#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o3r n TRP 46 N 0.00 0.00 -4.11 -0.14 2.14 -1.26 -4.93 117.44 109.14 2o3r n TRP 46 Ca 0.00 0.00 -0.27 0.00 2.07 0.00 0.00 57.50 59.30 2o3r n TRP 46 Cb 0.00 -0.01 -0.06 0.00 -0.81 0.00 0.00 31.31 30.42 2o3r n TRP 46 CO 0.00 0.00 0.00 1.03 2.07 0.00 0.00 177.69 180.79 2o3r s ARG 47 N -2.07 2.75 0.09 -2.67 0.52 -1.26 -5.12 118.95 111.19 2o3r s ARG 47 Ca 0.33 -0.89 0.10 0.00 -0.52 0.00 0.00 55.73 54.75 2o3r s ARG 47 Cb 0.20 -2.58 -0.03 0.00 0.52 0.00 0.00 34.95 33.06 2o3r s ARG 47 CO 0.35 0.50 -0.25 -0.65 0.02 0.00 0.00 175.30 175.27 2o3r s GLN 48 N -2.85 1.44 0.14 3.54 -0.21 -1.26 -5.04 119.66 115.42 2o3r s GLN 48 Ca 0.29 -1.20 -0.14 0.00 0.02 0.00 0.00 55.36 54.34 2o3r s GLN 48 Cb -0.10 -1.76 0.01 0.00 1.00 0.00 0.00 33.01 32.15 2o3r s GLN 48 CO 0.21 0.43 1.63 1.15 -2.12 0.00 0.00 175.29 176.59 2o3r h THR 49 N 4.06 1.25 -2.14 -0.19 2.02 -1.96 -3.47 112.91 112.49 2o3r h THR 49 Ca -0.48 -0.91 -0.59 0.00 0.77 0.00 0.00 66.41 65.20 2o3r h THR 49 Cb 1.16 0.93 -0.13 0.00 -1.74 0.00 0.00 68.15 68.37 2o3r h THR 49 CO 0.41 0.32 -0.52 0.26 0.37 0.00 0.00 175.52 176.36 2o3r s TRP 50 N -5.19 1.81 -0.65 3.16 0.52 -1.26 -5.05 118.94 112.28 2o3r s TRP 50 Ca -0.13 -1.21 0.21 0.00 0.02 0.00 0.00 56.10 54.99 2o3r s TRP 50 Cb 0.11 -1.26 -0.26 0.00 -1.15 0.00 0.00 33.47 30.91 2o3r s TRP 50 CO 0.80 -0.17 0.73 0.43 0.02 0.00 0.00 176.95 178.76 2o3r n SER 51 N -1.30 0.68 -4.96 2.95 7.64 -1.26 -4.73 113.62 112.65 2o3r n SER 51 Ca -0.09 -0.65 -0.22 0.00 1.01 0.00 0.00 58.87 58.92 2o3r n SER 51 Cb 0.65 1.34 0.02 0.00 -1.01 0.00 0.00 64.21 65.21 2o3r n SER 51 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2o3r s GLY 52 N -3.46 1.70 0.65 0.23 0.00 -0.41 -4.85 107.32 101.17 2o3r s GLY 52 Ca 0.02 -1.18 -0.18 0.00 0.00 0.00 0.00 44.72 43.39 2o3r s GLY 52 CO 0.86 -0.94 1.28 -1.05 0.00 0.00 0.00 173.10 173.24 2o3r n PRO 53 N -2.23 1.10 -1.68 2.90 -0.02 -1.26 -2.16 135.00 131.64 2o3r n PRO 53 Ca 0.05 0.43 -0.30 0.00 -2.02 0.00 0.00 63.50 61.66 2o3r n PRO 53 Cb 0.59 -2.52 0.22 0.00 -0.02 0.00 0.00 33.50 31.77 2o3r n PRO 53 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2o3r s GLY 54 N -1.38 1.76 0.27 -1.23 0.00 -1.24 -2.08 107.32 103.42 2o3r s GLY 54 Ca 0.83 -1.27 -0.30 0.00 0.00 0.00 0.00 44.72 43.97 2o3r s GLY 54 CO 0.40 -0.40 1.34 2.41 0.00 0.00 0.00 173.10 176.86 2o3r n THR 55 N -4.18 1.28 -1.73 0.90 -1.04 -0.36 -4.70 114.28 104.45 2o3r n THR 55 Ca 0.17 -0.32 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 2o3r n THR 55 Cb 0.59 -1.44 -0.00 0.00 -1.82 0.00 0.00 70.33 67.66 2o3r n THR 55 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2o3r n THR 56 N 1.38 1.92 -1.61 12.58 -1.04 -0.44 -4.70 114.28 122.37 2o3r n THR 56 Ca 0.10 -0.48 -0.50 0.00 -2.04 0.00 0.00 64.05 61.13 2o3r n THR 56 Cb 0.32 -1.76 -0.05 0.00 -1.82 0.00 0.00 70.33 67.02 2o3r n THR 56 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2o3r n LYS 57 N 0.62 1.42 -2.15 -2.82 4.81 -1.26 -1.72 118.16 117.07 2o3r n LYS 57 Ca 0.04 0.51 -0.15 0.00 -0.87 0.00 0.00 58.31 57.84 2o3r n LYS 57 Cb 0.37 -2.19 -0.02 0.00 0.02 0.00 0.00 35.03 33.22 2o3r n LYS 57 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2o3r n ARG 58 N 2.74 -1.15 -0.14 1.64 1.74 -1.26 -4.92 116.66 115.30 2o3r n ARG 58 Ca 0.18 0.76 -0.07 0.00 -0.77 0.00 0.00 57.85 57.95 2o3r n ARG 58 Cb 0.22 -5.05 -0.01 0.00 -1.02 0.00 0.00 32.46 26.60 2o3r n ARG 58 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2o3r h PHE 59 N 0.00 -0.91 -0.26 -1.55 3.57 -1.69 0.13 116.94 116.23 2o3r h PHE 59 Ca -0.34 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.20 2o3r h PHE 59 Cb 1.21 0.46 -0.01 0.00 2.79 0.00 0.00 35.95 40.41 2o3r h PHE 59 CO 0.40 -0.38 0.09 -1.35 -2.23 0.00 0.00 178.31 174.84 2o3r h PRO 60 N -0.23 0.39 -0.90 6.41 0.11 -1.91 0.31 132.00 136.18 2o3r h PRO 60 Ca 0.19 -0.08 0.08 0.00 0.11 0.00 0.00 66.00 66.31 2o3r h PRO 60 Cb 0.54 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.52 2o3r h PRO 60 CO -0.57 0.44 0.55 0.93 -0.21 0.00 0.00 178.00 179.14 2o3r h GLU 61 N 0.26 0.93 -0.39 1.05 3.07 -1.81 -1.86 114.58 115.82 2o3r h GLU 61 Ca 0.08 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 2o3r h GLU 61 Cb 0.20 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 2o3r h GLU 61 CO -0.01 0.61 0.19 1.15 -1.40 0.00 0.00 179.01 179.56 2o3r h THR 62 N 0.95 1.17 -0.21 1.13 2.02 -0.06 -0.28 112.91 117.63 2o3r h THR 62 Ca 0.42 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2o3r h THR 62 Cb 0.30 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 2o3r h THR 62 CO -0.22 0.18 0.04 0.58 0.37 0.00 0.00 175.52 176.48 2o3r h VAL 63 N 0.49 1.22 -0.42 3.16 2.07 -0.80 -0.30 116.25 121.68 2o3r h VAL 63 Ca 0.13 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2o3r h VAL 63 Cb 0.11 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2o3r h VAL 63 CO -0.02 0.22 0.22 0.25 0.02 0.00 0.00 177.57 178.26 2o3r h LEU 64 N 0.16 0.53 -1.17 2.57 5.85 -1.24 -0.69 115.31 121.31 2o3r h LEU 64 Ca 0.07 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 2o3r h LEU 64 Cb 0.29 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2o3r h LEU 64 CO 0.00 0.48 0.25 0.00 -0.34 0.00 0.00 178.44 178.83 2o3r h ALA 65 N 1.07 1.35 -0.41 1.25 0.00 -0.73 -0.07 119.26 121.72 2o3r h ALA 65 Ca 0.14 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2o3r h ALA 65 Cb 0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2o3r h ALA 65 CO -0.02 0.49 -0.05 0.00 0.00 0.00 0.00 179.25 179.67 2o3r h ARG 66 N 0.82 0.69 -0.14 0.00 3.08 -0.71 0.18 114.38 118.30 2o3r h ARG 66 Ca 0.20 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 2o3r h ARG 66 Cb 0.13 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2o3r h ARG 66 CO -0.02 0.74 -0.02 0.00 -1.07 0.00 0.00 179.97 179.60 2o3r h VAL 68 N -0.04 0.91 -0.41 0.00 2.07 -0.79 -1.61 116.25 116.38 2o3r h VAL 68 Ca 0.04 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 2o3r h VAL 68 Cb 0.43 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2o3r h VAL 68 CO 0.01 0.00 0.25 0.50 0.02 0.00 0.00 177.57 178.35 2o3r h LYS 69 N 0.01 0.55 -0.55 1.57 3.64 -0.78 -0.97 116.57 120.04 2o3r h LYS 69 Ca 0.05 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2o3r h LYS 69 Cb 0.07 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 2o3r h LYS 69 CO -0.10 0.41 0.30 -0.92 -2.27 0.00 0.00 179.45 176.87 2o3r h TYR 70 N 0.54 0.55 0.00 1.91 3.20 -0.57 -0.55 116.97 122.06 2o3r h TYR 70 Ca 0.15 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2o3r h TYR 70 Cb -0.01 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2o3r h TYR 70 CO -0.04 0.28 -0.17 1.79 -1.64 0.00 0.00 178.16 178.38 2o3r h THR 71 N 0.58 0.38 -0.00 1.81 1.35 -0.88 0.51 112.91 116.65 2o3r h THR 71 Ca 0.24 -1.09 -0.00 0.00 -0.55 0.00 0.00 66.41 65.01 2o3r h THR 71 Cb 0.12 1.82 -0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2o3r h THR 71 CO -0.15 0.17 0.00 -0.33 -0.25 0.00 0.00 175.52 174.96 2o3r h GLU 72 N 0.00 0.00 0.00 4.72 5.08 -0.05 -3.28 114.58 121.05 2o3r h GLU 72 Ca -0.00 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 2o3r h GLU 72 Cb 0.81 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2o3r h GLU 72 CO 0.02 0.21 -0.65 0.82 -1.00 0.00 0.00 179.01 178.41 2o3r h ILE 73 N -0.20 1.36 -3.31 3.13 2.04 -0.60 -3.38 117.51 116.54 2o3r h ILE 73 Ca 0.00 -2.30 -0.64 0.00 1.00 0.00 0.00 64.86 62.92 2o3r h ILE 73 Cb 0.21 2.28 -0.41 0.00 -0.74 0.00 0.00 36.82 38.16 2o3r h ILE 73 CO -0.00 0.64 -0.65 -1.00 0.00 0.00 0.00 178.15 177.14 2o3r s HIS 74 N -3.36 3.00 0.61 1.37 3.76 0.17 -4.95 115.29 115.89 2o3r s HIS 74 Ca -0.00 -3.07 0.31 0.00 -0.15 0.00 0.00 55.06 52.15 2o3r s HIS 74 Cb 0.11 -2.67 1.75 0.00 1.11 0.00 0.00 32.58 32.88 2o3r s HIS 74 CO 0.76 -0.74 2.12 -1.35 -0.85 0.00 0.00 174.74 174.68 2o3r h PRO 75 N 6.50 0.00 0.00 8.40 0.11 -1.76 0.03 132.00 145.29 2o3r h PRO 75 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2o3r h PRO 75 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2o3r h PRO 75 CO 0.66 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.60 2o3r n GLU 76 N -3.63 0.42 -0.48 1.05 0.00 -1.26 -2.33 120.64 114.41 2o3r n GLU 76 Ca 0.01 0.06 0.06 0.00 0.00 0.00 0.00 57.16 57.29 2o3r n GLU 76 Cb 0.29 -1.50 0.24 0.00 0.00 0.00 0.00 31.44 30.47 2o3r n GLU 76 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 2o3r n MET 77 N -1.20 2.53 0.00 3.44 2.81 -0.00 -4.63 117.12 120.08 2o3r n MET 77 Ca 0.12 -2.88 0.12 0.00 -1.81 0.00 0.00 57.70 53.25 2o3r n MET 77 Cb 0.14 -1.81 0.53 0.00 -0.71 0.00 0.00 33.22 31.37 2o3r n MET 77 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2o3r n ARG 78 N -0.73 0.04 0.00 0.03 1.74 -0.99 -2.69 116.66 114.07 2o3r n ARG 78 Ca 0.23 0.08 0.12 0.00 -0.77 0.00 0.00 57.85 57.51 2o3r n ARG 78 Cb 0.90 -1.50 0.71 0.00 -1.02 0.00 0.00 32.46 31.55 2o3r n ARG 78 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 2o3r n HIS 79 N -1.47 0.00 -2.79 -1.55 1.44 -1.26 -4.78 115.22 104.81 2o3r n HIS 79 Ca 0.07 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.38 2o3r n HIS 79 Cb 0.27 -0.09 -0.06 0.00 0.12 0.00 0.00 29.99 30.24 2o3r n HIS 79 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2o3r s VAL 80 N -2.18 4.15 -0.36 0.61 1.01 -1.09 -5.03 120.40 117.51 2o3r s VAL 80 Ca 0.34 2.02 -0.11 0.00 0.00 0.00 0.00 61.98 64.23 2o3r s VAL 80 Cb 0.17 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.27 2o3r s VAL 80 CO 0.32 0.49 0.19 -0.62 0.00 0.00 0.00 175.10 175.48 2o3r s ASP 81 N -1.09 5.68 0.35 3.32 3.68 -1.26 -4.97 116.67 122.38 2o3r s ASP 81 Ca 0.40 -0.90 0.10 0.00 2.13 0.00 0.00 52.55 54.28 2o3r s ASP 81 Cb -0.25 -2.01 0.66 0.00 -1.45 0.00 0.00 42.92 39.87 2o3r s ASP 81 CO 0.31 -0.34 1.81 0.00 0.13 0.00 0.00 175.17 177.08 2o3r h GLN 83 N 0.11 0.78 -0.75 0.00 5.75 -1.95 -0.32 115.11 118.72 2o3r h GLN 83 Ca 0.01 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.38 2o3r h GLN 83 Cb 0.63 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 29.01 2o3r h GLN 83 CO 0.05 0.65 0.44 0.77 -2.65 0.00 0.00 178.83 178.09 2o3r h SER 84 N 0.73 0.91 -0.13 -0.69 0.02 -1.76 -0.01 113.55 112.62 2o3r h SER 84 Ca 0.18 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2o3r h SER 84 Cb 0.14 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2o3r h SER 84 CO -0.02 0.71 0.04 0.58 -1.14 0.00 0.00 176.83 177.00 2o3r h VAL 85 N 1.04 1.18 -0.74 2.27 2.07 -0.83 -0.06 116.25 121.19 2o3r h VAL 85 Ca 0.27 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 2o3r h VAL 85 Cb -0.02 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 2o3r h VAL 85 CO -0.05 0.16 0.38 -0.25 0.02 0.00 0.00 177.57 177.84 2o3r h TRP 86 N 0.03 1.04 -0.93 1.57 2.91 -0.64 -1.48 115.95 118.44 2o3r h TRP 86 Ca 0.04 -0.04 0.03 0.00 1.13 0.00 0.00 58.89 60.05 2o3r h TRP 86 Cb 0.22 -0.33 -0.05 0.00 -0.51 0.00 0.00 29.16 28.49 2o3r h TRP 86 CO -0.00 0.75 0.61 -0.44 -1.03 0.00 0.00 178.44 178.33 2o3r h ASP 87 N 1.03 1.03 -0.28 2.65 3.32 -0.74 0.97 116.42 124.40 2o3r h ASP 87 Ca 0.26 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.21 2o3r h ASP 87 Cb 0.08 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2o3r h ASP 87 CO -0.04 0.72 -0.08 0.00 -1.72 0.00 0.00 179.24 178.12 2o3r h ALA 88 N 1.37 1.12 -0.00 3.45 0.00 -0.65 -1.27 119.26 123.28 2o3r h ALA 88 Ca 0.36 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2o3r h ALA 88 Cb -0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2o3r h ALA 88 CO -0.11 0.55 -0.00 0.35 0.00 0.00 0.00 179.25 180.04 2o3r h PHE 89 N 0.62 0.00 -0.70 0.00 3.04 -0.61 -2.64 116.94 116.66 2o3r h PHE 89 Ca 0.11 -0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.14 2o3r h PHE 89 Cb 0.51 -0.00 -0.06 0.00 2.56 0.00 0.00 35.95 38.96 2o3r h PHE 89 CO 0.02 0.49 0.37 -0.22 -2.02 0.00 0.00 178.31 176.96 2o3r h LYS 90 N -0.49 0.64 0.00 1.11 3.64 -0.82 -1.61 116.57 119.04 2o3r h LYS 90 Ca 0.00 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2o3r h LYS 90 Cb 0.49 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2o3r h LYS 90 CO 0.00 0.43 -0.08 0.78 -2.27 0.00 0.00 179.45 178.30 2o3r h GLY 91 N 0.66 0.00 2.00 5.01 0.00 -1.08 0.68 103.07 110.35 2o3r h GLY 91 Ca 0.33 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.59 2o3r h GLY 91 CO -0.22 0.00 -0.33 0.00 0.00 0.00 0.00 176.54 175.99 2o3r h ALA 92 N 1.92 1.35 0.00 3.60 0.00 -0.92 -3.38 119.26 121.83 2o3r h ALA 92 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2o3r h ALA 92 Cb 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2o3r h ALA 92 CO 0.01 0.41 -0.38 1.97 0.00 0.00 0.00 179.25 181.26 2o3r n PHE 93 N -3.98 0.00 -2.29 0.00 1.16 -0.89 -4.79 117.46 106.67 2o3r n PHE 93 Ca -0.02 0.00 -0.39 0.00 -1.87 0.00 0.00 57.45 55.18 2o3r n PHE 93 Cb 0.38 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.23 2o3r n PHE 93 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2o3r s ILE 94 N -0.85 3.13 0.00 1.97 -1.09 0.18 -2.29 121.20 122.25 2o3r s ILE 94 Ca 0.00 0.99 0.00 0.00 -2.23 0.00 0.00 60.65 59.41 2o3r s ILE 94 Cb 0.00 -3.57 0.00 0.00 -1.58 0.00 0.00 42.46 37.31 2o3r s ILE 94 CO 0.00 0.13 0.00 -1.20 -1.23 0.00 0.00 174.94 172.64 2o3r n SER 95 N 0.28 0.00 -4.88 3.58 7.64 -1.19 -4.94 113.62 114.11 2o3r n SER 95 Ca 0.03 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.62 2o3r n SER 95 Cb 0.46 -0.23 -0.04 0.00 -1.01 0.00 0.00 64.21 63.39 2o3r n SER 95 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2o3r s LYS 96 N -0.02 3.26 0.15 1.43 1.02 -0.97 -3.91 119.74 120.70 2o3r s LYS 96 Ca 0.00 -0.59 -0.31 0.00 0.02 0.00 0.00 55.97 55.09 2o3r s LYS 96 Cb 0.00 -2.90 -0.08 0.00 -0.52 0.00 0.00 37.83 34.32 2o3r s LYS 96 CO 0.00 0.56 1.35 -1.58 -0.92 0.00 0.00 175.35 174.76 2o3r s HIS 97 N -1.59 3.25 -2.00 3.18 5.65 -1.26 -3.33 115.29 119.19 2o3r s HIS 97 Ca 0.33 1.07 0.12 0.00 0.25 0.00 0.00 55.06 56.82 2o3r s HIS 97 Cb -0.12 -3.65 0.69 0.00 -1.18 0.00 0.00 32.58 28.32 2o3r s HIS 97 CO 0.26 -2.16 1.29 -0.35 -0.65 0.00 0.00 174.74 173.13 2o3r n PRO 98 N 3.41 0.80 -0.10 2.88 -0.04 -1.26 -1.15 135.00 139.54 2o3r n PRO 98 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 2o3r n PRO 98 Cb 0.43 -1.22 0.15 0.00 -0.04 0.00 0.00 33.50 32.81 2o3r n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2o3r n ASP 100 N 1.22 1.83 -4.78 0.00 8.00 -0.30 -4.38 116.55 118.13 2o3r n ASP 100 Ca 0.15 -3.49 -0.36 0.00 0.71 0.00 0.00 54.79 51.79 2o3r n ASP 100 Cb 0.53 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.11 2o3r n ASP 100 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2o3r s ILE 101 N -2.86 3.86 0.14 0.53 -1.09 -0.55 -4.92 121.20 116.32 2o3r s ILE 101 Ca 0.35 1.42 0.05 0.00 -2.23 0.00 0.00 60.65 60.24 2o3r s ILE 101 Cb 0.33 -3.73 -0.04 0.00 -1.58 0.00 0.00 42.46 37.44 2o3r s ILE 101 CO -0.04 0.00 -0.10 0.42 -1.23 0.00 0.00 174.94 173.99 2o3r s THR 102 N -1.69 1.18 0.50 2.92 -4.23 -1.26 -4.78 115.64 108.28 2o3r s THR 102 Ca 0.57 -2.02 0.24 0.00 -1.18 0.00 0.00 61.69 59.30 2o3r s THR 102 Cb -0.20 -1.81 0.29 0.00 1.34 0.00 0.00 72.50 72.12 2o3r s THR 102 CO 0.26 -0.72 2.14 -0.33 -0.54 0.00 0.00 174.62 175.43 2o3r h GLU 103 N 2.86 0.00 -0.03 3.99 5.08 -1.97 -2.03 114.58 122.48 2o3r h GLU 103 Ca -0.37 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.91 2o3r h GLU 103 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 2o3r h GLU 103 CO 0.62 0.07 -0.36 0.93 -1.00 0.00 0.00 179.01 179.27 2o3r h GLU 104 N 0.00 0.06 -0.03 2.33 5.08 -2.00 -1.29 114.58 118.73 2o3r h GLU 104 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2o3r h GLU 104 Cb 0.16 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2o3r h GLU 104 CO 0.01 0.41 0.02 -0.44 -1.00 0.00 0.00 179.01 178.01 2o3r h ASP 105 N 0.05 0.03 -0.08 1.42 3.32 -1.70 -2.22 116.42 117.25 2o3r h ASP 105 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2o3r h ASP 105 Cb 0.66 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2o3r h ASP 105 CO 0.05 0.02 0.00 -1.22 -1.72 0.00 0.00 179.24 176.37 2o3r n TYR 106 N -4.53 0.07 -0.22 4.55 4.02 -0.50 -4.19 117.16 116.36 2o3r n TYR 106 Ca -0.03 -0.04 -0.05 0.00 -0.01 0.00 0.00 57.90 57.77 2o3r n TYR 106 Cb 0.09 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.46 2o3r n TYR 106 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2o3r h GLN 107 N 3.82 0.83 -0.76 -0.72 1.08 -1.26 0.72 115.11 118.82 2o3r h GLN 107 Ca 0.00 -0.05 0.05 0.00 -1.45 0.00 0.00 58.65 57.20 2o3r h GLN 107 Cb 0.82 -0.19 -0.06 0.00 -0.05 0.00 0.00 27.48 28.00 2o3r h GLN 107 CO 0.00 0.55 0.46 -1.35 -0.95 0.00 0.00 178.83 177.54 2o3r h PRO 108 N 0.85 0.83 -0.46 1.46 0.11 -1.79 0.53 132.00 133.53 2o3r h PRO 108 Ca 0.24 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.20 2o3r h PRO 108 Cb -0.08 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.83 2o3r h PRO 108 CO -0.06 0.55 -0.10 1.25 -0.21 0.00 0.00 178.00 179.43 2o3r h LEU 109 N 0.85 0.89 -0.84 2.35 5.85 -1.68 -0.86 115.31 121.87 2o3r h LEU 109 Ca 0.33 -0.36 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 2o3r h LEU 109 Cb 0.14 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2o3r h LEU 109 CO -0.16 1.04 0.21 0.24 -0.34 0.00 0.00 178.44 179.42 2o3r h MET 110 N 0.72 1.07 -0.10 1.25 2.86 -0.16 -0.63 114.93 119.94 2o3r h MET 110 Ca 0.12 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 2o3r h MET 110 Cb 0.65 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 2o3r h MET 110 CO 0.04 0.92 0.05 0.87 1.06 0.00 0.00 176.91 179.85 2o3r h LYS 111 N 1.03 0.14 -0.96 1.72 1.57 -0.63 -2.07 116.57 117.38 2o3r h LYS 111 Ca 0.22 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2o3r h LYS 111 Cb 0.30 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 2o3r h LYS 111 CO -0.01 0.19 0.63 -0.07 -0.57 0.00 0.00 179.45 179.63 2o3r h LEU 112 N 0.05 1.09 -2.70 2.94 3.38 -0.91 -2.88 115.31 116.29 2o3r h LEU 112 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2o3r h LEU 112 Cb 0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2o3r h LEU 112 CO -0.00 0.79 0.02 0.61 0.09 0.00 0.00 178.44 179.94 2o3r n GLY 113 N -1.39 2.52 3.66 0.83 0.00 -0.26 -4.93 105.19 105.61 2o3r n GLY 113 Ca 0.11 -0.61 -0.58 0.00 0.00 0.00 0.00 46.02 44.95 2o3r n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2o3r n THR 114 N 0.37 0.13 -3.74 2.61 -1.04 -0.78 -4.72 114.28 107.11 2o3r n THR 114 Ca 0.19 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.05 62.05 2o3r n THR 114 Cb 0.89 -0.86 -0.12 0.00 -1.82 0.00 0.00 70.33 68.42 2o3r n THR 114 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2o3r s GLN 115 N 2.13 0.28 -0.23 -2.82 0.74 -1.26 -5.10 119.66 113.40 2o3r s GLN 115 Ca 0.94 0.51 -0.06 0.00 0.05 0.00 0.00 55.36 56.80 2o3r s GLN 115 Cb -1.12 -0.00 -0.03 0.00 1.10 0.00 0.00 33.01 32.96 2o3r s GLN 115 CO 0.61 -0.11 0.04 0.99 -0.55 0.00 0.00 175.29 176.27 2o3r s THR 116 N 0.85 4.13 0.03 -0.34 2.01 -1.26 -5.08 115.64 115.98 2o3r s THR 116 Ca -0.06 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.73 2o3r s THR 116 Cb -0.07 -2.90 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 2o3r s THR 116 CO -0.06 0.38 -0.01 0.68 -0.69 0.00 0.00 174.62 174.93 2o3r s VAL 117 N 1.36 4.06 0.07 3.82 -7.23 -1.26 -5.04 120.40 116.18 2o3r s VAL 117 Ca 0.05 -0.74 -0.34 0.00 -1.81 0.00 0.00 61.98 59.14 2o3r s VAL 117 Cb -0.15 -2.84 -0.13 0.00 0.56 0.00 0.00 36.38 33.82 2o3r s VAL 117 CO 0.02 0.30 1.70 -2.65 -0.31 0.00 0.00 175.10 174.16 2o3r n PRO 118 N 1.15 2.19 0.12 4.82 -0.02 -1.26 -4.81 135.00 137.19 2o3r n PRO 118 Ca -0.13 0.79 0.04 0.00 -2.02 0.00 0.00 63.50 62.18 2o3r n PRO 118 Cb 0.52 -2.60 0.45 0.00 -0.02 0.00 0.00 33.50 31.86 2o3r n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2o3r n ASN 120 N -4.39 0.00 -0.67 0.00 6.94 -1.25 -1.12 115.26 114.78 2o3r n ASN 120 Ca -0.00 -1.37 0.08 0.00 -0.02 0.00 0.00 54.58 53.27 2o3r n ASN 120 Cb 0.17 0.00 0.22 0.00 -2.36 0.00 0.00 39.78 37.82 2o3r n ASN 120 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2o3r n LYS 121 N -0.75 2.37 -3.30 -3.83 4.76 -0.64 -4.70 118.16 112.08 2o3r n LYS 121 Ca 0.11 -2.79 -0.38 0.00 -2.87 0.00 0.00 58.31 52.37 2o3r n LYS 121 Cb 0.05 -1.74 -0.06 0.00 -1.84 0.00 0.00 35.03 31.44 2o3r n LYS 121 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2o3r s ILE 122 N -2.88 5.17 -0.34 -0.18 1.01 -1.25 -0.82 121.20 121.92 2o3r s ILE 122 Ca 0.39 0.99 -0.02 0.00 0.00 0.00 0.00 60.65 62.02 2o3r s ILE 122 Cb 0.33 -3.83 0.07 0.00 0.01 0.00 0.00 42.46 39.03 2o3r s ILE 122 CO 0.06 0.33 0.07 -0.22 0.00 0.00 0.00 174.94 175.18 2o3r s LEU 123 N 0.59 4.36 0.49 2.97 2.96 0.14 -2.35 118.68 127.84 2o3r s LEU 123 Ca 0.27 -1.54 -0.04 0.00 -0.22 0.00 0.00 54.13 52.60 2o3r s LEU 123 Cb -0.15 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.77 2o3r s LEU 123 CO 0.11 -0.35 0.77 -0.76 -1.32 0.00 0.00 176.35 174.80 2o3r s LEU 124 N 1.21 3.58 -0.06 -0.68 1.43 -0.16 -4.11 118.68 119.88 2o3r s LEU 124 Ca -0.00 0.72 -0.28 0.00 -1.03 0.00 0.00 54.13 53.53 2o3r s LEU 124 Cb -0.21 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.46 2o3r s LEU 124 CO -0.02 -0.69 0.63 -1.66 0.23 0.00 0.00 176.35 174.84 2o3r s TRP 125 N -2.73 -0.60 -0.07 0.29 1.48 -1.26 -1.99 118.94 114.06 2o3r s TRP 125 Ca 0.48 1.07 0.00 0.00 -1.06 0.00 0.00 56.10 56.60 2o3r s TRP 125 Cb -0.10 0.36 0.02 0.00 -1.16 0.00 0.00 33.47 32.59 2o3r s TRP 125 CO 0.43 -0.56 -0.06 0.45 -4.06 0.00 0.00 176.95 173.15 2o3r s SER 126 N -1.08 1.59 0.00 -2.66 0.15 -1.15 -4.90 113.70 105.65 2o3r s SER 126 Ca -0.10 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.35 2o3r s SER 126 Cb -0.01 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.68 2o3r s SER 126 CO 0.08 -0.09 0.00 0.54 1.20 0.00 0.00 173.24 174.98 2o3r n ARG 127 N 4.52 -0.40 -2.80 5.44 5.12 -1.26 -4.22 116.66 123.06 2o3r n ARG 127 Ca -0.17 0.10 -0.12 0.00 -1.93 0.00 0.00 57.85 55.73 2o3r n ARG 127 Cb 0.51 -3.39 0.01 0.00 -1.16 0.00 0.00 32.46 28.43 2o3r n ARG 127 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 2o3r n ILE 128 N -2.65 0.71 0.00 0.55 0.13 -1.26 -4.74 119.36 112.09 2o3r n ILE 128 Ca 0.00 -3.48 -0.11 0.00 -1.10 0.00 0.00 62.75 58.06 2o3r n ILE 128 Cb 0.10 0.40 -0.05 0.00 -0.84 0.00 0.00 39.64 39.25 2o3r n ILE 128 CO 0.00 0.00 0.00 0.50 2.80 0.00 0.00 176.55 179.85 2o3r h LYS 129 N 3.00 0.11 0.16 9.51 3.64 -1.96 -2.99 116.57 128.03 2o3r h LYS 129 Ca -0.04 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2o3r h LYS 129 Cb 1.12 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.91 2o3r h LYS 129 CO 0.50 0.07 -0.13 -0.44 -2.27 0.00 0.00 179.45 177.19 2o3r h ASP 130 N 0.12 -0.35 -0.44 4.20 3.32 -2.00 -2.93 116.42 118.34 2o3r h ASP 130 Ca 0.03 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2o3r h ASP 130 Cb -0.01 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2o3r h ASP 130 CO -0.01 -0.21 0.19 0.25 -1.72 0.00 0.00 179.24 177.74 2o3r h LEU 131 N -0.31 0.63 -0.46 1.55 6.46 -1.98 -0.98 115.31 120.21 2o3r h LEU 131 Ca -0.00 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.61 2o3r h LEU 131 Cb 0.28 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.03 2o3r h LEU 131 CO -0.02 0.57 0.01 0.00 -0.62 0.00 0.00 178.44 178.39 2o3r h ALA 132 N 1.52 0.62 -0.25 1.25 0.00 -1.41 0.19 119.26 121.19 2o3r h ALA 132 Ca 0.17 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2o3r h ALA 132 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2o3r h ALA 132 CO -0.02 0.41 -0.47 0.45 0.00 0.00 0.00 179.25 179.63 2o3r h HIS 133 N 0.67 0.96 -0.26 0.00 3.86 -1.45 -0.96 115.15 117.96 2o3r h HIS 133 Ca 0.13 -0.34 -0.02 0.00 -1.16 0.00 0.00 60.37 58.99 2o3r h HIS 133 Cb 0.48 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.76 2o3r h HIS 133 CO 0.04 1.14 0.09 1.96 0.86 0.00 0.00 177.93 182.02 2o3r h GLN 134 N 0.50 0.36 0.19 2.45 4.20 -0.99 -0.36 115.11 121.47 2o3r h GLN 134 Ca 0.01 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2o3r h GLN 134 Cb 1.07 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.78 2o3r h GLN 134 CO 0.10 0.31 -0.09 0.35 -0.67 0.00 0.00 178.83 178.84 2o3r h PHE 135 N 0.36 -0.24 0.00 2.96 3.04 -0.12 -2.93 116.94 120.01 2o3r h PHE 135 Ca 0.09 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.04 2o3r h PHE 135 Cb 0.09 0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.68 2o3r h PHE 135 CO 0.00 0.10 0.00 0.25 -2.02 0.00 0.00 178.31 176.65 2o3r n THR 136 N -5.05 0.89 0.05 4.41 -2.24 -0.41 -0.76 114.28 111.17 2o3r n THR 136 Ca -0.09 0.22 -0.06 0.00 -2.27 0.00 0.00 64.05 61.85 2o3r n THR 136 Cb 0.24 -1.02 0.13 0.00 -2.10 0.00 0.00 70.33 67.59 2o3r n THR 136 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2o3r h GLN 137 N 0.00 0.37 0.07 -0.78 1.08 -0.88 -3.33 115.11 111.64 2o3r h GLN 137 Ca 0.00 -0.21 -0.22 0.00 -1.45 0.00 0.00 58.65 56.77 2o3r h GLN 137 Cb 0.31 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.75 2o3r h GLN 137 CO 0.00 0.78 -1.14 0.28 -0.95 0.00 0.00 178.83 177.81 2o3r h VAL 138 N 0.30 1.14 -3.61 -0.54 2.07 -1.29 -3.40 116.25 110.92 2o3r h VAL 138 Ca 0.01 -2.35 -0.78 0.00 0.82 0.00 0.00 66.70 64.40 2o3r h VAL 138 Cb 0.98 2.73 -0.28 0.00 -1.52 0.00 0.00 31.29 33.19 2o3r h VAL 138 CO 0.08 0.60 0.28 -1.58 0.02 0.00 0.00 177.57 176.97 2o3r s GLN 139 N -2.41 3.90 0.00 1.57 2.00 0.06 -4.80 119.66 119.98 2o3r s GLN 139 Ca -0.22 -3.01 0.18 0.00 -2.00 0.00 0.00 55.36 50.32 2o3r s GLN 139 Cb 0.03 -4.44 1.08 0.00 0.80 0.00 0.00 33.01 30.49 2o3r s GLN 139 CO 0.72 -1.25 1.51 0.54 -0.50 0.00 0.00 175.29 176.30 2o3r n ARG 140 N 3.02 0.69 0.08 1.67 5.12 -1.25 -1.44 116.66 124.55 2o3r n ARG 140 Ca 0.20 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 56.04 2o3r n ARG 140 Cb 0.41 -1.41 -0.06 0.00 -1.16 0.00 0.00 32.46 30.23 2o3r n ARG 140 CO 0.00 0.00 0.00 0.22 -1.93 0.00 0.00 177.63 175.92 2o3r h ASP 141 N 0.00 0.17 -2.77 0.55 -0.00 -1.87 -3.47 116.42 109.04 2o3r h ASP 141 Ca 0.00 -0.16 -0.58 0.00 -0.00 0.00 0.00 57.03 56.28 2o3r h ASP 141 Cb 0.00 -0.05 -0.05 0.00 -0.00 0.00 0.00 39.33 39.23 2o3r h ASP 141 CO 0.00 1.05 -0.51 -0.04 -0.00 0.00 0.00 179.24 179.73 2o3r s MET 142 N -2.94 3.25 -0.14 0.28 -1.94 -0.52 -4.90 119.30 112.39 2o3r s MET 142 Ca -0.01 -0.63 0.01 0.00 -1.71 0.00 0.00 55.69 53.35 2o3r s MET 142 Cb 0.10 -2.88 0.02 0.00 2.01 0.00 0.00 34.83 34.07 2o3r s MET 142 CO 0.83 0.54 -0.16 -0.06 -0.01 0.00 0.00 175.02 176.17 2o3r s PHE 143 N -1.63 2.21 0.72 -0.03 0.08 0.00 -4.80 117.98 114.52 2o3r s PHE 143 Ca 0.33 -1.19 -0.03 0.00 0.12 0.00 0.00 56.93 56.16 2o3r s PHE 143 Cb -0.12 -1.59 0.11 0.00 -0.57 0.00 0.00 43.02 40.85 2o3r s PHE 143 CO 0.26 -0.62 1.00 0.95 -0.10 0.00 0.00 175.22 176.71 2o3r s THR 144 N 1.28 2.23 0.28 0.64 -4.23 -1.26 0.25 115.64 114.83 2o3r s THR 144 Ca 0.01 -0.48 -0.01 0.00 -1.18 0.00 0.00 61.69 60.03 2o3r s THR 144 Cb -0.14 -2.75 0.28 0.00 1.34 0.00 0.00 72.50 71.23 2o3r s THR 144 CO -0.08 0.00 1.88 0.25 -0.54 0.00 0.00 174.62 176.13 2o3r h LEU 145 N -0.57 0.99 0.00 4.79 5.85 -1.98 -0.74 115.31 123.65 2o3r h LEU 145 Ca -0.40 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2o3r h LEU 145 Cb 1.28 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.11 2o3r h LEU 145 CO 0.45 0.61 0.00 -0.62 -0.34 0.00 0.00 178.44 178.55 2o3r n GLU 146 N -4.52 0.22 0.00 1.25 4.71 -1.26 -1.80 120.64 119.24 2o3r n GLU 146 Ca 0.16 0.13 0.12 0.00 -0.01 0.00 0.00 57.16 57.55 2o3r n GLU 146 Cb 0.22 -1.50 0.17 0.00 -1.01 0.00 0.00 31.44 29.32 2o3r n GLU 146 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2o3r n ASP 147 N -1.32 2.03 -4.90 1.62 10.43 -0.29 -2.95 116.55 121.16 2o3r n ASP 147 Ca 0.08 -1.52 -0.28 0.00 2.57 0.00 0.00 54.79 55.64 2o3r n ASP 147 Cb 0.16 0.22 -0.02 0.00 1.84 0.00 0.00 41.12 43.32 2o3r n ASP 147 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2o3r s THR 148 N -2.29 4.95 0.17 -3.53 -4.23 -0.74 -4.94 115.64 105.02 2o3r s THR 148 Ca 0.25 0.15 -0.16 0.00 -1.18 0.00 0.00 61.69 60.75 2o3r s THR 148 Cb 0.19 -3.79 0.08 0.00 1.34 0.00 0.00 72.50 70.32 2o3r s THR 148 CO 0.46 -0.54 1.69 0.25 -0.54 0.00 0.00 174.62 175.93 2o3r h LEU 149 N 1.06 -0.22 -0.43 4.79 5.85 -1.89 0.81 115.31 125.29 2o3r h LEU 149 Ca -0.48 0.10 -0.18 0.00 0.84 0.00 0.00 57.88 58.17 2o3r h LEU 149 Cb 1.20 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.41 2o3r h LEU 149 CO 0.64 -0.07 -0.64 -0.07 -0.34 0.00 0.00 178.44 177.96 2o3r h LEU 150 N 0.08 0.63 -0.71 2.25 3.38 -1.87 -1.16 115.31 117.91 2o3r h LEU 150 Ca 0.20 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 2o3r h LEU 150 Cb 0.28 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2o3r h LEU 150 CO -0.35 1.11 -0.14 1.23 0.09 0.00 0.00 178.44 180.38 2o3r h GLY 151 N 1.05 0.92 1.29 0.83 0.00 -1.54 -2.86 103.07 102.77 2o3r h GLY 151 Ca -0.01 -0.73 -0.08 0.00 0.00 0.00 0.00 47.33 46.51 2o3r h GLY 151 CO 0.12 0.67 -0.01 -1.82 0.00 0.00 0.00 176.54 175.50 2o3r h TYR 152 N 0.76 0.92 -0.69 5.60 5.03 -0.44 -1.61 116.97 126.54 2o3r h TYR 152 Ca 0.12 -0.14 -0.02 0.00 2.58 0.00 0.00 58.73 61.27 2o3r h TYR 152 Cb 0.65 -0.25 -0.03 0.00 1.55 0.00 0.00 36.73 38.65 2o3r h TYR 152 CO 0.04 0.84 0.34 -0.07 -1.32 0.00 0.00 178.16 177.99 2o3r h LEU 153 N 0.79 0.89 0.00 2.82 3.38 -1.03 -3.27 115.31 118.90 2o3r h LEU 153 Ca 0.15 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2o3r h LEU 153 Cb 0.49 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2o3r h LEU 153 CO 0.02 0.77 -1.13 0.00 0.09 0.00 0.00 178.44 178.20 2o3r n ALA 154 N -2.36 4.16 -1.70 1.53 0.00 -1.10 -4.79 120.51 116.26 2o3r n ALA 154 Ca 0.05 -0.54 -0.44 0.00 0.00 0.00 0.00 53.44 52.52 2o3r n ALA 154 Cb 0.12 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 2o3r n ALA 154 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2o3r n ASP 155 N -1.69 3.40 -0.77 0.00 4.64 -0.62 -2.07 116.55 119.44 2o3r n ASP 155 Ca 0.03 1.10 -0.10 0.00 -1.38 0.00 0.00 54.79 54.44 2o3r n ASP 155 Cb 0.38 -1.50 -0.04 0.00 -1.04 0.00 0.00 41.12 38.92 2o3r n ASP 155 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2o3r n ASP 156 N 3.02 -4.94 -4.75 1.67 8.00 -1.26 -4.99 116.55 113.30 2o3r n ASP 156 Ca 0.14 0.25 -0.23 0.00 0.71 0.00 0.00 54.79 55.66 2o3r n ASP 156 Cb 0.32 -3.32 -0.06 0.00 -0.02 0.00 0.00 41.12 38.04 2o3r n ASP 156 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2o3r s LEU 157 N -2.29 3.25 0.02 0.64 1.43 -0.88 -5.07 118.68 115.79 2o3r s LEU 157 Ca 0.00 -0.83 0.02 0.00 -1.03 0.00 0.00 54.13 52.30 2o3r s LEU 157 Cb 0.00 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 2o3r s LEU 157 CO 0.00 -0.39 -0.08 -0.89 0.23 0.00 0.00 176.35 175.22 2o3r s THR 158 N -2.46 0.60 0.08 5.49 2.01 -1.26 -4.99 115.64 115.11 2o3r s THR 158 Ca 0.40 -0.69 -0.20 0.00 0.31 0.00 0.00 61.69 61.51 2o3r s THR 158 Cb -0.01 -0.58 0.05 0.00 0.01 0.00 0.00 72.50 71.97 2o3r s THR 158 CO 0.23 -0.08 0.48 -1.66 -0.69 0.00 0.00 174.62 172.89 2o3r s TRP 159 N -0.73 -0.34 -0.06 4.92 -2.14 -1.26 -1.33 118.94 118.00 2o3r s TRP 159 Ca -0.02 0.23 -0.31 0.00 2.66 0.00 0.00 56.10 58.66 2o3r s TRP 159 Cb -0.06 0.32 0.11 0.00 -3.10 0.00 0.00 33.47 30.75 2o3r s TRP 159 CO 0.00 -0.68 0.99 0.00 -2.66 0.00 0.00 176.95 174.60 2o3r n GLY 161 N -0.20 5.24 3.03 0.00 0.00 -1.26 -0.92 105.19 111.07 2o3r n GLY 161 Ca -0.06 -2.06 -0.18 0.00 0.00 0.00 0.00 46.02 43.72 2o3r n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o3r s GLU 162 N 0.95 0.67 0.31 1.61 2.02 -1.24 -4.57 118.70 118.44 2o3r s GLU 162 Ca 0.00 -0.39 0.06 0.00 0.02 0.00 0.00 54.97 54.66 2o3r s GLU 162 Cb 0.00 -0.63 0.50 0.00 0.10 0.00 0.00 34.13 34.10 2o3r s GLU 162 CO 0.00 0.17 1.73 0.35 0.02 0.00 0.00 175.26 177.53 2o3r h PHE 163 N 5.68 0.31 -0.96 1.61 3.57 -1.67 -3.17 116.94 122.31 2o3r h PHE 163 Ca -0.31 -0.07 0.25 0.00 3.53 0.00 0.00 57.97 61.37 2o3r h PHE 163 Cb 1.18 -0.07 -0.13 0.00 2.79 0.00 0.00 35.95 39.72 2o3r h PHE 163 CO 0.44 0.59 0.50 -0.44 -2.23 0.00 0.00 178.31 177.18 2o3r h ASP 164 N 0.23 0.49 -5.22 0.41 3.32 -1.89 -3.41 116.42 110.35 2o3r h ASP 164 Ca 0.03 0.16 0.10 0.00 0.02 0.00 0.00 57.03 57.34 2o3r h ASP 164 Cb 0.73 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.35 2o3r h ASP 164 CO 0.06 -0.00 0.42 0.28 -1.72 0.00 0.00 179.24 178.28 2o3r s THR 165 N -5.79 0.00 -2.09 0.35 -1.32 -1.20 -5.05 115.64 100.54 2o3r s THR 165 Ca -0.11 -0.78 0.14 0.00 -1.21 0.00 0.00 61.69 59.73 2o3r s THR 165 Cb 0.27 -2.54 0.36 0.00 -1.51 0.00 0.00 72.50 69.08 2o3r s THR 165 CO 0.79 0.00 1.36 -1.54 -2.21 0.00 0.00 174.62 173.02 2o3r n SER 166 N -0.98 1.81 -4.89 8.08 3.41 -1.26 -3.14 113.62 116.65 2o3r n SER 166 Ca -0.05 -1.90 -0.33 0.00 -0.26 0.00 0.00 58.87 56.33 2o3r n SER 166 Cb 0.60 -0.19 -0.05 0.00 -0.26 0.00 0.00 64.21 64.31 2o3r n SER 166 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2o3r s LYS 167 N -1.62 3.65 0.24 4.33 1.02 -1.26 -4.80 119.74 121.30 2o3r s LYS 167 Ca 0.27 -0.02 -0.26 0.00 0.02 0.00 0.00 55.97 55.98 2o3r s LYS 167 Cb 0.14 -2.92 -0.09 0.00 -0.52 0.00 0.00 37.83 34.45 2o3r s LYS 167 CO 0.20 0.52 0.86 0.42 -0.92 0.00 0.00 175.35 176.42 2o3r s ILE 168 N -1.54 4.27 -0.64 2.17 1.01 -1.26 -3.63 121.20 121.58 2o3r s ILE 168 Ca 0.37 1.78 -0.22 0.00 0.00 0.00 0.00 60.65 62.58 2o3r s ILE 168 Cb -0.13 -4.12 0.07 0.00 0.01 0.00 0.00 42.46 38.30 2o3r s ILE 168 CO 0.22 0.37 0.92 0.21 0.00 0.00 0.00 174.94 176.65 2o3r s ASN 169 N -1.36 6.19 0.00 3.58 3.84 -0.10 -4.88 114.94 122.21 2o3r s ASN 169 Ca 0.42 -0.98 0.29 0.00 0.21 0.00 0.00 52.86 52.80 2o3r s ASN 169 Cb -0.22 -2.40 1.23 0.00 -0.55 0.00 0.00 41.25 39.31 2o3r s ASN 169 CO 0.26 -1.37 1.87 -1.22 -2.79 0.00 0.00 177.10 173.86 2o3r n TYR 170 N 7.47 0.00 -0.02 0.43 4.02 -1.26 -1.23 117.16 126.57 2o3r n TYR 170 Ca -0.04 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.64 2o3r n TYR 170 Cb 0.45 -0.23 -0.13 0.00 -0.02 0.00 0.00 39.34 39.41 2o3r n TYR 170 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2o3r n GLN 171 N -1.09 0.73 -3.51 -0.72 6.02 -1.26 -4.22 117.38 113.33 2o3r n GLN 171 Ca 0.13 0.27 -0.14 0.00 -0.01 0.00 0.00 57.00 57.26 2o3r n GLN 171 Cb 0.28 -1.69 -0.04 0.00 1.02 0.00 0.00 30.24 29.81 2o3r n GLN 171 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2o3r s SER 172 N -6.98 -0.54 0.05 1.08 1.04 -1.26 -3.62 113.70 103.46 2o3r s SER 172 Ca -0.24 0.41 -0.00 0.00 0.48 0.00 0.00 55.95 56.59 2o3r s SER 172 Cb 0.07 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 2o3r s SER 172 CO 0.73 -0.64 -0.03 0.00 0.98 0.00 0.00 173.24 174.28 2o3r n PRO 174 N 0.47 2.28 -3.17 0.00 -0.02 -1.26 -1.29 135.00 132.01 2o3r n PRO 174 Ca -0.16 0.81 -0.39 0.00 -2.02 0.00 0.00 63.50 61.74 2o3r n PRO 174 Cb 0.59 -2.52 -0.05 0.00 -0.02 0.00 0.00 33.50 31.51 2o3r n PRO 174 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2o3r s ASP 175 N 0.37 6.96 0.25 2.55 -1.08 -1.26 -4.64 116.67 119.81 2o3r s ASP 175 Ca 0.67 1.15 -0.04 0.00 -0.52 0.00 0.00 52.55 53.80 2o3r s ASP 175 Cb -0.59 -2.37 0.48 0.00 -1.46 0.00 0.00 42.92 38.97 2o3r s ASP 175 CO 0.49 0.04 1.69 -0.25 0.52 0.00 0.00 175.17 177.66 2o3r h TRP 176 N 5.96 0.30 0.14 -5.34 2.91 -1.94 0.94 115.95 118.93 2o3r h TRP 176 Ca -0.44 0.04 -0.31 0.00 1.13 0.00 0.00 58.89 59.32 2o3r h TRP 176 Cb 1.20 -0.02 -0.00 0.00 -0.51 0.00 0.00 29.16 29.83 2o3r h TRP 176 CO 0.65 -0.08 -1.55 0.00 -1.03 0.00 0.00 178.44 176.43 2o3r h ARG 177 N 0.28 0.29 0.00 2.65 3.08 -1.94 -3.27 114.38 115.48 2o3r h ARG 177 Ca 0.42 -0.50 -0.20 0.00 0.07 0.00 0.00 59.98 59.78 2o3r h ARG 177 Cb 0.72 0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 2o3r h ARG 177 CO -0.51 1.24 -0.99 0.87 -1.07 0.00 0.00 179.97 179.51 2o3r h LYS 178 N -0.16 0.00 0.00 0.04 1.57 -1.97 -3.43 116.57 112.62 2o3r h LYS 178 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2o3r h LYS 178 Cb 1.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.19 2o3r h LYS 178 CO 0.10 0.81 0.00 -0.25 -0.57 0.00 0.00 179.45 179.54 2o3r n ASP 179 N -3.27 0.00 -3.57 0.86 8.00 0.27 -4.97 116.55 113.87 2o3r n ASP 179 Ca -0.02 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.36 2o3r n ASP 179 Cb 0.91 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.78 2o3r n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2o3r h SER 181 N 2.82 0.00 -0.67 0.00 4.64 -1.84 -3.37 113.55 115.13 2o3r h SER 181 Ca -0.21 0.00 -0.72 0.00 -0.47 0.00 0.00 61.79 60.39 2o3r h SER 181 Cb 1.16 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.18 2o3r h SER 181 CO 0.31 0.76 2.95 0.59 -0.87 0.00 0.00 176.83 180.57 2o3r n ASN 182 N -3.15 7.57 -4.87 4.97 3.02 -1.26 -4.51 115.26 117.04 2o3r n ASN 182 Ca -0.05 -2.91 -0.21 0.00 -0.03 0.00 0.00 54.58 51.38 2o3r n ASN 182 Cb 0.88 -1.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.55 2o3r n ASN 182 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2o3r s ASN 183 N 1.32 5.19 0.36 6.41 4.22 -1.24 -1.48 114.94 129.71 2o3r s ASN 183 Ca 0.57 -0.62 0.05 0.00 -2.14 0.00 0.00 52.86 50.73 2o3r s ASN 183 Cb 0.17 -0.76 0.71 0.00 1.28 0.00 0.00 41.25 42.65 2o3r s ASN 183 CO -0.07 -0.52 1.96 -0.65 -2.04 0.00 0.00 177.10 175.78 2o3r h PRO 184 N 1.11 0.76 -0.00 3.55 0.11 -1.81 -0.64 132.00 135.09 2o3r h PRO 184 Ca -0.43 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2o3r h PRO 184 Cb 1.26 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2o3r h PRO 184 CO 0.57 0.51 -0.14 0.28 -0.21 0.00 0.00 178.00 179.01 2o3r h VAL 185 N 0.79 1.58 -0.56 3.15 2.07 -1.95 -2.38 116.25 118.95 2o3r h VAL 185 Ca 0.31 -1.91 -0.05 0.00 0.82 0.00 0.00 66.70 65.87 2o3r h VAL 185 Cb 0.21 2.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.77 2o3r h VAL 185 CO -0.10 0.51 0.15 0.28 0.02 0.00 0.00 177.57 178.43 2o3r h SER 186 N -0.62 0.85 0.02 0.57 0.02 -1.78 -2.11 113.55 110.50 2o3r h SER 186 Ca -0.02 -0.23 -0.17 0.00 -0.84 0.00 0.00 61.79 60.54 2o3r h SER 186 Cb 0.91 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 2o3r h SER 186 CO 0.03 0.85 -0.57 0.58 -1.14 0.00 0.00 176.83 176.58 2o3r h VAL 187 N 0.80 1.32 -0.38 2.27 2.07 -1.18 -2.07 116.25 119.08 2o3r h VAL 187 Ca 0.18 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 65.88 2o3r h VAL 187 Cb 0.33 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2o3r h VAL 187 CO 0.00 0.57 0.25 0.15 0.02 0.00 0.00 177.57 178.56 2o3r h PHE 188 N 0.43 0.48 -0.04 1.57 3.57 -1.09 -0.83 116.94 121.03 2o3r h PHE 188 Ca 0.00 0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.31 2o3r h PHE 188 Cb 1.12 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.70 2o3r h PHE 188 CO 0.05 0.30 -0.85 -1.49 -2.23 0.00 0.00 178.31 174.09 2o3r h TRP 189 N 0.51 0.61 -0.86 0.41 4.06 -1.26 -1.78 115.95 117.65 2o3r h TRP 189 Ca 0.14 -0.31 0.02 0.00 2.06 0.00 0.00 58.89 60.81 2o3r h TRP 189 Cb -0.06 -0.08 -0.05 0.00 -1.00 0.00 0.00 29.16 27.97 2o3r h TRP 189 CO -0.05 1.10 0.56 -0.22 -3.56 0.00 0.00 178.44 176.27 2o3r h LYS 190 N 0.27 1.08 0.12 0.49 3.64 -1.20 -1.43 116.57 119.54 2o3r h LYS 190 Ca -0.06 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2o3r h LYS 190 Cb 1.46 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2o3r h LYS 190 CO 0.15 0.72 -0.06 1.15 -2.27 0.00 0.00 179.45 179.14 2o3r h THR 191 N 1.11 1.06 -0.37 1.00 2.02 -0.71 -2.51 112.91 114.50 2o3r h THR 191 Ca 0.33 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.64 2o3r h THR 191 Cb -0.06 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 2o3r h THR 191 CO -0.09 0.19 -0.09 -0.37 0.37 0.00 0.00 175.52 175.52 2o3r h VAL 192 N -0.53 1.24 -0.63 3.16 -1.51 -1.35 -2.60 116.25 114.03 2o3r h VAL 192 Ca -0.02 -1.06 -0.05 0.00 -1.23 0.00 0.00 66.70 64.35 2o3r h VAL 192 Cb 0.43 1.05 -0.03 0.00 -2.13 0.00 0.00 31.29 30.61 2o3r h VAL 192 CO 0.03 0.36 0.19 0.28 -1.23 0.00 0.00 177.57 177.19 2o3r h SER 193 N 0.59 0.92 0.09 4.19 0.02 -1.29 -1.70 113.55 116.38 2o3r h SER 193 Ca 0.11 -0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2o3r h SER 193 Cb 0.51 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2o3r h SER 193 CO 0.03 0.89 -0.04 -0.09 -1.14 0.00 0.00 176.83 176.48 2o3r h ARG 194 N 0.91 -0.12 -0.85 3.45 2.43 -1.18 -0.15 114.38 118.87 2o3r h ARG 194 Ca 0.20 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.43 2o3r h ARG 194 Cb 0.30 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.83 2o3r h ARG 194 CO -0.00 0.01 0.56 0.00 -1.51 0.00 0.00 179.97 179.02 2o3r h ARG 195 N -0.23 0.99 0.25 0.20 -0.00 -1.32 -1.78 114.38 112.49 2o3r h ARG 195 Ca -0.01 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.98 59.40 2o3r h ARG 195 Cb 0.19 -0.22 0.00 0.00 0.00 0.00 0.00 29.97 29.93 2o3r h ARG 195 CO 0.02 0.66 -0.12 0.35 0.00 0.00 0.00 179.97 180.88 2o3r h PHE 196 N 1.02 -0.31 -0.83 3.04 3.57 -0.84 -2.76 116.94 119.83 2o3r h PHE 196 Ca 0.35 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 62.03 2o3r h PHE 196 Cb 0.09 0.10 -0.12 0.00 2.79 0.00 0.00 35.95 38.82 2o3r h PHE 196 CO -0.00 0.00 0.31 0.00 -2.23 0.00 0.00 178.31 176.40 2o3r h ALA 197 N 0.02 1.23 0.00 2.41 0.00 -0.94 -2.65 119.26 119.33 2o3r h ALA 197 Ca -0.03 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2o3r h ALA 197 Cb 0.45 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2o3r h ALA 197 CO 0.06 -0.31 -0.30 0.93 0.00 0.00 0.00 179.25 179.62 2o3r h GLU 198 N 0.37 0.00 0.00 0.00 5.08 -1.24 -2.40 114.58 116.39 2o3r h GLU 198 Ca 0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.85 2o3r h GLU 198 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2o3r h GLU 198 CO -0.51 0.30 -0.22 0.00 -1.00 0.00 0.00 179.01 177.58 2o3r h ALA 199 N 1.70 0.89 -2.73 3.43 0.00 -1.17 -3.44 119.26 117.94 2o3r h ALA 199 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2o3r h ALA 199 Cb 0.56 0.00 0.13 0.00 0.00 0.00 0.00 17.79 18.47 2o3r h ALA 199 CO 0.04 0.00 0.43 0.00 0.00 0.00 0.00 179.25 179.72 2o3r s ALA 200 N -3.24 2.38 0.13 0.00 0.00 -0.90 -4.62 121.76 115.51 2o3r s ALA 200 Ca 0.06 0.90 -0.14 0.00 0.00 0.00 0.00 51.96 52.78 2o3r s ALA 200 Cb 0.06 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.76 2o3r s ALA 200 CO 0.69 -1.43 0.35 0.00 0.00 0.00 0.00 175.76 175.37 2o3r n ASP 202 N -0.20 0.00 -4.41 0.00 9.92 0.17 -3.83 116.55 118.20 2o3r n ASP 202 Ca -0.14 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 53.74 2o3r n ASP 202 Cb 0.63 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.99 2o3r n ASP 202 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2o3r s VAL 203 N 0.00 4.40 0.01 2.53 1.01 -1.26 -0.15 120.40 126.94 2o3r s VAL 203 Ca 0.00 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.31 2o3r s VAL 203 Cb 0.00 -3.25 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 2o3r s VAL 203 CO 0.00 0.07 0.44 -0.69 0.00 0.00 0.00 175.10 174.92 2o3r s VAL 204 N 1.58 4.97 0.12 2.92 1.01 -0.03 -4.67 120.40 126.30 2o3r s VAL 204 Ca 0.04 0.92 0.07 0.00 0.00 0.00 0.00 61.98 63.00 2o3r s VAL 204 Cb -0.17 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 2o3r s VAL 204 CO 0.05 0.57 -0.06 -1.00 0.00 0.00 0.00 175.10 174.66 2o3r s HIS 205 N -1.06 2.80 -0.04 5.22 3.76 -0.99 0.44 115.29 125.42 2o3r s HIS 205 Ca 0.25 -0.13 0.00 0.00 -0.15 0.00 0.00 55.06 55.03 2o3r s HIS 205 Cb -0.17 -1.43 0.02 0.00 1.11 0.00 0.00 32.58 32.11 2o3r s HIS 205 CO 0.14 0.47 -0.02 0.54 -0.85 0.00 0.00 174.74 175.02 2o3r s VAL 206 N -1.39 0.37 -0.21 -0.90 0.11 0.14 -0.99 120.40 117.53 2o3r s VAL 206 Ca 0.24 -0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 59.12 2o3r s VAL 206 Cb -0.11 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.27 2o3r s VAL 206 CO 0.16 0.20 0.46 -0.32 -3.33 0.00 0.00 175.10 172.27 2o3r s MET 207 N 1.12 4.16 0.08 1.54 1.75 -0.84 -0.81 119.30 126.29 2o3r s MET 207 Ca -0.08 0.30 0.08 0.00 -1.25 0.00 0.00 55.69 54.74 2o3r s MET 207 Cb -0.14 -3.57 -0.03 0.00 2.84 0.00 0.00 34.83 33.93 2o3r s MET 207 CO -0.01 -0.14 -0.22 -0.51 -0.65 0.00 0.00 175.02 173.48 2o3r s LEU 208 N 1.62 2.25 -0.26 4.11 1.43 -0.99 -2.94 118.68 123.90 2o3r s LEU 208 Ca 0.21 -0.63 -0.26 0.00 -1.03 0.00 0.00 54.13 52.42 2o3r s LEU 208 Cb -0.15 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 45.07 2o3r s LEU 208 CO 0.09 0.13 0.92 -0.62 0.23 0.00 0.00 176.35 177.10 2o3r s ASP 209 N -1.63 6.91 -0.07 2.29 2.15 -1.26 -2.21 116.67 122.85 2o3r s ASP 209 Ca 0.08 1.10 -0.02 0.00 0.43 0.00 0.00 52.55 54.15 2o3r s ASP 209 Cb -0.10 -2.48 -0.02 0.00 -0.30 0.00 0.00 42.92 40.03 2o3r s ASP 209 CO 0.03 -0.62 2.37 0.61 -0.17 0.00 0.00 175.17 177.39 2o3r n GLY 210 N 3.68 2.95 2.67 2.66 0.00 0.26 -2.80 105.19 114.61 2o3r n GLY 210 Ca 0.08 -0.51 -0.02 0.00 0.00 0.00 0.00 46.02 45.57 2o3r n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2o3r n SER 211 N 1.48 -1.50 -4.99 1.61 3.41 -1.26 -4.39 113.62 107.99 2o3r n SER 211 Ca 0.16 -2.23 -0.18 0.00 -0.26 0.00 0.00 58.87 56.36 2o3r n SER 211 Cb 0.60 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 2o3r n SER 211 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2o3r s ARG 212 N 0.13 2.77 -0.14 4.33 1.81 -1.12 -5.05 118.95 121.69 2o3r s ARG 212 Ca 0.10 -1.30 -0.27 0.00 -1.72 0.00 0.00 55.73 52.54 2o3r s ARG 212 Cb 0.45 -2.70 -0.24 0.00 -0.45 0.00 0.00 34.95 32.01 2o3r s ARG 212 CO -0.13 -0.27 0.72 0.66 -0.68 0.00 0.00 175.30 175.61 2o3r h SER 213 N 0.70 0.00 -2.01 0.23 4.64 -1.99 -3.35 113.55 111.78 2o3r h SER 213 Ca -0.40 -0.94 -0.77 0.00 -0.47 0.00 0.00 61.79 59.21 2o3r h SER 213 Cb 1.28 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.17 2o3r h SER 213 CO 0.47 0.97 1.53 0.29 -0.87 0.00 0.00 176.83 179.22 2o3r n LYS 214 N -4.62 3.80 -0.33 4.77 5.02 -1.26 -4.83 118.16 120.71 2o3r n LYS 214 Ca -0.10 -3.89 0.03 0.00 -2.02 0.00 0.00 58.31 52.34 2o3r n LYS 214 Cb 0.45 -2.81 0.10 0.00 -0.02 0.00 0.00 35.03 32.74 2o3r n LYS 214 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2o3r n ILE 215 N 2.96 -0.41 -3.90 -0.18 5.41 -1.26 -2.89 119.36 119.09 2o3r n ILE 215 Ca 0.35 2.08 -0.35 0.00 1.00 0.00 0.00 62.75 65.83 2o3r n ILE 215 Cb 0.37 -2.84 -0.10 0.00 -0.71 0.00 0.00 39.64 36.35 2o3r n ILE 215 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 2o3r s PHE 216 N -6.04 3.23 -0.26 1.39 5.36 -1.26 -4.54 117.98 115.85 2o3r s PHE 216 Ca -0.13 0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 55.81 2o3r s PHE 216 Cb 0.22 -2.15 0.02 0.00 -0.34 0.00 0.00 43.02 40.78 2o3r s PHE 216 CO 0.68 0.04 -0.01 0.34 -1.46 0.00 0.00 175.22 174.81 2o3r s ASP 217 N 0.75 4.61 0.60 6.13 2.15 -1.14 -4.80 116.67 124.97 2o3r s ASP 217 Ca 0.04 -0.81 0.32 0.00 0.43 0.00 0.00 52.55 52.53 2o3r s ASP 217 Cb -0.13 -1.74 1.89 0.00 -0.30 0.00 0.00 42.92 42.64 2o3r s ASP 217 CO 0.02 -0.15 2.24 0.50 -0.17 0.00 0.00 175.17 177.61 2o3r h LYS 218 N 8.09 0.00 -0.00 4.34 3.64 -1.94 -1.80 116.57 128.90 2o3r h LYS 218 Ca -0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 2o3r h LYS 218 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2o3r h LYS 218 CO 0.58 0.00 -0.48 -0.25 -2.27 0.00 0.00 179.45 177.03 2o3r n ASP 219 N -3.70 0.89 -4.70 4.20 9.92 -1.26 -3.81 116.55 118.08 2o3r n ASP 219 Ca -0.02 -0.68 -0.32 0.00 -0.53 0.00 0.00 54.79 53.23 2o3r n ASP 219 Cb 0.13 0.33 0.13 0.00 -0.64 0.00 0.00 41.12 41.07 2o3r n ASP 219 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2o3r s SER 220 N -2.78 3.58 0.51 -2.24 1.04 -0.68 -4.30 113.70 108.83 2o3r s SER 220 Ca 0.16 2.19 0.26 0.00 0.48 0.00 0.00 55.95 59.04 2o3r s SER 220 Cb 0.18 -2.57 1.36 0.00 0.10 0.00 0.00 66.02 65.09 2o3r s SER 220 CO 0.65 -2.67 1.93 0.00 0.98 0.00 0.00 173.24 174.14 2o3r h THR 221 N -1.23 0.67 -0.88 2.02 1.03 -1.92 2.35 112.91 114.95 2o3r h THR 221 Ca -0.45 -0.03 0.07 0.00 -0.01 0.00 0.00 66.41 65.99 2o3r h THR 221 Cb 1.27 0.57 -0.06 0.00 -1.07 0.00 0.00 68.15 68.87 2o3r h THR 221 CO 0.46 0.02 0.57 0.15 -0.01 0.00 0.00 175.52 176.70 2o3r h PHE 222 N 0.08 0.99 0.11 0.00 3.57 -1.90 -1.16 116.94 118.63 2o3r h PHE 222 Ca 0.35 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.66 2o3r h PHE 222 Cb 1.28 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 39.70 2o3r h PHE 222 CO -0.00 0.51 -1.06 0.78 -2.23 0.00 0.00 178.31 176.31 2o3r h GLY 223 N 0.96 0.27 1.94 2.40 0.00 0.35 0.13 103.07 109.13 2o3r h GLY 223 Ca 0.38 -0.70 -0.16 0.00 0.00 0.00 0.00 47.33 46.85 2o3r h GLY 223 CO -0.14 0.61 -0.74 1.48 0.00 0.00 0.00 176.54 177.74 2o3r h SER 224 N -0.41 0.08 0.00 0.19 4.64 -0.25 -3.41 113.55 114.38 2o3r h SER 224 Ca -0.22 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2o3r h SER 224 Cb 1.64 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.71 2o3r h SER 224 CO 0.08 0.79 -0.16 0.52 -0.87 0.00 0.00 176.83 177.19 2o3r n VAL 225 N -3.69 1.16 0.19 0.95 0.31 -0.51 -4.82 118.33 111.92 2o3r n VAL 225 Ca -0.01 0.34 -0.13 0.00 -0.01 0.00 0.00 64.34 64.52 2o3r n VAL 225 Cb 0.72 -1.66 -0.07 0.00 -0.91 0.00 0.00 33.84 31.91 2o3r n VAL 225 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2o3r h ASP 226 N -0.16 -1.07 -0.13 4.52 5.19 -0.81 -0.75 116.42 123.21 2o3r h ASP 226 Ca 0.00 0.09 0.04 0.00 -0.62 0.00 0.00 57.03 56.54 2o3r h ASP 226 Cb 0.16 0.36 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 2o3r h ASP 226 CO 0.00 -0.48 0.21 1.62 -3.12 0.00 0.00 179.24 177.48 2o3r h VAL 227 N -0.70 0.29 0.00 -1.35 3.04 -0.99 -2.00 116.25 114.54 2o3r h VAL 227 Ca -0.04 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.62 2o3r h VAL 227 Cb 0.63 0.82 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 2o3r h VAL 227 CO -0.09 0.00 -0.89 0.45 -1.01 0.00 0.00 177.57 176.03 2o3r h HIS 228 N 0.00 0.00 -0.52 3.17 3.86 -1.41 -3.23 115.15 117.02 2o3r h HIS 228 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2o3r h HIS 228 Cb 0.48 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.95 2o3r h HIS 228 CO 0.00 0.14 0.00 0.09 0.86 0.00 0.00 177.93 179.02 2o3r n ASN 229 N -2.81 3.97 -4.59 2.45 3.02 -0.77 -4.87 115.26 111.67 2o3r n ASN 229 Ca -0.01 -2.33 -0.42 0.00 -0.03 0.00 0.00 54.58 51.79 2o3r n ASN 229 Cb 0.61 -0.46 -0.02 0.00 -0.61 0.00 0.00 39.78 39.30 2o3r n ASN 229 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2o3r s LEU 230 N -1.61 3.48 -0.35 3.41 1.43 -1.12 -3.06 118.68 120.88 2o3r s LEU 230 Ca 0.41 0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 53.80 2o3r s LEU 230 Cb 0.26 -3.27 0.01 0.00 0.03 0.00 0.00 46.19 43.22 2o3r s LEU 230 CO 0.21 -1.61 0.98 -1.10 0.23 0.00 0.00 176.35 175.06 2o3r s GLN 231 N 5.30 3.93 0.65 1.70 -1.52 -1.26 -4.94 119.66 123.52 2o3r s GLN 231 Ca 0.58 0.76 0.38 0.00 -1.95 0.00 0.00 55.36 55.13 2o3r s GLN 231 Cb -0.12 -3.77 2.08 0.00 -0.22 0.00 0.00 33.01 30.97 2o3r s GLN 231 CO 0.29 -0.92 2.17 -1.35 -0.25 0.00 0.00 175.29 175.23 2o3r h PRO 232 N 8.33 0.00 -0.00 2.91 0.11 -1.82 0.72 132.00 142.24 2o3r h PRO 232 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2o3r h PRO 232 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2o3r h PRO 232 CO 1.00 0.00 -0.21 0.39 -0.21 0.00 0.00 178.00 178.97 2o3r n GLU 233 N -2.96 0.17 -0.04 1.05 4.71 -1.26 -3.99 120.64 118.33 2o3r n GLU 233 Ca -0.03 -0.06 -0.05 0.00 -0.01 0.00 0.00 57.16 57.01 2o3r n GLU 233 Cb 0.18 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.07 2o3r n GLU 233 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2o3r n LYS 234 N -1.36 0.19 -3.55 3.49 5.02 0.22 -5.00 118.16 117.16 2o3r n LYS 234 Ca 0.08 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 56.02 2o3r n LYS 234 Cb 0.32 -1.14 -0.11 0.00 -0.02 0.00 0.00 35.03 34.09 2o3r n LYS 234 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2o3r s VAL 235 N -2.15 5.22 -0.10 -0.18 1.01 0.23 0.42 120.40 124.85 2o3r s VAL 235 Ca -0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 2o3r s VAL 235 Cb 0.03 -3.67 -0.26 0.00 0.00 0.00 0.00 36.38 32.48 2o3r s VAL 235 CO 0.17 0.01 0.45 0.00 0.00 0.00 0.00 175.10 175.73 2o3r n GLN 236 N 5.09 0.73 -4.04 2.72 10.64 0.78 -4.38 117.38 128.93 2o3r n GLN 236 Ca -0.13 0.27 -0.14 0.00 -1.83 0.00 0.00 57.00 55.18 2o3r n GLN 236 Cb 0.50 -1.73 -0.14 0.00 -0.86 0.00 0.00 30.24 28.00 2o3r n GLN 236 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2o3r s THR 237 N -2.57 0.25 -0.24 -0.39 2.01 0.19 -1.07 115.64 113.82 2o3r s THR 237 Ca -0.18 -0.22 -0.08 0.00 0.31 0.00 0.00 61.69 61.52 2o3r s THR 237 Cb 0.07 -0.24 -0.04 0.00 0.01 0.00 0.00 72.50 72.31 2o3r s THR 237 CO 0.79 0.02 0.10 -0.22 -0.69 0.00 0.00 174.62 174.61 2o3r s LEU 238 N -0.23 3.64 -0.12 4.42 2.96 -0.65 -0.85 118.68 127.85 2o3r s LEU 238 Ca -0.00 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2o3r s LEU 238 Cb -0.02 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2o3r s LEU 238 CO -0.00 0.00 -0.17 -0.70 -1.32 0.00 0.00 176.35 174.16 2o3r s GLU 239 N 1.42 3.25 -0.09 1.98 2.12 0.17 -2.22 118.70 125.33 2o3r s GLU 239 Ca 0.06 -0.76 -0.00 0.00 0.36 0.00 0.00 54.97 54.62 2o3r s GLU 239 Cb -0.15 -2.51 -0.03 0.00 0.26 0.00 0.00 34.13 31.70 2o3r s GLU 239 CO 0.05 0.19 -0.05 0.00 -0.54 0.00 0.00 175.26 174.90 2o3r s ALA 240 N 0.38 3.02 -0.23 6.30 0.00 -0.68 0.23 121.76 130.78 2o3r s ALA 240 Ca -0.14 -0.86 0.02 0.00 0.00 0.00 0.00 51.96 50.98 2o3r s ALA 240 Cb -0.17 -1.33 0.05 0.00 0.00 0.00 0.00 23.12 21.67 2o3r s ALA 240 CO 0.07 0.50 -0.14 -1.58 0.00 0.00 0.00 175.76 174.61 2o3r s TRP 241 N -0.58 3.10 -0.30 0.00 0.51 0.00 -1.38 118.94 120.30 2o3r s TRP 241 Ca 0.09 -2.07 -0.13 0.00 -2.12 0.00 0.00 56.10 51.87 2o3r s TRP 241 Cb -0.12 -1.93 -0.03 0.00 -0.81 0.00 0.00 33.47 30.58 2o3r s TRP 241 CO 0.02 -0.85 0.29 0.08 -0.51 0.00 0.00 176.95 175.98 2o3r s VAL 242 N 1.17 5.23 -0.31 4.03 1.01 -0.53 -2.35 120.40 128.66 2o3r s VAL 242 Ca -0.04 0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.84 2o3r s VAL 242 Cb -0.18 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2o3r s VAL 242 CO -0.08 0.09 0.99 -0.63 0.00 0.00 0.00 175.10 175.48 2o3r s ILE 243 N 1.90 4.61 0.69 2.22 -1.09 -0.94 -0.65 121.20 127.93 2o3r s ILE 243 Ca 0.10 1.61 -0.17 0.00 -2.23 0.00 0.00 60.65 59.96 2o3r s ILE 243 Cb -0.16 -4.33 0.01 0.00 -1.58 0.00 0.00 42.46 36.40 2o3r s ILE 243 CO 0.11 -0.39 1.28 -1.00 -1.23 0.00 0.00 174.94 173.71 2o3r s HIS 244 N 3.41 2.00 0.00 3.97 3.76 0.22 0.92 115.29 129.58 2o3r s HIS 244 Ca 0.42 1.53 0.00 0.00 -0.15 0.00 0.00 55.06 56.85 2o3r s HIS 244 Cb -0.13 -3.65 0.00 0.00 1.11 0.00 0.00 32.58 29.91 2o3r s HIS 244 CO 0.14 -2.93 0.00 0.41 -0.85 0.00 0.00 174.74 171.51 2o3r n GLY 245 N 0.81 1.20 3.10 -2.22 0.00 -1.26 -4.70 105.19 102.12 2o3r n GLY 245 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 2o3r n GLY 245 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2o3r s GLY 246 N -0.12 0.56 0.00 -0.02 0.00 -1.26 -4.92 107.32 101.57 2o3r s GLY 246 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2o3r s GLY 246 CO 0.00 -1.13 0.00 -2.13 0.00 0.00 0.00 173.10 169.84 2o3r n ARG 247 N 0.65 0.00 0.00 2.90 0.63 -1.26 -5.03 116.66 114.55 2o3r n ARG 247 Ca -0.17 0.34 0.00 0.00 -0.92 0.00 0.00 57.85 57.09 2o3r n ARG 247 Cb 0.58 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.49 2o3r n ARG 247 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2o3r n GLU 248 N 0.56 0.00 -1.68 -0.14 2.13 -1.26 -4.66 120.64 115.60 2o3r n GLU 248 Ca 0.00 0.00 -0.48 0.00 0.66 0.00 0.00 57.16 57.34 2o3r n GLU 248 Cb 0.00 -0.27 -0.05 0.00 0.27 0.00 0.00 31.44 31.39 2o3r n GLU 248 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2o3r n ASP 249 N 0.00 3.22 -2.69 4.31 4.64 -1.26 -4.97 116.55 119.80 2o3r n ASP 249 Ca 0.00 1.02 -0.13 0.00 -1.38 0.00 0.00 54.79 54.30 2o3r n ASP 249 Cb 0.00 -1.37 -0.03 0.00 -1.04 0.00 0.00 41.12 38.68 2o3r n ASP 249 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2o3r n SER 250 N 5.44 -1.06 -4.70 1.67 7.64 -1.26 -5.18 113.62 116.18 2o3r n SER 250 Ca 0.21 -2.62 -0.30 0.00 1.01 0.00 0.00 58.87 57.17 2o3r n SER 250 Cb 0.28 2.02 0.14 0.00 -1.01 0.00 0.00 64.21 65.64 2o3r n SER 250 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2o3r s ARG 251 N -2.73 1.25 -0.72 1.43 3.00 -1.26 -4.99 118.95 114.93 2o3r s ARG 251 Ca 0.26 1.12 -0.21 0.00 0.00 0.00 0.00 55.73 56.90 2o3r s ARG 251 Cb -0.00 -1.79 0.09 0.00 0.00 0.00 0.00 34.95 33.25 2o3r s ARG 251 CO 0.18 -2.33 0.98 0.34 0.00 0.00 0.00 175.30 174.47 2o3r s ASP 252 N -3.11 6.29 0.55 0.23 2.15 -1.26 -4.90 116.67 116.62 2o3r s ASP 252 Ca 0.64 -1.32 0.36 0.00 0.43 0.00 0.00 52.55 52.66 2o3r s ASP 252 Cb -0.20 -2.40 1.77 0.00 -0.30 0.00 0.00 42.92 41.79 2o3r s ASP 252 CO 0.58 -1.31 2.09 -0.07 -0.17 0.00 0.00 175.17 176.29 2o3r h LEU 253 N 10.96 0.00 -5.24 -1.34 3.38 -1.94 -3.16 115.31 117.97 2o3r h LEU 253 Ca -0.17 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.26 2o3r h LEU 253 Cb 1.06 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.83 2o3r h LEU 253 CO 1.16 0.00 3.26 0.00 0.09 0.00 0.00 178.44 182.95 2o3r n GLN 255 N 3.97 3.45 -1.66 0.00 -0.06 -1.20 -5.07 117.38 116.80 2o3r n GLN 255 Ca 0.62 0.00 -0.45 0.00 -2.00 0.00 0.00 57.00 55.17 2o3r n GLN 255 Cb 0.19 -0.33 -0.02 0.00 -4.06 0.00 0.00 30.24 26.01 2o3r n GLN 255 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2o3r n ASP 256 N -0.07 2.61 -0.29 1.69 -0.08 -1.00 -4.74 116.55 114.68 2o3r n ASP 256 Ca 0.00 1.15 0.10 0.00 -1.51 0.00 0.00 54.79 54.53 2o3r n ASP 256 Cb 0.00 -1.41 0.25 0.00 2.34 0.00 0.00 41.12 42.30 2o3r n ASP 256 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2o3r h PRO 257 N 3.91 0.40 0.00 -0.67 0.11 -1.98 0.81 132.00 134.57 2o3r h PRO 257 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2o3r h PRO 257 Cb 1.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2o3r h PRO 257 CO 0.73 0.26 0.00 1.79 -0.21 0.00 0.00 178.00 180.58 2o3r h THR 258 N 0.41 0.00 0.01 -1.15 1.35 -1.91 -1.72 112.91 109.89 2o3r h THR 258 Ca 0.50 -0.11 -0.35 0.00 -0.55 0.00 0.00 66.41 65.89 2o3r h THR 258 Cb 0.87 0.75 -0.06 0.00 -1.73 0.00 0.00 68.15 67.98 2o3r h THR 258 CO -0.49 0.00 -2.21 -0.38 -0.25 0.00 0.00 175.52 172.20 2o3r n ILE 259 N -2.35 1.48 0.30 6.82 2.08 0.09 -3.46 119.36 124.33 2o3r n ILE 259 Ca -0.00 -0.80 0.17 0.00 0.56 0.00 0.00 62.75 62.69 2o3r n ILE 259 Cb 0.12 -0.80 0.94 0.00 -0.75 0.00 0.00 39.64 39.16 2o3r n ILE 259 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2o3r h LYS 260 N 0.00 0.00 -0.65 0.38 1.79 -0.50 0.11 116.57 117.70 2o3r h LYS 260 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2o3r h LYS 260 Cb 2.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.78 2o3r h LYS 260 CO 0.03 0.04 0.00 -1.91 -1.08 0.00 0.00 179.45 176.53 2o3r n GLU 261 N -3.44 2.68 -0.02 3.15 4.07 -0.70 -3.16 120.64 123.23 2o3r n GLU 261 Ca -0.02 -2.57 -0.00 0.00 -0.06 0.00 0.00 57.16 54.51 2o3r n GLU 261 Cb 0.15 -1.55 -0.05 0.00 -0.06 0.00 0.00 31.44 29.93 2o3r n GLU 261 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2o3r n LEU 262 N 1.59 0.00 -0.27 4.31 7.94 -0.76 -4.33 117.00 125.47 2o3r n LEU 262 Ca 0.23 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 55.14 2o3r n LEU 262 Cb 0.61 0.08 0.13 0.00 0.53 0.00 0.00 43.42 44.78 2o3r n LEU 262 CO 0.16 0.08 1.13 -0.08 -1.11 0.00 0.00 177.39 177.58 2o3r h GLU 263 N 0.00 0.77 0.14 1.96 4.81 -1.04 -3.12 114.58 118.10 2o3r h GLU 263 Ca -0.09 -0.05 -0.31 0.00 -0.13 0.00 0.00 59.36 58.79 2o3r h GLU 263 Cb 0.89 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2o3r h GLU 263 CO 0.00 0.51 -1.49 0.77 -0.73 0.00 0.00 179.01 178.08 2o3r h SER 264 N 0.80 0.46 -0.49 1.04 0.02 -1.80 -3.02 113.55 110.56 2o3r h SER 264 Ca 0.35 -0.59 -0.02 0.00 -0.84 0.00 0.00 61.79 60.70 2o3r h SER 264 Cb 0.24 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2o3r h SER 264 CO -0.20 1.48 0.24 0.40 -1.14 0.00 0.00 176.83 177.61 2o3r h ILE 265 N 0.08 1.19 0.00 3.27 2.04 -1.75 0.87 117.51 123.21 2o3r h ILE 265 Ca -0.23 -0.53 -0.15 0.00 1.00 0.00 0.00 64.86 64.95 2o3r h ILE 265 Cb 2.03 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 2o3r h ILE 265 CO 0.18 0.21 -0.70 0.16 0.00 0.00 0.00 178.15 178.01 2o3r h ILE 266 N 0.65 1.39 -0.53 -0.67 3.07 -1.67 -2.23 117.51 117.51 2o3r h ILE 266 Ca 0.17 -2.48 -0.09 0.00 1.55 0.00 0.00 64.86 64.01 2o3r h ILE 266 Cb 0.11 2.38 -0.02 0.00 -0.27 0.00 0.00 36.82 39.02 2o3r h ILE 266 CO -0.02 0.68 -0.04 0.28 -1.05 0.00 0.00 178.15 178.00 2o3r h SER 267 N 0.00 0.92 0.25 2.16 0.02 -1.36 0.35 113.55 115.89 2o3r h SER 267 Ca -0.01 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2o3r h SER 267 Cb 1.32 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2o3r h SER 267 CO 0.09 1.00 0.00 1.17 -1.14 0.00 0.00 176.83 177.95 2o3r n LYS 268 N -4.18 0.49 -0.23 3.45 3.00 0.28 0.19 118.16 121.17 2o3r n LYS 268 Ca 0.02 0.04 0.10 0.00 -0.00 0.00 0.00 58.31 58.48 2o3r n LYS 268 Cb 0.35 -1.50 0.22 0.00 0.00 0.00 0.00 35.03 34.10 2o3r n LYS 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2o3r n ARG 269 N -1.17 2.49 -3.62 1.64 5.12 -0.82 -4.99 116.66 115.31 2o3r n ARG 269 Ca 0.14 -2.28 -0.25 0.00 -1.93 0.00 0.00 57.85 53.52 2o3r n ARG 269 Cb 0.14 -1.47 0.04 0.00 -1.16 0.00 0.00 32.46 30.01 2o3r n ARG 269 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2o3r n ASN 270 N 1.32 -4.16 -4.24 0.55 2.85 0.13 -4.64 115.26 107.08 2o3r n ASN 270 Ca 0.19 -0.90 -0.25 0.00 -0.11 0.00 0.00 54.58 53.50 2o3r n ASN 270 Cb 0.56 -3.90 -0.14 0.00 1.24 0.00 0.00 39.78 37.54 2o3r n ASN 270 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2o3r s ILE 271 N -3.54 1.61 0.37 -1.44 1.01 0.12 -4.83 121.20 114.50 2o3r s ILE 271 Ca 0.32 -1.13 -0.25 0.00 0.00 0.00 0.00 60.65 59.59 2o3r s ILE 271 Cb -0.09 -1.39 -0.10 0.00 0.01 0.00 0.00 42.46 40.89 2o3r s ILE 271 CO 0.83 0.23 0.99 -1.10 0.00 0.00 0.00 174.94 175.88 2o3r s GLN 272 N -1.07 4.38 -0.07 2.79 -0.21 -0.23 -3.32 119.66 121.93 2o3r s GLN 272 Ca 0.07 1.37 0.02 0.00 0.02 0.00 0.00 55.36 56.84 2o3r s GLN 272 Cb -0.09 -2.62 -0.02 0.00 1.00 0.00 0.00 33.01 31.28 2o3r s GLN 272 CO 0.01 0.08 -0.12 0.12 -2.12 0.00 0.00 175.29 173.27 2o3r s PHE 273 N -1.71 2.80 0.03 0.91 5.36 -1.26 -1.64 117.98 122.47 2o3r s PHE 273 Ca 0.55 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.32 2o3r s PHE 273 Cb -0.19 -1.71 -0.02 0.00 -0.34 0.00 0.00 43.02 40.77 2o3r s PHE 273 CO 0.24 0.14 -0.04 0.45 -1.46 0.00 0.00 175.22 174.55 2o3r s SER 274 N -0.50 0.36 -0.14 6.13 0.15 -0.94 -5.00 113.70 113.76 2o3r s SER 274 Ca 0.07 -0.53 -0.09 0.00 0.70 0.00 0.00 55.95 56.09 2o3r s SER 274 Cb -0.12 0.09 0.04 0.00 -1.71 0.00 0.00 66.02 64.33 2o3r s SER 274 CO 0.02 -0.30 0.34 0.00 1.20 0.00 0.00 173.24 174.50 2o3r s LYS 276 N 0.86 1.18 -0.32 0.00 -0.14 -0.48 -4.98 119.74 115.87 2o3r s LYS 276 Ca -0.06 -1.21 -0.12 0.00 -1.36 0.00 0.00 55.97 53.23 2o3r s LYS 276 Cb -0.06 -1.48 -0.03 0.00 -1.68 0.00 0.00 37.83 34.58 2o3r s LYS 276 CO -0.06 0.34 0.22 -0.80 -0.76 0.00 0.00 175.35 174.29 2o3r s ASN 277 N -1.97 5.99 -0.55 2.83 0.01 -1.26 -1.45 114.94 118.54 2o3r s ASN 277 Ca 0.08 -0.32 -0.16 0.00 -0.71 0.00 0.00 52.86 51.75 2o3r s ASN 277 Cb -0.10 -2.12 0.13 0.00 0.41 0.00 0.00 41.25 39.57 2o3r s ASN 277 CO 0.05 -0.18 0.52 -0.63 -1.51 0.00 0.00 177.10 175.34 2o3r s ILE 278 N 1.72 5.19 0.00 0.60 1.01 0.18 -4.95 121.20 124.95 2o3r s ILE 278 Ca 0.06 -1.48 0.00 0.00 0.00 0.00 0.00 60.65 59.23 2o3r s ILE 278 Cb -0.17 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 37.95 2o3r s ILE 278 CO 0.10 -0.89 0.19 -1.22 0.00 0.00 0.00 174.94 173.12 2o3r n TYR 279 N 5.30 0.00 -2.95 3.97 4.01 -1.26 0.73 117.16 126.96 2o3r n TYR 279 Ca -0.13 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.17 2o3r n TYR 279 Cb 0.40 -0.46 -0.03 0.00 -0.31 0.00 0.00 39.34 38.94 2o3r n TYR 279 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 2o3r s ARG 280 N -1.30 3.27 0.36 -0.72 3.03 -1.26 -4.14 118.95 118.19 2o3r s ARG 280 Ca 0.00 -1.29 0.17 0.00 2.03 0.00 0.00 55.73 56.64 2o3r s ARG 280 Cb 0.00 -4.47 1.13 0.00 -1.03 0.00 0.00 34.95 30.58 2o3r s ARG 280 CO 0.00 -1.73 1.67 -1.35 -1.13 0.00 0.00 175.30 172.76 2o3r h PRO 281 N 9.20 0.30 0.05 3.89 0.11 -1.84 0.11 132.00 143.82 2o3r h PRO 281 Ca -0.13 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.70 2o3r h PRO 281 Cb 1.06 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 32.11 2o3r h PRO 281 CO 1.13 0.20 -1.08 0.38 -0.21 0.00 0.00 178.00 178.42 2o3r h ASP 282 N 0.31 0.61 0.24 -2.05 3.04 -1.98 0.54 116.42 117.13 2o3r h ASP 282 Ca 0.73 -0.53 -0.01 0.00 -3.24 0.00 0.00 57.03 53.97 2o3r h ASP 282 Cb 1.76 -0.19 0.00 0.00 -1.04 0.00 0.00 39.33 39.87 2o3r h ASP 282 CO -0.54 1.35 -0.11 0.11 -2.04 0.00 0.00 179.24 178.01 2o3r h LYS 283 N 0.22 -0.31 -0.98 4.15 1.57 -1.89 -1.84 116.57 117.48 2o3r h LYS 283 Ca -0.12 0.02 0.17 0.00 -1.87 0.00 0.00 60.65 58.85 2o3r h LYS 283 Cb 1.74 0.07 -0.17 0.00 0.08 0.00 0.00 32.23 33.95 2o3r h LYS 283 CO 0.19 0.03 -0.33 0.35 -0.57 0.00 0.00 179.45 179.12 2o3r h PHE 284 N -0.69 -0.86 -0.34 -1.35 3.57 -0.73 0.70 116.94 117.23 2o3r h PHE 284 Ca -0.03 0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2o3r h PHE 284 Cb 0.48 0.53 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 2o3r h PHE 284 CO 0.04 -0.41 0.12 -0.07 -2.23 0.00 0.00 178.31 175.75 2o3r h LEU 285 N -0.00 0.49 -1.13 0.59 3.38 0.12 -1.08 115.31 117.68 2o3r h LEU 285 Ca 0.40 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2o3r h LEU 285 Cb 0.65 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2o3r h LEU 285 CO -0.99 0.55 0.02 -0.61 0.09 0.00 0.00 178.44 177.50 2o3r h GLN 286 N 0.40 0.63 -0.77 1.13 5.75 0.31 -1.82 115.11 120.74 2o3r h GLN 286 Ca 0.11 -0.14 0.05 0.00 -0.15 0.00 0.00 58.65 58.53 2o3r h GLN 286 Cb 0.23 -0.09 -0.06 0.00 1.07 0.00 0.00 27.48 28.63 2o3r h GLN 286 CO -0.01 0.64 0.47 0.00 -2.65 0.00 0.00 178.83 177.28 2o3r h VAL 288 N 0.87 1.23 -0.44 0.00 2.07 -0.40 -3.11 116.25 116.47 2o3r h VAL 288 Ca 0.33 -0.90 -0.13 0.00 0.82 0.00 0.00 66.70 66.82 2o3r h VAL 288 Cb 0.14 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2o3r h VAL 288 CO -0.16 0.32 -0.24 0.11 0.02 0.00 0.00 177.57 177.62 2o3r h LYS 289 N 0.73 0.91 -2.54 1.57 1.57 -0.99 -3.41 116.57 114.41 2o3r h LYS 289 Ca 0.15 -0.39 -0.32 0.00 -1.87 0.00 0.00 60.65 58.22 2o3r h LYS 289 Cb 0.38 -0.03 -0.36 0.00 0.08 0.00 0.00 32.23 32.30 2o3r h LYS 289 CO 0.01 1.04 -0.63 -0.80 -0.57 0.00 0.00 179.45 178.50 2o3r s ASN 290 N -6.75 1.42 0.88 0.86 -0.87 -0.93 -5.10 114.94 104.45 2o3r s ASN 290 Ca -0.10 -0.25 -0.13 0.00 -1.57 0.00 0.00 52.86 50.81 2o3r s ASN 290 Cb 0.12 0.36 0.06 0.00 -0.02 0.00 0.00 41.25 41.78 2o3r s ASN 290 CO 0.86 -0.33 0.80 -0.81 -2.57 0.00 0.00 177.10 175.06 2o3r n PRO 291 N 5.32 -0.13 -2.34 -0.60 -0.04 -1.21 -4.26 135.00 131.74 2o3r n PRO 291 Ca -0.05 0.02 -0.01 0.00 -0.04 0.00 0.00 63.50 63.41 2o3r n PRO 291 Cb 0.49 -2.13 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2o3r n PRO 291 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2o3r n GLU 292 N -2.58 -0.92 -2.15 0.54 0.00 -1.26 -5.00 120.64 109.26 2o3r n GLU 292 Ca 0.10 1.16 -0.11 0.00 0.00 0.00 0.00 57.16 58.31 2o3r n GLU 292 Cb 0.52 -3.87 0.05 0.00 0.00 0.00 0.00 31.44 28.13 2o3r n GLU 292 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2o3r n ASP 293 N -1.12 3.20 0.00 -1.84 -0.08 -1.26 -5.02 116.55 110.43 2o3r n ASP 293 Ca 0.02 -3.04 0.00 0.00 -1.51 0.00 0.00 54.79 50.26 2o3r n ASP 293 Cb 0.43 -0.40 0.00 0.00 2.34 0.00 0.00 41.12 43.48 2o3r n ASP 293 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2o3r n SER 294 N -0.63 0.00 -2.30 1.67 3.41 -1.26 -2.34 113.62 112.17 2o3r n SER 294 Ca 0.26 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.58 2o3r n SER 294 Cb 0.90 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.89 2o3r n SER 294 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2o3r n SER 295 N 2.65 7.21 0.00 4.04 2.88 -1.26 -5.28 113.62 123.86 2o3r n SER 295 Ca 0.00 -3.53 0.00 0.00 -1.33 0.00 0.00 58.87 54.01 2o3r n SER 295 Cb 0.00 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 2o3r n SER 295 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81