#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pgl h TRP 46 N 0.00 0.00 -3.24 2.89 0.09 -2.08 -3.43 115.95 110.18 2pgl h TRP 46 Ca 0.00 0.00 -0.43 0.00 0.09 0.00 0.00 58.89 58.55 2pgl h TRP 46 Cb 0.00 0.00 -0.39 0.00 0.08 0.00 0.00 29.16 28.85 2pgl h TRP 46 CO 0.00 0.00 -0.75 -0.98 0.09 0.00 0.00 178.44 176.80 2pgl s ARG 47 N -3.18 0.28 0.74 0.12 1.70 -1.26 -5.15 118.95 112.21 2pgl s ARG 47 Ca 0.07 0.09 -0.10 0.00 -0.47 0.00 0.00 55.73 55.32 2pgl s ARG 47 Cb 0.11 -1.14 0.05 0.00 -0.57 0.00 0.00 34.95 33.41 2pgl s ARG 47 CO 0.69 -0.43 1.10 -0.65 -1.08 0.00 0.00 175.30 174.93 2pgl s GLN 48 N 2.05 2.34 0.01 3.89 -1.52 -1.26 -5.00 119.66 120.18 2pgl s GLN 48 Ca 0.04 0.13 -0.22 0.00 -1.95 0.00 0.00 55.36 53.36 2pgl s GLN 48 Cb -0.14 -2.04 -0.17 0.00 -0.22 0.00 0.00 33.01 30.44 2pgl s GLN 48 CO -0.06 -1.30 1.27 1.15 -0.25 0.00 0.00 175.29 176.11 2pgl h THR 49 N -0.78 1.39 -1.82 -0.19 2.02 -1.94 -3.46 112.91 108.13 2pgl h THR 49 Ca -0.45 -1.40 -0.52 0.00 0.77 0.00 0.00 66.41 64.80 2pgl h THR 49 Cb 1.30 2.10 -0.06 0.00 -1.74 0.00 0.00 68.15 69.75 2pgl h THR 49 CO 0.64 0.40 -0.49 0.26 0.37 0.00 0.00 175.52 176.69 2pgl s TRP 50 N -4.07 2.77 -0.34 3.16 0.52 -1.26 -5.05 118.94 114.66 2pgl s TRP 50 Ca -0.15 -0.38 0.23 0.00 0.02 0.00 0.00 56.10 55.83 2pgl s TRP 50 Cb 0.04 -1.75 0.09 0.00 -1.15 0.00 0.00 33.47 30.69 2pgl s TRP 50 CO 0.74 0.24 1.13 0.77 0.02 0.00 0.00 176.95 179.84 2pgl h SER 51 N 1.40 0.00 -3.75 2.95 0.02 -1.90 -3.44 113.55 108.82 2pgl h SER 51 Ca -0.44 -0.06 -0.49 0.00 -0.84 0.00 0.00 61.79 59.96 2pgl h SER 51 Cb 1.25 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.84 2pgl h SER 51 CO 0.61 0.03 0.19 -0.83 -1.14 0.00 0.00 176.83 175.69 2pgl s GLY 52 N -4.19 1.55 0.58 -3.77 0.00 -0.02 -4.84 107.32 96.64 2pgl s GLY 52 Ca 0.01 -0.47 -0.19 0.00 0.00 0.00 0.00 44.72 44.07 2pgl s GLY 52 CO 0.77 -0.26 0.89 -1.05 0.00 0.00 0.00 173.10 173.45 2pgl n PRO 53 N -2.44 0.86 -1.68 2.90 -0.02 -1.26 -2.13 135.00 131.24 2pgl n PRO 53 Ca 0.03 0.33 -0.30 0.00 -2.02 0.00 0.00 63.50 61.54 2pgl n PRO 53 Cb 0.56 -2.07 0.18 0.00 -0.02 0.00 0.00 33.50 32.14 2pgl n PRO 53 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2pgl s GLY 54 N -1.19 1.68 0.28 -1.23 0.00 -1.25 -2.19 107.32 103.43 2pgl s GLY 54 Ca 0.73 -0.98 -0.30 0.00 0.00 0.00 0.00 44.72 44.17 2pgl s GLY 54 CO 0.49 -0.25 1.53 2.41 0.00 0.00 0.00 173.10 177.28 2pgl n THR 55 N -3.94 1.07 -1.63 0.90 -1.04 -0.53 -4.75 114.28 104.36 2pgl n THR 55 Ca 0.13 -0.27 -0.46 0.00 -2.04 0.00 0.00 64.05 61.41 2pgl n THR 55 Cb 0.60 -1.80 -0.03 0.00 -1.82 0.00 0.00 70.33 67.27 2pgl n THR 55 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2pgl n THR 56 N 1.95 1.01 -1.60 12.58 -1.04 -0.57 -4.71 114.28 121.90 2pgl n THR 56 Ca 0.09 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.05 61.43 2pgl n THR 56 Cb 0.35 -1.20 0.01 0.00 -1.82 0.00 0.00 70.33 67.67 2pgl n THR 56 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2pgl n LYS 57 N 1.81 1.30 -2.68 -2.82 2.85 -1.26 -2.25 118.16 115.12 2pgl n LYS 57 Ca 0.13 0.47 -0.18 0.00 -1.05 0.00 0.00 58.31 57.67 2pgl n LYS 57 Cb 0.29 -1.98 0.00 0.00 -0.65 0.00 0.00 35.03 32.69 2pgl n LYS 57 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2pgl n ARG 58 N 0.25 -2.78 -0.15 -1.58 1.74 -1.26 -4.89 116.66 108.00 2pgl n ARG 58 Ca 0.09 0.76 -0.03 0.00 -0.77 0.00 0.00 57.85 57.91 2pgl n ARG 58 Cb 0.38 -5.44 0.05 0.00 -1.02 0.00 0.00 32.46 26.43 2pgl n ARG 58 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2pgl h PHE 59 N -0.42 -0.12 -0.52 -1.55 3.57 -1.81 0.30 116.94 116.39 2pgl h PHE 59 Ca -0.42 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.16 2pgl h PHE 59 Cb 1.30 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 40.13 2pgl h PHE 59 CO 0.62 -0.15 0.29 -1.35 -2.23 0.00 0.00 178.31 175.49 2pgl h PRO 60 N 0.07 0.54 -0.42 6.41 0.11 -1.90 -1.00 132.00 135.81 2pgl h PRO 60 Ca 0.24 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.20 2pgl h PRO 60 Cb 0.37 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 2pgl h PRO 60 CO -0.45 0.36 -0.23 0.93 -0.21 0.00 0.00 178.00 178.40 2pgl h GLU 61 N 0.56 0.85 -0.10 1.05 3.07 -1.82 -1.98 114.58 116.21 2pgl h GLU 61 Ca 0.22 -0.36 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 2pgl h GLU 61 Cb 0.09 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2pgl h GLU 61 CO -0.13 1.00 0.04 1.15 -1.40 0.00 0.00 179.01 179.66 2pgl h THR 62 N 0.74 1.17 -0.42 1.13 2.02 -0.64 -1.06 112.91 115.84 2pgl h THR 62 Ca 0.10 -0.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.75 2pgl h THR 62 Cb 0.77 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 2pgl h THR 62 CO 0.06 0.15 0.15 0.58 0.37 0.00 0.00 175.52 176.83 2pgl h VAL 63 N -0.01 1.21 -0.54 3.16 2.07 -1.16 -0.41 116.25 120.57 2pgl h VAL 63 Ca 0.03 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 2pgl h VAL 63 Cb 0.20 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 2pgl h VAL 63 CO -0.00 0.24 0.17 0.25 0.02 0.00 0.00 177.57 178.25 2pgl h LEU 64 N 0.54 0.79 -0.32 2.57 5.85 -1.32 -0.16 115.31 123.27 2pgl h LEU 64 Ca 0.14 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2pgl h LEU 64 Cb 0.23 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2pgl h LEU 64 CO -0.01 0.79 0.17 0.00 -0.34 0.00 0.00 178.44 179.05 2pgl h ALA 65 N 1.03 0.40 -0.54 1.25 0.00 -1.06 -0.93 119.26 119.41 2pgl h ALA 65 Ca 0.17 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 2pgl h ALA 65 Cb 0.28 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 2pgl h ALA 65 CO -0.01 -0.06 0.24 0.00 0.00 0.00 0.00 179.25 179.42 2pgl h ARG 66 N 0.39 0.44 -0.22 0.00 3.08 -0.73 -0.14 114.38 117.20 2pgl h ARG 66 Ca 0.11 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2pgl h ARG 66 Cb 0.07 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2pgl h ARG 66 CO -0.02 0.29 0.14 0.00 -1.07 0.00 0.00 179.97 179.32 2pgl h VAL 68 N 0.28 0.47 -0.28 0.00 2.07 -0.79 -1.30 116.25 116.71 2pgl h VAL 68 Ca 0.08 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.65 2pgl h VAL 68 Cb -0.01 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 30.18 2pgl h VAL 68 CO -0.02 0.00 -0.01 0.50 0.02 0.00 0.00 177.57 178.06 2pgl h LYS 69 N -0.38 0.06 -0.29 1.57 1.63 -0.77 -0.14 116.57 118.24 2pgl h LYS 69 Ca 0.05 -0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 2pgl h LYS 69 Cb 0.45 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.05 2pgl h LYS 69 CO -0.18 0.04 0.18 -0.92 -3.45 0.00 0.00 179.45 175.12 2pgl h TYR 70 N 0.07 0.38 0.00 1.91 3.20 -0.76 -2.03 116.97 119.73 2pgl h TYR 70 Ca 0.13 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 2pgl h TYR 70 Cb 0.18 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 2pgl h TYR 70 CO -0.22 0.27 -0.29 1.79 -1.64 0.00 0.00 178.16 178.06 2pgl h THR 71 N 0.38 0.75 -0.44 1.81 1.35 -1.01 0.77 112.91 116.52 2pgl h THR 71 Ca 0.11 -1.24 -0.14 0.00 -0.55 0.00 0.00 66.41 64.59 2pgl h THR 71 Cb -0.01 1.78 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 2pgl h THR 71 CO -0.02 0.29 -0.26 -0.33 -0.25 0.00 0.00 175.52 174.94 2pgl h GLU 72 N 0.00 0.95 0.15 4.72 5.08 -0.71 -3.36 114.58 121.41 2pgl h GLU 72 Ca -0.00 -0.44 -0.24 0.00 -1.00 0.00 0.00 59.36 57.68 2pgl h GLU 72 Cb 0.76 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.01 2pgl h GLU 72 CO 0.04 1.10 -1.10 0.82 -1.00 0.00 0.00 179.01 178.87 2pgl h ILE 73 N 0.79 1.33 -3.39 3.13 1.08 -0.81 -3.43 117.51 116.20 2pgl h ILE 73 Ca 0.09 -2.52 -0.73 0.00 -0.39 0.00 0.00 64.86 61.31 2pgl h ILE 73 Cb 0.84 3.04 -0.21 0.00 -3.07 0.00 0.00 36.82 37.41 2pgl h ILE 73 CO 0.07 0.73 -0.35 -1.00 -0.69 0.00 0.00 178.15 176.92 2pgl s HIS 74 N -2.47 3.23 0.36 1.37 3.76 0.21 -4.97 115.29 116.79 2pgl s HIS 74 Ca -0.15 -0.74 0.26 0.00 -0.15 0.00 0.00 55.06 54.27 2pgl s HIS 74 Cb 0.02 -2.94 1.30 0.00 1.11 0.00 0.00 32.58 32.08 2pgl s HIS 74 CO 0.83 -0.72 2.01 -1.00 -0.85 0.00 0.00 174.74 175.01 2pgl h PRO 75 N 8.71 0.00 0.00 8.40 0.13 -1.84 -2.06 132.00 145.34 2pgl h PRO 75 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2pgl h PRO 75 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2pgl h PRO 75 CO 0.82 0.16 0.00 1.05 -0.23 0.00 0.00 178.00 179.79 2pgl h GLU 76 N 0.00 0.00 -0.65 0.86 9.09 -1.93 -2.51 114.58 119.44 2pgl h GLU 76 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2pgl h GLU 76 Cb 0.43 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.53 2pgl h GLU 76 CO 0.02 0.00 0.00 -1.33 0.05 0.00 0.00 179.01 177.75 2pgl n MET 77 N -2.95 2.52 0.27 1.06 2.81 -0.78 -4.64 117.12 115.41 2pgl n MET 77 Ca 0.02 -2.34 0.18 0.00 -1.81 0.00 0.00 57.70 53.75 2pgl n MET 77 Cb 0.40 -1.51 0.93 0.00 -0.71 0.00 0.00 33.22 32.32 2pgl n MET 77 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2pgl h ARG 78 N 3.80 0.00 0.00 0.03 2.43 -1.36 -2.68 114.38 116.59 2pgl h ARG 78 Ca 0.00 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.87 2pgl h ARG 78 Cb 0.88 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.37 2pgl h ARG 78 CO 0.00 0.00 -1.81 -2.39 -1.51 0.00 0.00 179.97 174.27 2pgl n HIS 79 N -3.50 0.86 -1.56 2.20 1.44 -1.26 -4.97 115.22 108.44 2pgl n HIS 79 Ca -0.01 0.31 -0.61 0.00 -2.01 0.00 0.00 57.72 55.41 2pgl n HIS 79 Cb 0.25 -1.16 -0.08 0.00 0.12 0.00 0.00 29.99 29.11 2pgl n HIS 79 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 2pgl n VAL 80 N -3.01 0.00 -2.79 0.61 0.31 -1.01 -4.89 118.33 107.55 2pgl n VAL 80 Ca -0.19 -0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.71 2pgl n VAL 80 Cb 1.07 -0.14 -0.04 0.00 -0.91 0.00 0.00 33.84 33.82 2pgl n VAL 80 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2pgl s ASP 81 N 0.68 6.66 0.26 4.52 2.15 -1.26 -4.95 116.67 124.73 2pgl s ASP 81 Ca 0.94 0.52 0.10 0.00 0.43 0.00 0.00 52.55 54.54 2pgl s ASP 81 Cb -1.31 -2.47 0.30 0.00 -0.30 0.00 0.00 42.92 39.15 2pgl s ASP 81 CO 0.62 -0.91 1.58 0.00 -0.17 0.00 0.00 175.17 176.30 2pgl h GLN 83 N 0.01 0.93 -0.67 0.00 5.75 -1.95 -0.47 115.11 118.71 2pgl h GLN 83 Ca -0.01 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 2pgl h GLN 83 Cb 1.15 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 2pgl h GLN 83 CO 0.09 0.64 0.35 0.77 -2.65 0.00 0.00 178.83 178.03 2pgl h SER 84 N 0.95 0.84 0.21 -0.69 0.02 -1.88 0.76 113.55 113.77 2pgl h SER 84 Ca 0.25 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2pgl h SER 84 Cb -0.07 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.26 2pgl h SER 84 CO -0.05 0.71 -0.10 0.58 -1.14 0.00 0.00 176.83 176.83 2pgl h VAL 85 N 0.91 0.82 -0.65 2.27 2.07 -0.98 -1.34 116.25 119.35 2pgl h VAL 85 Ca 0.23 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.68 2pgl h VAL 85 Cb 0.07 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.68 2pgl h VAL 85 CO -0.03 0.03 0.36 -0.25 0.02 0.00 0.00 177.57 177.69 2pgl h TRP 86 N -0.35 0.65 -0.41 1.57 2.91 -0.89 -0.35 115.95 119.07 2pgl h TRP 86 Ca -0.03 0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.06 2pgl h TRP 86 Cb 0.27 -0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 28.68 2pgl h TRP 86 CO -0.04 0.31 0.15 -0.44 -1.03 0.00 0.00 178.44 177.38 2pgl h ASP 87 N 0.66 0.16 -0.65 2.65 3.32 -0.64 0.79 116.42 122.70 2pgl h ASP 87 Ca 0.29 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.35 2pgl h ASP 87 Cb 0.19 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 2pgl h ASP 87 CO -0.18 0.13 0.27 0.00 -1.72 0.00 0.00 179.24 177.74 2pgl h ALA 88 N 1.26 1.20 0.15 3.45 0.00 -0.80 -0.20 119.26 124.33 2pgl h ALA 88 Ca 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2pgl h ALA 88 Cb 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2pgl h ALA 88 CO -0.19 0.58 -0.07 0.35 0.00 0.00 0.00 179.25 179.92 2pgl h PHE 89 N 0.98 -0.19 -0.73 0.00 3.04 -0.43 -2.62 116.94 116.98 2pgl h PHE 89 Ca 0.23 -0.00 0.16 0.00 3.98 0.00 0.00 57.97 62.34 2pgl h PHE 89 Cb 0.18 0.06 -0.11 0.00 2.56 0.00 0.00 35.95 38.65 2pgl h PHE 89 CO 0.01 0.16 0.16 0.87 -2.02 0.00 0.00 178.31 177.50 2pgl h LYS 90 N -0.58 0.25 -0.02 1.11 1.57 -0.78 -2.21 116.57 115.91 2pgl h LYS 90 Ca -0.02 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2pgl h LYS 90 Cb 0.44 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2pgl h LYS 90 CO 0.03 0.16 0.02 0.78 -0.57 0.00 0.00 179.45 179.88 2pgl h GLY 91 N 0.26 0.00 1.39 3.86 0.00 -0.68 0.76 103.07 108.66 2pgl h GLY 91 Ca 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.71 2pgl h GLY 91 CO -0.52 0.00 0.18 0.00 0.00 0.00 0.00 176.54 176.21 2pgl h ALA 92 N 1.98 1.33 0.00 3.60 0.00 -1.08 -3.39 119.26 121.71 2pgl h ALA 92 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2pgl h ALA 92 Cb 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2pgl h ALA 92 CO -0.00 0.49 -0.25 1.97 0.00 0.00 0.00 179.25 181.47 2pgl n PHE 93 N -4.32 0.00 -2.21 0.00 1.16 -0.70 -4.78 117.46 106.60 2pgl n PHE 93 Ca 0.04 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.22 2pgl n PHE 93 Cb 0.18 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.03 2pgl n PHE 93 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2pgl s ILE 94 N -0.66 2.94 -1.90 1.97 -1.09 0.18 -3.00 121.20 119.64 2pgl s ILE 94 Ca 0.00 0.88 0.00 0.00 -2.23 0.00 0.00 60.65 59.30 2pgl s ILE 94 Cb 0.00 -3.54 0.00 0.00 -1.58 0.00 0.00 42.46 37.34 2pgl s ILE 94 CO 0.00 0.16 0.00 -1.20 -1.23 0.00 0.00 174.94 172.67 2pgl n SER 95 N 0.53 -5.62 -4.21 3.58 7.64 -1.18 -4.94 113.62 109.43 2pgl n SER 95 Ca 0.02 0.20 -0.22 0.00 1.01 0.00 0.00 58.87 59.88 2pgl n SER 95 Cb 0.44 -4.75 -0.13 0.00 -1.01 0.00 0.00 64.21 58.76 2pgl n SER 95 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2pgl s LYS 96 N -4.45 1.03 0.02 1.43 1.02 -1.12 -3.99 119.74 113.68 2pgl s LYS 96 Ca 0.00 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.74 2pgl s LYS 96 Cb 0.00 -1.13 -0.07 0.00 -0.52 0.00 0.00 37.83 36.11 2pgl s LYS 96 CO 0.00 0.27 1.54 -1.58 -0.92 0.00 0.00 175.35 174.66 2pgl s HIS 97 N -1.03 2.55 -2.00 3.18 5.65 -1.26 -3.41 115.29 118.97 2pgl s HIS 97 Ca 0.03 0.52 0.16 0.00 0.25 0.00 0.00 55.06 56.02 2pgl s HIS 97 Cb -0.09 -3.82 0.95 0.00 -1.18 0.00 0.00 32.58 28.44 2pgl s HIS 97 CO 0.02 -3.23 1.37 -0.35 -0.65 0.00 0.00 174.74 171.91 2pgl n PRO 98 N 5.73 0.57 -0.32 2.88 -0.04 -1.26 -0.87 135.00 141.68 2pgl n PRO 98 Ca 0.15 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 2pgl n PRO 98 Cb 0.42 -1.44 0.24 0.00 -0.04 0.00 0.00 33.50 32.69 2pgl n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2pgl n ASP 100 N 0.88 3.39 -4.87 0.00 4.64 -0.05 -4.62 116.55 115.92 2pgl n ASP 100 Ca 0.18 -2.99 -0.34 0.00 -1.38 0.00 0.00 54.79 50.26 2pgl n ASP 100 Cb 0.59 -0.40 -0.05 0.00 -1.04 0.00 0.00 41.12 40.21 2pgl n ASP 100 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2pgl s ILE 101 N -4.19 5.08 0.24 5.18 -1.09 -0.64 -4.81 121.20 120.96 2pgl s ILE 101 Ca 0.40 0.45 0.07 0.00 -2.23 0.00 0.00 60.65 59.34 2pgl s ILE 101 Cb 0.37 -3.65 -0.05 0.00 -1.58 0.00 0.00 42.46 37.55 2pgl s ILE 101 CO 0.00 0.25 -0.09 0.42 -1.23 0.00 0.00 174.94 174.29 2pgl s THR 102 N -1.44 1.62 0.43 2.92 -4.23 -1.26 -4.73 115.64 108.95 2pgl s THR 102 Ca 0.34 -2.15 0.10 0.00 -1.18 0.00 0.00 61.69 58.80 2pgl s THR 102 Cb -0.14 -2.25 0.29 0.00 1.34 0.00 0.00 72.50 71.74 2pgl s THR 102 CO 0.19 -0.44 2.05 -0.33 -0.54 0.00 0.00 174.62 175.54 2pgl h GLU 103 N 2.43 0.42 -0.97 3.99 5.08 -1.99 -1.74 114.58 121.80 2pgl h GLU 103 Ca -0.39 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.05 2pgl h GLU 103 Cb 1.23 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.30 2pgl h GLU 103 CO 0.65 0.28 0.61 0.93 -1.00 0.00 0.00 179.01 180.47 2pgl h GLU 104 N 0.43 0.97 -0.80 2.33 3.07 -2.00 -0.82 114.58 117.77 2pgl h GLU 104 Ca 0.17 -0.06 0.16 0.00 -0.50 0.00 0.00 59.36 59.13 2pgl h GLU 104 Cb 0.13 -0.22 -0.06 0.00 -0.84 0.00 0.00 28.75 27.76 2pgl h GLU 104 CO -0.04 0.64 0.53 -0.44 -1.40 0.00 0.00 179.01 178.30 2pgl h ASP 105 N 1.00 0.43 -0.10 1.42 3.32 -1.63 -2.18 116.42 118.67 2pgl h ASP 105 Ca 0.47 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.54 2pgl h ASP 105 Cb 0.39 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2pgl h ASP 105 CO -0.24 0.21 0.00 -1.22 -1.72 0.00 0.00 179.24 176.27 2pgl n TYR 106 N -4.49 0.11 -0.18 4.55 4.02 -0.32 -3.92 117.16 116.93 2pgl n TYR 106 Ca 0.16 -0.06 -0.10 0.00 -0.01 0.00 0.00 57.90 57.89 2pgl n TYR 106 Cb 0.55 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.90 2pgl n TYR 106 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 2pgl h GLN 107 N 2.33 1.02 -0.74 -0.72 1.08 -1.29 -0.24 115.11 116.55 2pgl h GLN 107 Ca 0.00 -0.37 0.05 0.00 -1.45 0.00 0.00 58.65 56.88 2pgl h GLN 107 Cb 0.50 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.81 2pgl h GLN 107 CO 0.00 1.05 0.45 -1.35 -0.95 0.00 0.00 178.83 178.04 2pgl h PRO 108 N 0.90 0.83 -0.51 1.46 0.11 -1.80 -0.41 132.00 132.58 2pgl h PRO 108 Ca 0.14 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.18 2pgl h PRO 108 Cb 0.67 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 2pgl h PRO 108 CO 0.05 0.55 0.24 1.25 -0.21 0.00 0.00 178.00 179.88 2pgl h LEU 109 N 0.85 0.67 -1.25 2.35 5.85 -1.68 -2.03 115.31 120.08 2pgl h LEU 109 Ca 0.31 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 2pgl h LEU 109 Cb 0.10 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2pgl h LEU 109 CO -0.15 0.62 0.15 0.24 -0.34 0.00 0.00 178.44 178.96 2pgl h MET 110 N 0.68 0.67 0.27 1.25 2.86 -0.74 -0.22 114.93 119.70 2pgl h MET 110 Ca 0.18 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2pgl h MET 110 Cb 0.13 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2pgl h MET 110 CO -0.02 0.58 -0.13 -0.22 1.06 0.00 0.00 176.91 178.18 2pgl h LYS 111 N 0.66 -0.35 -0.43 1.72 3.64 -0.64 -1.89 116.57 119.28 2pgl h LYS 111 Ca 0.15 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.65 2pgl h LYS 111 Cb 0.19 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2pgl h LYS 111 CO -0.01 -0.01 0.30 -0.07 -2.27 0.00 0.00 179.45 177.38 2pgl h LEU 112 N -0.75 0.14 -1.14 5.20 3.38 -1.23 -2.03 115.31 118.88 2pgl h LEU 112 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2pgl h LEU 112 Cb 0.50 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2pgl h LEU 112 CO 0.06 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.29 2pgl n GLY 113 N -1.57 0.33 3.66 0.83 0.00 -0.11 -4.95 105.19 103.39 2pgl n GLY 113 Ca 0.07 -0.42 -0.58 0.00 0.00 0.00 0.00 46.02 45.09 2pgl n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2pgl n THR 114 N 0.35 0.14 -3.70 2.61 -1.04 -0.73 -4.75 114.28 107.17 2pgl n THR 114 Ca 0.16 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.05 62.04 2pgl n THR 114 Cb 0.33 -0.88 -0.11 0.00 -1.82 0.00 0.00 70.33 67.85 2pgl n THR 114 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2pgl s GLN 115 N 2.26 0.39 0.06 -2.82 0.74 -1.26 -5.07 119.66 113.95 2pgl s GLN 115 Ca 0.95 0.78 -0.31 0.00 0.05 0.00 0.00 55.36 56.83 2pgl s GLN 115 Cb -1.12 -0.03 -0.07 0.00 1.10 0.00 0.00 33.01 32.89 2pgl s GLN 115 CO 0.62 -0.16 1.41 0.99 -0.55 0.00 0.00 175.29 177.60 2pgl s THR 116 N 1.39 3.49 -0.05 -0.34 2.01 -1.26 -5.04 115.64 115.83 2pgl s THR 116 Ca -0.09 0.98 0.06 0.00 0.31 0.00 0.00 61.69 62.95 2pgl s THR 116 Cb -0.08 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 2pgl s THR 116 CO -0.13 0.03 -0.24 0.68 -0.69 0.00 0.00 174.62 174.28 2pgl s VAL 117 N 1.81 2.19 -0.24 3.82 -7.23 -1.26 -5.06 120.40 114.42 2pgl s VAL 117 Ca 0.65 -1.02 -0.31 0.00 -1.81 0.00 0.00 61.98 59.48 2pgl s VAL 117 Cb -0.34 -1.80 -0.08 0.00 0.56 0.00 0.00 36.38 34.72 2pgl s VAL 117 CO 0.29 0.57 2.17 -2.65 -0.31 0.00 0.00 175.10 175.17 2pgl n PRO 118 N 2.82 1.70 0.26 4.82 -0.02 -1.26 -4.79 135.00 138.54 2pgl n PRO 118 Ca -0.17 0.49 0.12 0.00 -2.02 0.00 0.00 63.50 61.92 2pgl n PRO 118 Cb 0.52 -2.90 0.71 0.00 -0.02 0.00 0.00 33.50 31.81 2pgl n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2pgl n ASN 120 N -3.79 1.97 -0.84 0.00 6.94 -1.26 -0.80 115.26 117.49 2pgl n ASN 120 Ca -0.02 -1.76 0.04 0.00 -0.02 0.00 0.00 54.58 52.82 2pgl n ASN 120 Cb 0.22 -0.12 0.17 0.00 -2.36 0.00 0.00 39.78 37.68 2pgl n ASN 120 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2pgl n LYS 121 N 0.53 1.47 -3.21 -3.83 5.02 -0.75 -4.61 118.16 112.78 2pgl n LYS 121 Ca 0.17 -3.17 -0.39 0.00 -2.02 0.00 0.00 58.31 52.90 2pgl n LYS 121 Cb 0.38 -1.42 -0.06 0.00 -0.02 0.00 0.00 35.03 33.92 2pgl n LYS 121 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2pgl s ILE 122 N -2.84 4.91 -0.25 -0.18 1.01 -1.26 -0.81 121.20 121.78 2pgl s ILE 122 Ca 0.38 1.24 0.00 0.00 0.00 0.00 0.00 60.65 62.27 2pgl s ILE 122 Cb 0.37 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.95 2pgl s ILE 122 CO -0.08 0.42 -0.09 -0.22 0.00 0.00 0.00 174.94 174.97 2pgl s LEU 123 N -0.18 3.20 0.46 2.97 2.96 -0.11 -2.47 118.68 125.51 2pgl s LEU 123 Ca 0.31 -1.06 0.00 0.00 -0.22 0.00 0.00 54.13 53.16 2pgl s LEU 123 Cb -0.18 -1.61 -0.00 0.00 0.50 0.00 0.00 46.19 44.90 2pgl s LEU 123 CO 0.17 -0.15 0.68 -0.76 -1.32 0.00 0.00 176.35 174.98 2pgl s LEU 124 N 1.24 3.63 0.12 -0.68 1.43 0.85 -4.22 118.68 121.04 2pgl s LEU 124 Ca -0.03 0.31 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 2pgl s LEU 124 Cb -0.18 -3.18 0.05 0.00 0.03 0.00 0.00 46.19 42.91 2pgl s LEU 124 CO -0.05 -0.72 0.46 -1.66 0.23 0.00 0.00 176.35 174.61 2pgl s TRP 125 N -2.58 -0.31 -0.07 0.29 1.48 -1.26 -1.32 118.94 115.17 2pgl s TRP 125 Ca 0.49 0.07 -0.03 0.00 -1.06 0.00 0.00 56.10 55.57 2pgl s TRP 125 Cb -0.10 0.34 0.04 0.00 -1.16 0.00 0.00 33.47 32.59 2pgl s TRP 125 CO 0.38 -0.72 0.12 0.45 -4.06 0.00 0.00 176.95 173.12 2pgl s SER 126 N -2.66 0.93 -1.90 -2.66 0.15 -0.71 -4.65 113.70 102.19 2pgl s SER 126 Ca 0.01 0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2pgl s SER 126 Cb 0.01 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.43 2pgl s SER 126 CO -0.11 -0.25 0.00 0.54 1.20 0.00 0.00 173.24 174.62 2pgl n ARG 127 N 5.32 -1.58 -2.70 5.44 3.00 -1.26 -3.64 116.66 121.23 2pgl n ARG 127 Ca -0.04 1.06 -0.06 0.00 -0.01 0.00 0.00 57.85 58.81 2pgl n ARG 127 Cb 0.50 -5.56 0.08 0.00 0.00 0.00 0.00 32.46 27.48 2pgl n ARG 127 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 2pgl n ILE 128 N -3.01 0.53 -0.18 0.55 0.13 -1.26 -4.76 119.36 111.36 2pgl n ILE 128 Ca -0.21 -2.16 -0.06 0.00 -1.10 0.00 0.00 62.75 59.21 2pgl n ILE 128 Cb 0.66 0.94 0.09 0.00 -0.84 0.00 0.00 39.64 40.49 2pgl n ILE 128 CO 0.00 0.00 0.00 0.07 2.80 0.00 0.00 176.55 179.42 2pgl h LYS 129 N 2.27 0.97 -0.50 9.51 2.10 -1.96 -3.03 116.57 125.92 2pgl h LYS 129 Ca -0.22 -0.26 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2pgl h LYS 129 Cb 1.25 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 32.45 2pgl h LYS 129 CO 0.14 0.92 0.32 -0.44 -2.00 0.00 0.00 179.45 178.40 2pgl h ASP 130 N 0.90 0.59 -0.36 7.07 3.32 -1.99 -1.07 116.42 124.88 2pgl h ASP 130 Ca 0.17 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 2pgl h ASP 130 Cb 0.46 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2pgl h ASP 130 CO 0.02 0.44 0.03 0.25 -1.72 0.00 0.00 179.24 178.26 2pgl h LEU 131 N 0.68 0.59 -0.62 1.55 6.46 -1.98 0.16 115.31 122.15 2pgl h LEU 131 Ca 0.18 -0.28 0.13 0.00 -0.12 0.00 0.00 57.88 57.78 2pgl h LEU 131 Cb -0.05 -0.16 -0.10 0.00 -0.73 0.00 0.00 40.66 39.62 2pgl h LEU 131 CO -0.04 0.73 0.09 0.00 -0.62 0.00 0.00 178.44 178.60 2pgl h ALA 132 N 0.88 0.71 -0.13 1.25 0.00 -1.36 0.35 119.26 120.96 2pgl h ALA 132 Ca 0.11 0.16 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 2pgl h ALA 132 Cb 0.41 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2pgl h ALA 132 CO 0.01 -0.34 -0.34 0.45 0.00 0.00 0.00 179.25 179.03 2pgl h HIS 133 N 0.21 0.60 -0.83 0.00 3.86 -0.90 -2.13 115.15 115.96 2pgl h HIS 133 Ca 0.33 -0.23 0.04 0.00 -1.16 0.00 0.00 60.37 59.35 2pgl h HIS 133 Cb 0.52 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 28.84 2pgl h HIS 133 CO -0.29 0.96 0.55 1.96 0.86 0.00 0.00 177.93 181.97 2pgl h GLN 134 N 0.07 0.97 -0.02 2.45 4.20 -0.44 -2.00 115.11 120.34 2pgl h GLN 134 Ca -0.01 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 2pgl h GLN 134 Cb 0.95 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 28.51 2pgl h GLN 134 CO 0.07 0.64 -0.00 0.35 -0.67 0.00 0.00 178.83 179.22 2pgl h PHE 135 N 1.00 0.04 -0.07 2.96 3.04 -0.77 -3.19 116.94 119.96 2pgl h PHE 135 Ca 0.34 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 62.21 2pgl h PHE 135 Cb 0.08 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.57 2pgl h PHE 135 CO -0.00 0.35 -0.27 1.79 -2.02 0.00 0.00 178.31 178.16 2pgl h THR 136 N -0.28 1.22 0.00 4.41 1.35 -1.22 -2.91 112.91 115.48 2pgl h THR 136 Ca 0.01 -1.05 -0.00 0.00 -0.55 0.00 0.00 66.41 64.81 2pgl h THR 136 Cb 0.33 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 2pgl h THR 136 CO 0.00 0.31 -0.01 1.56 -0.25 0.00 0.00 175.52 177.13 2pgl h GLN 137 N 0.11 0.00 0.09 4.72 4.20 -1.35 0.04 115.11 122.91 2pgl h GLN 137 Ca 0.02 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2pgl h GLN 137 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 2pgl h GLN 137 CO 0.04 0.01 -0.04 0.28 -0.67 0.00 0.00 178.83 178.45 2pgl h VAL 138 N 0.00 1.00 0.00 -0.54 2.07 -1.54 -3.41 116.25 113.83 2pgl h VAL 138 Ca -0.00 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.17 2pgl h VAL 138 Cb 0.26 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 2pgl h VAL 138 CO 0.00 0.08 -0.20 0.00 0.02 0.00 0.00 177.57 177.46 2pgl n GLN 139 N -5.08 0.00 -3.72 1.57 10.64 -1.23 -5.03 117.38 114.52 2pgl n GLN 139 Ca -0.08 -0.52 -0.26 0.00 -1.83 0.00 0.00 57.00 54.31 2pgl n GLN 139 Cb 0.13 0.09 0.06 0.00 -0.86 0.00 0.00 30.24 29.66 2pgl n GLN 139 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2pgl n ARG 140 N 0.03 -6.80 -0.04 2.61 1.74 -0.00 -4.85 116.66 109.35 2pgl n ARG 140 Ca -0.08 0.73 0.01 0.00 -0.77 0.00 0.00 57.85 57.74 2pgl n ARG 140 Cb 0.62 -5.70 0.32 0.00 -1.02 0.00 0.00 32.46 26.68 2pgl n ARG 140 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2pgl h ASP 141 N -2.38 0.55 -5.62 0.55 3.32 -1.86 -3.45 116.42 107.54 2pgl h ASP 141 Ca -0.58 -0.07 -0.28 0.00 0.02 0.00 0.00 57.03 56.13 2pgl h ASP 141 Cb 1.37 -0.14 -0.13 0.00 0.22 0.00 0.00 39.33 40.65 2pgl h ASP 141 CO 0.60 0.52 -0.46 -0.04 -1.72 0.00 0.00 179.24 178.15 2pgl s MET 142 N -5.24 1.50 -0.07 3.56 -1.94 -1.26 -4.91 119.30 110.93 2pgl s MET 142 Ca -0.08 -1.70 0.02 0.00 -1.71 0.00 0.00 55.69 52.21 2pgl s MET 142 Cb 0.16 0.34 0.02 0.00 2.01 0.00 0.00 34.83 37.36 2pgl s MET 142 CO 0.76 -0.55 -0.11 -0.06 -0.01 0.00 0.00 175.02 175.05 2pgl s PHE 143 N -3.79 1.38 0.53 -0.03 0.08 0.01 -4.78 117.98 111.39 2pgl s PHE 143 Ca 0.36 -0.53 0.05 0.00 0.12 0.00 0.00 56.93 56.93 2pgl s PHE 143 Cb 0.04 -1.05 0.05 0.00 -0.57 0.00 0.00 43.02 41.49 2pgl s PHE 143 CO 0.17 -0.30 0.74 0.95 -0.10 0.00 0.00 175.22 176.67 2pgl s THR 144 N 0.84 2.60 0.43 0.64 -4.23 -1.26 -0.93 115.64 113.73 2pgl s THR 144 Ca -0.11 -0.84 0.17 0.00 -1.18 0.00 0.00 61.69 59.72 2pgl s THR 144 Cb -0.15 -2.76 0.36 0.00 1.34 0.00 0.00 72.50 71.29 2pgl s THR 144 CO 0.02 0.00 1.92 0.25 -0.54 0.00 0.00 174.62 176.26 2pgl h LEU 145 N 0.21 0.36 -0.02 4.79 5.85 -1.97 -0.22 115.31 124.31 2pgl h LEU 145 Ca -0.38 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.36 2pgl h LEU 145 Cb 1.28 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.27 2pgl h LEU 145 CO 0.45 0.18 0.00 -0.62 -0.34 0.00 0.00 178.44 178.12 2pgl n GLU 146 N -4.47 0.02 0.00 1.25 4.71 -1.26 -1.49 120.64 119.40 2pgl n GLU 146 Ca 0.14 0.12 0.13 0.00 -0.01 0.00 0.00 57.16 57.55 2pgl n GLU 146 Cb 0.55 -1.53 0.48 0.00 -1.01 0.00 0.00 31.44 29.94 2pgl n GLU 146 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2pgl n ASP 147 N -1.56 0.51 -4.91 1.62 10.43 -0.09 -3.48 116.55 119.08 2pgl n ASP 147 Ca 0.05 -0.39 -0.28 0.00 2.57 0.00 0.00 54.79 56.74 2pgl n ASP 147 Cb 0.28 -0.02 -0.03 0.00 1.84 0.00 0.00 41.12 43.19 2pgl n ASP 147 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2pgl s THR 148 N -2.68 5.02 0.19 -3.53 -4.23 -0.55 -4.95 115.64 104.90 2pgl s THR 148 Ca 0.22 0.02 -0.16 0.00 -1.18 0.00 0.00 61.69 60.59 2pgl s THR 148 Cb 0.19 -3.75 0.16 0.00 1.34 0.00 0.00 72.50 70.44 2pgl s THR 148 CO 0.54 -0.37 1.64 0.25 -0.54 0.00 0.00 174.62 176.14 2pgl h LEU 149 N 1.51 -0.58 -0.21 4.79 5.85 -1.89 -0.94 115.31 123.83 2pgl h LEU 149 Ca -0.48 0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 2pgl h LEU 149 Cb 1.19 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.57 2pgl h LEU 149 CO 0.65 -0.20 -0.06 -0.07 -0.34 0.00 0.00 178.44 178.42 2pgl h LEU 150 N -0.04 0.42 -0.81 2.25 3.38 -1.86 -0.32 115.31 118.33 2pgl h LEU 150 Ca 0.25 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.92 2pgl h LEU 150 Cb 0.42 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 2pgl h LEU 150 CO -0.55 0.70 0.48 1.23 0.09 0.00 0.00 178.44 180.39 2pgl h GLY 151 N 0.14 1.23 0.96 0.83 0.00 -1.55 -2.72 103.07 101.96 2pgl h GLY 151 Ca 0.05 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 2pgl h GLY 151 CO 0.02 0.18 0.16 -1.82 0.00 0.00 0.00 176.54 175.09 2pgl h TYR 152 N 0.84 0.76 -0.63 5.60 5.03 -0.83 -0.96 116.97 126.78 2pgl h TYR 152 Ca 0.37 -0.07 0.05 0.00 2.58 0.00 0.00 58.73 61.66 2pgl h TYR 152 Cb 0.26 -0.22 -0.05 0.00 1.55 0.00 0.00 36.73 38.27 2pgl h TYR 152 CO -0.05 0.66 0.36 -0.07 -1.32 0.00 0.00 178.16 177.74 2pgl h LEU 153 N 0.64 0.54 0.00 2.82 3.38 -0.77 -3.24 115.31 118.69 2pgl h LEU 153 Ca 0.16 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2pgl h LEU 153 Cb 0.25 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2pgl h LEU 153 CO -0.01 0.36 -0.93 0.00 0.09 0.00 0.00 178.44 177.95 2pgl n ALA 154 N -2.34 4.09 -1.65 1.53 0.00 -1.07 -4.79 120.51 116.28 2pgl n ALA 154 Ca 0.07 -0.49 -0.48 0.00 0.00 0.00 0.00 53.44 52.53 2pgl n ALA 154 Cb 0.14 -0.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.65 2pgl n ALA 154 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2pgl n ASP 155 N -1.63 2.69 0.00 0.00 4.64 -0.38 -1.23 116.55 120.64 2pgl n ASP 155 Ca 0.04 1.08 0.00 0.00 -1.38 0.00 0.00 54.79 54.53 2pgl n ASP 155 Cb 0.36 -1.34 0.00 0.00 -1.04 0.00 0.00 41.12 39.10 2pgl n ASP 155 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 2pgl n ASP 156 N 3.60 -2.86 -4.96 1.67 8.00 -1.26 -5.00 116.55 115.73 2pgl n ASP 156 Ca 0.18 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.47 2pgl n ASP 156 Cb 0.25 -1.96 -0.02 0.00 -0.02 0.00 0.00 41.12 39.38 2pgl n ASP 156 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2pgl s LEU 157 N 0.00 4.27 0.01 0.64 1.43 -0.36 -5.05 118.68 119.61 2pgl s LEU 157 Ca 0.00 0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 2pgl s LEU 157 Cb 0.00 -2.94 -0.01 0.00 0.03 0.00 0.00 46.19 43.26 2pgl s LEU 157 CO 0.00 -0.11 -0.11 -0.89 0.23 0.00 0.00 176.35 175.48 2pgl s THR 158 N -2.03 0.85 -0.05 5.49 2.01 -1.26 -5.01 115.64 115.63 2pgl s THR 158 Ca 0.35 -0.67 -0.24 0.00 0.31 0.00 0.00 61.69 61.44 2pgl s THR 158 Cb -0.09 -0.75 0.05 0.00 0.01 0.00 0.00 72.50 71.72 2pgl s THR 158 CO 0.30 0.08 0.54 -1.66 -0.69 0.00 0.00 174.62 173.20 2pgl s TRP 159 N -0.55 -0.49 0.09 4.92 -2.14 -1.26 -1.52 118.94 117.99 2pgl s TRP 159 Ca 0.02 0.87 -0.26 0.00 2.66 0.00 0.00 56.10 59.39 2pgl s TRP 159 Cb -0.06 0.28 0.08 0.00 -3.10 0.00 0.00 33.47 30.68 2pgl s TRP 159 CO 0.00 -0.50 0.72 0.00 -2.66 0.00 0.00 176.95 174.51 2pgl n GLY 161 N -0.27 5.68 3.04 0.00 0.00 -1.26 -1.48 105.19 110.90 2pgl n GLY 161 Ca -0.14 -1.99 -0.13 0.00 0.00 0.00 0.00 46.02 43.76 2pgl n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2pgl s GLU 162 N 1.80 0.49 0.30 1.61 2.02 -1.24 -4.49 118.70 119.18 2pgl s GLU 162 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 54.97 54.06 2pgl s GLU 162 Cb 0.00 -0.28 -0.10 0.00 0.10 0.00 0.00 34.13 33.85 2pgl s GLU 162 CO 0.00 0.05 1.17 0.12 0.02 0.00 0.00 175.26 176.63 2pgl s PHE 163 N -1.14 3.38 -1.72 1.61 5.36 -1.22 -2.81 117.98 121.44 2pgl s PHE 163 Ca -0.08 1.60 -0.00 0.00 -0.96 0.00 0.00 56.93 57.48 2pgl s PHE 163 Cb -0.08 -3.43 0.00 0.00 -0.34 0.00 0.00 43.02 39.17 2pgl s PHE 163 CO 0.00 -1.03 0.06 -0.25 -1.46 0.00 0.00 175.22 172.54 2pgl n ASP 164 N 1.02 -5.82 -3.63 6.13 8.00 -1.26 -4.92 116.55 116.08 2pgl n ASP 164 Ca -0.01 -0.03 -0.16 0.00 0.71 0.00 0.00 54.79 55.31 2pgl n ASP 164 Cb 0.44 -4.83 -0.07 0.00 -0.02 0.00 0.00 41.12 36.63 2pgl n ASP 164 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2pgl s THR 165 N -3.03 0.02 -1.23 -3.53 -1.32 -1.25 -5.05 115.64 100.25 2pgl s THR 165 Ca 0.03 -0.14 0.14 0.00 -1.21 0.00 0.00 61.69 60.51 2pgl s THR 165 Cb -0.01 -0.84 0.56 0.00 -1.51 0.00 0.00 72.50 70.70 2pgl s THR 165 CO 0.03 -0.08 1.44 -1.54 -2.21 0.00 0.00 174.62 172.27 2pgl n SER 166 N 1.47 3.82 -4.78 8.08 3.41 -1.26 -3.13 113.62 121.23 2pgl n SER 166 Ca -0.18 -2.35 -0.38 0.00 -0.26 0.00 0.00 58.87 55.70 2pgl n SER 166 Cb 0.56 -0.51 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 2pgl n SER 166 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2pgl s LYS 167 N -1.78 4.61 0.25 4.33 1.02 -1.26 -4.75 119.74 122.16 2pgl s LYS 167 Ca 0.40 1.30 -0.30 0.00 0.02 0.00 0.00 55.97 57.39 2pgl s LYS 167 Cb 0.26 -2.96 -0.09 0.00 -0.52 0.00 0.00 37.83 34.51 2pgl s LYS 167 CO 0.19 0.38 1.05 0.42 -0.92 0.00 0.00 175.35 176.47 2pgl s ILE 168 N -1.46 3.71 -0.68 2.17 1.01 -1.26 -3.72 121.20 120.97 2pgl s ILE 168 Ca 0.46 1.69 -0.20 0.00 0.00 0.00 0.00 60.65 62.60 2pgl s ILE 168 Cb -0.20 -4.08 0.10 0.00 0.01 0.00 0.00 42.46 38.29 2pgl s ILE 168 CO 0.26 0.39 0.85 0.21 0.00 0.00 0.00 174.94 176.65 2pgl s ASN 169 N -0.86 6.28 0.00 3.58 3.84 -0.55 -4.87 114.94 122.36 2pgl s ASN 169 Ca 0.44 -1.45 0.30 0.00 0.21 0.00 0.00 52.86 52.36 2pgl s ASN 169 Cb -0.30 -2.35 1.40 0.00 -0.55 0.00 0.00 41.25 39.46 2pgl s ASN 169 CO 0.38 -1.19 1.95 -1.22 -2.79 0.00 0.00 177.10 174.23 2pgl n TYR 170 N 6.68 0.00 -0.08 0.43 4.02 -1.26 -1.45 117.16 125.50 2pgl n TYR 170 Ca -0.02 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.65 2pgl n TYR 170 Cb 0.45 -0.07 -0.12 0.00 -0.02 0.00 0.00 39.34 39.58 2pgl n TYR 170 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2pgl n GLN 171 N -0.65 0.65 -3.45 -0.72 1.13 -1.26 -4.11 117.38 108.97 2pgl n GLN 171 Ca 0.19 0.34 -0.11 0.00 -1.94 0.00 0.00 57.00 55.48 2pgl n GLN 171 Cb 0.24 -1.65 -0.02 0.00 0.11 0.00 0.00 30.24 28.93 2pgl n GLN 171 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2pgl s SER 172 N -6.98 -0.53 0.04 1.08 1.04 -1.26 -3.76 113.70 103.33 2pgl s SER 172 Ca -0.30 -0.03 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2pgl s SER 172 Cb 0.08 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.75 2pgl s SER 172 CO 0.63 -0.95 -0.04 0.00 0.98 0.00 0.00 173.24 173.86 2pgl n PRO 174 N 0.84 2.27 -3.07 0.00 -0.02 -1.26 -0.84 135.00 132.92 2pgl n PRO 174 Ca -0.19 0.81 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 2pgl n PRO 174 Cb 0.58 -2.48 -0.05 0.00 -0.02 0.00 0.00 33.50 31.52 2pgl n PRO 174 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2pgl s ASP 175 N 0.17 7.16 0.31 2.55 -1.08 -1.26 -4.60 116.67 119.92 2pgl s ASP 175 Ca 0.63 1.38 0.03 0.00 -0.52 0.00 0.00 52.55 54.07 2pgl s ASP 175 Cb -0.58 -2.43 0.60 0.00 -1.46 0.00 0.00 42.92 39.05 2pgl s ASP 175 CO 0.53 0.10 1.89 -0.25 0.52 0.00 0.00 175.17 177.96 2pgl h TRP 176 N 5.29 1.01 0.00 -5.34 7.01 -1.95 0.57 115.95 122.56 2pgl h TRP 176 Ca -0.45 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.53 2pgl h TRP 176 Cb 1.21 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 2pgl h TRP 176 CO 0.65 0.47 -0.36 -0.09 -2.79 0.00 0.00 178.44 176.32 2pgl h ARG 177 N 0.94 0.00 0.01 2.65 2.43 -1.94 -3.21 114.38 115.27 2pgl h ARG 177 Ca 0.43 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.39 2pgl h ARG 177 Cb 0.38 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 2pgl h ARG 177 CO -0.19 0.39 -0.91 0.87 -1.51 0.00 0.00 179.97 178.62 2pgl h LYS 178 N -1.00 0.22 0.00 0.20 1.57 -1.97 -3.42 116.57 112.17 2pgl h LYS 178 Ca -0.06 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2pgl h LYS 178 Cb 0.58 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2pgl h LYS 178 CO -0.04 0.99 -0.17 -0.25 -0.57 0.00 0.00 179.45 179.42 2pgl n ASP 179 N -3.65 0.41 -3.56 0.86 8.00 0.12 -4.97 116.55 113.75 2pgl n ASP 179 Ca -0.04 0.07 -0.13 0.00 0.71 0.00 0.00 54.79 55.39 2pgl n ASP 179 Cb 0.83 -0.41 -0.06 0.00 -0.02 0.00 0.00 41.12 41.46 2pgl n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pgl h SER 181 N 2.83 0.00 -1.22 0.00 4.64 -1.82 -3.32 113.55 114.66 2pgl h SER 181 Ca -0.22 -0.04 -0.55 0.00 -0.47 0.00 0.00 61.79 60.51 2pgl h SER 181 Cb 1.16 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.05 2pgl h SER 181 CO 0.32 0.02 0.54 0.59 -0.87 0.00 0.00 176.83 177.43 2pgl n ASN 182 N -2.65 6.67 -4.90 4.97 3.02 -1.26 -4.39 115.26 116.73 2pgl n ASN 182 Ca 0.02 -3.30 -0.21 0.00 -0.03 0.00 0.00 54.58 51.05 2pgl n ASN 182 Cb 0.52 -1.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.45 2pgl n ASN 182 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2pgl s ASN 183 N 0.13 5.88 0.24 6.41 4.22 -1.25 -1.62 114.94 128.95 2pgl s ASN 183 Ca 0.58 -0.12 -0.05 0.00 -2.14 0.00 0.00 52.86 51.12 2pgl s ASN 183 Cb 0.39 -1.57 0.44 0.00 1.28 0.00 0.00 41.25 41.79 2pgl s ASN 183 CO -0.25 -0.09 1.70 -0.65 -2.04 0.00 0.00 177.10 175.77 2pgl h PRO 184 N 1.31 0.30 -0.01 3.55 0.11 -1.81 -1.26 132.00 134.19 2pgl h PRO 184 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2pgl h PRO 184 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2pgl h PRO 184 CO 0.60 0.20 -0.04 0.28 -0.21 0.00 0.00 178.00 178.84 2pgl h VAL 185 N 0.31 1.49 -0.73 3.15 2.07 -1.95 -2.54 116.25 118.06 2pgl h VAL 185 Ca 0.40 -1.50 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 2pgl h VAL 185 Cb 0.66 2.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.86 2pgl h VAL 185 CO -0.47 0.39 0.40 0.28 0.02 0.00 0.00 177.57 178.20 2pgl h SER 186 N -0.56 0.90 -0.37 0.57 0.02 -1.80 -1.85 113.55 110.47 2pgl h SER 186 Ca -0.00 -0.09 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 2pgl h SER 186 Cb 0.67 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 2pgl h SER 186 CO 0.01 0.73 -0.08 0.58 -1.14 0.00 0.00 176.83 176.93 2pgl h VAL 187 N 1.00 1.25 -0.09 2.27 2.07 -1.30 -1.06 116.25 120.40 2pgl h VAL 187 Ca 0.26 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2pgl h VAL 187 Cb 0.03 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2pgl h VAL 187 CO -0.04 0.39 0.05 0.15 0.02 0.00 0.00 177.57 178.14 2pgl h PHE 188 N 0.73 0.10 -0.27 1.57 3.57 -1.04 -1.51 116.94 120.09 2pgl h PHE 188 Ca 0.13 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.49 2pgl h PHE 188 Cb 0.56 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 2pgl h PHE 188 CO 0.03 0.06 -0.41 -1.49 -2.23 0.00 0.00 178.31 174.27 2pgl h TRP 189 N 0.11 0.76 -0.13 0.41 4.06 -1.15 -1.40 115.95 118.61 2pgl h TRP 189 Ca 0.03 -0.22 -0.00 0.00 2.06 0.00 0.00 58.89 60.76 2pgl h TRP 189 Cb -0.00 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 27.99 2pgl h TRP 189 CO -0.08 0.94 0.07 -0.22 -3.56 0.00 0.00 178.44 175.60 2pgl h LYS 190 N 0.52 0.18 0.38 0.49 3.64 -1.04 0.67 116.57 121.41 2pgl h LYS 190 Ca 0.04 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2pgl h LYS 190 Cb 0.93 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2pgl h LYS 190 CO 0.08 0.18 -0.20 1.15 -2.27 0.00 0.00 179.45 178.39 2pgl h THR 191 N 0.13 0.59 -0.37 1.00 2.02 -1.01 -1.36 112.91 113.90 2pgl h THR 191 Ca 0.05 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.14 2pgl h THR 191 Cb 0.05 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 2pgl h THR 191 CO -0.01 0.00 -0.14 -0.37 0.37 0.00 0.00 175.52 175.38 2pgl h VAL 192 N -0.54 1.25 -0.54 3.16 -1.51 -1.20 -2.10 116.25 114.78 2pgl h VAL 192 Ca -0.05 -1.14 -0.09 0.00 -1.23 0.00 0.00 66.70 64.19 2pgl h VAL 192 Cb 0.42 1.12 -0.02 0.00 -2.13 0.00 0.00 31.29 30.68 2pgl h VAL 192 CO 0.07 0.38 -0.01 0.28 -1.23 0.00 0.00 177.57 177.06 2pgl h SER 193 N 0.59 0.94 0.28 4.19 0.02 -0.80 -1.13 113.55 117.64 2pgl h SER 193 Ca 0.10 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 2pgl h SER 193 Cb 0.57 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2pgl h SER 193 CO 0.04 1.02 -0.19 -0.09 -1.14 0.00 0.00 176.83 176.47 2pgl h ARG 194 N 0.83 -0.44 -0.95 3.45 2.43 -1.06 -2.10 114.38 116.54 2pgl h ARG 194 Ca 0.15 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.42 2pgl h ARG 194 Cb 0.55 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.14 2pgl h ARG 194 CO 0.03 -0.30 0.62 0.00 -1.51 0.00 0.00 179.97 178.81 2pgl h ARG 195 N -0.46 1.05 -0.15 0.20 3.08 -1.28 -1.13 114.38 115.69 2pgl h ARG 195 Ca -0.02 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 2pgl h ARG 195 Cb 0.39 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2pgl h ARG 195 CO 0.01 0.70 0.09 0.35 -1.07 0.00 0.00 179.97 180.05 2pgl h PHE 196 N 1.08 0.21 -0.75 3.04 3.57 -1.06 -2.31 116.94 120.73 2pgl h PHE 196 Ca 0.41 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.98 2pgl h PHE 196 Cb 0.21 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.82 2pgl h PHE 196 CO -0.00 0.19 0.43 0.00 -2.23 0.00 0.00 178.31 176.70 2pgl h ALA 197 N 1.00 1.02 0.00 2.41 0.00 -0.93 -1.80 119.26 120.97 2pgl h ALA 197 Ca 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2pgl h ALA 197 Cb 0.04 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2pgl h ALA 197 CO -0.01 0.12 -0.04 0.93 0.00 0.00 0.00 179.25 180.25 2pgl h GLU 198 N 0.78 0.00 0.00 0.00 5.08 -0.87 -2.61 114.58 116.96 2pgl h GLU 198 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 2pgl h GLU 198 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2pgl h GLU 198 CO -0.19 0.04 -0.01 0.00 -1.00 0.00 0.00 179.01 177.85 2pgl h ALA 199 N 1.96 1.00 -2.41 3.43 0.00 -0.78 -3.44 119.26 119.02 2pgl h ALA 199 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 2pgl h ALA 199 Cb 0.14 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.00 2pgl h ALA 199 CO 0.01 0.00 0.39 0.00 0.00 0.00 0.00 179.25 179.64 2pgl s ALA 200 N -3.18 2.70 0.19 0.00 0.00 -0.98 -4.60 121.76 115.89 2pgl s ALA 200 Ca 0.08 0.54 -0.10 0.00 0.00 0.00 0.00 51.96 52.48 2pgl s ALA 200 Cb 0.07 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 2pgl s ALA 200 CO 0.65 -0.80 0.35 0.00 0.00 0.00 0.00 175.76 175.96 2pgl n ASP 202 N -0.28 0.00 -4.62 0.00 8.00 -0.11 -4.08 116.55 115.46 2pgl n ASP 202 Ca -0.05 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.08 2pgl n ASP 202 Cb 0.63 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.63 2pgl n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2pgl s VAL 203 N 0.00 5.16 -0.11 2.53 1.01 -1.26 0.01 120.40 127.73 2pgl s VAL 203 Ca 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 2pgl s VAL 203 Cb 0.00 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 2pgl s VAL 203 CO 0.00 0.35 -0.06 -0.69 0.00 0.00 0.00 175.10 174.70 2pgl s VAL 204 N 1.10 3.77 0.04 2.92 1.01 -0.25 -4.60 120.40 124.39 2pgl s VAL 204 Ca 0.07 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2pgl s VAL 204 Cb -0.14 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2pgl s VAL 204 CO 0.05 0.55 -0.00 -1.00 0.00 0.00 0.00 175.10 174.70 2pgl s HIS 205 N -0.29 3.02 -0.07 5.22 3.76 -1.03 -0.63 115.29 125.27 2pgl s HIS 205 Ca 0.04 0.02 0.01 0.00 -0.15 0.00 0.00 55.06 54.98 2pgl s HIS 205 Cb -0.13 -1.60 0.02 0.00 1.11 0.00 0.00 32.58 31.99 2pgl s HIS 205 CO 0.02 0.46 -0.06 0.54 -0.85 0.00 0.00 174.74 174.86 2pgl s VAL 206 N -1.19 0.73 -0.14 -0.90 0.11 -0.00 -0.11 120.40 118.90 2pgl s VAL 206 Ca 0.22 -0.18 -0.19 0.00 -2.93 0.00 0.00 61.98 58.90 2pgl s VAL 206 Cb -0.12 -0.75 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 2pgl s VAL 206 CO 0.14 0.29 0.53 -0.04 -3.33 0.00 0.00 175.10 172.68 2pgl s MET 207 N 1.23 4.30 0.08 1.54 -1.94 -0.43 -0.17 119.30 123.92 2pgl s MET 207 Ca -0.05 0.50 0.09 0.00 -1.71 0.00 0.00 55.69 54.52 2pgl s MET 207 Cb -0.14 -3.48 -0.03 0.00 2.01 0.00 0.00 34.83 33.19 2pgl s MET 207 CO -0.02 0.04 -0.24 -0.51 -0.01 0.00 0.00 175.02 174.27 2pgl s LEU 208 N 1.01 2.23 -0.56 -0.03 1.43 -0.23 -1.75 118.68 120.79 2pgl s LEU 208 Ca 0.27 -0.64 -0.21 0.00 -1.03 0.00 0.00 54.13 52.53 2pgl s LEU 208 Cb -0.16 -1.13 0.07 0.00 0.03 0.00 0.00 46.19 45.00 2pgl s LEU 208 CO 0.11 0.18 0.75 -0.62 0.23 0.00 0.00 176.35 177.01 2pgl s ASP 209 N -1.57 6.23 0.00 2.29 2.15 -1.24 -0.65 116.67 123.88 2pgl s ASP 209 Ca 0.11 -0.93 0.23 0.00 0.43 0.00 0.00 52.55 52.39 2pgl s ASP 209 Cb -0.10 -2.34 1.19 0.00 -0.30 0.00 0.00 42.92 41.37 2pgl s ASP 209 CO 0.03 -1.09 1.77 0.61 -0.17 0.00 0.00 175.17 176.32 2pgl n GLY 210 N 5.21 -1.04 0.06 2.66 0.00 0.46 -2.54 105.19 110.00 2pgl n GLY 210 Ca -0.05 -0.11 0.13 0.00 0.00 0.00 0.00 46.02 45.98 2pgl n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2pgl n SER 211 N -1.27 0.52 -4.82 1.61 3.41 -1.26 -4.74 113.62 107.08 2pgl n SER 211 Ca 0.11 -0.30 -0.32 0.00 -0.26 0.00 0.00 58.87 58.10 2pgl n SER 211 Cb 0.18 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 2pgl n SER 211 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pgl s ARG 212 N -2.85 3.48 0.25 4.33 1.81 -1.05 -4.98 118.95 119.94 2pgl s ARG 212 Ca 0.16 1.10 -0.04 0.00 -1.72 0.00 0.00 55.73 55.23 2pgl s ARG 212 Cb 0.18 -2.06 0.29 0.00 -0.45 0.00 0.00 34.95 32.91 2pgl s ARG 212 CO 0.62 -0.67 1.81 1.03 -0.68 0.00 0.00 175.30 177.41 2pgl h SER 213 N 0.47 0.94 -3.78 0.23 0.87 -1.91 -3.32 113.55 107.05 2pgl h SER 213 Ca -0.47 -0.15 -0.68 0.00 -1.23 0.00 0.00 61.79 59.27 2pgl h SER 213 Cb 1.21 -0.24 -0.37 0.00 -0.44 0.00 0.00 62.40 62.55 2pgl h SER 213 CO 0.59 0.86 -0.58 -0.54 -0.53 0.00 0.00 176.83 176.63 2pgl s LYS 214 N -5.42 1.95 0.13 2.24 1.02 -1.26 -4.98 119.74 113.41 2pgl s LYS 214 Ca -0.11 -2.08 -0.20 0.00 0.02 0.00 0.00 55.97 53.61 2pgl s LYS 214 Cb 0.16 -3.47 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 2pgl s LYS 214 CO 0.82 -1.06 1.72 0.82 -0.92 0.00 0.00 175.35 176.73 2pgl h ILE 215 N 6.12 0.86 -3.70 2.17 2.04 -1.80 -3.32 117.51 119.87 2pgl h ILE 215 Ca -0.08 -0.02 -0.63 0.00 1.00 0.00 0.00 64.86 65.13 2pgl h ILE 215 Cb 1.00 0.78 -0.16 0.00 -0.74 0.00 0.00 36.82 37.70 2pgl h ILE 215 CO 0.65 0.01 -0.53 0.12 0.00 0.00 0.00 178.15 178.41 2pgl s PHE 216 N -6.19 3.25 -0.29 1.37 5.36 -1.26 -4.40 117.98 115.81 2pgl s PHE 216 Ca -0.13 0.11 -0.02 0.00 -0.96 0.00 0.00 56.93 55.93 2pgl s PHE 216 Cb 0.10 -2.30 0.04 0.00 -0.34 0.00 0.00 43.02 40.52 2pgl s PHE 216 CO 0.69 -0.06 -0.00 0.34 -1.46 0.00 0.00 175.22 174.72 2pgl s ASP 217 N 1.36 4.82 0.60 6.13 -1.08 -1.25 -4.86 116.67 122.39 2pgl s ASP 217 Ca 0.07 -1.18 0.31 0.00 -0.52 0.00 0.00 52.55 51.23 2pgl s ASP 217 Cb -0.15 -1.72 1.78 0.00 -1.46 0.00 0.00 42.92 41.38 2pgl s ASP 217 CO 0.07 -0.24 2.17 0.11 0.52 0.00 0.00 175.17 177.80 2pgl h LYS 218 N 8.02 0.00 -0.00 4.34 1.57 -1.95 -1.69 116.57 126.86 2pgl h LYS 218 Ca -0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 2pgl h LYS 218 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2pgl h LYS 218 CO 0.54 0.00 -0.35 -0.25 -0.57 0.00 0.00 179.45 178.82 2pgl n ASP 219 N -3.70 0.38 -4.70 0.86 10.43 -1.26 -2.90 116.55 115.65 2pgl n ASP 219 Ca -0.00 -0.07 -0.30 0.00 2.57 0.00 0.00 54.79 56.99 2pgl n ASP 219 Cb 0.23 0.04 0.15 0.00 1.84 0.00 0.00 41.12 43.37 2pgl n ASP 219 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2pgl s SER 220 N -2.98 3.29 0.22 -2.24 1.04 -0.63 -4.72 113.70 107.68 2pgl s SER 220 Ca 0.13 1.53 -0.08 0.00 0.48 0.00 0.00 55.95 58.01 2pgl s SER 220 Cb 0.18 -2.20 0.24 0.00 0.10 0.00 0.00 66.02 64.34 2pgl s SER 220 CO 0.65 -2.76 1.86 0.74 0.98 0.00 0.00 173.24 174.70 2pgl h THR 221 N -1.63 1.09 -0.12 2.02 2.02 -1.91 0.22 112.91 114.60 2pgl h THR 221 Ca -0.50 -0.32 0.02 0.00 0.77 0.00 0.00 66.41 66.38 2pgl h THR 221 Cb 1.29 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 2pgl h THR 221 CO 0.53 0.17 -0.01 0.15 0.37 0.00 0.00 175.52 176.73 2pgl h PHE 222 N 0.94 -0.03 0.00 3.16 3.57 -1.89 -1.83 116.94 120.86 2pgl h PHE 222 Ca 0.32 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.71 2pgl h PHE 222 Cb 0.05 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2pgl h PHE 222 CO -0.04 -0.03 -0.57 0.78 -2.23 0.00 0.00 178.31 176.22 2pgl h GLY 223 N 0.02 0.00 0.00 2.40 0.00 -1.55 -1.18 103.07 102.77 2pgl h GLY 223 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.25 2pgl h GLY 223 CO -0.11 0.00 -2.13 -1.14 0.00 0.00 0.00 176.54 173.16 2pgl n SER 224 N -3.27 0.07 0.01 0.19 3.41 0.73 -4.55 113.62 110.21 2pgl n SER 224 Ca 0.02 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.60 2pgl n SER 224 Cb 0.75 1.62 -0.01 0.00 -0.26 0.00 0.00 64.21 66.31 2pgl n SER 224 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2pgl n VAL 225 N -2.43 0.81 -0.07 -3.33 0.31 -0.74 -4.77 118.33 108.11 2pgl n VAL 225 Ca -0.15 0.19 -0.14 0.00 -0.01 0.00 0.00 64.34 64.24 2pgl n VAL 225 Cb 0.78 -1.63 -0.06 0.00 -0.91 0.00 0.00 33.84 32.03 2pgl n VAL 225 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 2pgl h GLN 226 N -0.13 0.59 -0.02 5.55 4.20 -0.91 -2.94 115.11 121.44 2pgl h GLN 226 Ca -0.04 -0.35 0.01 0.00 0.06 0.00 0.00 58.65 58.33 2pgl h GLN 226 Cb 0.54 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 2pgl h GLN 226 CO -0.02 0.95 0.02 -0.24 -0.67 0.00 0.00 178.83 178.87 2pgl h VAL 227 N 0.27 0.68 -0.01 -0.54 3.04 -1.47 -1.27 116.25 116.94 2pgl h VAL 227 Ca 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 2pgl h VAL 227 Cb 0.89 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2pgl h VAL 227 CO 0.07 0.00 -0.17 1.41 -1.01 0.00 0.00 177.57 177.87 2pgl n HIS 228 N -4.08 0.00 -0.11 3.17 8.25 -1.13 -4.00 115.22 117.33 2pgl n HIS 228 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2pgl n HIS 228 Cb 0.11 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2pgl n HIS 228 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2pgl n ASN 229 N -0.18 1.36 -4.76 0.41 3.02 -0.52 -4.98 115.26 109.61 2pgl n ASN 229 Ca 0.14 -1.47 -0.41 0.00 -0.03 0.00 0.00 54.58 52.82 2pgl n ASN 229 Cb 0.38 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.53 2pgl n ASN 229 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2pgl s LEU 230 N -0.47 4.40 -0.43 3.41 1.43 -0.98 -3.46 118.68 122.59 2pgl s LEU 230 Ca 0.00 2.70 -0.20 0.00 -1.03 0.00 0.00 54.13 55.60 2pgl s LEU 230 Cb 0.00 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.60 2pgl s LEU 230 CO 0.00 -0.64 0.59 -1.10 0.23 0.00 0.00 176.35 175.43 2pgl s GLN 231 N -1.08 3.28 0.60 1.70 -1.52 -1.26 -4.94 119.66 116.44 2pgl s GLN 231 Ca 0.54 -0.42 0.31 0.00 -1.95 0.00 0.00 55.36 53.84 2pgl s GLN 231 Cb -0.41 -3.94 1.83 0.00 -0.22 0.00 0.00 33.01 30.26 2pgl s GLN 231 CO 0.49 -0.94 2.20 -1.35 -0.25 0.00 0.00 175.29 175.43 2pgl h PRO 232 N 8.81 0.00 0.00 2.91 0.11 -1.85 0.75 132.00 142.73 2pgl h PRO 232 Ca -0.26 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.81 2pgl h PRO 232 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2pgl h PRO 232 CO 0.86 0.00 -0.22 0.93 -0.21 0.00 0.00 178.00 179.37 2pgl h GLU 233 N 0.00 0.00 0.00 1.05 3.07 -1.92 -3.36 114.58 113.43 2pgl h GLU 233 Ca 0.03 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.76 2pgl h GLU 233 Cb 0.22 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 2pgl h GLU 233 CO -0.00 0.22 -1.51 1.63 -1.40 0.00 0.00 179.01 177.95 2pgl n LYS 234 N -3.72 0.96 -3.14 2.33 5.02 -0.00 -4.98 118.16 114.62 2pgl n LYS 234 Ca -0.01 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.91 2pgl n LYS 234 Cb 0.33 -1.18 -0.06 0.00 -0.02 0.00 0.00 35.03 34.10 2pgl n LYS 234 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2pgl s VAL 235 N -2.18 5.02 -0.14 -0.18 1.01 0.05 -0.94 120.40 123.05 2pgl s VAL 235 Ca -0.10 1.10 -0.18 0.00 0.00 0.00 0.00 61.98 62.80 2pgl s VAL 235 Cb 0.03 -3.91 -0.25 0.00 0.00 0.00 0.00 36.38 32.24 2pgl s VAL 235 CO 0.23 0.09 0.49 -0.61 0.00 0.00 0.00 175.10 175.30 2pgl h GLN 236 N 7.68 0.15 -3.35 2.72 4.15 -0.73 -3.44 115.11 122.28 2pgl h GLN 236 Ca -0.30 -0.26 -0.17 0.00 0.77 0.00 0.00 58.65 58.69 2pgl h GLN 236 Cb 1.14 0.10 -0.25 0.00 0.21 0.00 0.00 27.48 28.68 2pgl h GLN 236 CO 0.76 1.12 -0.50 0.99 -1.93 0.00 0.00 178.83 179.28 2pgl s THR 237 N -2.42 0.02 -0.24 2.39 2.01 -0.82 -1.39 115.64 115.20 2pgl s THR 237 Ca -0.22 -0.19 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 2pgl s THR 237 Cb 0.04 -0.31 -0.03 0.00 0.01 0.00 0.00 72.50 72.22 2pgl s THR 237 CO 0.71 -0.10 0.05 -0.22 -0.69 0.00 0.00 174.62 174.37 2pgl s LEU 238 N -0.31 3.36 -0.25 4.42 2.96 -0.56 -1.09 118.68 127.20 2pgl s LEU 238 Ca -0.04 -0.23 -0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2pgl s LEU 238 Cb -0.03 -1.89 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 2pgl s LEU 238 CO 0.01 -0.02 0.04 -0.70 -1.32 0.00 0.00 176.35 174.35 2pgl s GLU 239 N 1.53 3.42 -0.11 1.98 2.12 0.20 -1.65 118.70 126.18 2pgl s GLU 239 Ca 0.06 -0.63 -0.14 0.00 0.36 0.00 0.00 54.97 54.62 2pgl s GLU 239 Cb -0.15 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 30.95 2pgl s GLU 239 CO 0.02 -0.26 0.35 0.00 -0.54 0.00 0.00 175.26 174.83 2pgl s ALA 240 N 1.54 3.62 -0.36 6.30 0.00 -0.16 -0.82 121.76 131.89 2pgl s ALA 240 Ca 0.05 -0.36 -0.07 0.00 0.00 0.00 0.00 51.96 51.59 2pgl s ALA 240 Cb -0.15 -2.41 0.05 0.00 0.00 0.00 0.00 23.12 20.61 2pgl s ALA 240 CO 0.01 0.21 0.14 -1.58 0.00 0.00 0.00 175.76 174.54 2pgl s TRP 241 N -0.00 3.28 -0.38 0.00 0.51 0.76 -0.46 118.94 122.65 2pgl s TRP 241 Ca 0.20 -1.47 -0.22 0.00 -2.12 0.00 0.00 56.10 52.49 2pgl s TRP 241 Cb -0.14 -2.43 0.01 0.00 -0.81 0.00 0.00 33.47 30.10 2pgl s TRP 241 CO 0.07 -0.76 0.74 0.08 -0.51 0.00 0.00 176.95 176.58 2pgl s VAL 242 N 1.40 4.76 -0.35 4.03 1.01 0.52 -1.06 120.40 130.71 2pgl s VAL 242 Ca -0.00 0.69 -0.18 0.00 0.00 0.00 0.00 61.98 62.49 2pgl s VAL 242 Cb -0.20 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 31.98 2pgl s VAL 242 CO 0.03 -0.46 0.50 -0.63 0.00 0.00 0.00 175.10 174.53 2pgl s ILE 243 N 3.02 5.03 0.36 2.22 -1.09 0.18 0.02 121.20 130.95 2pgl s ILE 243 Ca 0.29 0.30 -0.26 0.00 -2.23 0.00 0.00 60.65 58.75 2pgl s ILE 243 Cb -0.13 -3.95 -0.09 0.00 -1.58 0.00 0.00 42.46 36.71 2pgl s ILE 243 CO 0.17 -0.20 1.13 -1.00 -1.23 0.00 0.00 174.94 173.81 2pgl s HIS 244 N 2.35 3.26 -0.02 3.97 3.76 -0.24 -0.41 115.29 127.96 2pgl s HIS 244 Ca 0.18 1.61 0.03 0.00 -0.15 0.00 0.00 55.06 56.72 2pgl s HIS 244 Cb -0.16 -3.31 -0.04 0.00 1.11 0.00 0.00 32.58 30.18 2pgl s HIS 244 CO 0.13 -0.96 0.02 0.41 -0.85 0.00 0.00 174.74 173.49 2pgl n GLY 245 N 0.73 -0.13 3.56 -2.22 0.00 -1.26 -4.66 105.19 101.21 2pgl n GLY 245 Ca 0.03 -0.05 -0.45 0.00 0.00 0.00 0.00 46.02 45.54 2pgl n GLY 245 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pgl n GLY 246 N 2.71 0.92 0.14 -0.02 0.00 -1.26 -4.85 105.19 102.82 2pgl n GLY 246 Ca -0.03 0.82 -0.05 0.00 0.00 0.00 0.00 46.02 46.76 2pgl n GLY 246 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2pgl h ARG 247 N 14.22 -0.17 0.00 1.61 3.08 -1.89 -3.42 114.38 127.80 2pgl h ARG 247 Ca -0.38 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2pgl h ARG 247 Cb 1.26 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.35 2pgl h ARG 247 CO 0.97 -0.11 0.00 0.39 -1.07 0.00 0.00 179.97 180.15 2pgl n GLU 248 N -3.43 0.00 -3.33 0.04 1.02 -1.26 -4.64 120.64 109.04 2pgl n GLU 248 Ca -0.02 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 2pgl n GLU 248 Cb 0.11 -0.19 -0.09 0.00 -0.02 0.00 0.00 31.44 31.25 2pgl n GLU 248 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2pgl s ASP 249 N -3.54 6.22 0.27 1.62 2.15 -1.26 -4.88 116.67 117.25 2pgl s ASP 249 Ca 0.00 -0.35 -0.13 0.00 0.43 0.00 0.00 52.55 52.51 2pgl s ASP 249 Cb 0.00 -2.23 0.00 0.00 -0.30 0.00 0.00 42.92 40.40 2pgl s ASP 249 CO 0.00 -0.47 0.53 -0.55 -0.17 0.00 0.00 175.17 174.51 2pgl s SER 250 N 1.77 0.01 0.85 -0.34 0.15 -1.26 -5.07 113.70 109.82 2pgl s SER 250 Ca 0.14 -0.98 -0.13 0.00 0.70 0.00 0.00 55.95 55.69 2pgl s SER 250 Cb -0.16 0.63 0.10 0.00 -1.71 0.00 0.00 66.02 64.88 2pgl s SER 250 CO 0.13 -1.22 1.19 -0.13 1.20 0.00 0.00 173.24 174.40 2pgl s ARG 251 N -3.77 1.65 -0.95 5.44 3.00 -1.26 -4.99 118.95 118.08 2pgl s ARG 251 Ca 0.22 0.09 -0.24 0.00 0.00 0.00 0.00 55.73 55.79 2pgl s ARG 251 Cb -0.02 -1.92 0.03 0.00 0.00 0.00 0.00 34.95 33.05 2pgl s ARG 251 CO 0.10 -1.81 1.49 0.34 0.00 0.00 0.00 175.30 175.43 2pgl s ASP 252 N -4.51 6.24 0.00 0.23 2.15 -1.26 -4.86 116.67 114.66 2pgl s ASP 252 Ca 0.64 -1.13 0.22 0.00 0.43 0.00 0.00 52.55 52.70 2pgl s ASP 252 Cb -0.11 -2.57 1.11 0.00 -0.30 0.00 0.00 42.92 41.05 2pgl s ASP 252 CO 0.50 -1.74 1.70 0.18 -0.17 0.00 0.00 175.17 175.64 2pgl n LEU 253 N 9.70 0.00 0.00 -1.34 4.77 -1.26 -2.08 117.00 126.79 2pgl n LEU 253 Ca 0.28 0.27 0.09 0.00 -0.03 0.00 0.00 56.01 56.63 2pgl n LEU 253 Cb 0.50 -0.27 0.45 0.00 -2.33 0.00 0.00 43.42 41.77 2pgl n LEU 253 CO 0.66 -0.08 0.79 0.00 -1.33 0.00 0.00 177.39 177.44 2pgl n GLN 255 N -1.38 1.87 -1.70 0.00 1.13 -0.88 -4.64 117.38 111.77 2pgl n GLN 255 Ca 0.07 -1.37 -0.43 0.00 -1.94 0.00 0.00 57.00 53.32 2pgl n GLN 255 Cb 0.18 -1.47 -0.02 0.00 0.11 0.00 0.00 30.24 29.04 2pgl n GLN 255 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2pgl n ASP 256 N 0.63 3.02 -0.32 1.08 -0.08 -0.90 -4.82 116.55 115.17 2pgl n ASP 256 Ca 0.15 1.17 0.18 0.00 -1.51 0.00 0.00 54.79 54.78 2pgl n ASP 256 Cb 0.48 -1.49 0.37 0.00 2.34 0.00 0.00 41.12 42.82 2pgl n ASP 256 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2pgl h PRO 257 N 3.72 0.22 0.00 -0.67 0.11 -1.94 -0.35 132.00 133.09 2pgl h PRO 257 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2pgl h PRO 257 Cb 1.27 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2pgl h PRO 257 CO 0.71 0.15 -0.25 1.79 -0.21 0.00 0.00 178.00 180.19 2pgl h THR 258 N 0.23 0.71 -0.07 -1.15 1.35 -1.90 -1.43 112.91 110.66 2pgl h THR 258 Ca 0.64 -1.07 -0.23 0.00 -0.55 0.00 0.00 66.41 65.19 2pgl h THR 258 Cb 1.38 1.68 0.01 0.00 -1.73 0.00 0.00 68.15 69.49 2pgl h THR 258 CO -0.66 0.24 -0.89 0.40 -0.25 0.00 0.00 175.52 174.37 2pgl h ILE 259 N 0.00 1.31 -0.54 6.82 1.08 -1.41 -1.54 117.51 123.24 2pgl h ILE 259 Ca -0.00 -2.17 -0.06 0.00 -0.39 0.00 0.00 64.86 62.25 2pgl h ILE 259 Cb 0.66 2.20 -0.02 0.00 -3.07 0.00 0.00 36.82 36.59 2pgl h ILE 259 CO 0.03 0.67 0.11 0.11 -0.69 0.00 0.00 178.15 178.38 2pgl h LYS 260 N 0.40 0.84 0.17 2.37 1.79 -1.00 -0.33 116.57 120.82 2pgl h LYS 260 Ca -0.08 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 2pgl h LYS 260 Cb 1.52 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 32.05 2pgl h LYS 260 CO 0.17 0.77 -0.08 1.49 -1.08 0.00 0.00 179.45 180.72 2pgl h GLU 261 N 0.80 -0.22 -0.72 3.15 4.81 -1.15 -1.19 114.58 120.06 2pgl h GLU 261 Ca 0.17 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.49 2pgl h GLU 261 Cb 0.33 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.70 2pgl h GLU 261 CO 0.00 -0.12 0.40 1.25 -0.73 0.00 0.00 179.01 179.82 2pgl h LEU 262 N -0.27 0.59 -0.73 1.64 5.85 -0.96 -0.60 115.31 120.83 2pgl h LEU 262 Ca -0.02 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2pgl h LEU 262 Cb 0.21 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2pgl h LEU 262 CO 0.04 0.37 0.48 -0.08 -0.34 0.00 0.00 178.44 178.91 2pgl h GLU 263 N 0.72 0.96 -0.25 1.25 4.81 -0.86 -1.10 114.58 120.11 2pgl h GLU 263 Ca 0.33 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 2pgl h GLU 263 Cb 0.24 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2pgl h GLU 263 CO -0.21 0.64 0.09 1.03 -0.73 0.00 0.00 179.01 179.83 2pgl h SER 264 N 0.99 0.36 -0.12 1.04 0.87 -0.49 -0.31 113.55 115.90 2pgl h SER 264 Ca 0.27 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 2pgl h SER 264 Cb -0.11 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2pgl h SER 264 CO -0.06 0.45 0.04 0.40 -0.53 0.00 0.00 176.83 177.14 2pgl h ILE 265 N 0.25 1.16 -0.10 2.23 2.04 -0.91 -1.07 117.51 121.10 2pgl h ILE 265 Ca 0.08 -0.48 -0.17 0.00 1.00 0.00 0.00 64.86 65.29 2pgl h ILE 265 Cb 0.21 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2pgl h ILE 265 CO -0.00 0.14 -0.65 0.16 0.00 0.00 0.00 178.15 177.80 2pgl h ILE 266 N 0.02 1.37 -0.75 -0.67 3.07 -1.16 -2.66 117.51 116.73 2pgl h ILE 266 Ca 0.04 -2.02 -0.00 0.00 1.55 0.00 0.00 64.86 64.43 2pgl h ILE 266 Cb 0.19 2.00 -0.04 0.00 -0.27 0.00 0.00 36.82 38.71 2pgl h ILE 266 CO -0.00 0.61 0.45 0.28 -1.05 0.00 0.00 178.15 178.44 2pgl h SER 267 N 0.28 0.90 0.57 2.16 0.02 -0.89 -1.26 113.55 115.33 2pgl h SER 267 Ca -0.01 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2pgl h SER 267 Cb 1.20 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.51 2pgl h SER 267 CO 0.11 0.70 0.00 0.29 -1.14 0.00 0.00 176.83 176.79 2pgl n LYS 268 N -4.50 0.05 0.00 3.45 5.02 -0.42 -1.57 118.16 120.19 2pgl n LYS 268 Ca 0.07 0.17 0.14 0.00 -2.02 0.00 0.00 58.31 56.67 2pgl n LYS 268 Cb 0.06 -1.50 0.53 0.00 -0.02 0.00 0.00 35.03 34.10 2pgl n LYS 268 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2pgl n ARG 269 N -1.46 1.39 -3.07 1.97 1.74 -0.51 -4.95 116.66 111.77 2pgl n ARG 269 Ca 0.05 -0.75 -0.13 0.00 -0.77 0.00 0.00 57.85 56.26 2pgl n ARG 269 Cb 0.20 -1.48 0.04 0.00 -1.02 0.00 0.00 32.46 30.20 2pgl n ARG 269 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2pgl n ASN 270 N -0.15 -4.22 -4.16 0.55 3.02 -0.61 -4.74 115.26 104.95 2pgl n ASN 270 Ca 0.18 -0.29 -0.25 0.00 -0.03 0.00 0.00 54.58 54.19 2pgl n ASN 270 Cb 0.33 -2.94 -0.15 0.00 -0.61 0.00 0.00 39.78 36.41 2pgl n ASN 270 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pgl s ILE 271 N -3.17 1.37 0.58 2.41 1.01 -0.99 -4.93 121.20 117.48 2pgl s ILE 271 Ca 0.30 -0.74 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2pgl s ILE 271 Cb -0.13 -1.15 -0.05 0.00 0.01 0.00 0.00 42.46 41.14 2pgl s ILE 271 CO 0.39 0.39 1.02 -1.10 0.00 0.00 0.00 174.94 175.64 2pgl s GLN 272 N -0.37 3.64 -0.01 2.79 -0.21 -0.49 -3.42 119.66 121.60 2pgl s GLN 272 Ca 0.06 0.94 0.05 0.00 0.02 0.00 0.00 55.36 56.43 2pgl s GLN 272 Cb -0.07 -2.09 -0.01 0.00 1.00 0.00 0.00 33.01 31.84 2pgl s GLN 272 CO -0.00 -0.53 -0.15 0.12 -2.12 0.00 0.00 175.29 172.60 2pgl s PHE 273 N -2.79 1.36 0.05 0.91 5.36 -1.26 -1.50 117.98 120.11 2pgl s PHE 273 Ca 0.59 -0.26 0.03 0.00 -0.96 0.00 0.00 56.93 56.33 2pgl s PHE 273 Cb -0.12 -0.87 -0.03 0.00 -0.34 0.00 0.00 43.02 41.67 2pgl s PHE 273 CO 0.41 -0.02 -0.10 0.45 -1.46 0.00 0.00 175.22 174.50 2pgl s SER 274 N -0.40 1.17 -0.02 6.13 0.15 -0.66 -4.98 113.70 115.09 2pgl s SER 274 Ca 0.06 -0.56 -0.05 0.00 0.70 0.00 0.00 55.95 56.10 2pgl s SER 274 Cb -0.06 -0.00 0.01 0.00 -1.71 0.00 0.00 66.02 64.25 2pgl s SER 274 CO -0.00 -0.14 0.11 0.00 1.20 0.00 0.00 173.24 174.41 2pgl s LYS 276 N -0.56 0.31 0.02 0.00 1.02 0.39 -4.94 119.74 115.99 2pgl s LYS 276 Ca -0.06 -0.21 -0.25 0.00 0.02 0.00 0.00 55.97 55.46 2pgl s LYS 276 Cb -0.04 -0.26 -0.05 0.00 -0.52 0.00 0.00 37.83 36.97 2pgl s LYS 276 CO 0.00 0.07 0.79 -0.80 -0.92 0.00 0.00 175.35 174.49 2pgl s ASN 277 N -0.30 7.21 -0.49 2.83 0.01 -1.26 -0.35 114.94 122.58 2pgl s ASN 277 Ca -0.01 1.44 -0.05 0.00 -0.71 0.00 0.00 52.86 53.53 2pgl s ASN 277 Cb -0.03 -2.48 0.13 0.00 0.41 0.00 0.00 41.25 39.29 2pgl s ASN 277 CO -0.00 -0.04 0.32 -0.63 -1.51 0.00 0.00 177.10 175.24 2pgl s ILE 278 N 0.20 3.76 0.28 0.60 1.01 0.10 -4.88 121.20 122.28 2pgl s ILE 278 Ca 0.40 -2.20 0.04 0.00 0.00 0.00 0.00 60.65 58.89 2pgl s ILE 278 Cb -0.20 -3.50 0.04 0.00 0.01 0.00 0.00 42.46 38.81 2pgl s ILE 278 CO 0.23 -0.77 1.69 1.88 0.00 0.00 0.00 174.94 177.97 2pgl h TYR 279 N 7.93 0.44 -2.73 3.97 0.05 -1.93 -0.62 116.97 124.08 2pgl h TYR 279 Ca -0.12 -0.11 -0.56 0.00 0.05 0.00 0.00 58.73 57.99 2pgl h TYR 279 Cb 1.03 -0.10 -0.40 0.00 1.01 0.00 0.00 36.73 38.28 2pgl h TYR 279 CO 0.63 0.68 -0.81 1.03 -1.05 0.00 0.00 178.16 178.65 2pgl s ARG 280 N -4.31 0.43 0.50 4.88 0.52 -1.26 -4.58 118.95 115.13 2pgl s ARG 280 Ca -0.06 -0.98 0.33 0.00 -0.52 0.00 0.00 55.73 54.50 2pgl s ARG 280 Cb 0.13 -1.33 1.43 0.00 0.52 0.00 0.00 34.95 35.71 2pgl s ARG 280 CO 0.79 -1.11 1.97 -1.00 0.02 0.00 0.00 175.30 175.97 2pgl h PRO 281 N 7.70 0.00 -0.62 3.54 0.13 -1.83 -1.59 132.00 139.33 2pgl h PRO 281 Ca -0.07 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.97 2pgl h PRO 281 Cb 0.99 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.10 2pgl h PRO 281 CO 0.37 0.00 0.05 0.38 -0.23 0.00 0.00 178.00 178.57 2pgl h ASP 282 N 0.00 1.03 -0.16 1.44 2.03 -1.97 -1.04 116.42 117.75 2pgl h ASP 282 Ca 0.00 -0.28 -0.09 0.00 -0.73 0.00 0.00 57.03 55.93 2pgl h ASP 282 Cb 0.40 -0.28 -0.00 0.00 -0.83 0.00 0.00 39.33 38.62 2pgl h ASP 282 CO 0.00 1.06 -0.24 0.50 -1.03 0.00 0.00 179.24 179.53 2pgl h LYS 283 N 0.97 0.44 -0.20 4.15 3.64 -1.77 -2.48 116.57 121.32 2pgl h LYS 283 Ca 0.18 -0.26 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2pgl h LYS 283 Cb 0.50 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 2pgl h LYS 283 CO 0.02 0.85 -0.51 0.35 -2.27 0.00 0.00 179.45 177.89 2pgl h PHE 284 N 0.07 -1.52 -0.91 1.91 3.57 -1.27 0.16 116.94 118.95 2pgl h PHE 284 Ca 0.02 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.65 2pgl h PHE 284 Cb 0.81 0.69 -0.06 0.00 2.79 0.00 0.00 35.95 40.18 2pgl h PHE 284 CO 0.09 -0.52 0.59 -0.07 -2.23 0.00 0.00 178.31 176.17 2pgl h LEU 285 N -0.52 0.90 -0.73 0.59 3.38 -1.20 -0.90 115.31 116.83 2pgl h LEU 285 Ca 0.06 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2pgl h LEU 285 Cb 0.65 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2pgl h LEU 285 CO -0.47 0.57 0.31 -0.61 0.09 0.00 0.00 178.44 178.33 2pgl h GLN 286 N 1.01 1.07 -0.03 1.13 5.75 -0.91 -1.86 115.11 121.28 2pgl h GLN 286 Ca 0.39 -0.18 -0.08 0.00 -0.15 0.00 0.00 58.65 58.63 2pgl h GLN 286 Cb 0.23 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 2pgl h GLN 286 CO -0.15 0.87 -0.35 0.00 -2.65 0.00 0.00 178.83 176.55 2pgl h VAL 288 N 0.05 1.29 -0.03 0.00 2.07 -0.86 -1.38 116.25 117.39 2pgl h VAL 288 Ca 0.00 -1.34 -0.14 0.00 0.82 0.00 0.00 66.70 66.04 2pgl h VAL 288 Cb 0.65 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 2pgl h VAL 288 CO 0.05 0.44 -0.64 0.11 0.02 0.00 0.00 177.57 177.55 2pgl h LYS 289 N 0.53 0.12 -1.74 1.57 1.57 -1.10 -3.39 116.57 114.14 2pgl h LYS 289 Ca 0.07 -0.09 -0.46 0.00 -1.87 0.00 0.00 60.65 58.30 2pgl h LYS 289 Cb 0.76 0.02 -0.32 0.00 0.08 0.00 0.00 32.23 32.77 2pgl h LYS 289 CO 0.06 0.72 -0.88 0.09 -0.57 0.00 0.00 179.45 178.87 2pgl n ASN 290 N -3.82 -1.09 0.00 0.86 3.02 -0.13 -4.97 115.26 109.13 2pgl n ASN 290 Ca -0.02 -2.67 0.08 0.00 -0.03 0.00 0.00 54.58 51.94 2pgl n ASN 290 Cb 0.63 0.10 0.35 0.00 -0.61 0.00 0.00 39.78 40.25 2pgl n ASN 290 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2pgl n PRO 291 N 2.29 0.04 -0.29 3.52 -0.04 -0.52 -2.36 135.00 137.65 2pgl n PRO 291 Ca 0.23 0.21 -0.00 0.00 -0.04 0.00 0.00 63.50 63.90 2pgl n PRO 291 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2pgl n PRO 291 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2pgl n GLU 292 N -1.46 1.01 -4.75 0.54 4.07 -1.26 -4.85 120.64 113.94 2pgl n GLU 292 Ca 0.05 -0.02 -0.33 0.00 -0.06 0.00 0.00 57.16 56.80 2pgl n GLU 292 Cb 0.17 -1.01 -0.14 0.00 -0.06 0.00 0.00 31.44 30.41 2pgl n GLU 292 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2pgl s ASP 293 N 1.55 4.16 0.19 4.31 -1.08 -0.99 -5.04 116.67 119.78 2pgl s ASP 293 Ca 0.00 -0.25 -0.13 0.00 -0.52 0.00 0.00 52.55 51.66 2pgl s ASP 293 Cb 0.00 -1.42 0.21 0.00 -1.46 0.00 0.00 42.92 40.25 2pgl s ASP 293 CO 0.00 0.22 1.69 -1.28 0.52 0.00 0.00 175.17 176.32 2pgl h SER 294 N 6.27 -0.15 -0.01 -0.34 0.87 -1.90 -1.87 113.55 116.41 2pgl h SER 294 Ca -0.33 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.35 2pgl h SER 294 Cb 1.19 0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2pgl h SER 294 CO 0.55 -0.05 0.01 0.77 -0.53 0.00 0.00 176.83 177.58 2pgl h SER 295 N 0.15 0.00 0.00 6.23 4.64 -1.98 -3.55 113.55 119.04 2pgl h SER 295 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2pgl h SER 295 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2pgl h SER 295 CO -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.55