#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aby s LEU 2 N 0.00 4.27 0.50 -0.89 1.43 -1.26 -5.05 118.68 117.68 1aby s LEU 2 Ca 0.00 1.46 -0.07 0.00 -1.03 0.00 0.00 54.13 54.49 1aby s LEU 2 Cb 0.00 -3.45 -0.04 0.00 0.03 0.00 0.00 46.19 42.73 1aby s LEU 2 CO 0.00 -0.35 0.83 -0.94 0.23 0.00 0.00 176.35 176.11 1aby s SER 3 N 1.05 6.28 0.25 2.29 1.04 -1.26 -4.86 113.70 118.49 1aby s SER 3 Ca 0.46 1.03 -0.04 0.00 0.48 0.00 0.00 55.95 57.89 1aby s SER 3 Cb -0.19 -2.29 0.45 0.00 0.10 0.00 0.00 66.02 64.09 1aby s SER 3 CO 0.19 -0.61 1.76 -0.65 0.98 0.00 0.00 173.24 174.91 1aby h PRO 4 N 0.22 0.57 -0.95 4.02 0.11 -1.99 0.42 132.00 134.40 1aby h PRO 4 Ca -0.46 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1aby h PRO 4 Cb 1.20 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 1aby h PRO 4 CO 0.62 0.38 0.62 0.00 -0.21 0.00 0.00 178.00 179.40 1aby h ALA 5 N 1.51 1.28 -0.14 -0.75 0.00 -1.99 -0.89 119.26 118.27 1aby h ALA 5 Ca 0.41 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1aby h ALA 5 Cb 0.54 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1aby h ALA 5 CO -0.34 0.48 0.06 -0.44 0.00 0.00 0.00 179.25 179.00 1aby h ASP 6 N 1.18 0.19 -0.44 0.00 3.32 -0.68 -1.84 116.42 118.16 1aby h ASP 6 Ca 0.39 -0.16 0.07 0.00 0.02 0.00 0.00 57.03 57.35 1aby h ASP 6 Cb 0.04 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.47 1aby h ASP 6 CO -0.13 0.30 0.06 0.11 -1.72 0.00 0.00 179.24 177.86 1aby h LYS 7 N 0.07 0.18 -0.60 3.56 1.79 0.08 -1.87 116.57 119.77 1aby h LYS 7 Ca 0.05 -0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.55 1aby h LYS 7 Cb 0.17 -0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.74 1aby h LYS 7 CO -0.00 0.12 0.34 1.15 -1.08 0.00 0.00 179.45 179.97 1aby h THR 8 N 0.18 1.01 -0.56 -0.16 2.02 -1.01 -1.13 112.91 113.26 1aby h THR 8 Ca 0.22 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1aby h THR 8 Cb 0.29 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 1aby h THR 8 CO -0.31 0.12 0.13 0.78 0.37 0.00 0.00 175.52 176.62 1aby h ASN 9 N 0.66 0.82 0.51 4.18 2.35 -0.86 -2.42 115.58 120.81 1aby h ASN 9 Ca 0.26 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1aby h ASN 9 Cb 0.10 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.26 1aby h ASN 9 CO -0.14 0.80 -0.24 0.58 -1.65 0.00 0.00 177.43 176.77 1aby h VAL 10 N 0.84 0.00 -0.93 2.81 2.07 -0.85 -2.34 116.25 117.85 1aby h VAL 10 Ca 0.18 -0.15 0.27 0.00 0.82 0.00 0.00 66.70 67.82 1aby h VAL 10 Cb 0.31 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.93 1aby h VAL 10 CO -0.00 0.00 0.33 0.11 0.02 0.00 0.00 177.57 178.03 1aby h LYS 11 N -0.84 0.21 -0.20 1.57 6.56 -1.22 0.11 116.57 122.76 1aby h LYS 11 Ca -0.07 -0.01 -0.07 0.00 -1.06 0.00 0.00 60.65 59.43 1aby h LYS 11 Cb 0.52 -0.05 -0.00 0.00 -0.57 0.00 0.00 32.23 32.13 1aby h LYS 11 CO 0.11 0.14 -0.17 0.00 -2.06 0.00 0.00 179.45 177.47 1aby h ALA 12 N 1.83 0.29 -0.17 3.86 0.00 -1.47 -0.40 119.26 123.19 1aby h ALA 12 Ca 0.63 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1aby h ALA 12 Cb 1.35 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1aby h ALA 12 CO -0.67 0.19 0.01 0.00 0.00 0.00 0.00 179.25 178.78 1aby h ALA 13 N 0.66 0.23 -0.02 0.00 0.00 -0.64 -1.29 119.26 118.20 1aby h ALA 13 Ca 0.04 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1aby h ALA 13 Cb 0.70 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1aby h ALA 13 CO 0.04 -0.07 -0.27 2.35 0.00 0.00 0.00 179.25 181.31 1aby h TRP 14 N 0.06 0.03 -0.71 0.00 2.91 -0.88 -2.03 115.95 115.33 1aby h TRP 14 Ca 0.05 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.01 1aby h TRP 14 Cb 0.37 -0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 28.98 1aby h TRP 14 CO 0.03 0.30 0.24 0.78 -1.03 0.00 0.00 178.44 178.76 1aby h GLY 15 N 0.83 1.17 1.80 2.65 0.00 -0.68 -2.75 103.07 106.09 1aby h GLY 15 Ca 0.00 -0.67 -0.08 0.00 0.00 0.00 0.00 47.33 46.58 1aby h GLY 15 CO 0.04 0.63 -0.27 1.70 0.00 0.00 0.00 176.54 178.64 1aby h LYS 16 N 1.04 0.24 -0.10 4.80 1.63 -0.52 -2.82 116.57 120.84 1aby h LYS 16 Ca 0.23 -0.08 0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1aby h LYS 16 Cb 0.27 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 1aby h LYS 16 CO -0.01 0.50 0.01 0.28 -3.45 0.00 0.00 179.45 176.77 1aby h VAL 17 N 0.22 0.94 0.00 2.00 2.07 -1.18 -3.46 116.25 116.84 1aby h VAL 17 Ca 0.03 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1aby h VAL 17 Cb 0.60 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1aby h VAL 17 CO 0.04 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.25 1aby n GLY 18 N -1.13 3.96 0.00 2.17 0.00 -1.07 -2.20 105.19 106.92 1aby n GLY 18 Ca -0.05 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1aby n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aby n ALA 19 N 12.34 1.74 1.41 4.61 0.00 -1.26 -2.55 120.51 136.80 1aby n ALA 19 Ca 0.00 -0.06 0.14 0.00 0.00 0.00 0.00 53.44 53.52 1aby n ALA 19 Cb 0.00 -1.25 0.51 0.00 0.00 0.00 0.00 19.45 18.71 1aby n ALA 19 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1aby n HIS 20 N -1.47 0.00 -0.20 0.00 -0.00 -0.94 -4.06 115.22 108.56 1aby n HIS 20 Ca 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.78 1aby n HIS 20 Cb 0.17 -0.09 0.11 0.00 -0.00 0.00 0.00 29.99 30.19 1aby n HIS 20 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1aby h ALA 21 N 3.91 0.70 -0.63 -1.41 0.00 -1.65 0.24 119.26 120.42 1aby h ALA 21 Ca 0.00 0.15 0.09 0.00 0.00 0.00 0.00 54.91 55.16 1aby h ALA 21 Cb 0.44 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 1aby h ALA 21 CO 0.00 -0.34 0.26 0.78 0.00 0.00 0.00 179.25 179.95 1aby h GLY 22 N 0.21 0.91 2.00 0.00 0.00 -1.85 -1.57 103.07 102.77 1aby h GLY 22 Ca 0.33 -0.15 -0.16 0.00 0.00 0.00 0.00 47.33 47.34 1aby h GLY 22 CO -0.45 0.00 -0.78 1.05 0.00 0.00 0.00 176.54 176.36 1aby h GLU 23 N 0.46 0.00 0.00 4.80 4.11 -1.54 -3.18 114.58 119.22 1aby h GLU 23 Ca 0.32 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.66 1aby h GLU 23 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1aby h GLU 23 CO -0.29 0.78 -0.43 1.88 0.07 0.00 0.00 179.01 181.01 1aby h TYR 24 N 0.00 0.00 -0.28 2.06 0.05 -0.30 -2.57 116.97 115.93 1aby h TYR 24 Ca -0.01 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.61 1aby h TYR 24 Cb 1.52 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.25 1aby h TYR 24 CO 0.00 0.43 -0.46 0.78 -1.05 0.00 0.00 178.16 177.86 1aby h GLY 25 N 1.59 0.81 2.00 3.88 0.00 -1.30 -0.96 103.07 109.09 1aby h GLY 25 Ca -0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 47.33 46.34 1aby h GLY 25 CO 0.06 0.78 -0.57 0.00 0.00 0.00 0.00 176.54 176.81 1aby h ALA 26 N 0.89 1.06 -0.14 3.60 0.00 -1.53 -2.57 119.26 120.57 1aby h ALA 26 Ca 0.03 -0.52 -0.14 0.00 0.00 0.00 0.00 54.91 54.29 1aby h ALA 26 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1aby h ALA 26 CO 0.10 0.71 -0.48 1.49 0.00 0.00 0.00 179.25 181.07 1aby h GLU 27 N 0.00 0.57 -0.75 0.00 4.81 -1.24 -1.75 114.58 116.22 1aby h GLU 27 Ca -0.01 -0.42 -0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1aby h GLU 27 Cb 1.01 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.43 1aby h GLU 27 CO 0.07 1.05 0.46 0.00 -0.73 0.00 0.00 179.01 179.86 1aby h ALA 28 N 0.52 0.95 -0.22 2.92 0.00 -1.12 -0.50 119.26 121.82 1aby h ALA 28 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1aby h ALA 28 Cb 1.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1aby h ALA 28 CO 0.10 0.42 0.09 -0.07 0.00 0.00 0.00 179.25 179.79 1aby h LEU 29 N 1.02 0.30 -0.38 0.00 3.38 -1.41 -1.61 115.31 116.62 1aby h LEU 29 Ca 0.27 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1aby h LEU 29 Cb -0.04 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1aby h LEU 29 CO -0.05 0.37 0.23 -0.08 0.09 0.00 0.00 178.44 179.00 1aby h GLU 30 N 0.21 0.51 -0.88 1.13 4.81 -1.04 0.20 114.58 119.51 1aby h GLU 30 Ca 0.07 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1aby h GLU 30 Cb 0.16 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 1aby h GLU 30 CO -0.01 0.37 0.55 0.00 -0.73 0.00 0.00 179.01 179.19 1aby h ARG 31 N 0.50 0.99 -0.11 1.92 3.08 -0.97 -0.71 114.38 119.07 1aby h ARG 31 Ca 0.14 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1aby h ARG 31 Cb -0.02 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 29.81 1aby h ARG 31 CO -0.03 0.66 0.02 1.98 -1.07 0.00 0.00 179.97 181.53 1aby h MET 32 N 1.02 0.19 0.00 0.04 4.05 -0.78 0.19 114.93 119.64 1aby h MET 32 Ca 0.38 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.74 1aby h MET 32 Cb 0.14 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 30.92 1aby h MET 32 CO -0.16 0.39 -0.03 0.74 0.23 0.00 0.00 176.91 178.07 1aby h PHE 33 N -0.04 0.00 0.14 1.39 0.04 -0.47 0.74 116.94 118.74 1aby h PHE 33 Ca 0.03 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.47 1aby h PHE 33 Cb 0.29 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1aby h PHE 33 CO 0.02 0.03 -1.71 -0.07 -0.60 0.00 0.00 178.31 175.98 1aby h LEU 34 N 0.00 0.45 0.19 1.54 3.38 -0.85 -3.26 115.31 116.75 1aby h LEU 34 Ca -0.00 -0.71 -0.34 0.00 0.09 0.00 0.00 57.88 56.91 1aby h LEU 34 Cb 0.06 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.67 1aby h LEU 34 CO 0.00 1.61 -1.67 0.28 0.09 0.00 0.00 178.44 178.75 1aby h SER 35 N 0.08 0.62 -2.44 -0.43 0.02 -0.42 -3.40 113.55 107.57 1aby h SER 35 Ca -0.31 -0.86 -0.60 0.00 -0.84 0.00 0.00 61.79 59.17 1aby h SER 35 Cb 2.05 -0.20 -0.41 0.00 0.14 0.00 0.00 62.40 63.98 1aby h SER 35 CO 0.15 1.72 -0.68 0.49 -1.14 0.00 0.00 176.83 177.37 1aby n PHE 36 N -3.59 2.68 0.04 3.45 3.72 0.24 -4.96 117.46 119.03 1aby n PHE 36 Ca -0.22 -4.06 0.22 0.00 -0.05 0.00 0.00 57.45 53.33 1aby n PHE 36 Cb 1.08 -0.49 0.73 0.00 -0.94 0.00 0.00 39.48 39.85 1aby n PHE 36 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1aby h PRO 37 N 4.62 0.00 0.00 -1.08 0.13 -1.70 -1.60 132.00 132.38 1aby h PRO 37 Ca 0.17 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1aby h PRO 37 Cb 0.73 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 1aby h PRO 37 CO 0.72 0.00 -0.00 1.79 -0.23 0.00 0.00 178.00 180.28 1aby h THR 38 N 0.00 0.21 0.00 1.56 1.35 -1.91 -0.71 112.91 113.41 1aby h THR 38 Ca 0.24 -0.02 -0.04 0.00 -0.55 0.00 0.00 66.41 66.05 1aby h THR 38 Cb 1.23 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 68.65 1aby h THR 38 CO -0.00 0.00 -0.17 0.71 -0.25 0.00 0.00 175.52 175.81 1aby h THR 39 N 0.00 0.57 0.00 6.82 1.35 -1.62 -2.94 112.91 117.08 1aby h THR 39 Ca -0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1aby h THR 39 Cb 0.01 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 1aby h THR 39 CO 0.00 0.17 0.00 0.11 -0.25 0.00 0.00 175.52 175.55 1aby h LYS 40 N 0.00 0.00 0.00 4.72 1.57 -1.33 -2.25 116.57 119.28 1aby h LYS 40 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1aby h LYS 40 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1aby h LYS 40 CO 0.02 0.00 0.00 1.79 -0.57 0.00 0.00 179.45 180.69 1aby h THR 41 N 0.00 0.00 -0.01 -0.16 1.35 -1.71 -1.54 112.91 110.85 1aby h THR 41 Ca 0.00 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1aby h THR 41 Cb 0.07 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1aby h THR 41 CO 0.00 0.00 -0.23 -1.22 -0.25 0.00 0.00 175.52 173.82 1aby n TYR 42 N -3.02 0.00 -3.04 4.73 4.01 -0.84 -4.14 117.16 114.87 1aby n TYR 42 Ca -0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 1aby n TYR 42 Cb 0.25 -0.17 -0.02 0.00 -0.31 0.00 0.00 39.34 39.08 1aby n TYR 42 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1aby n PHE 43 N -0.89 1.27 0.38 -0.72 3.01 -0.58 -4.91 117.46 115.00 1aby n PHE 43 Ca 0.12 -3.69 0.14 0.00 1.01 0.00 0.00 57.45 55.03 1aby n PHE 43 Cb 0.32 -0.41 0.51 0.00 -0.01 0.00 0.00 39.48 39.89 1aby n PHE 43 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1aby h PRO 44 N 2.98 0.00 0.00 -1.08 0.13 -1.71 -3.15 132.00 129.17 1aby h PRO 44 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1aby h PRO 44 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1aby h PRO 44 CO 0.58 0.00 -1.18 -2.39 -0.23 0.00 0.00 178.00 174.78 1aby n HIS 45 N -2.61 0.34 -1.93 1.56 1.44 -1.26 -4.99 115.22 107.76 1aby n HIS 45 Ca 0.02 0.10 -0.30 0.00 -2.01 0.00 0.00 57.72 55.54 1aby n HIS 45 Cb 0.32 -0.53 0.05 0.00 0.12 0.00 0.00 29.99 29.95 1aby n HIS 45 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1aby s PHE 46 N -3.27 3.24 -0.50 -1.40 0.40 -1.19 -5.03 117.98 110.22 1aby s PHE 46 Ca 0.01 0.95 -0.14 0.00 -0.60 0.00 0.00 56.93 57.15 1aby s PHE 46 Cb 0.13 -3.12 0.11 0.00 0.51 0.00 0.00 43.02 40.65 1aby s PHE 46 CO 0.82 -1.26 0.43 0.34 0.70 0.00 0.00 175.22 176.24 1aby s ASP 47 N -4.40 6.04 -0.20 1.36 2.15 -1.26 -4.93 116.67 115.42 1aby s ASP 47 Ca 0.59 -1.69 0.11 0.00 0.43 0.00 0.00 52.55 51.98 1aby s ASP 47 Cb -0.11 -2.15 0.66 0.00 -0.30 0.00 0.00 42.92 41.02 1aby s ASP 47 CO 0.51 -0.75 1.52 0.18 -0.17 0.00 0.00 175.17 176.45 1aby n LEU 48 N 5.14 4.89 -4.77 -1.34 4.77 -1.26 -4.40 117.00 120.03 1aby n LEU 48 Ca -0.12 -2.49 -0.33 0.00 -0.03 0.00 0.00 56.01 53.04 1aby n LEU 48 Cb 0.41 -0.66 0.05 0.00 -2.33 0.00 0.00 43.42 40.89 1aby n LEU 48 CO 0.49 0.57 0.75 -0.94 -1.33 0.00 0.00 177.39 176.93 1aby s SER 49 N -0.64 5.07 0.41 -1.43 1.04 -1.26 -4.92 113.70 111.97 1aby s SER 49 Ca 0.44 2.05 -0.26 0.00 0.48 0.00 0.00 55.95 58.66 1aby s SER 49 Cb 0.34 -2.56 -0.10 0.00 0.10 0.00 0.00 66.02 63.80 1aby s SER 49 CO 0.13 -1.66 1.33 1.57 0.98 0.00 0.00 173.24 175.58 1aby n HIS 50 N -2.36 2.36 -1.20 5.02 -0.00 -1.26 -1.71 115.22 116.07 1aby n HIS 50 Ca 0.11 0.49 -0.07 0.00 0.46 0.00 0.00 57.72 58.71 1aby n HIS 50 Cb 0.52 -2.42 -0.03 0.00 -0.12 0.00 0.00 29.99 27.94 1aby n HIS 50 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1aby n GLY 51 N 0.72 0.72 3.35 1.57 0.00 -1.26 -4.93 105.19 105.36 1aby n GLY 51 Ca 0.05 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1aby n GLY 51 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aby n SER 52 N -0.83 -2.42 0.05 1.61 2.88 -0.70 -4.90 113.62 109.32 1aby n SER 52 Ca -0.07 0.58 -0.10 0.00 -1.33 0.00 0.00 58.87 57.95 1aby n SER 52 Cb 0.48 -1.06 -0.13 0.00 -0.75 0.00 0.00 64.21 62.75 1aby n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aby h ALA 53 N -0.27 0.38 -0.21 -1.46 0.00 -1.90 -3.07 119.26 112.75 1aby h ALA 53 Ca -0.44 -1.04 -0.14 0.00 0.00 0.00 0.00 54.91 53.29 1aby h ALA 53 Cb 1.38 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1aby h ALA 53 CO 0.41 1.26 -0.46 0.37 0.00 0.00 0.00 179.25 180.83 1aby h GLN 54 N 0.02 0.52 -0.17 0.00 4.15 -1.91 -2.72 115.11 115.01 1aby h GLN 54 Ca -0.11 -0.29 -0.19 0.00 0.77 0.00 0.00 58.65 58.84 1aby h GLN 54 Cb 1.88 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 29.58 1aby h GLN 54 CO 0.14 0.87 -0.65 0.28 -1.93 0.00 0.00 178.83 177.53 1aby h VAL 55 N 0.42 1.32 -0.88 2.39 2.07 -1.77 -2.20 116.25 117.60 1aby h VAL 55 Ca 0.03 -1.92 -0.02 0.00 0.82 0.00 0.00 66.70 65.61 1aby h VAL 55 Cb 0.96 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 1aby h VAL 55 CO 0.09 0.60 0.49 0.11 0.02 0.00 0.00 177.57 178.88 1aby h LYS 56 N 0.46 1.23 0.32 1.57 1.79 -1.45 -1.02 116.57 119.46 1aby h LYS 56 Ca -0.02 -0.14 -0.02 0.00 -2.18 0.00 0.00 60.65 58.30 1aby h LYS 56 Cb 1.24 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 1aby h LYS 56 CO 0.13 0.89 -0.15 0.78 -1.08 0.00 0.00 179.45 180.02 1aby h GLY 57 N 1.24 -0.44 1.29 3.86 0.00 -1.38 -2.79 103.07 104.85 1aby h GLY 57 Ca 0.31 0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.81 1aby h GLY 57 CO -0.05 -0.16 0.47 0.84 0.00 0.00 0.00 176.54 177.64 1aby h HIS 58 N -0.72 0.90 -0.86 5.60 -0.00 -1.32 -2.18 115.15 116.56 1aby h HIS 58 Ca -0.04 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.37 1aby h HIS 58 Cb 0.49 -0.30 -0.05 0.00 -0.00 0.00 0.00 27.41 27.55 1aby h HIS 58 CO 0.01 0.56 0.56 0.78 -0.00 0.00 0.00 177.93 179.85 1aby h GLY 59 N 0.96 1.24 1.21 5.26 0.00 -1.18 0.10 103.07 110.67 1aby h GLY 59 Ca 0.26 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 1aby h GLY 59 CO -0.06 0.40 0.01 1.70 0.00 0.00 0.00 176.54 178.59 1aby h LYS 60 N 1.12 0.95 -0.23 4.80 3.64 -1.12 0.12 116.57 125.85 1aby h LYS 60 Ca 0.33 -0.28 -0.11 0.00 -1.27 0.00 0.00 60.65 59.32 1aby h LYS 60 Cb -0.05 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1aby h LYS 60 CO -0.10 0.94 -0.33 0.87 -2.27 0.00 0.00 179.45 178.56 1aby h LYS 61 N 0.88 0.49 -0.19 1.90 1.57 -0.97 -0.50 116.57 119.75 1aby h LYS 61 Ca 0.16 -0.21 -0.14 0.00 -1.87 0.00 0.00 60.65 58.59 1aby h LYS 61 Cb 0.50 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1aby h LYS 61 CO 0.02 0.76 -0.47 0.28 -0.57 0.00 0.00 179.45 179.47 1aby h VAL 62 N 0.42 1.32 -0.37 0.50 2.07 -0.41 -2.83 116.25 116.94 1aby h VAL 62 Ca 0.05 -1.68 -0.11 0.00 0.82 0.00 0.00 66.70 65.78 1aby h VAL 62 Cb 0.77 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1aby h VAL 62 CO 0.06 0.52 -0.21 0.00 0.02 0.00 0.00 177.57 177.96 1aby h ALA 63 N 1.10 0.53 -0.13 1.67 0.00 -0.47 -2.86 119.26 119.10 1aby h ALA 63 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1aby h ALA 63 Cb 0.98 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1aby h ALA 63 CO 0.09 0.50 0.01 -0.44 0.00 0.00 0.00 179.25 179.40 1aby h ASP 64 N 0.60 0.16 0.24 0.00 3.32 -1.07 -2.10 116.42 117.58 1aby h ASP 64 Ca 0.08 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.93 1aby h ASP 64 Cb 0.77 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.28 1aby h ASP 64 CO 0.06 0.18 -0.73 0.00 -1.72 0.00 0.00 179.24 177.03 1aby h ALA 65 N 1.84 0.58 -0.04 3.45 0.00 -1.29 -1.98 119.26 121.83 1aby h ALA 65 Ca 0.04 -0.61 -0.13 0.00 0.00 0.00 0.00 54.91 54.21 1aby h ALA 65 Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1aby h ALA 65 CO 0.00 0.76 -0.58 -0.07 0.00 0.00 0.00 179.25 179.36 1aby h LEU 66 N 0.28 0.14 -0.50 0.00 3.38 -1.21 -0.66 115.31 116.74 1aby h LEU 66 Ca -0.03 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 1aby h LEU 66 Cb 1.31 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1aby h LEU 66 CO 0.13 0.69 -0.29 0.74 0.09 0.00 0.00 178.44 179.80 1aby h THR 67 N 0.09 1.27 -0.09 0.22 2.02 -1.33 0.48 112.91 115.57 1aby h THR 67 Ca -0.00 -1.45 -0.00 0.00 0.77 0.00 0.00 66.41 65.72 1aby h THR 67 Cb 1.06 1.25 -0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1aby h THR 67 CO 0.08 0.49 0.05 -1.13 0.37 0.00 0.00 175.52 175.38 1aby h ASN 68 N 0.78 0.11 -0.72 4.18 -1.24 -1.11 0.13 115.58 117.71 1aby h ASN 68 Ca 0.09 -0.10 -0.01 0.00 0.71 0.00 0.00 56.30 56.98 1aby h ASN 68 Cb 0.86 -0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.85 1aby h ASN 68 CO 0.08 0.18 0.39 0.00 -1.29 0.00 0.00 177.43 176.79 1aby h ALA 69 N 0.93 0.92 -0.15 1.57 0.00 -0.75 0.95 119.26 122.73 1aby h ALA 69 Ca 0.03 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1aby h ALA 69 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1aby h ALA 69 CO -0.00 0.43 -0.45 0.28 0.00 0.00 0.00 179.25 179.50 1aby h VAL 70 N 0.99 1.32 0.00 0.00 2.07 0.11 -1.42 116.25 119.32 1aby h VAL 70 Ca 0.25 -1.64 -0.12 0.00 0.82 0.00 0.00 66.70 66.01 1aby h VAL 70 Cb 0.03 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1aby h VAL 70 CO -0.04 0.50 -0.56 0.00 0.02 0.00 0.00 177.57 177.49 1aby h ALA 71 N 1.21 0.69 -0.70 1.67 0.00 -0.09 -3.28 119.26 118.77 1aby h ALA 71 Ca 0.02 -0.51 -0.50 0.00 0.00 0.00 0.00 54.91 53.92 1aby h ALA 71 Cb 0.92 -0.09 -0.37 0.00 0.00 0.00 0.00 17.79 18.26 1aby h ALA 71 CO 0.08 0.70 -0.58 0.72 0.00 0.00 0.00 179.25 180.16 1aby n HIS 72 N -3.32 2.50 0.23 0.00 8.25 0.27 -4.85 115.22 118.30 1aby n HIS 72 Ca 0.01 -2.22 0.17 0.00 -0.26 0.00 0.00 57.72 55.42 1aby n HIS 72 Cb 0.72 -0.46 0.74 0.00 1.12 0.00 0.00 29.99 32.11 1aby n HIS 72 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1aby h VAL 73 N 1.90 0.14 0.00 1.59 3.04 -1.32 0.05 116.25 121.65 1aby h VAL 73 Ca 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.05 1aby h VAL 73 Cb 1.42 0.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.31 1aby h VAL 73 CO 0.77 0.00 -0.38 0.44 -1.01 0.00 0.00 177.57 177.39 1aby h ASP 74 N 0.00 0.00 -1.50 3.17 3.32 -1.88 -3.38 116.42 116.15 1aby h ASP 74 Ca 0.08 -0.08 -0.46 0.00 0.02 0.00 0.00 57.03 56.59 1aby h ASP 74 Cb 0.95 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.17 1aby h ASP 74 CO -0.00 0.04 -0.97 -0.67 -1.72 0.00 0.00 179.24 175.92 1aby n ASP 75 N -2.42 -0.44 0.21 6.45 2.03 -0.01 -4.99 116.55 117.38 1aby n ASP 75 Ca 0.04 -2.93 -0.15 0.00 0.52 0.00 0.00 54.79 52.27 1aby n ASP 75 Cb 0.47 -0.01 -0.07 0.00 -0.72 0.00 0.00 41.12 40.78 1aby n ASP 75 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 1aby h MET 76 N 3.76 -0.67 -1.00 -0.67 4.05 -1.71 -2.76 114.93 115.92 1aby h MET 76 Ca 0.02 0.05 0.23 0.00 -0.28 0.00 0.00 59.70 59.71 1aby h MET 76 Cb 0.94 0.15 -0.10 0.00 -0.80 0.00 0.00 31.60 31.79 1aby h MET 76 CO 0.42 -0.45 0.63 -1.00 0.23 0.00 0.00 176.91 176.74 1aby h PRO 77 N -0.69 0.55 0.29 0.39 0.13 -1.94 -1.67 132.00 129.06 1aby h PRO 77 Ca -0.02 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 1aby h PRO 77 Cb 0.64 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.65 1aby h PRO 77 CO -0.08 0.36 -0.14 -0.97 -0.23 0.00 0.00 178.00 176.94 1aby h ASN 78 N 0.56 -0.33 -0.14 1.44 -0.00 -1.91 -2.63 115.58 112.58 1aby h ASN 78 Ca 0.58 0.01 0.04 0.00 -0.00 0.00 0.00 56.30 56.93 1aby h ASN 78 Cb 1.19 0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 39.59 1aby h ASN 78 CO -0.34 -0.19 0.19 0.00 -0.00 0.00 0.00 177.43 177.09 1aby h ALA 79 N -1.73 1.66 -0.42 1.57 0.00 -1.25 -2.32 119.26 116.75 1aby h ALA 79 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1aby h ALA 79 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1aby h ALA 79 CO 0.07 -0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.33 1aby n LEU 80 N -3.61 3.78 -0.07 0.00 4.77 -0.65 -4.74 117.00 116.47 1aby n LEU 80 Ca 0.01 -2.42 -0.08 0.00 -0.03 0.00 0.00 56.01 53.48 1aby n LEU 80 Cb 0.30 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 1aby n LEU 80 CO 0.25 0.75 0.66 0.77 -1.33 0.00 0.00 177.39 178.49 1aby h SER 81 N 2.64 -0.96 -0.82 -1.43 4.64 -1.02 -1.04 113.55 115.56 1aby h SER 81 Ca 0.00 0.17 0.02 0.00 -0.47 0.00 0.00 61.79 61.51 1aby h SER 81 Cb 1.16 0.44 -0.05 0.00 -0.31 0.00 0.00 62.40 63.65 1aby h SER 81 CO 0.13 -0.32 0.53 0.00 -0.87 0.00 0.00 176.83 176.31 1aby h ALA 82 N 0.71 1.06 -0.10 5.18 0.00 -1.85 -0.47 119.26 123.79 1aby h ALA 82 Ca 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1aby h ALA 82 Cb 0.52 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1aby h ALA 82 CO -0.45 0.38 -0.04 1.25 0.00 0.00 0.00 179.25 180.38 1aby h LEU 83 N 1.05 0.13 -0.06 0.00 5.85 -1.69 -2.03 115.31 118.55 1aby h LEU 83 Ca 0.32 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 1aby h LEU 83 Cb -0.04 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1aby h LEU 83 CO -0.10 0.20 -0.11 0.28 -0.34 0.00 0.00 178.44 178.37 1aby h SER 84 N 0.14 0.20 -0.59 1.25 0.02 0.15 -2.66 113.55 112.05 1aby h SER 84 Ca 0.03 -0.56 0.06 0.00 -0.84 0.00 0.00 61.79 60.48 1aby h SER 84 Cb 0.17 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.62 1aby h SER 84 CO 0.01 0.73 0.39 0.44 -1.14 0.00 0.00 176.83 177.26 1aby h ASP 85 N -0.32 0.51 0.60 3.07 3.32 -0.94 -1.16 116.42 121.50 1aby h ASP 85 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1aby h ASP 85 Cb 0.69 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 40.14 1aby h ASP 85 CO 0.03 0.33 -0.29 0.25 -1.72 0.00 0.00 179.24 177.84 1aby h LEU 86 N 0.58 -0.68 -1.32 1.55 5.85 -1.34 -0.54 115.31 119.40 1aby h LEU 86 Ca 0.26 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.93 1aby h LEU 86 Cb 0.27 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1aby h LEU 86 CO -0.07 -0.33 -0.31 0.45 -0.34 0.00 0.00 178.44 177.83 1aby h HIS 87 N -1.11 0.05 0.00 1.25 3.86 -1.32 0.40 115.15 118.28 1aby h HIS 87 Ca -0.08 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.07 1aby h HIS 87 Cb 0.62 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.07 1aby h HIS 87 CO 0.02 0.35 -0.46 0.00 0.86 0.00 0.00 177.93 178.70 1aby h ALA 88 N 1.65 0.06 0.00 2.45 0.00 -1.31 -0.15 119.26 121.95 1aby h ALA 88 Ca 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1aby h ALA 88 Cb 0.57 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1aby h ALA 88 CO 0.04 0.34 -0.11 0.45 0.00 0.00 0.00 179.25 179.97 1aby h HIS 89 N -1.00 0.00 0.12 0.00 3.86 -1.22 -3.22 115.15 113.69 1aby h HIS 89 Ca -0.07 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1aby h HIS 89 Cb 0.61 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.08 1aby h HIS 89 CO -0.02 0.57 -0.06 -0.22 0.86 0.00 0.00 177.93 179.06 1aby h LYS 90 N -1.00 -0.16 -0.38 2.45 3.64 -0.72 -3.39 116.57 117.01 1aby h LYS 90 Ca -0.02 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1aby h LYS 90 Cb 0.59 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.43 1aby h LYS 90 CO -0.01 -0.10 0.12 -0.07 -2.27 0.00 0.00 179.45 177.11 1aby h LEU 91 N -0.58 0.55 -2.04 5.20 3.38 -0.42 -3.48 115.31 117.92 1aby h LEU 91 Ca -0.02 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.60 1aby h LEU 91 Cb 0.12 -0.14 0.09 0.00 0.09 0.00 0.00 40.66 40.82 1aby h LEU 91 CO 0.03 0.61 -0.39 0.54 0.09 0.00 0.00 178.44 179.32 1aby n ARG 92 N -4.62 -2.77 -2.90 1.13 1.74 -0.35 -4.99 116.66 103.89 1aby n ARG 92 Ca -0.01 0.42 -0.42 0.00 -0.77 0.00 0.00 57.85 57.08 1aby n ARG 92 Cb 0.18 -4.04 -0.04 0.00 -1.02 0.00 0.00 32.46 27.53 1aby n ARG 92 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1aby s VAL 93 N -3.18 4.86 0.18 1.55 1.01 -0.22 -5.02 120.40 119.58 1aby s VAL 93 Ca 0.05 1.57 -0.32 0.00 0.00 0.00 0.00 61.98 63.28 1aby s VAL 93 Cb -0.01 -4.11 -0.12 0.00 0.00 0.00 0.00 36.38 32.14 1aby s VAL 93 CO 0.36 -0.04 1.76 -0.67 0.00 0.00 0.00 175.10 176.52 1aby n ASP 94 N 5.75 3.99 -0.17 3.32 -0.08 -1.26 -4.84 116.55 123.25 1aby n ASP 94 Ca 0.05 1.04 0.29 0.00 -1.51 0.00 0.00 54.79 54.66 1aby n ASP 94 Cb 0.48 -1.56 0.64 0.00 2.34 0.00 0.00 41.12 43.02 1aby n ASP 94 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1aby h PRO 95 N 7.37 0.00 0.00 -0.67 0.11 -1.96 -1.55 132.00 135.30 1aby h PRO 95 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1aby h PRO 95 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1aby h PRO 95 CO 0.95 0.00 0.00 -0.24 -0.21 0.00 0.00 178.00 178.50 1aby h VAL 96 N 0.00 0.00 0.00 3.15 3.04 -2.03 -2.59 116.25 117.82 1aby h VAL 96 Ca 0.44 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 65.76 1aby h VAL 96 Cb 2.23 1.29 0.00 0.00 -2.01 0.00 0.00 31.29 32.80 1aby h VAL 96 CO -0.00 0.00 -0.13 0.78 -1.01 0.00 0.00 177.57 177.21 1aby h ASN 97 N 0.00 0.00 0.50 3.17 2.35 -1.64 -3.21 115.58 116.75 1aby h ASN 97 Ca 0.00 -0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.67 1aby h ASN 97 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1aby h ASN 97 CO 0.00 0.00 -0.35 -0.26 -1.65 0.00 0.00 177.43 175.17 1aby h PHE 98 N 0.00 0.00 0.00 1.19 -1.00 -1.65 -2.10 116.94 113.38 1aby h PHE 98 Ca 0.00 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.67 1aby h PHE 98 Cb 0.98 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.53 1aby h PHE 98 CO 0.00 0.35 -0.53 0.87 -1.61 0.00 0.00 178.31 177.39 1aby h LYS 99 N 0.00 0.00 0.08 1.51 1.57 -1.69 -2.10 116.57 115.94 1aby h LYS 99 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 1aby h LYS 99 Cb 0.70 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.03 1aby h LYS 99 CO 0.05 0.53 -1.17 -0.07 -0.57 0.00 0.00 179.45 178.22 1aby h LEU 100 N 0.00 0.89 0.35 2.94 3.38 -1.50 -2.91 115.31 118.46 1aby h LEU 100 Ca -0.01 -0.80 -0.02 0.00 0.09 0.00 0.00 57.88 57.15 1aby h LEU 100 Cb 1.05 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1aby h LEU 100 CO 0.07 1.59 -0.17 0.25 0.09 0.00 0.00 178.44 180.27 1aby h LEU 101 N 0.30 -0.40 -0.81 1.67 5.85 -1.39 -2.55 115.31 117.98 1aby h LEU 101 Ca -0.17 -0.15 0.19 0.00 0.84 0.00 0.00 57.88 58.59 1aby h LEU 101 Cb 1.84 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 42.83 1aby h LEU 101 CO 0.23 -0.01 0.01 0.28 -0.34 0.00 0.00 178.44 178.60 1aby h SER 102 N -0.85 -0.38 -0.65 1.25 0.02 -1.51 0.19 113.55 111.63 1aby h SER 102 Ca -0.05 0.21 0.07 0.00 -0.84 0.00 0.00 61.79 61.19 1aby h SER 102 Cb 0.53 0.38 -0.06 0.00 0.14 0.00 0.00 62.40 63.39 1aby h SER 102 CO 0.08 -0.21 0.33 -0.74 -1.14 0.00 0.00 176.83 175.15 1aby h HIS 103 N 0.09 0.60 0.00 3.45 -0.00 -1.43 -0.60 115.15 117.26 1aby h HIS 103 Ca 0.45 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.85 1aby h HIS 103 Cb 0.83 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 28.06 1aby h HIS 103 CO -0.44 0.26 0.00 0.00 -0.00 0.00 0.00 177.93 177.74 1aby h LEU 105 N 0.00 0.17 -0.95 0.00 5.85 0.07 -2.77 115.31 117.69 1aby h LEU 105 Ca 0.00 -0.95 -0.04 0.00 0.84 0.00 0.00 57.88 57.74 1aby h LEU 105 Cb 0.58 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1aby h LEU 105 CO 0.00 1.11 0.30 -0.07 -0.34 0.00 0.00 178.44 179.44 1aby h LEU 106 N -0.73 0.97 -0.82 2.25 3.38 -1.00 -1.12 115.31 118.24 1aby h LEU 106 Ca -0.05 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1aby h LEU 106 Cb 1.19 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.65 1aby h LEU 106 CO 0.05 0.86 0.37 0.58 0.09 0.00 0.00 178.44 180.39 1aby h VAL 107 N 1.04 1.26 -0.29 1.22 2.07 -1.41 0.40 116.25 120.55 1aby h VAL 107 Ca 0.25 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.95 1aby h VAL 107 Cb 0.18 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1aby h VAL 107 CO -0.02 0.32 0.02 0.74 0.02 0.00 0.00 177.57 178.65 1aby h THR 108 N 1.18 1.25 -0.24 2.57 2.02 -1.15 -1.83 112.91 116.71 1aby h THR 108 Ca 0.28 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1aby h THR 108 Cb 0.16 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1aby h THR 108 CO -0.03 0.28 0.11 -0.07 0.37 0.00 0.00 175.52 176.18 1aby h LEU 109 N 0.29 0.32 -0.55 2.58 4.07 -1.00 -2.57 115.31 118.45 1aby h LEU 109 Ca 0.08 -0.14 0.05 0.00 0.08 0.00 0.00 57.88 57.96 1aby h LEU 109 Cb 0.39 -0.08 -0.05 0.00 1.08 0.00 0.00 40.66 42.00 1aby h LEU 109 CO 0.01 0.37 0.27 0.00 -1.08 0.00 0.00 178.44 178.01 1aby h ALA 110 N 0.96 0.71 0.00 1.53 0.00 -0.84 0.49 119.26 122.10 1aby h ALA 110 Ca 0.08 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1aby h ALA 110 Cb 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1aby h ALA 110 CO -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1aby h ALA 111 N 1.31 1.00 0.00 0.00 0.00 -1.20 -3.24 119.26 117.14 1aby h ALA 111 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1aby h ALA 111 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1aby h ALA 111 CO -0.18 0.00 -1.36 0.72 0.00 0.00 0.00 179.25 178.43 1aby n HIS 112 N -2.76 0.00 -3.31 0.00 -0.00 -0.51 -4.73 115.22 103.92 1aby n HIS 112 Ca 0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.44 1aby n HIS 112 Cb 0.27 -0.23 -0.06 0.00 -0.00 0.00 0.00 29.99 29.97 1aby n HIS 112 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1aby n LEU 113 N -1.80 4.21 -0.12 2.41 4.77 0.05 -4.94 117.00 121.58 1aby n LEU 113 Ca -0.01 -5.45 -0.06 0.00 -0.03 0.00 0.00 56.01 50.46 1aby n LEU 113 Cb 0.35 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1aby n LEU 113 CO 0.33 2.06 0.68 1.55 -1.33 0.00 0.00 177.39 180.67 1aby h PRO 114 N 4.16 -0.18 -0.17 3.23 0.13 -1.85 -1.16 132.00 136.16 1aby h PRO 114 Ca 0.20 0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 65.14 1aby h PRO 114 Cb 0.63 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.80 1aby h PRO 114 CO 0.90 -0.12 -0.69 0.00 -0.23 0.00 0.00 178.00 177.85 1aby h ALA 115 N 0.96 0.46 -0.00 -0.56 0.00 -1.95 -3.34 119.26 114.84 1aby h ALA 115 Ca 0.19 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 54.34 1aby h ALA 115 Cb 0.49 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1aby h ALA 115 CO -0.52 0.70 -0.84 0.93 0.00 0.00 0.00 179.25 179.53 1aby h GLU 116 N 0.49 0.12 -4.14 0.00 3.07 -1.90 -3.40 114.58 108.80 1aby h GLU 116 Ca -0.03 -0.13 -0.50 0.00 -0.50 0.00 0.00 59.36 58.20 1aby h GLU 116 Cb 1.29 0.04 0.04 0.00 -0.84 0.00 0.00 28.75 29.28 1aby h GLU 116 CO 0.14 0.88 2.22 0.34 -1.40 0.00 0.00 179.01 181.19 1aby n PHE 117 N -3.64 1.39 -1.73 4.33 7.35 -0.47 -4.77 117.46 119.92 1aby n PHE 117 Ca -0.02 -1.64 -0.30 0.00 -0.76 0.00 0.00 57.45 54.73 1aby n PHE 117 Cb 0.78 -1.52 0.07 0.00 0.35 0.00 0.00 39.48 39.17 1aby n PHE 117 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1aby s THR 118 N 4.66 3.13 0.30 -2.13 -4.23 -1.26 -4.81 115.64 111.29 1aby s THR 118 Ca 0.48 0.37 0.03 0.00 -1.18 0.00 0.00 61.69 61.38 1aby s THR 118 Cb 0.12 -3.24 0.10 0.00 1.34 0.00 0.00 72.50 70.82 1aby s THR 118 CO 0.08 -0.48 1.78 -0.65 -0.54 0.00 0.00 174.62 174.81 1aby h PRO 119 N -0.91 0.52 -0.58 3.99 0.11 -1.99 0.85 132.00 133.99 1aby h PRO 119 Ca -0.46 -0.16 -0.06 0.00 0.11 0.00 0.00 66.00 65.43 1aby h PRO 119 Cb 1.27 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1aby h PRO 119 CO 0.62 0.65 0.12 0.00 -0.21 0.00 0.00 178.00 179.18 1aby h ALA 120 N 1.38 0.76 -0.17 -0.75 0.00 -1.96 -0.86 119.26 117.66 1aby h ALA 120 Ca 0.08 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1aby h ALA 120 Cb 0.53 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1aby h ALA 120 CO 0.03 0.48 -0.55 0.28 0.00 0.00 0.00 179.25 179.49 1aby h VAL 121 N 0.83 1.33 -0.72 0.00 2.07 -1.79 -1.90 116.25 116.08 1aby h VAL 121 Ca 0.18 -1.81 -0.02 0.00 0.82 0.00 0.00 66.70 65.87 1aby h VAL 121 Cb 0.37 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 1aby h VAL 121 CO 0.01 0.56 0.39 -0.74 0.02 0.00 0.00 177.57 177.80 1aby h HIS 122 N 0.39 1.00 -0.39 1.57 6.17 -0.58 -0.53 115.15 122.78 1aby h HIS 122 Ca 0.01 -0.03 -0.11 0.00 0.71 0.00 0.00 60.37 60.95 1aby h HIS 122 Cb 1.09 -0.32 -0.01 0.00 2.52 0.00 0.00 27.41 30.69 1aby h HIS 122 CO 0.04 0.71 -0.19 0.00 0.71 0.00 0.00 177.93 179.20 1aby h ALA 123 N 1.19 0.55 0.00 5.26 0.00 -1.04 -1.89 119.26 123.34 1aby h ALA 123 Ca 0.25 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1aby h ALA 123 Cb 0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1aby h ALA 123 CO -0.04 0.50 -0.53 0.77 0.00 0.00 0.00 179.25 179.95 1aby h SER 124 N 0.62 0.00 -0.04 0.00 0.02 -1.13 -2.95 113.55 110.08 1aby h SER 124 Ca 0.09 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.83 1aby h SER 124 Cb 0.75 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.31 1aby h SER 124 CO 0.06 0.53 -0.80 -0.07 -1.14 0.00 0.00 176.83 175.41 1aby h LEU 125 N 0.00 0.77 -1.58 5.07 3.38 -1.00 -2.89 115.31 119.06 1aby h LEU 125 Ca -0.01 -0.71 -0.01 0.00 0.09 0.00 0.00 57.88 57.24 1aby h LEU 125 Cb 0.95 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1aby h LEU 125 CO 0.07 1.37 0.13 -0.78 0.09 0.00 0.00 178.44 179.32 1aby h ASP 126 N 0.23 0.36 -0.07 -0.43 1.82 -1.31 -1.25 116.42 115.77 1aby h ASP 126 Ca -0.09 -0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.46 1aby h ASP 126 Cb 1.46 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 41.38 1aby h ASP 126 CO 0.16 0.32 -0.21 0.11 -1.61 0.00 0.00 179.24 178.01 1aby h LYS 127 N 0.41 0.27 0.16 0.28 1.57 -1.54 -2.35 116.57 115.36 1aby h LYS 127 Ca 0.10 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1aby h LYS 127 Cb 0.07 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.37 1aby h LYS 127 CO -0.01 0.81 -0.41 0.35 -0.57 0.00 0.00 179.45 179.63 1aby h PHE 128 N -0.22 -1.13 -0.54 -1.35 3.57 -1.23 0.61 116.94 116.65 1aby h PHE 128 Ca -0.01 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.65 1aby h PHE 128 Cb 0.83 0.48 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 1aby h PHE 128 CO 0.12 -0.51 0.38 -0.07 -2.23 0.00 0.00 178.31 176.00 1aby h LEU 129 N -0.66 0.14 -0.63 0.59 3.38 -1.31 0.41 115.31 117.22 1aby h LEU 129 Ca 0.02 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1aby h LEU 129 Cb 0.68 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1aby h LEU 129 CO -0.21 0.08 -0.52 0.00 0.09 0.00 0.00 178.44 177.87 1aby h ALA 130 N 1.73 0.86 -0.02 1.53 0.00 -0.62 -2.47 119.26 120.28 1aby h ALA 130 Ca 0.26 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1aby h ALA 130 Cb 0.81 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1aby h ALA 130 CO -0.04 0.65 -0.09 0.77 0.00 0.00 0.00 179.25 180.55 1aby h SER 131 N 0.00 0.11 -0.65 0.00 0.02 0.19 -2.23 113.55 111.00 1aby h SER 131 Ca -0.01 -0.68 0.13 0.00 -0.84 0.00 0.00 61.79 60.39 1aby h SER 131 Cb 1.13 -0.03 -0.10 0.00 0.14 0.00 0.00 62.40 63.54 1aby h SER 131 CO 0.07 0.77 0.12 0.58 -1.14 0.00 0.00 176.83 177.23 1aby h VAL 132 N -0.55 0.58 -0.11 2.27 2.07 -1.10 -0.46 116.25 118.95 1aby h VAL 132 Ca -0.01 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1aby h VAL 132 Cb 0.77 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1aby h VAL 132 CO 0.02 0.04 0.06 0.28 0.02 0.00 0.00 177.57 177.99 1aby h SER 133 N 0.24 0.13 -0.69 0.57 0.02 -1.44 -1.09 113.55 111.28 1aby h SER 133 Ca 0.35 -0.07 0.09 0.00 -0.84 0.00 0.00 61.79 61.32 1aby h SER 133 Cb 0.55 -0.03 -0.07 0.00 0.14 0.00 0.00 62.40 62.99 1aby h SER 133 CO -0.46 0.16 0.34 0.74 -1.14 0.00 0.00 176.83 176.48 1aby h THR 134 N 0.09 0.86 -0.64 -2.27 2.02 -0.69 0.17 112.91 112.45 1aby h THR 134 Ca 0.04 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 1aby h THR 134 Cb 0.05 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 1aby h THR 134 CO -0.01 0.11 0.30 0.58 0.37 0.00 0.00 175.52 176.87 1aby h VAL 135 N 0.59 1.22 -0.00 3.16 2.07 -0.64 0.13 116.25 122.78 1aby h VAL 135 Ca 0.34 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1aby h VAL 135 Cb 0.34 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1aby h VAL 135 CO -0.26 0.26 -0.06 0.18 0.02 0.00 0.00 177.57 177.72 1aby n LEU 136 N -4.48 0.18 -0.36 2.57 4.77 -0.46 -3.04 117.00 116.19 1aby n LEU 136 Ca 0.05 0.20 0.03 0.00 -0.03 0.00 0.00 56.01 56.26 1aby n LEU 136 Cb 0.13 -0.27 0.08 0.00 -2.33 0.00 0.00 43.42 41.03 1aby n LEU 136 CO 0.38 0.03 0.53 0.41 -1.33 0.00 0.00 177.39 177.41 1aby n THR 137 N -1.21 0.78 0.24 -5.08 -1.04 0.52 -4.37 114.28 104.12 1aby n THR 137 Ca 0.13 -0.89 -0.10 0.00 -2.04 0.00 0.00 64.05 61.16 1aby n THR 137 Cb 0.27 0.64 -0.05 0.00 -1.82 0.00 0.00 70.33 69.37 1aby n THR 137 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1aby h SER 138 N 1.23 -0.55 0.00 8.00 4.64 -0.70 -3.34 113.55 122.83 1aby h SER 138 Ca 0.00 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 1aby h SER 138 Cb 0.56 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.77 1aby h SER 138 CO 0.00 -0.28 -0.07 0.29 -0.87 0.00 0.00 176.83 175.90 1aby n LYS 139 N -4.36 1.05 0.00 4.77 5.02 -1.26 -4.81 118.16 118.57 1aby n LYS 139 Ca -0.08 -0.25 0.00 0.00 -2.02 0.00 0.00 58.31 55.96 1aby n LYS 139 Cb 0.25 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1aby n LYS 139 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1aby n TYR 140 N 1.91 0.00 -1.90 2.13 4.02 -1.26 -4.70 117.16 117.36 1aby n TYR 140 Ca 0.11 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.68 1aby n TYR 140 Cb 0.51 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.79 1aby n TYR 140 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 1aby s ARG 141 N 1.22 2.39 0.11 -0.72 3.52 -1.26 -4.85 118.95 119.35 1aby s ARG 141 Ca 0.00 0.50 0.01 0.00 -0.13 0.00 0.00 55.73 56.12 1aby s ARG 141 Cb 0.00 -4.65 -0.00 0.00 -1.56 0.00 0.00 34.95 28.74 1aby s ARG 141 CO 0.00 -3.20 0.04 0.41 -0.81 0.00 0.00 175.30 171.74 1aby n GLY 142 N 6.18 3.87 1.84 8.12 0.00 -1.26 -5.04 105.19 118.90 1aby n GLY 142 Ca 0.31 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.39 1aby n GLY 142 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1aby n VAL 143 N -0.23 -6.04 -2.84 1.61 0.24 -1.26 -4.84 118.33 104.96 1aby n VAL 143 Ca -0.01 2.01 -0.43 0.00 -2.04 0.00 0.00 64.34 63.87 1aby n VAL 143 Cb 0.16 -2.95 -0.04 0.00 -1.47 0.00 0.00 33.84 29.54 1aby n VAL 143 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1aby s LEU 144 N -1.13 4.27 0.68 1.34 1.43 -1.26 -5.02 118.68 118.98 1aby s LEU 144 Ca 0.00 -0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 52.11 1aby s LEU 144 Cb 0.00 -2.49 0.01 0.00 0.03 0.00 0.00 46.19 43.74 1aby s LEU 144 CO 0.00 -1.43 1.10 -0.94 0.23 0.00 0.00 176.35 175.31 1aby s SER 145 N 3.54 5.08 0.60 2.29 1.04 -1.26 -4.77 113.70 120.22 1aby s SER 145 Ca 0.24 1.92 0.28 0.00 0.48 0.00 0.00 55.95 58.87 1aby s SER 145 Cb -0.16 -2.54 1.37 0.00 0.10 0.00 0.00 66.02 64.80 1aby s SER 145 CO 0.12 -1.64 1.78 1.55 0.98 0.00 0.00 173.24 176.02 1aby h PRO 146 N -0.21 0.00 -0.04 4.02 0.13 -1.99 0.14 132.00 134.05 1aby h PRO 146 Ca -0.46 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.45 1aby h PRO 146 Cb 1.24 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.37 1aby h PRO 146 CO 0.54 0.00 -0.89 0.00 -0.23 0.00 0.00 178.00 177.42 1aby h ALA 147 N 1.26 0.35 -0.26 -0.56 0.00 -2.00 -2.87 119.26 115.18 1aby h ALA 147 Ca 0.25 -0.67 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 1aby h ALA 147 Cb 1.48 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1aby h ALA 147 CO -0.00 0.76 -0.07 -0.44 0.00 0.00 0.00 179.25 179.50 1aby h ASP 148 N 0.33 0.51 -0.80 0.00 3.32 -1.12 -2.44 116.42 116.21 1aby h ASP 148 Ca -0.08 -0.37 0.19 0.00 0.02 0.00 0.00 57.03 56.80 1aby h ASP 148 Cb 1.52 -0.14 -0.12 0.00 0.22 0.00 0.00 39.33 40.81 1aby h ASP 148 CO 0.16 0.76 0.21 0.11 -1.72 0.00 0.00 179.24 178.76 1aby h LYS 149 N 0.25 0.26 0.63 3.56 1.79 -1.29 0.12 116.57 121.89 1aby h LYS 149 Ca 0.07 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.49 1aby h LYS 149 Cb 0.54 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 31.14 1aby h LYS 149 CO 0.03 0.17 -0.30 1.15 -1.08 0.00 0.00 179.45 179.41 1aby h THR 150 N 0.26 0.25 -0.63 -0.16 2.02 -1.40 -2.85 112.91 110.41 1aby h THR 150 Ca 0.47 -0.27 0.12 0.00 0.77 0.00 0.00 66.41 67.50 1aby h THR 150 Cb 0.87 0.32 -0.12 0.00 -1.74 0.00 0.00 68.15 67.48 1aby h THR 150 CO -0.56 0.03 -0.25 0.78 0.37 0.00 0.00 175.52 175.89 1aby h ASN 151 N -1.06 -0.87 -0.87 4.18 2.35 -0.74 0.76 115.58 119.32 1aby h ASN 151 Ca -0.09 0.21 0.04 0.00 -0.55 0.00 0.00 56.30 55.92 1aby h ASN 151 Cb 0.70 0.49 -0.05 0.00 0.05 0.00 0.00 38.32 39.50 1aby h ASN 151 CO 0.14 -0.26 0.57 0.58 -1.65 0.00 0.00 177.43 176.81 1aby h VAL 152 N -0.08 1.13 0.17 2.81 2.07 -0.87 -0.64 116.25 120.84 1aby h VAL 152 Ca 0.28 -0.36 -0.31 0.00 0.82 0.00 0.00 66.70 67.13 1aby h VAL 152 Cb 0.52 -0.03 0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1aby h VAL 152 CO -0.68 0.19 -1.34 0.11 0.02 0.00 0.00 177.57 175.87 1aby h LYS 153 N 1.06 0.54 0.00 1.57 1.57 -0.64 0.18 116.57 120.85 1aby h LYS 153 Ca 0.35 -0.81 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1aby h LYS 153 Cb 0.06 0.29 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1aby h LYS 153 CO -0.11 1.38 0.00 0.00 -0.57 0.00 0.00 179.45 180.15 1aby n ALA 154 N -2.67 1.71 -0.09 3.86 0.00 0.24 -0.56 120.51 123.01 1aby n ALA 154 Ca -0.14 -0.01 -0.16 0.00 0.00 0.00 0.00 53.44 53.13 1aby n ALA 154 Cb 1.04 -1.30 -0.07 0.00 0.00 0.00 0.00 19.45 19.12 1aby n ALA 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aby n ALA 155 N -1.60 1.79 0.07 0.00 0.00 -0.27 -4.15 120.51 116.34 1aby n ALA 155 Ca 0.03 -0.70 -0.00 0.00 0.00 0.00 0.00 53.44 52.77 1aby n ALA 155 Cb 0.21 0.22 0.29 0.00 0.00 0.00 0.00 19.45 20.17 1aby n ALA 155 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1aby h TRP 156 N -0.39 0.38 -0.81 0.00 2.91 -0.58 -1.47 115.95 115.97 1aby h TRP 156 Ca -0.42 -0.06 -0.02 0.00 1.13 0.00 0.00 58.89 59.53 1aby h TRP 156 Cb 1.45 -0.10 -0.04 0.00 -0.51 0.00 0.00 29.16 29.97 1aby h TRP 156 CO -0.03 0.53 0.44 0.78 -1.03 0.00 0.00 178.44 179.13 1aby h GLY 157 N 0.92 1.21 0.46 2.65 0.00 -1.03 -0.64 103.07 106.65 1aby h GLY 157 Ca 0.06 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1aby h GLY 157 CO 0.03 0.53 0.00 1.17 0.00 0.00 0.00 176.54 178.28 1aby n LYS 158 N -4.40 0.60 -0.02 4.80 3.00 -0.57 -2.64 118.16 118.93 1aby n LYS 158 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.38 1aby n LYS 158 Cb 0.10 -1.23 -0.00 0.00 0.00 0.00 0.00 35.03 33.89 1aby n LYS 158 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1aby n VAL 159 N -0.73 0.37 0.00 3.15 0.31 -0.25 -5.03 118.33 116.15 1aby n VAL 159 Ca 0.07 0.43 0.00 0.00 -0.01 0.00 0.00 64.34 64.82 1aby n VAL 159 Cb 0.03 -1.73 0.00 0.00 -0.91 0.00 0.00 33.84 31.23 1aby n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1aby n GLY 160 N 1.70 2.10 0.46 2.92 0.00 -1.08 -3.47 105.19 107.81 1aby n GLY 160 Ca -0.02 -0.49 0.06 0.00 0.00 0.00 0.00 46.02 45.58 1aby n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aby n ALA 161 N 9.08 2.49 -0.49 4.61 0.00 -1.26 -3.31 120.51 131.63 1aby n ALA 161 Ca 0.00 -0.45 0.09 0.00 0.00 0.00 0.00 53.44 53.08 1aby n ALA 161 Cb 0.00 -1.04 0.28 0.00 0.00 0.00 0.00 19.45 18.69 1aby n ALA 161 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1aby n HIS 162 N 0.18 1.02 0.12 0.00 -0.00 -1.23 -4.55 115.22 110.77 1aby n HIS 162 Ca 0.11 -0.59 -0.12 0.00 -0.00 0.00 0.00 57.72 57.13 1aby n HIS 162 Cb 0.24 -0.14 -0.08 0.00 -0.00 0.00 0.00 29.99 30.01 1aby n HIS 162 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1aby h ALA 163 N 3.29 -0.35 0.00 -1.41 0.00 -1.80 -0.63 119.26 118.36 1aby h ALA 163 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1aby h ALA 163 Cb 1.15 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1aby h ALA 163 CO 0.11 -0.45 -0.05 0.78 0.00 0.00 0.00 179.25 179.64 1aby h GLY 164 N -0.83 0.00 1.01 0.00 0.00 -1.84 0.15 103.07 101.56 1aby h GLY 164 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.17 1aby h GLY 164 CO 0.06 0.00 -0.26 -2.09 0.00 0.00 0.00 176.54 174.25 1aby h GLU 165 N 0.00 0.79 -0.00 4.80 4.81 -1.80 -3.05 114.58 120.13 1aby h GLU 165 Ca -0.00 -0.38 -0.26 0.00 -0.13 0.00 0.00 59.36 58.59 1aby h GLU 165 Cb 0.09 -0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.49 1aby h GLU 165 CO 0.01 1.01 -1.02 1.88 -0.73 0.00 0.00 179.01 180.16 1aby h TYR 166 N 0.57 0.98 0.00 0.92 0.05 -0.14 -3.00 116.97 116.35 1aby h TYR 166 Ca 0.07 -0.53 -0.01 0.00 0.05 0.00 0.00 58.73 58.30 1aby h TYR 166 Cb 0.83 -0.11 -0.00 0.00 1.01 0.00 0.00 36.73 38.45 1aby h TYR 166 CO 0.06 1.37 -0.07 0.78 -1.05 0.00 0.00 178.16 179.25 1aby h GLY 167 N 0.54 0.00 1.58 3.88 0.00 -0.81 0.15 103.07 108.41 1aby h GLY 167 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 46.97 1aby h GLY 167 CO 0.20 0.00 -1.01 0.00 0.00 0.00 0.00 176.54 175.73 1aby h ALA 168 N 1.93 0.31 0.00 3.60 0.00 -1.56 -2.54 119.26 121.01 1aby h ALA 168 Ca -0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 54.91 54.12 1aby h ALA 168 Cb 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1aby h ALA 168 CO 0.01 0.85 -0.20 1.49 0.00 0.00 0.00 179.25 181.40 1aby h GLU 169 N 0.19 0.00 -0.04 0.00 4.81 -1.10 -2.44 114.58 115.99 1aby h GLU 169 Ca -0.09 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 1aby h GLU 169 Cb 1.66 0.00 0.01 0.00 0.63 0.00 0.00 28.75 31.05 1aby h GLU 169 CO 0.17 0.20 -0.34 0.00 -0.73 0.00 0.00 179.01 178.31 1aby h ALA 170 N 1.80 0.09 -0.76 2.92 0.00 -0.67 -2.74 119.26 119.89 1aby h ALA 170 Ca -0.00 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.45 1aby h ALA 170 Cb 0.89 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1aby h ALA 170 CO 0.03 0.18 0.50 -0.07 0.00 0.00 0.00 179.25 179.88 1aby h LEU 171 N -0.26 0.86 -0.46 0.00 3.38 -1.35 -1.70 115.31 115.79 1aby h LEU 171 Ca -0.03 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1aby h LEU 171 Cb 1.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1aby h LEU 171 CO 0.07 0.62 -0.17 -0.08 0.09 0.00 0.00 178.44 178.97 1aby h GLU 172 N 1.02 0.93 -0.24 1.13 4.81 -1.52 -0.97 114.58 119.74 1aby h GLU 172 Ca 0.28 -0.38 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 1aby h GLU 172 Cb -0.10 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1aby h GLU 172 CO -0.07 1.04 -0.05 0.00 -0.73 0.00 0.00 179.01 179.21 1aby h ARG 173 N 0.77 0.37 -0.04 1.92 3.08 -1.18 -1.14 114.38 118.17 1aby h ARG 173 Ca 0.11 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1aby h ARG 173 Cb 0.73 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1aby h ARG 173 CO 0.06 0.44 -0.16 1.98 -1.07 0.00 0.00 179.97 181.22 1aby h MET 174 N 0.36 0.18 -0.79 0.04 4.05 -1.04 -1.44 114.93 116.30 1aby h MET 174 Ca 0.08 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1aby h MET 174 Cb 0.32 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.10 1aby h MET 174 CO 0.01 0.77 0.50 0.74 0.23 0.00 0.00 176.91 179.17 1aby h PHE 175 N -0.37 1.01 0.01 1.39 0.04 -0.95 0.56 116.94 118.62 1aby h PHE 175 Ca -0.01 0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.69 1aby h PHE 175 Cb 0.79 -0.34 0.01 0.00 2.20 0.00 0.00 35.95 38.61 1aby h PHE 175 CO 0.14 0.65 -0.33 -0.07 -0.60 0.00 0.00 178.31 178.09 1aby h LEU 176 N 1.07 0.27 -0.20 1.54 -0.00 -1.27 -3.20 115.31 113.52 1aby h LEU 176 Ca 0.29 -0.80 -0.14 0.00 -0.00 0.00 0.00 57.88 57.22 1aby h LEU 176 Cb -0.09 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 40.49 1aby h LEU 176 CO -0.06 1.04 -0.43 0.28 -0.00 0.00 0.00 178.44 179.27 1aby h SER 177 N -0.46 0.73 -3.63 -0.43 0.02 -1.19 -3.38 113.55 105.20 1aby h SER 177 Ca -0.04 -0.56 -0.63 0.00 -0.84 0.00 0.00 61.79 59.72 1aby h SER 177 Cb 1.10 -0.21 -0.41 0.00 0.14 0.00 0.00 62.40 63.02 1aby h SER 177 CO 0.06 1.15 -0.63 -0.36 -1.14 0.00 0.00 176.83 175.92 1aby s PHE 178 N -4.03 3.15 0.38 3.45 0.08 0.19 -4.98 117.98 116.24 1aby s PHE 178 Ca -0.12 -3.15 0.11 0.00 0.12 0.00 0.00 56.93 53.89 1aby s PHE 178 Cb 0.07 -2.60 0.90 0.00 -0.57 0.00 0.00 43.02 40.82 1aby s PHE 178 CO 0.84 -0.66 1.90 -1.35 -0.10 0.00 0.00 175.22 175.85 1aby h PRO 179 N 5.98 0.57 0.00 0.24 0.11 -1.73 -2.41 132.00 134.77 1aby h PRO 179 Ca 0.04 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1aby h PRO 179 Cb 0.83 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1aby h PRO 179 CO 0.67 0.38 0.00 1.79 -0.21 0.00 0.00 178.00 180.63 1aby h THR 180 N 0.59 0.00 0.00 -1.15 1.35 -1.92 -1.45 112.91 110.33 1aby h THR 180 Ca 0.39 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 66.19 1aby h THR 180 Cb 0.69 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 1aby h THR 180 CO -0.15 0.00 0.00 0.71 -0.25 0.00 0.00 175.52 175.83 1aby h THR 181 N 0.00 0.00 0.00 6.82 1.35 -1.77 -2.66 112.91 116.65 1aby h THR 181 Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1aby h THR 181 Cb 0.07 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1aby h THR 181 CO 0.00 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.56 1aby n LYS 182 N -2.90 0.04 0.00 4.72 5.02 -0.55 -2.28 118.16 122.22 1aby n LYS 182 Ca 0.01 0.30 0.05 0.00 -2.02 0.00 0.00 58.31 56.65 1aby n LYS 182 Cb 0.30 -1.58 0.25 0.00 -0.02 0.00 0.00 35.03 33.97 1aby n LYS 182 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1aby n THR 183 N -1.67 0.98 0.66 -0.18 -2.24 -1.00 -1.85 114.28 108.98 1aby n THR 183 Ca 0.03 0.25 0.09 0.00 -2.27 0.00 0.00 64.05 62.15 1aby n THR 183 Cb 0.17 -1.07 -0.12 0.00 -2.10 0.00 0.00 70.33 67.22 1aby n THR 183 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1aby n TYR 184 N -1.38 0.00 -3.15 4.78 4.01 -0.97 -4.58 117.16 115.88 1aby n TYR 184 Ca 0.04 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.56 1aby n TYR 184 Cb 0.10 -0.11 -0.05 0.00 -0.31 0.00 0.00 39.34 38.97 1aby n TYR 184 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1aby n PHE 185 N -1.63 1.45 0.18 -0.72 3.01 -0.77 -4.95 117.46 114.03 1aby n PHE 185 Ca 0.02 -3.85 0.07 0.00 1.01 0.00 0.00 57.45 54.69 1aby n PHE 185 Cb 0.35 -0.44 0.22 0.00 -0.01 0.00 0.00 39.48 39.60 1aby n PHE 185 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1aby h PRO 186 N 3.30 0.00 -0.01 -1.08 0.13 -1.79 -3.19 132.00 129.36 1aby h PRO 186 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1aby h PRO 186 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1aby h PRO 186 CO 0.61 0.33 -0.59 0.72 -0.23 0.00 0.00 178.00 178.83 1aby n HIS 187 N -3.28 0.00 -1.89 1.56 8.25 -1.26 -4.96 115.22 113.64 1aby n HIS 187 Ca 0.01 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.17 1aby n HIS 187 Cb 0.59 -0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.64 1aby n HIS 187 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1aby s PHE 188 N -2.74 3.57 -0.62 4.41 0.40 -1.21 -5.00 117.98 116.80 1aby s PHE 188 Ca 0.15 1.23 -0.17 0.00 -0.60 0.00 0.00 56.93 57.55 1aby s PHE 188 Cb 0.18 -2.78 0.14 0.00 0.51 0.00 0.00 43.02 41.07 1aby s PHE 188 CO 0.67 -0.77 0.63 0.34 0.70 0.00 0.00 175.22 176.79 1aby s ASP 189 N -4.21 6.31 0.00 1.36 2.15 -1.26 -4.87 116.67 116.15 1aby s ASP 189 Ca 0.55 -1.86 0.14 0.00 0.43 0.00 0.00 52.55 51.81 1aby s ASP 189 Cb -0.11 -2.24 0.64 0.00 -0.30 0.00 0.00 42.92 40.90 1aby s ASP 189 CO 0.53 -0.89 1.44 0.18 -0.17 0.00 0.00 175.17 176.26 1aby n LEU 190 N 5.38 0.80 -4.72 -1.34 4.77 -1.26 -4.46 117.00 116.18 1aby n LEU 190 Ca -0.06 -0.36 -0.36 0.00 -0.03 0.00 0.00 56.01 55.19 1aby n LEU 190 Cb 0.42 -0.07 0.08 0.00 -2.33 0.00 0.00 43.42 41.52 1aby n LEU 190 CO 0.51 0.18 0.87 -1.54 -1.33 0.00 0.00 177.39 176.08 1aby n SER 191 N -0.18 1.83 -4.67 -1.43 3.41 -1.26 -4.87 113.62 106.45 1aby n SER 191 Ca 0.11 0.78 -0.47 0.00 -0.26 0.00 0.00 58.87 59.03 1aby n SER 191 Cb 0.17 -1.54 -0.04 0.00 -0.26 0.00 0.00 64.21 62.53 1aby n SER 191 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1aby n HIS 192 N -2.20 2.26 -1.20 7.33 -0.00 -1.26 -1.79 115.22 118.36 1aby n HIS 192 Ca 0.15 0.19 -0.07 0.00 0.46 0.00 0.00 57.72 58.46 1aby n HIS 192 Cb 0.48 -2.57 -0.03 0.00 -0.12 0.00 0.00 29.99 27.75 1aby n HIS 192 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1aby n GLY 193 N 3.72 0.92 3.78 1.57 0.00 -1.26 -5.01 105.19 108.90 1aby n GLY 193 Ca 0.19 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 1aby n GLY 193 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1aby s SER 194 N -2.88 4.61 0.38 1.61 1.04 -0.74 -4.94 113.70 112.78 1aby s SER 194 Ca 0.00 1.77 0.22 0.00 0.48 0.00 0.00 55.95 58.41 1aby s SER 194 Cb 0.00 -2.50 0.24 0.00 0.10 0.00 0.00 66.02 63.87 1aby s SER 194 CO 0.00 -1.96 1.50 0.00 0.98 0.00 0.00 173.24 173.76 1aby h ALA 195 N -1.08 0.88 0.01 5.32 0.00 -1.90 -2.89 119.26 119.60 1aby h ALA 195 Ca -0.44 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1aby h ALA 195 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1aby h ALA 195 CO 0.52 0.12 -0.00 1.96 0.00 0.00 0.00 179.25 181.85 1aby h GLN 196 N 0.00 -0.01 -0.39 0.00 1.08 -1.92 0.13 115.11 114.00 1aby h GLN 196 Ca -0.00 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.12 1aby h GLN 196 Cb 1.07 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.49 1aby h GLN 196 CO 0.01 0.41 -0.06 0.28 -0.95 0.00 0.00 178.83 178.53 1aby h VAL 197 N -0.44 1.24 0.02 -0.54 2.07 -1.78 0.10 116.25 116.93 1aby h VAL 197 Ca -0.00 -1.00 -0.25 0.00 0.82 0.00 0.00 66.70 66.27 1aby h VAL 197 Cb 0.43 1.00 0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1aby h VAL 197 CO 0.00 0.34 -0.97 0.50 0.02 0.00 0.00 177.57 177.46 1aby h LYS 198 N 0.61 0.62 0.00 1.57 3.64 -1.53 0.37 116.57 121.85 1aby h LYS 198 Ca 0.12 -0.70 -0.08 0.00 -1.27 0.00 0.00 60.65 58.73 1aby h LYS 198 Cb 0.47 0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 1aby h LYS 198 CO 0.02 1.29 -0.36 0.78 -2.27 0.00 0.00 179.45 178.91 1aby h GLY 199 N 0.24 0.00 0.95 5.01 0.00 -0.54 -2.73 103.07 106.00 1aby h GLY 199 Ca -0.13 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.87 1aby h GLY 199 CO 0.19 0.00 -1.74 0.84 0.00 0.00 0.00 176.54 175.83 1aby h HIS 200 N 0.00 0.51 -0.08 5.60 -0.00 -0.77 -3.35 115.15 117.07 1aby h HIS 200 Ca -0.00 -0.38 0.02 0.00 -0.00 0.00 0.00 60.37 60.01 1aby h HIS 200 Cb 0.69 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.08 1aby h HIS 200 CO 0.00 1.55 0.06 0.78 -0.00 0.00 0.00 177.93 180.32 1aby h GLY 201 N 1.35 0.00 2.00 5.26 0.00 -0.05 -0.91 103.07 110.72 1aby h GLY 201 Ca -0.33 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.85 1aby h GLY 201 CO 0.14 0.00 -0.73 0.07 0.00 0.00 0.00 176.54 176.02 1aby h LYS 202 N 0.00 0.00 -0.37 4.80 2.10 -1.62 -3.13 116.57 118.35 1aby h LYS 202 Ca 0.04 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.52 1aby h LYS 202 Cb 0.15 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.48 1aby h LYS 202 CO -0.00 0.73 -0.41 0.87 -2.00 0.00 0.00 179.45 178.64 1aby h LYS 203 N 0.00 0.94 0.12 0.07 1.57 -1.30 -1.99 116.57 115.98 1aby h LYS 203 Ca -0.01 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.26 1aby h LYS 203 Cb 1.41 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1aby h LYS 203 CO 0.09 1.16 -0.06 0.28 -0.57 0.00 0.00 179.45 180.36 1aby h VAL 204 N 0.76 0.90 0.00 0.50 2.07 -1.53 -1.26 116.25 117.68 1aby h VAL 204 Ca 0.06 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1aby h VAL 204 Cb 1.01 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1aby h VAL 204 CO 0.10 0.01 -0.02 0.00 0.02 0.00 0.00 177.57 177.68 1aby h ALA 205 N 0.69 1.01 0.05 1.67 0.00 -1.58 -0.34 119.26 120.77 1aby h ALA 205 Ca -0.02 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.61 1aby h ALA 205 Cb 0.15 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.95 1aby h ALA 205 CO 0.03 0.03 -1.10 -0.44 0.00 0.00 0.00 179.25 177.76 1aby h ASP 206 N 0.00 0.73 0.69 0.00 3.32 -0.94 -1.09 116.42 119.14 1aby h ASP 206 Ca -0.00 -0.63 -0.14 0.00 0.02 0.00 0.00 57.03 56.28 1aby h ASP 206 Cb 0.47 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1aby h ASP 206 CO 0.00 1.44 -0.65 0.00 -1.72 0.00 0.00 179.24 178.32 1aby h ALA 207 N 0.49 0.89 -0.00 3.45 0.00 -0.76 -2.06 119.26 121.27 1aby h ALA 207 Ca -0.13 -0.59 -0.18 0.00 0.00 0.00 0.00 54.91 54.00 1aby h ALA 207 Cb 1.76 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 1aby h ALA 207 CO 0.20 0.81 -0.82 -0.07 0.00 0.00 0.00 179.25 179.37 1aby h LEU 208 N 0.00 0.18 -0.26 0.00 3.38 -1.03 -0.97 115.31 116.61 1aby h LEU 208 Ca -0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1aby h LEU 208 Cb 1.18 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1aby h LEU 208 CO 0.08 0.92 -0.07 0.74 0.09 0.00 0.00 178.44 180.20 1aby h THR 209 N 0.08 1.29 -0.39 0.22 2.02 -1.09 -2.21 112.91 112.83 1aby h THR 209 Ca -0.03 -1.10 -0.04 0.00 0.77 0.00 0.00 66.41 66.00 1aby h THR 209 Cb 1.43 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 69.29 1aby h THR 209 CO 0.12 0.35 0.05 -1.13 0.37 0.00 0.00 175.52 175.28 1aby h ASN 210 N 0.26 0.55 -0.03 4.18 -1.24 -1.30 -0.81 115.58 117.18 1aby h ASN 210 Ca 0.06 -0.09 -0.13 0.00 0.71 0.00 0.00 56.30 56.85 1aby h ASN 210 Cb 0.55 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 39.45 1aby h ASN 210 CO 0.03 0.58 -0.41 0.00 -1.29 0.00 0.00 177.43 176.34 1aby h ALA 211 N 1.49 0.85 -0.11 1.57 0.00 -0.98 -1.07 119.26 121.02 1aby h ALA 211 Ca 0.13 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1aby h ALA 211 Cb 0.28 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1aby h ALA 211 CO 0.00 0.64 -0.06 0.28 0.00 0.00 0.00 179.25 180.11 1aby h VAL 212 N 0.45 1.33 -0.88 0.00 2.07 -0.78 0.13 116.25 118.58 1aby h VAL 212 Ca 0.04 -1.13 0.11 0.00 0.82 0.00 0.00 66.70 66.54 1aby h VAL 212 Cb 0.91 1.85 -0.08 0.00 -1.52 0.00 0.00 31.29 32.45 1aby h VAL 212 CO 0.08 0.32 0.51 0.00 0.02 0.00 0.00 177.57 178.50 1aby h ALA 213 N 0.63 1.28 -1.12 1.67 0.00 -1.04 -1.43 119.26 119.25 1aby h ALA 213 Ca 0.02 0.04 -0.67 0.00 0.00 0.00 0.00 54.91 54.30 1aby h ALA 213 Cb 0.54 -0.14 -0.34 0.00 0.00 0.00 0.00 17.79 17.85 1aby h ALA 213 CO 0.02 0.11 0.22 0.72 0.00 0.00 0.00 179.25 180.32 1aby n HIS 214 N -4.72 3.13 0.18 0.00 8.25 -0.42 -4.79 115.22 116.84 1aby n HIS 214 Ca 0.15 -2.68 0.10 0.00 -0.26 0.00 0.00 57.72 55.04 1aby n HIS 214 Cb 0.32 -0.77 0.63 0.00 1.12 0.00 0.00 29.99 31.28 1aby n HIS 214 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1aby h VAL 215 N 2.03 0.95 -0.01 1.59 3.04 0.18 -2.08 116.25 121.96 1aby h VAL 215 Ca 0.47 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 66.14 1aby h VAL 215 Cb 0.65 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 1aby h VAL 215 CO 1.19 0.01 -0.12 0.47 -1.01 0.00 0.00 177.57 178.11 1aby n ASP 216 N -4.50 0.83 -2.78 3.17 8.00 -1.26 -4.31 116.55 115.70 1aby n ASP 216 Ca 0.00 -0.92 -0.10 0.00 0.71 0.00 0.00 54.79 54.48 1aby n ASP 216 Cb 0.20 0.01 0.06 0.00 -0.02 0.00 0.00 41.12 41.37 1aby n ASP 216 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1aby n ASP 217 N -0.60 -0.58 -0.10 -2.24 2.03 -0.81 -4.95 116.55 109.29 1aby n ASP 217 Ca 0.16 -2.87 -0.03 0.00 0.52 0.00 0.00 54.79 52.57 1aby n ASP 217 Cb 0.30 0.49 0.20 0.00 -0.72 0.00 0.00 41.12 41.39 1aby n ASP 217 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 1aby h MET 218 N 2.65 0.77 -0.95 -0.67 2.86 -1.68 -2.90 114.93 115.01 1aby h MET 218 Ca -0.13 -0.17 0.22 0.00 -2.06 0.00 0.00 59.70 57.57 1aby h MET 218 Cb 1.17 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.65 1aby h MET 218 CO 0.23 0.72 0.62 -1.35 1.06 0.00 0.00 176.91 178.20 1aby h PRO 219 N 0.74 0.39 0.00 -0.22 0.11 -1.92 0.23 132.00 131.33 1aby h PRO 219 Ca 0.16 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.21 1aby h PRO 219 Cb 0.33 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1aby h PRO 219 CO 0.00 0.26 -0.25 -0.91 -0.21 0.00 0.00 178.00 176.90 1aby h ASN 220 N 0.40 0.00 -0.62 -2.05 4.21 -1.95 -3.22 115.58 112.35 1aby h ASN 220 Ca 0.51 -0.50 0.12 0.00 1.21 0.00 0.00 56.30 57.63 1aby h ASN 220 Cb 1.28 0.00 -0.12 0.00 -1.12 0.00 0.00 38.32 38.36 1aby h ASN 220 CO -0.20 0.89 -0.18 0.00 -1.29 0.00 0.00 177.43 176.64 1aby h ALA 221 N -0.50 0.35 -0.39 -0.83 0.00 -1.26 -1.99 119.26 114.65 1aby h ALA 221 Ca -0.05 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1aby h ALA 221 Cb 0.68 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1aby h ALA 221 CO -0.03 -0.46 0.00 1.28 0.00 0.00 0.00 179.25 180.04 1aby n LEU 222 N -5.43 2.14 -0.16 0.00 4.77 0.78 -4.63 117.00 114.46 1aby n LEU 222 Ca 0.07 -1.07 -0.06 0.00 -0.03 0.00 0.00 56.01 54.92 1aby n LEU 222 Cb 0.33 -0.27 -0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1aby n LEU 222 CO 0.04 0.52 0.64 0.77 -1.33 0.00 0.00 177.39 178.03 1aby h SER 223 N 2.27 -1.09 1.11 -1.43 4.64 -1.36 0.62 113.55 118.30 1aby h SER 223 Ca 0.00 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1aby h SER 223 Cb 0.55 0.53 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1aby h SER 223 CO 0.01 -0.31 0.00 0.00 -0.87 0.00 0.00 176.83 175.66 1aby n ALA 224 N -3.07 2.03 0.03 5.18 0.00 -1.26 -2.41 120.51 121.00 1aby n ALA 224 Ca 0.03 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.38 1aby n ALA 224 Cb 0.34 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.24 1aby n ALA 224 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1aby h LEU 225 N 0.00 0.06 -0.31 0.00 5.85 -1.48 -3.00 115.31 116.43 1aby h LEU 225 Ca 0.00 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.52 1aby h LEU 225 Cb 0.55 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1aby h LEU 225 CO 0.00 1.08 -0.51 0.77 -0.34 0.00 0.00 178.44 179.43 1aby h SER 226 N 0.01 0.00 0.02 1.25 4.64 -0.76 -2.74 113.55 115.97 1aby h SER 226 Ca -0.16 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.92 1aby h SER 226 Cb 1.91 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 64.01 1aby h SER 226 CO 0.11 0.51 -0.92 -0.78 -0.87 0.00 0.00 176.83 174.89 1aby h ASP 227 N 0.00 0.84 0.94 4.97 1.82 -1.54 -1.25 116.42 122.20 1aby h ASP 227 Ca -0.01 -0.63 -0.04 0.00 -0.39 0.00 0.00 57.03 55.96 1aby h ASP 227 Cb 1.27 -0.25 0.01 0.00 0.68 0.00 0.00 39.33 41.03 1aby h ASP 227 CO 0.07 1.42 -0.49 0.25 -1.61 0.00 0.00 179.24 178.88 1aby h LEU 228 N 0.41 -1.19 0.59 2.28 5.85 -1.46 -0.78 115.31 121.02 1aby h LEU 228 Ca -0.09 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1aby h LEU 228 Cb 1.56 0.32 0.01 0.00 0.37 0.00 0.00 40.66 42.92 1aby h LEU 228 CO 0.18 -0.80 -0.28 0.45 -0.34 0.00 0.00 178.44 177.64 1aby h HIS 229 N -1.31 -0.73 0.00 1.25 3.86 -1.57 0.55 115.15 117.19 1aby h HIS 229 Ca -0.13 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.03 1aby h HIS 229 Cb 1.02 0.24 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 1aby h HIS 229 CO -0.04 -0.46 -0.16 0.00 0.86 0.00 0.00 177.93 178.13 1aby h ALA 230 N -1.34 1.61 0.00 2.45 0.00 -1.31 0.56 119.26 121.23 1aby h ALA 230 Ca -0.08 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1aby h ALA 230 Cb 0.61 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1aby h ALA 230 CO 0.13 0.20 -1.27 0.72 0.00 0.00 0.00 179.25 179.04 1aby n HIS 231 N -4.17 0.00 0.21 0.00 -0.00 -0.44 -4.10 115.22 106.72 1aby n HIS 231 Ca -0.02 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.78 1aby n HIS 231 Cb 0.24 -0.32 0.40 0.00 -0.00 0.00 0.00 29.99 30.30 1aby n HIS 231 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 1aby h LYS 232 N -0.37 0.00 0.00 -0.41 1.79 -0.13 -3.37 116.57 114.08 1aby h LYS 232 Ca -0.20 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.23 1aby h LYS 232 Cb 1.01 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.65 1aby h LYS 232 CO -0.12 0.28 -1.18 1.28 -1.08 0.00 0.00 179.45 178.62 1aby n LEU 233 N -3.42 0.60 -3.25 2.94 4.77 0.08 -5.00 117.00 113.72 1aby n LEU 233 Ca 0.00 -0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.82 1aby n LEU 233 Cb 0.47 0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.66 1aby n LEU 233 CO 0.35 0.16 0.07 0.54 -1.33 0.00 0.00 177.39 177.18 1aby n ARG 234 N -2.20 -4.46 -2.55 3.23 5.12 0.20 -4.97 116.66 111.03 1aby n ARG 234 Ca -0.05 0.82 -0.42 0.00 -1.93 0.00 0.00 57.85 56.27 1aby n ARG 234 Cb 0.58 -5.69 -0.03 0.00 -1.16 0.00 0.00 32.46 26.17 1aby n ARG 234 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1aby s VAL 235 N -3.36 4.44 0.17 1.55 1.01 -1.15 -4.96 120.40 118.10 1aby s VAL 235 Ca 0.20 1.75 -0.32 0.00 0.00 0.00 0.00 61.98 63.61 1aby s VAL 235 Cb -0.03 -4.12 -0.11 0.00 0.00 0.00 0.00 36.38 32.13 1aby s VAL 235 CO 0.70 0.07 1.67 -0.62 0.00 0.00 0.00 175.10 176.91 1aby s ASP 236 N 1.19 6.49 0.32 3.32 -1.08 -1.26 -4.88 116.67 120.77 1aby s ASP 236 Ca 0.54 2.72 0.10 0.00 -0.52 0.00 0.00 52.55 55.39 1aby s ASP 236 Cb -0.24 -2.59 0.97 0.00 -1.46 0.00 0.00 42.92 39.60 1aby s ASP 236 CO 0.24 -0.91 1.64 -0.65 0.52 0.00 0.00 175.17 176.02 1aby h PRO 237 N 7.15 0.22 0.00 4.34 0.11 -2.00 -0.82 132.00 141.00 1aby h PRO 237 Ca -0.43 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 1aby h PRO 237 Cb 1.20 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1aby h PRO 237 CO 0.94 0.15 -0.06 -0.24 -0.21 0.00 0.00 178.00 178.57 1aby h VAL 238 N 0.23 0.65 -0.40 3.15 3.04 -2.02 -1.65 116.25 119.25 1aby h VAL 238 Ca 0.68 -0.25 -0.03 0.00 -1.01 0.00 0.00 66.70 66.09 1aby h VAL 238 Cb 1.52 1.15 -0.02 0.00 -2.01 0.00 0.00 31.29 31.93 1aby h VAL 238 CO -0.66 0.06 0.14 0.78 -1.01 0.00 0.00 177.57 176.88 1aby h ASN 239 N 0.00 0.52 0.18 3.17 2.35 -1.51 -1.97 115.58 118.32 1aby h ASN 239 Ca -0.00 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1aby h ASN 239 Cb 0.15 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 1aby h ASN 239 CO 0.01 0.49 -0.12 -0.26 -1.65 0.00 0.00 177.43 175.90 1aby h PHE 240 N 0.57 0.00 0.00 1.19 -1.00 -1.43 0.06 116.94 116.32 1aby h PHE 240 Ca 0.14 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.91 1aby h PHE 240 Cb 0.15 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.71 1aby h PHE 240 CO 0.01 0.12 -0.04 0.87 -1.61 0.00 0.00 178.31 177.66 1aby h LYS 241 N 0.00 0.00 0.02 1.51 1.57 -1.46 -2.20 116.57 116.00 1aby h LYS 241 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1aby h LYS 241 Cb 0.24 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.56 1aby h LYS 241 CO 0.02 0.04 -0.23 -0.07 -0.57 0.00 0.00 179.45 178.63 1aby h LEU 242 N 0.00 0.17 -1.55 2.94 3.38 -0.96 -2.50 115.31 116.78 1aby h LEU 242 Ca -0.00 -0.86 -0.02 0.00 0.09 0.00 0.00 57.88 57.09 1aby h LEU 242 Cb 0.87 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1aby h LEU 242 CO 0.00 1.02 0.09 0.25 0.09 0.00 0.00 178.44 179.89 1aby h LEU 243 N -0.65 0.34 -0.29 1.67 5.85 -1.27 -2.55 115.31 118.40 1aby h LEU 243 Ca -0.03 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.54 1aby h LEU 243 Cb 1.07 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 1aby h LEU 243 CO 0.05 0.33 -0.25 0.28 -0.34 0.00 0.00 178.44 178.50 1aby h SER 244 N 0.38 0.73 -0.47 1.25 0.02 -1.45 -2.37 113.55 111.64 1aby h SER 244 Ca 0.10 -0.46 -0.01 0.00 -0.84 0.00 0.00 61.79 60.58 1aby h SER 244 Cb 0.11 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1aby h SER 244 CO -0.01 1.04 0.26 -0.74 -1.14 0.00 0.00 176.83 176.23 1aby h HIS 245 N 0.44 0.65 -0.34 3.45 -0.00 -1.09 -2.56 115.15 115.68 1aby h HIS 245 Ca 0.05 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.36 1aby h HIS 245 Cb 0.82 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 28.00 1aby h HIS 245 CO 0.07 0.49 0.02 0.00 -0.00 0.00 0.00 177.93 178.51 1aby h LEU 247 N 0.50 0.61 -0.55 0.00 3.38 -1.24 -2.23 115.31 115.78 1aby h LEU 247 Ca 0.11 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1aby h LEU 247 Cb 0.30 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1aby h LEU 247 CO 0.01 0.87 -0.16 -0.07 0.09 0.00 0.00 178.44 179.17 1aby h LEU 248 N 0.51 1.01 -0.55 1.67 3.38 -0.95 -0.09 115.31 120.29 1aby h LEU 248 Ca 0.07 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.57 1aby h LEU 248 Cb 0.76 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1aby h LEU 248 CO 0.06 1.14 -0.08 0.58 0.09 0.00 0.00 178.44 180.24 1aby h VAL 249 N 0.87 1.27 0.16 1.22 2.07 -1.23 0.37 116.25 120.98 1aby h VAL 249 Ca 0.12 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.40 1aby h VAL 249 Cb 0.73 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1aby h VAL 249 CO 0.06 0.44 -0.07 0.74 0.02 0.00 0.00 177.57 178.75 1aby h THR 250 N 0.91 0.97 -0.58 2.57 2.02 -1.29 0.06 112.91 117.57 1aby h THR 250 Ca 0.15 -0.62 0.08 0.00 0.77 0.00 0.00 66.41 66.78 1aby h THR 250 Cb 0.64 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.34 1aby h THR 250 CO 0.04 0.14 0.23 0.25 0.37 0.00 0.00 175.52 176.55 1aby h LEU 251 N -0.51 0.24 -1.25 2.58 5.85 -0.99 -1.55 115.31 119.68 1aby h LEU 251 Ca -0.02 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1aby h LEU 251 Cb 0.40 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1aby h LEU 251 CO 0.04 0.16 -0.01 0.00 -0.34 0.00 0.00 178.44 178.28 1aby h ALA 252 N 1.38 1.00 0.00 1.25 0.00 -0.76 -0.50 119.26 121.63 1aby h ALA 252 Ca 0.28 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.05 1aby h ALA 252 Cb 0.32 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1aby h ALA 252 CO -0.27 0.01 -1.11 0.00 0.00 0.00 0.00 179.25 177.88 1aby h ALA 253 N 1.99 0.65 0.00 0.00 0.00 -0.04 -3.35 119.26 118.51 1aby h ALA 253 Ca -0.00 -0.68 -0.34 0.00 0.00 0.00 0.00 54.91 53.89 1aby h ALA 253 Cb 0.59 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1aby h ALA 253 CO 0.00 0.78 -2.24 0.72 0.00 0.00 0.00 179.25 178.51 1aby n HIS 254 N -2.98 0.20 -3.06 0.00 -0.00 -0.73 -4.66 115.22 103.98 1aby n HIS 254 Ca -0.05 0.07 -0.25 0.00 -0.00 0.00 0.00 57.72 57.49 1aby n HIS 254 Cb 0.79 -1.02 -0.04 0.00 -0.00 0.00 0.00 29.99 29.71 1aby n HIS 254 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1aby n LEU 255 N -2.80 3.57 0.30 2.41 4.77 -0.22 -4.98 117.00 120.05 1aby n LEU 255 Ca -0.29 -5.50 -0.18 0.00 -0.03 0.00 0.00 56.01 50.02 1aby n LEU 255 Cb 1.12 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 41.82 1aby n LEU 255 CO 0.43 2.30 0.52 1.55 -1.33 0.00 0.00 177.39 180.87 1aby h PRO 256 N 3.18 -0.95 -0.02 3.23 0.13 -1.80 -0.13 132.00 135.64 1aby h PRO 256 Ca 0.13 0.06 0.01 0.00 -0.87 0.00 0.00 66.00 65.33 1aby h PRO 256 Cb 0.62 0.22 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 1aby h PRO 256 CO 0.75 -0.63 0.05 0.00 -0.23 0.00 0.00 178.00 177.94 1aby h ALA 257 N -0.97 1.27 0.00 -0.56 0.00 -1.93 0.16 119.26 117.22 1aby h ALA 257 Ca -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1aby h ALA 257 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1aby h ALA 257 CO -0.04 -0.06 -0.95 -1.91 0.00 0.00 0.00 179.25 176.28 1aby n GLU 258 N -3.36 0.37 -2.19 0.00 2.13 -1.01 -4.50 120.64 112.08 1aby n GLU 258 Ca -0.02 0.04 -0.42 0.00 0.66 0.00 0.00 57.16 57.42 1aby n GLU 258 Cb 0.13 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.18 1aby n GLU 258 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1aby n PHE 259 N -2.16 2.87 -2.28 4.31 7.35 0.55 -4.77 117.46 123.33 1aby n PHE 259 Ca 0.02 -2.81 -0.27 0.00 -0.76 0.00 0.00 57.45 53.62 1aby n PHE 259 Cb 0.47 -1.98 0.04 0.00 0.35 0.00 0.00 39.48 38.36 1aby n PHE 259 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1aby s THR 260 N 0.29 3.47 0.23 -2.13 -4.23 -1.26 -4.80 115.64 107.21 1aby s THR 260 Ca 0.44 0.06 -0.06 0.00 -1.18 0.00 0.00 61.69 60.95 1aby s THR 260 Cb 0.12 -3.41 0.19 0.00 1.34 0.00 0.00 72.50 70.74 1aby s THR 260 CO -0.02 -0.44 1.76 -0.65 -0.54 0.00 0.00 174.62 174.72 1aby h PRO 261 N -0.31 0.51 -0.56 3.99 0.11 -1.98 0.27 132.00 134.03 1aby h PRO 261 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1aby h PRO 261 Cb 1.26 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1aby h PRO 261 CO 0.61 0.34 0.37 0.00 -0.21 0.00 0.00 178.00 179.11 1aby h ALA 262 N 1.47 0.71 -0.38 -0.75 0.00 -1.97 -0.88 119.26 117.45 1aby h ALA 262 Ca 0.37 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 1aby h ALA 262 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1aby h ALA 262 CO -0.32 0.15 -0.08 0.28 0.00 0.00 0.00 179.25 179.28 1aby h VAL 263 N 0.75 1.27 0.00 0.00 2.07 -1.54 -2.98 116.25 115.83 1aby h VAL 263 Ca 0.20 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.57 1aby h VAL 263 Cb -0.08 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1aby h VAL 263 CO -0.04 0.38 0.00 1.57 0.02 0.00 0.00 177.57 179.50 1aby n HIS 264 N -4.38 0.00 -0.31 1.57 -0.00 0.83 -1.96 115.22 110.98 1aby n HIS 264 Ca -0.01 0.00 0.27 0.00 -0.00 0.00 0.00 57.72 57.97 1aby n HIS 264 Cb 0.35 -0.45 0.50 0.00 -0.00 0.00 0.00 29.99 30.38 1aby n HIS 264 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1aby n ALA 265 N -2.22 0.87 0.02 1.57 0.00 -0.37 -0.59 120.51 119.80 1aby n ALA 265 Ca 0.00 0.97 -0.11 0.00 0.00 0.00 0.00 53.44 54.30 1aby n ALA 265 Cb 0.00 -0.91 0.03 0.00 0.00 0.00 0.00 19.45 18.56 1aby n ALA 265 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1aby h SER 266 N 0.00 0.60 0.25 0.00 0.02 -1.34 -1.90 113.55 111.18 1aby h SER 266 Ca 0.75 -0.36 -0.17 0.00 -0.84 0.00 0.00 61.79 61.17 1aby h SER 266 Cb 1.93 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 64.29 1aby h SER 266 CO -0.76 1.10 -0.67 -0.07 -1.14 0.00 0.00 176.83 175.29 1aby h LEU 267 N 0.37 0.45 -0.82 5.07 3.38 -0.18 -1.07 115.31 122.51 1aby h LEU 267 Ca -0.02 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 1aby h LEU 267 Cb 1.24 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1aby h LEU 267 CO 0.12 0.99 0.15 -0.78 0.09 0.00 0.00 178.44 179.01 1aby h ASP 268 N 0.27 0.98 0.02 -0.43 1.82 -1.26 0.05 116.42 117.87 1aby h ASP 268 Ca -0.02 -0.20 -0.17 0.00 -0.39 0.00 0.00 57.03 56.25 1aby h ASP 268 Cb 1.23 -0.26 -0.00 0.00 0.68 0.00 0.00 39.33 40.98 1aby h ASP 268 CO 0.11 0.95 -0.59 0.50 -1.61 0.00 0.00 179.24 178.61 1aby h LYS 269 N 0.98 0.58 0.38 0.28 3.64 -1.20 -1.79 116.57 119.44 1aby h LYS 269 Ca 0.21 -0.39 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 1aby h LYS 269 Cb 0.36 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1aby h LYS 269 CO 0.00 1.00 -0.18 0.35 -2.27 0.00 0.00 179.45 178.35 1aby h PHE 270 N 0.44 -0.47 -0.78 1.91 3.57 -0.83 -2.57 116.94 118.21 1aby h PHE 270 Ca 0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 1aby h PHE 270 Cb 1.15 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.99 1aby h PHE 270 CO 0.05 -0.14 0.51 -0.07 -2.23 0.00 0.00 178.31 176.43 1aby h LEU 271 N -0.87 0.71 -1.34 0.59 3.38 -1.06 0.62 115.31 117.34 1aby h LEU 271 Ca -0.05 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1aby h LEU 271 Cb 0.54 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1aby h LEU 271 CO 0.08 0.45 0.45 0.00 0.09 0.00 0.00 178.44 179.51 1aby h ALA 272 N 1.58 1.53 -0.18 1.53 0.00 -1.28 -1.69 119.26 120.75 1aby h ALA 272 Ca 0.34 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 1aby h ALA 272 Cb 0.30 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1aby h ALA 272 CO -0.12 0.43 -0.42 0.77 0.00 0.00 0.00 179.25 179.92 1aby h SER 273 N 0.90 0.68 -0.16 0.00 0.02 -0.51 -2.58 113.55 111.91 1aby h SER 273 Ca 0.25 -0.56 0.03 0.00 -0.84 0.00 0.00 61.79 60.67 1aby h SER 273 Cb -0.09 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 1aby h SER 273 CO -0.06 1.12 -0.05 0.58 -1.14 0.00 0.00 176.83 177.29 1aby h VAL 274 N 0.27 0.82 -0.64 2.27 2.07 -0.81 -1.46 116.25 118.77 1aby h VAL 274 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1aby h VAL 274 Cb 1.02 0.82 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 1aby h VAL 274 CO 0.09 0.00 0.29 0.28 0.02 0.00 0.00 177.57 178.25 1aby h SER 275 N -0.02 0.35 -0.28 0.57 0.02 -1.32 -0.10 113.55 112.77 1aby h SER 275 Ca 0.08 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1aby h SER 275 Cb 0.14 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1aby h SER 275 CO -0.17 0.21 -0.02 0.74 -1.14 0.00 0.00 176.83 176.44 1aby h THR 276 N 0.51 1.22 -0.46 -2.27 2.02 -1.03 -0.28 112.91 112.63 1aby h THR 276 Ca 0.32 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.58 1aby h THR 276 Cb 0.35 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1aby h THR 276 CO -0.27 0.31 0.27 0.58 0.37 0.00 0.00 175.52 176.78 1aby h VAL 277 N 0.59 1.15 0.00 3.16 2.07 0.03 -1.57 116.25 121.68 1aby h VAL 277 Ca 0.12 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1aby h VAL 277 Cb 0.40 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1aby h VAL 277 CO 0.02 0.15 0.00 -0.07 0.02 0.00 0.00 177.57 177.69 1aby h LEU 278 N 0.60 0.00 0.00 2.57 3.38 -1.09 -3.36 115.31 117.42 1aby h LEU 278 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1aby h LEU 278 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1aby h LEU 278 CO -0.03 0.00 0.00 0.41 0.09 0.00 0.00 178.44 178.91 1aby n THR 279 N -2.88 0.00 0.00 0.22 -1.04 -0.14 -3.78 114.28 106.66 1aby n THR 279 Ca 0.03 0.46 0.00 0.00 -2.04 0.00 0.00 64.05 62.50 1aby n THR 279 Cb 0.40 -1.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.90 1aby n THR 279 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1aby n SER 280 N -1.08 0.00 0.00 8.00 7.64 -0.78 -1.35 113.62 126.04 1aby n SER 280 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1aby n SER 280 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1aby n SER 280 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1aby n LYS 281 N 0.00 0.00 -0.25 1.43 5.02 -1.26 -3.39 118.16 119.71 1aby n LYS 281 Ca 0.00 0.11 -0.01 0.00 -2.02 0.00 0.00 58.31 56.39 1aby n LYS 281 Cb 0.00 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.62 1aby n LYS 281 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1aby h TYR 282 N 0.00 0.75 0.00 2.13 5.03 -1.42 -3.44 116.97 120.02 1aby h TYR 282 Ca 0.00 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.34 1aby h TYR 282 Cb 0.00 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.05 1aby h TYR 282 CO 0.00 0.36 0.00 0.54 -1.32 0.00 0.00 178.16 177.74