#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mde s PHE 12 N 0.00 3.05 -0.26 1.61 0.08 -1.26 -5.07 117.98 116.14 3mde s PHE 12 Ca 0.00 1.57 -0.15 0.00 0.12 0.00 0.00 56.93 58.48 3mde s PHE 12 Cb 0.00 -3.02 0.08 0.00 -0.57 0.00 0.00 43.02 39.50 3mde s PHE 12 CO 0.00 -0.73 0.63 0.45 -0.10 0.00 0.00 175.22 175.47 3mde s SER 13 N -2.10 -0.85 -0.19 1.36 0.15 -1.26 -5.02 113.70 105.79 3mde s SER 13 Ca 0.66 1.38 0.13 0.00 0.70 0.00 0.00 55.95 58.82 3mde s SER 13 Cb -0.15 1.26 0.41 0.00 -1.71 0.00 0.00 66.02 65.83 3mde s SER 13 CO 0.20 -0.23 1.21 0.49 1.20 0.00 0.00 173.24 176.11 3mde n PHE 14 N 4.26 0.00 -4.01 3.44 3.72 -1.26 -5.01 117.46 118.59 3mde n PHE 14 Ca -0.21 -1.39 -0.35 0.00 -0.05 0.00 0.00 57.45 55.45 3mde n PHE 14 Cb 0.58 -0.24 -0.12 0.00 -0.94 0.00 0.00 39.48 38.77 3mde n PHE 14 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 3mde s GLU 15 N -2.96 3.73 0.47 -1.08 2.56 -1.26 -5.10 118.70 115.06 3mde s GLU 15 Ca 0.37 -0.46 -0.21 0.00 0.00 0.00 0.00 54.97 54.67 3mde s GLU 15 Cb 0.36 -3.17 -0.08 0.00 2.00 0.00 0.00 34.13 33.24 3mde s GLU 15 CO -0.07 0.06 1.05 -0.51 -0.56 0.00 0.00 175.26 175.22 3mde s LEU 16 N 0.92 3.89 0.66 2.70 1.02 -1.26 -5.04 118.68 121.57 3mde s LEU 16 Ca 0.02 1.97 -0.12 0.00 0.02 0.00 0.00 54.13 56.02 3mde s LEU 16 Cb -0.14 -4.49 -0.01 0.00 0.02 0.00 0.00 46.19 41.56 3mde s LEU 16 CO 0.02 -0.76 1.05 0.42 0.02 0.00 0.00 176.35 177.10 3mde s THR 17 N -1.91 4.17 0.49 5.49 -4.23 -1.26 -4.87 115.64 113.52 3mde s THR 17 Ca 0.66 0.76 0.25 0.00 -1.18 0.00 0.00 61.69 62.18 3mde s THR 17 Cb -0.18 -3.51 0.29 0.00 1.34 0.00 0.00 72.50 70.44 3mde s THR 17 CO 0.22 -0.86 2.13 -0.33 -0.54 0.00 0.00 174.62 175.23 3mde h GLU 18 N -0.40 0.00 -0.20 3.99 4.39 -1.99 -0.37 114.58 119.99 3mde h GLU 18 Ca -0.44 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.15 3mde h GLU 18 Cb 1.21 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.85 3mde h GLU 18 CO 0.58 0.08 -0.28 0.37 -1.16 0.00 0.00 179.01 178.60 3mde h GLN 19 N 0.00 0.54 -0.03 2.33 4.15 -2.00 -2.87 115.11 117.23 3mde h GLN 19 Ca -0.00 -0.32 -0.09 0.00 0.77 0.00 0.00 58.65 59.01 3mde h GLN 19 Cb 0.19 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 3mde h GLN 19 CO 0.01 0.91 -0.41 1.96 -1.93 0.00 0.00 178.83 179.38 3mde h GLN 20 N 0.21 0.06 -0.44 1.69 4.20 -1.68 -1.86 115.11 117.29 3mde h GLN 20 Ca 0.02 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 3mde h GLN 20 Cb 0.85 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 3mde h GLN 20 CO 0.07 0.46 -0.16 0.87 -0.67 0.00 0.00 178.83 179.39 3mde h LYS 21 N 0.05 0.84 -0.06 1.46 1.57 -1.02 -1.72 116.57 117.69 3mde h LYS 21 Ca 0.00 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.43 3mde h LYS 21 Cb 0.75 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 3mde h LYS 21 CO 0.06 0.94 -0.09 0.93 -0.57 0.00 0.00 179.45 180.71 3mde h GLU 22 N 0.74 0.18 -0.83 3.15 5.08 -1.28 -1.17 114.58 120.44 3mde h GLU 22 Ca 0.11 -0.10 0.11 0.00 -1.00 0.00 0.00 59.36 58.48 3mde h GLU 22 Cb 0.68 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.86 3mde h GLU 22 CO 0.05 0.66 0.46 0.74 -1.00 0.00 0.00 179.01 179.92 3mde h PHE 23 N -0.30 0.83 -0.23 4.33 0.04 -1.31 -1.27 116.94 119.04 3mde h PHE 23 Ca 0.01 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.85 3mde h PHE 23 Cb 0.64 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 38.51 3mde h PHE 23 CO 0.10 0.30 -0.03 0.37 -0.60 0.00 0.00 178.31 178.45 3mde h GLN 24 N 0.74 0.03 -0.43 1.51 4.15 -1.18 -1.08 115.11 118.85 3mde h GLN 24 Ca 0.42 -0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.87 3mde h GLN 24 Cb 0.45 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 3mde h GLN 24 CO -0.28 0.02 0.23 0.00 -1.93 0.00 0.00 178.83 176.86 3mde h ALA 25 N 1.21 0.54 -0.25 3.38 0.00 -0.92 -0.10 119.26 123.12 3mde h ALA 25 Ca 0.11 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3mde h ALA 25 Cb 0.15 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3mde h ALA 25 CO -0.21 -0.12 0.06 1.15 0.00 0.00 0.00 179.25 180.13 3mde h THR 26 N 0.45 0.90 -0.60 0.00 2.02 -1.08 -0.15 112.91 114.45 3mde h THR 26 Ca 0.18 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.25 3mde h THR 26 Cb 0.08 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 3mde h THR 26 CO -0.12 0.03 0.15 0.00 0.37 0.00 0.00 175.52 175.95 3mde h ALA 27 N 1.18 0.79 0.38 6.16 0.00 -0.91 -2.00 119.26 124.85 3mde h ALA 27 Ca 0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3mde h ALA 27 Cb 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3mde h ALA 27 CO -0.14 0.49 -0.18 -0.09 0.00 0.00 0.00 179.25 179.33 3mde h ARG 28 N 0.87 -0.49 -0.65 0.00 2.43 -0.68 -1.15 114.38 114.71 3mde h ARG 28 Ca 0.19 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.46 3mde h ARG 28 Cb 0.34 0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 3mde h ARG 28 CO 0.00 -0.23 0.33 -0.22 -1.51 0.00 0.00 179.97 178.35 3mde h LYS 29 N -0.69 0.58 0.14 0.20 3.64 -1.04 -0.00 116.57 119.41 3mde h LYS 29 Ca -0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3mde h LYS 29 Cb 0.49 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3mde h LYS 29 CO 0.08 0.38 -0.08 0.35 -2.27 0.00 0.00 179.45 177.92 3mde h PHE 30 N 0.60 -0.22 -0.96 1.91 3.57 -1.30 0.68 116.94 121.23 3mde h PHE 30 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.81 3mde h PHE 30 Cb 0.26 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 3mde h PHE 30 CO -0.10 -0.13 0.62 0.00 -2.23 0.00 0.00 178.31 176.46 3mde h ALA 31 N 0.64 1.22 0.00 2.41 0.00 -0.66 0.37 119.26 123.23 3mde h ALA 31 Ca -0.01 -0.08 -0.28 0.00 0.00 0.00 0.00 54.91 54.54 3mde h ALA 31 Cb 0.18 -0.39 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 3mde h ALA 31 CO 0.02 0.63 -1.65 0.00 0.00 0.00 0.00 179.25 178.26 3mde h ARG 32 N 1.31 0.00 0.01 0.00 3.08 -0.95 -1.82 114.38 116.01 3mde h ARG 32 Ca 0.35 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.09 3mde h ARG 32 Cb -0.12 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.88 3mde h ARG 32 CO -0.07 0.49 -1.78 0.39 -1.07 0.00 0.00 179.97 177.93 3mde n GLU 33 N -3.04 0.65 -0.06 0.04 1.02 0.22 -4.45 120.64 115.01 3mde n GLU 33 Ca -0.15 0.28 -0.10 0.00 -0.02 0.00 0.00 57.16 57.17 3mde n GLU 33 Cb 1.03 -1.77 -0.06 0.00 -0.02 0.00 0.00 31.44 30.62 3mde n GLU 33 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3mde n GLU 34 N -3.08 0.31 0.11 3.49 1.02 0.12 -4.75 120.64 117.87 3mde n GLU 34 Ca -0.20 0.08 -0.06 0.00 -0.02 0.00 0.00 57.16 56.96 3mde n GLU 34 Cb 1.06 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 31.25 3mde n GLU 34 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3mde h ILE 35 N -0.09 0.07 -0.72 -3.67 2.04 -1.33 -3.39 117.51 110.43 3mde h ILE 35 Ca -0.29 -0.76 0.14 0.00 1.00 0.00 0.00 64.86 64.95 3mde h ILE 35 Cb 1.41 0.13 -0.14 0.00 -0.74 0.00 0.00 36.82 37.48 3mde h ILE 35 CO -0.07 0.02 -0.23 0.40 0.00 0.00 0.00 178.15 178.26 3mde h ILE 36 N -1.09 0.22 -0.09 -0.67 2.04 -1.55 -0.59 117.51 115.78 3mde h ILE 36 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 3mde h ILE 36 Cb 0.32 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.62 3mde h ILE 36 CO 0.06 0.00 0.08 -0.65 0.00 0.00 0.00 178.15 177.65 3mde h PRO 37 N -0.04 0.00 -0.00 2.37 0.11 -1.81 -3.07 132.00 129.56 3mde h PRO 37 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 3mde h PRO 37 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3mde h PRO 37 CO -0.75 0.00 -0.29 1.33 -0.21 0.00 0.00 178.00 178.07 3mde n VAL 38 N -4.14 0.00 -0.21 3.15 0.24 -0.79 -4.72 118.33 111.86 3mde n VAL 38 Ca -0.01 -0.35 0.02 0.00 -2.04 0.00 0.00 64.34 61.96 3mde n VAL 38 Cb 0.19 1.02 0.13 0.00 -1.47 0.00 0.00 33.84 33.71 3mde n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3mde h ALA 39 N 1.04 0.77 -0.99 2.33 0.00 -1.03 -2.07 119.26 119.32 3mde h ALA 39 Ca 0.00 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3mde h ALA 39 Cb 0.18 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3mde h ALA 39 CO 0.00 -0.31 0.64 0.00 0.00 0.00 0.00 179.25 179.58 3mde h ALA 40 N 1.52 1.39 0.00 0.00 0.00 -1.85 -2.32 119.26 118.01 3mde h ALA 40 Ca 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3mde h ALA 40 Cb 0.53 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3mde h ALA 40 CO -0.44 0.49 -0.27 1.49 0.00 0.00 0.00 179.25 180.52 3mde h GLU 41 N 1.20 0.00 0.00 0.00 4.57 -1.72 -2.97 114.58 115.66 3mde h GLU 41 Ca 0.41 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.44 3mde h GLU 41 Cb 0.09 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 3mde h GLU 41 CO -0.14 0.00 -0.86 1.88 -1.18 0.00 0.00 179.01 178.71 3mde h TYR 42 N 0.00 0.00 -0.16 0.92 0.05 -1.07 -2.53 116.97 114.18 3mde h TYR 42 Ca 0.00 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.59 3mde h TYR 42 Cb 0.94 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.68 3mde h TYR 42 CO 0.00 0.63 -0.65 0.22 -1.05 0.00 0.00 178.16 177.31 3mde h ASP 43 N 0.00 0.71 -0.09 3.88 3.58 -1.32 0.15 116.42 123.33 3mde h ASP 43 Ca -0.05 -0.42 -0.10 0.00 0.42 0.00 0.00 57.03 56.87 3mde h ASP 43 Cb 1.53 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.38 3mde h ASP 43 CO 0.07 1.18 -0.33 0.03 -2.88 0.00 0.00 179.24 177.31 3mde h ARG 44 N 0.45 0.38 0.04 0.28 3.08 -1.51 -3.34 114.38 113.77 3mde h ARG 44 Ca -0.02 -0.29 -0.27 0.00 0.07 0.00 0.00 59.98 59.47 3mde h ARG 44 Cb 1.23 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.31 3mde h ARG 44 CO 0.13 0.92 -1.39 1.79 -1.07 0.00 0.00 179.97 180.35 3mde h THR 45 N -0.08 1.27 -0.40 2.04 1.35 -1.53 -3.48 112.91 112.08 3mde h THR 45 Ca -0.02 -3.00 -0.13 0.00 -0.55 0.00 0.00 66.41 62.72 3mde h THR 45 Cb 0.97 2.70 -0.04 0.00 -1.73 0.00 0.00 68.15 70.05 3mde h THR 45 CO 0.07 0.79 -0.12 0.61 -0.25 0.00 0.00 175.52 176.61 3mde n GLY 46 N 1.52 0.72 3.76 5.82 0.00 0.52 -5.01 105.19 112.52 3mde n GLY 46 Ca -0.11 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 3mde n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mde s GLU 47 N -2.85 3.00 -0.08 1.61 2.02 -1.23 -4.55 118.70 116.62 3mde s GLU 47 Ca 0.00 1.78 -0.30 0.00 0.02 0.00 0.00 54.97 56.48 3mde s GLU 47 Cb 0.00 -1.94 -0.03 0.00 0.10 0.00 0.00 34.13 32.26 3mde s GLU 47 CO 0.00 -1.17 1.33 -0.47 0.02 0.00 0.00 175.26 174.97 3mde s TYR 48 N -1.65 2.84 -0.50 1.61 5.04 -1.26 -4.67 117.35 118.76 3mde s TYR 48 Ca 0.76 0.92 -0.05 0.00 -2.44 0.00 0.00 57.07 56.26 3mde s TYR 48 Cb -0.29 -3.57 -0.12 0.00 0.35 0.00 0.00 41.96 38.33 3mde s TYR 48 CO 0.33 -2.04 2.37 -0.35 -1.34 0.00 0.00 175.55 174.51 3mde n PRO 49 N 5.95 1.79 -0.17 4.97 -0.04 -1.26 -4.72 135.00 141.52 3mde n PRO 49 Ca 0.13 -1.09 -0.09 0.00 -0.04 0.00 0.00 63.50 62.41 3mde n PRO 49 Cb 0.45 -2.15 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 3mde n PRO 49 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3mde h VAL 50 N 2.85 0.09 -0.36 0.52 2.07 -1.98 -0.75 116.25 118.71 3mde h VAL 50 Ca 0.33 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.94 3mde h VAL 50 Cb 0.58 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3mde h VAL 50 CO 0.90 0.00 0.25 1.55 0.02 0.00 0.00 177.57 180.29 3mde h PRO 51 N -0.28 0.10 -0.00 1.57 0.14 -2.01 -1.52 132.00 130.00 3mde h PRO 51 Ca 0.15 -0.01 -0.27 0.00 0.14 0.00 0.00 66.00 66.02 3mde h PRO 51 Cb 0.57 -0.02 0.02 0.00 0.14 0.00 0.00 31.00 31.71 3mde h PRO 51 CO -0.64 0.07 -1.04 -0.07 0.14 0.00 0.00 178.00 176.46 3mde h LEU 52 N 0.10 0.92 -0.48 1.56 3.38 -1.56 -3.02 115.31 116.21 3mde h LEU 52 Ca 0.17 -0.73 -0.09 0.00 0.09 0.00 0.00 57.88 57.31 3mde h LEU 52 Cb 0.53 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3mde h LEU 52 CO -0.02 1.54 -0.07 -0.07 0.09 0.00 0.00 178.44 179.91 3mde h LEU 53 N 0.40 0.90 -0.30 1.67 3.38 -0.79 -1.31 115.31 119.26 3mde h LEU 53 Ca -0.13 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.53 3mde h LEU 53 Cb 1.69 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 42.17 3mde h LEU 53 CO 0.20 1.03 0.11 0.11 0.09 0.00 0.00 178.44 179.98 3mde h LYS 54 N 0.75 0.24 -0.48 1.13 1.57 -1.37 -1.02 116.57 117.39 3mde h LYS 54 Ca 0.13 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3mde h LYS 54 Cb 0.61 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 3mde h LYS 54 CO 0.04 0.16 0.31 0.00 -0.57 0.00 0.00 179.45 179.39 3mde h ARG 55 N 0.25 0.62 -0.50 3.15 2.47 -1.39 -1.55 114.38 117.44 3mde h ARG 55 Ca 0.13 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 3mde h ARG 55 Cb 0.09 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.25 3mde h ARG 55 CO -0.13 0.41 0.24 0.00 0.56 0.00 0.00 179.97 181.06 3mde h ALA 56 N 1.19 1.50 -0.07 0.04 0.00 -0.85 -0.69 119.26 120.37 3mde h ALA 56 Ca 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3mde h ALA 56 Cb -0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3mde h ALA 56 CO -0.05 0.40 -0.02 2.35 0.00 0.00 0.00 179.25 181.93 3mde h TRP 57 N 0.69 0.16 -0.46 0.00 7.01 -0.58 0.27 115.95 123.04 3mde h TRP 57 Ca 0.17 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.11 3mde h TRP 57 Cb 0.07 -0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.07 3mde h TRP 57 CO 0.01 0.48 0.16 0.93 -2.79 0.00 0.00 178.44 177.23 3mde h GLU 58 N -0.21 0.66 0.00 2.65 5.08 -0.96 -1.87 114.58 119.93 3mde h GLU 58 Ca 0.02 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3mde h GLU 58 Cb 0.43 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3mde h GLU 58 CO 0.01 0.56 0.00 1.25 -1.00 0.00 0.00 179.01 179.83 3mde h LEU 59 N 0.65 0.00 -0.28 1.33 5.85 -1.07 -3.47 115.31 118.32 3mde h LEU 59 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 3mde h LEU 59 Cb 0.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.19 3mde h LEU 59 CO -0.01 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.70 3mde n GLY 60 N 0.80 0.65 1.65 3.75 0.00 -0.70 -4.98 105.19 106.35 3mde n GLY 60 Ca 0.03 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 3mde n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mde n LEU 61 N -0.14 5.31 -3.86 0.99 4.77 0.89 -4.83 117.00 120.13 3mde n LEU 61 Ca 0.00 -3.69 -0.11 0.00 -0.03 0.00 0.00 56.01 52.17 3mde n LEU 61 Cb 0.46 -0.73 -0.10 0.00 -2.33 0.00 0.00 43.42 40.72 3mde n LEU 61 CO 0.00 1.16 -0.15 -0.32 -1.33 0.00 0.00 177.39 176.76 3mde s MET 62 N -3.27 0.53 -1.46 3.23 1.75 -1.24 -4.86 119.30 113.99 3mde s MET 62 Ca 0.50 -0.42 0.00 0.00 -1.25 0.00 0.00 55.69 54.52 3mde s MET 62 Cb 0.44 0.22 0.00 0.00 2.84 0.00 0.00 34.83 38.33 3mde s MET 62 CO 0.05 -0.13 0.00 0.09 -0.65 0.00 0.00 175.02 174.38 3mde n ASN 63 N 1.32 -4.79 0.26 1.11 5.03 -1.26 -4.84 115.26 112.09 3mde n ASN 63 Ca -0.22 0.14 0.16 0.00 0.87 0.00 0.00 54.58 55.53 3mde n ASN 63 Cb 0.56 -4.07 0.90 0.00 -1.02 0.00 0.00 39.78 36.15 3mde n ASN 63 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 3mde h THR 64 N 0.00 0.47 -0.00 3.41 2.02 -1.90 -2.15 112.91 114.75 3mde h THR 64 Ca -0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.80 3mde h THR 64 Cb 1.26 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 3mde h THR 64 CO 0.47 0.00 -0.41 1.57 0.37 0.00 0.00 175.52 177.52 3mde n HIS 65 N -3.77 0.00 -2.06 3.16 -0.00 -1.26 -1.28 115.22 110.00 3mde n HIS 65 Ca -0.01 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.29 3mde n HIS 65 Cb 0.18 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.99 29.98 3mde n HIS 65 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 3mde s ILE 66 N -2.74 3.19 0.82 3.57 1.01 -0.81 -4.61 121.20 121.63 3mde s ILE 66 Ca 0.17 0.74 -0.13 0.00 0.00 0.00 0.00 60.65 61.43 3mde s ILE 66 Cb 0.18 -3.48 0.08 0.00 0.01 0.00 0.00 42.46 39.26 3mde s ILE 66 CO 0.62 0.02 1.14 -2.65 0.00 0.00 0.00 174.94 174.07 3mde n PRO 67 N 4.83 0.12 -0.12 2.79 -0.02 -1.26 0.12 135.00 141.46 3mde n PRO 67 Ca 0.14 0.12 0.02 0.00 -2.02 0.00 0.00 63.50 61.76 3mde n PRO 67 Cb 0.41 -2.39 0.33 0.00 -0.02 0.00 0.00 33.50 31.83 3mde n PRO 67 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3mde h GLU 68 N -0.98 0.79 -0.99 -0.52 5.08 -1.86 -1.57 114.58 114.52 3mde h GLU 68 Ca -0.46 -0.05 0.27 0.00 -1.00 0.00 0.00 59.36 58.13 3mde h GLU 68 Cb 1.30 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.32 3mde h GLU 68 CO 0.45 0.52 0.69 0.77 -1.00 0.00 0.00 179.01 180.44 3mde h SER 69 N 0.81 0.13 -0.49 1.42 0.02 -1.91 0.11 113.55 113.65 3mde h SER 69 Ca 0.22 0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 60.96 3mde h SER 69 Cb -0.08 -0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.32 3mde h SER 69 CO -0.05 0.04 0.08 0.49 -1.14 0.00 0.00 176.83 176.25 3mde n PHE 70 N -4.34 1.52 -1.06 3.45 3.72 -0.99 -4.92 117.46 114.84 3mde n PHE 70 Ca 0.21 -1.58 -0.02 0.00 -0.05 0.00 0.00 57.45 56.02 3mde n PHE 70 Cb 0.98 -0.57 -0.01 0.00 -0.94 0.00 0.00 39.48 38.94 3mde n PHE 70 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mde n GLY 71 N -1.04 0.54 3.93 1.37 0.00 0.39 -4.44 105.19 105.94 3mde n GLY 71 Ca 0.38 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 3mde n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mde n GLY 72 N -2.34 -0.13 0.11 -0.02 0.00 -0.63 -4.95 105.19 97.23 3mde n GLY 72 Ca -0.02 -1.92 0.06 0.00 0.00 0.00 0.00 46.02 44.14 3mde n GLY 72 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3mde h LEU 73 N 0.00 0.00 -1.09 0.99 4.07 -1.64 -3.32 115.31 114.32 3mde h LEU 73 Ca -0.37 0.00 -0.44 0.00 0.08 0.00 0.00 57.88 57.15 3mde h LEU 73 Cb 1.22 0.00 0.04 0.00 1.08 0.00 0.00 40.66 43.00 3mde h LEU 73 CO 0.34 0.29 -0.75 0.61 -1.08 0.00 0.00 178.44 177.85 3mde n GLY 74 N 1.28 -0.47 3.83 0.83 0.00 0.12 -4.75 105.19 106.03 3mde n GLY 74 Ca -0.04 0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 3mde n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mde s LEU 75 N -7.16 2.93 0.66 0.99 1.02 -0.40 -4.92 118.68 111.79 3mde s LEU 75 Ca 0.52 1.39 0.04 0.00 0.02 0.00 0.00 54.13 56.10 3mde s LEU 75 Cb -0.25 -4.20 0.11 0.00 0.02 0.00 0.00 46.19 41.87 3mde s LEU 75 CO 0.79 -1.51 0.91 -0.83 0.02 0.00 0.00 176.35 175.73 3mde s GLY 76 N -4.00 1.75 0.38 -3.19 0.00 -1.26 -4.51 107.32 96.49 3mde s GLY 76 Ca 0.58 -1.94 0.11 0.00 0.00 0.00 0.00 44.72 43.48 3mde s GLY 76 CO 0.54 -1.41 1.86 -2.22 0.00 0.00 0.00 173.10 171.87 3mde h ILE 77 N -0.22 1.22 -0.72 0.90 1.08 -1.93 -2.19 117.51 115.66 3mde h ILE 77 Ca -0.33 -1.06 -0.03 0.00 -0.39 0.00 0.00 64.86 63.05 3mde h ILE 77 Cb 1.28 1.49 -0.03 0.00 -3.07 0.00 0.00 36.82 36.48 3mde h ILE 77 CO 0.40 0.31 0.35 0.40 -0.69 0.00 0.00 178.15 178.92 3mde h ILE 78 N 0.10 1.24 0.07 -0.67 2.04 -1.96 -2.03 117.51 116.29 3mde h ILE 78 Ca 0.01 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.21 3mde h ILE 78 Cb 0.54 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3mde h ILE 78 CO 0.04 0.28 -0.03 0.44 0.00 0.00 0.00 178.15 178.88 3mde h ASP 79 N 1.01 -0.07 -0.65 1.72 3.32 -1.84 -1.96 116.42 117.95 3mde h ASP 79 Ca 0.25 -0.19 0.10 0.00 0.02 0.00 0.00 57.03 57.21 3mde h ASP 79 Cb 0.12 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.61 3mde h ASP 79 CO -0.03 0.14 0.26 0.28 -1.72 0.00 0.00 179.24 178.18 3mde h SER 80 N -0.29 0.28 0.10 6.45 0.02 -1.25 -1.67 113.55 117.19 3mde h SER 80 Ca -0.01 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 3mde h SER 80 Cb 0.26 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3mde h SER 80 CO 0.01 0.16 -0.05 0.00 -1.14 0.00 0.00 176.83 175.81 3mde h LEU 82 N -0.24 0.07 0.26 0.00 4.07 -0.96 0.42 115.31 118.92 3mde h LEU 82 Ca -0.01 0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.04 3mde h LEU 82 Cb 0.20 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.07 3mde h LEU 82 CO 0.02 0.04 -0.13 0.40 -1.08 0.00 0.00 178.44 177.70 3mde h ILE 83 N 0.30 0.77 -0.73 1.22 2.04 -1.17 -3.22 117.51 116.71 3mde h ILE 83 Ca 0.32 -0.67 0.14 0.00 1.00 0.00 0.00 64.86 65.65 3mde h ILE 83 Cb 0.47 1.12 -0.10 0.00 -0.74 0.00 0.00 36.82 37.57 3mde h ILE 83 CO -0.38 0.14 0.26 0.74 0.00 0.00 0.00 178.15 178.91 3mde h THR 84 N -0.73 0.64 -0.83 -0.27 2.02 -0.66 -0.17 112.91 112.91 3mde h THR 84 Ca -0.04 -0.14 0.04 0.00 0.77 0.00 0.00 66.41 67.05 3mde h THR 84 Cb 0.49 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 67.05 3mde h THR 84 CO 0.06 0.07 0.55 -0.08 0.37 0.00 0.00 175.52 176.49 3mde h GLU 85 N 0.40 0.98 -0.35 6.66 4.81 -0.97 0.97 114.58 127.08 3mde h GLU 85 Ca 0.40 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.42 3mde h GLU 85 Cb 0.62 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3mde h GLU 85 CO -0.42 0.65 -0.36 0.93 -0.73 0.00 0.00 179.01 179.08 3mde h GLU 86 N 1.01 0.87 -0.04 1.92 4.39 -1.07 -2.93 114.58 118.72 3mde h GLU 86 Ca 0.34 -0.46 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 3mde h GLU 86 Cb 0.08 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 3mde h GLU 86 CO -0.11 1.11 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.78 3mde h LEU 87 N 0.67 0.08 -1.93 1.33 4.07 -0.75 -3.16 115.31 115.61 3mde h LEU 87 Ca 0.05 -0.32 0.09 0.00 0.08 0.00 0.00 57.88 57.78 3mde h LEU 87 Cb 0.95 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.66 3mde h LEU 87 CO 0.09 0.38 0.26 0.00 -1.08 0.00 0.00 178.44 178.09 3mde h ALA 88 N 0.70 2.24 -0.60 1.53 0.00 -0.88 -0.41 119.26 121.83 3mde h ALA 88 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3mde h ALA 88 Cb 0.34 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3mde h ALA 88 CO 0.00 -0.33 0.40 -0.92 0.00 0.00 0.00 179.25 178.39 3mde h TYR 89 N 0.08 0.75 0.21 0.00 5.03 -1.47 -3.19 116.97 118.37 3mde h TYR 89 Ca 0.17 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.49 3mde h TYR 89 Cb 0.57 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 38.60 3mde h TYR 89 CO -0.00 0.47 -0.10 0.78 -1.32 0.00 0.00 178.16 177.99 3mde h GLY 90 N 0.80 -0.29 -5.26 1.82 0.00 -1.18 -3.44 103.07 95.52 3mde h GLY 90 Ca 0.22 0.11 0.09 0.00 0.00 0.00 0.00 47.33 47.75 3mde h GLY 90 CO -0.05 -0.10 0.07 0.00 0.00 0.00 0.00 176.54 176.46 3mde n THR 92 N 4.78 0.00 -0.01 0.00 -2.24 -1.25 -1.42 114.28 114.14 3mde n THR 92 Ca -0.14 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.44 3mde n THR 92 Cb 0.54 -0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.64 3mde n THR 92 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3mde h GLY 93 N 4.96 -0.01 0.85 3.38 0.00 -1.93 -1.29 103.07 109.04 3mde h GLY 93 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 47.33 47.27 3mde h GLY 93 CO 0.00 -0.01 -0.11 -2.08 0.00 0.00 0.00 176.54 174.35 3mde h VAL 94 N -0.55 1.30 -0.85 4.60 2.07 -1.91 -3.02 116.25 117.89 3mde h VAL 94 Ca -0.00 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 3mde h VAL 94 Cb 0.54 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 3mde h VAL 94 CO 0.00 0.36 0.42 -0.61 0.02 0.00 0.00 177.57 177.77 3mde h GLN 95 N 0.24 1.21 -0.47 1.57 -0.00 -1.33 -2.30 115.11 114.03 3mde h GLN 95 Ca 0.06 -0.17 -0.01 0.00 -0.00 0.00 0.00 58.65 58.53 3mde h GLN 95 Cb 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 27.48 27.84 3mde h GLN 95 CO 0.03 0.92 0.27 1.15 0.00 0.00 0.00 178.83 181.20 3mde h THR 96 N 1.20 1.14 -0.35 2.39 2.02 -1.12 0.09 112.91 118.27 3mde h THR 96 Ca 0.29 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.14 3mde h THR 96 Cb 0.10 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3mde h THR 96 CO -0.04 0.15 0.23 0.00 0.37 0.00 0.00 175.52 176.23 3mde h ALA 97 N 1.65 0.44 -0.10 6.16 0.00 -1.29 -1.79 119.26 124.34 3mde h ALA 97 Ca 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3mde h ALA 97 Cb -0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3mde h ALA 97 CO -0.03 -0.09 0.04 0.82 0.00 0.00 0.00 179.25 180.00 3mde h ILE 98 N 0.47 1.14 -0.15 0.00 2.04 -1.10 -3.12 117.51 116.78 3mde h ILE 98 Ca 0.13 -0.41 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 3mde h ILE 98 Cb -0.04 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 3mde h ILE 98 CO -0.03 0.12 -0.20 -0.33 0.00 0.00 0.00 178.15 177.72 3mde h GLU 99 N 0.01 0.25 -0.36 2.37 4.39 -0.92 -2.40 114.58 117.93 3mde h GLU 99 Ca 0.03 -0.07 0.07 0.00 0.34 0.00 0.00 59.36 59.73 3mde h GLU 99 Cb 0.16 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3mde h GLU 99 CO -0.00 0.45 0.25 0.00 -1.16 0.00 0.00 179.01 178.54 3mde h ALA 100 N 1.57 2.12 0.05 3.43 0.00 -1.26 -1.15 119.26 124.01 3mde h ALA 100 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3mde h ALA 100 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3mde h ALA 100 CO 0.03 -0.20 -0.02 -0.91 0.00 0.00 0.00 179.25 178.15 3mde h ASN 101 N 0.17 -0.05 0.17 0.00 4.21 -1.49 -2.50 115.58 116.08 3mde h ASN 101 Ca 0.16 -0.13 -0.03 0.00 1.21 0.00 0.00 56.30 57.52 3mde h ASN 101 Cb 0.43 0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.64 3mde h ASN 101 CO -0.02 0.09 -0.15 0.74 -1.29 0.00 0.00 177.43 176.80 3mde h THR 102 N -0.20 1.03 -0.30 2.81 2.02 -1.31 -2.32 112.91 114.64 3mde h THR 102 Ca -0.01 -0.52 -0.10 0.00 0.77 0.00 0.00 66.41 66.55 3mde h THR 102 Cb 0.18 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3mde h THR 102 CO 0.01 0.14 -0.21 0.25 0.37 0.00 0.00 175.52 176.08 3mde h LEU 103 N 0.00 0.71 -0.13 2.58 5.85 -1.08 -2.14 115.31 121.09 3mde h LEU 103 Ca -0.00 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 3mde h LEU 103 Cb 0.27 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 3mde h LEU 103 CO 0.02 0.99 -0.15 1.23 -0.34 0.00 0.00 178.44 180.20 3mde h GLY 104 N 0.42 0.00 0.58 3.75 0.00 -1.16 -3.34 103.07 103.33 3mde h GLY 104 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.23 3mde h GLY 104 CO 0.06 0.00 -0.68 1.46 0.00 0.00 0.00 176.54 177.37 3mde h GLN 105 N 0.00 0.25 -0.59 4.80 4.20 -1.41 -3.38 115.11 118.98 3mde h GLN 105 Ca -0.00 -0.43 0.12 0.00 0.06 0.00 0.00 58.65 58.39 3mde h GLN 105 Cb 1.07 0.16 -0.11 0.00 0.30 0.00 0.00 27.48 28.89 3mde h GLN 105 CO 0.02 1.21 -0.21 0.28 -0.67 0.00 0.00 178.83 179.46 3mde h VAL 106 N -0.47 0.32 -0.98 -0.54 2.07 -1.50 -1.68 116.25 113.47 3mde h VAL 106 Ca -0.12 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.61 3mde h VAL 106 Cb 1.54 0.32 -0.11 0.00 -1.52 0.00 0.00 31.29 31.51 3mde h VAL 106 CO 0.13 0.00 0.56 -0.65 0.02 0.00 0.00 177.57 177.63 3mde h PRO 107 N -0.06 0.62 -0.34 1.57 0.11 -1.75 0.17 132.00 132.31 3mde h PRO 107 Ca 0.27 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.27 3mde h PRO 107 Cb 0.49 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 3mde h PRO 107 CO -0.64 0.41 -0.10 1.25 -0.21 0.00 0.00 178.00 178.72 3mde h LEU 108 N 0.64 0.68 -0.37 2.35 5.85 -1.58 -0.05 115.31 122.82 3mde h LEU 108 Ca 0.59 -0.37 -0.15 0.00 0.84 0.00 0.00 57.88 58.79 3mde h LEU 108 Cb 1.02 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3mde h LEU 108 CO -0.43 0.89 -0.37 0.40 -0.34 0.00 0.00 178.44 178.59 3mde h ILE 109 N 0.46 1.28 0.00 4.05 2.04 -0.16 0.21 117.51 125.38 3mde h ILE 109 Ca 0.09 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.40 3mde h ILE 109 Cb 0.60 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 3mde h ILE 109 CO 0.04 0.51 -1.17 2.30 0.00 0.00 0.00 178.15 179.83 3mde n ILE 110 N -4.09 0.32 -0.71 -0.67 -5.35 0.41 -4.58 119.36 104.68 3mde n ILE 110 Ca -0.02 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 3mde n ILE 110 Cb 0.53 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 3mde n ILE 110 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3mde n GLY 111 N 1.28 -1.06 3.97 3.28 0.00 -0.04 -5.08 105.19 107.55 3mde n GLY 111 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 3mde n GLY 111 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mde s GLY 112 N -0.25 1.32 0.73 -0.02 0.00 0.75 -3.22 107.32 106.62 3mde s GLY 112 Ca 0.00 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 43.44 3mde s GLY 112 CO 0.00 -1.29 1.00 0.54 0.00 0.00 0.00 173.10 173.35 3mde s ASN 113 N -4.02 4.30 0.18 1.64 2.20 -1.26 -4.88 114.94 113.09 3mde s ASN 113 Ca 0.37 -0.58 -0.12 0.00 -0.94 0.00 0.00 52.86 51.59 3mde s ASN 113 Cb -0.09 0.29 0.10 0.00 -2.00 0.00 0.00 41.25 39.54 3mde s ASN 113 CO 0.29 -1.92 1.78 0.22 -2.94 0.00 0.00 177.10 174.54 3mde h TYR 114 N -0.50 0.90 -0.38 1.54 3.20 -1.99 -1.22 116.97 118.52 3mde h TYR 114 Ca -0.33 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.48 3mde h TYR 114 Cb 1.26 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 3mde h TYR 114 CO -0.18 0.67 0.16 1.96 -1.64 0.00 0.00 178.16 179.13 3mde h GLN 115 N 0.87 0.55 0.11 1.82 7.50 -1.99 0.15 115.11 124.12 3mde h GLN 115 Ca 0.22 -0.09 -0.01 0.00 0.50 0.00 0.00 58.65 59.27 3mde h GLN 115 Cb 0.09 -0.09 0.00 0.00 0.05 0.00 0.00 27.48 27.53 3mde h GLN 115 CO -0.03 0.52 -0.05 1.96 -1.50 0.00 0.00 178.83 179.73 3mde h GLN 116 N 0.46 -0.14 -0.11 1.46 4.20 -1.87 -1.90 115.11 117.21 3mde h GLN 116 Ca 0.13 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3mde h GLN 116 Cb 0.16 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 3mde h GLN 116 CO -0.01 -0.05 0.06 1.96 -0.67 0.00 0.00 178.83 180.12 3mde h GLN 117 N -0.19 0.16 -0.40 1.46 4.20 -1.11 -0.85 115.11 118.38 3mde h GLN 117 Ca -0.01 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.75 3mde h GLN 117 Cb 0.15 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.83 3mde h GLN 117 CO 0.02 0.20 -0.07 -0.22 -0.67 0.00 0.00 178.83 178.09 3mde h LYS 118 N 0.08 0.03 0.30 1.46 3.64 -0.66 0.44 116.57 121.87 3mde h LYS 118 Ca 0.04 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3mde h LYS 118 Cb 0.09 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 3mde h LYS 118 CO -0.01 0.02 -0.14 -0.22 -2.27 0.00 0.00 179.45 176.83 3mde h LYS 119 N 0.03 -0.39 0.08 1.90 3.64 -1.21 -2.22 116.57 118.40 3mde h LYS 119 Ca 0.20 0.03 -0.29 0.00 -1.27 0.00 0.00 60.65 59.32 3mde h LYS 119 Cb 0.30 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 3mde h LYS 119 CO -0.39 -0.05 -1.47 1.88 -2.27 0.00 0.00 179.45 177.15 3mde h TYR 120 N -0.84 0.29 0.22 1.91 0.05 -1.13 -3.21 116.97 114.25 3mde h TYR 120 Ca -0.04 -0.21 -0.35 0.00 0.05 0.00 0.00 58.73 58.18 3mde h TYR 120 Cb 0.52 -0.01 0.02 0.00 1.01 0.00 0.00 36.73 38.27 3mde h TYR 120 CO 0.04 1.25 -1.66 -0.07 -1.05 0.00 0.00 178.16 176.67 3mde h LEU 121 N 0.04 0.72 -1.03 3.88 4.07 -0.28 -3.35 115.31 119.35 3mde h LEU 121 Ca -0.21 -0.93 0.11 0.00 0.08 0.00 0.00 57.88 56.92 3mde h LEU 121 Cb 1.97 -0.23 -0.08 0.00 1.08 0.00 0.00 40.66 43.40 3mde h LEU 121 CO 0.14 1.77 0.63 1.23 -1.08 0.00 0.00 178.44 181.13 3mde h GLY 122 N 0.46 1.58 1.45 0.83 0.00 -0.87 -1.77 103.07 104.74 3mde h GLY 122 Ca -0.31 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.50 3mde h GLY 122 CO 0.22 0.20 -0.11 0.07 0.00 0.00 0.00 176.54 176.92 3mde h ARG 123 N 1.02 0.66 0.00 4.80 0.11 -1.68 -2.75 114.38 116.54 3mde h ARG 123 Ca 0.48 -0.20 -0.01 0.00 0.10 0.00 0.00 59.98 60.34 3mde h ARG 123 Cb 0.42 -0.06 -0.00 0.00 1.11 0.00 0.00 29.97 31.43 3mde h ARG 123 CO -0.23 0.75 -0.06 0.52 0.10 0.00 0.00 179.97 181.05 3mde h MET 124 N 0.60 0.00 0.00 0.08 2.86 -1.45 -1.82 114.93 115.20 3mde h MET 124 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3mde h MET 124 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3mde h MET 124 CO 0.03 0.06 -0.76 2.41 1.06 0.00 0.00 176.91 179.72 3mde n THR 125 N -3.57 0.20 -0.10 2.22 -1.04 -1.05 -4.29 114.28 106.65 3mde n THR 125 Ca -0.02 -0.20 -0.24 0.00 -2.04 0.00 0.00 64.05 61.55 3mde n THR 125 Cb 0.17 0.10 -0.11 0.00 -1.82 0.00 0.00 70.33 68.67 3mde n THR 125 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3mde n GLU 126 N -1.91 0.60 -4.29 -2.82 1.02 -0.73 -5.01 120.64 107.49 3mde n GLU 126 Ca 0.03 0.43 -0.20 0.00 -0.02 0.00 0.00 57.16 57.40 3mde n GLU 126 Cb 0.41 -1.66 -0.11 0.00 -0.02 0.00 0.00 31.44 30.07 3mde n GLU 126 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3mde s GLU 127 N -2.44 1.16 0.00 3.49 2.02 -0.90 -5.04 118.70 116.99 3mde s GLU 127 Ca -0.32 -1.33 -0.02 0.00 0.02 0.00 0.00 54.97 53.32 3mde s GLU 127 Cb 0.09 -1.14 -0.10 0.00 0.10 0.00 0.00 34.13 33.09 3mde s GLU 127 CO 0.58 0.23 1.84 -2.30 0.02 0.00 0.00 175.26 175.62 3mde n PRO 128 N 0.40 0.91 -1.91 0.39 -0.02 -1.26 -4.51 135.00 129.00 3mde n PRO 128 Ca -0.14 -0.36 -0.32 0.00 -2.02 0.00 0.00 63.50 60.65 3mde n PRO 128 Cb 0.57 -1.58 0.02 0.00 -0.02 0.00 0.00 33.50 32.49 3mde n PRO 128 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3mde s LEU 129 N 0.00 3.42 0.32 2.45 1.02 -1.26 -4.95 118.68 119.67 3mde s LEU 129 Ca 0.24 1.83 0.11 0.00 0.02 0.00 0.00 54.13 56.32 3mde s LEU 129 Cb 0.11 -4.53 -0.06 0.00 0.02 0.00 0.00 46.19 41.73 3mde s LEU 129 CO 0.00 -1.31 -0.14 -0.04 0.02 0.00 0.00 176.35 174.88 3mde s MET 130 N -4.22 1.76 0.21 1.70 -1.94 -1.26 -4.95 119.30 110.61 3mde s MET 130 Ca 0.63 -1.87 -0.04 0.00 -1.71 0.00 0.00 55.69 52.71 3mde s MET 130 Cb -0.17 -1.73 -0.03 0.00 2.01 0.00 0.00 34.83 34.91 3mde s MET 130 CO 0.41 0.22 0.22 0.00 -0.01 0.00 0.00 175.02 175.86 3mde s ALA 132 N -4.10 0.03 -0.29 0.00 0.00 -1.14 -4.18 121.76 112.07 3mde s ALA 132 Ca 0.35 -0.77 -0.07 0.00 0.00 0.00 0.00 51.96 51.48 3mde s ALA 132 Cb 0.05 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.54 3mde s ALA 132 CO 0.12 -0.42 0.08 -0.47 0.00 0.00 0.00 175.76 175.06 3mde s TYR 133 N -3.53 3.15 -0.74 0.00 5.04 -1.26 -0.81 117.35 119.20 3mde s TYR 133 Ca 0.03 -1.01 -0.05 0.00 -2.44 0.00 0.00 57.07 53.60 3mde s TYR 133 Cb 0.04 -2.25 0.19 0.00 0.35 0.00 0.00 41.96 40.29 3mde s TYR 133 CO -0.09 -0.59 0.59 0.00 -1.34 0.00 0.00 175.55 174.13 3mde n VAL 135 N 3.27 1.24 -1.69 0.00 0.31 -1.26 -2.09 118.33 118.11 3mde n VAL 135 Ca 0.12 0.26 -0.44 0.00 -0.01 0.00 0.00 64.34 64.28 3mde n VAL 135 Cb 0.39 -1.83 -0.02 0.00 -0.91 0.00 0.00 33.84 31.47 3mde n VAL 135 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3mde n THR 136 N -3.79 1.29 -4.45 2.52 -1.04 -1.26 -4.90 114.28 102.64 3mde n THR 136 Ca -0.07 -0.32 -0.22 0.00 -2.04 0.00 0.00 64.05 61.40 3mde n THR 136 Cb 0.24 -1.57 -0.11 0.00 -1.82 0.00 0.00 70.33 67.07 3mde n THR 136 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3mde s GLU 137 N -0.88 1.63 0.27 -2.82 2.02 0.99 -0.28 118.70 119.63 3mde s GLU 137 Ca 0.64 -1.87 -0.01 0.00 0.02 0.00 0.00 54.97 53.75 3mde s GLU 137 Cb -0.60 -1.08 0.48 0.00 0.10 0.00 0.00 34.13 33.03 3mde s GLU 137 CO 0.53 -0.06 1.83 -1.35 0.02 0.00 0.00 175.26 176.23 3mde h PRO 138 N 2.17 0.89 -0.00 0.39 0.11 -1.89 -2.51 132.00 131.15 3mde h PRO 138 Ca -0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3mde h PRO 138 Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3mde h PRO 138 CO 0.70 0.59 -0.50 0.41 -0.21 0.00 0.00 178.00 178.99 3mde n GLY 139 N -1.34 -1.08 3.56 -0.55 0.00 -1.26 -4.90 105.19 99.62 3mde n GLY 139 Ca 0.17 -0.39 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 3mde n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mde s ALA 140 N -2.89 -1.70 0.01 4.61 0.00 -0.94 -5.00 121.76 115.83 3mde s ALA 140 Ca 0.13 2.22 0.00 0.00 0.00 0.00 0.00 51.96 54.32 3mde s ALA 140 Cb 0.18 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.95 3mde s ALA 140 CO 0.68 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.45 3mde n GLY 141 N 4.40 -0.03 0.28 0.00 0.00 -1.26 -0.01 105.19 108.57 3mde n GLY 141 Ca -0.20 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.77 3mde n GLY 141 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3mde h SER 142 N 0.00 0.82 -2.56 1.61 0.02 -1.96 -3.35 113.55 108.13 3mde h SER 142 Ca 0.00 -0.03 -0.71 0.00 -0.84 0.00 0.00 61.79 60.21 3mde h SER 142 Cb 0.00 -0.21 -0.19 0.00 0.14 0.00 0.00 62.40 62.14 3mde h SER 142 CO 0.00 0.61 0.83 -0.62 -1.14 0.00 0.00 176.83 176.50 3mde s ASP 143 N -5.87 6.74 0.00 3.07 2.15 -1.26 -4.84 116.67 116.65 3mde s ASP 143 Ca -0.13 -2.32 0.29 0.00 0.43 0.00 0.00 52.55 50.82 3mde s ASP 143 Cb 0.14 -2.37 1.24 0.00 -0.30 0.00 0.00 42.92 41.63 3mde s ASP 143 CO 0.78 -0.93 1.91 1.33 -0.17 0.00 0.00 175.17 178.08 3mde n VAL 144 N 5.10 0.00 0.88 1.11 0.24 -1.26 -1.49 118.33 122.92 3mde n VAL 144 Ca 0.25 -0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.67 3mde n VAL 144 Cb 0.48 -0.41 0.55 0.00 -1.47 0.00 0.00 33.84 32.98 3mde n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3mde n ALA 145 N -1.42 2.18 1.31 2.33 0.00 -1.26 -2.41 120.51 121.25 3mde n ALA 145 Ca 0.09 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3mde n ALA 145 Cb 0.31 -1.42 0.42 0.00 0.00 0.00 0.00 19.45 18.77 3mde n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mde n GLY 146 N 1.17 -0.46 3.75 0.00 0.00 -0.55 -4.99 105.19 104.09 3mde n GLY 146 Ca 0.06 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 3mde n GLY 146 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mde s ILE 147 N -2.37 2.35 0.00 -0.61 -4.36 -1.01 -4.81 121.20 110.38 3mde s ILE 147 Ca 0.28 0.23 0.00 0.00 -0.26 0.00 0.00 60.65 60.90 3mde s ILE 147 Cb 0.20 -3.10 0.00 0.00 1.25 0.00 0.00 42.46 40.81 3mde s ILE 147 CO 0.47 -0.03 0.19 0.29 0.24 0.00 0.00 174.94 176.09 3mde n LYS 148 N -1.46 3.53 -1.95 0.37 5.02 -1.26 -4.76 118.16 117.65 3mde n LYS 148 Ca 0.13 -0.19 -0.42 0.00 -2.02 0.00 0.00 58.31 55.81 3mde n LYS 148 Cb 0.48 -0.67 -0.03 0.00 -0.02 0.00 0.00 35.03 34.80 3mde n LYS 148 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mde s THR 149 N -0.56 3.47 0.26 -0.18 -4.23 -1.26 -4.82 115.64 108.33 3mde s THR 149 Ca 0.00 0.55 -0.17 0.00 -1.18 0.00 0.00 61.69 60.89 3mde s THR 149 Cb 0.00 -3.42 -0.08 0.00 1.34 0.00 0.00 72.50 70.34 3mde s THR 149 CO 0.00 -0.12 0.71 -0.54 -0.54 0.00 0.00 174.62 174.13 3mde s LYS 150 N 4.53 4.12 -0.25 3.99 -0.14 0.97 0.09 119.74 133.04 3mde s LYS 150 Ca 0.78 0.75 -0.01 0.00 -1.36 0.00 0.00 55.97 56.13 3mde s LYS 150 Cb -0.32 -2.69 0.08 0.00 -1.68 0.00 0.00 37.83 33.21 3mde s LYS 150 CO 0.32 0.30 0.03 0.00 -0.76 0.00 0.00 175.35 175.24 3mde s ALA 151 N -1.71 1.54 -0.19 5.17 0.00 -0.21 -1.53 121.76 124.82 3mde s ALA 151 Ca 0.47 -1.31 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 3mde s ALA 151 Cb -0.14 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 3mde s ALA 151 CO 0.19 -1.38 0.00 -1.21 0.00 0.00 0.00 175.76 173.37 3mde s GLU 152 N 1.60 3.66 -0.02 0.00 2.02 0.45 -4.40 118.70 122.01 3mde s GLU 152 Ca 0.02 -0.50 -0.30 0.00 0.02 0.00 0.00 54.97 54.21 3mde s GLU 152 Cb -0.18 -3.08 -0.05 0.00 0.10 0.00 0.00 34.13 30.92 3mde s GLU 152 CO -0.14 0.06 1.41 0.21 0.02 0.00 0.00 175.26 176.82 3mde s LYS 153 N 0.88 4.27 -0.41 1.61 2.20 -1.26 0.56 119.74 127.59 3mde s LYS 153 Ca 0.01 1.96 0.02 0.00 -0.36 0.00 0.00 55.97 57.60 3mde s LYS 153 Cb -0.14 -3.62 0.14 0.00 -1.51 0.00 0.00 37.83 32.70 3mde s LYS 153 CO 0.02 -0.60 0.25 0.21 -0.36 0.00 0.00 175.35 174.87 3mde s LYS 154 N 2.60 0.97 6.11 4.03 2.20 0.13 -4.94 119.74 130.84 3mde s LYS 154 Ca 0.64 -1.78 0.00 0.00 -0.36 0.00 0.00 55.97 54.47 3mde s LYS 154 Cb -0.31 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.20 3mde s LYS 154 CO 0.26 -1.22 0.00 0.41 -0.36 0.00 0.00 175.35 174.44 3mde n GLY 155 N 3.60 1.57 1.54 5.54 0.00 -1.26 -2.20 105.19 113.98 3mde n GLY 155 Ca 0.13 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.36 3mde n GLY 155 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3mde n ASP 156 N 11.08 4.85 -4.02 1.61 2.03 -1.26 -4.97 116.55 125.88 3mde n ASP 156 Ca 0.00 -2.63 -0.10 0.00 0.52 0.00 0.00 54.79 52.59 3mde n ASP 156 Cb 0.00 -0.59 -0.06 0.00 -0.72 0.00 0.00 41.12 39.75 3mde n ASP 156 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 3mde s GLU 157 N -2.17 1.39 -0.05 -0.67 -1.05 -0.93 -2.24 118.70 112.97 3mde s GLU 157 Ca 0.50 -1.29 0.05 0.00 -0.15 0.00 0.00 54.97 54.08 3mde s GLU 157 Cb 0.35 0.41 -0.02 0.00 -0.44 0.00 0.00 34.13 34.43 3mde s GLU 157 CO 0.20 -0.54 -0.20 0.71 0.95 0.00 0.00 175.26 176.38 3mde s TYR 158 N -4.03 2.55 -0.25 4.83 1.51 0.75 0.20 117.35 122.92 3mde s TYR 158 Ca 0.24 -0.41 -0.10 0.00 -1.01 0.00 0.00 57.07 55.79 3mde s TYR 158 Cb 0.02 -1.61 -0.05 0.00 -0.11 0.00 0.00 41.96 40.21 3mde s TYR 158 CO 0.07 -0.00 0.16 0.42 -1.11 0.00 0.00 175.55 175.08 3mde s ILE 159 N -0.46 5.24 -0.17 2.71 -1.09 0.19 -1.31 121.20 126.30 3mde s ILE 159 Ca 0.05 0.14 -0.02 0.00 -2.23 0.00 0.00 60.65 58.59 3mde s ILE 159 Cb -0.12 -3.45 -0.01 0.00 -1.58 0.00 0.00 42.46 37.29 3mde s ILE 159 CO 0.01 0.32 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.34 3mde s ILE 160 N 1.26 3.36 -0.06 2.92 1.01 0.51 -0.41 121.20 129.80 3mde s ILE 160 Ca 0.07 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.21 3mde s ILE 160 Cb -0.14 -2.47 0.02 0.00 0.01 0.00 0.00 42.46 39.87 3mde s ILE 160 CO 0.06 0.48 -0.07 0.20 0.00 0.00 0.00 174.94 175.61 3mde s ASN 161 N 0.79 1.38 0.00 3.58 -0.87 -0.58 -1.50 114.94 117.75 3mde s ASN 161 Ca -0.03 -0.20 0.00 0.00 -1.57 0.00 0.00 52.86 51.06 3mde s ASN 161 Cb -0.15 -0.62 0.00 0.00 -0.02 0.00 0.00 41.25 40.47 3mde s ASN 161 CO 0.01 -0.04 0.00 0.61 -2.57 0.00 0.00 177.10 175.12 3mde n GLY 162 N 4.10 -2.39 2.93 0.66 0.00 -0.14 -0.02 105.19 110.33 3mde n GLY 162 Ca -0.22 -1.29 -0.17 0.00 0.00 0.00 0.00 46.02 44.34 3mde n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3mde s GLN 163 N -2.00 0.52 0.06 1.61 0.74 -1.26 0.34 119.66 119.67 3mde s GLN 163 Ca 0.00 -0.14 0.06 0.00 0.05 0.00 0.00 55.36 55.33 3mde s GLN 163 Cb 0.00 -0.54 -0.04 0.00 1.10 0.00 0.00 33.01 33.53 3mde s GLN 163 CO 0.00 0.04 -0.11 0.15 -0.55 0.00 0.00 175.29 174.81 3mde s LYS 164 N 0.28 2.23 0.07 1.67 -0.14 0.28 -4.42 119.74 119.71 3mde s LYS 164 Ca -0.03 -0.93 0.05 0.00 -1.36 0.00 0.00 55.97 53.70 3mde s LYS 164 Cb -0.07 -2.33 -0.03 0.00 -1.68 0.00 0.00 37.83 33.72 3mde s LYS 164 CO -0.00 0.54 -0.14 1.41 -0.76 0.00 0.00 175.35 176.40 3mde s MET 165 N -1.77 0.82 -1.16 1.68 1.75 0.62 0.20 119.30 121.44 3mde s MET 165 Ca 0.18 -0.97 -0.04 0.00 -1.25 0.00 0.00 55.69 53.61 3mde s MET 165 Cb -0.11 -0.80 -0.03 0.00 2.84 0.00 0.00 34.83 36.74 3mde s MET 165 CO 0.10 0.17 0.90 0.91 -0.65 0.00 0.00 175.02 176.45 3mde n TRP 166 N 1.21 -2.21 -3.52 4.11 5.03 -1.13 -4.48 117.44 116.45 3mde n TRP 166 Ca -0.21 0.86 -0.39 0.00 3.03 0.00 0.00 57.50 60.79 3mde n TRP 166 Cb 0.54 -4.50 -0.10 0.00 -1.03 0.00 0.00 31.31 26.22 3mde n TRP 166 CO 0.00 0.00 0.00 0.42 -0.03 0.00 0.00 177.69 178.08 3mde s ILE 167 N -3.43 5.26 0.02 -0.99 -1.09 0.63 -4.80 121.20 116.79 3mde s ILE 167 Ca 0.20 0.17 -0.30 0.00 -2.23 0.00 0.00 60.65 58.49 3mde s ILE 167 Cb -0.03 -3.63 -0.06 0.00 -1.58 0.00 0.00 42.46 37.16 3mde s ILE 167 CO 0.76 0.15 1.43 -0.89 -1.23 0.00 0.00 174.94 175.16 3mde s THR 168 N 1.84 3.60 -0.01 2.92 2.01 -1.26 -1.67 115.64 123.08 3mde s THR 168 Ca 0.09 1.01 0.00 0.00 0.31 0.00 0.00 61.69 63.10 3mde s THR 168 Cb -0.16 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.70 3mde s THR 168 CO 0.11 0.00 0.00 0.59 -0.69 0.00 0.00 174.62 174.63 3mde n ASN 169 N 5.30 -3.56 -0.32 3.53 5.03 0.22 -4.53 115.26 120.94 3mde n ASN 169 Ca 0.13 0.00 0.22 0.00 0.87 0.00 0.00 54.58 55.80 3mde n ASN 169 Cb 0.43 -1.07 0.49 0.00 -1.02 0.00 0.00 39.78 38.62 3mde n ASN 169 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3mde h GLY 170 N 0.00 1.25 -1.94 7.41 0.00 -1.51 0.62 103.07 108.91 3mde h GLY 170 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 3mde h GLY 170 CO 0.00 -0.13 0.00 0.61 0.00 0.00 0.00 176.54 177.03 3mde n GLY 171 N -1.46 1.39 0.00 4.60 0.00 -1.26 -4.43 105.19 104.03 3mde n GLY 171 Ca 0.25 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3mde n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mde n LYS 172 N 1.25 -0.13 -3.32 1.61 4.76 -0.14 -5.08 118.16 117.12 3mde n LYS 172 Ca 0.16 -0.53 -0.34 0.00 -2.87 0.00 0.00 58.31 54.73 3mde n LYS 172 Cb 0.54 -0.85 -0.06 0.00 -1.84 0.00 0.00 35.03 32.82 3mde n LYS 172 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mde s ALA 173 N -0.14 3.53 0.04 7.82 0.00 0.02 -4.32 121.76 128.71 3mde s ALA 173 Ca 0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 51.96 51.70 3mde s ALA 173 Cb 0.00 -2.57 -0.32 0.00 0.00 0.00 0.00 23.12 20.24 3mde s ALA 173 CO 0.00 0.44 1.06 -0.97 0.00 0.00 0.00 175.76 176.29 3mde h ASN 174 N 3.22 0.87 -5.26 0.00 -1.24 -1.21 -3.42 115.58 108.54 3mde h ASN 174 Ca -0.48 -0.86 -0.12 0.00 0.71 0.00 0.00 56.30 55.55 3mde h ASN 174 Cb 1.19 -0.28 -0.14 0.00 0.73 0.00 0.00 38.32 39.82 3mde h ASN 174 CO 0.66 1.65 -0.44 -1.66 -1.29 0.00 0.00 177.43 176.36 3mde s TRP 175 N -2.83 0.43 0.01 0.67 1.48 -1.26 -1.61 118.94 115.82 3mde s TRP 175 Ca -0.09 -0.83 0.06 0.00 -1.06 0.00 0.00 56.10 54.17 3mde s TRP 175 Cb 0.05 -0.18 -0.02 0.00 -1.16 0.00 0.00 33.47 32.16 3mde s TRP 175 CO 0.94 -0.59 -0.17 0.71 -4.06 0.00 0.00 176.95 173.78 3mde s TYR 176 N -3.95 1.48 -0.08 1.66 2.02 0.42 -2.88 117.35 116.04 3mde s TYR 176 Ca 0.14 -0.32 -0.21 0.00 -0.37 0.00 0.00 57.07 56.31 3mde s TYR 176 Cb 0.05 -0.92 -0.04 0.00 -0.40 0.00 0.00 41.96 40.65 3mde s TYR 176 CO -0.04 0.02 0.61 0.12 -1.57 0.00 0.00 175.55 174.68 3mde s PHE 177 N -0.59 3.57 -0.11 2.71 5.36 0.01 -0.31 117.98 128.62 3mde s PHE 177 Ca 0.05 1.12 -0.00 0.00 -0.96 0.00 0.00 56.93 57.14 3mde s PHE 177 Cb -0.07 -2.69 0.02 0.00 -0.34 0.00 0.00 43.02 39.94 3mde s PHE 177 CO 0.00 0.15 -0.08 -1.17 -1.46 0.00 0.00 175.22 172.67 3mde s LEU 178 N 0.61 1.20 -0.24 6.12 1.98 0.00 0.36 118.68 128.71 3mde s LEU 178 Ca 0.33 -0.30 -0.11 0.00 -2.89 0.00 0.00 54.13 51.16 3mde s LEU 178 Cb -0.17 -0.83 -0.05 0.00 0.66 0.00 0.00 46.19 45.80 3mde s LEU 178 CO 0.15 -0.11 0.20 -0.22 -1.89 0.00 0.00 176.35 174.48 3mde s LEU 179 N 1.65 4.11 0.09 -0.68 2.96 -0.89 -0.83 118.68 125.09 3mde s LEU 179 Ca 0.04 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.13 3mde s LEU 179 Cb -0.13 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 3mde s LEU 179 CO -0.07 0.03 -0.09 0.00 -1.32 0.00 0.00 176.35 174.90 3mde s ALA 180 N 1.21 1.01 -0.26 5.97 0.00 -0.59 -4.84 121.76 124.25 3mde s ALA 180 Ca 0.09 -1.19 -0.24 0.00 0.00 0.00 0.00 51.96 50.62 3mde s ALA 180 Cb -0.14 0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.05 3mde s ALA 180 CO 0.06 -0.10 0.81 0.50 0.00 0.00 0.00 175.76 177.03 3mde s ARG 181 N -2.98 4.13 -0.03 0.00 3.52 0.11 -0.54 118.95 123.17 3mde s ARG 181 Ca 0.06 0.85 0.12 0.00 -0.13 0.00 0.00 55.73 56.63 3mde s ARG 181 Cb -0.01 -3.66 -0.19 0.00 -1.56 0.00 0.00 34.95 29.53 3mde s ARG 181 CO -0.01 -0.55 0.23 -1.13 -0.81 0.00 0.00 175.30 173.03 3mde n SER 182 N 6.05 2.13 -4.47 -2.12 3.41 -0.26 -1.04 113.62 117.31 3mde n SER 182 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.23 3mde n SER 182 Cb 0.48 1.43 -0.09 0.00 -0.26 0.00 0.00 64.21 65.76 3mde n SER 182 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3mde s ASP 183 N -3.63 6.14 0.45 4.04 -1.08 -0.90 -4.89 116.67 116.80 3mde s ASP 183 Ca -0.05 -0.82 0.21 0.00 -0.52 0.00 0.00 52.55 51.37 3mde s ASP 183 Cb 0.07 -2.19 1.08 0.00 -1.46 0.00 0.00 42.92 40.43 3mde s ASP 183 CO 0.51 -0.51 1.94 1.55 0.52 0.00 0.00 175.17 179.19 3mde h PRO 184 N 8.67 0.00 -6.31 4.34 0.13 -1.89 -3.43 132.00 133.50 3mde h PRO 184 Ca -0.27 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.32 3mde h PRO 184 Cb 1.12 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.26 3mde h PRO 184 CO 0.76 0.23 1.22 0.34 -0.23 0.00 0.00 178.00 180.32 3mde s ASP 185 N -6.47 6.43 0.51 1.44 2.15 -1.26 -4.87 116.67 114.60 3mde s ASP 185 Ca -0.02 2.51 0.25 0.00 0.43 0.00 0.00 52.55 55.72 3mde s ASP 185 Cb 0.13 -2.53 1.39 0.00 -0.30 0.00 0.00 42.92 41.61 3mde s ASP 185 CO 0.65 -1.09 2.07 1.55 -0.17 0.00 0.00 175.17 178.17 3mde h PRO 186 N 10.68 0.00 -0.25 4.34 0.13 -2.04 -2.02 132.00 142.84 3mde h PRO 186 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3mde h PRO 186 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3mde h PRO 186 CO 0.95 0.12 0.00 1.63 -0.23 0.00 0.00 178.00 180.47 3mde n LYS 187 N -3.79 1.86 -2.51 0.86 4.01 -1.26 -4.89 118.16 112.44 3mde n LYS 187 Ca -0.02 -1.30 -0.41 0.00 -0.51 0.00 0.00 58.31 56.07 3mde n LYS 187 Cb 0.23 -1.38 -0.04 0.00 -0.51 0.00 0.00 35.03 33.32 3mde n LYS 187 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3mde s ALA 188 N -1.68 3.39 0.49 7.82 0.00 -0.76 -5.01 121.76 126.01 3mde s ALA 188 Ca 0.31 0.84 -0.20 0.00 0.00 0.00 0.00 51.96 52.91 3mde s ALA 188 Cb 0.17 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.88 3mde s ALA 188 CO 0.25 -0.17 1.08 -1.25 0.00 0.00 0.00 175.76 175.66 3mde s PRO 189 N -0.83 3.69 0.30 0.00 0.04 -1.26 -4.82 135.00 132.11 3mde s PRO 189 Ca 0.47 1.48 0.05 0.00 0.04 0.00 0.00 61.00 63.04 3mde s PRO 189 Cb -0.30 -2.12 0.70 0.00 0.04 0.00 0.00 34.50 32.81 3mde s PRO 189 CO 0.37 -0.55 1.78 0.00 0.04 0.00 0.00 177.00 178.64 3mde h ALA 190 N 1.56 1.61 0.00 8.56 0.00 -1.97 -0.72 119.26 128.30 3mde h ALA 190 Ca -0.50 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3mde h ALA 190 Cb 1.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3mde h ALA 190 CO 0.59 -0.02 0.00 -1.13 0.00 0.00 0.00 179.25 178.68 3mde n SER 191 N -4.76 0.55 0.00 0.00 3.41 -1.26 -3.16 113.62 108.39 3mde n SER 191 Ca 0.22 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.53 3mde n SER 191 Cb 0.54 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 3mde n SER 191 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3mde n LYS 192 N -2.18 0.15 0.00 4.33 5.02 -0.40 -4.53 118.16 120.54 3mde n LYS 192 Ca 0.00 -0.18 0.12 0.00 -2.02 0.00 0.00 58.31 56.24 3mde n LYS 192 Cb 0.11 -0.63 0.23 0.00 -0.02 0.00 0.00 35.03 34.72 3mde n LYS 192 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mde n ALA 193 N -0.07 3.36 -2.51 7.82 0.00 -0.49 -4.39 120.51 124.22 3mde n ALA 193 Ca 0.00 -0.48 -0.25 0.00 0.00 0.00 0.00 53.44 52.71 3mde n ALA 193 Cb 0.12 -1.01 -0.13 0.00 0.00 0.00 0.00 19.45 18.42 3mde n ALA 193 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3mde s PHE 194 N -2.56 1.78 -0.04 0.00 0.08 -1.26 -1.10 117.98 114.89 3mde s PHE 194 Ca 0.21 -0.39 0.05 0.00 0.12 0.00 0.00 56.93 56.92 3mde s PHE 194 Cb 0.19 -1.03 -0.01 0.00 -0.57 0.00 0.00 43.02 41.60 3mde s PHE 194 CO 0.57 0.13 -0.19 0.99 -0.10 0.00 0.00 175.22 176.63 3mde s THR 195 N -0.94 1.53 -0.13 0.64 2.01 0.30 -0.11 115.64 118.93 3mde s THR 195 Ca 0.07 -0.79 -0.12 0.00 0.31 0.00 0.00 61.69 61.16 3mde s THR 195 Cb -0.09 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 3mde s THR 195 CO 0.03 0.44 0.25 -0.83 -0.69 0.00 0.00 174.62 173.82 3mde s GLY 196 N -0.12 2.22 0.07 4.40 0.00 -1.26 -1.55 107.32 111.07 3mde s GLY 196 Ca -0.01 -0.49 0.05 0.00 0.00 0.00 0.00 44.72 44.27 3mde s GLY 196 CO 0.02 0.17 -0.13 -1.36 0.00 0.00 0.00 173.10 171.79 3mde s PHE 197 N -0.11 1.16 -0.21 1.90 0.40 -0.01 -1.54 117.98 119.57 3mde s PHE 197 Ca 0.16 -0.48 -0.04 0.00 -0.60 0.00 0.00 56.93 55.97 3mde s PHE 197 Cb -0.13 -0.65 -0.02 0.00 0.51 0.00 0.00 43.02 42.73 3mde s PHE 197 CO 0.04 0.05 -0.03 -1.50 0.70 0.00 0.00 175.22 174.48 3mde s ILE 198 N -1.38 3.60 -0.10 0.64 1.10 -0.28 -0.82 121.20 123.97 3mde s ILE 198 Ca -0.02 -0.43 0.04 0.00 -0.51 0.00 0.00 60.65 59.73 3mde s ILE 198 Cb -0.09 -2.63 0.00 0.00 0.15 0.00 0.00 42.46 39.89 3mde s ILE 198 CO 0.02 0.43 -0.23 -0.69 -2.11 0.00 0.00 174.94 172.36 3mde s VAL 199 N 1.22 1.99 -0.04 4.00 1.01 0.58 -4.85 120.40 124.31 3mde s VAL 199 Ca 0.03 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.77 3mde s VAL 199 Cb -0.14 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 3mde s VAL 199 CO -0.00 0.54 0.84 -1.61 0.00 0.00 0.00 175.10 174.87 3mde s GLU 200 N 0.37 4.48 0.60 2.72 2.02 -1.26 0.16 118.70 127.78 3mde s GLU 200 Ca -0.19 1.14 0.29 0.00 0.02 0.00 0.00 54.97 56.23 3mde s GLU 200 Cb -0.18 -3.46 1.62 0.00 0.10 0.00 0.00 34.13 32.21 3mde s GLU 200 CO 0.09 -0.02 2.03 0.00 0.02 0.00 0.00 175.26 177.38 3mde h ALA 201 N 6.82 1.85 -0.14 5.21 0.00 -1.56 -1.51 119.26 129.93 3mde h ALA 201 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3mde h ALA 201 Cb 1.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3mde h ALA 201 CO 0.76 -0.42 0.00 -0.40 0.00 0.00 0.00 179.25 179.19 3mde n ASP 202 N -3.67 1.47 -4.70 0.00 5.68 -1.26 -4.84 116.55 109.23 3mde n ASP 202 Ca 0.03 -1.66 -0.42 0.00 -0.50 0.00 0.00 54.79 52.24 3mde n ASP 202 Cb 0.43 -0.09 -0.03 0.00 -1.14 0.00 0.00 41.12 40.29 3mde n ASP 202 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3mde s THR 203 N -1.82 3.42 0.15 2.12 2.01 -0.57 -4.93 115.64 116.01 3mde s THR 203 Ca 0.32 0.89 -0.34 0.00 0.31 0.00 0.00 61.69 62.87 3mde s THR 203 Cb 0.17 -3.57 -0.14 0.00 0.01 0.00 0.00 72.50 68.96 3mde s THR 203 CO 0.26 0.02 1.51 -2.65 -0.69 0.00 0.00 174.62 173.07 3mde n PRO 204 N 5.02 1.92 0.00 4.92 -0.02 -1.26 -2.19 135.00 143.39 3mde n PRO 204 Ca 0.13 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3mde n PRO 204 Cb 0.42 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3mde n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mde n GLY 205 N 3.10 2.55 3.65 -1.23 0.00 -1.26 -4.45 105.19 107.55 3mde n GLY 205 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3mde n GLY 205 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3mde s VAL 206 N -2.29 4.81 -0.43 1.61 -7.23 -0.93 -1.76 120.40 114.18 3mde s VAL 206 Ca 0.00 1.68 0.01 0.00 -1.81 0.00 0.00 61.98 61.86 3mde s VAL 206 Cb 0.00 -4.16 0.12 0.00 0.56 0.00 0.00 36.38 32.89 3mde s VAL 206 CO 0.00 -0.07 0.19 -1.10 -0.31 0.00 0.00 175.10 173.80 3mde s GLN 207 N 2.76 1.88 0.14 4.82 -0.21 0.22 -4.99 119.66 124.29 3mde s GLN 207 Ca 0.38 -2.05 -0.30 0.00 0.02 0.00 0.00 55.36 53.40 3mde s GLN 207 Cb -0.16 -3.43 -0.07 0.00 1.00 0.00 0.00 33.01 30.35 3mde s GLN 207 CO 0.08 -1.04 1.21 0.42 -2.12 0.00 0.00 175.29 173.84 3mde s ILE 208 N 0.69 3.70 0.71 1.08 1.01 -1.26 -0.96 121.20 126.16 3mde s ILE 208 Ca 0.12 1.34 -0.07 0.00 0.00 0.00 0.00 60.65 62.04 3mde s ILE 208 Cb -0.22 -3.86 0.15 0.00 0.01 0.00 0.00 42.46 38.55 3mde s ILE 208 CO -0.05 0.17 0.96 0.61 0.00 0.00 0.00 174.94 176.64 3mde n GLY 209 N 2.60 -0.38 3.74 6.18 0.00 0.45 -4.98 105.19 112.80 3mde n GLY 209 Ca 0.06 -1.86 -0.31 0.00 0.00 0.00 0.00 46.02 43.91 3mde n GLY 209 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3mde s ARG 210 N -5.02 1.84 0.10 1.61 1.70 -1.26 -4.74 118.95 113.18 3mde s ARG 210 Ca 0.59 1.22 -0.30 0.00 -0.47 0.00 0.00 55.73 56.76 3mde s ARG 210 Cb -0.02 -1.85 -0.07 0.00 -0.57 0.00 0.00 34.95 32.45 3mde s ARG 210 CO 0.40 -1.95 1.21 0.21 -1.08 0.00 0.00 175.30 174.09 3mde s LYS 211 N -4.84 4.44 -0.06 3.89 2.20 -1.26 -4.41 119.74 119.70 3mde s LYS 211 Ca 0.63 1.82 -0.19 0.00 -0.36 0.00 0.00 55.97 57.87 3mde s LYS 211 Cb -0.19 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 3mde s LYS 211 CO 0.57 -0.22 0.52 -1.21 -0.36 0.00 0.00 175.35 174.66 3mde s GLU 212 N 0.68 4.29 -0.39 4.03 0.41 -0.90 -5.05 118.70 121.77 3mde s GLU 212 Ca 0.57 0.57 -0.20 0.00 -0.41 0.00 0.00 54.97 55.50 3mde s GLU 212 Cb -0.31 -3.38 0.01 0.00 -1.78 0.00 0.00 34.13 28.67 3mde s GLU 212 CO 0.31 0.28 0.63 0.42 -0.49 0.00 0.00 175.26 176.42 3mde s ILE 213 N 0.17 4.87 0.44 -1.63 -1.09 -1.26 -4.74 121.20 117.96 3mde s ILE 213 Ca 0.28 0.41 0.06 0.00 -2.23 0.00 0.00 60.65 59.17 3mde s ILE 213 Cb -0.16 -4.12 -0.04 0.00 -1.58 0.00 0.00 42.46 36.56 3mde s ILE 213 CO 0.13 -0.41 0.17 0.20 -1.23 0.00 0.00 174.94 173.80 3mde s ASN 214 N 1.87 4.36 0.18 3.58 0.01 -1.26 -5.05 114.94 118.63 3mde s ASN 214 Ca 0.24 -1.21 -0.09 0.00 -0.71 0.00 0.00 52.86 51.09 3mde s ASN 214 Cb -0.14 -0.21 0.07 0.00 0.41 0.00 0.00 41.25 41.38 3mde s ASN 214 CO 0.16 -0.66 1.62 -0.03 -1.51 0.00 0.00 177.10 176.69 3mde h MET 215 N 1.35 1.03 -4.84 -0.60 1.85 -1.97 -3.45 114.93 108.30 3mde h MET 215 Ca -0.42 -0.36 -0.39 0.00 -0.61 0.00 0.00 59.70 57.91 3mde h MET 215 Cb 1.27 -0.08 -0.14 0.00 0.43 0.00 0.00 31.60 33.08 3mde h MET 215 CO 0.70 1.05 -0.56 0.20 -0.40 0.00 0.00 176.91 177.90 3mde s GLY 216 N -3.65 2.00 -1.57 1.39 0.00 -1.25 -4.73 107.32 99.51 3mde s GLY 216 Ca -0.11 -1.80 -0.12 0.00 0.00 0.00 0.00 44.72 42.69 3mde s GLY 216 CO 0.86 -1.54 0.75 -1.06 0.00 0.00 0.00 173.10 172.11 3mde n GLN 217 N -0.54 -3.91 0.28 2.90 6.02 -1.26 -4.82 117.38 116.05 3mde n GLN 217 Ca 0.02 0.45 0.14 0.00 -0.01 0.00 0.00 57.00 57.60 3mde n GLN 217 Cb 0.65 -5.07 0.84 0.00 1.02 0.00 0.00 30.24 27.67 3mde n GLN 217 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mde h ARG 218 N -1.76 0.00 0.00 -1.09 3.08 -1.87 -1.45 114.38 111.29 3mde h ARG 218 Ca -0.60 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.45 3mde h ARG 218 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.43 3mde h ARG 218 CO 0.70 0.04 -0.03 0.00 -1.07 0.00 0.00 179.97 179.62 3mde s SER 220 N -3.92 6.97 -0.31 0.00 0.15 -0.55 -4.08 113.70 111.95 3mde s SER 220 Ca 0.12 2.19 -0.18 0.00 0.70 0.00 0.00 55.95 58.77 3mde s SER 220 Cb 0.15 -2.61 -0.01 0.00 -1.71 0.00 0.00 66.02 61.84 3mde s SER 220 CO 0.58 -0.35 0.51 -0.62 1.20 0.00 0.00 173.24 174.56 3mde s ASP 221 N -1.19 6.36 -0.04 5.45 2.15 -1.26 -5.00 116.67 123.14 3mde s ASP 221 Ca 0.51 0.19 -0.01 0.00 0.43 0.00 0.00 52.55 53.67 3mde s ASP 221 Cb -0.28 -2.27 0.03 0.00 -0.30 0.00 0.00 42.92 40.10 3mde s ASP 221 CO 0.35 -0.40 0.06 0.28 -0.17 0.00 0.00 175.17 175.29 3mde s THR 222 N 2.36 -0.10 0.20 1.71 -1.32 -1.26 0.71 115.64 117.95 3mde s THR 222 Ca 0.20 0.34 -0.00 0.00 -1.21 0.00 0.00 61.69 61.01 3mde s THR 222 Cb -0.15 -0.13 -0.04 0.00 -1.51 0.00 0.00 72.50 70.66 3mde s THR 222 CO 0.12 0.14 0.09 -0.13 -2.21 0.00 0.00 174.62 172.63 3mde s ARG 223 N 1.73 1.18 0.10 7.08 0.52 -0.67 -2.12 118.95 126.78 3mde s ARG 223 Ca -0.01 -1.61 -0.02 0.00 -0.52 0.00 0.00 55.73 53.58 3mde s ARG 223 Cb -0.12 0.06 -0.05 0.00 0.52 0.00 0.00 34.95 35.36 3mde s ARG 223 CO -0.03 -0.30 0.28 0.20 0.02 0.00 0.00 175.30 175.46 3mde s GLY 224 N -3.18 2.16 -0.02 -3.53 0.00 -1.26 -0.27 107.32 101.22 3mde s GLY 224 Ca 0.34 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.30 3mde s GLY 224 CO 0.09 -0.71 0.02 -0.42 0.00 0.00 0.00 173.10 172.08 3mde s ILE 225 N -1.59 -0.01 -0.11 0.90 1.01 0.13 -0.41 121.20 121.13 3mde s ILE 225 Ca 0.37 0.20 -0.07 0.00 0.00 0.00 0.00 60.65 61.15 3mde s ILE 225 Cb -0.13 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.18 3mde s ILE 225 CO 0.27 0.10 0.16 -0.69 0.00 0.00 0.00 174.94 174.78 3mde s VAL 226 N 1.09 5.48 -0.32 2.92 1.01 -0.13 0.98 120.40 131.43 3mde s VAL 226 Ca -0.09 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.12 3mde s VAL 226 Cb -0.13 -3.43 0.10 0.00 0.00 0.00 0.00 36.38 32.92 3mde s VAL 226 CO -0.03 0.60 0.09 -0.36 0.00 0.00 0.00 175.10 175.40 3mde s PHE 227 N -1.05 2.34 -0.15 5.22 0.40 0.15 -0.61 117.98 124.28 3mde s PHE 227 Ca 0.16 -2.15 0.01 0.00 -0.60 0.00 0.00 56.93 54.36 3mde s PHE 227 Cb -0.12 -2.09 0.01 0.00 0.51 0.00 0.00 43.02 41.32 3mde s PHE 227 CO 0.06 -0.90 -0.19 -1.83 0.70 0.00 0.00 175.22 173.06 3mde s GLU 228 N 1.35 3.07 -1.51 0.44 -1.05 -0.73 -0.96 118.70 119.32 3mde s GLU 228 Ca 0.10 -0.82 -0.11 0.00 -0.15 0.00 0.00 54.97 54.00 3mde s GLU 228 Cb -0.18 -2.53 0.07 0.00 -0.44 0.00 0.00 34.13 31.05 3mde s GLU 228 CO -0.19 -0.05 0.85 -0.25 0.95 0.00 0.00 175.26 176.56 3mde n ASP 229 N 4.20 -3.45 -4.68 0.83 8.00 -1.09 -4.47 116.55 115.89 3mde n ASP 229 Ca -0.20 -0.85 -0.43 0.00 0.71 0.00 0.00 54.79 54.03 3mde n ASP 229 Cb 0.51 -3.66 -0.02 0.00 -0.02 0.00 0.00 41.12 37.93 3mde n ASP 229 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3mde s VAL 230 N -3.43 4.37 -0.22 2.53 1.01 -0.56 -4.78 120.40 119.32 3mde s VAL 230 Ca 0.49 1.68 -0.17 0.00 0.00 0.00 0.00 61.98 63.97 3mde s VAL 230 Cb -0.25 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 3mde s VAL 230 CO 0.85 -0.06 0.46 -0.13 0.00 0.00 0.00 175.10 176.22 3mde s ARG 231 N 2.68 4.14 -0.08 2.72 0.52 -1.26 -0.36 118.95 127.31 3mde s ARG 231 Ca 0.53 0.28 0.02 0.00 -0.52 0.00 0.00 55.73 56.04 3mde s ARG 231 Cb -0.22 -3.58 0.02 0.00 0.52 0.00 0.00 34.95 31.68 3mde s ARG 231 CO 0.18 -0.17 -0.11 0.54 0.02 0.00 0.00 175.30 175.75 3mde s VAL 232 N 1.71 1.14 0.56 3.52 0.11 -0.43 -4.98 120.40 122.03 3mde s VAL 232 Ca 0.21 -0.45 -0.20 0.00 -2.93 0.00 0.00 61.98 58.61 3mde s VAL 232 Cb -0.15 -1.06 -0.04 0.00 -1.53 0.00 0.00 36.38 33.59 3mde s VAL 232 CO 0.09 0.36 1.25 -2.16 -3.33 0.00 0.00 175.10 171.32 3mde s PRO 233 N 0.93 3.14 0.64 1.54 0.04 -1.26 -0.18 135.00 139.85 3mde s PRO 233 Ca -0.09 1.96 0.42 0.00 0.04 0.00 0.00 61.00 63.33 3mde s PRO 233 Cb -0.15 -2.11 2.19 0.00 0.04 0.00 0.00 34.50 34.47 3mde s PRO 233 CO 0.00 -1.11 2.28 1.57 0.04 0.00 0.00 177.00 179.79 3mde h LYS 234 N 1.25 0.00 0.00 4.56 5.09 -1.79 -1.51 116.57 124.17 3mde h LYS 234 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.24 3mde h LYS 234 Cb 1.29 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.62 3mde h LYS 234 CO 0.57 0.00 0.00 -0.85 -2.09 0.00 0.00 179.45 177.08 3mde n GLU 235 N -3.08 0.68 0.00 0.07 0.00 -1.26 -2.42 120.64 114.63 3mde n GLU 235 Ca -0.02 0.02 0.10 0.00 0.00 0.00 0.00 57.16 57.25 3mde n GLU 235 Cb 0.12 -1.50 0.05 0.00 0.00 0.00 0.00 31.44 30.11 3mde n GLU 235 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3mde n ASN 236 N -1.09 2.31 -4.70 -1.84 5.03 -0.57 -4.90 115.26 109.49 3mde n ASN 236 Ca 0.17 -1.65 -0.42 0.00 0.87 0.00 0.00 54.58 53.55 3mde n ASN 236 Cb 0.13 0.20 -0.03 0.00 -1.02 0.00 0.00 39.78 39.06 3mde n ASN 236 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3mde s VAL 237 N -1.89 3.71 0.01 2.41 1.01 -1.02 -1.13 120.40 123.50 3mde s VAL 237 Ca 0.20 1.17 -0.06 0.00 0.00 0.00 0.00 61.98 63.29 3mde s VAL 237 Cb 0.16 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 3mde s VAL 237 CO 0.35 0.05 0.96 -0.07 0.00 0.00 0.00 175.10 176.38 3mde h LEU 238 N 7.54 -0.17 0.00 3.92 4.07 -1.57 -3.43 115.31 125.67 3mde h LEU 238 Ca -0.40 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.49 3mde h LEU 238 Cb 1.19 0.04 -0.01 0.00 1.08 0.00 0.00 40.66 42.96 3mde h LEU 238 CO 0.87 -0.11 -1.29 0.41 -1.08 0.00 0.00 178.44 177.24 3mde n THR 239 N -2.60 0.29 0.00 0.22 -1.04 -1.20 -4.38 114.28 105.57 3mde n THR 239 Ca -0.02 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 3mde n THR 239 Cb 0.08 -0.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 3mde n THR 239 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3mde n GLY 240 N 3.20 1.46 3.67 3.41 0.00 -1.26 -5.05 105.19 110.62 3mde n GLY 240 Ca -0.09 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 3mde n GLY 240 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3mde s GLU 241 N -2.00 4.16 0.00 1.61 2.12 -1.26 -2.00 118.70 121.33 3mde s GLU 241 Ca 0.00 2.47 0.00 0.00 0.36 0.00 0.00 54.97 57.80 3mde s GLU 241 Cb 0.00 -3.87 0.00 0.00 0.26 0.00 0.00 34.13 30.52 3mde s GLU 241 CO 0.00 -0.86 0.00 0.41 -0.54 0.00 0.00 175.26 174.27 3mde n GLY 242 N 4.27 2.72 0.02 -1.50 0.00 -1.10 -4.93 105.19 104.68 3mde n GLY 242 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3mde n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mde n ALA 243 N -1.80 2.61 0.08 4.61 0.00 -0.85 -3.86 120.51 121.30 3mde n ALA 243 Ca 0.00 -0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.18 3mde n ALA 243 Cb 0.00 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.10 3mde n ALA 243 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3mde h GLY 244 N 5.38 -0.41 0.30 0.00 0.00 -0.72 -2.84 103.07 104.78 3mde h GLY 244 Ca 0.00 0.30 0.06 0.00 0.00 0.00 0.00 47.33 47.68 3mde h GLY 244 CO 0.00 -0.21 -0.17 -2.75 0.00 0.00 0.00 176.54 173.41 3mde h PHE 245 N -0.41 -0.43 -0.34 5.60 3.57 -1.75 -2.43 116.94 120.75 3mde h PHE 245 Ca 0.05 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.54 3mde h PHE 245 Cb 0.47 0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 3mde h PHE 245 CO -0.26 -0.24 0.06 -0.22 -2.23 0.00 0.00 178.31 175.41 3mde h LYS 246 N -0.17 0.50 -0.39 1.11 3.11 -1.86 -2.03 116.57 116.84 3mde h LYS 246 Ca 0.13 -0.09 -0.14 0.00 -2.81 0.00 0.00 60.65 57.74 3mde h LYS 246 Cb 0.36 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.50 3mde h LYS 246 CO -0.33 0.49 -0.32 0.82 -2.81 0.00 0.00 179.45 177.30 3mde h ILE 247 N 0.49 1.28 0.05 2.00 2.04 -1.21 -0.61 117.51 121.54 3mde h ILE 247 Ca 0.11 -1.49 -0.00 0.00 1.00 0.00 0.00 64.86 64.48 3mde h ILE 247 Cb 0.23 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 3mde h ILE 247 CO 0.00 0.50 -0.02 0.00 0.00 0.00 0.00 178.15 178.62 3mde h ALA 248 N 0.90 -0.07 -0.56 1.87 0.00 -1.08 0.03 119.26 120.35 3mde h ALA 248 Ca 0.08 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 3mde h ALA 248 Cb 0.89 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3mde h ALA 248 CO 0.08 -0.46 -0.05 0.52 0.00 0.00 0.00 179.25 179.34 3mde h MET 249 N -0.22 1.00 -0.69 0.00 2.86 -1.39 -2.33 114.93 114.15 3mde h MET 249 Ca -0.01 -0.33 0.02 0.00 -2.06 0.00 0.00 59.70 57.32 3mde h MET 249 Cb 0.19 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 3mde h MET 249 CO 0.01 1.01 0.46 0.78 1.06 0.00 0.00 176.91 180.23 3mde h GLY 250 N 0.98 0.97 0.85 8.32 0.00 -0.95 -2.75 103.07 110.48 3mde h GLY 250 Ca 0.15 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.07 3mde h GLY 250 CO 0.04 0.33 -0.08 -0.84 0.00 0.00 0.00 176.54 175.99 3mde h THR 251 N 0.90 1.29 -0.33 4.70 2.02 -0.47 -3.16 112.91 117.86 3mde h THR 251 Ca 0.26 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.35 3mde h THR 251 Cb -0.05 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3mde h THR 251 CO -0.06 0.35 0.22 -0.26 0.37 0.00 0.00 175.52 176.14 3mde h PHE 252 N 0.24 0.33 -0.63 3.16 0.04 -1.15 -2.31 116.94 116.63 3mde h PHE 252 Ca 0.06 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.75 3mde h PHE 252 Cb 0.56 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.57 3mde h PHE 252 CO 0.05 0.20 0.04 -0.44 -0.60 0.00 0.00 178.31 177.57 3mde h ASP 253 N 0.35 1.05 1.77 2.17 3.32 -1.50 0.40 116.42 123.98 3mde h ASP 253 Ca 0.13 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 3mde h ASP 253 Cb 0.10 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 3mde h ASP 253 CO -0.03 1.08 -0.08 0.11 -1.72 0.00 0.00 179.24 178.59 3mde h LYS 254 N 0.99 0.00 0.00 3.56 1.57 -1.51 -3.36 116.57 117.81 3mde h LYS 254 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3mde h LYS 254 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3mde h LYS 254 CO 0.02 0.08 -1.31 -2.37 -0.57 0.00 0.00 179.45 175.31 3mde n THR 255 N -3.13 0.00 -0.09 -0.16 5.66 -0.91 -4.43 114.28 111.22 3mde n THR 255 Ca 0.03 -0.19 -0.11 0.00 -3.05 0.00 0.00 64.05 60.73 3mde n THR 255 Cb 0.53 0.35 -0.04 0.00 -1.55 0.00 0.00 70.33 69.63 3mde n THR 255 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 175.07 171.93 3mde h ARG 256 N 0.00 0.51 -0.21 1.09 9.65 -0.35 -3.06 114.38 122.00 3mde h ARG 256 Ca 0.00 -0.17 0.06 0.00 -1.10 0.00 0.00 59.98 58.76 3mde h ARG 256 Cb 0.36 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.84 3mde h ARG 256 CO 0.00 0.68 -0.18 -1.35 2.80 0.00 0.00 179.97 181.93 3mde h PRO 257 N 0.28 -0.17 0.00 0.20 0.11 -1.77 -1.72 132.00 128.92 3mde h PRO 257 Ca 0.08 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.17 3mde h PRO 257 Cb 0.47 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 3mde h PRO 257 CO 0.02 -0.12 -0.15 -1.35 -0.21 0.00 0.00 178.00 176.20 3mde h PRO 258 N -0.18 0.00 -0.12 1.05 0.11 -1.78 -1.02 132.00 130.06 3mde h PRO 258 Ca 0.13 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.06 3mde h PRO 258 Cb 0.37 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 3mde h PRO 258 CO -0.32 0.15 -0.65 -0.24 -0.21 0.00 0.00 178.00 176.72 3mde h VAL 259 N 0.00 1.36 -0.38 3.15 3.04 -1.32 -2.25 116.25 119.85 3mde h VAL 259 Ca -0.00 -1.99 -0.01 0.00 -1.01 0.00 0.00 66.70 63.69 3mde h VAL 259 Cb 0.26 1.97 -0.02 0.00 -2.01 0.00 0.00 31.29 31.50 3mde h VAL 259 CO 0.02 0.60 0.21 0.00 -1.01 0.00 0.00 177.57 177.40 3mde h ALA 260 N 0.97 0.49 -0.03 3.17 0.00 -0.41 -2.34 119.26 121.11 3mde h ALA 260 Ca -0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3mde h ALA 260 Cb 1.21 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3mde h ALA 260 CO 0.11 0.02 -0.08 0.00 0.00 0.00 0.00 179.25 179.30 3mde h ALA 261 N 1.07 1.80 -0.03 0.00 0.00 -1.10 -0.81 119.26 120.20 3mde h ALA 261 Ca 0.14 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 3mde h ALA 261 Cb 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3mde h ALA 261 CO -0.02 0.15 -0.54 0.78 0.00 0.00 0.00 179.25 179.62 3mde h GLY 262 N 0.35 0.10 1.87 0.00 0.00 -0.90 -2.27 103.07 102.22 3mde h GLY 262 Ca 0.01 -0.11 -0.22 0.00 0.00 0.00 0.00 47.33 47.01 3mde h GLY 262 CO 0.01 0.10 -1.03 0.00 0.00 0.00 0.00 176.54 175.63 3mde h ALA 263 N 1.38 0.34 0.00 3.60 0.00 -0.67 -2.80 119.26 121.10 3mde h ALA 263 Ca -0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 3mde h ALA 263 Cb 0.98 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3mde h ALA 263 CO 0.08 1.10 -0.34 1.33 0.00 0.00 0.00 179.25 181.42 3mde n VAL 264 N -3.47 0.01 0.03 0.00 0.24 -0.78 -1.96 118.33 112.40 3mde n VAL 264 Ca -0.03 -0.01 -0.19 0.00 -2.04 0.00 0.00 64.34 62.07 3mde n VAL 264 Cb 0.93 -0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 33.18 3mde n VAL 264 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3mde h GLY 265 N 4.99 0.64 2.00 7.63 0.00 -1.26 0.21 103.07 117.28 3mde h GLY 265 Ca 0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 47.33 46.18 3mde h GLY 265 CO 0.00 1.01 -0.02 -2.00 0.00 0.00 0.00 176.54 175.53 3mde h LEU 266 N 0.16 0.00 0.13 3.11 5.85 -1.52 -1.22 115.31 121.82 3mde h LEU 266 Ca -0.11 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.30 3mde h LEU 266 Cb 1.56 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.59 3mde h LEU 266 CO 0.17 0.02 -1.48 0.00 -0.34 0.00 0.00 178.44 176.81 3mde h ALA 267 N 1.98 0.21 -0.39 1.25 0.00 -1.11 -1.41 119.26 119.79 3mde h ALA 267 Ca -0.00 -1.05 -0.07 0.00 0.00 0.00 0.00 54.91 53.78 3mde h ALA 267 Cb 0.91 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3mde h ALA 267 CO 0.00 1.08 -0.04 0.37 0.00 0.00 0.00 179.25 180.66 3mde h GLN 268 N 0.07 0.72 0.12 0.00 5.75 -0.22 -1.10 115.11 120.46 3mde h GLN 268 Ca -0.23 -0.25 -0.00 0.00 -0.15 0.00 0.00 58.65 58.02 3mde h GLN 268 Cb 2.02 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 30.51 3mde h GLN 268 CO 0.18 0.83 -0.08 -0.09 -2.65 0.00 0.00 178.83 177.02 3mde h ARG 269 N 0.54 -0.19 -0.75 1.69 9.65 -1.13 0.17 114.38 124.35 3mde h ARG 269 Ca 0.11 0.01 0.10 0.00 -1.10 0.00 0.00 59.98 59.09 3mde h ARG 269 Cb 0.53 0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 29.08 3mde h ARG 269 CO 0.03 -0.12 0.40 0.00 2.80 0.00 0.00 179.97 183.07 3mde h ALA 270 N 0.68 1.06 -0.51 2.80 0.00 -1.12 0.34 119.26 122.51 3mde h ALA 270 Ca -0.01 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3mde h ALA 270 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3mde h ALA 270 CO 0.01 0.00 -0.08 1.25 0.00 0.00 0.00 179.25 180.43 3mde h LEU 271 N 0.67 0.95 -0.12 0.00 5.85 -0.79 -1.71 115.31 120.16 3mde h LEU 271 Ca 0.37 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3mde h LEU 271 Cb 0.38 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 3mde h LEU 271 CO -0.26 1.07 0.02 0.44 -0.34 0.00 0.00 178.44 179.37 3mde h ASP 272 N 0.82 0.18 -0.08 1.25 5.19 -0.03 -1.33 116.42 122.42 3mde h ASP 272 Ca 0.13 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.30 3mde h ASP 272 Cb 0.63 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.09 3mde h ASP 272 CO 0.04 0.38 0.05 -0.33 -3.12 0.00 0.00 179.24 176.26 3mde h GLU 273 N -0.02 0.10 -0.61 3.56 4.39 -0.90 -1.05 114.58 120.05 3mde h GLU 273 Ca 0.04 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.73 3mde h GLU 273 Cb 0.27 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 3mde h GLU 273 CO 0.00 0.08 0.40 0.00 -1.16 0.00 0.00 179.01 178.33 3mde h ALA 274 N 1.02 0.77 0.13 3.43 0.00 -1.32 -1.60 119.26 121.69 3mde h ALA 274 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3mde h ALA 274 Cb -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3mde h ALA 274 CO -0.01 0.21 -0.06 1.15 0.00 0.00 0.00 179.25 180.54 3mde h THR 275 N 0.82 0.95 -0.71 0.00 2.02 -1.08 0.11 112.91 115.02 3mde h THR 275 Ca 0.22 -0.33 0.09 0.00 0.77 0.00 0.00 66.41 67.16 3mde h THR 275 Cb -0.09 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.42 3mde h THR 275 CO -0.05 0.08 0.36 0.11 0.37 0.00 0.00 175.52 176.39 3mde h LYS 276 N -0.33 0.59 -0.49 6.66 1.57 -1.10 -1.85 116.57 121.62 3mde h LYS 276 Ca -0.02 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3mde h LYS 276 Cb 0.27 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 3mde h LYS 276 CO 0.03 0.39 -0.12 -0.92 -0.57 0.00 0.00 179.45 178.27 3mde h TYR 277 N 0.61 1.02 0.00 -1.35 3.20 -1.13 -2.78 116.97 116.54 3mde h TYR 277 Ca 0.35 -0.20 0.00 0.00 3.14 0.00 0.00 58.73 62.01 3mde h TYR 277 Cb 0.36 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.37 3mde h TYR 277 CO -0.10 0.97 0.00 0.00 -1.64 0.00 0.00 178.16 177.39 3mde h ALA 278 N 1.04 1.00 -0.36 1.82 0.00 -0.18 -1.50 119.26 121.07 3mde h ALA 278 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3mde h ALA 278 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3mde h ALA 278 CO 0.05 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.58 3mde n LEU 279 N -3.00 2.83 0.00 0.00 4.32 -0.84 -1.02 117.00 119.30 3mde n LEU 279 Ca -0.00 -1.26 0.00 0.00 -0.02 0.00 0.00 56.01 54.73 3mde n LEU 279 Cb 0.24 -0.24 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3mde n LEU 279 CO 0.24 0.63 -0.36 -0.62 -1.22 0.00 0.00 177.39 176.06 3mde n GLU 280 N 1.07 0.00 -2.25 3.23 1.02 -0.86 -5.02 120.64 117.83 3mde n GLU 280 Ca 0.18 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.94 3mde n GLU 280 Cb 0.50 -0.46 -0.02 0.00 -0.02 0.00 0.00 31.44 31.44 3mde n GLU 280 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3mde s ARG 281 N -1.95 4.03 0.02 3.49 6.06 -0.62 -4.95 118.95 125.03 3mde s ARG 281 Ca 0.00 1.89 0.06 0.00 -2.50 0.00 0.00 55.73 55.18 3mde s ARG 281 Cb 0.00 -2.68 -0.02 0.00 0.06 0.00 0.00 34.95 32.31 3mde s ARG 281 CO 0.00 -0.35 -0.18 0.15 -2.50 0.00 0.00 175.30 172.42 3mde s LYS 282 N -2.29 1.29 -0.18 5.12 1.02 -1.26 -1.37 119.74 122.07 3mde s LYS 282 Ca 0.57 -0.77 -0.12 0.00 0.02 0.00 0.00 55.97 55.67 3mde s LYS 282 Cb -0.32 -1.31 0.05 0.00 -0.52 0.00 0.00 37.83 35.73 3mde s LYS 282 CO 0.40 0.34 0.45 0.95 -0.92 0.00 0.00 175.35 176.57 3mde s THR 283 N -0.65 -0.01 -1.54 2.17 -4.23 0.15 -4.89 115.64 106.64 3mde s THR 283 Ca 0.06 0.05 -0.04 0.00 -1.18 0.00 0.00 61.69 60.57 3mde s THR 283 Cb -0.08 -0.65 0.01 0.00 1.34 0.00 0.00 72.50 73.13 3mde s THR 283 CO 0.01 0.02 0.49 0.49 -0.54 0.00 0.00 174.62 175.09 3mde n PHE 284 N 3.71 -1.81 -0.33 3.99 3.72 -1.26 -1.90 117.46 123.58 3mde n PHE 284 Ca -0.19 0.43 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 3mde n PHE 284 Cb 0.56 -4.19 0.00 0.00 -0.94 0.00 0.00 39.48 34.91 3mde n PHE 284 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mde n GLY 285 N -1.39 2.25 3.39 1.37 0.00 -1.26 -5.01 105.19 104.54 3mde n GLY 285 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 3mde n GLY 285 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mde s LYS 286 N -0.03 1.44 0.24 1.61 1.02 -0.80 -5.10 119.74 118.13 3mde s LYS 286 Ca 0.00 -1.33 -0.31 0.00 0.02 0.00 0.00 55.97 54.35 3mde s LYS 286 Cb 0.00 -1.91 -0.13 0.00 -0.52 0.00 0.00 37.83 35.27 3mde s LYS 286 CO 0.00 0.46 1.47 -0.11 -0.92 0.00 0.00 175.35 176.25 3mde n LEU 287 N 0.97 3.41 -0.33 3.17 7.94 -1.26 -0.67 117.00 130.22 3mde n LEU 287 Ca -0.18 1.14 0.16 0.00 -1.11 0.00 0.00 56.01 56.02 3mde n LEU 287 Cb 0.53 -1.47 0.36 0.00 0.53 0.00 0.00 43.42 43.37 3mde n LEU 287 CO 0.23 -0.32 1.12 -0.07 -1.11 0.00 0.00 177.39 177.24 3mde h LEU 288 N 4.53 0.55 -1.94 -1.96 4.07 -0.98 0.19 115.31 119.77 3mde h LEU 288 Ca -0.45 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.65 3mde h LEU 288 Cb 1.26 0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.07 3mde h LEU 288 CO 0.78 0.06 0.00 0.00 -1.08 0.00 0.00 178.44 178.20 3mde h ALA 289 N 1.73 1.00 0.00 1.53 0.00 -1.37 -1.85 119.26 120.30 3mde h ALA 289 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 3mde h ALA 289 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3mde h ALA 289 CO -0.50 0.00 -0.46 0.39 0.00 0.00 0.00 179.25 178.68 3mde n GLU 290 N -2.70 0.27 -2.85 0.00 1.02 0.05 -4.22 120.64 112.21 3mde n GLU 290 Ca -0.01 0.11 -0.42 0.00 -0.02 0.00 0.00 57.16 56.82 3mde n GLU 290 Cb 0.12 -1.71 -0.04 0.00 -0.02 0.00 0.00 31.44 29.79 3mde n GLU 290 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3mde s HIS 291 N -3.14 3.31 0.39 -0.32 3.76 -0.70 -4.91 115.29 113.68 3mde s HIS 291 Ca 0.08 1.17 0.14 0.00 -0.15 0.00 0.00 55.06 56.30 3mde s HIS 291 Cb 0.13 -3.10 0.99 0.00 1.11 0.00 0.00 32.58 31.71 3mde s HIS 291 CO 0.69 -0.43 1.83 0.37 -0.85 0.00 0.00 174.74 176.35 3mde h GLN 292 N 7.67 0.49 -0.44 1.40 4.15 -1.87 0.10 115.11 126.62 3mde h GLN 292 Ca -0.22 -0.03 0.09 0.00 0.77 0.00 0.00 58.65 59.26 3mde h GLN 292 Cb 1.09 -0.11 -0.08 0.00 0.21 0.00 0.00 27.48 28.58 3mde h GLN 292 CO 0.89 0.33 -0.10 0.78 -1.93 0.00 0.00 178.83 178.80 3mde h GLY 293 N 0.51 0.34 1.12 2.39 0.00 -1.93 -0.62 103.07 104.88 3mde h GLY 293 Ca 0.50 0.14 -0.22 0.00 0.00 0.00 0.00 47.33 47.74 3mde h GLY 293 CO -0.23 -0.16 -0.82 -2.22 0.00 0.00 0.00 176.54 173.11 3mde h ILE 294 N 0.01 1.30 -0.89 2.60 1.08 -1.13 -2.94 117.51 117.54 3mde h ILE 294 Ca 0.21 -2.04 0.03 0.00 -0.39 0.00 0.00 64.86 62.67 3mde h ILE 294 Cb 0.33 2.17 -0.05 0.00 -3.07 0.00 0.00 36.82 36.20 3mde h ILE 294 CO -0.45 0.64 0.59 0.77 -0.69 0.00 0.00 178.15 179.01 3mde h SER 295 N 0.40 0.98 -0.59 1.72 4.64 -0.68 0.22 113.55 120.25 3mde h SER 295 Ca -0.08 -0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.15 3mde h SER 295 Cb 1.46 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 3mde h SER 295 CO 0.17 0.69 0.05 -0.26 -0.87 0.00 0.00 176.83 176.60 3mde h PHE 296 N 1.15 1.09 -0.42 4.77 -1.00 -1.16 -1.14 116.94 120.22 3mde h PHE 296 Ca 0.35 -0.17 -0.02 0.00 2.81 0.00 0.00 57.97 60.93 3mde h PHE 296 Cb -0.03 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.22 3mde h PHE 296 CO -0.00 0.95 0.17 1.25 -1.61 0.00 0.00 178.31 179.08 3mde h LEU 297 N 0.91 0.57 -0.86 1.54 5.85 -1.13 -1.61 115.31 120.58 3mde h LEU 297 Ca 0.17 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3mde h LEU 297 Cb 0.48 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 3mde h LEU 297 CO 0.02 0.58 0.51 -0.07 -0.34 0.00 0.00 178.44 179.14 3mde h LEU 298 N 0.53 1.03 -0.52 2.25 4.07 -0.80 -1.91 115.31 119.97 3mde h LEU 298 Ca 0.14 -0.07 -0.04 0.00 0.08 0.00 0.00 57.88 57.99 3mde h LEU 298 Cb 0.18 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 3mde h LEU 298 CO -0.01 0.80 0.18 0.00 -1.08 0.00 0.00 178.44 178.33 3mde h ALA 299 N 1.28 0.67 -0.44 1.53 0.00 -0.92 -1.48 119.26 119.90 3mde h ALA 299 Ca 0.31 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3mde h ALA 299 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3mde h ALA 299 CO -0.06 0.32 -0.02 -0.44 0.00 0.00 0.00 179.25 179.04 3mde h ASP 300 N 0.70 0.69 -0.02 0.00 3.32 -0.99 -1.60 116.42 118.52 3mde h ASP 300 Ca 0.17 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3mde h ASP 300 Cb 0.25 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 3mde h ASP 300 CO -0.01 0.78 0.01 0.24 -1.72 0.00 0.00 179.24 178.54 3mde h MET 301 N 0.67 0.03 -0.81 3.56 2.86 -0.97 -2.46 114.93 117.82 3mde h MET 301 Ca 0.13 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 3mde h MET 301 Cb 0.45 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.07 3mde h MET 301 CO 0.02 0.10 0.32 0.00 1.06 0.00 0.00 176.91 178.41 3mde h ALA 302 N 0.93 1.05 -0.26 6.32 0.00 -1.04 -2.38 119.26 123.88 3mde h ALA 302 Ca 0.01 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.78 3mde h ALA 302 Cb 0.08 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 3mde h ALA 302 CO -0.00 0.67 -0.09 1.98 0.00 0.00 0.00 179.25 181.81 3mde h MET 303 N 1.17 -0.04 -0.32 0.00 -1.53 -1.13 -2.26 114.93 110.81 3mde h MET 303 Ca 0.27 0.00 -0.11 0.00 -3.44 0.00 0.00 59.70 56.42 3mde h MET 303 Cb 0.22 0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.26 3mde h MET 303 CO -0.02 -0.02 -0.26 0.87 0.14 0.00 0.00 176.91 177.61 3mde h LYS 304 N -0.04 0.66 -0.30 0.39 1.57 -1.22 -1.87 116.57 115.75 3mde h LYS 304 Ca 0.13 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.60 3mde h LYS 304 Cb 0.24 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3mde h LYS 304 CO -0.29 0.86 0.05 0.28 -0.57 0.00 0.00 179.45 179.77 3mde h VAL 305 N 0.57 1.23 -0.68 0.50 2.07 -1.17 -0.47 116.25 118.30 3mde h VAL 305 Ca 0.08 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 3mde h VAL 305 Cb 0.75 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3mde h VAL 305 CO 0.06 0.27 0.23 -0.33 0.02 0.00 0.00 177.57 177.82 3mde h GLU 306 N 0.33 1.03 -0.21 1.57 4.39 -1.36 -1.49 114.58 118.84 3mde h GLU 306 Ca 0.09 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.53 3mde h GLU 306 Cb 0.35 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3mde h GLU 306 CO 0.01 0.87 -0.12 -0.07 -1.16 0.00 0.00 179.01 178.53 3mde h LEU 307 N 1.00 0.47 -0.70 1.33 4.07 -1.18 -2.45 115.31 117.85 3mde h LEU 307 Ca 0.22 -0.43 -0.11 0.00 0.08 0.00 0.00 57.88 57.65 3mde h LEU 307 Cb 0.25 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 3mde h LEU 307 CO -0.01 0.79 -0.14 0.00 -1.08 0.00 0.00 178.44 178.00 3mde h ALA 308 N 0.69 0.89 -0.47 1.53 0.00 -0.97 -2.17 119.26 118.77 3mde h ALA 308 Ca 0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3mde h ALA 308 Cb 0.63 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3mde h ALA 308 CO 0.03 0.63 0.24 -0.09 0.00 0.00 0.00 179.25 180.06 3mde h ARG 309 N 0.77 0.67 -0.93 0.00 2.43 -1.28 -2.62 114.38 113.42 3mde h ARG 309 Ca 0.12 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3mde h ARG 309 Cb 0.65 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.03 3mde h ARG 309 CO 0.05 0.56 0.56 1.25 -1.51 0.00 0.00 179.97 180.87 3mde h LEU 310 N 0.62 1.13 -0.46 3.80 5.85 -1.23 -2.33 115.31 122.69 3mde h LEU 310 Ca 0.16 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.73 3mde h LEU 310 Cb 0.10 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3mde h LEU 310 CO -0.02 0.87 -0.05 0.77 -0.34 0.00 0.00 178.44 179.67 3mde h SER 311 N 1.29 0.84 0.33 1.25 4.64 -1.05 -1.96 113.55 118.89 3mde h SER 311 Ca 0.33 -0.33 -0.13 0.00 -0.47 0.00 0.00 61.79 61.20 3mde h SER 311 Cb -0.05 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 3mde h SER 311 CO -0.06 0.97 -0.52 0.10 -0.87 0.00 0.00 176.83 176.45 3mde h TYR 312 N 0.69 0.26 -0.33 4.77 -0.00 -1.37 -2.35 116.97 118.64 3mde h TYR 312 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 58.73 58.76 3mde h TYR 312 Cb 0.57 -0.05 -0.02 0.00 0.00 0.00 0.00 36.73 37.23 3mde h TYR 312 CO 0.04 0.69 0.18 1.96 -0.00 0.00 0.00 178.16 181.03 3mde h GLN 313 N 0.17 0.46 -0.19 0.10 4.20 -1.16 -0.34 115.11 118.34 3mde h GLN 313 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3mde h GLN 313 Cb 0.97 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.65 3mde h GLN 313 CO 0.08 0.39 0.12 -0.09 -0.67 0.00 0.00 178.83 178.66 3mde h ARG 314 N 0.41 0.25 -0.54 1.46 9.65 -1.25 -0.76 114.38 123.60 3mde h ARG 314 Ca 0.12 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.92 3mde h ARG 314 Cb 0.07 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 3mde h ARG 314 CO -0.02 0.16 0.08 0.00 2.80 0.00 0.00 179.97 183.00 3mde h ALA 315 N 1.07 1.13 -0.09 2.80 0.00 -1.24 -2.24 119.26 120.69 3mde h ALA 315 Ca 0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3mde h ALA 315 Cb -0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3mde h ALA 315 CO -0.01 0.57 -0.11 0.00 0.00 0.00 0.00 179.25 179.69 3mde h ALA 316 N 1.27 0.13 -0.79 0.00 0.00 -0.85 -3.05 119.26 115.96 3mde h ALA 316 Ca 0.17 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.83 3mde h ALA 316 Cb 0.37 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3mde h ALA 316 CO 0.01 -0.01 0.48 2.35 0.00 0.00 0.00 179.25 182.07 3mde h TRP 317 N -0.21 0.88 0.32 0.00 7.01 -1.07 -1.51 115.95 121.36 3mde h TRP 317 Ca 0.01 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 3mde h TRP 317 Cb 0.66 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.42 3mde h TRP 317 CO 0.10 0.43 -0.33 1.49 -2.79 0.00 0.00 178.44 177.34 3mde h GLU 318 N 0.87 -0.66 -0.26 2.65 4.57 -1.42 -0.28 114.58 120.05 3mde h GLU 318 Ca 0.35 0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.50 3mde h GLU 318 Cb 0.19 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3mde h GLU 318 CO -0.18 -0.44 -0.17 0.97 -1.18 0.00 0.00 179.01 178.01 3mde h ILE 319 N -0.68 1.24 0.00 2.32 6.09 -1.41 -2.00 117.51 123.06 3mde h ILE 319 Ca -0.02 -1.08 -0.06 0.00 -1.37 0.00 0.00 64.86 62.33 3mde h ILE 319 Cb 0.63 1.23 -0.01 0.00 0.47 0.00 0.00 36.82 39.14 3mde h ILE 319 CO -0.07 0.35 -0.30 0.44 -3.07 0.00 0.00 178.15 175.50 3mde h ASP 320 N 0.41 0.00 0.49 2.19 3.32 -0.97 -2.01 116.42 119.85 3mde h ASP 320 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3mde h ASP 320 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 3mde h ASP 320 CO 0.03 0.30 0.00 -1.20 -1.72 0.00 0.00 179.24 176.66 3mde n SER 321 N -3.77 0.00 0.00 6.45 7.64 -0.14 -4.89 113.62 118.90 3mde n SER 321 Ca -0.01 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.76 3mde n SER 321 Cb 0.39 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 3mde n SER 321 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mde n GLY 322 N 0.96 0.77 3.73 0.23 0.00 -0.75 -5.08 105.19 105.05 3mde n GLY 322 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3mde n GLY 322 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mde s ARG 323 N -0.69 2.71 0.04 1.61 0.52 -1.07 -5.03 118.95 117.05 3mde s ARG 323 Ca 0.00 -0.78 -0.30 0.00 -0.52 0.00 0.00 55.73 54.12 3mde s ARG 323 Cb 0.00 -2.62 -0.08 0.00 0.52 0.00 0.00 34.95 32.77 3mde s ARG 323 CO 0.00 0.55 1.66 0.50 0.02 0.00 0.00 175.30 178.03 3mde s ARG 324 N -2.41 4.19 -0.19 3.54 3.52 -1.26 -3.52 118.95 122.82 3mde s ARG 324 Ca 0.28 2.31 0.16 0.00 -0.13 0.00 0.00 55.73 58.34 3mde s ARG 324 Cb -0.12 -3.69 0.50 0.00 -1.56 0.00 0.00 34.95 30.08 3mde s ARG 324 CO 0.20 -0.76 1.40 0.27 -0.81 0.00 0.00 175.30 175.60 3mde n ASN 325 N 5.95 3.46 -0.25 -2.12 6.94 -1.26 -4.83 115.26 123.15 3mde n ASN 325 Ca 0.16 -3.17 -0.00 0.00 -0.02 0.00 0.00 54.58 51.55 3mde n ASN 325 Cb 0.41 -0.55 0.06 0.00 -2.36 0.00 0.00 39.78 37.34 3mde n ASN 325 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 3mde h THR 326 N 1.44 0.20 -0.20 5.53 2.02 -1.91 0.16 112.91 120.17 3mde h THR 326 Ca 0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.24 3mde h THR 326 Cb 1.44 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 3mde h THR 326 CO 0.23 0.00 0.07 0.22 0.37 0.00 0.00 175.52 176.41 3mde h TYR 327 N -0.05 0.13 -0.06 3.16 3.20 -1.91 -2.01 116.97 119.44 3mde h TYR 327 Ca 0.33 0.01 -0.19 0.00 3.14 0.00 0.00 58.73 62.01 3mde h TYR 327 Cb 0.56 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.79 3mde h TYR 327 CO -0.63 0.06 -0.78 1.88 -1.64 0.00 0.00 178.16 177.05 3mde h TYR 328 N 0.17 0.56 -0.38 -3.82 0.05 -1.70 -2.78 116.97 109.06 3mde h TYR 328 Ca 0.08 -0.26 -0.03 0.00 0.05 0.00 0.00 58.73 58.57 3mde h TYR 328 Cb 0.05 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.69 3mde h TYR 328 CO -0.11 1.03 0.12 0.00 -1.05 0.00 0.00 178.16 178.15 3mde h ALA 329 N 0.89 0.49 -0.05 3.88 0.00 -0.64 -1.97 119.26 121.86 3mde h ALA 329 Ca -0.04 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 3mde h ALA 329 Cb 1.37 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3mde h ALA 329 CO 0.13 0.13 -0.57 0.77 0.00 0.00 0.00 179.25 179.71 3mde h SER 330 N 0.46 0.18 -0.30 0.00 0.02 -1.43 -0.69 113.55 111.79 3mde h SER 330 Ca 0.12 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3mde h SER 330 Cb 0.25 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3mde h SER 330 CO -0.00 0.71 0.01 0.40 -1.14 0.00 0.00 176.83 176.81 3mde h ILE 331 N 0.12 1.25 -0.36 3.27 2.04 -1.36 -1.58 117.51 120.90 3mde h ILE 331 Ca -0.00 -0.90 -0.06 0.00 1.00 0.00 0.00 64.86 64.89 3mde h ILE 331 Cb 1.04 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 3mde h ILE 331 CO 0.08 0.29 -0.02 0.00 0.00 0.00 0.00 178.15 178.51 3mde h ALA 332 N 0.85 0.48 -0.23 1.87 0.00 -1.21 -0.41 119.26 120.61 3mde h ALA 332 Ca 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3mde h ALA 332 Cb 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3mde h ALA 332 CO 0.01 0.27 0.10 -0.22 0.00 0.00 0.00 179.25 179.41 3mde h LYS 333 N 0.45 0.33 -0.32 0.00 3.11 -1.11 -0.91 116.57 118.12 3mde h LYS 333 Ca 0.10 -0.06 -0.04 0.00 -2.81 0.00 0.00 60.65 57.84 3mde h LYS 333 Cb 0.49 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 3mde h LYS 333 CO 0.02 0.37 0.05 0.00 -2.81 0.00 0.00 179.45 177.08 3mde h ALA 334 N 0.95 0.42 -0.05 5.00 0.00 -1.27 -2.42 119.26 121.89 3mde h ALA 334 Ca 0.08 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3mde h ALA 334 Cb 0.16 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.83 3mde h ALA 334 CO -0.01 0.12 -0.48 -0.92 0.00 0.00 0.00 179.25 177.96 3mde h TYR 335 N 0.35 0.58 -0.47 0.00 3.20 -1.06 -2.92 116.97 116.66 3mde h TYR 335 Ca 0.10 -0.28 0.01 0.00 3.14 0.00 0.00 58.73 61.69 3mde h TYR 335 Cb 0.35 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 3mde h TYR 335 CO 0.02 1.07 0.31 0.00 -1.64 0.00 0.00 178.16 177.91 3mde h ALA 336 N 0.39 0.59 -0.40 1.82 0.00 -1.24 -2.24 119.26 118.19 3mde h ALA 336 Ca -0.05 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3mde h ALA 336 Cb 1.16 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 3mde h ALA 336 CO 0.10 0.03 0.05 0.00 0.00 0.00 0.00 179.25 179.43 3mde h ALA 337 N 1.18 0.41 0.07 0.00 0.00 -1.50 -0.73 119.26 118.68 3mde h ALA 337 Ca 0.17 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3mde h ALA 337 Cb -0.06 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3mde h ALA 337 CO -0.04 -0.35 -0.03 -0.44 0.00 0.00 0.00 179.25 178.38 3mde h ASP 338 N 0.17 -0.08 0.87 0.00 3.32 -1.32 -2.96 116.42 116.40 3mde h ASP 338 Ca 0.19 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 3mde h ASP 338 Cb 0.25 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3mde h ASP 338 CO -0.28 0.11 -0.20 0.16 -1.72 0.00 0.00 179.24 177.31 3mde h ILE 339 N -0.27 0.52 -0.61 0.35 -0.00 -1.25 -1.67 117.51 114.58 3mde h ILE 339 Ca -0.01 -1.02 -0.10 0.00 -0.00 0.00 0.00 64.86 63.74 3mde h ILE 339 Cb 0.23 1.70 -0.02 0.00 -0.00 0.00 0.00 36.82 38.73 3mde h ILE 339 CO 0.02 0.20 0.01 0.00 -0.00 0.00 0.00 178.15 178.37 3mde h ALA 340 N 1.80 0.86 -0.13 0.16 0.00 -1.08 -0.31 119.26 120.56 3mde h ALA 340 Ca -0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 3mde h ALA 340 Cb 0.69 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3mde h ALA 340 CO 0.03 0.67 -0.54 -0.91 0.00 0.00 0.00 179.25 178.50 3mde h ASN 341 N 0.97 0.41 -0.16 0.00 4.21 -1.25 -1.64 115.58 118.13 3mde h ASN 341 Ca 0.17 -0.22 -0.16 0.00 1.21 0.00 0.00 56.30 57.30 3mde h ASN 341 Cb 0.55 -0.12 0.01 0.00 -1.12 0.00 0.00 38.32 37.64 3mde h ASN 341 CO 0.03 0.87 -0.54 1.56 -1.29 0.00 0.00 177.43 178.07 3mde h GLN 342 N 0.29 0.64 -0.47 0.81 4.20 -1.00 -3.11 115.11 116.47 3mde h GLN 342 Ca 0.01 -0.48 -0.12 0.00 0.06 0.00 0.00 58.65 58.12 3mde h GLN 342 Cb 1.04 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.89 3mde h GLN 342 CO 0.09 1.10 -0.16 -0.07 -0.67 0.00 0.00 178.83 179.12 3mde h LEU 343 N 0.31 0.96 -0.52 1.46 4.07 -1.05 -2.00 115.31 118.54 3mde h LEU 343 Ca -0.02 -0.38 0.05 0.00 0.08 0.00 0.00 57.88 57.61 3mde h LEU 343 Cb 1.16 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 42.59 3mde h LEU 343 CO 0.11 1.12 0.26 0.00 -1.08 0.00 0.00 178.44 178.85 3mde h ALA 344 N 0.87 0.67 -0.05 1.53 0.00 -1.35 0.15 119.26 121.09 3mde h ALA 344 Ca 0.11 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 3mde h ALA 344 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3mde h ALA 344 CO 0.06 -0.09 -0.77 0.00 0.00 0.00 0.00 179.25 178.44 3mde h THR 345 N 0.51 1.40 -0.01 0.00 1.03 -1.52 -2.61 112.91 111.72 3mde h THR 345 Ca 0.23 -2.25 -0.13 0.00 -0.01 0.00 0.00 66.41 64.25 3mde h THR 345 Cb 0.15 2.21 -0.02 0.00 -1.07 0.00 0.00 68.15 69.42 3mde h THR 345 CO -0.17 0.67 -0.59 0.44 -0.01 0.00 0.00 175.52 175.86 3mde h ASP 346 N 0.23 0.02 -0.32 0.00 3.32 -1.02 -2.45 116.42 116.20 3mde h ASP 346 Ca -0.04 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.86 3mde h ASP 346 Cb 1.36 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 3mde h ASP 346 CO 0.13 0.61 -0.32 0.00 -1.72 0.00 0.00 179.24 177.93 3mde h ALA 347 N 1.39 0.47 0.00 3.45 0.00 -0.62 -2.13 119.26 121.83 3mde h ALA 347 Ca -0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 3mde h ALA 347 Cb 1.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3mde h ALA 347 CO 0.08 0.52 -0.07 0.28 0.00 0.00 0.00 179.25 180.06 3mde h VAL 348 N 0.56 0.75 0.06 0.00 2.07 -1.35 -2.92 116.25 115.41 3mde h VAL 348 Ca 0.05 -0.26 -0.15 0.00 0.82 0.00 0.00 66.70 67.16 3mde h VAL 348 Cb 0.90 1.15 0.01 0.00 -1.52 0.00 0.00 31.29 31.84 3mde h VAL 348 CO 0.08 0.07 -0.62 -0.61 0.02 0.00 0.00 177.57 176.51 3mde h GLN 349 N 0.00 0.32 0.00 1.57 5.75 -0.91 -2.91 115.11 118.93 3mde h GLN 349 Ca -0.00 -0.42 0.00 0.00 -0.15 0.00 0.00 58.65 58.08 3mde h GLN 349 Cb 0.15 0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.84 3mde h GLN 349 CO 0.01 1.13 0.00 -0.39 -2.65 0.00 0.00 178.83 176.93 3mde h VAL 350 N -0.29 0.00 0.00 2.39 -1.51 -1.35 -2.04 116.25 113.44 3mde h VAL 350 Ca -0.09 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 3mde h VAL 350 Cb 1.40 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 3mde h VAL 350 CO 0.12 0.00 0.00 -0.26 -1.23 0.00 0.00 177.57 176.20 3mde h PHE 351 N 0.00 0.00 0.00 5.19 -1.00 -1.38 -3.47 116.94 116.28 3mde h PHE 351 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3mde h PHE 351 Cb 0.56 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.12 3mde h PHE 351 CO 0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 3mde n GLY 352 N 1.14 2.40 0.37 -1.45 0.00 -0.77 -3.04 105.19 103.84 3mde n GLY 352 Ca 0.05 -0.49 0.10 0.00 0.00 0.00 0.00 46.02 45.69 3mde n GLY 352 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3mde h GLY 353 N 0.00 1.27 2.00 -0.02 0.00 -1.90 -1.27 103.07 103.15 3mde h GLY 353 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 3mde h GLY 353 CO 0.00 0.13 -0.18 3.43 0.00 0.00 0.00 176.54 179.92 3mde h ASN 354 N 0.77 0.00 0.77 0.19 -0.26 -1.90 -2.79 115.58 112.37 3mde h ASN 354 Ca 0.44 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 56.13 3mde h ASN 354 Cb 0.61 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 3mde h ASN 354 CO -0.20 0.18 -0.25 1.23 -1.06 0.00 0.00 177.43 177.32 3mde h GLY 355 N 1.32 0.00 1.40 2.83 0.00 -1.28 -2.40 103.07 104.93 3mde h GLY 355 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3mde h GLY 355 CO 0.02 0.00 -0.42 0.33 0.00 0.00 0.00 176.54 176.48 3mde n PHE 356 N -3.51 0.53 -3.35 5.60 7.35 -1.05 -3.64 117.46 119.39 3mde n PHE 356 Ca -0.00 0.16 -0.35 0.00 -0.76 0.00 0.00 57.45 56.49 3mde n PHE 356 Cb 0.42 -0.66 -0.06 0.00 0.35 0.00 0.00 39.48 39.53 3mde n PHE 356 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3mde s ASN 357 N -4.05 6.84 0.21 -2.13 3.84 -0.90 -4.97 114.94 113.77 3mde s ASN 357 Ca 0.08 1.09 0.21 0.00 0.21 0.00 0.00 52.86 54.46 3mde s ASN 357 Cb 0.14 -2.29 0.91 0.00 -0.55 0.00 0.00 41.25 39.46 3mde s ASN 357 CO 0.67 0.11 1.65 0.41 -2.79 0.00 0.00 177.10 177.15 3mde n THR 358 N 0.85 0.90 0.86 -5.21 -1.04 -1.26 -2.67 114.28 106.71 3mde n THR 358 Ca -0.06 0.28 0.12 0.00 -2.04 0.00 0.00 64.05 62.35 3mde n THR 358 Cb 0.52 -1.18 0.30 0.00 -1.82 0.00 0.00 70.33 68.15 3mde n THR 358 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3mde n GLU 359 N -2.10 0.09 -4.03 -2.82 -0.58 -1.26 -4.80 120.64 105.15 3mde n GLU 359 Ca 0.02 0.03 -0.30 0.00 -0.42 0.00 0.00 57.16 56.50 3mde n GLU 359 Cb 0.20 -1.57 -0.06 0.00 -0.57 0.00 0.00 31.44 29.45 3mde n GLU 359 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 3mde s TYR 360 N -3.05 3.25 -1.18 -0.32 1.51 -1.09 -5.05 117.35 111.42 3mde s TYR 360 Ca 0.10 0.09 0.28 0.00 -1.01 0.00 0.00 57.07 56.53 3mde s TYR 360 Cb 0.16 -1.62 1.27 0.00 -0.11 0.00 0.00 41.96 41.66 3mde s TYR 360 CO 0.67 0.53 1.91 -0.35 -1.11 0.00 0.00 175.55 177.21 3mde n PRO 361 N 0.23 0.16 0.12 -1.71 -0.04 -1.26 -4.19 135.00 128.30 3mde n PRO 361 Ca -0.08 0.03 0.06 0.00 -0.04 0.00 0.00 63.50 63.47 3mde n PRO 361 Cb 0.52 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 3mde n PRO 361 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3mde h VAL 362 N 0.00 0.34 0.00 0.52 -1.51 -1.89 -3.35 116.25 110.37 3mde h VAL 362 Ca 0.00 -1.56 -0.04 0.00 -1.23 0.00 0.00 66.70 63.87 3mde h VAL 362 Cb 0.39 1.97 -0.01 0.00 -2.13 0.00 0.00 31.29 31.51 3mde h VAL 362 CO 0.00 0.20 -0.18 1.05 -1.23 0.00 0.00 177.57 177.40 3mde h GLU 363 N 0.00 0.00 -0.50 5.19 -0.00 -1.73 -2.39 114.58 115.15 3mde h GLU 363 Ca -0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 59.36 59.27 3mde h GLU 363 Cb 1.25 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.98 3mde h GLU 363 CO 0.03 0.18 0.14 -0.22 -0.00 0.00 0.00 179.01 179.14 3mde h LYS 364 N 0.00 0.80 -0.89 1.06 3.64 -1.85 -2.09 116.57 117.24 3mde h LYS 364 Ca -0.00 -0.18 0.07 0.00 -1.27 0.00 0.00 60.65 59.27 3mde h LYS 364 Cb 0.79 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.44 3mde h LYS 364 CO 0.02 0.76 0.55 -0.07 -2.27 0.00 0.00 179.45 178.44 3mde h LEU 365 N 0.69 0.85 -0.47 5.20 4.07 -1.57 0.17 115.31 124.25 3mde h LEU 365 Ca 0.16 0.02 -0.06 0.00 0.08 0.00 0.00 57.88 58.08 3mde h LEU 365 Cb 0.31 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 3mde h LEU 365 CO -0.00 0.53 0.06 -0.03 -1.08 0.00 0.00 178.44 177.92 3mde h MET 366 N 0.98 0.79 -0.37 1.13 4.05 -0.97 0.19 114.93 120.73 3mde h MET 366 Ca 0.40 -0.22 -0.16 0.00 -0.28 0.00 0.00 59.70 59.43 3mde h MET 366 Cb 0.22 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.93 3mde h MET 366 CO -0.19 0.81 -0.41 0.00 0.23 0.00 0.00 176.91 177.35 3mde h ARG 367 N 0.65 0.91 0.07 0.39 3.08 -0.72 -3.23 114.38 115.53 3mde h ARG 367 Ca 0.14 -0.49 -0.00 0.00 0.07 0.00 0.00 59.98 59.70 3mde h ARG 367 Cb 0.42 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3mde h ARG 367 CO 0.01 1.14 -0.03 -0.44 -1.07 0.00 0.00 179.97 179.58 3mde h ASP 368 N 0.74 -0.08 -0.87 7.04 3.32 -0.62 -3.30 116.42 122.64 3mde h ASP 368 Ca 0.05 -0.18 0.14 0.00 0.02 0.00 0.00 57.03 57.07 3mde h ASP 368 Cb 1.00 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 40.50 3mde h ASP 368 CO 0.10 0.14 0.56 0.00 -1.72 0.00 0.00 179.24 178.32 3mde h ALA 369 N 0.61 1.88 -0.93 3.45 0.00 -0.97 -3.16 119.26 120.14 3mde h ALA 369 Ca -0.01 0.01 0.20 0.00 0.00 0.00 0.00 54.91 55.11 3mde h ALA 369 Cb 0.26 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 3mde h ALA 369 CO 0.02 -0.11 0.60 -0.22 0.00 0.00 0.00 179.25 179.54 3mde h LYS 370 N 0.65 0.49 -0.06 0.00 1.63 -1.64 -2.29 116.57 115.35 3mde h LYS 370 Ca 0.44 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 60.19 3mde h LYS 370 Cb 0.74 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.26 3mde h LYS 370 CO -0.19 0.32 -0.03 0.97 -3.45 0.00 0.00 179.45 177.07 3mde h ILE 371 N 0.50 1.06 -0.05 2.00 6.09 -1.79 -2.71 117.51 122.62 3mde h ILE 371 Ca 0.50 -0.25 0.01 0.00 -1.37 0.00 0.00 64.86 63.75 3mde h ILE 371 Cb 1.10 1.05 -0.00 0.00 0.47 0.00 0.00 36.82 39.44 3mde h ILE 371 CO -0.22 0.08 0.05 1.88 -3.07 0.00 0.00 178.15 176.87 3mde h TYR 372 N 0.08 0.00 -0.01 2.19 0.05 -1.63 0.23 116.97 117.88 3mde h TYR 372 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3mde h TYR 372 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 3mde h TYR 372 CO 0.00 0.00 -0.01 1.04 -1.05 0.00 0.00 178.16 178.14 3mde n GLN 373 N -3.82 1.52 0.04 4.88 6.02 -1.02 -4.54 117.38 120.45 3mde n GLN 373 Ca -0.02 -0.78 -0.00 0.00 -0.01 0.00 0.00 57.00 56.18 3mde n GLN 373 Cb 0.15 -1.48 -0.00 0.00 1.02 0.00 0.00 30.24 29.92 3mde n GLN 373 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 3mde n ILE 374 N -0.05 1.02 -2.55 5.09 5.41 0.70 -1.73 119.36 127.24 3mde n ILE 374 Ca 0.20 0.32 -0.33 0.00 1.00 0.00 0.00 62.75 63.95 3mde n ILE 374 Cb 0.31 -1.59 -0.05 0.00 -0.71 0.00 0.00 39.64 37.60 3mde n ILE 374 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3mde s TYR 375 N -2.02 3.38 -0.90 1.39 -0.85 -0.46 -2.58 117.35 115.30 3mde s TYR 375 Ca -0.01 1.52 -0.02 0.00 -0.52 0.00 0.00 57.07 58.05 3mde s TYR 375 Cb 0.00 -2.83 0.00 0.00 0.38 0.00 0.00 41.96 39.52 3mde s TYR 375 CO 0.01 -0.30 0.23 0.39 -1.52 0.00 0.00 175.55 174.36 3mde n GLU 376 N -1.22 -2.14 -0.32 -3.49 -0.58 -1.26 -4.57 120.64 107.05 3mde n GLU 376 Ca 0.07 0.52 0.00 0.00 -0.42 0.00 0.00 57.16 57.33 3mde n GLU 376 Cb 0.54 -4.57 0.00 0.00 -0.57 0.00 0.00 31.44 26.84 3mde n GLU 376 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mde n GLY 377 N -1.12 -0.40 3.46 0.62 0.00 -1.25 -4.99 105.19 101.51 3mde n GLY 377 Ca -0.09 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 3mde n GLY 377 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3mde n THR 378 N 1.15 1.80 -0.34 2.61 -1.04 -1.07 -4.65 114.28 112.74 3mde n THR 378 Ca 0.00 -0.50 0.17 0.00 -2.04 0.00 0.00 64.05 61.68 3mde n THR 378 Cb 0.00 -0.56 0.39 0.00 -1.82 0.00 0.00 70.33 68.33 3mde n THR 378 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mde h ALA 379 N 0.92 1.82 -0.16 2.41 0.00 -1.63 -0.90 119.26 121.72 3mde h ALA 379 Ca -0.40 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.56 3mde h ALA 379 Cb 1.39 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3mde h ALA 379 CO 0.53 -0.26 -0.11 1.96 0.00 0.00 0.00 179.25 181.37 3mde h GLN 380 N 0.61 0.35 -0.03 0.00 7.50 -1.90 -2.90 115.11 118.74 3mde h GLN 380 Ca 0.62 -0.17 -0.01 0.00 0.50 0.00 0.00 58.65 59.59 3mde h GLN 380 Cb 1.17 -0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.69 3mde h GLN 380 CO -0.42 0.69 -0.01 0.82 -1.50 0.00 0.00 178.83 178.41 3mde h ILE 381 N 0.01 1.04 -0.27 2.54 5.03 -1.71 -1.52 117.51 122.62 3mde h ILE 381 Ca 0.03 -0.14 -0.13 0.00 -0.12 0.00 0.00 64.86 64.50 3mde h ILE 381 Cb 0.61 1.03 -0.01 0.00 -3.03 0.00 0.00 36.82 35.41 3mde h ILE 381 CO 0.03 0.04 -0.37 1.56 -0.68 0.00 0.00 178.15 178.73 3mde h GLN 382 N 0.05 0.61 -0.29 2.37 1.08 -1.00 -2.64 115.11 115.28 3mde h GLN 382 Ca 0.01 -0.30 -0.12 0.00 -1.45 0.00 0.00 58.65 56.79 3mde h GLN 382 Cb 0.06 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 3mde h GLN 382 CO 0.00 0.88 -0.33 0.00 -0.95 0.00 0.00 178.83 178.43 3mde h ARG 383 N 0.51 0.62 -0.30 1.46 2.47 -1.10 -1.51 114.38 116.52 3mde h ARG 383 Ca 0.05 -0.29 0.01 0.00 -1.26 0.00 0.00 59.98 58.49 3mde h ARG 383 Cb 0.87 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.17 3mde h ARG 383 CO 0.08 0.87 0.19 0.82 0.56 0.00 0.00 179.97 182.49 3mde h ILE 384 N 0.53 1.06 -0.12 2.04 2.04 -1.17 -1.03 117.51 120.86 3mde h ILE 384 Ca 0.06 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 3mde h ILE 384 Cb 0.83 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3mde h ILE 384 CO 0.07 0.07 0.03 0.40 0.00 0.00 0.00 178.15 178.72 3mde h ILE 385 N 0.39 1.20 -0.37 -0.67 2.04 -1.37 -1.59 117.51 117.14 3mde h ILE 385 Ca 0.11 -0.61 0.02 0.00 1.00 0.00 0.00 64.86 65.38 3mde h ILE 385 Cb -0.03 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 3mde h ILE 385 CO -0.03 0.18 0.21 0.40 0.00 0.00 0.00 178.15 178.90 3mde h ILE 386 N -0.00 1.02 -0.08 -0.67 2.04 -1.18 0.53 117.51 119.17 3mde h ILE 386 Ca 0.04 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.77 3mde h ILE 386 Cb 0.25 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 3mde h ILE 386 CO 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 178.15 178.21 3mde h ALA 387 N 1.17 0.06 -0.26 1.87 0.00 -1.13 0.73 119.26 121.70 3mde h ALA 387 Ca 0.15 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3mde h ALA 387 Cb 0.02 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3mde h ALA 387 CO -0.08 -0.48 0.15 -0.09 0.00 0.00 0.00 179.25 178.74 3mde h ARG 388 N 0.01 0.30 -0.35 0.00 2.43 -1.03 0.17 114.38 115.91 3mde h ARG 388 Ca 0.04 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 3mde h ARG 388 Cb 0.05 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3mde h ARG 388 CO -0.08 0.20 -0.04 0.93 -1.51 0.00 0.00 179.97 179.47 3mde h GLU 389 N 0.31 0.65 0.84 0.20 4.39 -0.64 -2.60 114.58 117.72 3mde h GLU 389 Ca 0.10 -0.23 -0.04 0.00 0.34 0.00 0.00 59.36 59.53 3mde h GLU 389 Cb -0.00 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.61 3mde h GLU 389 CO -0.05 0.79 -0.42 1.25 -1.16 0.00 0.00 179.01 179.42 3mde h HIS 390 N 0.44 -1.09 -0.84 4.33 2.76 0.73 -3.18 115.15 118.31 3mde h HIS 390 Ca 0.09 -0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.37 3mde h HIS 390 Cb 0.53 0.36 -0.06 0.00 1.55 0.00 0.00 27.41 29.79 3mde h HIS 390 CO 0.04 -0.67 0.55 0.82 -1.30 0.00 0.00 177.93 177.37 3mde h ILE 391 N -1.15 0.86 0.00 6.26 2.04 -0.70 -2.02 117.51 122.80 3mde h ILE 391 Ca -0.11 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.52 3mde h ILE 391 Cb 0.89 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3mde h ILE 391 CO 0.18 0.12 0.00 0.61 0.00 0.00 0.00 178.15 179.06 3mde n GLY 392 N -1.45 -0.57 0.44 5.37 0.00 -0.98 -1.59 105.19 106.41 3mde n GLY 392 Ca 0.16 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.29 3mde n GLY 392 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mde n ARG 393 N -1.46 1.22 -0.01 1.61 1.74 -0.76 -4.09 116.66 114.90 3mde n ARG 393 Ca 0.01 -0.89 -0.01 0.00 -0.77 0.00 0.00 57.85 56.19 3mde n ARG 393 Cb 0.04 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 29.97 3mde n ARG 393 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3mde n TYR 394 N -0.11 0.00 1.18 -1.55 4.02 -0.63 -5.18 117.16 114.90 3mde n TYR 394 Ca 0.12 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 58.14 3mde n TYR 394 Cb 0.42 -0.14 0.25 0.00 -0.02 0.00 0.00 39.34 39.86 3mde n TYR 394 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02