0.00 66.41 67.26 1igw h THR 44 Cb 0.73 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1igw h THR 44 CO 0.73 0.01 -0.08 -0.07 0.37 0.00 0.00 175.52 176.48 1igw h LEU 45 N 0.03 0.60 -0.53 2.58 3.38 -1.93 -1.57 115.31 117.87 1igw h LEU 45 Ca 0.19 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1igw h LEU 45 Cb 0.29 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1igw h LEU 45 CO -0.38 0.73 -0.14 0.00 0.09 0.00 0.00 178.44 178.73 1igw h ALA 46 N 1.34 0.73 -0.05 1.53 0.00 -1.69 0.10 119.26 121.22 1igw h ALA 46 Ca 0.11 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1igw h ALA 46 Cb 0.49 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1igw h ALA 46 CO 0.03 0.68 0.02 1.96 0.00 0.00 0.00 179.25 181.94 1igw h GLN 47 N 0.91 0.07 -0.25 0.00 1.08 -1.20 -0.85 115.11 114.86 1igw h GLN 47 Ca 0.13 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.30 1igw h GLN 47 Cb 0.72 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.13 1igw h GLN 47 CO 0.06 0.16 0.06 -0.07 -0.95 0.00 0.00 178.83 178.08 1igw h LEU 48 N -0.03 0.38 -0.34 1.46 3.38 -1.15 -2.38 115.31 116.64 1igw h LEU 48 Ca 0.02 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1igw h LEU 48 Cb 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1igw h LEU 48 CO -0.00 0.52 0.22 1.23 0.09 0.00 0.00 178.44 180.49 1igw h GLY 49 N 0.23 0.47 1.29 0.83 0.00 -0.67 -1.62 103.07 103.61 1igw h GLY 49 Ca 0.08 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 1igw h GLY 49 CO 0.00 0.17 0.19 0.00 0.00 0.00 0.00 176.54 176.90 1igw h ALA 50 N 1.12 1.21 -0.23 3.60 0.00 -1.13 -0.55 119.26 123.28 1igw h ALA 50 Ca 0.12 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1igw h ALA 50 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1igw h ALA 50 CO -0.03 0.56 -0.13 0.00 0.00 0.00 0.00 179.25 179.65 1igw h ALA 51 N 1.33 0.33 -0.59 0.00 0.00 -1.38 -1.89 119.26 117.05 1igw h ALA 51 Ca 0.20 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1igw h ALA 51 Cb 0.25 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1igw h ALA 51 CO -0.01 0.20 0.17 -0.22 0.00 0.00 0.00 179.25 179.38 1igw h LYS 52 N 0.21 0.93 -0.53 0.00 3.64 -1.05 -2.32 116.57 117.44 1igw h LYS 52 Ca 0.05 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 1igw h LYS 52 Cb 0.64 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1igw h LYS 52 CO 0.04 0.84 0.20 1.98 -2.27 0.00 0.00 179.45 180.24 1igw h MET 53 N 0.84 0.80 -0.83 1.90 4.05 -1.05 -0.85 114.93 119.80 1igw h MET 53 Ca 0.19 -0.15 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1igw h MET 53 Cb 0.31 -0.13 -0.04 0.00 -0.80 0.00 0.00 31.60 30.94 1igw h MET 53 CO -0.00 0.71 0.53 2.35 0.23 0.00 0.00 176.91 180.72 1igw h TRP 54 N 0.72 1.06 -0.40 1.39 2.91 -1.14 -1.26 115.95 119.23 1igw h TRP 54 Ca 0.18 0.01 -0.15 0.00 1.13 0.00 0.00 58.89 60.06 1igw h TRP 54 Cb 0.22 -0.35 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 1igw h TRP 54 CO 0.01 0.69 -0.32 0.00 -1.03 0.00 0.00 178.44 177.78 1igw h ARG 55 N 1.12 0.93 -0.41 2.65 3.08 -1.19 -2.61 114.38 117.95 1igw h ARG 55 Ca 0.30 -0.46 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 1igw h ARG 55 Cb -0.09 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1igw h ARG 55 CO -0.06 1.12 0.06 -0.07 -1.07 0.00 0.00 179.97 179.95 1igw h LEU 56 N 0.76 0.58 0.00 3.04 3.38 -0.83 -1.41 115.31 120.83 1igw h LEU 56 Ca 0.07 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1igw h LEU 56 Cb 0.91 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1igw h LEU 56 CO 0.08 0.61 0.00 0.18 0.09 0.00 0.00 178.44 179.41 1igw n LEU 57 N -4.29 0.00 -2.93 1.67 4.77 -0.50 -2.99 117.00 112.74 1igw n LEU 57 Ca 0.02 0.46 -0.25 0.00 -0.03 0.00 0.00 56.01 56.22 1igw n LEU 57 Cb 0.23 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.82 1igw n LEU 57 CO 0.39 -0.06 0.08 1.41 -1.33 0.00 0.00 177.39 177.88 1igw n HIS 58 N -1.46 3.25 -0.19 -1.77 8.25 -0.60 -4.92 115.22 117.78 1igw n HIS 58 Ca 0.07 -3.84 0.00 0.00 -0.26 0.00 0.00 57.72 53.69 1igw n HIS 58 Cb 0.28 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 30.96 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 -0.18 0.88 0.87 -1.41 0.00 -1.23 -4.92 105.19 99.20 1igw n GLY 59 Ca 0.30 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.44 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 -2.00 2.12 -1.89 1.61 1.02 -0.77 -4.94 120.64 115.79 1igw n GLU 60 Ca 0.00 -1.75 -0.34 0.00 -0.02 0.00 0.00 57.16 55.05 1igw n GLU 60 Cb 0.00 -1.46 0.04 0.00 -0.02 0.00 0.00 31.44 29.99 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 -2.09 5.23 0.17 1.62 1.04 -1.16 -4.86 113.70 113.65 1igw s SER 61 Ca 0.26 2.08 -0.12 0.00 0.48 0.00 0.00 55.95 58.65 1igw s SER 61 Cb 0.20 -2.56 0.06 0.00 0.10 0.00 0.00 66.02 63.81 1igw s SER 61 CO 0.35 -1.55 1.69 0.11 0.98 0.00 0.00 173.24 174.82 1igw h LYS 62 N 0.36 0.89 -0.05 4.02 1.57 -1.92 -3.28 116.57 118.16 1igw h LYS 62 Ca -0.48 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.10 1igw h LYS 62 Cb 1.25 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1igw h LYS 62 CO 0.55 0.81 0.00 1.63 -0.57 0.00 0.00 179.45 181.87 1igw n LYS 63 N -4.42 1.72 0.00 3.15 5.02 -1.26 -4.95 118.16 117.43 1igw n LYS 63 Ca 0.03 -1.69 0.00 0.00 -2.02 0.00 0.00 58.31 54.63 1igw n LYS 63 Cb 0.21 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 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 1.09 1.32 3.18 0.72 0.00 -1.24 -5.02 105.19 105.25 1igw n GLY 64 Ca 0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.32 0.06 -0.30 1.61 -0.85 -1.26 -4.92 117.35 109.36 1igw s TYR 65 Ca 0.00 -0.29 -0.11 0.00 -0.52 0.00 0.00 57.07 56.15 1igw s TYR 65 Cb 0.00 -0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.29 1igw s TYR 65 CO 0.00 -0.44 0.18 0.42 -1.52 0.00 0.00 175.55 174.18 1igw s ILE 66 N -2.68 4.93 -0.19 -3.49 1.01 -0.03 -4.74 121.20 116.01 1igw s ILE 66 Ca -0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 60.65 60.38 1igw s ILE 66 Cb -0.01 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 1igw s ILE 66 CO -0.04 0.13 -0.04 0.54 0.00 0.00 0.00 174.94 175.52 1igw s ASN 67 N 1.68 4.54 0.42 3.58 4.22 -1.26 -1.14 114.94 126.98 1igw s ASN 67 Ca 0.06 -0.26 0.06 0.00 -2.14 0.00 0.00 52.86 50.58 1igw s ASN 67 Cb -0.17 -1.76 -0.07 0.00 1.28 0.00 0.00 41.25 40.54 1igw s ASN 67 CO 0.08 0.08 0.01 -0.44 -2.04 0.00 0.00 177.10 174.79 1igw s SER 68 N 0.91 3.77 -0.02 3.54 0.01 0.13 -4.66 113.70 117.38 1igw s SER 68 Ca -0.00 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 55.85 1igw s SER 68 Cb -0.15 -0.25 0.02 0.00 0.21 0.00 0.00 66.02 65.85 1igw s SER 68 CO 0.01 -0.52 0.00 -0.76 0.41 0.00 0.00 173.24 172.38 1igw s LEU 69 N -3.71 1.34 0.31 2.44 1.43 -1.26 -1.76 118.68 117.46 1igw s LEU 69 Ca 0.31 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 53.10 1igw s LEU 69 Cb 0.09 -0.17 -0.12 0.00 0.03 0.00 0.00 46.19 46.01 1igw s LEU 69 CO 0.16 -0.08 1.46 0.61 0.23 0.00 0.00 176.35 178.74 1igw n GLY 70 N 3.90 1.01 3.03 -3.19 0.00 0.02 -3.90 105.19 106.06 1igw n GLY 70 Ca -0.24 0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.45 1.00 -0.62 4.61 0.00 -0.65 -0.78 121.76 124.86 1igw s ALA 71 Ca 0.61 -0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.22 1igw s ALA 71 Cb -0.55 -0.36 0.04 0.00 0.00 0.00 0.00 23.12 22.26 1igw s ALA 71 CO 0.55 0.17 0.67 1.47 0.00 0.00 0.00 175.76 178.62 1igw n LEU 72 N 3.26 1.45 -4.14 0.00 -0.00 -1.26 -4.51 117.00 111.80 1igw n LEU 72 Ca -0.18 -1.03 -0.15 0.00 -0.00 0.00 0.00 56.01 54.65 1igw n LEU 72 Cb 0.54 -0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.84 1igw n LEU 72 CO 0.25 0.31 -0.42 0.42 -0.00 0.00 0.00 177.39 177.95 1igw s THR 73 N -0.44 0.85 0.30 1.47 -4.23 -1.26 -4.93 115.64 107.41 1igw s THR 73 Ca 0.06 -1.43 0.02 0.00 -1.18 0.00 0.00 61.69 59.16 1igw s THR 73 Cb 0.04 -1.11 0.29 0.00 1.34 0.00 0.00 72.50 73.07 1igw s THR 73 CO 0.06 -0.45 1.86 1.23 -0.54 0.00 0.00 174.62 176.78 1igw h GLY 74 N 3.95 1.49 1.60 3.99 0.00 -1.89 -2.07 103.07 110.14 1igw h GLY 74 Ca -0.38 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 46.48 1igw h GLY 74 CO 0.47 0.19 -0.14 -1.33 0.00 0.00 0.00 176.54 175.74 1igw h GLY 75 N 0.96 0.52 1.01 4.60 0.00 -1.95 -0.91 103.07 107.30 1igw h GLY 75 Ca 0.46 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 47.34 1igw h GLY 75 CO -0.22 0.34 -0.05 1.46 0.00 0.00 0.00 176.54 178.06 1igw h GLN 76 N 0.44 0.85 -0.70 4.80 4.20 -1.79 -2.30 115.11 120.61 1igw h GLN 76 Ca 0.08 -0.30 -0.05 0.00 0.06 0.00 0.00 58.65 58.45 1igw h GLN 76 Cb 0.51 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 1igw h GLN 76 CO 0.03 0.92 0.25 0.00 -0.67 0.00 0.00 178.83 179.37 1igw h ALA 77 N 0.89 1.12 -0.27 3.87 0.00 -1.23 -1.88 119.26 121.78 1igw h ALA 77 Ca 0.12 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1igw h ALA 77 Cb 0.58 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1igw h ALA 77 CO 0.03 0.62 0.12 1.25 0.00 0.00 0.00 179.25 181.27 1igw h LEU 78 N 1.02 0.16 -1.33 0.00 5.85 -1.03 -1.37 115.31 118.62 1igw h LEU 78 Ca 0.23 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 1igw h LEU 78 Cb 0.24 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1igw h LEU 78 CO -0.01 0.13 -0.04 1.56 -0.34 0.00 0.00 178.44 179.73 1igw h GLN 79 N 0.25 0.40 -0.53 1.25 1.08 -0.98 -2.25 115.11 114.34 1igw h GLN 79 Ca 0.11 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 1igw h GLN 79 Cb 0.05 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 1igw h GLN 79 CO -0.09 0.46 0.23 1.96 -0.95 0.00 0.00 178.83 180.44 1igw h GLN 80 N 0.39 0.77 -0.37 1.46 4.20 -0.85 -0.55 115.11 120.16 1igw h GLN 80 Ca 0.08 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1igw h GLN 80 Cb 0.32 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1igw h GLN 80 CO 0.01 0.66 0.07 0.00 -0.67 0.00 0.00 178.83 178.90 1igw h ALA 81 N 1.07 1.44 0.00 3.87 0.00 -0.94 -1.12 119.26 123.59 1igw h ALA 81 Ca 0.18 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1igw h ALA 81 Cb 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1igw h ALA 81 CO -0.02 0.41 -0.52 0.87 0.00 0.00 0.00 179.25 179.99 1igw h LYS 82 N 0.54 0.00 -0.00 0.00 1.57 -0.81 -2.99 116.57 114.88 1igw h LYS 82 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1igw h LYS 82 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1igw h LYS 82 CO -0.00 0.52 -0.21 0.00 -0.57 0.00 0.00 179.45 179.19 1igw n ALA 83 N -2.33 2.85 0.00 3.86 0.00 -0.27 -4.88 120.51 119.73 1igw n ALA 83 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1igw n ALA 83 Cb 0.61 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.48 0.84 3.77 0.00 0.00 -0.80 -5.07 105.19 105.40 1igw n GLY 84 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 2.69 -1.20 -0.61 -1.09 -0.49 -4.96 121.20 113.54 1igw s ILE 85 Ca 0.00 0.58 0.18 0.00 -2.23 0.00 0.00 60.65 59.17 1igw s ILE 85 Cb 0.00 -3.32 -0.11 0.00 -1.58 0.00 0.00 42.46 37.45 1igw s ILE 85 CO 0.00 0.05 0.83 -0.62 -1.23 0.00 0.00 174.94 173.97 1igw n GLU 86 N -0.17 1.38 -3.60 2.79 1.02 -1.26 -4.58 120.64 116.22 1igw n GLU 86 Ca 0.05 -0.39 -0.16 0.00 -0.02 0.00 0.00 57.16 56.65 1igw n GLU 86 Cb 0.45 -1.33 -0.07 0.00 -0.02 0.00 0.00 31.44 30.47 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 -2.40 -1.61 -0.17 0.62 0.00 -1.26 -4.16 121.76 112.77 1igw s ALA 87 Ca 0.10 1.44 -0.08 0.00 0.00 0.00 0.00 51.96 53.42 1igw s ALA 87 Cb 0.14 -0.44 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 1igw s ALA 87 CO 0.60 -0.33 0.11 0.08 0.00 0.00 0.00 175.76 176.22 1igw s VAL 88 N -0.56 5.26 -0.25 0.00 1.01 -0.11 -4.66 120.40 121.09 1igw s VAL 88 Ca -0.07 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 61.94 1igw s VAL 88 Cb -0.02 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 1igw s VAL 88 CO 0.06 0.49 0.16 -0.47 0.00 0.00 0.00 175.10 175.33 1igw s TYR 89 N -0.00 3.27 -0.48 5.22 5.04 -1.25 -0.05 117.35 129.10 1igw s TYR 89 Ca 0.09 0.15 -0.09 0.00 -2.44 0.00 0.00 57.07 54.78 1igw s TYR 89 Cb -0.12 -2.28 0.12 0.00 0.35 0.00 0.00 41.96 40.03 1igw s TYR 89 CO -0.00 -0.01 0.35 -1.17 -1.34 0.00 0.00 175.55 173.39 1igw s LEU 90 N 1.22 5.72 0.06 6.97 0.20 0.36 -1.64 118.68 131.57 1igw s LEU 90 Ca 0.07 -1.92 -0.30 0.00 0.69 0.00 0.00 54.13 52.67 1igw s LEU 90 Cb -0.14 -2.02 -0.05 0.00 -0.43 0.00 0.00 46.19 43.55 1igw s LEU 90 CO 0.06 -0.70 0.97 -0.55 -0.29 0.00 0.00 176.35 175.83 1igw s SER 91 N 2.70 7.43 0.26 3.68 0.15 -1.26 -2.37 113.70 124.29 1igw s SER 91 Ca 0.06 1.72 0.04 0.00 0.70 0.00 0.00 55.95 58.48 1igw s SER 91 Cb -0.26 -2.58 0.34 0.00 -1.71 0.00 0.00 66.02 61.81 1igw s SER 91 CO -0.01 -0.15 1.63 1.23 1.20 0.00 0.00 173.24 177.14 1igw h GLY 92 N 6.13 0.31 0.93 9.45 0.00 -1.94 -2.49 103.07 115.46 1igw h GLY 92 Ca -0.42 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.56 1igw h GLY 92 CO 0.73 0.30 -0.09 -0.25 0.00 0.00 0.00 176.54 177.24 1igw h TRP 93 N 0.23 -0.23 -0.90 5.60 7.01 -1.95 0.44 115.95 126.16 1igw h TRP 93 Ca 0.01 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.04 1igw h TRP 93 Cb 0.95 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 28.03 1igw h TRP 93 CO 0.02 -0.08 0.58 1.96 -2.79 0.00 0.00 178.44 178.13 1igw h GLN 94 N -0.32 1.10 -0.91 2.65 4.20 -1.86 -1.95 115.11 118.02 1igw h GLN 94 Ca -0.03 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1igw h GLN 94 Cb 0.25 -0.25 -0.04 0.00 0.30 0.00 0.00 27.48 27.74 1igw h GLN 94 CO 0.04 0.73 0.53 0.28 -0.67 0.00 0.00 178.83 179.74 1igw h VAL 95 N 1.13 1.25 -0.66 -0.54 2.07 -1.14 -1.46 116.25 116.90 1igw h VAL 95 Ca 0.36 -0.57 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 1igw h VAL 95 Cb 0.01 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1igw h VAL 95 CO -0.12 0.27 0.09 0.00 0.02 0.00 0.00 177.57 177.83 1igw h ALA 96 N 1.29 0.88 -0.05 1.67 0.00 -0.59 -1.22 119.26 121.24 1igw h ALA 96 Ca 0.32 -0.28 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 1igw h ALA 96 Cb -0.03 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.52 1igw h ALA 96 CO -0.06 0.66 -0.92 0.00 0.00 0.00 0.00 179.25 178.94 1igw h ALA 97 N 1.04 0.28 0.00 0.00 0.00 -1.07 0.44 119.26 119.94 1igw h ALA 97 Ca 0.20 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1igw h ALA 97 Cb 0.47 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1igw h ALA 97 CO 0.02 0.72 -0.15 -3.47 0.00 0.00 0.00 179.25 176.37 1igw n ASP 98 N -3.85 0.00 -2.70 0.00 2.03 -0.58 -4.35 116.55 107.10 1igw n ASP 98 Ca -0.08 -1.30 -0.05 0.00 0.52 0.00 0.00 54.79 53.87 1igw n ASP 98 Cb 0.82 -0.06 0.10 0.00 -0.72 0.00 0.00 41.12 41.26 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 2.21 -2.43 -1.67 0.00 -0.55 -4.99 120.51 113.08 1igw n ALA 99 Ca 0.00 -1.58 -0.24 0.00 0.00 0.00 0.00 53.44 51.62 1igw n ALA 99 Cb 0.56 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 19.02 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 -1.68 4.54 0.00 0.00 2.20 -0.68 -4.80 114.94 114.51 1igw s ASN 100 Ca 0.19 -0.98 0.21 0.00 -0.94 0.00 0.00 52.86 51.35 1igw s ASN 100 Cb 0.42 -0.54 0.92 0.00 -2.00 0.00 0.00 41.25 40.05 1igw s ASN 100 CO -0.08 -0.50 1.68 0.18 -2.94 0.00 0.00 177.10 175.44 1igw n LEU 101 N -1.25 0.00 -0.37 3.54 4.77 -1.26 -2.11 117.00 120.32 1igw n LEU 101 Ca -0.01 0.49 0.14 0.00 -0.03 0.00 0.00 56.01 56.59 1igw n LEU 101 Cb 0.63 -0.49 0.51 0.00 -2.33 0.00 0.00 43.42 41.75 1igw n LEU 101 CO 0.45 -0.13 0.82 0.00 -1.33 0.00 0.00 177.39 177.19 1igw n ALA 102 N -1.49 2.73 -2.85 -1.18 0.00 -1.26 -4.94 120.51 111.53 1igw n ALA 102 Ca 0.05 -0.41 -0.20 0.00 0.00 0.00 0.00 53.44 52.88 1igw n ALA 102 Cb 0.24 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 -0.18 -0.88 -2.38 0.00 0.00 -0.90 -4.96 120.51 111.21 1igw n ALA 103 Ca 0.17 0.19 -0.19 0.00 0.00 0.00 0.00 53.44 53.60 1igw n ALA 103 Cb 0.34 -2.85 -0.10 0.00 0.00 0.00 0.00 19.45 16.84 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 -2.44 2.56 -0.29 0.00 0.01 -1.26 -5.04 113.70 107.24 1igw s SER 104 Ca 0.20 -0.98 -0.19 0.00 1.31 0.00 0.00 55.95 56.30 1igw s SER 104 Cb -0.10 -0.14 -0.02 0.00 0.21 0.00 0.00 66.02 65.98 1igw s SER 104 CO 0.25 -0.14 0.56 -0.32 0.41 0.00 0.00 173.24 173.99 1igw s MET 105 N -3.41 3.94 0.17 12.44 1.75 -1.26 -4.58 119.30 128.34 1igw s MET 105 Ca 0.20 0.25 0.08 0.00 -1.25 0.00 0.00 55.69 54.97 1igw s MET 105 Cb -0.02 -3.70 -0.04 0.00 2.84 0.00 0.00 34.83 33.91 1igw s MET 105 CO 0.07 -0.47 -0.17 0.71 -0.65 0.00 0.00 175.02 174.50 1igw s TYR 106 N 2.43 1.75 0.85 4.11 4.12 0.15 -4.96 117.35 125.80 1igw s TYR 106 Ca 0.22 -0.49 -0.12 0.00 0.02 0.00 0.00 57.07 56.70 1igw s TYR 106 Cb -0.15 -0.87 0.10 0.00 -1.52 0.00 0.00 41.96 39.52 1igw s TYR 106 CO 0.11 0.31 1.16 -1.25 0.02 0.00 0.00 175.55 175.90 1igw s PRO 107 N -2.91 1.62 -1.35 -1.71 0.04 -1.26 -3.14 135.00 126.29 1igw s PRO 107 Ca 0.16 0.19 -0.15 0.00 0.04 0.00 0.00 61.00 61.24 1igw s PRO 107 Cb -0.05 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.67 1igw s PRO 107 CO 0.06 -1.85 1.90 -3.47 0.04 0.00 0.00 177.00 173.68 1igw n ASP 108 N -3.51 4.60 -2.30 6.66 2.03 -1.26 -4.60 116.55 118.17 1igw n ASP 108 Ca 0.07 -2.92 -0.04 0.00 0.52 0.00 0.00 54.79 52.43 1igw n ASP 108 Cb 0.60 -1.67 0.05 0.00 -0.72 0.00 0.00 41.12 39.38 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 6.81 1.84 -4.05 -0.67 6.02 -1.26 -5.00 117.38 121.07 1igw n GLN 109 Ca 0.48 -3.39 -0.30 0.00 -0.01 0.00 0.00 57.00 53.77 1igw n GLN 109 Cb 0.42 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.18 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 -0.48 -2.20 0.07 1.08 7.64 -1.26 -4.45 113.62 114.02 1igw n SER 110 Ca 0.16 -0.97 0.12 0.00 1.01 0.00 0.00 58.87 59.18 1igw n SER 110 Cb 0.89 -3.07 0.08 0.00 -1.01 0.00 0.00 64.21 61.09 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 -4.43 0.72 -4.89 -3.43 4.77 -1.26 -4.95 117.00 103.52 1igw n LEU 111 Ca -0.10 0.20 -0.29 0.00 -0.03 0.00 0.00 56.01 55.78 1igw n LEU 111 Cb 0.58 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1igw n LEU 111 CO 0.80 -0.07 0.59 -0.72 -1.33 0.00 0.00 177.39 176.65 1igw s TYR 112 N -3.24 3.60 0.24 -1.77 -0.85 -1.26 -5.00 117.35 109.07 1igw s TYR 112 Ca 0.03 1.07 -0.31 0.00 -0.52 0.00 0.00 57.07 57.34 1igw s TYR 112 Cb 0.12 -2.53 -0.13 0.00 0.38 0.00 0.00 41.96 39.81 1igw s TYR 112 CO 0.76 -0.50 1.56 -2.30 -1.52 0.00 0.00 175.55 173.56 1igw n PRO 113 N -2.51 2.43 0.29 -3.49 -0.02 -1.26 -4.86 135.00 125.58 1igw n PRO 113 Ca 0.03 0.87 0.16 0.00 -2.02 0.00 0.00 63.50 62.54 1igw n PRO 113 Cb 0.55 -2.62 0.79 0.00 -0.02 0.00 0.00 33.50 32.19 1igw n PRO 113 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1igw h ALA 114 N 5.16 1.50 -0.50 3.55 0.00 -1.97 -1.19 119.26 125.81 1igw h ALA 114 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1igw h ALA 114 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1igw h ALA 114 CO 0.83 -0.41 0.00 0.27 0.00 0.00 0.00 179.25 179.94 1igw n ASN 115 N -3.04 3.08 -0.18 0.00 6.94 -1.26 -4.49 115.26 116.32 1igw n ASN 115 Ca -0.00 -2.12 -0.10 0.00 -0.02 0.00 0.00 54.58 52.34 1igw n ASN 115 Cb 0.44 -0.40 0.01 0.00 -2.36 0.00 0.00 39.78 37.47 1igw n ASN 115 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1igw h SER 116 N 3.02 1.00 -0.21 0.53 0.02 -1.57 -2.95 113.55 113.39 1igw h SER 116 Ca 0.00 -0.35 -0.06 0.00 -0.84 0.00 0.00 61.79 60.54 1igw h SER 116 Cb 0.85 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1igw h SER 116 CO 0.06 1.12 -0.10 0.58 -1.14 0.00 0.00 176.83 177.35 1igw h VAL 117 N 0.87 1.30 -0.37 2.27 2.07 -1.84 -2.77 116.25 117.78 1igw h VAL 117 Ca 0.14 -1.17 0.07 0.00 0.82 0.00 0.00 66.70 66.56 1igw h VAL 117 Cb 0.67 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1igw h VAL 117 CO 0.05 0.36 0.26 -0.65 0.02 0.00 0.00 177.57 177.60 1igw h PRO 118 N 0.15 0.20 -0.65 1.57 0.11 -1.87 0.54 132.00 132.05 1igw h PRO 118 Ca 0.05 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.08 1igw h PRO 118 Cb 0.60 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.63 1igw h PRO 118 CO 0.03 0.13 0.15 0.00 -0.21 0.00 0.00 178.00 178.10 1igw h ALA 119 N 1.81 0.86 -0.05 -0.75 0.00 -1.35 -0.81 119.26 118.96 1igw h ALA 119 Ca 0.17 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 1igw h ALA 119 Cb 0.41 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1igw h ALA 119 CO -0.03 0.59 -0.67 0.28 0.00 0.00 0.00 179.25 179.42 1igw h VAL 120 N 0.98 1.41 -0.43 0.00 2.07 -0.76 -2.37 116.25 117.15 1igw h VAL 120 Ca 0.20 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1igw h VAL 120 Cb 0.38 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1igw h VAL 120 CO 0.01 0.63 0.28 0.58 0.02 0.00 0.00 177.57 179.08 1igw h VAL 121 N 0.17 1.12 -0.75 2.57 2.07 -0.36 -1.22 116.25 119.86 1igw h VAL 121 Ca -0.02 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1igw h VAL 121 Cb 1.21 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1igw h VAL 121 CO 0.10 0.12 0.33 -0.08 0.02 0.00 0.00 177.57 178.06 1igw h GLU 122 N 0.58 1.09 -0.43 1.57 4.81 -1.06 -1.15 114.58 119.99 1igw h GLU 122 Ca 0.16 -0.18 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1igw h GLU 122 Cb -0.05 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 1igw h GLU 122 CO -0.03 0.87 0.26 0.00 -0.73 0.00 0.00 179.01 179.38 1igw h ARG 123 N 1.06 0.52 -0.23 1.92 3.08 -1.04 -0.24 114.38 119.44 1igw h ARG 123 Ca 0.25 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1igw h ARG 123 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1igw h ARG 123 CO -0.03 0.34 0.11 0.82 -1.07 0.00 0.00 179.97 180.14 1igw h ILE 124 N 0.54 1.15 -0.67 2.04 2.04 -0.98 -1.43 117.51 120.19 1igw h ILE 124 Ca 0.17 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.53 1igw h ILE 124 Cb -0.01 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1igw h ILE 124 CO -0.06 0.15 0.21 0.78 0.00 0.00 0.00 178.15 179.23 1igw h ASN 125 N 0.24 0.96 -0.83 1.72 2.35 -0.94 -1.21 115.58 117.86 1igw h ASN 125 Ca 0.08 -0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 1igw h ASN 125 Cb 0.14 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 1igw h ASN 125 CO -0.01 0.89 0.42 0.78 -1.65 0.00 0.00 177.43 177.86 1igw h ASN 126 N 0.99 1.08 -0.58 5.81 2.35 -0.89 0.55 115.58 124.89 1igw h ASN 126 Ca 0.22 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 1igw h ASN 126 Cb 0.27 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 1igw h ASN 126 CO -0.01 0.89 0.14 0.74 -1.65 0.00 0.00 177.43 177.55 1igw h THR 127 N 1.19 1.25 -0.53 2.81 2.02 -0.83 -1.97 112.91 116.84 1igw h THR 127 Ca 0.29 -0.90 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 1igw h THR 127 Cb 0.09 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1igw h THR 127 CO -0.04 0.33 0.32 -0.26 0.37 0.00 0.00 175.52 176.24 1igw h PHE 128 N 0.84 0.71 -0.67 3.16 0.05 -0.64 -1.99 116.94 118.40 1igw h PHE 128 Ca 0.18 -0.00 0.03 0.00 3.82 0.00 0.00 57.97 62.00 1igw h PHE 128 Cb 0.35 -0.23 -0.04 0.00 2.00 0.00 0.00 35.95 38.02 1igw h PHE 128 CO 0.02 0.49 0.42 0.00 -0.18 0.00 0.00 178.31 179.07 1igw h ARG 129 N 0.72 0.80 -0.48 1.51 3.08 -0.56 -1.30 114.38 118.15 1igw h ARG 129 Ca 0.19 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1igw h ARG 129 Cb -0.01 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 1igw h ARG 129 CO -0.04 0.53 0.22 -0.09 -1.07 0.00 0.00 179.97 179.53 1igw h ARG 130 N 0.83 0.70 -0.66 0.04 9.65 -1.11 0.21 114.38 124.04 1igw h ARG 130 Ca 0.27 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 59.02 1igw h ARG 130 Cb 0.01 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1igw h ARG 130 CO -0.10 0.60 0.35 0.00 2.80 0.00 0.00 179.97 183.62 1igw h ALA 131 N 1.06 0.85 -0.65 2.80 0.00 -1.17 0.63 119.26 122.79 1igw h ALA 131 Ca 0.16 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1igw h ALA 131 Cb 0.14 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1igw h ALA 131 CO -0.02 0.38 0.14 0.22 0.00 0.00 0.00 179.25 179.97 1igw h ASP 132 N 0.91 0.97 -0.48 0.00 3.58 -1.03 -1.75 116.42 118.61 1igw h ASP 132 Ca 0.23 -0.20 -0.07 0.00 0.42 0.00 0.00 57.03 57.41 1igw h ASP 132 Cb 0.07 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.84 1igw h ASP 132 CO -0.03 0.95 0.02 1.56 -2.88 0.00 0.00 179.24 178.86 1igw h GLN 133 N 0.98 0.84 0.02 0.28 4.20 -0.28 -0.24 115.11 120.90 1igw h GLN 133 Ca 0.20 -0.25 0.02 0.00 0.06 0.00 0.00 58.65 58.68 1igw h GLN 133 Cb 0.37 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1igw h GLN 133 CO 0.00 0.87 -0.16 0.82 -0.67 0.00 0.00 178.83 179.69 1igw h ILE 134 N 0.70 0.61 -0.45 2.54 2.04 -0.71 -0.24 117.51 122.00 1igw h ILE 134 Ca 0.14 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.02 1igw h ILE 134 Cb 0.48 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1igw h ILE 134 CO 0.02 0.00 0.26 -0.61 0.00 0.00 0.00 178.15 177.82 1igw h GLN 135 N -0.28 0.51 -0.58 2.37 4.15 -1.28 -2.55 115.11 117.45 1igw h GLN 135 Ca 0.04 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 1igw h GLN 135 Cb 0.33 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 1igw h GLN 135 CO -0.14 0.34 0.09 2.35 -1.93 0.00 0.00 178.83 179.54 1igw h TRP 136 N 0.52 1.02 0.00 3.99 2.91 -0.71 -2.22 115.95 121.46 1igw h TRP 136 Ca 0.18 -0.14 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1igw h TRP 136 Cb 0.03 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.40 1igw h TRP 136 CO -0.08 0.89 0.00 0.66 -1.03 0.00 0.00 178.44 178.88 1igw h SER 137 N 0.86 0.00 -0.09 2.65 4.64 -0.93 0.14 113.55 120.81 1igw h SER 137 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1igw h SER 137 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1igw h SER 137 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1igw n ALA 138 N -2.00 2.54 -0.97 5.18 0.00 -0.97 -4.91 120.51 119.38 1igw n ALA 138 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1igw n ALA 138 Cb 0.25 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 1.17 0.86 3.58 0.00 0.00 0.48 -4.99 105.19 106.28 1igw n GLY 139 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1igw n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1igw s ILE 140 N -3.41 3.84 0.16 -0.61 1.01 -0.86 -5.00 121.20 116.32 1igw s ILE 140 Ca 0.00 0.74 0.03 0.00 0.00 0.00 0.00 60.65 61.42 1igw s ILE 140 Cb 0.00 -4.47 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 1igw s ILE 140 CO 0.00 -1.17 0.23 -1.61 0.00 0.00 0.00 174.94 172.40 1igw s GLU 141 N 5.35 3.24 -0.45 2.79 2.02 -1.26 -4.19 118.70 126.19 1igw s GLU 141 Ca 0.51 -0.70 -0.44 0.00 0.02 0.00 0.00 54.97 54.36 1igw s GLU 141 Cb -0.10 -2.85 -0.18 0.00 0.10 0.00 0.00 34.13 31.09 1igw s GLU 141 CO 0.26 0.51 1.82 -2.30 0.02 0.00 0.00 175.26 175.56 1igw n PRO 142 N -0.48 0.27 0.00 0.39 -0.02 -1.26 -1.87 135.00 132.02 1igw n PRO 142 Ca -0.07 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 1igw n PRO 142 Cb 0.54 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 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 5.18 1.87 3.54 -1.23 0.00 -1.26 -5.11 105.19 108.18 1igw n GLY 143 Ca 0.38 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.00 4.32 0.00 1.61 3.68 -0.78 -4.98 116.67 118.51 1igw s ASP 144 Ca 0.00 -0.22 0.00 0.00 2.13 0.00 0.00 52.55 54.46 1igw s ASP 144 Cb 0.00 -0.92 0.00 0.00 -1.45 0.00 0.00 42.92 40.55 1igw s ASP 144 CO 0.00 0.29 0.34 -2.65 0.13 0.00 0.00 175.17 173.27 1igw n PRO 145 N 1.69 0.00 -0.29 4.34 -0.02 -1.26 0.13 135.00 139.58 1igw n PRO 145 Ca -0.16 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 1igw n PRO 145 Cb 0.52 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 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 -0.84 0.00 -2.41 -0.52 1.85 -1.26 -5.07 116.66 108.41 1igw n ARG 146 Ca 0.00 -0.58 -0.42 0.00 -1.00 0.00 0.00 57.85 55.85 1igw n ARG 146 Cb 0.12 -0.37 -0.02 0.00 -1.05 0.00 0.00 32.46 31.14 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 2.37 -0.17 2.89 5.04 0.12 -5.01 117.35 122.59 1igw s TYR 147 Ca 0.00 0.53 -0.17 0.00 -2.44 0.00 0.00 57.07 54.98 1igw s TYR 147 Cb 0.00 -4.39 -0.04 0.00 0.35 0.00 0.00 41.96 37.88 1igw s TYR 147 CO 0.00 -1.89 0.45 0.08 -1.34 0.00 0.00 175.55 172.84 1igw s VAL 148 N 5.72 5.18 -0.57 3.14 1.01 -1.26 -4.79 120.40 128.82 1igw s VAL 148 Ca 0.53 0.83 -0.26 0.00 0.00 0.00 0.00 61.98 63.08 1igw s VAL 148 Cb -0.11 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1igw s VAL 148 CO 0.27 0.26 1.07 -0.62 0.00 0.00 0.00 175.10 176.08 1igw s ASP 149 N 0.91 6.38 0.42 3.32 2.15 -1.26 -4.88 116.67 123.70 1igw s ASP 149 Ca 0.22 -0.16 0.25 0.00 0.43 0.00 0.00 52.55 53.29 1igw s ASP 149 Cb -0.15 -2.49 0.62 0.00 -0.30 0.00 0.00 42.92 40.59 1igw s ASP 149 CO 0.09 -1.37 1.70 1.88 -0.17 0.00 0.00 175.17 177.30 1igw h TYR 150 N 9.45 0.00 -1.08 -5.34 -1.99 -1.94 -3.42 116.97 112.65 1igw h TYR 150 Ca -0.26 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 59.79 1igw h TYR 150 Cb 1.06 0.00 -0.10 0.00 2.00 0.00 0.00 36.73 39.70 1igw h TYR 150 CO 0.98 0.00 2.01 -0.06 -0.00 0.00 0.00 178.16 181.09 1igw s PHE 151 N -3.28 2.86 0.19 4.88 0.40 -1.26 -4.87 117.98 116.91 1igw s PHE 151 Ca 0.06 -1.63 -0.29 0.00 -0.60 0.00 0.00 56.93 54.47 1igw s PHE 151 Cb 0.07 -4.69 -0.08 0.00 0.51 0.00 0.00 43.02 38.83 1igw s PHE 151 CO 0.63 -1.76 0.92 -0.51 0.70 0.00 0.00 175.22 175.19 1igw s LEU 152 N 3.91 4.60 0.49 -0.37 1.43 -1.26 -4.93 118.68 122.55 1igw s LEU 152 Ca 0.51 1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 55.23 1igw s LEU 152 Cb 0.03 -3.55 -0.07 0.00 0.03 0.00 0.00 46.19 42.63 1igw s LEU 152 CO 0.05 0.11 1.40 -2.84 0.23 0.00 0.00 176.35 175.30 1igw s PRO 153 N -0.87 3.45 -0.18 1.29 0.02 -1.26 -4.69 135.00 132.77 1igw s PRO 153 Ca 0.42 2.34 -0.02 0.00 0.02 0.00 0.00 61.00 63.76 1igw s PRO 153 Cb -0.25 -2.48 -0.01 0.00 0.02 0.00 0.00 34.50 31.77 1igw s PRO 153 CO 0.30 -0.98 -0.08 0.42 -0.33 0.00 0.00 177.00 176.34 1igw s ILE 154 N -1.24 3.29 -0.29 2.83 1.01 -1.26 -0.94 121.20 124.60 1igw s ILE 154 Ca 0.66 -0.55 -0.11 0.00 0.00 0.00 0.00 60.65 60.65 1igw s ILE 154 Cb -0.42 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 1igw s ILE 154 CO 0.53 0.47 0.19 -0.69 0.00 0.00 0.00 174.94 175.44 1igw s VAL 155 N 0.90 5.20 0.04 2.92 1.01 0.92 -0.71 120.40 130.68 1igw s VAL 155 Ca -0.02 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1igw s VAL 155 Cb -0.15 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1igw s VAL 155 CO 0.00 0.22 -0.19 0.00 0.00 0.00 0.00 175.10 175.13 1igw s ALA 156 N 1.74 2.53 -0.42 5.51 0.00 0.51 -0.49 121.76 131.14 1igw s ALA 156 Ca 0.07 -1.19 -0.28 0.00 0.00 0.00 0.00 51.96 50.55 1igw s ALA 156 Cb -0.16 -0.70 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1igw s ALA 156 CO 0.10 0.56 1.06 0.34 0.00 0.00 0.00 175.76 177.83 1igw s ASP 157 N -1.35 6.69 -0.14 0.00 -1.08 -1.00 -1.66 116.67 118.13 1igw s ASP 157 Ca 0.14 0.57 0.17 0.00 -0.52 0.00 0.00 52.55 52.90 1igw s ASP 157 Cb -0.10 -2.52 0.72 0.00 -1.46 0.00 0.00 42.92 39.55 1igw s ASP 157 CO 0.04 -1.08 1.63 0.00 0.52 0.00 0.00 175.17 176.28 1igw n ALA 158 N 7.38 3.23 -0.19 3.66 0.00 -0.46 -4.73 120.51 129.40 1igw n ALA 158 Ca 0.10 -1.72 0.00 0.00 0.00 0.00 0.00 53.44 51.83 1igw n ALA 158 Cb 0.48 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 0.86 0.00 -0.72 0.00 1.02 -1.24 -0.76 120.64 119.80 1igw n GLU 159 Ca 0.25 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.38 1igw n GLU 159 Cb 0.95 0.00 0.22 0.00 -0.02 0.00 0.00 31.44 32.59 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 9.04 3.94 -0.96 0.62 0.00 -1.26 -1.69 120.51 130.20 1igw n ALA 160 Ca 0.00 -2.79 0.00 0.00 0.00 0.00 0.00 53.44 50.65 1igw n ALA 160 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.87 0.81 3.66 0.00 0.00 0.06 -4.28 105.19 104.58 1igw n GLY 161 Ca 0.31 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.36 -2.20 0.00 1.61 3.01 -1.26 -3.01 117.46 113.24 1igw n PHE 162 Ca 0.00 0.90 0.00 0.00 1.01 0.00 0.00 57.45 59.36 1igw n PHE 162 Cb 0.00 -4.58 0.00 0.00 -0.01 0.00 0.00 39.48 34.89 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 -1.56 0.34 0.00 1.37 0.00 -1.26 -4.83 105.19 99.26 1igw n GLY 163 Ca -0.19 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.51 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 0.43 0.24 -0.02 0.00 -1.26 -4.87 105.19 99.70 1igw n GLY 164 Ca 0.00 -1.86 0.01 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.28 1.20 -0.01 1.61 -1.51 -1.94 -2.11 116.25 113.21 1igw h VAL 165 Ca 0.00 -0.90 -0.16 0.00 -1.23 0.00 0.00 66.70 64.42 1igw h VAL 165 Cb 0.00 1.23 -0.02 0.00 -2.13 0.00 0.00 31.29 30.37 1igw h VAL 165 CO 0.00 0.28 -0.72 -0.07 -1.23 0.00 0.00 177.57 175.83 1igw h LEU 166 N 0.28 0.08 -0.53 4.19 3.38 -1.95 -1.14 115.31 119.62 1igw h LEU 166 Ca 0.05 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1igw h LEU 166 Cb 0.43 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1igw h LEU 166 CO 0.03 0.77 -0.15 0.78 0.09 0.00 0.00 178.44 179.96 1igw h ASN 167 N 0.04 1.04 0.06 -0.43 4.21 -1.71 -1.17 115.58 117.64 1igw h ASN 167 Ca -0.01 -0.37 -0.14 0.00 1.21 0.00 0.00 56.30 56.99 1igw h ASN 167 Cb 1.27 -0.29 -0.01 0.00 -1.12 0.00 0.00 38.32 38.18 1igw h ASN 167 CO 0.10 1.18 -0.47 0.00 -1.29 0.00 0.00 177.43 176.94 1igw h ALA 168 N 0.90 0.84 -0.18 -0.83 0.00 -1.21 -1.66 119.26 117.12 1igw h ALA 168 Ca 0.13 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1igw h ALA 168 Cb 0.73 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1igw h ALA 168 CO 0.06 0.66 0.08 0.35 0.00 0.00 0.00 179.25 180.40 1igw h PHE 169 N 0.38 0.26 -0.31 0.00 3.57 -1.01 -0.85 116.94 118.98 1igw h PHE 169 Ca 0.02 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 1igw h PHE 169 Cb 0.97 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1igw h PHE 169 CO 0.03 0.30 -0.14 0.93 -2.23 0.00 0.00 178.31 177.20 1igw h GLU 170 N 0.15 0.55 -0.34 1.11 4.39 -1.10 -1.91 114.58 117.43 1igw h GLU 170 Ca 0.06 -0.17 -0.16 0.00 0.34 0.00 0.00 59.36 59.43 1igw h GLU 170 Cb 0.14 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1igw h GLU 170 CO -0.01 0.68 -0.44 1.25 -1.16 0.00 0.00 179.01 179.33 1igw h LEU 171 N 0.50 0.93 -0.64 1.33 5.85 -1.16 -1.94 115.31 120.19 1igw h LEU 171 Ca 0.09 -0.45 0.01 0.00 0.84 0.00 0.00 57.88 58.37 1igw h LEU 171 Cb 0.54 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1igw h LEU 171 CO 0.03 1.23 0.42 -0.03 -0.34 0.00 0.00 178.44 179.75 1igw h MET 172 N 0.69 0.84 -0.77 1.25 4.05 -0.93 -0.14 114.93 119.93 1igw h MET 172 Ca 0.04 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1igw h MET 172 Cb 1.02 -0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 31.60 1igw h MET 172 CO 0.10 0.56 0.49 -0.22 0.23 0.00 0.00 176.91 178.08 1igw h LYS 173 N 0.87 1.02 -0.29 0.39 3.64 -1.12 -1.45 116.57 119.63 1igw h LYS 173 Ca 0.23 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.43 1igw h LYS 173 Cb -0.10 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.49 1igw h LYS 173 CO -0.05 0.69 -0.28 0.00 -2.27 0.00 0.00 179.45 177.54 1igw h ALA 174 N 1.27 0.98 -0.53 5.00 0.00 -0.92 -0.55 119.26 124.50 1igw h ALA 174 Ca 0.28 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 1igw h ALA 174 Cb -0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1igw h ALA 174 CO -0.06 0.60 0.12 0.52 0.00 0.00 0.00 179.25 180.43 1igw h MET 175 N 0.51 0.86 -0.09 0.00 2.86 -0.58 -2.08 114.93 116.41 1igw h MET 175 Ca 0.07 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1igw h MET 175 Cb 0.74 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 1igw h MET 175 CO 0.06 0.82 -0.04 0.82 1.06 0.00 0.00 176.91 179.63 1igw h ILE 176 N 0.76 1.32 -0.42 -1.22 2.04 -0.86 -1.11 117.51 118.01 1igw h ILE 176 Ca 0.17 -1.05 0.05 0.00 1.00 0.00 0.00 64.86 65.03 1igw h ILE 176 Cb 0.36 1.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 1igw h ILE 176 CO 0.00 0.29 0.28 -0.33 0.00 0.00 0.00 178.15 178.40 1igw h GLU 177 N -0.19 0.36 0.00 2.37 5.08 -1.10 -1.12 114.58 119.97 1igw h GLU 177 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1igw h GLU 177 Cb 0.49 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1igw h GLU 177 CO 0.01 0.24 0.00 0.00 -1.00 0.00 0.00 179.01 178.26 1igw n ALA 178 N -2.51 2.20 0.00 3.43 0.00 -0.78 -4.92 120.51 117.92 1igw n ALA 178 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1igw n ALA 178 Cb 0.22 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 1.15 1.50 3.78 0.00 0.00 -0.42 -4.21 105.19 106.98 1igw n GLY 179 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 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 3.13 -0.15 4.61 0.00 -0.44 -4.34 121.76 122.57 1igw s ALA 180 Ca 0.00 0.70 0.20 0.00 0.00 0.00 0.00 51.96 52.86 1igw s ALA 180 Cb 0.00 -3.27 -0.14 0.00 0.00 0.00 0.00 23.12 19.71 1igw s ALA 180 CO 0.00 -0.17 0.77 0.00 0.00 0.00 0.00 175.76 176.36 1igw n ALA 181 N 0.11 2.26 -3.37 0.00 0.00 0.11 -4.65 120.51 114.96 1igw n ALA 181 Ca 0.04 -0.50 -0.15 0.00 0.00 0.00 0.00 53.44 52.83 1igw n ALA 181 Cb 0.49 -0.90 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 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 -3.15 -1.25 0.01 0.00 0.00 -0.93 -2.19 121.76 114.26 1igw s ALA 182 Ca -0.04 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.79 1igw s ALA 182 Cb 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 1igw s ALA 182 CO 0.82 -0.31 -0.09 0.08 0.00 0.00 0.00 175.76 176.26 1igw s VAL 183 N -1.16 0.73 -0.08 0.00 1.01 -0.33 -0.37 120.40 120.20 1igw s VAL 183 Ca -0.12 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1igw s VAL 183 Cb -0.03 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1igw s VAL 183 CO 0.07 0.05 -0.16 -1.38 0.00 0.00 0.00 175.10 173.67 1igw s HIS 184 N -0.54 2.69 0.03 5.22 -3.43 -0.66 -0.81 115.29 117.80 1igw s HIS 184 Ca 0.01 -0.47 0.07 0.00 -0.80 0.00 0.00 55.06 53.87 1igw s HIS 184 Cb -0.05 -1.71 -0.03 0.00 -1.43 0.00 0.00 32.58 29.36 1igw s HIS 184 CO 0.00 -0.05 -0.20 -0.06 -2.00 0.00 0.00 174.74 172.42 1igw s PHE 185 N -0.19 2.49 0.32 0.38 0.40 -0.69 -1.35 117.98 119.33 1igw s PHE 185 Ca -0.01 -0.30 0.09 0.00 -0.60 0.00 0.00 56.93 56.12 1igw s PHE 185 Cb -0.13 -1.46 -0.06 0.00 0.51 0.00 0.00 43.02 41.88 1igw s PHE 185 CO 0.03 0.20 -0.11 -1.83 0.70 0.00 0.00 175.22 174.21 1igw s GLU 186 N -1.28 1.74 -0.02 0.44 -1.05 -0.68 -0.52 118.70 117.33 1igw s GLU 186 Ca 0.13 -1.87 0.19 0.00 -0.15 0.00 0.00 54.97 53.27 1igw s GLU 186 Cb -0.10 -1.61 0.58 0.00 -0.44 0.00 0.00 34.13 32.56 1igw s GLU 186 CO 0.04 0.16 1.49 -0.40 0.95 0.00 0.00 175.26 177.49 1igw n ASP 187 N -0.72 3.85 -4.92 0.83 5.68 -1.13 -4.64 116.55 115.51 1igw n ASP 187 Ca -0.05 -2.09 -0.28 0.00 -0.50 0.00 0.00 54.79 51.87 1igw n ASP 187 Cb 0.63 -0.45 -0.03 0.00 -1.14 0.00 0.00 41.12 40.13 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 -1.16 3.52 -0.78 0.11 -2.07 -1.26 -1.98 119.66 116.04 1igw s GLN 188 Ca 0.44 -0.32 -0.07 0.00 -1.82 0.00 0.00 55.36 53.58 1igw s GLN 188 Cb 0.24 -2.86 0.20 0.00 -1.09 0.00 0.00 33.01 29.50 1igw s GLN 188 CO 0.28 0.43 0.66 -0.51 -1.32 0.00 0.00 175.29 174.84 1igw s LEU 189 N -3.15 5.88 0.53 2.60 1.43 0.85 -4.78 118.68 122.05 1igw s LEU 189 Ca 0.38 -3.02 0.19 0.00 -1.03 0.00 0.00 54.13 50.65 1igw s LEU 189 Cb -0.11 -2.01 1.36 0.00 0.03 0.00 0.00 46.19 45.46 1igw s LEU 189 CO 0.28 -0.39 2.13 0.00 0.23 0.00 0.00 176.35 178.60 1igw h ALA 190 N 7.06 2.03 0.00 4.21 0.00 -1.92 -2.19 119.26 128.44 1igw h ALA 190 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1igw h ALA 190 Cb 0.95 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1igw h ALA 190 CO 0.77 -0.12 0.00 -1.13 0.00 0.00 0.00 179.25 178.77 1igw n SER 191 N -4.42 0.28 -0.65 0.00 3.41 -1.26 -2.33 113.62 108.65 1igw n SER 191 Ca -0.01 0.59 0.06 0.00 -0.26 0.00 0.00 58.87 59.25 1igw n SER 191 Cb 0.18 -0.64 0.13 0.00 -0.26 0.00 0.00 64.21 63.62 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 -1.83 1.38 -1.64 -3.33 0.31 -0.83 -5.06 118.33 107.33 1igw n VAL 192 Ca 0.02 -2.12 -0.46 0.00 -0.01 0.00 0.00 64.34 61.77 1igw n VAL 192 Cb 0.13 0.12 -0.03 0.00 -0.91 0.00 0.00 33.84 33.15 1igw n VAL 192 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1igw n LYS 193 N -0.71 1.79 -2.50 5.55 2.85 -0.98 -4.83 118.16 119.32 1igw n LYS 193 Ca 0.13 0.64 -0.41 0.00 -1.05 0.00 0.00 58.31 57.62 1igw n LYS 193 Cb 0.78 -2.25 -0.04 0.00 -0.65 0.00 0.00 35.03 32.86 1igw n LYS 193 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1igw s LYS 194 N -0.34 4.59 0.29 -1.58 2.20 -0.67 -4.90 119.74 119.33 1igw s LYS 194 Ca 0.70 1.73 0.01 0.00 -0.36 0.00 0.00 55.97 58.05 1igw s LYS 194 Cb -0.71 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.30 1igw s LYS 194 CO 0.50 0.06 0.47 0.00 -0.36 0.00 0.00 175.35 176.02 1igw n GLY 196 N -1.48 2.19 0.00 0.00 0.00 -1.26 -4.71 105.19 99.93 1igw n GLY 196 Ca -0.06 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1igw n GLY 196 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1igw n HIS 197 N 13.20 0.00 -3.30 1.61 8.25 -1.26 -2.48 115.22 131.24 1igw n HIS 197 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1igw n HIS 197 Cb 0.00 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.16 1igw n HIS 197 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1igw n MET 198 N 0.00 -1.89 -0.40 -0.41 0.00 -1.26 -5.01 117.12 108.14 1igw n MET 198 Ca 0.00 0.91 0.00 0.00 -0.00 0.00 0.00 57.70 58.61 1igw n MET 198 Cb 0.00 -5.46 0.00 0.00 0.00 0.00 0.00 33.22 27.76 1igw n MET 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1igw n GLY 199 N -1.41 5.08 0.00 -5.12 0.00 -1.04 -5.07 105.19 97.63 1igw n GLY 199 Ca -0.07 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 43.88 1igw n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1igw n GLY 200 N 5.00 0.45 3.77 -0.02 0.00 -1.00 -4.95 105.19 108.43 1igw n GLY 200 Ca 0.00 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 1igw n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1igw s LYS 201 N -2.00 4.40 -0.19 1.61 -2.85 -1.26 -1.67 119.74 117.77 1igw s LYS 201 Ca 0.00 1.74 -0.03 0.00 -1.00 0.00 0.00 55.97 56.67 1igw s LYS 201 Cb 0.00 -2.91 -0.01 0.00 -2.06 0.00 0.00 37.83 32.84 1igw s LYS 201 CO 0.00 0.01 -0.05 0.08 0.10 0.00 0.00 175.35 175.49 1igw s VAL 202 N -1.35 3.48 0.58 1.79 1.01 -1.26 -3.97 120.40 120.68 1igw s VAL 202 Ca 0.51 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.95 1igw s VAL 202 Cb -0.29 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1igw s VAL 202 CO 0.37 0.45 0.90 -0.76 0.00 0.00 0.00 175.10 176.06 1igw s LEU 203 N 1.08 3.27 0.29 3.92 1.43 0.69 -0.11 118.68 129.26 1igw s LEU 203 Ca 0.01 0.78 0.08 0.00 -1.03 0.00 0.00 54.13 53.98 1igw s LEU 203 Cb -0.15 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 1igw s LEU 203 CO -0.00 -1.00 0.12 0.68 0.23 0.00 0.00 176.35 176.37 1igw s VAL 204 N -2.98 3.59 0.62 -1.59 -7.23 -0.84 -1.37 120.40 110.60 1igw s VAL 204 Ca 0.53 -1.67 -0.19 0.00 -1.81 0.00 0.00 61.98 58.84 1igw s VAL 204 Cb -0.11 -3.06 -0.03 0.00 0.56 0.00 0.00 36.38 33.75 1igw s VAL 204 CO 0.46 -0.29 1.25 -2.65 -0.31 0.00 0.00 175.10 173.55 1igw n PRO 205 N -1.09 1.22 -0.22 4.82 -0.02 -1.26 -4.80 135.00 133.65 1igw n PRO 205 Ca -0.05 0.47 0.03 0.00 -2.02 0.00 0.00 63.50 61.92 1igw n PRO 205 Cb 0.59 -2.48 0.14 0.00 -0.02 0.00 0.00 33.50 31.73 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 0.74 0.62 -0.85 3.45 2.02 -1.95 -1.06 112.91 115.88 1igw h THR 206 Ca -0.50 -0.10 0.09 0.00 0.77 0.00 0.00 66.41 66.67 1igw h THR 206 Cb 1.34 0.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.96 1igw h THR 206 CO 0.54 0.05 0.50 -0.61 0.37 0.00 0.00 175.52 176.37 1igw h GLN 207 N 0.30 0.82 -0.64 6.66 5.75 -1.97 -0.38 115.11 125.64 1igw h GLN 207 Ca 0.36 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.74 1igw h GLN 207 Cb 0.55 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 1igw h GLN 207 CO -0.43 0.54 0.12 0.93 -2.65 0.00 0.00 178.83 177.35 1igw h GLU 208 N 0.84 1.04 -0.21 1.69 5.08 -1.55 -1.37 114.58 120.10 1igw h GLU 208 Ca 0.41 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1igw h GLU 208 Cb 0.35 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1igw h GLU 208 CO -0.24 0.96 -0.24 0.00 -1.00 0.00 0.00 179.01 178.49 1igw h ALA 209 N 1.04 1.21 -0.33 3.43 0.00 -1.02 -2.75 119.26 120.83 1igw h ALA 209 Ca 0.20 -0.32 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1igw h ALA 209 Cb 0.41 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1igw h ALA 209 CO 0.01 0.51 -0.33 0.82 0.00 0.00 0.00 179.25 180.27 1igw h ILE 210 N 0.34 1.29 0.00 0.00 2.04 -0.77 -2.66 117.51 117.75 1igw h ILE 210 Ca 0.05 -1.50 -0.02 0.00 1.00 0.00 0.00 64.86 64.40 1igw h ILE 210 Cb 0.61 1.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1igw h ILE 210 CO 0.04 0.49 -0.09 1.56 0.00 0.00 0.00 178.15 180.15 1igw h GLN 211 N 0.58 0.00 -0.14 2.37 4.20 -1.04 -1.10 115.11 119.98 1igw h GLN 211 Ca 0.05 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.62 1igw h GLN 211 Cb 0.91 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 1igw h GLN 211 CO 0.08 0.09 -0.53 0.87 -0.67 0.00 0.00 178.83 178.68 1igw h LYS 212 N 0.00 0.40 -0.12 1.46 1.57 -1.20 0.60 116.57 119.28 1igw h LYS 212 Ca -0.00 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 58.41 1igw h LYS 212 Cb 0.17 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1igw h LYS 212 CO 0.01 0.83 -0.47 -0.07 -0.57 0.00 0.00 179.45 179.18 1igw h LEU 213 N 0.31 0.33 -0.33 2.94 3.38 -1.11 -1.27 115.31 119.56 1igw h LEU 213 Ca 0.01 -0.16 -0.20 0.00 0.09 0.00 0.00 57.88 57.63 1igw h LEU 213 Cb 1.03 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1igw h LEU 213 CO 0.09 0.76 -0.72 0.58 0.09 0.00 0.00 178.44 179.24 1igw h VAL 214 N 0.25 1.33 -0.72 1.22 2.07 -0.95 -1.21 116.25 118.24 1igw h VAL 214 Ca 0.01 -2.02 -0.05 0.00 0.82 0.00 0.00 66.70 65.46 1igw h VAL 214 Cb 0.93 2.00 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 1igw h VAL 214 CO 0.08 0.62 0.24 0.00 0.02 0.00 0.00 177.57 178.53 1igw h ALA 215 N 0.80 1.07 -0.11 1.67 0.00 -0.70 -0.83 119.26 121.15 1igw h ALA 215 Ca -0.03 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 1igw h ALA 215 Cb 1.31 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1igw h ALA 215 CO 0.13 0.64 -0.74 0.00 0.00 0.00 0.00 179.25 179.29 1igw h ALA 216 N 1.20 0.50 -0.55 0.00 0.00 -1.01 -2.68 119.26 116.71 1igw h ALA 216 Ca 0.24 -0.60 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 1igw h ALA 216 Cb 0.27 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1igw h ALA 216 CO -0.01 0.73 -0.10 -0.09 0.00 0.00 0.00 179.25 179.77 1igw h ARG 217 N 0.38 1.05 -0.27 0.00 9.65 -1.09 -1.88 114.38 122.23 1igw h ARG 217 Ca -0.04 -0.39 -0.01 0.00 -1.10 0.00 0.00 59.98 58.44 1igw h ARG 217 Cb 1.33 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.83 1igw h ARG 217 CO 0.14 1.08 0.12 1.25 2.80 0.00 0.00 179.97 185.36 1igw h LEU 218 N 0.93 0.37 -0.58 3.80 5.85 -1.15 -0.33 115.31 124.20 1igw h LEU 218 Ca 0.14 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1igw h LEU 218 Cb 0.68 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1igw h LEU 218 CO 0.05 0.40 0.36 0.00 -0.34 0.00 0.00 178.44 178.92 1igw h ALA 220 N 1.19 0.74 -0.39 0.00 0.00 -1.11 -1.66 119.26 118.03 1igw h ALA 220 Ca 0.21 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 1igw h ALA 220 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1igw h ALA 220 CO -0.04 0.09 -0.10 -0.44 0.00 0.00 0.00 179.25 178.76 1igw h ASP 221 N 0.70 0.67 -0.30 0.00 3.32 -0.63 -1.14 116.42 119.03 1igw h ASP 221 Ca 0.23 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 1igw h ASP 221 Cb 0.01 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1igw h ASP 221 CO -0.09 0.80 0.11 0.58 -1.72 0.00 0.00 179.24 178.92 1igw h VAL 222 N 0.63 1.19 0.00 -1.35 2.07 -0.42 -2.16 116.25 116.20 1igw h VAL 222 Ca 0.11 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1igw h VAL 222 Cb 0.54 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1igw h VAL 222 CO 0.03 0.20 -0.05 0.71 0.02 0.00 0.00 177.57 178.48 1igw h THR 223 N 0.34 0.17 0.00 2.57 1.35 -1.16 -3.46 112.91 112.71 1igw h THR 223 Ca 0.10 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1igw h THR 223 Cb 0.20 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1igw h THR 223 CO -0.01 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 1igw n GLY 224 N -0.25 0.46 3.45 5.82 0.00 -0.47 -4.93 105.19 109.26 1igw n GLY 224 Ca -0.00 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 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 3.33 -0.70 1.61 1.01 -0.96 -5.02 120.40 117.67 1igw s VAL 225 Ca 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.33 1igw s VAL 225 Cb 0.00 -2.39 -0.10 0.00 0.00 0.00 0.00 36.38 33.89 1igw s VAL 225 CO 0.00 0.54 3.11 -0.81 0.00 0.00 0.00 175.10 177.94 1igw n PRO 226 N 3.09 2.90 -1.73 2.72 -0.04 -1.26 -4.49 135.00 136.19 1igw n PRO 226 Ca -0.18 -1.94 -0.42 0.00 -0.04 0.00 0.00 63.50 60.92 1igw n PRO 226 Cb 0.53 -2.33 -0.01 0.00 -0.04 0.00 0.00 33.50 31.65 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 2.33 1.78 -2.76 0.52 -1.04 -1.26 -4.82 114.28 109.02 1igw n THR 227 Ca 0.56 -0.44 -0.41 0.00 -2.04 0.00 0.00 64.05 61.72 1igw n THR 227 Cb 0.57 -1.75 -0.04 0.00 -1.82 0.00 0.00 70.33 67.29 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 -1.19 4.46 -0.22 -4.42 1.02 -0.93 -4.98 118.68 112.43 1igw s LEU 228 Ca 0.57 1.71 -0.05 0.00 0.02 0.00 0.00 54.13 56.37 1igw s LEU 228 Cb -0.54 -3.53 -0.02 0.00 0.02 0.00 0.00 46.19 42.12 1igw s LEU 228 CO 0.60 -0.10 0.01 -0.22 0.02 0.00 0.00 176.35 176.66 1igw s LEU 229 N 0.24 3.23 -0.29 1.79 0.20 -1.26 -1.19 118.68 121.40 1igw s LEU 229 Ca 0.47 -0.24 -0.06 0.00 0.69 0.00 0.00 54.13 54.98 1igw s LEU 229 Cb -0.22 -1.83 0.01 0.00 -0.43 0.00 0.00 46.19 43.71 1igw s LEU 229 CO 0.28 0.02 0.06 -0.69 -0.29 0.00 0.00 176.35 175.73 1igw s VAL 230 N 1.27 3.85 -0.30 1.68 1.01 0.01 -0.64 120.40 127.28 1igw s VAL 230 Ca 0.04 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 1igw s VAL 230 Cb -0.15 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 1igw s VAL 230 CO 0.01 0.11 0.42 0.00 0.00 0.00 0.00 175.10 175.64 1igw s ALA 231 N 1.48 3.54 -0.03 5.51 0.00 -0.48 -1.71 121.76 130.08 1igw s ALA 231 Ca 0.03 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.10 1igw s ALA 231 Cb -0.17 -2.82 -0.03 0.00 0.00 0.00 0.00 23.12 20.10 1igw s ALA 231 CO 0.02 -0.86 0.00 0.50 0.00 0.00 0.00 175.76 175.42 1igw s ARG 232 N 2.16 2.84 -0.02 0.00 3.52 0.32 -0.96 118.95 126.82 1igw s ARG 232 Ca 0.16 -0.55 0.06 0.00 -0.13 0.00 0.00 55.73 55.27 1igw s ARG 232 Cb -0.16 -2.70 -0.01 0.00 -1.56 0.00 0.00 34.95 30.51 1igw s ARG 232 CO 0.11 0.65 -0.19 -0.08 -0.81 0.00 0.00 175.30 174.97 1igw s THR 233 N -1.03 1.51 -0.34 4.11 -1.32 0.05 -2.84 115.64 115.78 1igw s THR 233 Ca 0.18 -0.81 0.16 0.00 -1.21 0.00 0.00 61.69 60.00 1igw s THR 233 Cb -0.11 -1.26 0.56 0.00 -1.51 0.00 0.00 72.50 70.18 1igw s THR 233 CO 0.08 0.43 1.46 0.47 -2.21 0.00 0.00 174.62 174.85 1igw n ASP 234 N 2.63 4.09 0.02 8.08 9.92 -1.26 -1.83 116.55 138.20 1igw n ASP 234 Ca -0.15 -2.85 0.09 0.00 -0.53 0.00 0.00 54.79 51.35 1igw n ASP 234 Cb 0.53 -0.53 0.38 0.00 -0.64 0.00 0.00 41.12 40.86 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 -0.12 1.77 -0.15 2.24 0.00 -1.26 -1.84 120.51 121.15 1igw n ALA 235 Ca 0.21 -0.04 -0.08 0.00 0.00 0.00 0.00 53.44 53.53 1igw n ALA 235 Cb 0.88 -1.29 0.06 0.00 0.00 0.00 0.00 19.45 19.10 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 0.93 0.00 0.00 -0.00 -1.84 -3.27 116.42 112.25 1igw h ASP 236 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 57.03 56.73 1igw h ASP 236 Cb 0.31 -0.25 0.00 0.00 -0.00 0.00 0.00 39.33 39.39 1igw h ASP 236 CO 0.00 1.05 -1.32 0.00 -0.00 0.00 0.00 179.24 178.97 1igw n ALA 237 N -2.49 2.65 -2.63 -0.78 0.00 -1.16 -1.69 120.51 114.41 1igw n ALA 237 Ca 0.02 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.75 1igw n ALA 237 Cb 0.39 -0.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.41 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 -2.65 3.40 -0.24 0.00 0.00 -0.77 -4.87 121.76 116.63 1igw s ALA 238 Ca -0.02 0.46 0.10 0.00 0.00 0.00 0.00 51.96 52.50 1igw s ALA 238 Cb 0.08 -3.45 0.45 0.00 0.00 0.00 0.00 23.12 20.20 1igw s ALA 238 CO 0.48 -0.61 1.32 -0.40 0.00 0.00 0.00 175.76 176.55 1igw n ASP 239 N 4.93 2.01 -3.94 0.00 5.68 -1.26 -4.51 116.55 119.46 1igw n ASP 239 Ca 0.09 -3.86 -0.13 0.00 -0.50 0.00 0.00 54.79 50.39 1igw n ASP 239 Cb 0.48 -0.57 -0.13 0.00 -1.14 0.00 0.00 41.12 39.76 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 -3.25 2.08 0.06 -2.12 1.43 -1.25 -1.06 118.68 114.57 1igw s LEU 240 Ca 0.41 -0.19 0.04 0.00 -1.03 0.00 0.00 54.13 53.36 1igw s LEU 240 Cb 0.38 -0.10 -0.03 0.00 0.03 0.00 0.00 46.19 46.48 1igw s LEU 240 CO -0.04 -0.06 -0.12 -0.51 0.23 0.00 0.00 176.35 175.85 1igw s ILE 241 N -0.47 0.93 -0.16 -0.59 2.07 0.18 -0.22 121.20 122.94 1igw s ILE 241 Ca -0.03 -1.17 0.19 0.00 -1.41 0.00 0.00 60.65 58.23 1igw s ILE 241 Cb -0.04 -0.91 0.16 0.00 0.13 0.00 0.00 42.46 41.81 1igw s ILE 241 CO -0.00 -0.23 1.56 0.71 -1.91 0.00 0.00 174.94 175.07 1igw h THR 242 N 4.40 0.60 -2.90 4.00 1.35 -1.52 -0.02 112.91 118.82 1igw h THR 242 Ca -0.39 -1.71 0.01 0.00 -0.55 0.00 0.00 66.41 63.78 1igw h THR 242 Cb 1.19 2.19 -0.11 0.00 -1.73 0.00 0.00 68.15 69.69 1igw h THR 242 CO 0.41 0.32 0.25 -0.55 -0.25 0.00 0.00 175.52 175.71 1igw s SER 243 N -6.34 -0.49 -0.23 5.36 0.15 -1.26 -4.70 113.70 106.19 1igw s SER 243 Ca 0.04 -0.11 0.13 0.00 0.70 0.00 0.00 55.95 56.71 1igw s SER 243 Cb 0.08 0.59 0.51 0.00 -1.71 0.00 0.00 66.02 65.49 1igw s SER 243 CO 0.70 -0.99 1.44 -0.90 1.20 0.00 0.00 173.24 174.69 1igw n ASP 244 N -0.38 3.18 0.28 5.45 5.75 -1.26 -4.66 116.55 124.91 1igw n ASP 244 Ca -0.14 -3.37 0.16 0.00 -0.01 0.00 0.00 54.79 51.43 1igw n ASP 244 Cb 0.64 -0.59 0.80 0.00 -1.03 0.00 0.00 41.12 40.94 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 -5.82 6.02 0.58 0.00 -1.08 -1.26 -4.95 116.67 110.16 1igw s ASP 246 Ca -0.02 -0.54 0.28 0.00 -0.52 0.00 0.00 52.55 51.75 1igw s ASP 246 Cb 0.12 -2.13 1.54 0.00 -1.46 0.00 0.00 42.92 40.99 1igw s ASP 246 CO 0.54 -0.28 2.01 -0.65 0.52 0.00 0.00 175.17 177.31 1igw h PRO 247 N 8.50 0.00 0.00 4.34 0.11 -2.00 -1.13 132.00 141.82 1igw h PRO 247 Ca -0.30 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.79 1igw h PRO 247 Cb 1.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1igw h PRO 247 CO 0.65 0.00 -0.08 -0.92 -0.21 0.00 0.00 178.00 177.44 1igw h TYR 248 N 0.00 0.00 -0.01 0.65 3.20 -1.96 -2.39 116.97 116.46 1igw h TYR 248 Ca 0.16 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1igw h TYR 248 Cb 0.82 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.09 1igw h TYR 248 CO 0.00 0.08 -0.43 -0.25 -1.64 0.00 0.00 178.16 175.92 1igw n ASP 249 N -3.71 1.51 -0.29 -2.11 8.00 -0.43 -4.54 116.55 114.99 1igw n ASP 249 Ca -0.02 -1.19 0.18 0.00 0.71 0.00 0.00 54.79 54.47 1igw n ASP 249 Cb 0.19 0.38 0.47 0.00 -0.02 0.00 0.00 41.12 42.13 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 1.69 0.51 0.39 -2.24 4.64 -1.49 -0.12 113.55 116.94 1igw h SER 250 Ca 0.00 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 1igw h SER 250 Cb 0.63 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1igw h SER 250 CO 0.00 0.18 -0.06 1.05 -0.87 0.00 0.00 176.83 177.13 1igw h GLU 251 N 0.49 0.00 -0.00 4.77 4.11 -1.80 -2.31 114.58 119.84 1igw h GLU 251 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.95 1igw h GLU 251 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1igw h GLU 251 CO -0.24 0.06 -0.77 1.19 0.07 0.00 0.00 179.01 179.31 1igw n PHE 252 N -3.39 0.00 -2.63 2.06 3.01 -0.07 -4.89 117.46 111.55 1igw n PHE 252 Ca -0.02 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.01 1igw n PHE 252 Cb 0.20 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 39.57 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 -2.93 4.45 0.29 4.37 1.01 -0.87 -0.52 121.20 127.00 1igw s ILE 253 Ca 0.11 1.64 0.04 0.00 0.00 0.00 0.00 60.65 62.44 1igw s ILE 253 Cb 0.17 -4.44 0.07 0.00 0.01 0.00 0.00 42.46 38.27 1igw s ILE 253 CO 0.78 -0.56 1.73 0.74 0.00 0.00 0.00 174.94 177.63 1igw h THR 254 N 5.82 1.27 0.00 2.92 2.02 -1.69 -3.48 112.91 119.77 1igw h THR 254 Ca -0.21 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 65.68 1igw h THR 254 Cb 1.06 1.43 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1igw h THR 254 CO 1.05 0.40 0.00 0.61 0.37 0.00 0.00 175.52 177.95 1igw n GLY 255 N -0.37 1.77 3.77 2.16 0.00 -1.26 -5.07 105.19 106.19 1igw n GLY 255 Ca -0.01 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 3.44 0.09 1.61 2.02 -1.26 -4.93 118.70 119.67 1igw s GLU 256 Ca 0.00 1.74 0.08 0.00 0.02 0.00 0.00 54.97 56.81 1igw s GLU 256 Cb 0.00 -2.16 -0.03 0.00 0.10 0.00 0.00 34.13 32.03 1igw s GLU 256 CO 0.00 -0.81 -0.21 1.03 0.02 0.00 0.00 175.26 175.30 1igw s ARG 257 N -3.04 1.15 0.59 1.61 0.52 -1.26 -1.93 118.95 116.58 1igw s ARG 257 Ca 0.70 -1.13 0.05 0.00 -0.52 0.00 0.00 55.73 54.82 1igw s ARG 257 Cb -0.28 -1.39 0.08 0.00 0.52 0.00 0.00 34.95 33.88 1igw s ARG 257 CO 0.32 0.33 0.82 0.95 0.02 0.00 0.00 175.30 177.73 1igw s THR 258 N -1.12 2.38 0.30 0.02 -4.23 -0.12 -4.96 115.64 107.91 1igw s THR 258 Ca 0.06 -0.81 0.25 0.00 -1.18 0.00 0.00 61.69 60.01 1igw s THR 258 Cb -0.10 -2.57 0.25 0.00 1.34 0.00 0.00 72.50 71.42 1igw s THR 258 CO 0.04 0.00 1.95 0.77 -0.54 0.00 0.00 174.62 176.84 1igw h SER 259 N 0.01 0.00 1.37 3.99 4.64 -2.02 -2.49 113.55 119.05 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 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1igw h SER 259 CO 0.43 0.19 0.00 -0.33 -0.87 0.00 0.00 176.83 176.25 1igw h GLU 260 N 0.00 0.00 0.00 4.77 3.07 -2.03 -3.46 114.58 116.93 1igw h GLU 260 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1igw h GLU 260 Cb 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1igw h GLU 260 CO 0.02 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.04 1igw n GLY 261 N 0.70 0.78 3.79 -3.84 0.00 -0.94 -5.10 105.19 100.59 1igw n GLY 261 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.00 2.79 -0.13 1.61 2.99 -1.26 -4.75 117.98 117.23 1igw s PHE 262 Ca 0.00 1.53 -0.02 0.00 0.00 0.00 0.00 56.93 58.44 1igw s PHE 262 Cb 0.00 -3.10 -0.03 0.00 0.00 0.00 0.00 43.02 39.89 1igw s PHE 262 CO 0.00 -1.41 -0.06 -0.06 -0.00 0.00 0.00 175.22 173.69 1igw s PHE 263 N -2.35 2.97 0.50 0.36 0.40 -0.02 -0.95 117.98 118.89 1igw s PHE 263 Ca 0.66 -0.28 -0.20 0.00 -0.60 0.00 0.00 56.93 56.51 1igw s PHE 263 Cb -0.19 -1.88 -0.08 0.00 0.51 0.00 0.00 43.02 41.39 1igw s PHE 263 CO 0.38 0.02 1.04 1.03 0.70 0.00 0.00 175.22 178.40 1igw s ARG 264 N 0.08 3.72 0.17 0.44 0.52 -0.81 -0.64 118.95 122.41 1igw s ARG 264 Ca -0.02 1.34 0.01 0.00 -0.52 0.00 0.00 55.73 56.55 1igw s ARG 264 Cb -0.14 -2.08 -0.04 0.00 0.52 0.00 0.00 34.95 33.20 1igw s ARG 264 CO 0.03 -0.50 0.02 0.95 0.02 0.00 0.00 175.30 175.82 1igw s THR 265 N -2.05 0.55 -0.70 0.02 -4.23 -0.22 -1.91 115.64 107.10 1igw s THR 265 Ca 0.67 -1.97 -0.23 0.00 -1.18 0.00 0.00 61.69 58.98 1igw s THR 265 Cb -0.16 -2.12 0.06 0.00 1.34 0.00 0.00 72.50 71.62 1igw s THR 265 CO 0.23 -0.45 1.05 -1.00 -0.54 0.00 0.00 174.62 173.90 1igw s HIS 266 N -3.74 2.61 0.76 3.99 3.76 0.32 -4.70 115.29 118.30 1igw s HIS 266 Ca 0.24 -0.50 -0.11 0.00 -0.15 0.00 0.00 55.06 54.54 1igw s HIS 266 Cb 0.06 -4.37 0.05 0.00 1.11 0.00 0.00 32.58 29.43 1igw s HIS 266 CO 0.04 -1.74 1.08 0.00 -0.85 0.00 0.00 174.74 173.27 1igw s ALA 267 N 4.35 2.34 0.00 -1.40 0.00 -1.26 -4.59 121.76 121.21 1igw s ALA 267 Ca 0.26 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1igw s ALA 267 Cb -0.14 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.80 1igw s ALA 267 CO 0.10 -1.61 0.00 0.41 0.00 0.00 0.00 175.76 174.66 1igw n GLY 268 N -1.75 1.00 0.24 0.00 0.00 -0.68 -4.87 105.19 99.12 1igw n GLY 268 Ca 0.08 -1.97 0.08 0.00 0.00 0.00 0.00 46.02 44.21 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 0.93 -0.38 -0.61 2.10 -1.88 -2.30 117.51 115.37 1igw h ILE 269 Ca 0.00 -0.61 -0.04 0.00 1.08 0.00 0.00 64.86 65.29 1igw h ILE 269 Cb 0.00 1.35 -0.02 0.00 -1.09 0.00 0.00 36.82 37.06 1igw h ILE 269 CO 0.00 0.16 0.09 -0.33 -1.08 0.00 0.00 178.15 177.00 1igw h GLU 270 N 0.00 0.60 -0.65 2.19 5.08 -1.93 0.31 114.58 120.19 1igw h GLU 270 Ca -0.00 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.13 1igw h GLU 270 Cb 0.33 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 1igw h GLU 270 CO 0.02 0.64 0.07 0.37 -1.00 0.00 0.00 179.01 179.11 1igw h GLN 271 N 0.46 1.10 -0.75 2.33 4.15 -1.71 -1.30 115.11 119.39 1igw h GLN 271 Ca 0.12 -0.31 -0.02 0.00 0.77 0.00 0.00 58.65 59.21 1igw h GLN 271 Cb 0.31 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.84 1igw h GLN 271 CO 0.00 1.03 0.39 0.00 -1.93 0.00 0.00 178.83 178.32 1igw h ALA 272 N 1.04 0.97 -0.68 3.38 0.00 -1.09 -1.28 119.26 121.60 1igw h ALA 272 Ca 0.19 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1igw h ALA 272 Cb 0.48 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1igw h ALA 272 CO 0.02 0.50 0.17 0.82 0.00 0.00 0.00 179.25 180.76 1igw h ILE 273 N 1.05 1.26 -0.07 0.00 2.04 -0.13 0.72 117.51 122.38 1igw h ILE 273 Ca 0.26 -0.95 -0.09 0.00 1.00 0.00 0.00 64.86 65.09 1igw h ILE 273 Cb 0.07 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1igw h ILE 273 CO -0.04 0.36 -0.35 0.77 0.00 0.00 0.00 178.15 178.90 1igw h SER 274 N 1.02 0.14 -0.10 1.72 4.64 -0.66 -1.04 113.55 119.27 1igw h SER 274 Ca 0.22 -0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 61.32 1igw h SER 274 Cb 0.36 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1igw h SER 274 CO 0.00 0.49 -0.60 0.03 -0.87 0.00 0.00 176.83 175.88 1igw h ARG 275 N 0.12 0.58 -0.64 4.77 2.47 -0.80 -2.84 114.38 118.04 1igw h ARG 275 Ca 0.01 -0.49 0.09 0.00 -1.26 0.00 0.00 59.98 58.33 1igw h ARG 275 Cb 0.68 0.11 -0.07 0.00 -1.65 0.00 0.00 29.97 29.04 1igw h ARG 275 CO 0.05 1.12 0.27 0.78 0.56 0.00 0.00 179.97 182.75 1igw h GLY 276 N 0.20 0.92 1.24 0.04 0.00 -0.48 -0.55 103.07 104.45 1igw h GLY 276 Ca -0.05 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 1igw h GLY 276 CO 0.12 0.01 -0.14 1.41 0.00 0.00 0.00 176.54 177.94 1igw h LEU 277 N 0.47 0.88 -0.58 3.11 3.38 -1.23 -1.70 115.31 119.64 1igw h LEU 277 Ca 0.32 -0.29 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1igw h LEU 277 Cb 0.38 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1igw h LEU 277 CO -0.29 1.02 -0.36 0.00 0.09 0.00 0.00 178.44 178.90 1igw h ALA 278 N 1.05 0.76 0.00 1.53 0.00 -1.08 -3.23 119.26 118.29 1igw h ALA 278 Ca 0.12 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 1igw h ALA 278 Cb 0.66 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1igw h ALA 278 CO 0.05 0.65 -0.84 1.88 0.00 0.00 0.00 179.25 180.99 1igw h TYR 279 N 0.61 0.00 -0.98 0.00 0.99 -1.06 -3.40 116.97 113.13 1igw h TYR 279 Ca 0.06 0.00 0.22 0.00 2.00 0.00 0.00 58.73 61.01 1igw h TYR 279 Cb 0.89 0.00 -0.19 0.00 1.00 0.00 0.00 36.73 38.44 1igw h TYR 279 CO 0.05 0.67 -0.14 0.00 -0.00 0.00 0.00 178.16 178.74 1igw h ALA 280 N 1.33 0.84 0.00 3.88 0.00 -1.32 0.31 119.26 124.30 1igw h ALA 280 Ca -0.04 0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1igw h ALA 280 Cb 1.55 0.69 0.00 0.00 0.00 0.00 0.00 17.79 20.03 1igw h ALA 280 CO 0.08 -0.45 0.00 -0.35 0.00 0.00 0.00 179.25 178.53 1igw n PRO 281 N -5.57 0.14 0.00 0.00 -0.04 -1.26 -2.90 135.00 125.37 1igw n PRO 281 Ca 0.18 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 64.06 1igw n PRO 281 Cb 0.59 -1.75 0.04 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.00 0.00 -4.25 0.54 4.02 0.11 0.52 117.16 116.09 1igw n TYR 282 Ca 0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.77 1igw n TYR 282 Cb 0.23 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.45 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 -1.61 1.48 -0.19 -0.72 0.00 -1.03 -4.90 121.76 114.78 1igw s ALA 283 Ca 0.16 -1.44 0.19 0.00 0.00 0.00 0.00 51.96 50.87 1igw s ALA 283 Cb 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 1igw s ALA 283 CO 0.30 -0.04 1.08 -0.44 0.00 0.00 0.00 175.76 176.66 1igw h ASP 284 N 2.97 0.00 -4.49 0.00 3.32 -1.16 -3.46 116.42 113.60 1igw h ASP 284 Ca -0.37 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.42 1igw h ASP 284 Cb 1.19 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.51 1igw h ASP 284 CO 0.60 0.33 -0.73 -0.76 -1.72 0.00 0.00 179.24 176.96 1igw s LEU 285 N -5.81 2.16 -0.07 1.55 1.02 -0.94 -4.27 118.68 112.32 1igw s LEU 285 Ca 0.00 -0.36 0.04 0.00 0.02 0.00 0.00 54.13 53.83 1igw s LEU 285 Cb 0.08 -0.10 -0.02 0.00 0.02 0.00 0.00 46.19 46.18 1igw s LEU 285 CO 0.78 -0.14 -0.20 -0.69 0.02 0.00 0.00 176.35 176.12 1igw s VAL 286 N -0.93 2.53 -0.06 -1.59 1.01 -0.58 -1.39 120.40 119.39 1igw s VAL 286 Ca -0.07 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.02 1igw s VAL 286 Cb -0.07 -1.97 0.02 0.00 0.00 0.00 0.00 36.38 34.36 1igw s VAL 286 CO -0.00 0.57 -0.07 0.86 0.00 0.00 0.00 175.10 176.45 1igw s TRP 287 N -0.21 1.08 -0.40 5.22 -0.00 -0.14 -1.07 118.94 123.43 1igw s TRP 287 Ca -0.01 -0.38 -0.03 0.00 -0.00 0.00 0.00 56.10 55.68 1igw s TRP 287 Cb -0.13 -0.88 0.10 0.00 -0.00 0.00 0.00 33.47 32.56 1igw s TRP 287 CO 0.03 -0.26 0.19 0.00 -0.00 0.00 0.00 176.95 176.91 1igw n GLU 289 N 4.62 0.58 -4.25 0.00 -0.58 -0.76 -4.87 120.64 115.39 1igw n GLU 289 Ca -0.04 0.21 -0.17 0.00 -0.42 0.00 0.00 57.16 56.74 1igw n GLU 289 Cb 0.42 -1.78 -0.11 0.00 -0.57 0.00 0.00 31.44 29.40 1igw n GLU 289 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1igw s THR 290 N 0.30 1.30 0.00 2.62 -4.23 -1.26 -4.77 115.64 109.60 1igw s THR 290 Ca 0.88 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1igw s THR 290 Cb -1.11 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1igw s THR 290 CO 0.52 -0.52 0.44 -1.54 -0.54 0.00 0.00 174.62 172.98 1igw n SER 291 N 0.27 0.89 -3.94 3.99 3.41 -1.26 -4.73 113.62 112.25 1igw n SER 291 Ca -0.14 -0.95 -0.09 0.00 -0.26 0.00 0.00 58.87 57.43 1igw n SER 291 Cb 0.58 0.10 -0.10 0.00 -0.26 0.00 0.00 64.21 64.53 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 -0.10 0.13 -1.24 6.66 -4.23 -1.26 -4.84 115.64 110.75 1igw s THR 292 Ca 0.00 -1.03 -0.13 0.00 -1.18 0.00 0.00 61.69 59.34 1igw s THR 292 Cb 0.00 -0.71 0.15 0.00 1.34 0.00 0.00 72.50 73.28 1igw s THR 292 CO 0.00 -0.57 1.58 -0.81 -0.54 0.00 0.00 174.62 174.28 1igw n PRO 293 N 1.04 3.38 -3.65 3.99 -0.04 -1.26 -4.94 135.00 133.51 1igw n PRO 293 Ca -0.20 -3.68 -0.39 0.00 -0.04 0.00 0.00 63.50 59.19 1igw n PRO 293 Cb 0.57 -3.09 -0.10 0.00 -0.04 0.00 0.00 33.50 30.85 1igw n PRO 293 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1igw s ASP 294 N 2.66 5.51 0.40 3.54 -1.08 -1.26 -4.96 116.67 121.48 1igw s ASP 294 Ca 0.44 -1.98 0.07 0.00 -0.52 0.00 0.00 52.55 50.56 1igw s ASP 294 Cb 0.01 -1.93 0.83 0.00 -1.46 0.00 0.00 42.92 40.37 1igw s ASP 294 CO 0.01 -0.63 2.05 -0.07 0.52 0.00 0.00 175.17 177.05 1igw h LEU 295 N 8.26 0.51 -0.38 -1.34 3.38 -1.99 -1.98 115.31 121.77 1igw h LEU 295 Ca -0.17 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 1igw h LEU 295 Cb 1.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1igw h LEU 295 CO 0.79 0.37 -0.06 -0.08 0.09 0.00 0.00 178.44 179.54 1igw h GLU 296 N 0.60 0.70 -0.70 1.13 4.57 -2.00 -0.54 114.58 118.36 1igw h GLU 296 Ca 0.18 -0.26 -0.06 0.00 -1.18 0.00 0.00 59.36 58.04 1igw h GLU 296 Cb -0.03 -0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 1igw h GLU 296 CO -0.04 0.84 0.20 1.25 -1.18 0.00 0.00 179.01 180.08 1igw h LEU 297 N 0.51 1.02 -0.29 1.64 5.85 -1.90 -1.67 115.31 120.47 1igw h LEU 297 Ca 0.10 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1igw h LEU 297 Cb 0.56 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1igw h LEU 297 CO 0.03 0.96 0.15 0.00 -0.34 0.00 0.00 178.44 179.24 1igw h ALA 298 N 1.17 0.36 -0.29 1.25 0.00 -0.92 -0.48 119.26 120.34 1igw h ALA 298 Ca 0.22 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1igw h ALA 298 Cb 0.32 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1igw h ALA 298 CO -0.00 -0.24 0.12 -0.09 0.00 0.00 0.00 179.25 179.04 1igw h ARG 299 N 0.31 0.25 -0.13 0.00 2.43 -0.72 0.34 114.38 116.86 1igw h ARG 299 Ca 0.12 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1igw h ARG 299 Cb 0.04 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1igw h ARG 299 CO -0.08 0.17 0.01 -0.09 -1.51 0.00 0.00 179.97 178.47 1igw h ARG 300 N 0.26 0.06 -0.33 0.20 2.43 -1.03 0.35 114.38 116.31 1igw h ARG 300 Ca 0.13 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1igw h ARG 300 Cb 0.07 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1igw h ARG 300 CO -0.11 0.04 0.20 0.35 -1.51 0.00 0.00 179.97 178.94 1igw h PHE 301 N 0.06 0.37 -0.15 2.20 3.57 -0.86 -1.15 116.94 120.99 1igw h PHE 301 Ca 0.06 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 1igw h PHE 301 Cb 0.06 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1igw h PHE 301 CO -0.13 0.22 0.08 0.00 -2.23 0.00 0.00 178.31 176.25 1igw h ALA 302 N 1.14 0.19 -0.92 2.41 0.00 -0.33 -2.03 119.26 119.73 1igw h ALA 302 Ca 0.13 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1igw h ALA 302 Cb -0.01 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 1igw h ALA 302 CO -0.06 -0.26 0.57 1.96 0.00 0.00 0.00 179.25 181.46 1igw h GLN 303 N 0.12 0.96 -0.47 0.00 4.20 -0.19 -0.50 115.11 119.24 1igw h GLN 303 Ca 0.05 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1igw h GLN 303 Cb 0.10 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1igw h GLN 303 CO -0.01 0.64 0.14 0.00 -0.67 0.00 0.00 178.83 178.93 1igw h ALA 304 N 1.45 0.61 -0.26 3.87 0.00 -0.82 0.98 119.26 125.08 1igw h ALA 304 Ca 0.42 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1igw h ALA 304 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1igw h ALA 304 CO -0.21 0.27 0.00 0.82 0.00 0.00 0.00 179.25 180.13 1igw h ILE 305 N 0.62 1.26 0.00 0.00 1.08 -0.96 -3.17 117.51 116.34 1igw h ILE 305 Ca 0.15 -0.91 -0.05 0.00 -0.39 0.00 0.00 64.86 63.66 1igw h ILE 305 Cb 0.28 1.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.35 1igw h ILE 305 CO -0.00 0.29 -0.26 0.45 -0.69 0.00 0.00 178.15 177.94 1igw h HIS 306 N 0.24 0.00 -0.37 1.37 3.86 -0.93 0.37 115.15 119.70 1igw h HIS 306 Ca 0.07 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 1igw h HIS 306 Cb 0.42 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 1igw h HIS 306 CO 0.04 0.26 0.25 0.00 0.86 0.00 0.00 177.93 179.33 1igw h ALA 307 N 1.74 1.88 0.01 2.45 0.00 -0.77 -2.62 119.26 121.95 1igw h ALA 307 Ca -0.00 -0.02 -0.38 0.00 0.00 0.00 0.00 54.91 54.51 1igw h ALA 307 Cb 0.57 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1igw h ALA 307 CO 0.03 0.08 -2.38 1.63 0.00 0.00 0.00 179.25 178.61 1igw n LYS 308 N -4.48 0.67 -3.74 0.00 4.76 -0.89 -4.76 118.16 109.72 1igw n LYS 308 Ca 0.04 0.12 -0.28 0.00 -2.87 0.00 0.00 58.31 55.31 1igw n LYS 308 Cb 0.16 -1.55 -0.12 0.00 -1.84 0.00 0.00 35.03 31.68 1igw n LYS 308 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1igw s TYR 309 N -2.52 2.56 0.32 2.13 1.51 0.13 -5.10 117.35 116.38 1igw s TYR 309 Ca -0.25 -2.87 -0.29 0.00 -1.01 0.00 0.00 57.07 52.65 1igw s TYR 309 Cb 0.08 -2.09 -0.12 0.00 -0.11 0.00 0.00 41.96 39.72 1igw s TYR 309 CO 0.69 -0.69 1.43 -2.30 -1.11 0.00 0.00 175.55 173.58 1igw n PRO 310 N 2.65 2.38 -0.14 -1.71 -0.02 -1.00 -2.23 135.00 134.93 1igw n PRO 310 Ca 0.18 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.50 1igw n PRO 310 Cb 0.38 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 1igw n PRO 310 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1igw n GLY 311 N 1.25 2.15 3.57 -1.23 0.00 -1.26 -4.97 105.19 104.70 1igw n GLY 311 Ca 0.06 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.55 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 0.97 -2.51 1.61 3.00 -0.95 -4.89 118.16 113.38 1igw n LYS 312 Ca 0.00 0.35 -0.41 0.00 -0.00 0.00 0.00 58.31 58.25 1igw n LYS 312 Cb 0.00 -1.94 -0.04 0.00 0.00 0.00 0.00 35.03 33.05 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 0.48 4.50 0.17 3.14 1.43 -1.26 -4.97 118.68 122.18 1igw s LEU 313 Ca 0.83 2.12 0.09 0.00 -1.03 0.00 0.00 54.13 56.14 1igw s LEU 313 Cb -0.98 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 41.59 1igw s LEU 313 CO 0.49 -0.20 -0.20 -0.76 0.23 0.00 0.00 176.35 175.92 1igw s LEU 314 N -0.58 2.44 0.19 1.79 1.43 -1.15 -1.52 118.68 121.27 1igw s LEU 314 Ca 0.48 -0.86 0.11 0.00 -1.03 0.00 0.00 54.13 52.83 1igw s LEU 314 Cb -0.30 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 1igw s LEU 314 CO 0.36 0.01 -0.22 0.00 0.23 0.00 0.00 176.35 176.72 1igw s ALA 315 N -1.95 2.58 -0.02 4.21 0.00 -0.23 -2.33 121.76 124.02 1igw s ALA 315 Ca 0.17 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.52 1igw s ALA 315 Cb -0.06 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1igw s ALA 315 CO 0.08 0.44 -0.01 -0.47 0.00 0.00 0.00 175.76 175.80 1igw s TYR 316 N -1.66 0.27 0.39 0.00 5.04 -0.43 -4.33 117.35 116.63 1igw s TYR 316 Ca 0.21 -0.00 0.04 0.00 -2.44 0.00 0.00 57.07 54.88 1igw s TYR 316 Cb -0.08 -0.32 -0.06 0.00 0.35 0.00 0.00 41.96 41.85 1igw s TYR 316 CO 0.10 -0.09 0.04 0.54 -1.34 0.00 0.00 175.55 174.81 1igw s ASN 317 N 0.71 3.21 -0.06 4.32 4.22 -1.26 -1.91 114.94 124.16 1igw s ASN 317 Ca -0.07 -1.46 -0.31 0.00 -2.14 0.00 0.00 52.86 48.89 1igw s ASN 317 Cb -0.10 -0.01 0.08 0.00 1.28 0.00 0.00 41.25 42.50 1igw s ASN 317 CO -0.01 -0.64 0.73 0.00 -2.04 0.00 0.00 177.10 175.14 1igw h SER 319 N 2.89 -0.00 -2.83 0.00 4.64 -1.88 -1.44 113.55 114.92 1igw h SER 319 Ca -0.26 -0.89 -0.64 0.00 -0.47 0.00 0.00 61.79 59.53 1igw h SER 319 Cb 1.15 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.19 1igw h SER 319 CO 0.38 0.92 -0.42 -2.16 -0.87 0.00 0.00 176.83 174.67 1igw s PRO 320 N -2.40 3.53 0.10 4.77 0.04 -1.26 -0.86 135.00 138.93 1igw s PRO 320 Ca -0.18 -0.12 0.23 0.00 0.04 0.00 0.00 61.00 60.98 1igw s PRO 320 Cb -0.02 -3.12 0.14 0.00 0.04 0.00 0.00 34.50 31.54 1igw s PRO 320 CO 0.65 0.69 1.12 -1.13 0.04 0.00 0.00 177.00 178.37 1igw n SER 321 N 1.31 0.66 -4.87 6.66 3.41 -1.26 -4.95 113.62 114.59 1igw n SER 321 Ca -0.13 0.01 -0.26 0.00 -0.26 0.00 0.00 58.87 58.22 1igw n SER 321 Cb 0.53 0.54 -0.02 0.00 -0.26 0.00 0.00 64.21 65.00 1igw n SER 321 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1igw s PHE 322 N -3.22 1.89 -0.70 7.33 -0.71 -1.26 -5.07 117.98 116.23 1igw s PHE 322 Ca 0.04 -0.78 -0.19 0.00 -1.04 0.00 0.00 56.93 54.95 1igw s PHE 322 Cb 0.13 -1.92 0.11 0.00 -1.21 0.00 0.00 43.02 40.13 1igw s PHE 322 CO 0.77 -0.30 0.86 1.21 -1.34 0.00 0.00 175.22 176.43 1igw s ASN 323 N -4.18 6.32 0.39 1.98 3.84 -1.26 -4.91 114.94 117.11 1igw s ASN 323 Ca 0.34 -1.57 0.16 0.00 0.21 0.00 0.00 52.86 52.01 1igw s ASN 323 Cb -0.01 -2.34 1.04 0.00 -0.55 0.00 0.00 41.25 39.39 1igw s ASN 323 CO 0.21 -1.14 1.79 -0.50 -2.79 0.00 0.00 177.10 174.67 1igw h TRP 324 N 9.09 0.70 0.00 0.43 4.06 -1.97 0.97 115.95 129.23 1igw h TRP 324 Ca -0.16 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.81 1igw h TRP 324 Cb 1.07 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 1igw h TRP 324 CO 0.95 0.10 0.00 1.96 -3.56 0.00 0.00 178.44 177.90 1igw h GLN 325 N 0.46 0.00 0.07 0.49 4.20 -1.91 -0.68 115.11 117.73 1igw h GLN 325 Ca 0.57 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 59.03 1igw h GLN 325 Cb 1.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 1igw h GLN 325 CO -0.29 0.00 -1.15 -0.22 -0.67 0.00 0.00 178.83 176.51 1igw h LYS 326 N 0.00 0.14 0.00 1.46 3.64 -1.22 -3.35 116.57 117.24 1igw h LYS 326 Ca 0.00 -0.24 -0.18 0.00 -1.27 0.00 0.00 60.65 58.96 1igw h LYS 326 Cb 0.39 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1igw h LYS 326 CO 0.00 1.10 -1.44 0.09 -2.27 0.00 0.00 179.45 176.93 1igw n ASN 327 N -3.44 0.86 -4.17 4.20 3.02 -0.90 -5.03 115.26 109.81 1igw n ASN 327 Ca -0.05 0.38 -0.11 0.00 -0.03 0.00 0.00 54.58 54.77 1igw n ASN 327 Cb 0.99 0.14 -0.10 0.00 -0.61 0.00 0.00 39.78 40.20 1igw n ASN 327 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1igw s LEU 328 N -5.80 1.41 0.47 3.41 1.43 -0.31 -5.09 118.68 114.19 1igw s LEU 328 Ca -0.03 -1.31 -0.07 0.00 -1.03 0.00 0.00 54.13 51.70 1igw s LEU 328 Cb 0.09 0.36 -0.04 0.00 0.03 0.00 0.00 46.19 46.62 1igw s LEU 328 CO 0.81 -0.80 0.79 1.51 0.23 0.00 0.00 176.35 178.89 1igw s ASP 329 N -3.11 6.32 0.29 2.29 -4.77 -1.26 -4.57 116.67 111.86 1igw s ASP 329 Ca 0.32 0.99 -0.01 0.00 -3.30 0.00 0.00 52.55 50.56 1igw s ASP 329 Cb 0.07 -2.27 0.47 0.00 -1.09 0.00 0.00 42.92 40.10 1igw s ASP 329 CO 0.08 -0.54 1.92 0.44 0.70 0.00 0.00 175.17 177.77 1igw h ASP 330 N 0.47 0.96 -0.46 2.11 3.45 -1.96 -2.22 116.42 118.76 1igw h ASP 330 Ca -0.47 -0.00 -0.07 0.00 0.43 0.00 0.00 57.03 56.92 1igw h ASP 330 Cb 1.20 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 39.73 1igw h ASP 330 CO 0.62 0.64 0.04 0.07 -1.57 0.00 0.00 179.24 179.04 1igw h LYS 331 N 1.10 0.86 -0.20 3.56 2.10 -2.00 -1.87 116.57 120.12 1igw h LYS 331 Ca 0.37 -0.22 -0.14 0.00 -2.00 0.00 0.00 60.65 58.66 1igw h LYS 331 Cb 0.08 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.30 1igw h LYS 331 CO -0.12 0.83 -0.45 1.15 -2.00 0.00 0.00 179.45 178.86 1igw h THR 332 N 0.80 1.31 -0.28 0.07 2.02 -1.88 -2.05 112.91 112.91 1igw h THR 332 Ca 0.16 -1.65 0.00 0.00 0.77 0.00 0.00 66.41 65.70 1igw h THR 332 Cb 0.43 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.48 1igw h THR 332 CO 0.02 0.51 0.18 0.40 0.37 0.00 0.00 175.52 176.99 1igw h ILE 333 N 0.40 1.06 -0.81 3.11 2.04 -0.97 -0.37 117.51 121.97 1igw h ILE 333 Ca 0.03 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1igw h ILE 333 Cb 0.95 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 1igw h ILE 333 CO 0.08 0.07 0.53 0.00 0.00 0.00 0.00 178.15 178.83 1igw h ALA 334 N 1.11 1.03 -0.53 1.87 0.00 -1.15 -2.75 119.26 118.83 1igw h ALA 334 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1igw h ALA 334 Cb -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1igw h ALA 334 CO -0.03 0.41 0.00 -1.13 0.00 0.00 0.00 179.25 178.50 1igw n SER 335 N -4.54 3.50 -0.04 0.00 3.41 -0.79 -4.63 113.62 110.53 1igw n SER 335 Ca 0.08 -1.98 -0.09 0.00 -0.26 0.00 0.00 58.87 56.62 1igw n SER 335 Cb 0.03 -0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 63.61 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 4.16 -0.70 -0.46 7.33 3.04 -0.75 -1.49 116.94 128.07 1igw h PHE 336 Ca 0.00 0.04 -0.05 0.00 3.98 0.00 0.00 57.97 61.94 1igw h PHE 336 Cb 0.93 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.76 1igw h PHE 336 CO 0.35 -0.34 0.08 1.96 -2.02 0.00 0.00 178.31 178.34 1igw h GLN 337 N -0.27 0.71 -0.59 1.11 4.20 -1.82 -2.17 115.11 116.28 1igw h GLN 337 Ca 0.13 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1igw h GLN 337 Cb 0.48 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1igw h GLN 337 CO -0.39 0.67 0.11 0.37 -0.67 0.00 0.00 178.83 178.92 1igw h GLN 338 N 0.68 0.97 -0.65 1.46 5.75 -1.69 -2.16 115.11 119.47 1igw h GLN 338 Ca 0.15 -0.25 -0.06 0.00 -0.15 0.00 0.00 58.65 58.34 1igw h GLN 338 Cb 0.31 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1igw h GLN 338 CO 0.00 0.91 0.19 1.96 -2.65 0.00 0.00 178.83 179.25 1igw h GLN 339 N 0.87 1.02 -0.72 1.69 4.20 -0.95 -2.72 115.11 118.51 1igw h GLN 339 Ca 0.18 -0.23 0.02 0.00 0.06 0.00 0.00 58.65 58.68 1igw h GLN 339 Cb 0.40 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1igw h GLN 339 CO 0.01 0.90 0.46 -0.07 -0.67 0.00 0.00 178.83 179.46 1igw h LEU 340 N 0.95 0.79 -0.63 1.46 3.38 -1.20 -2.73 115.31 117.33 1igw h LEU 340 Ca 0.21 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1igw h LEU 340 Cb 0.31 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1igw h LEU 340 CO -0.00 0.56 0.40 -1.28 0.09 0.00 0.00 178.44 178.21 1igw h SER 341 N 0.93 0.68 0.40 -0.43 0.87 -1.16 -0.68 113.55 114.16 1igw h SER 341 Ca 0.27 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1igw h SER 341 Cb -0.05 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1igw h SER 341 CO -0.08 0.48 0.00 0.47 -0.53 0.00 0.00 176.83 177.17 1igw n ASP 342 N -4.68 0.61 0.01 6.23 8.00 -1.04 -0.96 116.55 124.71 1igw n ASP 342 Ca 0.06 0.70 0.11 0.00 0.71 0.00 0.00 54.79 56.37 1igw n ASP 342 Cb 0.05 -0.81 0.13 0.00 -0.02 0.00 0.00 41.12 40.47 1igw n ASP 342 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1igw n MET 343 N -2.23 0.07 0.00 -1.24 2.81 -0.33 -4.95 117.12 111.24 1igw n MET 343 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1igw n MET 343 Cb 0.14 -1.53 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 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 1.47 1.09 3.45 3.03 0.00 -0.13 -4.87 105.19 109.22 1igw n GLY 344 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.63 1igw n GLY 344 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1igw s TYR 345 N -2.00 3.04 -0.88 1.61 1.51 -0.75 -2.93 117.35 116.95 1igw s TYR 345 Ca 0.00 -1.24 0.26 0.00 -1.01 0.00 0.00 57.07 55.07 1igw s TYR 345 Cb 0.00 -4.28 0.60 0.00 -0.11 0.00 0.00 41.96 38.17 1igw s TYR 345 CO 0.00 -1.51 1.50 1.63 -1.11 0.00 0.00 175.55 176.05 1igw n LYS 346 N 6.75 0.10 -3.93 -0.62 4.76 -0.99 -3.89 118.16 120.35 1igw n LYS 346 Ca 0.19 0.04 -0.30 0.00 -2.87 0.00 0.00 58.31 55.36 1igw n LYS 346 Cb 0.48 -1.57 -0.15 0.00 -1.84 0.00 0.00 35.03 31.95 1igw n LYS 346 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1igw s PHE 347 N -3.06 2.61 0.07 2.13 5.36 -1.19 -0.85 117.98 123.05 1igw s PHE 347 Ca 0.10 -2.02 0.09 0.00 -0.96 0.00 0.00 56.93 54.14 1igw s PHE 347 Cb 0.16 -1.87 -0.03 0.00 -0.34 0.00 0.00 43.02 40.94 1igw s PHE 347 CO 0.67 -0.83 -0.25 -0.65 -1.46 0.00 0.00 175.22 172.70 1igw s GLN 348 N 1.32 1.57 0.07 10.12 -0.21 -0.29 -1.31 119.66 130.92 1igw s GLN 348 Ca -0.01 -1.14 -0.25 0.00 0.02 0.00 0.00 55.36 53.98 1igw s GLN 348 Cb -0.19 -1.82 0.07 0.00 1.00 0.00 0.00 33.01 32.06 1igw s GLN 348 CO -0.09 0.46 0.60 -0.59 -2.12 0.00 0.00 175.29 173.55 1igw s PHE 349 N -0.89 -0.54 -0.43 0.91 -0.12 -0.80 0.19 117.98 116.28 1igw s PHE 349 Ca 0.11 0.60 -0.09 0.00 -0.05 0.00 0.00 56.93 57.50 1igw s PHE 349 Cb -0.10 0.46 0.09 0.00 -0.63 0.00 0.00 43.02 42.84 1igw s PHE 349 CO 0.03 -0.72 0.29 0.42 -0.05 0.00 0.00 175.22 175.18 1igw s ILE 350 N -2.65 4.20 0.27 -4.49 1.01 -0.72 -2.76 121.20 116.06 1igw s ILE 350 Ca -0.04 -1.54 -0.03 0.00 0.00 0.00 0.00 60.65 59.04 1igw s ILE 350 Cb -0.01 -3.64 0.27 0.00 0.01 0.00 0.00 42.46 39.09 1igw s ILE 350 CO -0.03 -0.60 1.91 0.71 0.00 0.00 0.00 174.94 176.93 1igw h THR 351 N 6.10 1.15 -0.43 2.92 1.35 -1.34 0.11 112.91 122.77 1igw h THR 351 Ca -0.22 -0.42 -0.11 0.00 -0.55 0.00 0.00 66.41 65.12 1igw h THR 351 Cb 1.08 -0.17 -0.06 0.00 -1.73 0.00 0.00 68.15 67.27 1igw h THR 351 CO 0.79 0.22 0.06 0.18 -0.25 0.00 0.00 175.52 176.53 1igw n LEU 352 N -4.45 4.64 -0.14 3.87 4.77 -0.04 -3.90 117.00 121.76 1igw n LEU 352 Ca 0.13 -3.25 -0.08 0.00 -0.03 0.00 0.00 56.01 52.78 1igw n LEU 352 Cb 0.11 -0.63 -0.00 0.00 -2.33 0.00 0.00 43.42 40.57 1igw n LEU 352 CO 0.34 0.84 0.98 0.00 -1.33 0.00 0.00 177.39 178.23 1igw h ALA 353 N 1.92 0.52 -0.98 -1.18 0.00 -1.72 -1.88 119.26 115.96 1igw h ALA 353 Ca 0.13 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1igw h ALA 353 Cb 1.77 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 19.35 1igw h ALA 353 CO 0.42 0.06 0.63 0.78 0.00 0.00 0.00 179.25 181.14 1igw h GLY 354 N 0.53 1.39 1.42 0.00 0.00 -1.23 0.55 103.07 105.72 1igw h GLY 354 Ca 0.14 -0.53 -0.25 0.00 0.00 0.00 0.00 47.33 46.70 1igw h GLY 354 CO -0.02 0.52 -1.01 1.19 0.00 0.00 0.00 176.54 177.22 1igw h ILE 355 N 1.33 1.36 -0.42 2.60 2.10 -1.76 -1.25 117.51 121.47 1igw h ILE 355 Ca 0.36 -2.40 -0.05 0.00 1.08 0.00 0.00 64.86 63.84 1igw h ILE 355 Cb -0.13 2.44 -0.02 0.00 -1.09 0.00 0.00 36.82 38.02 1igw h ILE 355 CO -0.07 0.73 0.05 0.45 -1.08 0.00 0.00 178.15 178.22 1igw h HIS 356 N 0.28 0.76 0.11 2.19 3.86 -1.22 0.08 115.15 121.21 1igw h HIS 356 Ca -0.10 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.00 1igw h HIS 356 Cb 1.65 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 29.89 1igw h HIS 356 CO 0.08 0.74 -0.18 1.03 0.86 0.00 0.00 177.93 180.46 1igw h SER 357 N 0.55 -0.50 0.66 2.45 0.87 -0.83 -0.88 113.55 115.86 1igw h SER 357 Ca 0.12 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 1igw h SER 357 Cb 0.41 0.19 0.01 0.00 -0.44 0.00 0.00 62.40 62.57 1igw h SER 357 CO 0.01 -0.26 -0.32 -0.03 -0.53 0.00 0.00 176.83 175.70 1igw h MET 358 N -0.36 -0.85 -0.52 2.24 -1.53 -1.16 -2.30 114.93 110.45 1igw h MET 358 Ca 0.02 0.06 -0.03 0.00 -3.44 0.00 0.00 59.70 56.31 1igw h MET 358 Cb 0.37 0.19 -0.02 0.00 -0.55 0.00 0.00 31.60 31.59 1igw h MET 358 CO -0.10 -0.53 0.21 -1.49 0.14 0.00 0.00 176.91 175.15 1igw h TRP 359 N -1.04 0.79 -0.19 1.39 4.06 -1.01 -1.92 115.95 118.02 1igw h TRP 359 Ca -0.09 -0.06 -0.01 0.00 2.06 0.00 0.00 58.89 60.79 1igw h TRP 359 Cb 0.72 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.63 1igw h TRP 359 CO -0.01 0.65 0.10 0.35 -3.56 0.00 0.00 178.44 175.97 1igw h PHE 360 N 0.71 0.28 -0.10 0.49 3.57 -1.24 -2.19 116.94 118.46 1igw h PHE 360 Ca 0.18 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 1igw h PHE 360 Cb 0.19 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 1igw h PHE 360 CO 0.00 0.29 -0.23 -0.91 -2.23 0.00 0.00 178.31 175.23 1igw h ASN 361 N 0.19 0.16 -0.34 0.41 2.35 -1.34 -1.14 115.58 115.87 1igw h ASN 361 Ca 0.07 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 1igw h ASN 361 Cb 0.11 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1igw h ASN 361 CO -0.01 0.40 -0.01 -0.03 -1.65 0.00 0.00 177.43 176.13 1igw h MET 362 N 0.15 0.60 -0.16 0.81 4.05 -1.25 -1.93 114.93 117.21 1igw h MET 362 Ca 0.03 -0.20 0.02 0.00 -0.28 0.00 0.00 59.70 59.27 1igw h MET 362 Cb 0.49 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.22 1igw h MET 362 CO 0.03 0.73 0.05 0.35 0.23 0.00 0.00 176.91 178.30 1igw h PHE 363 N 0.41 0.08 -0.45 1.39 3.57 -1.01 0.16 116.94 121.10 1igw h PHE 363 Ca 0.10 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1igw h PHE 363 Cb 0.46 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1igw h PHE 363 CO 0.04 0.04 0.22 0.22 -2.23 0.00 0.00 178.31 176.60 1igw h ASP 364 N 0.12 0.31 0.04 0.41 3.58 -1.17 0.24 116.42 119.95 1igw h ASP 364 Ca 0.07 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 1igw h ASP 364 Cb 0.05 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1igw h ASP 364 CO -0.08 0.22 -0.02 0.25 -2.88 0.00 0.00 179.24 176.74 1igw h LEU 365 N 0.44 -0.04 -0.51 2.28 5.85 -1.13 -3.18 115.31 119.02 1igw h LEU 365 Ca 0.20 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.58 1igw h LEU 365 Cb 0.12 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 1igw h LEU 365 CO -0.15 0.37 0.26 0.00 -0.34 0.00 0.00 178.44 178.58 1igw h ALA 366 N 0.47 0.65 -0.52 1.25 0.00 -0.44 -1.32 119.26 119.35 1igw h ALA 366 Ca -0.01 0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1igw h ALA 366 Cb 0.43 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1igw h ALA 366 CO 0.01 -0.09 0.22 -0.97 0.00 0.00 0.00 179.25 178.42 1igw h ASN 367 N 0.51 0.26 -0.10 0.00 -1.24 -0.61 -0.04 115.58 114.35 1igw h ASN 367 Ca 0.22 0.05 -0.06 0.00 0.71 0.00 0.00 56.30 57.22 1igw h ASN 367 Cb 0.13 0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.19 1igw h ASN 367 CO -0.15 0.18 -0.19 0.00 -1.29 0.00 0.00 177.43 175.97 1igw h ALA 368 N 1.33 0.16 -0.46 1.57 0.00 -1.47 -3.30 119.26 117.09 1igw h ALA 368 Ca 0.25 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 54.87 1igw h ALA 368 Cb 0.24 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 1igw h ALA 368 CO -0.23 0.09 0.08 -0.92 0.00 0.00 0.00 179.25 178.28 1igw h TYR 369 N -0.13 0.13 0.00 0.00 3.20 -1.13 -1.75 116.97 117.30 1igw h TYR 369 Ca 0.01 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 1igw h TYR 369 Cb 0.77 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.05 1igw h TYR 369 CO 0.11 -0.01 -0.00 0.00 -1.64 0.00 0.00 178.16 176.62 1igw h ALA 370 N 1.36 1.10 0.00 1.82 0.00 -1.08 -2.51 119.26 119.94 1igw h ALA 370 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1igw h ALA 370 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1igw h ALA 370 CO -0.30 0.01 -0.65 1.96 0.00 0.00 0.00 179.25 180.26 1igw h GLN 371 N 0.00 0.00 0.00 0.00 4.20 -1.39 -3.50 115.11 114.41 1igw h GLN 371 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1igw h GLN 371 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1igw h GLN 371 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1igw n GLY 372 N 1.22 1.22 3.00 3.46 0.00 -0.95 -5.01 105.19 108.13 1igw n GLY 372 Ca 0.02 -1.99 -0.17 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.83 -2.86 -0.36 1.61 1.02 -1.26 -4.59 120.64 112.38 1igw n GLU 373 Ca 0.00 0.42 0.05 0.00 -0.02 0.00 0.00 57.16 57.61 1igw n GLU 373 Cb 0.00 -5.06 0.12 0.00 -0.02 0.00 0.00 31.44 26.48 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 -0.52 0.61 1.75 0.62 0.00 -1.88 -1.59 103.07 102.07 1igw h GLY 374 Ca -0.33 0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.25 1igw h GLY 374 CO 0.41 -0.35 -0.40 -0.33 0.00 0.00 0.00 176.54 175.86 1igw h MET 375 N -0.00 0.27 -0.63 4.80 2.86 -1.95 -2.16 114.93 118.13 1igw h MET 375 Ca 0.45 -0.13 -0.06 0.00 -2.06 0.00 0.00 59.70 57.91 1igw h MET 375 Cb 0.70 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 1igw h MET 375 CO -1.01 0.64 0.17 -0.22 1.06 0.00 0.00 176.91 177.55 1igw h LYS 376 N 0.23 0.98 -0.25 1.72 3.64 -1.67 -0.12 116.57 121.11 1igw h LYS 376 Ca 0.02 -0.21 -0.07 0.00 -1.27 0.00 0.00 60.65 59.12 1igw h LYS 376 Cb 0.82 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1igw h LYS 376 CO 0.06 0.85 -0.12 0.45 -2.27 0.00 0.00 179.45 178.42 1igw h HIS 377 N 0.94 0.60 -0.97 1.91 3.86 -1.24 0.13 115.15 120.38 1igw h HIS 377 Ca 0.20 -0.15 0.05 0.00 -1.16 0.00 0.00 60.37 59.31 1igw h HIS 377 Cb 0.30 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.57 1igw h HIS 377 CO 0.02 0.79 0.63 -0.92 0.86 0.00 0.00 177.93 179.30 1igw h TYR 378 N 0.24 1.17 -0.25 2.45 3.20 -1.19 0.32 116.97 122.91 1igw h TYR 378 Ca 0.05 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 1igw h TYR 378 Cb 0.63 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 1igw h TYR 378 CO 0.06 0.65 -0.05 0.28 -1.64 0.00 0.00 178.16 177.46 1igw h VAL 379 N 1.18 1.28 -0.09 1.81 2.07 -0.71 -1.23 116.25 120.56 1igw h VAL 379 Ca 0.40 -1.03 -0.24 0.00 0.82 0.00 0.00 66.70 66.65 1igw h VAL 379 Cb 0.07 1.45 0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1igw h VAL 379 CO -0.14 0.32 -0.89 -0.33 0.02 0.00 0.00 177.57 176.55 1igw h GLU 380 N 0.22 0.77 0.00 1.57 5.08 -0.43 -1.41 114.58 120.37 1igw h GLU 380 Ca 0.06 -0.70 -0.08 0.00 -1.00 0.00 0.00 59.36 57.64 1igw h GLU 380 Cb 0.50 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1igw h GLU 380 CO 0.02 1.29 -0.69 0.87 -1.00 0.00 0.00 179.01 179.50 1igw h LYS 381 N 0.49 0.00 0.00 2.33 1.57 -0.43 -3.41 116.57 117.12 1igw h LYS 381 Ca -0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1igw h LYS 381 Cb 1.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.84 1igw h LYS 381 CO 0.18 0.26 -0.21 0.28 -0.57 0.00 0.00 179.45 179.38 1igw n VAL 382 N -3.02 0.72 -0.09 0.50 0.31 -0.49 -4.75 118.33 111.50 1igw n VAL 382 Ca -0.01 0.24 -0.10 0.00 -0.01 0.00 0.00 64.34 64.47 1igw n VAL 382 Cb 0.68 -1.34 -0.02 0.00 -0.91 0.00 0.00 33.84 32.24 1igw n VAL 382 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1igw h GLN 383 N 0.00 0.42 -0.21 5.55 4.15 -1.49 -1.73 115.11 121.80 1igw h GLN 383 Ca 0.00 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 1igw h GLN 383 Cb 0.21 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 1igw h GLN 383 CO 0.00 0.39 0.10 0.37 -1.93 0.00 0.00 178.83 177.76 1igw h GLN 384 N 0.34 0.29 -0.69 1.69 4.15 -1.51 -1.50 115.11 117.88 1igw h GLN 384 Ca 0.10 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.50 1igw h GLN 384 Cb 0.11 -0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 1igw h GLN 384 CO -0.01 0.30 0.46 -1.35 -1.93 0.00 0.00 178.83 176.30 1igw h PRO 385 N 0.21 0.87 -0.46 -2.39 0.11 -1.78 -1.98 132.00 126.58 1igw h PRO 385 Ca 0.07 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.08 1igw h PRO 385 Cb 0.10 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 1igw h PRO 385 CO -0.01 0.58 0.08 0.93 -0.21 0.00 0.00 178.00 179.37 1igw h GLU 386 N 0.90 0.76 -0.78 1.05 5.08 -0.70 -1.23 114.58 119.66 1igw h GLU 386 Ca 0.26 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1igw h GLU 386 Cb -0.05 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 1igw h GLU 386 CO -0.06 0.77 0.37 0.74 -1.00 0.00 0.00 179.01 179.83 1igw h PHE 387 N 0.63 1.13 -0.31 4.33 0.05 -0.59 -2.29 116.94 119.89 1igw h PHE 387 Ca 0.14 -0.06 -0.06 0.00 3.82 0.00 0.00 57.97 61.81 1igw h PHE 387 Cb 0.37 -0.35 -0.02 0.00 2.00 0.00 0.00 35.95 37.96 1igw h PHE 387 CO 0.03 0.83 -0.06 0.00 -0.18 0.00 0.00 178.31 178.92 1igw h ALA 388 N 1.19 1.31 0.00 2.45 0.00 -1.14 -2.40 119.26 120.67 1igw h ALA 388 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1igw h ALA 388 Cb 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1igw h ALA 388 CO -0.03 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1igw h ALA 389 N 1.46 1.00 -0.71 0.00 0.00 -0.65 -3.29 119.26 117.06 1igw h ALA 389 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.12 1igw h ALA 389 Cb 0.41 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 1igw h ALA 389 CO 0.02 0.00 0.30 0.00 0.00 0.00 0.00 179.25 179.57 1igw h ALA 390 N 2.31 0.98 -0.55 0.00 0.00 -1.16 0.30 119.26 121.14 1igw h ALA 390 Ca 0.00 0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.16 1igw h ALA 390 Cb 0.47 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1igw h ALA 390 CO 0.00 -0.16 0.39 1.57 0.00 0.00 0.00 179.25 181.06 1igw h LYS 391 N 0.48 0.02 -0.04 0.00 2.10 -1.76 -1.65 116.57 115.72 1igw h LYS 391 Ca 0.38 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 1igw h LYS 391 Cb 0.50 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 1igw h LYS 391 CO -0.35 0.02 0.00 -0.25 -2.00 0.00 0.00 179.45 176.87 1igw n ASP 392 N -4.38 1.41 0.00 7.07 8.00 0.08 -4.91 116.55 123.83 1igw n ASP 392 Ca 0.10 -1.50 0.00 0.00 0.71 0.00 0.00 54.79 54.10 1igw n ASP 392 Cb 0.61 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 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 1.15 0.89 3.67 0.44 0.00 -0.62 -4.95 105.19 105.77 1igw n GLY 393 Ca 0.19 0.00 -0.43 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 2.67 -1.01 1.61 5.04 -1.15 -4.88 117.35 117.63 1igw s TYR 394 Ca 0.00 0.79 0.09 0.00 -2.44 0.00 0.00 57.07 55.51 1igw s TYR 394 Cb 0.00 -3.63 0.05 0.00 0.35 0.00 0.00 41.96 38.73 1igw s TYR 394 CO 0.00 -2.34 0.73 0.25 -1.34 0.00 0.00 175.55 172.85 1igw n THR 395 N 5.17 0.00 0.40 4.34 -2.24 -1.26 -4.21 114.28 116.48 1igw n THR 395 Ca 0.14 -0.48 0.04 0.00 -2.27 0.00 0.00 64.05 61.48 1igw n THR 395 Cb 0.44 1.16 0.21 0.00 -2.10 0.00 0.00 70.33 70.04 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 0.32 0.00 0.24 4.78 7.35 -1.26 -0.88 117.46 128.01 1igw n PHE 396 Ca 0.05 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.81 1igw n PHE 396 Cb 0.21 -0.28 0.58 0.00 0.35 0.00 0.00 39.48 40.34 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 1.04 -2.96 -2.13 -1.51 -1.91 -2.36 116.25 106.41 1igw h VAL 397 Ca 0.00 -0.38 -0.79 0.00 -1.23 0.00 0.00 66.70 64.30 1igw h VAL 397 Cb 0.08 1.21 -0.26 0.00 -2.13 0.00 0.00 31.29 30.19 1igw h VAL 397 CO 0.00 0.11 0.83 -1.20 -1.23 0.00 0.00 177.57 176.08 1igw n SER 398 N -4.35 5.77 0.08 4.19 7.64 -0.06 -4.89 113.62 122.01 1igw n SER 398 Ca -0.03 -3.17 0.04 0.00 1.01 0.00 0.00 58.87 56.72 1igw n SER 398 Cb 0.18 -1.37 0.44 0.00 -1.01 0.00 0.00 64.21 62.45 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 6.19 0.34 -0.29 1.43 -0.00 -1.64 -2.85 115.15 118.34 1igw h HIS 399 Ca 0.22 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.54 1igw h HIS 399 Cb 0.76 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 28.05 1igw h HIS 399 CO 0.93 0.30 0.03 1.96 -0.00 0.00 0.00 177.93 181.15 1igw h GLN 400 N 0.35 0.49 -0.66 5.12 1.08 -1.90 -3.16 115.11 116.43 1igw h GLN 400 Ca 0.09 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 1igw h GLN 400 Cb 0.13 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.48 1igw h GLN 400 CO -0.00 0.61 0.37 1.96 -0.95 0.00 0.00 178.83 180.82 1igw h GLN 401 N 0.29 0.91 -0.83 1.46 7.50 -1.94 -2.55 115.11 119.95 1igw h GLN 401 Ca 0.08 -0.10 0.15 0.00 0.50 0.00 0.00 58.65 59.28 1igw h GLN 401 Cb 0.38 -0.18 -0.09 0.00 0.05 0.00 0.00 27.48 27.63 1igw h GLN 401 CO 0.01 0.68 0.41 1.49 -1.50 0.00 0.00 178.83 179.92 1igw h GLU 402 N 0.89 0.57 -0.33 1.46 4.57 -1.47 -1.77 114.58 118.50 1igw h GLU 402 Ca 0.23 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.38 1igw h GLU 402 Cb 0.03 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.49 1igw h GLU 402 CO -0.04 0.38 0.00 1.33 -1.18 0.00 0.00 179.01 179.50 1igw n VAL 403 N -4.89 0.44 0.00 0.32 0.24 -1.17 -4.89 118.33 108.38 1igw n VAL 403 Ca 0.17 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1igw n VAL 403 Cb 0.43 0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.99 1igw n VAL 403 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1igw n GLY 404 N 0.98 0.94 0.36 7.63 0.00 -0.67 -4.99 105.19 109.44 1igw n GLY 404 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.11 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 1.22 -0.48 2.61 2.02 -1.62 0.13 112.91 116.80 1igw h THR 405 Ca 0.00 -0.43 -0.10 0.00 0.77 0.00 0.00 66.41 66.65 1igw h THR 405 Cb 0.00 -0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.23 1igw h THR 405 CO 0.00 0.23 -0.08 1.23 0.37 0.00 0.00 175.52 177.27 1igw h GLY 406 N 1.27 0.97 0.91 2.16 0.00 -1.81 -1.72 103.07 104.83 1igw h GLY 406 Ca 0.36 -0.78 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1igw h GLY 406 CO -0.09 0.71 -0.03 -1.82 0.00 0.00 0.00 176.54 175.30 1igw h TYR 407 N 0.74 -0.08 0.00 5.60 3.20 -1.76 -2.59 116.97 122.08 1igw h TYR 407 Ca 0.12 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 1igw h TYR 407 Cb 0.62 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 1igw h TYR 407 CO 0.05 0.04 -0.26 0.74 -1.64 0.00 0.00 178.16 177.08 1igw h PHE 408 N -0.19 0.00 -0.44 -3.82 -1.00 -0.89 -2.27 116.94 108.34 1igw h PHE 408 Ca -0.01 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.67 1igw h PHE 408 Cb 0.16 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.70 1igw h PHE 408 CO -0.04 0.26 -0.14 0.22 -1.61 0.00 0.00 178.31 177.00 1igw h ASP 409 N 0.00 0.82 0.01 2.17 1.82 -1.12 -0.96 116.42 119.16 1igw h ASP 409 Ca -0.00 -0.26 -0.10 0.00 -0.39 0.00 0.00 57.03 56.27 1igw h ASP 409 Cb 0.62 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.40 1igw h ASP 409 CO 0.03 0.97 -0.29 0.11 -1.61 0.00 0.00 179.24 178.45 1igw h LYS 410 N 0.73 0.42 0.16 0.28 1.57 -1.06 -0.69 116.57 117.98 1igw h LYS 410 Ca 0.12 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1igw h LYS 410 Cb 0.65 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1igw h LYS 410 CO 0.05 0.68 -0.07 0.28 -0.57 0.00 0.00 179.45 179.81 1igw h VAL 411 N 0.37 0.94 -0.33 0.50 2.07 -0.84 -1.93 116.25 117.03 1igw h VAL 411 Ca 0.05 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.21 1igw h VAL 411 Cb 0.71 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 31.62 1igw h VAL 411 CO 0.05 0.10 -0.13 0.74 0.02 0.00 0.00 177.57 178.36 1igw h THR 412 N -0.41 0.58 -0.75 2.57 2.02 -0.92 -1.25 112.91 114.75 1igw h THR 412 Ca -0.02 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1igw h THR 412 Cb 0.33 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1igw h THR 412 CO 0.03 0.00 0.49 0.74 0.37 0.00 0.00 175.52 177.15 1igw h THR 413 N -0.06 1.20 -0.29 3.16 2.02 -1.10 -1.68 112.91 116.16 1igw h THR 413 Ca 0.17 -0.37 -0.13 0.00 0.77 0.00 0.00 66.41 66.84 1igw h THR 413 Cb 0.31 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1igw h THR 413 CO -0.37 0.19 -0.33 0.40 0.37 0.00 0.00 175.52 175.77 1igw h ILE 414 N 1.02 1.30 -0.50 3.11 2.04 -0.64 0.10 117.51 123.95 1igw h ILE 414 Ca 0.27 -1.51 -0.02 0.00 1.00 0.00 0.00 64.86 64.60 1igw h ILE 414 Cb -0.10 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1igw h ILE 414 CO -0.06 0.49 0.22 0.40 0.00 0.00 0.00 178.15 179.20 1igw h ILE 415 N 0.48 1.20 -0.11 -0.67 2.04 -0.83 -1.32 117.51 118.30 1igw h ILE 415 Ca 0.04 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1igw h ILE 415 Cb 0.92 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1igw h ILE 415 CO 0.08 0.23 0.00 0.00 0.00 0.00 0.00 178.15 178.46 1igw n GLN 416 N -4.58 1.66 0.00 2.37 6.02 -0.67 -5.11 117.38 117.06 1igw n GLN 416 Ca 0.02 -0.98 0.00 0.00 -0.01 0.00 0.00 57.00 56.03 1igw n GLN 416 Cb 0.14 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 29.98 1igw n GLN 416 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46