#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abl h ILE 3 N 0.00 1.33 -0.68 -2.13 2.04 -2.01 -1.04 117.51 115.01 3abl h ILE 3 Ca 0.00 -1.91 0.07 0.00 1.00 0.00 0.00 64.86 64.03 3abl h ILE 3 Cb 0.00 2.12 -0.06 0.00 -0.74 0.00 0.00 36.82 38.14 3abl h ILE 3 CO 0.00 0.59 0.36 0.78 0.00 0.00 0.00 178.15 179.88 3abl h ASN 4 N 0.30 0.51 -0.13 1.72 4.21 -1.95 -0.15 115.58 120.09 3abl h ASN 4 Ca -0.05 0.04 -0.15 0.00 1.21 0.00 0.00 56.30 57.35 3abl h ASN 4 Cb 1.28 -0.05 0.01 0.00 -1.12 0.00 0.00 38.32 38.43 3abl h ASN 4 CO 0.13 0.32 -0.51 -0.09 -1.29 0.00 0.00 177.43 175.99 3abl h ARG 5 N 0.65 0.58 0.00 0.81 2.43 -1.87 -3.00 114.38 113.97 3abl h ARG 5 Ca 0.32 -0.45 -0.09 0.00 -0.81 0.00 0.00 59.98 58.95 3abl h ARG 5 Cb 0.26 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 3abl h ARG 5 CO -0.22 1.07 -2.01 0.91 -1.51 0.00 0.00 179.97 178.21 3abl n TRP 6 N -4.20 0.00 -0.01 2.20 7.02 -0.40 -3.57 117.44 118.48 3abl n TRP 6 Ca -0.07 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.45 3abl n TRP 6 Cb 0.60 -0.58 -0.08 0.00 -2.42 0.00 0.00 31.31 28.84 3abl n TRP 6 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3abl n LEU 7 N -2.33 0.00 -0.54 -0.99 4.32 -0.13 -4.55 117.00 112.78 3abl n LEU 7 Ca -0.11 0.00 0.06 0.00 -0.02 0.00 0.00 56.01 55.94 3abl n LEU 7 Cb 0.67 0.01 0.19 0.00 -1.62 0.00 0.00 43.42 42.67 3abl n LEU 7 CO 0.42 0.01 0.47 0.49 -1.22 0.00 0.00 177.39 177.55 3abl n PHE 8 N -1.86 0.17 -1.67 -1.77 3.72 -0.81 -5.02 117.46 110.23 3abl n PHE 8 Ca -0.02 -1.36 -0.38 0.00 -0.05 0.00 0.00 57.45 55.64 3abl n PHE 8 Cb 0.27 -0.26 0.05 0.00 -0.94 0.00 0.00 39.48 38.61 3abl n PHE 8 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3abl n SER 9 N -1.18 1.50 -1.68 4.37 2.88 -1.22 -4.85 113.62 113.44 3abl n SER 9 Ca 0.20 0.87 0.01 0.00 -1.33 0.00 0.00 58.87 58.61 3abl n SER 9 Cb 0.73 -1.46 0.07 0.00 -0.75 0.00 0.00 64.21 62.79 3abl n SER 9 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3abl n THR 10 N -1.52 1.00 -4.73 2.46 -2.24 -1.26 -4.66 114.28 103.33 3abl n THR 10 Ca 0.13 -2.23 -0.33 0.00 -2.27 0.00 0.00 64.05 59.35 3abl n THR 10 Cb 0.46 0.60 -0.16 0.00 -2.10 0.00 0.00 70.33 69.13 3abl n THR 10 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3abl s ASN 11 N -2.84 3.28 0.53 3.42 3.84 -1.26 -4.80 114.94 117.11 3abl s ASN 11 Ca 0.35 -0.55 0.24 0.00 0.21 0.00 0.00 52.86 53.11 3abl s ASN 11 Cb 0.37 -1.48 1.37 0.00 -0.55 0.00 0.00 41.25 40.97 3abl s ASN 11 CO -0.10 0.10 2.01 1.12 -2.79 0.00 0.00 177.10 177.44 3abl h HIS 12 N 7.20 0.02 0.07 0.43 2.07 -1.92 -1.28 115.15 121.74 3abl h HIS 12 Ca -0.30 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.06 3abl h HIS 12 Cb 1.20 -0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.17 3abl h HIS 12 CO 0.48 0.01 -0.79 0.87 -3.07 0.00 0.00 177.93 175.42 3abl h LYS 13 N 0.01 0.15 -0.33 5.12 1.57 -1.91 -0.82 116.57 120.36 3abl h LYS 13 Ca 0.23 -0.25 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 3abl h LYS 13 Cb 0.90 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.25 3abl h LYS 13 CO -0.01 1.12 0.04 -0.44 -0.57 0.00 0.00 179.45 179.59 3abl h ASP 14 N -0.65 -0.05 -0.22 0.86 3.45 -1.95 0.31 116.42 118.17 3abl h ASP 14 Ca -0.17 0.06 0.03 0.00 0.43 0.00 0.00 57.03 57.38 3abl h ASP 14 Cb 1.42 0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 40.26 3abl h ASP 14 CO 0.02 0.01 0.02 0.40 -1.57 0.00 0.00 179.24 178.12 3abl h ILE 15 N 0.14 0.87 -0.97 0.35 2.04 -1.30 -0.74 117.51 117.90 3abl h ILE 15 Ca 0.16 -0.03 0.22 0.00 1.00 0.00 0.00 64.86 66.20 3abl h ILE 15 Cb 0.19 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 36.96 3abl h ILE 15 CO -0.23 0.02 0.63 1.23 0.00 0.00 0.00 178.15 179.79 3abl h GLY 16 N 0.10 1.16 1.29 5.37 0.00 -0.88 -0.45 103.07 109.66 3abl h GLY 16 Ca 0.10 -0.23 -0.24 0.00 0.00 0.00 0.00 47.33 46.96 3abl h GLY 16 CO -0.15 -0.06 -0.92 -0.84 0.00 0.00 0.00 176.54 174.57 3abl h THR 17 N 0.48 1.30 0.22 4.70 2.02 -0.01 -1.74 112.91 119.89 3abl h THR 17 Ca 0.53 -2.18 -0.01 0.00 0.77 0.00 0.00 66.41 65.52 3abl h THR 17 Cb 1.23 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.88 3abl h THR 17 CO -0.25 0.68 -0.11 -0.07 0.37 0.00 0.00 175.52 176.13 3abl h LEU 18 N 0.41 -0.25 -0.98 2.58 3.38 -0.59 -1.59 115.31 118.27 3abl h LEU 18 Ca -0.09 -0.02 0.20 0.00 0.09 0.00 0.00 57.88 58.06 3abl h LEU 18 Cb 1.56 0.07 -0.11 0.00 0.09 0.00 0.00 40.66 42.26 3abl h LEU 18 CO 0.18 -0.14 0.58 1.88 0.09 0.00 0.00 178.44 181.02 3abl h TYR 19 N -0.34 1.01 -0.42 1.13 0.05 -1.05 -1.09 116.97 116.26 3abl h TYR 19 Ca -0.03 0.04 -0.13 0.00 0.05 0.00 0.00 58.73 58.66 3abl h TYR 19 Cb 0.26 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 3abl h TYR 19 CO -0.05 0.17 -0.25 -0.07 -1.05 0.00 0.00 178.16 176.92 3abl h LEU 20 N 0.69 0.94 -0.50 3.88 3.38 -1.08 0.74 115.31 123.34 3abl h LEU 20 Ca 0.58 -0.42 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 3abl h LEU 20 Cb 0.96 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 3abl h LEU 20 CO -0.41 1.15 0.22 -0.07 0.09 0.00 0.00 178.44 179.42 3abl h LEU 21 N 0.73 0.68 0.37 1.67 3.38 -0.81 -0.22 115.31 121.11 3abl h LEU 21 Ca 0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3abl h LEU 21 Cb 0.82 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3abl h LEU 21 CO 0.07 0.65 -0.18 0.15 0.09 0.00 0.00 178.44 179.22 3abl h PHE 22 N 0.67 -0.47 -0.78 1.13 3.57 -1.14 -2.53 116.94 117.39 3abl h PHE 22 Ca 0.17 -0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.81 3abl h PHE 22 Cb 0.17 0.15 -0.10 0.00 2.79 0.00 0.00 35.95 38.97 3abl h PHE 22 CO 0.00 -0.19 0.31 0.78 -2.23 0.00 0.00 178.31 176.98 3abl h GLY 23 N -0.69 1.20 0.96 2.40 0.00 -0.77 0.11 103.07 106.29 3abl h GLY 23 Ca -0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 3abl h GLY 23 CO 0.08 -0.12 0.21 0.00 0.00 0.00 0.00 176.54 176.71 3abl h ALA 24 N 1.57 0.58 0.02 3.60 0.00 -1.02 0.02 119.26 124.03 3abl h ALA 24 Ca 0.44 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 3abl h ALA 24 Cb 0.69 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3abl h ALA 24 CO -0.43 0.14 -0.01 2.35 0.00 0.00 0.00 179.25 181.31 3abl h TRP 25 N 0.58 -0.03 -0.70 0.00 7.01 -1.21 -2.72 115.95 118.88 3abl h TRP 25 Ca 0.15 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.27 3abl h TRP 25 Cb 0.13 0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.15 3abl h TRP 25 CO -0.01 0.20 0.47 0.00 -2.79 0.00 0.00 178.44 176.31 3abl h ALA 26 N 0.72 1.98 0.00 2.65 0.00 -0.67 -0.88 119.26 123.06 3abl h ALA 26 Ca -0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3abl h ALA 26 Cb 0.24 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3abl h ALA 26 CO 0.01 -0.14 -0.38 0.78 0.00 0.00 0.00 179.25 179.51 3abl h GLY 27 N 0.50 0.00 1.05 0.00 0.00 -0.75 -0.85 103.07 103.02 3abl h GLY 27 Ca 0.33 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.52 3abl h GLY 27 CO -0.11 0.00 -0.33 -0.33 0.00 0.00 0.00 176.54 175.77 3abl h MET 28 N 0.00 0.83 -0.06 4.80 2.07 -0.86 -0.78 114.93 120.93 3abl h MET 28 Ca -0.00 -0.44 -0.00 0.00 -2.07 0.00 0.00 59.70 57.19 3abl h MET 28 Cb 0.69 0.01 -0.00 0.00 -1.87 0.00 0.00 31.60 30.43 3abl h MET 28 CO 0.05 1.07 0.03 0.28 1.07 0.00 0.00 176.91 179.41 3abl h VAL 29 N 0.62 1.07 0.00 -2.22 2.07 -1.13 -1.00 116.25 115.66 3abl h VAL 29 Ca 0.06 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.27 3abl h VAL 29 Cb 0.92 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 3abl h VAL 29 CO 0.08 0.06 -0.51 1.23 0.02 0.00 0.00 177.57 178.45 3abl h GLY 30 N 0.01 0.00 0.92 2.17 0.00 -1.13 0.25 103.07 105.30 3abl h GLY 30 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 3abl h GLY 30 CO -0.00 0.00 -0.12 -0.84 0.00 0.00 0.00 176.54 175.57 3abl h THR 31 N 0.00 1.29 -0.43 4.70 2.02 -0.76 -1.21 112.91 118.53 3abl h THR 31 Ca -0.01 -1.21 -0.01 0.00 0.77 0.00 0.00 66.41 65.95 3abl h THR 31 Cb 0.95 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 3abl h THR 31 CO 0.07 0.39 0.22 0.00 0.37 0.00 0.00 175.52 176.57 3abl h ALA 32 N 0.78 0.55 -0.76 6.16 0.00 -0.76 -0.11 119.26 125.12 3abl h ALA 32 Ca 0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3abl h ALA 32 Cb 0.64 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3abl h ALA 32 CO 0.04 0.09 0.40 -0.07 0.00 0.00 0.00 179.25 179.70 3abl h LEU 33 N 0.55 0.96 -1.38 0.00 3.38 -0.85 -0.88 115.31 117.10 3abl h LEU 33 Ca 0.15 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 3abl h LEU 33 Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3abl h LEU 33 CO -0.02 0.80 -0.31 0.77 0.09 0.00 0.00 178.44 179.77 3abl h SER 34 N 1.05 0.00 1.11 -0.43 4.64 -0.92 -2.29 113.55 116.71 3abl h SER 34 Ca 0.26 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.45 3abl h SER 34 Cb 0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 3abl h SER 34 CO -0.04 0.31 -0.66 -0.07 -0.87 0.00 0.00 176.83 175.50 3abl h LEU 35 N 0.00 0.00 -0.56 5.97 3.38 0.29 -2.83 115.31 121.56 3abl h LEU 35 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3abl h LEU 35 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3abl h LEU 35 CO 0.04 0.66 0.04 -0.07 0.09 0.00 0.00 178.44 179.20 3abl h LEU 36 N 0.00 0.93 0.16 1.67 3.38 -0.73 0.38 115.31 121.10 3abl h LEU 36 Ca -0.01 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3abl h LEU 36 Cb 1.39 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3abl h LEU 36 CO 0.09 0.99 -0.08 0.40 0.09 0.00 0.00 178.44 179.93 3abl h ILE 37 N 0.85 0.89 0.00 1.22 2.04 -1.45 -1.37 117.51 119.68 3abl h ILE 37 Ca 0.16 -0.17 -0.08 0.00 1.00 0.00 0.00 64.86 65.77 3abl h ILE 37 Cb 0.48 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3abl h ILE 37 CO 0.02 0.04 -0.38 0.03 0.00 0.00 0.00 178.15 177.86 3abl h ARG 38 N -0.29 0.00 -0.39 2.37 2.47 -1.39 -2.12 114.38 115.03 3abl h ARG 38 Ca -0.02 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.67 3abl h ARG 38 Cb 0.23 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 3abl h ARG 38 CO 0.04 0.38 0.11 0.00 0.56 0.00 0.00 179.97 181.06 3abl h ALA 39 N 1.62 0.51 -0.63 0.04 0.00 -0.69 0.36 119.26 120.47 3abl h ALA 39 Ca -0.00 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.76 3abl h ALA 39 Cb 0.84 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 3abl h ALA 39 CO 0.05 0.16 0.38 1.49 0.00 0.00 0.00 179.25 181.33 3abl h GLU 40 N 0.48 0.73 -0.01 0.00 4.57 -1.04 -2.78 114.58 116.53 3abl h GLU 40 Ca 0.12 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 3abl h GLU 40 Cb 0.27 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 3abl h GLU 40 CO -0.00 0.48 -0.15 1.28 -1.18 0.00 0.00 179.01 179.44 3abl n LEU 41 N -4.73 0.77 -0.05 1.64 4.77 -0.81 -4.45 117.00 114.14 3abl n LEU 41 Ca 0.06 -0.15 0.15 0.00 -0.03 0.00 0.00 56.01 56.04 3abl n LEU 41 Cb 0.09 -0.14 0.73 0.00 -2.33 0.00 0.00 43.42 41.78 3abl n LEU 41 CO 0.32 0.14 0.98 0.61 -1.33 0.00 0.00 177.39 178.11 3abl n GLY 42 N 1.29 -1.09 3.32 -0.72 0.00 0.11 -4.49 105.19 103.60 3abl n GLY 42 Ca 0.14 -0.20 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 3abl n GLY 42 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3abl s GLN 43 N -2.43 0.96 0.66 1.61 -2.07 -1.26 -4.42 119.66 112.70 3abl s GLN 43 Ca 0.32 -0.47 -0.17 0.00 -1.82 0.00 0.00 55.36 53.21 3abl s GLN 43 Cb 0.20 0.43 -0.00 0.00 -1.09 0.00 0.00 33.01 32.55 3abl s GLN 43 CO 0.45 -0.34 1.25 -2.14 -1.32 0.00 0.00 175.29 173.19 3abl s PRO 44 N -2.87 2.54 0.00 9.60 0.02 -1.26 -4.79 135.00 138.23 3abl s PRO 44 Ca -0.03 1.94 0.00 0.00 0.02 0.00 0.00 61.00 62.93 3abl s PRO 44 Cb 0.00 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.66 3abl s PRO 44 CO -0.05 -1.58 0.00 0.41 -0.33 0.00 0.00 177.00 175.45 3abl n GLY 45 N 0.70 -0.71 3.15 0.52 0.00 -1.26 -5.02 105.19 102.56 3abl n GLY 45 Ca 0.15 -2.17 -0.31 0.00 0.00 0.00 0.00 46.02 43.69 3abl n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3abl s THR 46 N 0.00 1.86 -0.17 2.61 2.01 -1.26 -4.64 115.64 116.05 3abl s THR 46 Ca 0.00 -0.88 -0.16 0.00 0.31 0.00 0.00 61.69 60.96 3abl s THR 46 Cb 0.00 -1.64 -0.06 0.00 0.01 0.00 0.00 72.50 70.81 3abl s THR 46 CO 0.00 0.51 -0.31 -0.11 -0.69 0.00 0.00 174.62 174.03 3abl n LEU 47 N 3.85 1.91 0.00 4.42 7.94 -1.26 -4.91 117.00 128.96 3abl n LEU 47 Ca -0.20 0.40 0.00 0.00 -1.11 0.00 0.00 56.01 55.11 3abl n LEU 47 Cb 0.52 -0.77 0.00 0.00 0.53 0.00 0.00 43.42 43.70 3abl n LEU 47 CO 0.27 -0.29 0.00 0.18 -1.11 0.00 0.00 177.39 176.43 3abl n LEU 48 N -4.49 0.07 0.00 -1.96 4.77 -1.26 -5.10 117.00 109.03 3abl n LEU 48 Ca -0.13 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3abl n LEU 48 Cb 0.47 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3abl n LEU 48 CO 0.18 -0.48 0.00 0.61 -1.33 0.00 0.00 177.39 176.37 3abl n GLY 49 N 1.83 2.91 0.00 -0.72 0.00 -1.26 -5.12 105.19 102.84 3abl n GLY 49 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 3abl n GLY 49 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3abl n ASP 50 N 0.00 0.00 0.28 1.61 3.85 -1.26 -4.78 116.55 116.25 3abl n ASP 50 Ca 0.00 -0.44 0.17 0.00 -0.71 0.00 0.00 54.79 53.81 3abl n ASP 50 Cb 0.00 0.00 0.73 0.00 -1.35 0.00 0.00 41.12 40.50 3abl n ASP 50 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 3abl h ASP 51 N 0.00 0.00 0.70 -1.12 3.45 -1.99 -2.89 116.42 114.57 3abl h ASP 51 Ca 0.00 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.43 3abl h ASP 51 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3abl h ASP 51 CO 0.00 0.03 -0.37 -0.61 -1.57 0.00 0.00 179.24 176.72 3abl h GLN 52 N 0.00 -0.95 -0.30 3.56 5.75 -1.93 0.14 115.11 121.38 3abl h GLN 52 Ca -0.00 0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.51 3abl h GLN 52 Cb 0.47 0.22 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 3abl h GLN 52 CO 0.00 -0.63 -0.04 0.97 -2.65 0.00 0.00 178.83 176.48 3abl h ILE 53 N -0.99 1.20 -0.63 2.39 2.10 -1.85 -0.14 117.51 119.59 3abl h ILE 53 Ca -0.09 -0.82 -0.00 0.00 1.08 0.00 0.00 64.86 65.02 3abl h ILE 53 Cb 0.77 1.02 -0.03 0.00 -1.09 0.00 0.00 36.82 37.49 3abl h ILE 53 CO 0.13 0.28 0.38 0.22 -1.08 0.00 0.00 178.15 178.07 3abl h TYR 54 N 0.45 0.83 0.00 2.19 5.03 -1.27 -2.37 116.97 121.83 3abl h TYR 54 Ca 0.09 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.40 3abl h TYR 54 Cb 0.36 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.37 3abl h TYR 54 CO 0.01 0.56 -0.61 -0.91 -1.32 0.00 0.00 178.16 175.89 3abl h ASN 55 N 0.85 0.00 -0.61 -2.11 2.35 0.07 -0.34 115.58 115.78 3abl h ASN 55 Ca 0.22 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 3abl h ASN 55 Cb -0.02 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 3abl h ASN 55 CO -0.04 0.09 0.27 0.58 -1.65 0.00 0.00 177.43 176.67 3abl h VAL 56 N 0.00 1.22 -0.37 2.81 2.07 -0.75 0.17 116.25 121.40 3abl h VAL 56 Ca 0.00 -0.67 -0.16 0.00 0.82 0.00 0.00 66.70 66.69 3abl h VAL 56 Cb 0.77 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3abl h VAL 56 CO 0.00 0.27 -0.40 0.58 0.02 0.00 0.00 177.57 178.03 3abl h VAL 57 N 0.84 1.27 -0.60 2.57 2.07 -0.84 -2.04 116.25 119.52 3abl h VAL 57 Ca 0.21 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.11 3abl h VAL 57 Cb 0.17 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3abl h VAL 57 CO -0.02 0.53 0.22 0.58 0.02 0.00 0.00 177.57 178.90 3abl h VAL 58 N 0.74 1.24 -0.40 2.57 2.07 -0.97 0.17 116.25 121.66 3abl h VAL 58 Ca 0.06 -0.76 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 3abl h VAL 58 Cb 1.00 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3abl h VAL 58 CO 0.10 0.29 0.00 0.74 0.02 0.00 0.00 177.57 178.73 3abl h THR 59 N 0.85 1.26 -0.18 2.57 2.02 -0.90 -2.73 112.91 115.80 3abl h THR 59 Ca 0.20 -1.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.35 3abl h THR 59 Cb 0.24 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 3abl h THR 59 CO -0.01 0.34 -0.01 0.00 0.37 0.00 0.00 175.52 176.21 3abl h ALA 60 N 0.89 0.24 -0.86 6.16 0.00 -1.26 -2.34 119.26 122.09 3abl h ALA 60 Ca 0.11 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.89 3abl h ALA 60 Cb 0.47 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 3abl h ALA 60 CO 0.02 -0.04 -0.51 1.58 0.00 0.00 0.00 179.25 180.31 3abl n HIS 61 N -4.71 -0.38 0.14 0.00 -0.00 0.04 -1.20 115.22 109.11 3abl n HIS 61 Ca -0.05 1.07 -0.13 0.00 -0.00 0.00 0.00 57.72 58.61 3abl n HIS 61 Cb 0.23 -0.57 -0.06 0.00 -0.00 0.00 0.00 29.99 29.60 3abl n HIS 61 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3abl h ALA 62 N 0.36 -0.45 -0.39 1.57 0.00 -1.45 -1.47 119.26 117.42 3abl h ALA 62 Ca 0.14 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3abl h ALA 62 Cb 0.35 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 3abl h ALA 62 CO -0.81 -0.79 0.12 0.74 0.00 0.00 0.00 179.25 178.52 3abl h PHE 63 N -0.48 0.22 -0.28 0.00 0.04 -1.29 0.40 116.94 115.55 3abl h PHE 63 Ca 0.01 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.75 3abl h PHE 63 Cb 0.47 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 3abl h PHE 63 CO -0.19 0.08 -0.03 0.28 -0.60 0.00 0.00 178.31 177.85 3abl h VAL 64 N 0.27 1.27 -0.61 -0.55 2.07 -1.15 0.84 116.25 118.40 3abl h VAL 64 Ca 0.18 -0.99 -0.09 0.00 0.82 0.00 0.00 66.70 66.62 3abl h VAL 64 Cb 0.18 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3abl h VAL 64 CO -0.20 0.32 0.03 0.24 0.02 0.00 0.00 177.57 177.98 3abl h MET 65 N 0.28 1.05 0.20 1.57 2.86 -1.09 0.13 114.93 119.93 3abl h MET 65 Ca 0.08 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 3abl h MET 65 Cb 0.47 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.03 3abl h MET 65 CO 0.02 1.01 -0.09 0.82 1.06 0.00 0.00 176.91 179.73 3abl h ILE 66 N 0.95 0.25 0.00 -1.22 2.04 -0.89 -0.49 117.51 118.15 3abl h ILE 66 Ca 0.18 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 3abl h ILE 66 Cb 0.52 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 3abl h ILE 66 CO 0.02 0.07 -0.69 -0.26 0.00 0.00 0.00 178.15 177.29 3abl h PHE 67 N -1.04 0.00 0.00 1.37 0.04 -0.93 -2.74 116.94 113.64 3abl h PHE 67 Ca -0.03 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 3abl h PHE 67 Cb 0.32 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 3abl h PHE 67 CO 0.03 0.14 -1.19 1.19 -0.60 0.00 0.00 178.31 177.88 3abl n PHE 68 N -2.90 0.00 -0.06 -0.55 3.72 -0.50 -4.36 117.46 112.80 3abl n PHE 68 Ca 0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.32 3abl n PHE 68 Cb 0.60 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 39.02 3abl n PHE 68 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 3abl n MET 69 N -1.70 0.41 0.27 -1.08 1.56 0.34 -4.04 117.12 112.87 3abl n MET 69 Ca -0.01 0.16 -0.15 0.00 -0.27 0.00 0.00 57.70 57.43 3abl n MET 69 Cb 0.17 -1.21 -0.08 0.00 2.15 0.00 0.00 33.22 34.25 3abl n MET 69 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 3abl h VAL 70 N -0.77 0.41 -0.37 1.12 2.07 -1.09 -2.11 116.25 115.52 3abl h VAL 70 Ca -0.03 -0.33 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 3abl h VAL 70 Cb 0.80 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3abl h VAL 70 CO -0.02 0.05 -0.08 0.24 0.02 0.00 0.00 177.57 177.78 3abl h MET 71 N -0.91 0.71 -0.74 1.57 2.07 -1.74 0.14 114.93 116.02 3abl h MET 71 Ca -0.07 -0.27 0.10 0.00 -2.07 0.00 0.00 59.70 57.39 3abl h MET 71 Cb 0.61 -0.04 -0.07 0.00 -1.87 0.00 0.00 31.60 30.22 3abl h MET 71 CO 0.12 0.85 0.38 -1.35 1.07 0.00 0.00 176.91 177.98 3abl h PRO 72 N 0.51 0.62 -0.16 -0.22 0.11 -1.76 0.27 132.00 131.36 3abl h PRO 72 Ca 0.09 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.08 3abl h PRO 72 Cb 0.59 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 3abl h PRO 72 CO 0.03 0.41 -0.26 0.82 -0.21 0.00 0.00 178.00 178.80 3abl h ILE 73 N 0.64 1.35 0.01 4.15 2.04 -1.07 0.16 117.51 124.79 3abl h ILE 73 Ca 0.37 -1.48 -0.12 0.00 1.00 0.00 0.00 64.86 64.63 3abl h ILE 73 Cb 0.39 1.91 0.01 0.00 -0.74 0.00 0.00 36.82 38.39 3abl h ILE 73 CO -0.27 0.44 -0.47 0.24 0.00 0.00 0.00 178.15 178.09 3abl h MET 74 N 0.10 0.30 0.00 2.37 2.86 -0.48 0.14 114.93 120.22 3abl h MET 74 Ca 0.01 -0.34 -0.15 0.00 -2.06 0.00 0.00 59.70 57.17 3abl h MET 74 Cb 0.83 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 3abl h MET 74 CO 0.06 1.04 -1.19 -0.89 1.06 0.00 0.00 176.91 176.99 3abl n ILE 75 N -4.33 1.49 -0.12 -1.22 5.41 0.06 -1.58 119.36 119.07 3abl n ILE 75 Ca -0.10 0.02 -0.06 0.00 1.00 0.00 0.00 62.75 63.61 3abl n ILE 75 Cb 0.61 -2.19 0.12 0.00 -0.71 0.00 0.00 39.64 37.47 3abl n ILE 75 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 3abl h GLY 76 N -1.00 0.90 0.00 7.39 0.00 -1.37 -2.28 103.07 106.71 3abl h GLY 76 Ca -0.23 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.44 3abl h GLY 76 CO -0.14 0.61 0.00 0.61 0.00 0.00 0.00 176.54 177.62 3abl n GLY 77 N -0.48 0.50 0.36 4.60 0.00 0.53 -3.10 105.19 107.60 3abl n GLY 77 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 3abl n GLY 77 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3abl h PHE 78 N 0.00 1.16 -0.18 1.61 -1.00 -0.78 -2.28 116.94 115.47 3abl h PHE 78 Ca 0.00 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.74 3abl h PHE 78 Cb 0.00 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 39.18 3abl h PHE 78 CO 0.00 0.80 0.04 0.78 -1.61 0.00 0.00 178.31 178.32 3abl h GLY 79 N 1.21 0.32 1.61 -1.45 0.00 -0.70 0.18 103.07 104.23 3abl h GLY 79 Ca 0.30 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 3abl h GLY 79 CO -0.05 0.19 -0.28 3.43 0.00 0.00 0.00 176.54 179.83 3abl h ASN 80 N 0.10 0.46 0.02 0.19 2.35 -1.42 -0.73 115.58 116.55 3abl h ASN 80 Ca 0.06 -0.16 -0.17 0.00 -0.55 0.00 0.00 56.30 55.48 3abl h ASN 80 Cb 0.28 -0.13 0.01 0.00 0.05 0.00 0.00 38.32 38.54 3abl h ASN 80 CO 0.00 0.73 -0.67 -0.50 -1.65 0.00 0.00 177.43 175.35 3abl h TRP 81 N 0.40 0.63 0.18 1.19 4.06 -0.99 -3.39 115.95 118.04 3abl h TRP 81 Ca 0.05 -0.36 -0.34 0.00 2.06 0.00 0.00 58.89 60.30 3abl h TRP 81 Cb 0.70 -0.07 0.01 0.00 -1.00 0.00 0.00 29.16 28.81 3abl h TRP 81 CO 0.02 1.19 -1.72 -0.07 -3.56 0.00 0.00 178.44 174.30 3abl h LEU 82 N -0.11 0.60 0.25 -4.49 3.38 -0.61 -3.36 115.31 110.97 3abl h LEU 82 Ca -0.09 -0.93 -0.01 0.00 0.09 0.00 0.00 57.88 56.93 3abl h LEU 82 Cb 1.39 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3abl h LEU 82 CO 0.13 1.78 -0.12 0.58 0.09 0.00 0.00 178.44 180.90 3abl h VAL 83 N 0.07 0.81 -0.41 1.22 2.07 -1.27 0.92 116.25 119.65 3abl h VAL 83 Ca -0.34 -0.37 0.07 0.00 0.82 0.00 0.00 66.70 66.88 3abl h VAL 83 Cb 2.07 1.02 -0.06 0.00 -1.52 0.00 0.00 31.29 32.80 3abl h VAL 83 CO 0.17 0.08 0.02 -0.65 0.02 0.00 0.00 177.57 177.21 3abl h PRO 84 N -0.53 0.13 -0.74 1.57 0.11 -1.79 -1.97 132.00 128.79 3abl h PRO 84 Ca -0.03 -0.01 0.12 0.00 0.11 0.00 0.00 66.00 66.19 3abl h PRO 84 Cb 0.39 -0.03 -0.08 0.00 0.11 0.00 0.00 31.00 31.39 3abl h PRO 84 CO 0.06 0.08 0.33 -0.07 -0.21 0.00 0.00 178.00 178.19 3abl h LEU 85 N 0.13 0.38 -0.12 2.35 3.38 -1.57 -0.05 115.31 119.81 3abl h LEU 85 Ca 0.20 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3abl h LEU 85 Cb 0.28 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3abl h LEU 85 CO -0.31 0.19 0.00 0.23 0.09 0.00 0.00 178.44 178.63 3abl n MET 86 N -4.93 0.11 -0.10 1.13 2.81 0.27 -2.01 117.12 114.40 3abl n MET 86 Ca 0.13 0.18 0.03 0.00 -1.81 0.00 0.00 57.70 56.23 3abl n MET 86 Cb 0.35 -1.65 0.08 0.00 -0.71 0.00 0.00 33.22 31.29 3abl n MET 86 CO 0.00 0.00 0.00 0.44 1.51 0.00 0.00 175.97 177.92 3abl n ILE 87 N -1.84 0.94 -3.52 2.02 -5.35 -0.97 -4.78 119.36 105.87 3abl n ILE 87 Ca 0.05 -0.97 -0.21 0.00 -0.27 0.00 0.00 62.75 61.35 3abl n ILE 87 Cb 0.31 0.54 0.08 0.00 -1.74 0.00 0.00 39.64 38.84 3abl n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3abl n GLY 88 N 0.11 -0.46 3.91 3.28 0.00 -0.52 -3.95 105.19 107.56 3abl n GLY 88 Ca 0.07 0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 3abl n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abl s ALA 89 N -3.33 3.75 -0.12 4.61 0.00 -0.15 -4.64 121.76 121.89 3abl s ALA 89 Ca 0.37 -0.63 0.23 0.00 0.00 0.00 0.00 51.96 51.93 3abl s ALA 89 Cb -0.16 -2.15 0.59 0.00 0.00 0.00 0.00 23.12 21.40 3abl s ALA 89 CO 0.72 0.48 1.68 -1.00 0.00 0.00 0.00 175.76 177.65 3abl h PRO 90 N 2.27 0.00 0.00 0.00 0.13 -1.79 -3.41 132.00 129.20 3abl h PRO 90 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3abl h PRO 90 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3abl h PRO 90 CO 0.69 0.20 0.00 -3.47 -0.23 0.00 0.00 178.00 175.19 3abl n ASP 91 N -3.22 0.00 -4.94 1.44 -0.08 -1.26 -4.59 116.55 103.90 3abl n ASP 91 Ca 0.02 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.06 3abl n ASP 91 Cb 0.52 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.98 3abl n ASP 91 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 3abl s MET 92 N 1.10 3.37 0.27 -0.67 -1.94 -1.26 -4.83 119.30 115.34 3abl s MET 92 Ca 0.00 -0.31 -0.04 0.00 -1.71 0.00 0.00 55.69 53.63 3abl s MET 92 Cb 0.00 -2.59 0.35 0.00 2.01 0.00 0.00 34.83 34.60 3abl s MET 92 CO 0.00 -0.02 1.91 0.00 -0.01 0.00 0.00 175.02 176.90 3abl h ALA 93 N 0.58 1.29 -2.79 3.03 0.00 -1.92 -3.33 119.26 116.11 3abl h ALA 93 Ca -0.48 -0.10 -0.61 0.00 0.00 0.00 0.00 54.91 53.71 3abl h ALA 93 Cb 1.23 -0.33 -0.41 0.00 0.00 0.00 0.00 17.79 18.27 3abl h ALA 93 CO 0.60 0.60 -0.65 1.19 0.00 0.00 0.00 179.25 180.98 3abl n PHE 94 N -4.36 2.59 0.23 0.00 3.72 -1.26 -4.96 117.46 113.42 3abl n PHE 94 Ca 0.09 -4.12 0.11 0.00 -0.05 0.00 0.00 57.45 53.48 3abl n PHE 94 Cb 0.07 -0.48 0.48 0.00 -0.94 0.00 0.00 39.48 38.62 3abl n PHE 94 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3abl h PRO 95 N 5.16 0.00 0.04 -1.08 0.11 -1.88 0.93 132.00 135.28 3abl h PRO 95 Ca 0.17 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.08 3abl h PRO 95 Cb 0.76 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 3abl h PRO 95 CO 0.68 0.20 -1.07 -0.09 -0.21 0.00 0.00 178.00 177.50 3abl h ARG 96 N 0.00 0.08 -0.98 1.05 2.43 -1.87 -3.05 114.38 112.04 3abl h ARG 96 Ca -0.00 -0.15 0.22 0.00 -0.81 0.00 0.00 59.98 59.25 3abl h ARG 96 Cb 0.72 0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 30.23 3abl h ARG 96 CO 0.03 1.07 0.63 1.98 -1.51 0.00 0.00 179.97 182.16 3abl h MET 97 N -0.75 0.50 -0.37 0.20 4.05 -1.93 0.05 114.93 116.69 3abl h MET 97 Ca -0.27 -0.03 -0.05 0.00 -0.28 0.00 0.00 59.70 59.08 3abl h MET 97 Cb 1.41 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 32.08 3abl h MET 97 CO -0.07 0.33 0.03 -0.97 0.23 0.00 0.00 176.91 176.45 3abl h ASN 98 N 0.51 0.52 0.61 1.39 -1.24 -0.87 -1.73 115.58 114.78 3abl h ASN 98 Ca 0.55 -0.09 -0.08 0.00 0.71 0.00 0.00 56.30 57.39 3abl h ASN 98 Cb 1.21 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 40.11 3abl h ASN 98 CO -0.28 0.58 -0.38 -1.13 -1.29 0.00 0.00 177.43 174.92 3abl h ASN 99 N 0.54 0.00 -0.24 1.15 -1.24 -0.87 -2.97 115.58 111.95 3abl h ASN 99 Ca 0.12 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 56.99 3abl h ASN 99 Cb 0.31 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.35 3abl h ASN 99 CO 0.01 0.38 -0.36 -0.03 -1.29 0.00 0.00 177.43 176.14 3abl h MET 100 N 0.00 0.78 -0.72 6.67 4.05 -1.06 -1.41 114.93 123.24 3abl h MET 100 Ca -0.00 -0.39 0.11 0.00 -0.28 0.00 0.00 59.70 59.14 3abl h MET 100 Cb 0.79 0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 31.52 3abl h MET 100 CO 0.05 1.01 0.34 0.77 0.23 0.00 0.00 176.91 179.31 3abl h SER 101 N 0.64 0.40 -0.15 1.39 0.02 -1.33 0.26 113.55 114.78 3abl h SER 101 Ca 0.06 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3abl h SER 101 Cb 0.91 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.46 3abl h SER 101 CO 0.08 0.21 -0.02 0.15 -1.14 0.00 0.00 176.83 176.12 3abl h PHE 102 N 0.55 0.31 0.00 3.45 3.57 -1.39 -3.26 116.94 120.17 3abl h PHE 102 Ca 0.37 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.81 3abl h PHE 102 Cb 0.44 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.10 3abl h PHE 102 CO -0.12 0.53 0.00 -1.49 -2.23 0.00 0.00 178.31 175.00 3abl h TRP 103 N -0.01 0.00 0.00 0.41 4.06 -0.20 -0.81 115.95 119.41 3abl h TRP 103 Ca 0.04 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.99 3abl h TRP 103 Cb 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.58 3abl h TRP 103 CO 0.04 0.00 0.00 -0.07 -3.56 0.00 0.00 178.44 174.85 3abl h LEU 104 N 0.00 0.00 0.11 -4.49 3.38 -0.58 -3.35 115.31 110.38 3abl h LEU 104 Ca 0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 3abl h LEU 104 Cb 0.59 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3abl h LEU 104 CO 0.00 0.00 -1.90 0.18 0.09 0.00 0.00 178.44 176.81 3abl n LEU 105 N -2.40 2.53 -0.20 1.67 4.77 -0.31 -2.04 117.00 121.03 3abl n LEU 105 Ca -0.01 0.24 -0.01 0.00 -0.03 0.00 0.00 56.01 56.19 3abl n LEU 105 Cb 0.08 -1.10 0.09 0.00 -2.33 0.00 0.00 43.42 40.17 3abl n LEU 105 CO 0.13 0.77 1.01 -0.65 -1.33 0.00 0.00 177.39 177.33 3abl h PRO 106 N -0.09 0.46 -0.56 3.23 0.11 -1.72 -0.45 132.00 132.97 3abl h PRO 106 Ca -0.42 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.74 3abl h PRO 106 Cb 1.93 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 32.87 3abl h PRO 106 CO 0.04 0.30 0.23 -1.35 -0.21 0.00 0.00 178.00 177.02 3abl h PRO 107 N 0.47 0.43 -0.90 1.05 0.11 -1.73 0.10 132.00 131.52 3abl h PRO 107 Ca 0.28 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.42 3abl h PRO 107 Cb 0.28 -0.10 -0.06 0.00 0.11 0.00 0.00 31.00 31.24 3abl h PRO 107 CO -0.25 0.28 0.57 1.03 -0.21 0.00 0.00 178.00 179.43 3abl h SER 108 N 0.44 0.93 -0.15 -2.05 0.87 -1.12 -0.16 113.55 112.31 3abl h SER 108 Ca 0.27 0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.67 3abl h SER 108 Cb 0.28 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3abl h SER 108 CO -0.25 0.61 -0.53 0.15 -0.53 0.00 0.00 176.83 176.28 3abl h PHE 109 N 1.07 0.92 -0.63 2.24 -0.00 -0.65 -2.58 116.94 117.31 3abl h PHE 109 Ca 0.38 -0.32 0.02 0.00 -0.00 0.00 0.00 57.97 58.05 3abl h PHE 109 Cb 0.10 -0.17 -0.04 0.00 -0.00 0.00 0.00 35.95 35.84 3abl h PHE 109 CO -0.02 1.11 0.40 1.25 -0.00 0.00 0.00 178.31 181.04 3abl h LEU 110 N 0.57 0.66 -1.24 0.59 5.85 -0.36 0.98 115.31 122.35 3abl h LEU 110 Ca 0.02 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.78 3abl h LEU 110 Cb 1.11 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 3abl h LEU 110 CO 0.11 0.46 0.53 -0.07 -0.34 0.00 0.00 178.44 179.14 3abl h LEU 111 N 0.79 0.83 -0.08 2.25 3.38 -0.79 0.55 115.31 122.25 3abl h LEU 111 Ca 0.25 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 3abl h LEU 111 Cb -0.01 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3abl h LEU 111 CO -0.09 0.56 -0.14 0.25 0.09 0.00 0.00 178.44 179.11 3abl h LEU 112 N 0.96 0.26 -0.86 1.67 6.46 -0.91 -0.04 115.31 122.85 3abl h LEU 112 Ca 0.33 -0.56 0.13 0.00 -0.12 0.00 0.00 57.88 57.67 3abl h LEU 112 Cb 0.11 -0.07 -0.09 0.00 -0.73 0.00 0.00 40.66 39.87 3abl h LEU 112 CO -0.11 0.76 0.47 -0.07 -0.62 0.00 0.00 178.44 178.88 3abl h LEU 113 N -0.24 0.61 -0.49 2.25 3.38 -0.44 -2.43 115.31 117.94 3abl h LEU 113 Ca 0.00 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3abl h LEU 113 Cb 0.72 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 3abl h LEU 113 CO 0.03 0.28 0.25 0.00 0.09 0.00 0.00 178.44 179.09 3abl h ALA 114 N 1.54 0.63 -0.73 1.53 0.00 -0.62 -1.60 119.26 120.01 3abl h ALA 114 Ca 0.46 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.36 3abl h ALA 114 Cb 0.59 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 3abl h ALA 114 CO -0.33 0.18 0.37 1.03 0.00 0.00 0.00 179.25 180.49 3abl h SER 115 N 0.65 0.47 1.39 0.00 0.87 -0.54 -0.71 113.55 115.67 3abl h SER 115 Ca 0.17 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 3abl h SER 115 Cb 0.09 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3abl h SER 115 CO -0.02 0.26 -0.01 -1.54 -0.53 0.00 0.00 176.83 174.99 3abl n SER 116 N -4.86 0.67 0.00 6.23 3.41 -0.75 -3.80 113.62 114.52 3abl n SER 116 Ca 0.12 0.56 -0.14 0.00 -0.26 0.00 0.00 58.87 59.15 3abl n SER 116 Cb 0.29 -0.73 -0.14 0.00 -0.26 0.00 0.00 64.21 63.37 3abl n SER 116 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 3abl h MET 117 N 0.00 0.12 -6.94 4.33 2.86 -0.29 -3.40 114.93 111.61 3abl h MET 117 Ca 0.00 -0.20 -0.46 0.00 -2.06 0.00 0.00 59.70 56.98 3abl h MET 117 Cb 0.70 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 3abl h MET 117 CO 0.00 0.82 0.24 0.14 1.06 0.00 0.00 176.91 179.17 3abl s VAL 118 N -2.59 4.53 0.00 -2.22 -7.23 -0.40 -4.91 120.40 107.57 3abl s VAL 118 Ca -0.11 1.22 0.00 0.00 -1.81 0.00 0.00 61.98 61.28 3abl s VAL 118 Cb 0.07 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.39 3abl s VAL 118 CO 0.81 -0.32 0.00 -0.62 -0.31 0.00 0.00 175.10 174.66 3abl n GLU 119 N -0.68 0.00 -0.43 4.82 -0.58 -1.26 -1.21 120.64 121.30 3abl n GLU 119 Ca 0.05 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.88 3abl n GLU 119 Cb 0.54 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.66 3abl n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3abl n ALA 120 N 10.80 2.95 -0.53 0.62 0.00 -1.26 -5.10 120.51 127.98 3abl n ALA 120 Ca 0.00 -2.24 0.05 0.00 0.00 0.00 0.00 53.44 51.25 3abl n ALA 120 Cb 0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 3abl n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abl n GLY 121 N -0.45 -1.91 3.28 0.00 0.00 -0.35 -4.70 105.19 101.06 3abl n GLY 121 Ca 0.21 -1.32 -0.45 0.00 0.00 0.00 0.00 46.02 44.46 3abl n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abl s ALA 122 N -1.48 3.58 -0.83 4.61 0.00 -1.25 -4.77 121.76 121.62 3abl s ALA 122 Ca 0.00 -2.54 -0.00 0.00 0.00 0.00 0.00 51.96 49.42 3abl s ALA 122 Cb 0.00 -3.14 0.35 0.00 0.00 0.00 0.00 23.12 20.33 3abl s ALA 122 CO 0.00 -1.99 1.77 0.41 0.00 0.00 0.00 175.76 175.95 3abl n GLY 123 N 5.15 5.77 0.30 0.00 0.00 -1.26 -4.38 105.19 110.78 3abl n GLY 123 Ca -0.12 -2.57 0.05 0.00 0.00 0.00 0.00 46.02 43.38 3abl n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3abl n THR 124 N -0.37 0.00 -0.49 2.61 -2.24 -1.26 -4.75 114.28 107.78 3abl n THR 124 Ca 0.48 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 3abl n THR 124 Cb 0.31 1.16 -0.00 0.00 -2.10 0.00 0.00 70.33 69.69 3abl n THR 124 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3abl n GLY 125 N 0.84 -3.18 0.15 3.38 0.00 -1.26 -3.82 105.19 101.30 3abl n GLY 125 Ca 0.05 -1.17 0.11 0.00 0.00 0.00 0.00 46.02 45.02 3abl n GLY 125 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3abl n TRP 126 N -1.88 0.74 0.70 1.61 4.27 -1.26 0.18 117.44 121.79 3abl n TRP 126 Ca -0.00 0.36 0.12 0.00 -3.89 0.00 0.00 57.50 54.10 3abl n TRP 126 Cb 0.15 -1.08 0.27 0.00 -1.36 0.00 0.00 31.31 29.30 3abl n TRP 126 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 3abl n THR 127 N -2.24 0.30 -3.90 -1.67 -2.24 -1.26 -4.97 114.28 98.31 3abl n THR 127 Ca -0.01 -0.20 -0.29 0.00 -2.27 0.00 0.00 64.05 61.29 3abl n THR 127 Cb 0.08 -0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.15 3abl n THR 127 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3abl n VAL 128 N -1.97 -2.48 -2.05 2.28 0.31 0.13 -4.90 118.33 109.65 3abl n VAL 128 Ca 0.04 -0.12 -0.42 0.00 -0.01 0.00 0.00 64.34 63.83 3abl n VAL 128 Cb 0.41 -2.94 -0.03 0.00 -0.91 0.00 0.00 33.84 30.37 3abl n VAL 128 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 3abl s TYR 129 N -3.40 3.12 0.76 3.52 4.12 -1.26 -4.75 117.35 119.46 3abl s TYR 129 Ca 0.51 0.88 -0.11 0.00 0.02 0.00 0.00 57.07 58.37 3abl s TYR 129 Cb -0.26 -3.80 0.05 0.00 -1.52 0.00 0.00 41.96 36.43 3abl s TYR 129 CO 0.84 -2.79 1.08 -1.25 0.02 0.00 0.00 175.55 173.45 3abl s PRO 130 N 0.61 2.37 0.00 -1.71 0.04 -1.26 -2.09 135.00 132.96 3abl s PRO 130 Ca 0.64 1.02 0.29 0.00 0.04 0.00 0.00 61.00 62.99 3abl s PRO 130 Cb -0.41 -1.92 1.18 0.00 0.04 0.00 0.00 34.50 33.39 3abl s PRO 130 CO 0.35 -1.52 1.87 -2.30 0.04 0.00 0.00 177.00 175.43 3abl n PRO 131 N -3.42 0.13 -0.34 0.56 -0.02 -1.26 -4.79 135.00 125.86 3abl n PRO 131 Ca 0.08 -0.02 0.17 0.00 -2.02 0.00 0.00 63.50 61.71 3abl n PRO 131 Cb 0.54 -1.50 0.40 0.00 -0.02 0.00 0.00 33.50 32.91 3abl n PRO 131 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3abl h LEU 132 N 0.05 0.65 -0.65 2.45 5.85 -1.94 0.19 115.31 121.90 3abl h LEU 132 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3abl h LEU 132 Cb 0.45 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.48 3abl h LEU 132 CO 0.00 0.17 -0.08 0.00 -0.34 0.00 0.00 178.44 178.20 3abl n ALA 133 N -2.37 2.73 -1.30 1.25 0.00 -0.89 -3.34 120.51 116.59 3abl n ALA 133 Ca 0.25 -0.39 -0.30 0.00 0.00 0.00 0.00 53.44 53.00 3abl n ALA 133 Cb 0.70 -1.22 0.22 0.00 0.00 0.00 0.00 19.45 19.15 3abl n ALA 133 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3abl s GLY 134 N -2.18 1.62 0.00 0.00 0.00 0.65 -4.76 107.32 102.65 3abl s GLY 134 Ca 0.35 -0.93 0.22 0.00 0.00 0.00 0.00 44.72 44.36 3abl s GLY 134 CO 0.40 -0.11 1.72 1.16 0.00 0.00 0.00 173.10 176.26 3abl n ASN 135 N -4.43 0.00 -0.09 1.64 0.23 -1.26 -1.04 115.26 110.31 3abl n ASN 135 Ca 0.12 0.30 -0.21 0.00 -0.53 0.00 0.00 54.58 54.26 3abl n ASN 135 Cb 0.59 -0.42 -0.12 0.00 -2.08 0.00 0.00 39.78 37.75 3abl n ASN 135 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3abl h LEU 136 N 0.00 0.06 -0.02 -4.53 5.85 -1.93 -3.27 115.31 111.46 3abl h LEU 136 Ca 0.00 -0.60 0.00 0.00 0.84 0.00 0.00 57.88 58.12 3abl h LEU 136 Cb 0.32 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3abl h LEU 136 CO 0.00 1.50 -0.41 0.00 -0.34 0.00 0.00 178.44 179.19 3abl n ALA 137 N -3.31 3.35 -3.06 1.25 0.00 -1.21 -4.32 120.51 113.22 3abl n ALA 137 Ca -0.30 -0.31 -0.17 0.00 0.00 0.00 0.00 53.44 52.66 3abl n ALA 137 Cb 0.71 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.98 3abl n ALA 137 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3abl n HIS 138 N -1.47 -0.87 -2.39 0.00 8.25 -0.20 -4.90 115.22 113.64 3abl n HIS 138 Ca 0.06 -3.24 -0.34 0.00 -0.26 0.00 0.00 57.72 53.94 3abl n HIS 138 Cb 0.34 0.19 -0.02 0.00 1.12 0.00 0.00 29.99 31.62 3abl n HIS 138 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3abl s ALA 139 N -1.34 2.81 0.00 -1.41 0.00 -1.23 -4.53 121.76 116.06 3abl s ALA 139 Ca 0.35 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.91 3abl s ALA 139 Cb 0.29 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 20.14 3abl s ALA 139 CO -0.09 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.58 3abl n GLY 140 N -0.32 -2.82 0.19 0.00 0.00 -1.26 -4.75 105.19 96.23 3abl n GLY 140 Ca 0.10 -1.86 0.08 0.00 0.00 0.00 0.00 46.02 44.33 3abl n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abl h ALA 141 N 0.00 0.86 -0.13 4.61 0.00 -1.95 -3.38 119.26 119.27 3abl h ALA 141 Ca 0.00 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.72 3abl h ALA 141 Cb 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 3abl h ALA 141 CO 0.00 0.32 -0.39 0.77 0.00 0.00 0.00 179.25 179.95 3abl h SER 142 N 0.00 -1.23 -0.45 0.00 0.02 -1.85 0.12 113.55 110.16 3abl h SER 142 Ca -0.00 0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 3abl h SER 142 Cb 1.11 0.51 -0.02 0.00 0.14 0.00 0.00 62.40 64.13 3abl h SER 142 CO 0.03 -0.41 0.22 0.58 -1.14 0.00 0.00 176.83 176.11 3abl h VAL 143 N -0.47 1.17 -0.09 2.27 2.07 -1.84 -1.58 116.25 117.79 3abl h VAL 143 Ca 0.08 -0.51 -0.12 0.00 0.82 0.00 0.00 66.70 66.97 3abl h VAL 143 Cb 0.61 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3abl h VAL 143 CO -0.39 0.21 -0.47 0.44 0.02 0.00 0.00 177.57 177.38 3abl h ASP 144 N 0.69 0.22 -0.73 0.57 3.45 -1.37 -0.34 116.42 118.92 3abl h ASP 144 Ca 0.17 -0.10 -0.06 0.00 0.43 0.00 0.00 57.03 57.46 3abl h ASP 144 Cb 0.10 -0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 38.78 3abl h ASP 144 CO -0.02 0.66 0.21 -0.07 -1.57 0.00 0.00 179.24 178.45 3abl h LEU 145 N 0.17 1.08 -0.67 1.55 3.38 -0.04 -2.13 115.31 118.65 3abl h LEU 145 Ca 0.01 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 3abl h LEU 145 Cb 0.89 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 3abl h LEU 145 CO 0.07 1.01 0.20 0.74 0.09 0.00 0.00 178.44 180.56 3abl h THR 146 N 1.10 1.25 -0.41 0.22 2.02 -0.84 -1.84 112.91 114.42 3abl h THR 146 Ca 0.23 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 3abl h THR 146 Cb 0.33 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 3abl h THR 146 CO -0.00 0.34 0.15 0.40 0.37 0.00 0.00 175.52 176.78 3abl h ILE 147 N 0.98 1.20 -0.60 3.11 2.04 -0.86 -2.25 117.51 121.13 3abl h ILE 147 Ca 0.22 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 3abl h ILE 147 Cb 0.31 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 3abl h ILE 147 CO -0.01 0.23 0.23 -0.26 0.00 0.00 0.00 178.15 178.34 3abl h PHE 148 N 0.52 0.89 -0.61 1.37 0.04 -1.17 -1.40 116.94 116.58 3abl h PHE 148 Ca 0.14 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.77 3abl h PHE 148 Cb 0.21 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 3abl h PHE 148 CO 0.00 0.70 0.09 1.03 -0.60 0.00 0.00 178.31 179.53 3abl h SER 149 N 0.87 0.98 -0.46 2.17 0.87 -0.99 -1.45 113.55 115.55 3abl h SER 149 Ca 0.20 -0.27 -0.12 0.00 -1.23 0.00 0.00 61.79 60.38 3abl h SER 149 Cb 0.19 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 3abl h SER 149 CO -0.02 1.00 -0.17 -0.07 -0.53 0.00 0.00 176.83 177.04 3abl h LEU 150 N 0.92 0.96 -1.16 2.23 3.38 -0.88 0.27 115.31 121.04 3abl h LEU 150 Ca 0.18 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 3abl h LEU 150 Cb 0.44 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 3abl h LEU 150 CO 0.01 1.11 0.09 0.45 0.09 0.00 0.00 178.44 180.19 3abl h HIS 151 N 0.83 0.69 -0.14 1.13 3.86 -1.00 0.41 115.15 120.94 3abl h HIS 151 Ca 0.12 -0.06 -0.18 0.00 -1.16 0.00 0.00 60.37 59.09 3abl h HIS 151 Cb 0.72 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 29.00 3abl h HIS 151 CO 0.05 0.61 -0.63 -0.07 0.86 0.00 0.00 177.93 178.75 3abl h LEU 152 N 0.65 0.79 -0.88 2.43 3.38 -0.62 -1.42 115.31 119.64 3abl h LEU 152 Ca 0.15 -0.63 -0.04 0.00 0.09 0.00 0.00 57.88 57.45 3abl h LEU 152 Cb 0.28 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 3abl h LEU 152 CO 0.00 1.29 0.35 0.00 0.09 0.00 0.00 178.44 180.17 3abl h ALA 153 N 0.52 1.12 0.41 1.53 0.00 -0.76 -1.40 119.26 120.69 3abl h ALA 153 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 3abl h ALA 153 Cb 1.26 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3abl h ALA 153 CO 0.13 0.65 -0.25 0.78 0.00 0.00 0.00 179.25 180.56 3abl h GLY 154 N 1.16 -0.65 0.98 0.00 0.00 -0.10 -0.29 103.07 104.17 3abl h GLY 154 Ca 0.27 0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.87 3abl h GLY 154 CO -0.03 -0.25 0.21 -2.08 0.00 0.00 0.00 176.54 174.40 3abl h VAL 155 N -0.62 1.13 -0.24 4.60 2.07 -1.08 0.04 116.25 122.14 3abl h VAL 155 Ca -0.05 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 67.23 3abl h VAL 155 Cb 0.51 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 3abl h VAL 155 CO 0.05 0.13 -0.17 -1.28 0.02 0.00 0.00 177.57 176.32 3abl h SER 156 N 0.47 -0.55 -0.48 0.57 0.87 -1.05 -0.82 113.55 112.56 3abl h SER 156 Ca 0.13 0.11 -0.11 0.00 -1.23 0.00 0.00 61.79 60.69 3abl h SER 156 Cb 0.02 0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 3abl h SER 156 CO -0.02 -0.21 -0.11 0.28 -0.53 0.00 0.00 176.83 176.24 3abl h SER 157 N -0.16 0.96 -0.51 6.23 0.02 -0.67 -1.00 113.55 118.42 3abl h SER 157 Ca 0.14 -0.31 0.02 0.00 -0.84 0.00 0.00 61.79 60.79 3abl h SER 157 Cb 0.36 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 3abl h SER 157 CO -0.34 1.08 0.31 0.40 -1.14 0.00 0.00 176.83 177.14 3abl h ILE 158 N 0.86 1.07 -0.16 3.27 2.04 -0.72 -0.30 117.51 123.58 3abl h ILE 158 Ca 0.14 -0.21 -0.18 0.00 1.00 0.00 0.00 64.86 65.61 3abl h ILE 158 Cb 0.66 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 3abl h ILE 158 CO 0.05 0.11 -0.62 -0.07 0.00 0.00 0.00 178.15 177.62 3abl h LEU 159 N 0.62 0.65 -0.91 1.44 3.38 -1.11 -1.82 115.31 117.56 3abl h LEU 159 Ca 0.20 -0.37 0.14 0.00 0.09 0.00 0.00 57.88 57.94 3abl h LEU 159 Cb -0.01 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.46 3abl h LEU 159 CO -0.08 1.11 0.52 1.23 0.09 0.00 0.00 178.44 181.31 3abl h GLY 160 N 1.03 1.50 0.86 0.83 0.00 -1.08 -2.05 103.07 104.17 3abl h GLY 160 Ca -0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 3abl h GLY 160 CO 0.12 0.02 0.02 0.00 0.00 0.00 0.00 176.54 176.71 3abl h ALA 161 N 1.55 0.35 -0.26 3.60 0.00 -0.44 0.13 119.26 124.19 3abl h ALA 161 Ca 0.48 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3abl h ALA 161 Cb 0.62 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3abl h ALA 161 CO -0.33 0.06 0.16 0.82 0.00 0.00 0.00 179.25 179.97 3abl h ILE 162 N 0.25 1.05 -0.30 0.00 2.04 -1.24 0.64 117.51 119.95 3abl h ILE 162 Ca 0.08 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3abl h ILE 162 Cb 0.37 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 3abl h ILE 162 CO 0.01 0.06 -0.00 -1.13 0.00 0.00 0.00 178.15 177.09 3abl h ASN 163 N 0.34 -0.12 -0.51 1.72 -0.73 -1.21 -1.47 115.58 113.58 3abl h ASN 163 Ca 0.10 0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.31 3abl h ASN 163 Cb -0.02 0.12 -0.02 0.00 0.27 0.00 0.00 38.32 38.66 3abl h ASN 163 CO -0.04 -0.03 0.23 -0.26 -0.37 0.00 0.00 177.43 176.97 3abl h PHE 164 N 0.09 0.76 -0.37 0.67 -1.00 -0.41 0.15 116.94 116.83 3abl h PHE 164 Ca 0.14 -0.05 -0.08 0.00 2.81 0.00 0.00 57.97 60.80 3abl h PHE 164 Cb 0.19 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 3abl h PHE 164 CO -0.22 0.62 -0.07 0.82 -1.61 0.00 0.00 178.31 177.84 3abl h ILE 165 N 0.69 1.27 0.20 -0.55 2.04 -0.85 -2.02 117.51 118.29 3abl h ILE 165 Ca 0.17 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 3abl h ILE 165 Cb 0.16 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3abl h ILE 165 CO -0.02 0.38 -0.09 0.74 0.00 0.00 0.00 178.15 179.15 3abl h THR 166 N 0.50 0.85 -0.85 -0.27 2.02 -1.04 -1.55 112.91 112.57 3abl h THR 166 Ca 0.10 -0.21 0.19 0.00 0.77 0.00 0.00 66.41 67.26 3abl h THR 166 Cb 0.58 0.98 -0.11 0.00 -1.74 0.00 0.00 68.15 67.85 3abl h THR 166 CO 0.03 0.05 0.36 0.74 0.37 0.00 0.00 175.52 177.07 3abl h THR 167 N -0.36 0.54 0.00 3.16 2.02 -0.63 0.10 112.91 117.74 3abl h THR 167 Ca -0.03 -0.14 -0.19 0.00 0.77 0.00 0.00 66.41 66.81 3abl h THR 167 Cb 0.28 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 3abl h THR 167 CO 0.04 0.08 -1.15 0.40 0.37 0.00 0.00 175.52 175.26 3abl h ILE 168 N 0.42 1.03 0.11 3.11 2.04 -1.04 0.21 117.51 123.39 3abl h ILE 168 Ca 0.51 -2.64 -0.30 0.00 1.00 0.00 0.00 64.86 63.42 3abl h ILE 168 Cb 0.89 2.46 -0.01 0.00 -0.74 0.00 0.00 36.82 39.42 3abl h ILE 168 CO -0.49 0.59 -1.52 0.40 0.00 0.00 0.00 178.15 177.13 3abl h ILE 169 N 0.00 1.16 0.00 -0.67 1.08 -1.08 -3.40 117.51 114.59 3abl h ILE 169 Ca -0.11 -2.81 0.00 0.00 -0.39 0.00 0.00 64.86 61.55 3abl h ILE 169 Cb 1.69 2.75 0.00 0.00 -3.07 0.00 0.00 36.82 38.19 3abl h ILE 169 CO 0.08 0.81 -1.66 -3.20 -0.69 0.00 0.00 178.15 173.49 3abl n ASN 170 N -3.44 0.96 -0.64 1.72 5.15 0.01 -4.63 115.26 114.39 3abl n ASN 170 Ca -0.16 -0.12 0.05 0.00 -0.60 0.00 0.00 54.58 53.75 3abl n ASN 170 Cb 1.04 1.69 0.20 0.00 -0.53 0.00 0.00 39.78 42.18 3abl n ASN 170 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 3abl n MET 171 N -2.01 1.80 -1.91 1.20 2.81 0.73 -5.00 117.12 114.73 3abl n MET 171 Ca -0.02 -2.98 -0.30 0.00 -1.81 0.00 0.00 57.70 52.58 3abl n MET 171 Cb 0.43 -1.68 0.02 0.00 -0.71 0.00 0.00 33.22 31.29 3abl n MET 171 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3abl s LYS 172 N -3.06 3.31 0.54 0.03 1.02 -1.26 -4.49 119.74 115.82 3abl s LYS 172 Ca 0.39 0.61 -0.22 0.00 0.02 0.00 0.00 55.97 56.76 3abl s LYS 172 Cb 0.35 -2.07 -0.05 0.00 -0.52 0.00 0.00 37.83 35.53 3abl s LYS 172 CO 0.00 -0.73 1.36 -2.14 -0.92 0.00 0.00 175.35 172.93 3abl s PRO 173 N -5.23 3.19 0.50 -1.68 0.02 -1.25 -4.87 135.00 125.68 3abl s PRO 173 Ca 0.56 2.25 0.20 0.00 0.02 0.00 0.00 61.00 64.03 3abl s PRO 173 Cb -0.11 -2.29 1.27 0.00 0.02 0.00 0.00 34.50 33.39 3abl s PRO 173 CO 0.53 -1.15 2.02 -1.35 -0.33 0.00 0.00 177.00 176.71 3abl h PRO 174 N 1.53 0.11 0.00 5.54 0.10 -1.95 -1.15 132.00 136.18 3abl h PRO 174 Ca -0.51 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.58 3abl h PRO 174 Cb 1.30 -0.02 0.00 0.00 0.10 0.00 0.00 31.00 32.37 3abl h PRO 174 CO 0.58 0.07 -0.09 0.00 0.10 0.00 0.00 178.00 178.66 3abl n ALA 175 N -2.59 2.42 -2.64 -0.75 0.00 -1.26 -4.83 120.51 110.86 3abl n ALA 175 Ca 0.07 -0.08 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 3abl n ALA 175 Cb 0.44 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 18.43 3abl n ALA 175 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3abl s MET 176 N -3.07 4.15 0.86 0.00 0.00 -0.44 -4.96 119.30 115.84 3abl s MET 176 Ca 0.11 0.97 -0.11 0.00 0.00 0.00 0.00 55.69 56.65 3abl s MET 176 Cb 0.15 -3.67 0.15 0.00 0.00 0.00 0.00 34.83 31.46 3abl s MET 176 CO 0.60 -0.61 1.20 -1.54 0.00 0.00 0.00 175.02 174.67 3abl s SER 177 N 1.40 3.74 0.38 1.11 1.04 -1.26 -4.78 113.70 115.33 3abl s SER 177 Ca 0.37 0.24 0.08 0.00 0.48 0.00 0.00 55.95 57.11 3abl s SER 177 Cb -0.15 -0.48 0.77 0.00 0.10 0.00 0.00 66.02 66.27 3abl s SER 177 CO 0.09 -2.32 1.95 -0.61 0.98 0.00 0.00 173.24 173.33 3abl h GLN 178 N -1.22 0.38 -0.93 4.02 5.75 -1.96 -0.82 115.11 120.33 3abl h GLN 178 Ca -0.43 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.00 3abl h GLN 178 Cb 1.26 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 29.75 3abl h GLN 178 CO 0.45 0.41 0.00 0.66 -2.65 0.00 0.00 178.83 177.70 3abl n TYR 179 N -4.33 0.36 -1.09 3.99 4.01 -1.26 -2.62 117.16 116.21 3abl n TYR 179 Ca 0.01 -0.13 0.05 0.00 -0.16 0.00 0.00 57.90 57.66 3abl n TYR 179 Cb 0.21 -0.17 0.07 0.00 -0.31 0.00 0.00 39.34 39.13 3abl n TYR 179 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3abl n GLN 180 N 0.11 1.16 -4.05 -0.72 6.02 -0.31 -5.05 117.38 114.52 3abl n GLN 180 Ca 0.05 -1.78 -0.30 0.00 -0.01 0.00 0.00 57.00 54.96 3abl n GLN 180 Cb 0.42 -1.06 -0.06 0.00 1.02 0.00 0.00 30.24 30.55 3abl n GLN 180 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3abl s THR 181 N -1.53 4.54 0.82 5.09 -4.23 -1.08 -4.91 115.64 114.34 3abl s THR 181 Ca 0.15 -0.82 -0.11 0.00 -1.18 0.00 0.00 61.69 59.73 3abl s THR 181 Cb 0.13 -3.21 0.08 0.00 1.34 0.00 0.00 72.50 70.84 3abl s THR 181 CO 0.01 0.08 1.09 -2.84 -0.54 0.00 0.00 174.62 172.43 3abl s PRO 182 N -2.52 1.88 0.45 3.99 0.02 -1.26 -4.80 135.00 132.76 3abl s PRO 182 Ca 0.30 1.04 0.11 0.00 0.02 0.00 0.00 61.00 62.47 3abl s PRO 182 Cb -0.12 -1.86 0.99 0.00 0.02 0.00 0.00 34.50 33.53 3abl s PRO 182 CO 0.22 -1.87 2.05 -0.07 -0.33 0.00 0.00 177.00 177.01 3abl h LEU 183 N -1.29 0.22 -1.04 -5.54 3.38 -1.98 -0.39 115.31 108.67 3abl h LEU 183 Ca -0.46 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 3abl h LEU 183 Cb 1.25 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 3abl h LEU 183 CO 0.52 0.22 0.32 0.15 0.09 0.00 0.00 178.44 179.74 3abl h PHE 184 N 0.25 1.00 -0.04 1.13 3.57 -1.93 -0.82 116.94 120.10 3abl h PHE 184 Ca 0.06 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3abl h PHE 184 Cb 0.08 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.51 3abl h PHE 184 CO 0.00 0.74 -0.01 0.28 -2.23 0.00 0.00 178.31 177.09 3abl h VAL 185 N 0.99 1.30 -0.84 1.41 2.07 -1.44 -1.69 116.25 118.06 3abl h VAL 185 Ca 0.24 -0.93 0.21 0.00 0.82 0.00 0.00 66.70 67.04 3abl h VAL 185 Cb 0.13 1.85 -0.13 0.00 -1.52 0.00 0.00 31.29 31.62 3abl h VAL 185 CO -0.03 0.25 0.21 -0.50 0.02 0.00 0.00 177.57 177.52 3abl h TRP 186 N -0.29 0.31 -0.32 1.57 4.06 -1.32 -0.75 115.95 119.22 3abl h TRP 186 Ca 0.01 0.05 -0.06 0.00 2.06 0.00 0.00 58.89 60.95 3abl h TRP 186 Cb 0.41 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.55 3abl h TRP 186 CO 0.06 -0.18 -0.07 0.66 -3.56 0.00 0.00 178.44 175.35 3abl h SER 187 N 0.22 0.49 -0.06 -3.49 4.64 -0.71 -1.31 113.55 113.34 3abl h SER 187 Ca 0.51 -0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.66 3abl h SER 187 Cb 0.98 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3abl h SER 187 CO -0.62 0.62 -0.17 0.58 -0.87 0.00 0.00 176.83 176.36 3abl h VAL 188 N 0.48 1.44 -0.15 0.95 2.07 -1.03 -0.50 116.25 119.50 3abl h VAL 188 Ca 0.10 -1.55 0.05 0.00 0.82 0.00 0.00 66.70 66.11 3abl h VAL 188 Cb 0.43 2.30 -0.06 0.00 -1.52 0.00 0.00 31.29 32.44 3abl h VAL 188 CO 0.02 0.43 -0.21 -0.03 0.02 0.00 0.00 177.57 177.81 3abl h MET 189 N -0.29 -0.24 -0.31 1.57 -1.53 -1.02 0.55 114.93 113.66 3abl h MET 189 Ca -0.00 0.02 0.03 0.00 -3.44 0.00 0.00 59.70 56.30 3abl h MET 189 Cb 0.79 0.05 -0.03 0.00 -0.55 0.00 0.00 31.60 31.86 3abl h MET 189 CO 0.04 -0.16 0.11 0.82 0.14 0.00 0.00 176.91 177.86 3abl h ILE 190 N -0.25 0.92 -0.78 1.77 2.04 -1.30 -1.57 117.51 118.34 3abl h ILE 190 Ca 0.11 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.92 3abl h ILE 190 Cb 0.41 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 3abl h ILE 190 CO -0.30 0.04 0.49 0.74 0.00 0.00 0.00 178.15 179.13 3abl h THR 191 N 0.25 1.09 -0.66 -0.27 2.02 -0.73 -2.08 112.91 112.52 3abl h THR 191 Ca 0.14 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 3abl h THR 191 Cb 0.10 0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 66.55 3abl h THR 191 CO -0.14 0.17 0.29 0.00 0.37 0.00 0.00 175.52 176.22 3abl h ALA 192 N 1.34 1.27 -0.47 6.16 0.00 -0.54 -0.89 119.26 126.13 3abl h ALA 192 Ca 0.32 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 3abl h ALA 192 Cb 0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3abl h ALA 192 CO -0.13 0.55 -0.15 0.28 0.00 0.00 0.00 179.25 179.80 3abl h VAL 193 N 0.94 1.27 -0.54 0.00 2.07 -0.63 -0.47 116.25 118.89 3abl h VAL 193 Ca 0.23 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 3abl h VAL 193 Cb 0.14 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3abl h VAL 193 CO -0.03 0.44 0.21 -0.07 0.02 0.00 0.00 177.57 178.15 3abl h LEU 194 N 0.80 0.75 -0.54 2.57 3.38 -1.05 -1.69 115.31 119.52 3abl h LEU 194 Ca 0.12 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 57.97 3abl h LEU 194 Cb 0.69 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 3abl h LEU 194 CO 0.05 0.72 0.28 -0.07 0.09 0.00 0.00 178.44 179.51 3abl h LEU 195 N 0.73 0.40 -1.18 1.67 3.38 -0.98 -1.50 115.31 117.83 3abl h LEU 195 Ca 0.18 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 3abl h LEU 195 Cb 0.20 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3abl h LEU 195 CO -0.01 0.27 0.38 0.25 0.09 0.00 0.00 178.44 179.42 3abl h LEU 196 N 0.54 0.84 0.01 1.67 5.85 -0.44 -2.14 115.31 121.64 3abl h LEU 196 Ca 0.24 -0.06 -0.28 0.00 0.84 0.00 0.00 57.88 58.62 3abl h LEU 196 Cb 0.15 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3abl h LEU 196 CO -0.16 0.67 -1.57 -0.07 -0.34 0.00 0.00 178.44 176.96 3abl h LEU 197 N 0.95 0.03 0.10 2.25 3.38 -1.24 -3.40 115.31 117.38 3abl h LEU 197 Ca 0.24 -0.06 -0.34 0.00 0.09 0.00 0.00 57.88 57.82 3abl h LEU 197 Cb 0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3abl h LEU 197 CO -0.04 1.05 -1.86 -1.54 0.09 0.00 0.00 178.44 176.14 3abl n SER 198 N -3.14 2.08 -0.13 -0.43 3.41 -0.57 -4.33 113.62 110.51 3abl n SER 198 Ca -0.14 0.25 -0.08 0.00 -0.26 0.00 0.00 58.87 58.64 3abl n SER 198 Cb 1.03 -0.89 0.07 0.00 -0.26 0.00 0.00 64.21 64.17 3abl n SER 198 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3abl h LEU 199 N -0.14 0.88 -1.04 1.04 3.38 -1.61 -1.63 115.31 116.18 3abl h LEU 199 Ca -0.41 -0.29 0.15 0.00 0.09 0.00 0.00 57.88 57.42 3abl h LEU 199 Cb 1.89 -0.24 -0.09 0.00 0.09 0.00 0.00 40.66 42.31 3abl h LEU 199 CO 0.03 1.02 0.62 -0.65 0.09 0.00 0.00 178.44 179.55 3abl h PRO 200 N 0.78 0.86 -0.40 1.13 0.11 -1.77 0.15 132.00 132.86 3abl h PRO 200 Ca 0.12 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.09 3abl h PRO 200 Cb 0.66 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3abl h PRO 200 CO 0.05 0.57 -0.09 0.28 -0.21 0.00 0.00 178.00 178.59 3abl h VAL 201 N 0.88 1.27 -0.16 3.15 2.07 -1.51 -0.76 116.25 121.19 3abl h VAL 201 Ca 0.52 -1.18 0.04 0.00 0.82 0.00 0.00 66.70 66.91 3abl h VAL 201 Cb 0.66 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 3abl h VAL 201 CO -0.30 0.39 -0.11 0.25 0.02 0.00 0.00 177.57 177.83 3abl h LEU 202 N 0.58 -0.35 -1.39 2.57 5.85 -0.87 -1.10 115.31 120.59 3abl h LEU 202 Ca 0.10 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.94 3abl h LEU 202 Cb 0.61 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 3abl h LEU 202 CO 0.04 -0.15 0.44 0.00 -0.34 0.00 0.00 178.44 178.44 3abl h ALA 203 N 1.01 1.64 -0.67 1.25 0.00 -0.58 0.10 119.26 122.02 3abl h ALA 203 Ca 0.10 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3abl h ALA 203 Cb 0.25 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3abl h ALA 203 CO -0.23 0.28 0.09 0.00 0.00 0.00 0.00 179.25 179.39 3abl h ALA 204 N 1.61 0.90 -0.11 0.00 0.00 -0.46 -2.24 119.26 118.96 3abl h ALA 204 Ca 0.27 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3abl h ALA 204 Cb 0.10 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.65 3abl h ALA 204 CO -0.08 0.67 -0.46 0.78 0.00 0.00 0.00 179.25 180.16 3abl h GLY 205 N 1.04 0.56 1.99 0.00 0.00 0.29 -1.68 103.07 105.27 3abl h GLY 205 Ca 0.20 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.77 3abl h GLY 205 CO 0.02 0.68 -0.01 0.16 0.00 0.00 0.00 176.54 177.39 3abl h ILE 206 N 0.10 0.00 -0.17 2.60 3.07 -0.94 -2.04 117.51 120.12 3abl h ILE 206 Ca -0.03 -0.92 -0.03 0.00 1.55 0.00 0.00 64.86 65.44 3abl h ILE 206 Cb 1.10 1.91 -0.01 0.00 -0.27 0.00 0.00 36.82 39.56 3abl h ILE 206 CO 0.10 0.00 -0.01 0.74 -1.05 0.00 0.00 178.15 177.93 3abl h THR 207 N 0.00 1.26 -0.98 0.16 2.02 -1.23 -0.13 112.91 114.00 3abl h THR 207 Ca 0.00 -0.87 0.08 0.00 0.77 0.00 0.00 66.41 66.38 3abl h THR 207 Cb 0.96 1.50 -0.07 0.00 -1.74 0.00 0.00 68.15 68.80 3abl h THR 207 CO 0.00 0.26 0.63 0.24 0.37 0.00 0.00 175.52 177.02 3abl h MET 208 N 0.04 1.08 -0.53 6.66 2.86 -1.19 0.10 114.93 123.94 3abl h MET 208 Ca 0.05 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 3abl h MET 208 Cb 0.39 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 3abl h MET 208 CO 0.01 0.71 0.06 1.25 1.06 0.00 0.00 176.91 180.00 3abl h LEU 209 N 1.11 0.82 -0.44 1.22 5.85 -1.16 -0.97 115.31 121.74 3abl h LEU 209 Ca 0.44 -0.18 -0.18 0.00 0.84 0.00 0.00 57.88 58.80 3abl h LEU 209 Cb 0.24 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3abl h LEU 209 CO -0.18 0.85 -0.71 0.25 -0.34 0.00 0.00 178.44 178.31 3abl h LEU 210 N 0.81 0.44 -0.09 2.25 5.85 0.21 -0.55 115.31 124.24 3abl h LEU 210 Ca 0.17 -0.28 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 3abl h LEU 210 Cb 0.40 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 3abl h LEU 210 CO 0.01 1.01 -0.55 0.71 -0.34 0.00 0.00 178.44 179.28 3abl h THR 211 N 0.25 0.97 -0.21 1.05 1.35 -0.61 -1.22 112.91 114.50 3abl h THR 211 Ca -0.03 -2.31 -0.11 0.00 -0.55 0.00 0.00 66.41 63.41 3abl h THR 211 Cb 1.27 2.44 -0.01 0.00 -1.73 0.00 0.00 68.15 70.12 3abl h THR 211 CO 0.12 0.54 -0.36 0.44 -0.25 0.00 0.00 175.52 176.01 3abl h ASP 212 N 0.00 0.47 0.86 5.36 3.45 -0.72 0.27 116.42 126.12 3abl h ASP 212 Ca -0.01 -0.19 -0.15 0.00 0.43 0.00 0.00 57.03 57.12 3abl h ASP 212 Cb 1.39 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 40.01 3abl h ASP 212 CO 0.07 0.80 -0.70 0.03 -1.57 0.00 0.00 179.24 177.87 3abl h ARG 213 N 0.38 0.00 0.00 3.56 3.08 -0.86 -3.40 114.38 117.15 3abl h ARG 213 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3abl h ARG 213 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.86 3abl h ARG 213 CO 0.07 0.70 0.00 0.09 -1.07 0.00 0.00 179.97 179.75 3abl n ASN 214 N -3.56 0.02 0.00 7.04 3.02 -0.48 -4.75 115.26 116.55 3abl n ASN 214 Ca -0.00 -0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 3abl n ASN 214 Cb 0.72 0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.97 3abl n ASN 214 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3abl n LEU 215 N -0.09 1.49 -2.51 3.41 4.77 0.94 -5.00 117.00 120.01 3abl n LEU 215 Ca 0.00 -1.49 -0.19 0.00 -0.03 0.00 0.00 56.01 54.31 3abl n LEU 215 Cb 0.04 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.16 3abl n LEU 215 CO 0.00 0.37 -0.02 0.59 -1.33 0.00 0.00 177.39 177.00 3abl n ASN 216 N -0.36 -5.39 -4.90 -1.43 3.02 -1.05 -4.98 115.26 100.17 3abl n ASN 216 Ca 0.00 -0.22 -0.28 0.00 -0.03 0.00 0.00 54.58 54.05 3abl n ASN 216 Cb 0.30 -4.25 0.06 0.00 -0.61 0.00 0.00 39.78 35.29 3abl n ASN 216 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3abl s THR 217 N -3.06 2.76 -0.29 3.41 -4.23 -1.07 -4.99 115.64 108.17 3abl s THR 217 Ca 0.23 0.11 0.18 0.00 -1.18 0.00 0.00 61.69 61.03 3abl s THR 217 Cb -0.10 -3.22 0.48 0.00 1.34 0.00 0.00 72.50 71.00 3abl s THR 217 CO 0.28 -0.27 1.07 0.35 -0.54 0.00 0.00 174.62 175.52 3abl n THR 218 N -3.04 1.41 -0.26 3.99 -2.24 -1.26 -4.22 114.28 108.66 3abl n THR 218 Ca 0.07 -3.25 0.08 0.00 -2.27 0.00 0.00 64.05 58.68 3abl n THR 218 Cb 0.59 0.65 0.32 0.00 -2.10 0.00 0.00 70.33 69.80 3abl n THR 218 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 3abl h PHE 219 N 2.67 0.88 0.00 4.78 -1.00 -1.95 -2.85 116.94 119.48 3abl h PHE 219 Ca -0.04 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.77 3abl h PHE 219 Cb 1.25 -0.29 0.00 0.00 3.61 0.00 0.00 35.95 40.53 3abl h PHE 219 CO 0.56 0.41 -0.03 1.19 -1.61 0.00 0.00 178.31 178.83 3abl n PHE 220 N -4.52 0.00 -4.03 -0.55 3.72 -1.26 -1.42 117.46 109.39 3abl n PHE 220 Ca 0.14 -0.66 -0.33 0.00 -0.05 0.00 0.00 57.45 56.56 3abl n PHE 220 Cb 0.32 -0.09 -0.15 0.00 -0.94 0.00 0.00 39.48 38.62 3abl n PHE 220 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3abl s ASP 221 N -1.78 4.37 0.57 4.37 -1.08 -1.09 -3.01 116.67 119.03 3abl s ASP 221 Ca 0.14 -1.24 0.28 0.00 -0.52 0.00 0.00 52.55 51.21 3abl s ASP 221 Cb 0.13 -1.58 1.52 0.00 -1.46 0.00 0.00 42.92 41.53 3abl s ASP 221 CO 0.01 -0.18 2.01 -0.65 0.52 0.00 0.00 175.17 176.88 3abl h PRO 222 N 7.86 0.00 0.00 4.34 0.11 -1.85 -1.29 132.00 141.17 3abl h PRO 222 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3abl h PRO 222 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3abl h PRO 222 CO 0.50 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.29 3abl h ALA 223 N 1.66 1.00 -0.50 -0.75 0.00 -1.94 0.18 119.26 118.92 3abl h ALA 223 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3abl h ALA 223 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3abl h ALA 223 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3abl n GLY 224 N -0.26 2.85 0.76 0.00 0.00 -0.67 -4.94 105.19 102.94 3abl n GLY 224 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 3abl n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abl n GLY 225 N 0.81 0.74 1.30 -0.02 0.00 0.05 -4.96 105.19 103.11 3abl n GLY 225 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 3abl n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abl n GLY 226 N -2.14 -1.06 3.06 -0.02 0.00 -0.58 -4.90 105.19 99.55 3abl n GLY 226 Ca 0.00 -1.71 -0.07 0.00 0.00 0.00 0.00 46.02 44.23 3abl n GLY 226 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3abl s ASP 227 N -2.61 -0.10 0.50 1.61 3.68 -0.51 -3.40 116.67 115.84 3abl s ASP 227 Ca 0.25 0.55 0.26 0.00 2.13 0.00 0.00 52.55 55.74 3abl s ASP 227 Cb -0.01 1.31 1.33 0.00 -1.45 0.00 0.00 42.92 44.11 3abl s ASP 227 CO 0.17 -0.27 1.89 -0.65 0.13 0.00 0.00 175.17 176.45 3abl h PRO 228 N 8.16 0.13 0.00 4.34 0.11 -1.82 -2.01 132.00 140.91 3abl h PRO 228 Ca -0.19 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.83 3abl h PRO 228 Cb 1.14 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3abl h PRO 228 CO 0.22 0.09 -0.38 0.82 -0.21 0.00 0.00 178.00 178.54 3abl h ILE 229 N 0.14 0.97 -0.56 4.15 1.08 -1.93 -2.67 117.51 118.69 3abl h ILE 229 Ca 0.41 -1.49 0.01 0.00 -0.39 0.00 0.00 64.86 63.40 3abl h ILE 229 Cb 1.42 1.88 -0.03 0.00 -3.07 0.00 0.00 36.82 37.02 3abl h ILE 229 CO -0.06 0.38 0.36 0.25 -0.69 0.00 0.00 178.15 178.39 3abl h LEU 230 N 0.00 0.62 -0.53 1.44 5.85 -1.72 -1.47 115.31 119.51 3abl h LEU 230 Ca -0.00 -0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.81 3abl h LEU 230 Cb 0.85 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.63 3abl h LEU 230 CO 0.05 0.45 -0.16 0.22 -0.34 0.00 0.00 178.44 178.66 3abl h TYR 231 N 0.74 -0.37 -0.54 1.25 5.03 -1.55 -1.77 116.97 119.75 3abl h TYR 231 Ca 0.21 0.05 0.07 0.00 2.58 0.00 0.00 58.73 61.64 3abl h TYR 231 Cb -0.07 0.25 -0.06 0.00 1.55 0.00 0.00 36.73 38.40 3abl h TYR 231 CO -0.04 -0.26 0.23 1.96 -1.32 0.00 0.00 178.16 178.73 3abl h GLN 232 N -0.04 0.42 -0.19 1.82 4.20 -1.36 0.69 115.11 120.66 3abl h GLN 232 Ca 0.25 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 3abl h GLN 232 Cb 0.42 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3abl h GLN 232 CO -0.57 0.28 0.06 0.45 -0.67 0.00 0.00 178.83 178.38 3abl h HIS 233 N 0.44 0.31 -0.23 2.96 3.86 -0.66 -1.63 115.15 120.20 3abl h HIS 233 Ca 0.26 -0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.48 3abl h HIS 233 Cb 0.25 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.59 3abl h HIS 233 CO -0.14 0.40 -0.05 -0.07 0.86 0.00 0.00 177.93 178.93 3abl h LEU 234 N 0.13 -0.19 -0.26 2.43 3.38 -0.49 0.74 115.31 121.05 3abl h LEU 234 Ca 0.06 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.14 3abl h LEU 234 Cb 0.24 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3abl h LEU 234 CO -0.00 -0.07 0.01 0.15 0.09 0.00 0.00 178.44 178.62 3abl h PHE 235 N 0.01 0.01 0.00 1.13 3.57 0.46 -3.11 116.94 119.01 3abl h PHE 235 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 3abl h PHE 235 Cb 0.16 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.94 3abl h PHE 235 CO -0.23 -0.03 -0.26 -1.49 -2.23 0.00 0.00 178.31 174.07 3abl h TRP 236 N 0.09 0.00 -0.14 0.41 4.06 -1.16 0.21 115.95 119.43 3abl h TRP 236 Ca 0.12 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.03 3abl h TRP 236 Cb 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 3abl h TRP 236 CO -0.20 0.00 -0.11 0.35 -3.56 0.00 0.00 178.44 174.92 3abl h PHE 237 N 0.00 0.22 0.17 0.49 3.04 -0.78 -2.31 116.94 117.77 3abl h PHE 237 Ca 0.00 -0.02 -0.28 0.00 3.98 0.00 0.00 57.97 61.65 3abl h PHE 237 Cb 0.90 -0.06 0.01 0.00 2.56 0.00 0.00 35.95 39.36 3abl h PHE 237 CO 0.00 0.32 -1.36 0.35 -2.02 0.00 0.00 178.31 175.61 3abl h PHE 238 N 0.20 0.64 0.00 0.41 3.57 -1.50 -3.39 116.94 116.88 3abl h PHE 238 Ca 0.04 -0.47 -0.13 0.00 3.53 0.00 0.00 57.97 60.94 3abl h PHE 238 Cb 0.33 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 3abl h PHE 238 CO 0.00 1.53 -0.62 0.78 -2.23 0.00 0.00 178.31 177.77 3abl h GLY 239 N 0.11 0.00 0.25 2.40 0.00 -0.13 0.12 103.07 105.81 3abl h GLY 239 Ca -0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 3abl h GLY 239 CO 0.15 0.00 -0.12 0.84 0.00 0.00 0.00 176.54 177.41 3abl h HIS 240 N 0.00 -0.31 -0.94 5.60 -0.00 -1.68 -2.89 115.15 114.92 3abl h HIS 240 Ca -0.01 -0.01 0.28 0.00 -0.00 0.00 0.00 60.37 60.64 3abl h HIS 240 Cb 1.11 0.10 -0.16 0.00 -0.00 0.00 0.00 27.41 28.46 3abl h HIS 240 CO 0.00 -0.19 0.24 -1.35 -0.00 0.00 0.00 177.93 176.63 3abl h PRO 241 N -1.05 0.12 -0.82 5.26 0.11 -1.55 0.21 132.00 134.27 3abl h PRO 241 Ca -0.03 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 66.27 3abl h PRO 241 Cb 0.26 -0.03 -0.13 0.00 0.11 0.00 0.00 31.00 31.21 3abl h PRO 241 CO 0.06 0.08 0.17 1.49 -0.21 0.00 0.00 178.00 179.58 3abl h GLU 242 N 0.12 0.19 0.00 1.05 4.57 -0.99 -0.03 114.58 119.49 3abl h GLU 242 Ca 0.63 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.74 3abl h GLU 242 Cb 1.37 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.91 3abl h GLU 242 CO -0.75 0.13 -0.28 -0.39 -1.18 0.00 0.00 179.01 176.53 3abl h VAL 243 N 0.20 0.61 -0.05 0.32 -1.51 -0.73 0.31 116.25 115.41 3abl h VAL 243 Ca 0.49 -1.36 -0.12 0.00 -1.23 0.00 0.00 66.70 64.48 3abl h VAL 243 Cb 0.94 1.92 -0.01 0.00 -2.13 0.00 0.00 31.29 32.00 3abl h VAL 243 CO -0.63 0.27 -0.51 1.88 -1.23 0.00 0.00 177.57 177.35 3abl h TYR 244 N 0.00 0.15 -0.36 5.19 0.05 -1.02 -2.89 116.97 118.09 3abl h TYR 244 Ca -0.00 -0.05 -0.09 0.00 0.05 0.00 0.00 58.73 58.64 3abl h TYR 244 Cb 0.90 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.60 3abl h TYR 244 CO 0.00 0.61 -0.13 0.82 -1.05 0.00 0.00 178.16 178.41 3abl h ILE 245 N 0.10 1.28 0.00 -2.88 2.04 -0.68 -1.18 117.51 116.18 3abl h ILE 245 Ca 0.00 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 3abl h ILE 245 Cb 0.94 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.33 3abl h ILE 245 CO 0.07 0.41 -0.07 -0.07 0.00 0.00 0.00 178.15 178.49 3abl h LEU 246 N 0.52 0.00 0.00 1.44 3.38 -0.80 -3.35 115.31 116.50 3abl h LEU 246 Ca 0.09 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 3abl h LEU 246 Cb 0.66 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 3abl h LEU 246 CO 0.04 0.07 -1.86 0.00 0.09 0.00 0.00 178.44 176.78 3abl n ILE 247 N -3.38 0.69 -0.04 1.22 0.13 -1.00 -4.54 119.36 112.43 3abl n ILE 247 Ca -0.01 -0.51 -0.11 0.00 -1.10 0.00 0.00 62.75 61.02 3abl n ILE 247 Cb 0.22 -0.42 -0.04 0.00 -0.84 0.00 0.00 39.64 38.55 3abl n ILE 247 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 3abl h LEU 248 N 0.00 0.23 -1.92 9.51 3.38 -1.36 0.71 115.31 125.86 3abl h LEU 248 Ca -0.27 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 3abl h LEU 248 Cb 1.53 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 3abl h LEU 248 CO 0.01 0.28 -0.09 -0.65 0.09 0.00 0.00 178.44 178.09 3abl h PRO 249 N 0.17 0.00 -0.30 1.13 0.11 -1.76 0.33 132.00 131.68 3abl h PRO 249 Ca 0.06 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.10 3abl h PRO 249 Cb 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 3abl h PRO 249 CO -0.01 0.09 -0.08 0.78 -0.21 0.00 0.00 178.00 178.57 3abl h GLY 250 N 1.05 0.63 0.45 -0.55 0.00 -1.28 -0.23 103.07 103.14 3abl h GLY 250 Ca -0.00 -0.53 0.06 0.00 0.00 0.00 0.00 47.33 46.86 3abl h GLY 250 CO 0.01 0.48 -0.04 0.74 0.00 0.00 0.00 176.54 177.73 3abl h PHE 251 N 0.35 -0.09 -0.87 5.60 0.05 0.16 -1.28 116.94 120.86 3abl h PHE 251 Ca 0.08 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.88 3abl h PHE 251 Cb 0.57 0.09 -0.04 0.00 2.00 0.00 0.00 35.95 38.56 3abl h PHE 251 CO 0.05 -0.09 0.49 0.78 -0.18 0.00 0.00 178.31 179.36 3abl h GLY 252 N 0.04 1.30 1.07 -1.45 0.00 -0.79 -1.76 103.07 101.49 3abl h GLY 252 Ca 0.15 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 3abl h GLY 252 CO -0.28 0.56 0.13 -0.33 0.00 0.00 0.00 176.54 176.62 3abl h MET 253 N 1.22 1.13 -0.41 4.80 2.86 -0.57 -3.04 114.93 120.91 3abl h MET 253 Ca 0.31 -0.29 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 3abl h MET 253 Cb 0.01 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 3abl h MET 253 CO -0.05 1.02 0.07 0.82 1.06 0.00 0.00 176.91 179.83 3abl h ILE 254 N 1.06 1.24 -0.80 -1.22 1.08 -1.02 0.13 117.51 117.97 3abl h ILE 254 Ca 0.21 -0.86 0.13 0.00 -0.39 0.00 0.00 64.86 63.95 3abl h ILE 254 Cb 0.42 1.01 -0.09 0.00 -3.07 0.00 0.00 36.82 35.09 3abl h ILE 254 CO 0.01 0.30 0.40 0.28 -0.69 0.00 0.00 178.15 178.44 3abl h SER 255 N 0.53 0.49 -0.40 1.72 0.02 -1.30 0.13 113.55 114.74 3abl h SER 255 Ca 0.13 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.12 3abl h SER 255 Cb 0.36 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 3abl h SER 255 CO 0.01 0.23 0.09 0.45 -1.14 0.00 0.00 176.83 176.47 3abl h HIS 256 N 0.61 0.67 -0.08 3.45 3.86 -1.26 -2.30 115.15 120.11 3abl h HIS 256 Ca 0.42 -0.08 -0.02 0.00 -1.16 0.00 0.00 60.37 59.52 3abl h HIS 256 Cb 0.55 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.83 3abl h HIS 256 CO -0.10 0.65 -0.04 0.82 0.86 0.00 0.00 177.93 180.12 3abl h ILE 257 N 0.50 1.33 -0.56 2.45 2.04 -0.31 -0.67 117.51 122.30 3abl h ILE 257 Ca 0.12 -1.06 0.07 0.00 1.00 0.00 0.00 64.86 64.99 3abl h ILE 257 Cb 0.32 1.87 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 3abl h ILE 257 CO 0.00 0.30 0.23 0.58 0.00 0.00 0.00 178.15 179.26 3abl h VAL 258 N -0.21 0.84 -0.10 1.67 2.07 -1.06 0.22 116.25 119.68 3abl h VAL 258 Ca 0.02 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 3abl h VAL 258 Cb 0.49 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3abl h VAL 258 CO 0.01 0.08 0.01 0.74 0.02 0.00 0.00 177.57 178.43 3abl h THR 259 N 0.43 1.24 0.10 2.57 2.02 -1.34 -1.64 112.91 116.29 3abl h THR 259 Ca 0.27 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 3abl h THR 259 Cb 0.28 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 3abl h THR 259 CO -0.25 0.22 -0.05 0.22 0.37 0.00 0.00 175.52 176.03 3abl h TYR 260 N -0.08 -0.12 -0.10 3.16 3.20 -0.83 -2.20 116.97 120.00 3abl h TYR 260 Ca 0.03 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3abl h TYR 260 Cb 0.33 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.64 3abl h TYR 260 CO 0.03 -0.03 0.00 0.66 -1.64 0.00 0.00 178.16 177.18 3abl n TYR 261 N -5.12 0.13 1.21 -3.82 4.01 0.04 -1.86 117.16 111.74 3abl n TYR 261 Ca -0.08 -0.06 0.13 0.00 -0.16 0.00 0.00 57.90 57.72 3abl n TYR 261 Cb 0.10 0.00 0.36 0.00 -0.31 0.00 0.00 39.34 39.48 3abl n TYR 261 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3abl n SER 262 N -0.12 0.95 -0.33 7.72 7.64 -0.62 -0.97 113.62 127.89 3abl n SER 262 Ca 0.15 -0.80 -0.04 0.00 1.01 0.00 0.00 58.87 59.19 3abl n SER 262 Cb 0.22 0.16 -0.01 0.00 -1.01 0.00 0.00 64.21 63.56 3abl n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3abl n GLY 263 N 1.36 0.57 3.94 0.23 0.00 -0.78 -2.14 105.19 108.37 3abl n GLY 263 Ca 0.11 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 3abl n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3abl s LYS 264 N -2.75 3.41 0.02 1.61 -0.14 -0.85 -4.84 119.74 116.21 3abl s LYS 264 Ca 0.00 -0.62 0.26 0.00 -1.36 0.00 0.00 55.97 54.25 3abl s LYS 264 Cb 0.00 -2.95 0.67 0.00 -1.68 0.00 0.00 37.83 33.87 3abl s LYS 264 CO 0.00 0.52 1.53 0.36 -0.76 0.00 0.00 175.35 177.00 3abl n LYS 265 N -0.58 0.04 -3.54 1.68 2.85 -1.26 -4.51 118.16 112.84 3abl n LYS 265 Ca -0.07 0.01 -0.15 0.00 -1.05 0.00 0.00 58.31 57.05 3abl n LYS 265 Cb 0.54 -1.53 -0.06 0.00 -0.65 0.00 0.00 35.03 33.34 3abl n LYS 265 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 3abl s GLU 266 N -3.02 0.88 0.67 -1.58 -1.05 -1.26 -4.86 118.70 108.48 3abl s GLU 266 Ca 0.11 0.21 -0.14 0.00 -0.15 0.00 0.00 54.97 55.00 3abl s GLU 266 Cb 0.17 0.42 0.01 0.00 -0.44 0.00 0.00 34.13 34.28 3abl s GLU 266 CO 0.66 -0.28 1.10 -1.25 0.95 0.00 0.00 175.26 176.44 3abl s PRO 267 N -1.18 2.77 0.24 -4.83 0.04 -1.26 -4.93 135.00 125.85 3abl s PRO 267 Ca -0.07 1.30 -0.30 0.00 0.04 0.00 0.00 61.00 61.97 3abl s PRO 267 Cb -0.00 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 3abl s PRO 267 CO 0.07 -1.26 1.11 0.12 0.04 0.00 0.00 177.00 177.08 3abl s PHE 268 N -2.50 3.57 -0.99 0.56 5.36 -1.26 -4.18 117.98 118.54 3abl s PHE 268 Ca 0.65 1.64 -0.05 0.00 -0.96 0.00 0.00 56.93 58.21 3abl s PHE 268 Cb -0.19 -3.29 -0.06 0.00 -0.34 0.00 0.00 43.02 39.14 3abl s PHE 268 CO 0.44 -0.63 0.87 0.41 -1.46 0.00 0.00 175.22 174.86 3abl n GLY 269 N 1.55 -1.12 0.12 13.12 0.00 -1.26 -4.78 105.19 112.82 3abl n GLY 269 Ca 0.01 0.55 -0.07 0.00 0.00 0.00 0.00 46.02 46.50 3abl n GLY 269 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3abl h TYR 270 N -0.91 -0.11 -0.09 1.61 3.20 -2.01 -0.91 116.97 117.75 3abl h TYR 270 Ca -0.54 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.22 3abl h TYR 270 Cb 1.27 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 3abl h TYR 270 CO 0.28 -0.10 -0.54 0.52 -1.64 0.00 0.00 178.16 176.68 3abl h MET 271 N 0.01 0.26 -0.97 1.82 2.86 -1.96 -2.06 114.93 114.89 3abl h MET 271 Ca 0.12 -0.16 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3abl h MET 271 Cb 0.18 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.80 3abl h MET 271 CO -0.25 0.73 0.64 0.78 1.06 0.00 0.00 176.91 179.87 3abl h GLY 272 N 1.38 1.39 0.79 8.32 0.00 -1.76 -0.09 103.07 113.10 3abl h GLY 272 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 3abl h GLY 272 CO 0.08 0.44 -0.01 -0.33 0.00 0.00 0.00 176.54 176.73 3abl h MET 273 N 1.24 -0.01 -0.39 4.80 2.07 -0.71 0.57 114.93 122.51 3abl h MET 273 Ca 0.38 0.00 0.05 0.00 -2.07 0.00 0.00 59.70 58.06 3abl h MET 273 Cb -0.04 0.00 -0.08 0.00 -1.87 0.00 0.00 31.60 29.62 3abl h MET 273 CO -0.11 0.20 -0.55 0.28 1.07 0.00 0.00 176.91 177.81 3abl h VAL 274 N -0.23 0.01 -0.72 -2.22 2.07 -1.32 -0.97 116.25 112.87 3abl h VAL 274 Ca -0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 3abl h VAL 274 Cb 0.22 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 29.90 3abl h VAL 274 CO 0.00 0.00 0.25 -0.25 0.02 0.00 0.00 177.57 177.59 3abl h TRP 275 N -0.41 0.41 -0.28 1.57 7.01 -0.92 -1.80 115.95 121.54 3abl h TRP 275 Ca 0.08 0.04 -0.09 0.00 2.11 0.00 0.00 58.89 61.03 3abl h TRP 275 Cb 0.60 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.59 3abl h TRP 275 CO -0.71 0.01 -0.17 0.00 -2.79 0.00 0.00 178.44 174.78 3abl h ALA 276 N 1.55 0.40 -0.59 2.65 0.00 -0.60 -1.04 119.26 121.63 3abl h ALA 276 Ca 0.40 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3abl h ALA 276 Cb 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3abl h ALA 276 CO -0.43 0.31 0.15 0.52 0.00 0.00 0.00 179.25 179.81 3abl h MET 277 N 0.35 0.93 -0.52 0.00 2.86 -0.74 -1.67 114.93 116.14 3abl h MET 277 Ca 0.06 -0.22 0.05 0.00 -2.06 0.00 0.00 59.70 57.53 3abl h MET 277 Cb 0.70 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.19 3abl h MET 277 CO 0.05 0.85 0.26 0.52 1.06 0.00 0.00 176.91 179.65 3abl h MET 278 N 0.84 0.49 -0.39 1.72 2.07 -1.17 -0.42 114.93 118.08 3abl h MET 278 Ca 0.19 -0.03 -0.10 0.00 -2.07 0.00 0.00 59.70 57.68 3abl h MET 278 Cb 0.33 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 29.94 3abl h MET 278 CO -0.00 0.33 -0.17 0.77 1.07 0.00 0.00 176.91 178.91 3abl h SER 279 N 0.51 0.81 -0.71 1.22 0.02 -1.06 0.21 113.55 114.54 3abl h SER 279 Ca 0.23 -0.40 -0.07 0.00 -0.84 0.00 0.00 61.79 60.72 3abl h SER 279 Cb 0.15 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 3abl h SER 279 CO -0.17 1.03 0.18 0.40 -1.14 0.00 0.00 176.83 177.13 3abl h ILE 280 N 0.59 1.26 -0.17 3.27 2.04 -1.22 0.98 117.51 124.27 3abl h ILE 280 Ca 0.09 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 3abl h ILE 280 Cb 0.71 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3abl h ILE 280 CO 0.05 0.37 0.01 1.23 0.00 0.00 0.00 178.15 179.82 3abl h GLY 281 N 1.09 0.32 1.01 5.37 0.00 -0.64 0.87 103.07 111.09 3abl h GLY 281 Ca 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 3abl h GLY 281 CO 0.00 0.21 -0.25 -2.75 0.00 0.00 0.00 176.54 173.75 3abl h PHE 282 N 0.07 -0.64 -0.21 5.60 3.57 -0.47 -2.68 116.94 122.18 3abl h PHE 282 Ca 0.05 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.60 3abl h PHE 282 Cb 0.35 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 3abl h PHE 282 CO 0.03 -0.40 0.17 -0.07 -2.23 0.00 0.00 178.31 175.82 3abl h LEU 283 N -0.69 0.00 -1.57 0.59 3.38 -0.77 0.76 115.31 117.02 3abl h LEU 283 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3abl h LEU 283 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3abl h LEU 283 CO 0.11 0.00 0.00 1.23 0.09 0.00 0.00 178.44 179.87 3abl h GLY 284 N 0.00 0.00 0.92 0.83 0.00 -0.45 -2.60 103.07 101.77 3abl h GLY 284 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3abl h GLY 284 CO -0.00 0.00 -0.63 0.69 0.00 0.00 0.00 176.54 176.60 3abl n PHE 285 N -2.47 0.15 -1.28 5.60 3.72 0.26 -3.35 117.46 120.09 3abl n PHE 285 Ca -0.01 0.04 0.04 0.00 -0.05 0.00 0.00 57.45 57.47 3abl n PHE 285 Cb 0.10 -0.35 0.20 0.00 -0.94 0.00 0.00 39.48 38.50 3abl n PHE 285 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 3abl n ILE 286 N -1.69 2.29 -0.66 4.37 -5.35 -0.98 -4.72 119.36 112.62 3abl n ILE 286 Ca 0.04 -2.51 0.00 0.00 -0.27 0.00 0.00 62.75 60.02 3abl n ILE 286 Cb 0.37 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 3abl n ILE 286 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 3abl n VAL 287 N -1.03 0.21 -0.11 7.28 0.24 -1.26 -4.90 118.33 118.75 3abl n VAL 287 Ca 0.24 -0.27 0.10 0.00 -2.04 0.00 0.00 64.34 62.37 3abl n VAL 287 Cb 0.86 1.16 0.46 0.00 -1.47 0.00 0.00 33.84 34.84 3abl n VAL 287 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 3abl h TRP 288 N 0.00 0.53 0.00 6.34 0.09 -1.84 -1.95 115.95 119.11 3abl h TRP 288 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 58.89 58.99 3abl h TRP 288 Cb 0.63 -0.17 0.00 0.00 0.08 0.00 0.00 29.16 29.70 3abl h TRP 288 CO 0.00 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.79 3abl n ALA 289 N -2.50 2.14 0.87 0.11 0.00 -1.26 -1.55 120.51 118.32 3abl n ALA 289 Ca 0.10 -0.09 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3abl n ALA 289 Cb 0.32 -1.24 0.43 0.00 0.00 0.00 0.00 19.45 18.96 3abl n ALA 289 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3abl n HIS 290 N -0.91 0.00 -0.25 0.00 1.44 -0.74 -1.03 115.22 113.73 3abl n HIS 290 Ca 0.11 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.92 3abl n HIS 290 Cb 0.05 -0.11 0.31 0.00 0.12 0.00 0.00 29.99 30.36 3abl n HIS 290 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3abl n HIS 291 N -1.11 1.12 -2.52 -1.40 8.25 -0.59 -4.32 115.22 114.64 3abl n HIS 291 Ca 0.10 -0.49 0.03 0.00 -0.26 0.00 0.00 57.72 57.10 3abl n HIS 291 Cb 0.08 -0.11 0.02 0.00 1.12 0.00 0.00 29.99 31.10 3abl n HIS 291 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3abl n MET 292 N 1.25 0.14 0.12 -0.41 2.00 -0.20 -4.89 117.12 115.13 3abl n MET 292 Ca 0.23 -2.10 0.12 0.00 0.00 0.00 0.00 57.70 55.96 3abl n MET 292 Cb 0.69 -0.12 0.46 0.00 0.00 0.00 0.00 33.22 34.25 3abl n MET 292 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 3abl n PHE 293 N 0.39 0.84 0.47 2.03 3.72 -1.24 -2.80 117.46 120.88 3abl n PHE 293 Ca 0.05 0.29 0.11 0.00 -0.05 0.00 0.00 57.45 57.85 3abl n PHE 293 Cb 1.11 -0.97 0.17 0.00 -0.94 0.00 0.00 39.48 38.84 3abl n PHE 293 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3abl n THR 294 N -2.23 0.36 0.85 4.37 -2.24 -1.26 -4.62 114.28 109.50 3abl n THR 294 Ca 0.04 -0.68 0.13 0.00 -2.27 0.00 0.00 64.05 61.27 3abl n THR 294 Cb 0.31 1.12 0.54 0.00 -2.10 0.00 0.00 70.33 70.20 3abl n THR 294 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3abl n VAL 295 N 1.35 0.26 0.00 2.28 0.24 -1.12 -4.92 118.33 116.42 3abl n VAL 295 Ca 0.17 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 3abl n VAL 295 Cb 0.57 -0.59 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 3abl n VAL 295 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3abl n GLY 296 N 1.25 1.31 3.86 7.63 0.00 -1.26 -5.13 105.19 112.85 3abl n GLY 296 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3abl n GLY 296 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3abl s MET 297 N -0.27 3.84 0.57 1.61 1.00 -1.26 -5.03 119.30 119.75 3abl s MET 297 Ca 0.00 0.79 -0.20 0.00 0.00 0.00 0.00 55.69 56.28 3abl s MET 297 Cb 0.00 -2.19 -0.05 0.00 0.00 0.00 0.00 34.83 32.58 3abl s MET 297 CO 0.00 -0.26 1.09 -0.25 0.00 0.00 0.00 175.02 175.60 3abl n ASP 298 N -1.72 1.40 -0.35 3.03 8.00 -1.26 -4.81 116.55 120.83 3abl n ASP 298 Ca 0.05 0.88 0.02 0.00 0.71 0.00 0.00 54.79 56.45 3abl n ASP 298 Cb 0.54 -1.44 0.16 0.00 -0.02 0.00 0.00 41.12 40.36 3abl n ASP 298 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 3abl h VAL 299 N 0.87 1.08 -0.71 2.53 3.04 -1.99 -1.89 116.25 119.19 3abl h VAL 299 Ca -0.49 -0.39 -0.04 0.00 -1.01 0.00 0.00 66.70 64.77 3abl h VAL 299 Cb 1.34 -0.15 -0.03 0.00 -2.01 0.00 0.00 31.29 30.45 3abl h VAL 299 CO 0.53 0.21 0.28 0.44 -1.01 0.00 0.00 177.57 178.02 3abl h ASP 300 N 1.13 0.98 -0.26 3.17 3.32 -1.98 0.16 116.42 122.93 3abl h ASP 300 Ca 0.41 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.29 3abl h ASP 300 Cb 0.15 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 3abl h ASP 300 CO -0.17 0.88 0.16 0.74 -1.72 0.00 0.00 179.24 179.14 3abl h THR 301 N 1.01 1.09 -0.24 0.35 2.02 -1.75 -0.16 112.91 115.23 3abl h THR 301 Ca 0.24 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 3abl h THR 301 Cb 0.21 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 3abl h THR 301 CO -0.02 0.08 -0.01 0.03 0.37 0.00 0.00 175.52 175.97 3abl h ARG 302 N 0.34 0.35 -0.13 6.66 3.08 -0.90 -0.84 114.38 122.95 3abl h ARG 302 Ca 0.10 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3abl h ARG 302 Cb -0.01 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 3abl h ARG 302 CO -0.02 0.39 -0.01 0.00 -1.07 0.00 0.00 179.97 179.26 3abl h ALA 303 N 1.65 0.17 -0.31 0.04 0.00 -0.34 -1.61 119.26 118.87 3abl h ALA 303 Ca 0.08 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3abl h ALA 303 Cb 0.25 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3abl h ALA 303 CO 0.01 -0.11 0.12 -0.92 0.00 0.00 0.00 179.25 178.34 3abl h TYR 304 N -0.05 0.22 0.00 0.00 3.20 -0.74 -2.62 116.97 116.98 3abl h TYR 304 Ca 0.03 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 3abl h TYR 304 Cb 0.40 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3abl h TYR 304 CO 0.04 0.11 -0.20 0.74 -1.64 0.00 0.00 178.16 177.21 3abl h PHE 305 N 0.27 0.00 0.20 -3.82 0.04 -1.03 -1.44 116.94 111.16 3abl h PHE 305 Ca 0.13 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 3abl h PHE 305 Cb 0.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 3abl h PHE 305 CO -0.12 0.20 -0.10 1.15 -0.60 0.00 0.00 178.31 178.84 3abl h THR 306 N 0.00 0.86 -0.10 -1.55 2.02 -1.11 -1.81 112.91 111.23 3abl h THR 306 Ca -0.00 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 3abl h THR 306 Cb 0.38 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.11 3abl h THR 306 CO 0.03 0.18 0.06 0.28 0.37 0.00 0.00 175.52 176.44 3abl h SER 307 N -0.75 0.12 0.14 4.18 0.02 -1.22 -1.62 113.55 114.43 3abl h SER 307 Ca -0.03 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.82 3abl h SER 307 Cb 0.50 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 3abl h SER 307 CO 0.05 0.13 -0.22 0.00 -1.14 0.00 0.00 176.83 175.64 3abl h ALA 308 N 1.00 1.47 -0.36 3.77 0.00 -1.33 -1.92 119.26 121.89 3abl h ALA 308 Ca 0.04 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3abl h ALA 308 Cb 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3abl h ALA 308 CO -0.01 0.38 -0.23 1.15 0.00 0.00 0.00 179.25 180.55 3abl h THR 309 N 0.14 1.29 -0.10 0.00 2.02 -0.99 -3.25 112.91 112.01 3abl h THR 309 Ca 0.02 -1.37 -0.05 0.00 0.77 0.00 0.00 66.41 65.78 3abl h THR 309 Cb 0.47 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 3abl h THR 309 CO 0.03 0.45 -0.17 0.24 0.37 0.00 0.00 175.52 176.45 3abl h MET 310 N 0.57 0.16 0.00 6.66 2.86 -0.50 -2.97 114.93 121.70 3abl h MET 310 Ca 0.07 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 3abl h MET 310 Cb 0.79 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.42 3abl h MET 310 CO 0.06 0.33 -0.12 0.82 1.06 0.00 0.00 176.91 179.06 3abl h ILE 311 N 0.15 0.83 0.00 -1.22 2.04 -1.52 -0.51 117.51 117.28 3abl h ILE 311 Ca 0.03 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.42 3abl h ILE 311 Cb 0.39 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 3abl h ILE 311 CO 0.03 0.12 0.00 0.40 0.00 0.00 0.00 178.15 178.70 3abl h ILE 312 N 0.00 0.00 0.00 -0.67 2.04 -1.66 -1.48 117.51 115.74 3abl h ILE 312 Ca -0.00 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3abl h ILE 312 Cb 0.26 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3abl h ILE 312 CO 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 178.15 178.07 3abl h ALA 313 N 2.04 1.32 0.75 1.87 0.00 -1.29 -2.68 119.26 121.27 3abl h ALA 313 Ca 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3abl h ALA 313 Cb 0.12 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.90 3abl h ALA 313 CO 0.00 0.12 -0.36 0.82 0.00 0.00 0.00 179.25 179.83 3abl h ILE 314 N 0.00 0.00 -0.11 0.00 2.04 -1.47 0.12 117.51 118.09 3abl h ILE 314 Ca -0.00 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3abl h ILE 314 Cb 0.27 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 3abl h ILE 314 CO 0.01 0.00 0.01 1.55 0.00 0.00 0.00 178.15 179.72 3abl h PRO 315 N -1.24 0.15 -0.37 2.37 0.13 -1.74 -2.38 132.00 128.91 3abl h PRO 315 Ca -0.10 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.91 3abl h PRO 315 Cb 0.77 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 3abl h PRO 315 CO 0.17 0.16 -0.15 1.15 -0.23 0.00 0.00 178.00 179.09 3abl h THR 316 N 0.15 1.28 -0.85 1.56 2.02 -1.40 -2.68 112.91 112.99 3abl h THR 316 Ca 0.04 -1.27 0.00 0.00 0.77 0.00 0.00 66.41 65.95 3abl h THR 316 Cb 0.09 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 3abl h THR 316 CO -0.00 0.42 0.54 1.23 0.37 0.00 0.00 175.52 178.08 3abl h GLY 317 N 0.56 1.22 0.04 2.16 0.00 -0.28 -1.76 103.07 105.00 3abl h GLY 317 Ca 0.09 -0.49 0.17 0.00 0.00 0.00 0.00 47.33 47.10 3abl h GLY 317 CO 0.05 0.47 0.37 -2.08 0.00 0.00 0.00 176.54 175.35 3abl h VAL 318 N 1.17 0.61 -0.12 4.60 2.07 -1.21 -0.93 116.25 122.43 3abl h VAL 318 Ca 0.31 -0.16 -0.11 0.00 0.82 0.00 0.00 66.70 67.56 3abl h VAL 318 Cb -0.09 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 3abl h VAL 318 CO -0.06 0.09 -0.35 0.11 0.02 0.00 0.00 177.57 177.38 3abl h LYS 319 N 0.47 0.45 -0.08 1.57 1.57 -1.02 0.41 116.57 119.95 3abl h LYS 319 Ca 0.48 -0.32 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 3abl h LYS 319 Cb 0.79 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 33.09 3abl h LYS 319 CO -0.44 0.94 -0.38 0.28 -0.57 0.00 0.00 179.45 179.28 3abl h VAL 320 N 0.04 0.20 -0.33 0.50 2.07 -1.07 -0.78 116.25 116.88 3abl h VAL 320 Ca -0.01 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 3abl h VAL 320 Cb 0.96 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3abl h VAL 320 CO 0.07 0.00 0.06 -0.26 0.02 0.00 0.00 177.57 177.46 3abl h PHE 321 N -0.49 0.49 -0.30 1.57 0.05 -1.20 -2.44 116.94 114.63 3abl h PHE 321 Ca 0.07 -0.03 -0.07 0.00 3.82 0.00 0.00 57.97 61.76 3abl h PHE 321 Cb 0.61 -0.15 -0.02 0.00 2.00 0.00 0.00 35.95 38.39 3abl h PHE 321 CO -0.43 0.45 -0.12 0.77 -0.18 0.00 0.00 178.31 178.80 3abl h SER 322 N 0.48 0.49 -0.51 2.17 0.02 -0.36 -0.73 113.55 115.10 3abl h SER 322 Ca 0.11 -0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.86 3abl h SER 322 Cb 0.22 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3abl h SER 322 CO -0.00 0.64 0.04 -0.50 -1.14 0.00 0.00 176.83 175.87 3abl h TRP 323 N 0.47 0.94 -0.76 3.45 6.55 -0.83 -0.80 115.95 124.96 3abl h TRP 323 Ca 0.09 -0.15 -0.05 0.00 0.95 0.00 0.00 58.89 59.73 3abl h TRP 323 Cb 0.49 -0.25 -0.03 0.00 -0.86 0.00 0.00 29.16 28.51 3abl h TRP 323 CO 0.02 0.87 0.29 -0.07 -1.05 0.00 0.00 178.44 178.49 3abl h LEU 324 N 0.74 1.06 -1.00 -4.49 3.38 -1.22 -1.86 115.31 111.92 3abl h LEU 324 Ca 0.15 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3abl h LEU 324 Cb 0.47 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3abl h LEU 324 CO 0.02 0.95 -0.19 0.00 0.09 0.00 0.00 178.44 179.31 3abl h ALA 325 N 1.20 0.99 -0.19 1.53 0.00 -1.02 -2.07 119.26 119.70 3abl h ALA 325 Ca 0.25 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3abl h ALA 325 Cb 0.24 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3abl h ALA 325 CO -0.02 0.23 -0.21 1.15 0.00 0.00 0.00 179.25 180.40 3abl h THR 326 N 0.00 1.34 -0.97 0.00 2.02 -0.56 -3.18 112.91 111.55 3abl h THR 326 Ca -0.00 -1.39 0.18 0.00 0.77 0.00 0.00 66.41 65.97 3abl h THR 326 Cb 0.77 1.82 -0.10 0.00 -1.74 0.00 0.00 68.15 68.90 3abl h THR 326 CO 0.02 0.42 0.57 -0.07 0.37 0.00 0.00 175.52 176.84 3abl h LEU 327 N 0.13 0.74 -9.35 2.58 3.38 -0.82 -3.41 115.31 108.55 3abl h LEU 327 Ca 0.03 0.09 -0.53 0.00 0.09 0.00 0.00 57.88 57.56 3abl h LEU 327 Cb 0.76 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.49 3abl h LEU 327 CO 0.05 0.28 1.23 -2.28 0.09 0.00 0.00 178.44 177.81 3abl s HIS 328 N -5.89 1.31 0.00 1.13 2.46 -0.83 -0.46 115.29 113.01 3abl s HIS 328 Ca -0.11 -0.44 0.00 0.00 0.47 0.00 0.00 55.06 54.98 3abl s HIS 328 Cb 0.24 -4.23 0.00 0.00 -0.13 0.00 0.00 32.58 28.46 3abl s HIS 328 CO 0.80 -5.51 0.00 0.41 -2.47 0.00 0.00 174.74 167.97 3abl n GLY 329 N 4.53 0.66 3.90 1.59 0.00 -1.26 -4.98 105.19 109.63 3abl n GLY 329 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 3abl n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3abl s GLY 330 N -1.96 1.59 -0.91 -0.02 0.00 0.39 -5.01 107.32 101.40 3abl s GLY 330 Ca 0.00 -0.51 -0.23 0.00 0.00 0.00 0.00 44.72 43.99 3abl s GLY 330 CO 0.00 -0.35 1.29 0.21 0.00 0.00 0.00 173.10 174.24 3abl s ASN 331 N -3.84 6.44 -0.24 1.64 2.47 -0.91 -5.02 114.94 115.48 3abl s ASN 331 Ca 0.47 -1.38 -0.27 0.00 0.42 0.00 0.00 52.86 52.10 3abl s ASN 331 Cb -0.10 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 3abl s ASN 331 CO 0.40 -1.45 0.96 -0.63 -3.72 0.00 0.00 177.10 172.66 3abl s ILE 332 N 4.43 4.74 -0.37 -5.21 -1.09 -1.26 -3.81 121.20 118.63 3abl s ILE 332 Ca 0.38 1.85 -0.20 0.00 -2.23 0.00 0.00 60.65 60.45 3abl s ILE 332 Cb -0.04 -4.24 0.01 0.00 -1.58 0.00 0.00 42.46 36.60 3abl s ILE 332 CO -0.03 -0.15 0.60 -0.75 -1.23 0.00 0.00 174.94 173.38 3abl s LYS 333 N 3.08 3.57 -0.66 2.79 2.47 -0.15 -4.98 119.74 125.86 3abl s LYS 333 Ca 0.41 -0.10 -0.07 0.00 -1.56 0.00 0.00 55.97 54.65 3abl s LYS 333 Cb -0.15 -3.84 -0.16 0.00 -1.46 0.00 0.00 37.83 32.22 3abl s LYS 333 CO 0.07 -0.77 2.92 0.91 0.16 0.00 0.00 175.35 178.64 3abl n TRP 334 N 6.00 0.97 -1.48 4.03 7.02 -1.26 -4.77 117.44 127.95 3abl n TRP 334 Ca -0.02 -1.95 -0.30 0.00 -1.02 0.00 0.00 57.50 54.21 3abl n TRP 334 Cb 0.48 -1.79 0.10 0.00 -2.42 0.00 0.00 31.31 27.68 3abl n TRP 334 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 3abl s SER 335 N 2.36 4.30 0.23 -0.99 1.04 -1.26 -4.87 113.70 114.50 3abl s SER 335 Ca 0.58 1.36 -0.08 0.00 0.48 0.00 0.00 55.95 58.29 3abl s SER 335 Cb 0.22 -2.08 0.21 0.00 0.10 0.00 0.00 66.02 64.46 3abl s SER 335 CO -0.02 -2.10 1.88 1.55 0.98 0.00 0.00 173.24 175.52 3abl h PRO 336 N -1.18 1.20 -1.00 4.02 0.13 -1.92 -2.20 132.00 131.05 3abl h PRO 336 Ca -0.47 -0.11 0.08 0.00 -0.87 0.00 0.00 66.00 64.63 3abl h PRO 336 Cb 1.27 -0.25 -0.07 0.00 0.13 0.00 0.00 31.00 32.08 3abl h PRO 336 CO 0.58 0.84 0.64 0.00 -0.23 0.00 0.00 178.00 179.83 3abl h ALA 337 N 1.29 1.42 -0.63 -0.56 0.00 -1.92 -1.61 119.26 117.25 3abl h ALA 337 Ca 0.32 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 3abl h ALA 337 Cb -0.06 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 3abl h ALA 337 CO -0.06 0.38 0.31 1.98 0.00 0.00 0.00 179.25 181.87 3abl h MET 338 N 1.13 0.90 -0.19 0.00 -1.53 -1.80 -1.86 114.93 111.57 3abl h MET 338 Ca 0.45 -0.13 0.01 0.00 -3.44 0.00 0.00 59.70 56.60 3abl h MET 338 Cb 0.25 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 31.12 3abl h MET 338 CO -0.20 0.71 0.09 0.52 0.14 0.00 0.00 176.91 178.17 3abl h MET 339 N 0.86 0.20 -0.90 0.39 2.86 -0.75 -0.04 114.93 117.55 3abl h MET 339 Ca 0.22 -0.01 0.16 0.00 -2.06 0.00 0.00 59.70 58.01 3abl h MET 339 Cb 0.10 -0.04 -0.10 0.00 0.06 0.00 0.00 31.60 31.62 3abl h MET 339 CO -0.03 0.13 0.49 -1.49 1.06 0.00 0.00 176.91 177.07 3abl h TRP 340 N 0.20 0.86 0.03 -0.22 4.06 -1.14 0.40 115.95 120.14 3abl h TRP 340 Ca 0.08 0.03 -0.25 0.00 2.06 0.00 0.00 58.89 60.82 3abl h TRP 340 Cb 0.02 -0.24 0.01 0.00 -1.00 0.00 0.00 29.16 27.94 3abl h TRP 340 CO -0.09 0.19 -1.03 0.00 -3.56 0.00 0.00 178.44 173.95 3abl h ALA 341 N 1.59 0.26 -0.38 1.49 0.00 -0.71 -1.66 119.26 119.85 3abl h ALA 341 Ca 0.50 -0.74 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3abl h ALA 341 Cb 0.74 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3abl h ALA 341 CO -0.37 0.81 0.10 -0.07 0.00 0.00 0.00 179.25 179.71 3abl h LEU 342 N 0.23 0.56 -0.72 0.00 3.38 -0.58 -1.41 115.31 116.78 3abl h LEU 342 Ca -0.11 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 57.74 3abl h LEU 342 Cb 1.69 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 42.21 3abl h LEU 342 CO 0.18 0.64 0.35 1.23 0.09 0.00 0.00 178.44 180.94 3abl h GLY 343 N 0.46 1.09 1.00 0.83 0.00 -0.83 -2.29 103.07 103.33 3abl h GLY 343 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.23 3abl h GLY 343 CO 0.00 0.04 0.20 -2.75 0.00 0.00 0.00 176.54 174.03 3abl h PHE 344 N 0.59 0.39 -0.43 5.60 3.04 -0.94 0.15 116.94 125.34 3abl h PHE 344 Ca 0.36 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 62.26 3abl h PHE 344 Cb 0.41 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.77 3abl h PHE 344 CO -0.11 0.25 0.03 0.82 -2.02 0.00 0.00 178.31 177.28 3abl h ILE 345 N 0.42 1.26 -0.03 1.41 2.04 -0.69 0.20 117.51 122.11 3abl h ILE 345 Ca 0.11 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 3abl h ILE 345 Cb -0.04 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 3abl h ILE 345 CO -0.02 0.34 -0.07 0.15 0.00 0.00 0.00 178.15 178.54 3abl h PHE 346 N 0.59 0.12 -0.01 1.37 3.57 -1.34 -2.93 116.94 118.32 3abl h PHE 346 Ca 0.12 -0.05 -0.15 0.00 3.53 0.00 0.00 57.97 61.43 3abl h PHE 346 Cb 0.45 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 3abl h PHE 346 CO 0.03 0.68 -0.69 -0.07 -2.23 0.00 0.00 178.31 176.03 3abl h LEU 347 N -0.47 0.06 -0.88 0.59 3.38 -0.53 -2.65 115.31 114.81 3abl h LEU 347 Ca -0.00 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 3abl h LEU 347 Cb 0.67 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3abl h LEU 347 CO 0.02 0.73 -0.05 0.15 0.09 0.00 0.00 178.44 179.38 3abl h PHE 348 N 0.03 0.84 -0.64 1.13 3.04 -1.06 -1.36 116.94 118.91 3abl h PHE 348 Ca -0.01 -0.13 -0.04 0.00 3.98 0.00 0.00 57.97 61.76 3abl h PHE 348 Cb 1.23 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 39.49 3abl h PHE 348 CO 0.01 0.80 0.23 1.15 -2.02 0.00 0.00 178.31 178.48 3abl h THR 349 N 0.72 1.24 -0.32 4.41 2.02 -1.29 0.66 112.91 120.35 3abl h THR 349 Ca 0.13 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.50 3abl h THR 349 Cb 0.51 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3abl h THR 349 CO 0.03 0.31 0.18 0.58 0.37 0.00 0.00 175.52 176.99 3abl h VAL 350 N 0.92 1.13 -0.30 3.16 2.07 -1.26 0.94 116.25 122.91 3abl h VAL 350 Ca 0.21 -0.34 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 3abl h VAL 350 Cb 0.25 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3abl h VAL 350 CO -0.01 0.13 -0.20 1.23 0.02 0.00 0.00 177.57 178.74 3abl h GLY 351 N 0.40 0.72 0.79 2.17 0.00 -0.96 -1.33 103.07 104.86 3abl h GLY 351 Ca 0.11 -0.69 0.05 0.00 0.00 0.00 0.00 47.33 46.81 3abl h GLY 351 CO -0.02 0.62 0.53 -1.33 0.00 0.00 0.00 176.54 176.35 3abl h GLY 352 N 0.41 1.25 1.32 4.60 0.00 0.51 -2.35 103.07 108.81 3abl h GLY 352 Ca 0.06 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 3abl h GLY 352 CO 0.05 0.30 -0.20 1.41 0.00 0.00 0.00 176.54 178.11 3abl h LEU 353 N 1.00 0.80 -1.69 3.11 3.38 -0.42 -1.03 115.31 120.46 3abl h LEU 353 Ca 0.35 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3abl h LEU 353 Cb 0.09 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3abl h LEU 353 CO -0.15 0.99 -0.11 0.71 0.09 0.00 0.00 178.44 179.96 3abl h THR 354 N 0.70 0.39 -0.16 0.22 1.35 -0.99 -1.52 112.91 112.91 3abl h THR 354 Ca 0.10 -0.65 -0.18 0.00 -0.55 0.00 0.00 66.41 65.12 3abl h THR 354 Cb 0.71 1.47 0.01 0.00 -1.73 0.00 0.00 68.15 68.61 3abl h THR 354 CO 0.05 0.11 -0.62 1.23 -0.25 0.00 0.00 175.52 176.04 3abl h GLY 355 N 1.37 0.77 0.86 5.82 0.00 -0.71 -2.03 103.07 109.16 3abl h GLY 355 Ca -0.00 -1.05 0.09 0.00 0.00 0.00 0.00 47.33 46.37 3abl h GLY 355 CO 0.01 0.93 0.52 -2.22 0.00 0.00 0.00 176.54 175.79 3abl h ILE 356 N 0.39 0.96 -0.13 2.60 1.08 -0.76 -0.66 117.51 121.00 3abl h ILE 356 Ca -0.03 -0.26 -0.00 0.00 -0.39 0.00 0.00 64.86 64.18 3abl h ILE 356 Cb 1.25 0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.15 3abl h ILE 356 CO 0.13 0.14 0.07 0.58 -0.69 0.00 0.00 178.15 178.38 3abl h VAL 357 N 0.75 1.09 0.00 1.67 2.07 -1.00 -2.90 116.25 117.93 3abl h VAL 357 Ca 0.36 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.62 3abl h VAL 357 Cb 0.41 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 3abl h VAL 357 CO -0.14 0.09 0.00 -0.07 0.02 0.00 0.00 177.57 177.47 3abl h LEU 358 N 0.11 0.00 -2.30 2.57 3.38 -1.06 -2.66 115.31 115.35 3abl h LEU 358 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3abl h LEU 358 Cb 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 3abl h LEU 358 CO -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 178.44 178.48 3abl h ALA 359 N 2.02 1.30 -1.62 1.53 0.00 -0.91 -3.41 119.26 118.17 3abl h ALA 359 Ca 0.00 -0.04 -0.56 0.00 0.00 0.00 0.00 54.91 54.31 3abl h ALA 359 Cb 0.42 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.13 3abl h ALA 359 CO 0.00 0.06 0.93 -0.80 0.00 0.00 0.00 179.25 179.44 3abl s ASN 360 N -5.94 6.45 0.47 0.00 0.01 -1.00 -4.35 114.94 110.58 3abl s ASN 360 Ca -0.04 0.09 0.24 0.00 -0.71 0.00 0.00 52.86 52.45 3abl s ASN 360 Cb 0.14 -2.54 1.27 0.00 0.41 0.00 0.00 41.25 40.52 3abl s ASN 360 CO 0.54 -1.44 1.87 0.77 -1.51 0.00 0.00 177.10 177.33 3abl h SER 361 N 9.50 0.22 0.14 -1.22 4.64 -1.86 0.82 113.55 125.79 3abl h SER 361 Ca -0.25 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.09 3abl h SER 361 Cb 1.06 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3abl h SER 361 CO 1.17 0.08 -0.07 0.28 -0.87 0.00 0.00 176.83 177.43 3abl h SER 362 N 0.22 -0.16 0.14 4.97 0.02 -1.95 -2.88 113.55 113.91 3abl h SER 362 Ca 0.45 -0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 61.02 3abl h SER 362 Cb 1.42 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 64.00 3abl h SER 362 CO -0.11 0.14 -0.60 0.25 -1.14 0.00 0.00 176.83 175.36 3abl h LEU 363 N -0.46 0.52 -2.21 5.07 6.46 -1.82 -3.13 115.31 119.74 3abl h LEU 363 Ca -0.02 -0.30 0.01 0.00 -0.12 0.00 0.00 57.88 57.46 3abl h LEU 363 Cb 0.36 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.14 3abl h LEU 363 CO 0.03 1.00 0.04 -0.78 -0.62 0.00 0.00 178.44 178.11 3abl h ASP 364 N 0.34 0.00 -0.71 1.25 -0.00 -0.81 -1.20 116.42 115.30 3abl h ASP 364 Ca -0.01 0.00 0.15 0.00 -0.00 0.00 0.00 57.03 57.18 3abl h ASP 364 Cb 1.15 0.00 -0.13 0.00 -0.00 0.00 0.00 39.33 40.35 3abl h ASP 364 CO 0.11 0.00 -0.04 0.40 -0.00 0.00 0.00 179.24 179.70 3abl h ILE 365 N 0.00 0.37 0.00 2.25 1.08 -1.45 1.84 117.51 121.59 3abl h ILE 365 Ca 0.02 -0.03 -0.13 0.00 -0.39 0.00 0.00 64.86 64.33 3abl h ILE 365 Cb 0.09 0.28 -0.02 0.00 -3.07 0.00 0.00 36.82 34.10 3abl h ILE 365 CO -0.00 0.01 -0.81 0.58 -0.69 0.00 0.00 178.15 177.24 3abl h VAL 366 N 0.08 0.80 0.00 1.67 2.07 -1.42 -3.34 116.25 116.10 3abl h VAL 366 Ca 0.37 -2.21 -0.15 0.00 0.82 0.00 0.00 66.70 65.53 3abl h VAL 366 Cb 0.62 2.32 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 3abl h VAL 366 CO -0.65 0.45 -1.79 0.18 0.02 0.00 0.00 177.57 175.79 3abl n LEU 367 N -3.13 0.39 -4.64 2.57 4.77 -0.73 -4.84 117.00 111.39 3abl n LEU 367 Ca -0.02 0.17 -0.45 0.00 -0.03 0.00 0.00 56.01 55.68 3abl n LEU 367 Cb 0.78 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.98 3abl n LEU 367 CO 0.42 0.15 0.87 1.57 -1.33 0.00 0.00 177.39 179.07 3abl n HIS 368 N -2.64 1.86 -2.74 -1.77 -0.00 0.62 -2.12 115.22 108.42 3abl n HIS 368 Ca -0.13 0.54 -0.20 0.00 0.46 0.00 0.00 57.72 58.39 3abl n HIS 368 Cb 0.81 -2.38 0.01 0.00 -0.12 0.00 0.00 29.99 28.30 3abl n HIS 368 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 3abl n ASP 369 N 1.82 -5.43 -4.47 0.26 2.03 -1.26 -4.99 116.55 104.52 3abl n ASP 369 Ca 0.11 -0.12 -0.25 0.00 0.52 0.00 0.00 54.79 55.06 3abl n ASP 369 Cb 0.31 -4.48 -0.10 0.00 -0.72 0.00 0.00 41.12 36.13 3abl n ASP 369 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3abl s THR 370 N -3.01 1.27 -1.20 5.18 -4.23 -0.90 -1.41 115.64 111.35 3abl s THR 370 Ca 0.15 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.76 3abl s THR 370 Cb -0.07 -2.72 0.12 0.00 1.34 0.00 0.00 72.50 71.17 3abl s THR 370 CO 0.19 0.00 1.26 -1.22 -0.54 0.00 0.00 174.62 174.31 3abl n TYR 371 N -0.83 0.00 -0.26 3.99 4.01 -0.88 -1.36 117.16 121.82 3abl n TYR 371 Ca -0.05 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.63 3abl n TYR 371 Cb 0.66 -0.40 0.05 0.00 -0.31 0.00 0.00 39.34 39.35 3abl n TYR 371 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 3abl h TYR 372 N 0.00 1.07 -0.49 -0.72 5.03 -1.82 0.27 116.97 120.31 3abl h TYR 372 Ca 0.00 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.24 3abl h TYR 372 Cb 0.13 -0.32 -0.02 0.00 1.55 0.00 0.00 36.73 38.06 3abl h TYR 372 CO 0.00 0.81 0.30 0.28 -1.32 0.00 0.00 178.16 178.23 3abl h VAL 373 N 1.02 1.15 -0.95 1.81 2.07 -1.42 0.73 116.25 120.65 3abl h VAL 373 Ca 0.24 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 3abl h VAL 373 Cb 0.17 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 3abl h VAL 373 CO -0.02 0.15 0.58 0.58 0.02 0.00 0.00 177.57 178.87 3abl h VAL 374 N 0.66 1.26 0.01 2.57 2.07 -1.48 -0.12 116.25 121.21 3abl h VAL 374 Ca 0.18 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 3abl h VAL 374 Cb -0.02 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.66 3abl h VAL 374 CO -0.03 0.27 -0.00 0.00 0.02 0.00 0.00 177.57 177.82 3abl h ALA 375 N 1.33 -0.01 0.01 1.67 0.00 0.41 -1.83 119.26 120.84 3abl h ALA 375 Ca 0.34 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.15 3abl h ALA 375 Cb -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3abl h ALA 375 CO -0.07 -0.37 -0.28 1.25 0.00 0.00 0.00 179.25 179.78 3abl h HIS 376 N -0.27 -0.76 0.00 0.00 6.17 -0.44 -2.08 115.15 117.76 3abl h HIS 376 Ca -0.00 0.02 -0.09 0.00 0.71 0.00 0.00 60.37 61.02 3abl h HIS 376 Cb 0.27 0.34 -0.01 0.00 2.52 0.00 0.00 27.41 30.52 3abl h HIS 376 CO 0.02 -0.38 -0.41 0.27 0.71 0.00 0.00 177.93 178.14 3abl h PHE 377 N -0.44 0.00 0.00 5.26 -0.00 -1.03 -2.72 116.94 118.02 3abl h PHE 377 Ca 0.06 0.00 -0.07 0.00 -0.00 0.00 0.00 57.97 57.96 3abl h PHE 377 Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.45 3abl h PHE 377 CO -0.31 0.41 -0.35 0.45 -0.00 0.00 0.00 178.31 178.51 3abl h HIS 378 N 0.00 0.00 0.23 6.09 3.86 -1.09 0.11 115.15 124.35 3abl h HIS 378 Ca -0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 3abl h HIS 378 Cb 0.86 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.33 3abl h HIS 378 CO 0.00 0.35 -0.11 1.88 0.86 0.00 0.00 177.93 180.91 3abl h TYR 379 N 0.00 -0.29 0.00 2.45 -1.99 -1.08 0.48 116.97 116.53 3abl h TYR 379 Ca -0.00 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 3abl h TYR 379 Cb 1.01 0.10 -0.00 0.00 2.00 0.00 0.00 36.73 39.84 3abl h TYR 379 CO 0.00 0.01 -0.03 -0.39 -0.00 0.00 0.00 178.16 177.75 3abl h VAL 380 N -0.58 0.07 0.00 -2.88 -1.51 -1.45 -2.79 116.25 107.10 3abl h VAL 380 Ca -0.03 -0.67 0.00 0.00 -1.23 0.00 0.00 66.70 64.77 3abl h VAL 380 Cb 0.43 1.63 0.00 0.00 -2.13 0.00 0.00 31.29 31.21 3abl h VAL 380 CO 0.05 0.03 -0.58 0.18 -1.23 0.00 0.00 177.57 176.02 3abl n LEU 381 N -3.13 1.62 0.22 4.19 4.77 0.38 -1.30 117.00 123.75 3abl n LEU 381 Ca 0.01 0.49 0.08 0.00 -0.03 0.00 0.00 56.01 56.56 3abl n LEU 381 Cb 0.36 -0.79 0.50 0.00 -2.33 0.00 0.00 43.42 41.16 3abl n LEU 381 CO 0.29 -0.42 0.82 0.28 -1.33 0.00 0.00 177.39 177.03 3abl h SER 382 N -0.87 0.00 -0.17 -1.43 0.02 -0.24 -0.66 113.55 110.19 3abl h SER 382 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3abl h SER 382 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 3abl h SER 382 CO 0.00 0.25 0.00 0.23 -1.14 0.00 0.00 176.83 176.17 3abl n MET 383 N -3.67 1.71 0.00 3.45 2.81 -0.98 -4.38 117.12 116.06 3abl n MET 383 Ca -0.01 -1.56 0.00 0.00 -1.81 0.00 0.00 57.70 54.32 3abl n MET 383 Cb 0.37 -1.21 0.00 0.00 -0.71 0.00 0.00 33.22 31.67 3abl n MET 383 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3abl n GLY 384 N 0.45 0.58 0.32 3.03 0.00 -1.07 -4.40 105.19 104.10 3abl n GLY 384 Ca 0.08 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.32 3abl n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abl n ALA 385 N -2.95 0.72 0.07 4.61 0.00 -0.42 -0.47 120.51 122.08 3abl n ALA 385 Ca 0.00 0.99 -0.11 0.00 0.00 0.00 0.00 53.44 54.32 3abl n ALA 385 Cb 0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 3abl n ALA 385 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3abl h VAL 386 N 0.00 1.44 -0.32 0.00 2.07 -1.34 -1.22 116.25 116.88 3abl h VAL 386 Ca 0.69 -2.48 -0.08 0.00 0.82 0.00 0.00 66.70 65.65 3abl h VAL 386 Cb 1.64 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 33.80 3abl h VAL 386 CO -0.81 0.73 -0.13 -0.26 0.02 0.00 0.00 177.57 177.12 3abl h PHE 387 N 0.18 0.74 -0.60 1.57 0.05 -0.98 0.19 116.94 118.09 3abl h PHE 387 Ca -0.06 -0.17 -0.05 0.00 3.82 0.00 0.00 57.97 61.51 3abl h PHE 387 Cb 1.50 -0.17 -0.03 0.00 2.00 0.00 0.00 35.95 39.25 3abl h PHE 387 CO 0.04 0.85 0.16 0.00 -0.18 0.00 0.00 178.31 179.19 3abl h ALA 388 N 0.78 1.17 -0.65 2.45 0.00 -0.84 -1.33 119.26 120.84 3abl h ALA 388 Ca 0.07 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3abl h ALA 388 Cb 0.64 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3abl h ALA 388 CO 0.04 0.57 0.25 0.82 0.00 0.00 0.00 179.25 180.93 3abl h ILE 389 N 0.88 1.24 -0.30 0.00 2.04 -0.72 0.84 117.51 121.49 3abl h ILE 389 Ca 0.19 -0.76 -0.16 0.00 1.00 0.00 0.00 64.86 65.14 3abl h ILE 389 Cb 0.29 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 3abl h ILE 389 CO -0.00 0.30 -0.42 0.24 0.00 0.00 0.00 178.15 178.26 3abl h MET 390 N 0.91 0.82 -0.29 2.37 2.86 -0.83 0.81 114.93 121.58 3abl h MET 390 Ca 0.21 -0.48 -0.03 0.00 -2.06 0.00 0.00 59.70 57.34 3abl h MET 390 Cb 0.22 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3abl h MET 390 CO -0.02 1.12 0.06 0.78 1.06 0.00 0.00 176.91 179.91 3abl h GLY 391 N 0.60 0.51 0.52 8.32 0.00 -1.14 0.23 103.07 112.12 3abl h GLY 391 Ca 0.03 -0.33 0.07 0.00 0.00 0.00 0.00 47.33 47.11 3abl h GLY 391 CO 0.10 0.31 0.25 -1.33 0.00 0.00 0.00 176.54 175.87 3abl h GLY 392 N 0.30 0.82 0.65 4.60 0.00 -0.65 -0.73 103.07 108.07 3abl h GLY 392 Ca 0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 3abl h GLY 392 CO 0.00 0.04 -0.01 -2.75 0.00 0.00 0.00 176.54 173.83 3abl h PHE 393 N 0.47 0.06 -0.26 5.60 3.57 0.13 -0.48 116.94 126.03 3abl h PHE 393 Ca 0.28 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.69 3abl h PHE 393 Cb 0.28 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3abl h PHE 393 CO -0.14 0.41 -0.18 -0.39 -2.23 0.00 0.00 178.31 175.78 3abl h VAL 394 N -0.30 1.24 -0.30 1.41 -1.51 -0.50 -0.22 116.25 116.07 3abl h VAL 394 Ca 0.01 -1.10 -0.11 0.00 -1.23 0.00 0.00 66.70 64.26 3abl h VAL 394 Cb 0.39 1.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.79 3abl h VAL 394 CO 0.00 0.35 -0.26 -0.74 -1.23 0.00 0.00 177.57 175.70 3abl h HIS 395 N 0.41 0.84 -0.01 5.19 -0.00 -1.02 -3.29 115.15 117.27 3abl h HIS 395 Ca 0.07 -0.24 0.00 0.00 -0.00 0.00 0.00 60.37 60.20 3abl h HIS 395 Cb 0.55 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 27.78 3abl h HIS 395 CO 0.02 0.98 -0.69 0.91 -0.00 0.00 0.00 177.93 179.14 3abl n TRP 396 N -4.28 0.00 -0.34 5.26 8.01 -0.20 -4.49 117.44 121.40 3abl n TRP 396 Ca -0.03 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.19 3abl n TRP 396 Cb 0.45 -0.01 0.10 0.00 -2.01 0.00 0.00 31.31 29.85 3abl n TRP 396 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 3abl h PHE 397 N 1.35 -0.65 -0.93 -5.99 3.04 -1.11 -1.16 116.94 111.49 3abl h PHE 397 Ca 0.00 0.09 0.01 0.00 3.98 0.00 0.00 57.97 62.05 3abl h PHE 397 Cb 0.64 0.43 -0.05 0.00 2.56 0.00 0.00 35.95 39.53 3abl h PHE 397 CO 0.00 -0.40 0.62 -1.35 -2.02 0.00 0.00 178.31 175.15 3abl h PRO 398 N -0.01 1.21 0.27 6.41 0.11 -1.78 0.29 132.00 138.50 3abl h PRO 398 Ca 0.42 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.45 3abl h PRO 398 Cb 0.66 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 3abl h PRO 398 CO -0.96 0.80 -0.19 1.25 -0.21 0.00 0.00 178.00 178.69 3abl h LEU 399 N 1.25 -0.48 -0.65 2.35 5.85 -1.53 0.58 115.31 122.68 3abl h LEU 399 Ca 0.35 0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.97 3abl h LEU 399 Cb -0.12 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3abl h LEU 399 CO -0.08 -0.29 -0.40 -0.26 -0.34 0.00 0.00 178.44 177.07 3abl h PHE 400 N -0.45 0.72 0.00 1.25 0.04 -0.80 -3.31 116.94 114.39 3abl h PHE 400 Ca -0.02 -0.21 -0.16 0.00 2.80 0.00 0.00 57.97 60.38 3abl h PHE 400 Cb 0.39 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 3abl h PHE 400 CO -0.11 0.91 -2.05 -1.13 -0.60 0.00 0.00 178.31 175.33 3abl n SER 401 N -4.03 0.59 0.00 2.17 3.41 0.98 -4.70 113.62 112.04 3abl n SER 401 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 3abl n SER 401 Cb 0.52 1.42 0.00 0.00 -0.26 0.00 0.00 64.21 65.89 3abl n SER 401 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3abl n GLY 402 N 1.65 0.83 3.57 5.00 0.00 0.20 -4.38 105.19 112.06 3abl n GLY 402 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 3abl n GLY 402 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3abl s TYR 403 N -3.23 2.80 0.43 1.61 2.02 -1.23 -0.13 117.35 119.63 3abl s TYR 403 Ca 0.00 -0.10 -0.04 0.00 -0.37 0.00 0.00 57.07 56.56 3abl s TYR 403 Cb 0.00 -1.54 -0.04 0.00 -0.40 0.00 0.00 41.96 39.98 3abl s TYR 403 CO 0.00 0.37 0.71 0.95 -1.57 0.00 0.00 175.55 176.01 3abl s THR 404 N -1.05 4.96 0.53 -0.71 -4.23 -0.87 -3.37 115.64 110.89 3abl s THR 404 Ca 0.18 0.05 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 3abl s THR 404 Cb -0.11 -3.85 0.03 0.00 1.34 0.00 0.00 72.50 69.91 3abl s THR 404 CO 0.09 -0.73 0.75 -0.76 -0.54 0.00 0.00 174.62 173.43 3abl s LEU 405 N -4.52 3.32 -0.41 4.79 1.43 -1.26 -4.70 118.68 117.33 3abl s LEU 405 Ca 0.46 -0.09 -0.26 0.00 -1.03 0.00 0.00 54.13 53.20 3abl s LEU 405 Cb -0.10 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.33 3abl s LEU 405 CO 0.41 -1.10 0.97 0.21 0.23 0.00 0.00 176.35 177.07 3abl s ASN 406 N -4.42 6.63 0.29 2.29 3.84 -1.26 -4.95 114.94 117.35 3abl s ASN 406 Ca 0.57 0.44 0.00 0.00 0.21 0.00 0.00 52.86 54.08 3abl s ASN 406 Cb -0.10 -2.48 0.45 0.00 -0.55 0.00 0.00 41.25 38.57 3abl s ASN 406 CO 0.38 -0.98 1.84 0.44 -2.79 0.00 0.00 177.10 175.98 3abl h ASP 407 N 8.76 0.71 0.05 -4.21 3.45 -1.99 -2.02 116.42 121.17 3abl h ASP 407 Ca -0.23 -0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.10 3abl h ASP 407 Cb 1.07 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.66 3abl h ASP 407 CO 1.02 0.71 -0.03 0.74 -1.57 0.00 0.00 179.24 180.12 3abl h THR 408 N 0.73 0.94 -0.93 0.35 2.02 -1.99 -0.78 112.91 113.25 3abl h THR 408 Ca 0.16 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.42 3abl h THR 408 Cb 0.30 0.94 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 3abl h THR 408 CO 0.00 0.00 0.59 -0.50 0.37 0.00 0.00 175.52 175.98 3abl h TRP 409 N -0.07 1.08 -0.35 3.16 -0.00 -1.95 -1.03 115.95 116.80 3abl h TRP 409 Ca -0.01 0.03 -0.07 0.00 -0.00 0.00 0.00 58.89 58.85 3abl h TRP 409 Cb 0.06 -0.35 -0.02 0.00 -0.00 0.00 0.00 29.16 28.85 3abl h TRP 409 CO -0.08 0.53 -0.07 0.00 -0.00 0.00 0.00 178.44 178.82 3abl h ALA 410 N 1.45 1.23 -0.21 1.49 0.00 -0.94 0.27 119.26 122.55 3abl h ALA 410 Ca 0.42 -0.25 -0.19 0.00 0.00 0.00 0.00 54.91 54.88 3abl h ALA 410 Cb 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3abl h ALA 410 CO -0.19 0.50 -0.63 0.87 0.00 0.00 0.00 179.25 179.80 3abl h LYS 411 N 0.54 0.73 -0.24 0.00 1.57 -0.60 -1.03 116.57 117.54 3abl h LYS 411 Ca 0.11 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 3abl h LYS 411 Cb 0.45 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3abl h LYS 411 CO 0.02 1.13 0.13 0.82 -0.57 0.00 0.00 179.45 180.98 3abl h ILE 412 N 0.54 1.12 -0.26 1.86 2.04 -0.88 -1.81 117.51 120.12 3abl h ILE 412 Ca -0.01 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.58 3abl h ILE 412 Cb 1.22 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 38.14 3abl h ILE 412 CO 0.13 0.12 -0.12 -0.74 0.00 0.00 0.00 178.15 177.54 3abl h HIS 413 N 0.28 -0.29 -0.38 1.37 2.76 -0.15 -1.90 115.15 116.84 3abl h HIS 413 Ca 0.08 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.36 3abl h HIS 413 Cb 0.08 0.17 -0.07 0.00 1.55 0.00 0.00 27.41 29.14 3abl h HIS 413 CO -0.03 -0.19 -0.07 0.35 -1.30 0.00 0.00 177.93 176.70 3abl h PHE 414 N -0.08 -0.15 -0.50 5.26 3.57 -0.97 -1.52 116.94 122.55 3abl h PHE 414 Ca 0.14 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 3abl h PHE 414 Cb 0.29 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 3abl h PHE 414 CO -0.30 -0.14 0.29 0.00 -2.23 0.00 0.00 178.31 175.93 3abl h ALA 415 N 1.36 0.63 -0.02 2.41 0.00 -0.94 0.20 119.26 122.92 3abl h ALA 415 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3abl h ALA 415 Cb 0.27 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3abl h ALA 415 CO -0.36 0.13 -0.00 0.82 0.00 0.00 0.00 179.25 179.83 3abl h ILE 416 N 0.66 1.28 -0.77 0.00 2.04 -0.95 -1.87 117.51 117.90 3abl h ILE 416 Ca 0.18 -0.85 0.16 0.00 1.00 0.00 0.00 64.86 65.35 3abl h ILE 416 Cb 0.00 1.83 -0.10 0.00 -0.74 0.00 0.00 36.82 37.80 3abl h ILE 416 CO -0.03 0.22 0.28 -0.03 0.00 0.00 0.00 178.15 178.59 3abl h MET 417 N -0.32 0.38 -0.40 2.37 4.05 -1.08 0.10 114.93 120.03 3abl h MET 417 Ca 0.00 -0.02 0.02 0.00 -0.28 0.00 0.00 59.70 59.42 3abl h MET 417 Cb 0.36 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 3abl h MET 417 CO 0.00 0.25 0.24 0.35 0.23 0.00 0.00 176.91 177.98 3abl h PHE 418 N 0.39 0.45 -0.35 1.39 3.57 -0.11 0.73 116.94 123.01 3abl h PHE 418 Ca 0.44 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.91 3abl h PHE 418 Cb 0.72 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 3abl h PHE 418 CO -0.19 0.27 0.06 0.28 -2.23 0.00 0.00 178.31 176.50 3abl h VAL 419 N 0.49 1.24 0.05 1.41 2.07 -0.78 -2.87 116.25 117.86 3abl h VAL 419 Ca 0.16 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 3abl h VAL 419 Cb -0.00 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3abl h VAL 419 CO -0.07 0.28 -0.03 1.23 0.02 0.00 0.00 177.57 179.00 3abl h GLY 420 N 0.42 -0.07 1.21 2.17 0.00 0.04 -1.34 103.07 105.50 3abl h GLY 420 Ca 0.11 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 3abl h GLY 420 CO 0.01 -0.03 0.40 -0.39 0.00 0.00 0.00 176.54 176.53 3abl h VAL 421 N -0.36 1.22 -0.04 4.60 -1.51 -0.97 0.79 116.25 119.98 3abl h VAL 421 Ca -0.01 -0.57 -0.20 0.00 -1.23 0.00 0.00 66.70 64.69 3abl h VAL 421 Cb 0.32 0.22 -0.00 0.00 -2.13 0.00 0.00 31.29 29.70 3abl h VAL 421 CO 0.01 0.25 -0.82 0.78 -1.23 0.00 0.00 177.57 176.56 3abl h ASN 422 N 1.05 0.50 -0.71 4.19 2.35 -1.41 -1.70 115.58 119.85 3abl h ASN 422 Ca 0.26 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 3abl h ASN 422 Cb 0.04 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 3abl h ASN 422 CO -0.04 1.13 0.38 -0.03 -1.65 0.00 0.00 177.43 177.22 3abl h MET 423 N 0.25 0.99 -0.03 0.81 4.05 -0.88 -1.49 114.93 118.64 3abl h MET 423 Ca -0.05 -0.12 0.00 0.00 -0.28 0.00 0.00 59.70 59.25 3abl h MET 423 Cb 1.43 -0.19 -0.00 0.00 -0.80 0.00 0.00 31.60 32.04 3abl h MET 423 CO 0.14 0.75 0.01 1.15 0.23 0.00 0.00 176.91 179.19 3abl h THR 424 N 0.97 1.00 0.00 -0.77 2.02 -0.73 -3.35 112.91 112.05 3abl h THR 424 Ca 0.25 -0.01 -0.35 0.00 0.77 0.00 0.00 66.41 67.07 3abl h THR 424 Cb 0.05 0.97 -0.07 0.00 -1.74 0.00 0.00 68.15 67.36 3abl h THR 424 CO -0.04 0.01 -2.37 0.49 0.37 0.00 0.00 175.52 173.98 3abl n PHE 425 N -5.08 0.00 0.01 3.16 3.01 -0.65 -4.44 117.46 113.47 3abl n PHE 425 Ca -0.07 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.29 3abl n PHE 425 Cb 0.03 -0.97 -0.06 0.00 -0.01 0.00 0.00 39.48 38.47 3abl n PHE 425 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3abl h PHE 426 N 0.00 -0.02 0.00 1.38 3.57 -1.47 -1.16 116.94 119.24 3abl h PHE 426 Ca -0.52 0.01 0.00 0.00 3.53 0.00 0.00 57.97 60.99 3abl h PHE 426 Cb 2.18 0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.94 3abl h PHE 426 CO 0.00 -0.02 0.00 -2.30 -2.23 0.00 0.00 178.31 173.76 3abl n PRO 427 N -5.11 0.03 0.18 6.41 -0.02 -1.26 -1.82 135.00 133.40 3abl n PRO 427 Ca -0.05 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 62.04 3abl n PRO 427 Cb 0.06 -1.58 0.34 0.00 -0.02 0.00 0.00 33.50 32.30 3abl n PRO 427 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3abl h GLN 428 N 0.00 0.00 -0.73 -0.52 4.20 -1.42 -2.61 115.11 114.02 3abl h GLN 428 Ca 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 3abl h GLN 428 Cb 0.04 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.79 3abl h GLN 428 CO 0.00 0.00 0.43 0.45 -0.67 0.00 0.00 178.83 179.04 3abl h HIS 429 N 0.00 0.97 -0.06 2.96 3.86 -1.45 0.17 115.15 121.61 3abl h HIS 429 Ca 0.00 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 3abl h HIS 429 Cb 0.80 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 3abl h HIS 429 CO 0.00 0.66 0.00 0.74 0.86 0.00 0.00 177.93 180.20 3abl h PHE 430 N 1.00 0.11 -0.73 2.45 0.04 -1.65 -0.83 116.94 117.32 3abl h PHE 430 Ca 0.26 -0.02 0.15 0.00 2.80 0.00 0.00 57.97 61.17 3abl h PHE 430 Cb -0.02 -0.03 -0.11 0.00 2.20 0.00 0.00 35.95 38.00 3abl h PHE 430 CO -0.01 0.35 0.20 -0.07 -0.60 0.00 0.00 178.31 178.18 3abl h LEU 431 N -0.17 0.06 0.27 1.54 3.38 -1.44 -0.43 115.31 118.53 3abl h LEU 431 Ca 0.02 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3abl h LEU 431 Cb 0.31 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3abl h LEU 431 CO 0.00 -0.01 -0.13 1.23 0.09 0.00 0.00 178.44 179.62 3abl h GLY 432 N 0.30 -0.38 1.55 0.83 0.00 -0.76 -0.11 103.07 104.50 3abl h GLY 432 Ca 0.41 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.88 3abl h GLY 432 CO -0.49 -0.14 0.27 1.41 0.00 0.00 0.00 176.54 177.60 3abl h LEU 433 N -0.54 0.52 -0.27 3.11 3.38 -0.51 -1.54 115.31 119.46 3abl h LEU 433 Ca -0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3abl h LEU 433 Cb 0.40 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3abl h LEU 433 CO 0.06 0.40 0.00 -1.54 0.09 0.00 0.00 178.44 177.45 3abl n SER 434 N -4.45 0.43 0.00 -0.43 3.41 -0.23 -4.90 113.62 107.45 3abl n SER 434 Ca 0.04 -1.14 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 3abl n SER 434 Cb 0.08 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 3abl n SER 434 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3abl n GLY 435 N 1.05 0.97 3.65 5.00 0.00 -0.58 -5.06 105.19 110.22 3abl n GLY 435 Ca 0.23 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 3abl n GLY 435 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3abl s MET 436 N -1.04 4.05 0.73 1.61 0.00 -0.10 -4.99 119.30 119.56 3abl s MET 436 Ca 0.00 1.85 -0.13 0.00 0.00 0.00 0.00 55.69 57.41 3abl s MET 436 Cb 0.00 -3.95 0.04 0.00 0.00 0.00 0.00 34.83 30.92 3abl s MET 436 CO 0.00 -0.98 1.12 -2.14 0.00 0.00 0.00 175.02 173.02 3abl s PRO 437 N 4.14 2.39 0.39 4.11 0.02 -1.26 -2.08 135.00 142.70 3abl s PRO 437 Ca 0.68 1.38 -0.24 0.00 0.02 0.00 0.00 61.00 62.84 3abl s PRO 437 Cb -0.27 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.25 3abl s PRO 437 CO 0.26 -1.57 1.00 1.03 -0.33 0.00 0.00 177.00 177.39 3abl s ARG 438 N -4.38 4.28 -0.09 5.54 0.52 -0.50 -4.37 118.95 119.96 3abl s ARG 438 Ca 0.66 1.38 -0.00 0.00 -0.52 0.00 0.00 55.73 57.25 3abl s ARG 438 Cb -0.21 -2.53 0.00 0.00 0.52 0.00 0.00 34.95 32.73 3abl s ARG 438 CO 0.48 -0.02 0.02 0.54 0.02 0.00 0.00 175.30 176.34 3abl n ARG 439 N -0.03 -0.18 -4.26 3.54 1.74 -1.26 -4.99 116.66 111.21 3abl n ARG 439 Ca 0.05 0.05 -0.34 0.00 -0.77 0.00 0.00 57.85 56.84 3abl n ARG 439 Cb 0.51 -3.36 -0.13 0.00 -1.02 0.00 0.00 32.46 28.45 3abl n ARG 439 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3abl s TYR 440 N -2.32 2.95 -0.65 -1.55 4.12 -1.26 -4.93 117.35 113.70 3abl s TYR 440 Ca 0.01 -0.65 0.22 0.00 0.02 0.00 0.00 57.07 56.66 3abl s TYR 440 Cb -0.00 -2.00 0.88 0.00 -1.52 0.00 0.00 41.96 39.32 3abl s TYR 440 CO 0.01 -0.31 1.66 -1.13 0.02 0.00 0.00 175.55 175.81 3abl n SER 441 N 4.11 0.48 -3.56 2.29 3.41 -1.26 -4.87 113.62 114.22 3abl n SER 441 Ca -0.18 0.61 -0.09 0.00 -0.26 0.00 0.00 58.87 58.95 3abl n SER 441 Cb 0.52 -0.72 -0.02 0.00 -0.26 0.00 0.00 64.21 63.73 3abl n SER 441 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3abl s ASP 442 N -3.90 -0.42 -0.00 4.04 3.68 -1.26 -4.61 116.67 114.20 3abl s ASP 442 Ca 0.06 -0.17 -0.08 0.00 2.13 0.00 0.00 52.55 54.49 3abl s ASP 442 Cb 0.10 0.57 0.00 0.00 -1.45 0.00 0.00 42.92 42.14 3abl s ASP 442 CO 0.38 -0.96 0.16 -0.72 0.13 0.00 0.00 175.17 174.15 3abl s TYR 443 N -3.60 0.01 0.36 -5.34 -0.85 -1.26 -5.07 117.35 101.60 3abl s TYR 443 Ca 0.05 -0.06 -0.24 0.00 -0.52 0.00 0.00 57.07 56.30 3abl s TYR 443 Cb -0.02 -0.03 -0.14 0.00 0.38 0.00 0.00 41.96 42.16 3abl s TYR 443 CO -0.06 -0.28 0.62 -2.30 -1.52 0.00 0.00 175.55 172.00 3abl n PRO 444 N 1.53 0.63 -0.34 -3.49 -0.02 -1.26 -4.83 135.00 127.22 3abl n PRO 444 Ca -0.22 0.23 0.21 0.00 -2.02 0.00 0.00 63.50 61.69 3abl n PRO 444 Cb 0.56 -1.49 0.43 0.00 -0.02 0.00 0.00 33.50 32.98 3abl n PRO 444 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3abl h ASP 445 N 1.05 0.56 -0.79 2.55 3.45 -2.03 -2.13 116.42 119.08 3abl h ASP 445 Ca -0.38 0.17 0.23 0.00 0.43 0.00 0.00 57.03 57.47 3abl h ASP 445 Cb 1.39 0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 40.23 3abl h ASP 445 CO 0.54 -0.04 0.70 0.00 -1.57 0.00 0.00 179.24 178.86 3abl h ALA 446 N 1.80 2.63 -0.44 3.45 0.00 -2.05 -2.08 119.26 122.57 3abl h ALA 446 Ca 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.57 3abl h ALA 446 Cb 1.47 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.32 3abl h ALA 446 CO -0.56 -1.10 0.00 0.66 0.00 0.00 0.00 179.25 178.25 3abl n TYR 447 N -3.86 0.97 -0.04 0.00 4.01 -0.80 -4.46 117.16 112.98 3abl n TYR 447 Ca 0.16 -0.39 -0.13 0.00 -0.16 0.00 0.00 57.90 57.38 3abl n TYR 447 Cb 0.97 -0.16 -0.08 0.00 -0.31 0.00 0.00 39.34 39.76 3abl n TYR 447 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3abl h THR 448 N 2.75 1.35 -0.28 -0.72 2.02 -1.57 -2.95 112.91 113.52 3abl h THR 448 Ca 0.00 -1.17 -0.02 0.00 0.77 0.00 0.00 66.41 65.99 3abl h THR 448 Cb 1.02 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 69.35 3abl h THR 448 CO 0.14 0.33 0.11 -0.03 0.37 0.00 0.00 175.52 176.44 3abl h MET 449 N -0.20 0.42 -0.30 6.66 1.85 -1.84 -0.06 114.93 121.46 3abl h MET 449 Ca 0.02 -0.08 -0.06 0.00 -0.61 0.00 0.00 59.70 58.97 3abl h MET 449 Cb 0.56 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.51 3abl h MET 449 CO 0.02 0.45 -0.08 -1.49 -0.40 0.00 0.00 176.91 175.41 3abl h TRP 450 N 0.30 0.52 -0.32 1.39 -0.00 -1.90 -1.21 115.95 114.73 3abl h TRP 450 Ca 0.09 -0.07 -0.10 0.00 -0.00 0.00 0.00 58.89 58.82 3abl h TRP 450 Cb 0.19 -0.14 -0.01 0.00 -0.00 0.00 0.00 29.16 29.20 3abl h TRP 450 CO -0.01 0.56 -0.17 -0.91 -0.00 0.00 0.00 178.44 177.92 3abl h ASN 451 N 0.46 0.70 -0.10 -3.49 2.35 -1.30 -0.30 115.58 113.90 3abl h ASN 451 Ca 0.09 -0.42 0.02 0.00 -0.55 0.00 0.00 56.30 55.45 3abl h ASN 451 Cb 0.42 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 3abl h ASN 451 CO 0.02 0.96 -0.04 0.74 -1.65 0.00 0.00 177.43 177.47 3abl h THR 452 N 0.44 0.87 -0.31 2.81 2.02 -0.36 -2.06 112.91 116.32 3abl h THR 452 Ca 0.07 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.22 3abl h THR 452 Cb 0.71 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 3abl h THR 452 CO 0.05 0.00 0.07 0.40 0.37 0.00 0.00 175.52 176.41 3abl h ILE 453 N -0.02 1.22 -0.53 3.11 2.04 -1.08 -2.24 117.51 120.01 3abl h ILE 453 Ca 0.05 -0.75 0.11 0.00 1.00 0.00 0.00 64.86 65.27 3abl h ILE 453 Cb 0.10 1.11 -0.10 0.00 -0.74 0.00 0.00 36.82 37.20 3abl h ILE 453 CO -0.12 0.25 -0.08 -1.28 0.00 0.00 0.00 178.15 176.92 3abl h SER 454 N 0.35 -0.39 -0.41 1.72 0.87 -1.00 -0.56 113.55 114.13 3abl h SER 454 Ca 0.10 0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.74 3abl h SER 454 Cb 0.30 0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 3abl h SER 454 CO 0.00 -0.14 0.02 0.28 -0.53 0.00 0.00 176.83 176.46 3abl h SER 455 N 0.04 0.76 -0.62 6.23 0.02 -1.12 -2.53 113.55 116.33 3abl h SER 455 Ca 0.26 -0.17 0.05 0.00 -0.84 0.00 0.00 61.79 61.09 3abl h SER 455 Cb 0.41 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 3abl h SER 455 CO -0.51 0.81 0.35 0.24 -1.14 0.00 0.00 176.83 176.58 3abl h MET 456 N 0.75 0.63 -0.85 3.45 2.07 -1.00 -2.45 114.93 117.52 3abl h MET 456 Ca 0.15 -0.04 0.21 0.00 -2.07 0.00 0.00 59.70 57.95 3abl h MET 456 Cb 0.43 -0.14 -0.12 0.00 -1.87 0.00 0.00 31.60 29.89 3abl h MET 456 CO 0.02 0.42 0.30 0.78 1.07 0.00 0.00 176.91 179.50 3abl h GLY 457 N 0.65 1.37 1.33 8.32 0.00 -0.70 -1.40 103.07 112.64 3abl h GLY 457 Ca 0.27 -0.10 -0.13 0.00 0.00 0.00 0.00 47.33 47.37 3abl h GLY 457 CO -0.16 -0.27 -0.32 1.48 0.00 0.00 0.00 176.54 177.27 3abl h SER 458 N 0.33 0.79 -0.37 0.19 4.64 -1.10 -1.88 113.55 116.14 3abl h SER 458 Ca 0.52 -0.32 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 3abl h SER 458 Cb 0.98 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.83 3abl h SER 458 CO -0.55 1.04 0.20 -0.26 -0.87 0.00 0.00 176.83 176.39 3abl h PHE 459 N 0.64 0.53 -0.32 4.77 0.04 -0.82 -0.75 116.94 121.04 3abl h PHE 459 Ca 0.07 -0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.70 3abl h PHE 459 Cb 0.85 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.81 3abl h PHE 459 CO 0.04 0.39 -0.35 0.82 -0.60 0.00 0.00 178.31 178.61 3abl h ILE 460 N 0.56 1.28 -0.48 -0.55 2.04 -1.04 -0.73 117.51 118.59 3abl h ILE 460 Ca 0.14 -1.51 -0.09 0.00 1.00 0.00 0.00 64.86 64.40 3abl h ILE 460 Cb 0.04 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 3abl h ILE 460 CO -0.02 0.49 -0.08 0.28 0.00 0.00 0.00 178.15 178.82 3abl h SER 461 N 0.60 0.85 -0.66 1.72 0.02 -0.96 -2.31 113.55 112.81 3abl h SER 461 Ca 0.06 -0.25 0.02 0.00 -0.84 0.00 0.00 61.79 60.78 3abl h SER 461 Cb 0.88 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.15 3abl h SER 461 CO 0.08 0.96 0.42 0.25 -1.14 0.00 0.00 176.83 177.39 3abl h LEU 462 N 0.78 0.69 -1.29 5.07 5.85 -0.55 -1.69 115.31 124.18 3abl h LEU 462 Ca 0.13 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.91 3abl h LEU 462 Cb 0.58 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 3abl h LEU 462 CO 0.04 0.48 0.52 0.74 -0.34 0.00 0.00 178.44 179.88 3abl h THR 463 N 0.82 1.05 -0.36 1.05 2.02 -0.81 -0.73 112.91 115.96 3abl h THR 463 Ca 0.26 -0.30 -0.08 0.00 0.77 0.00 0.00 66.41 67.06 3abl h THR 463 Cb -0.00 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 3abl h THR 463 CO -0.10 0.16 -0.12 0.00 0.37 0.00 0.00 175.52 175.84 3abl h ALA 464 N 1.57 1.14 -0.24 6.16 0.00 -0.78 -0.20 119.26 126.91 3abl h ALA 464 Ca 0.34 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 3abl h ALA 464 Cb 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3abl h ALA 464 CO -0.12 0.54 -0.03 0.28 0.00 0.00 0.00 179.25 179.93 3abl h VAL 465 N 0.57 1.27 -0.62 0.00 2.07 -0.59 0.13 116.25 119.07 3abl h VAL 465 Ca 0.10 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 3abl h VAL 465 Cb 0.53 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 3abl h VAL 465 CO 0.03 0.31 0.17 0.24 0.02 0.00 0.00 177.57 178.34 3abl h MET 466 N 0.19 0.96 -0.26 1.57 2.86 -1.05 -2.46 114.93 116.73 3abl h MET 466 Ca 0.06 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.47 3abl h MET 466 Cb 0.47 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 3abl h MET 466 CO 0.02 0.84 0.06 1.25 1.06 0.00 0.00 176.91 180.14 3abl h LEU 467 N 0.92 0.41 -0.92 1.22 5.85 -0.62 -2.29 115.31 119.88 3abl h LEU 467 Ca 0.20 -0.24 0.19 0.00 0.84 0.00 0.00 57.88 58.87 3abl h LEU 467 Cb 0.30 -0.11 -0.11 0.00 0.37 0.00 0.00 40.66 41.12 3abl h LEU 467 CO -0.00 0.54 0.49 -0.03 -0.34 0.00 0.00 178.44 179.10 3abl h MET 468 N 0.25 0.57 -0.07 1.25 4.05 -0.57 -0.46 114.93 119.95 3abl h MET 468 Ca 0.08 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.47 3abl h MET 468 Cb 0.30 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.97 3abl h MET 468 CO 0.00 0.38 0.04 0.28 0.23 0.00 0.00 176.91 177.84 3abl h VAL 469 N 0.59 1.07 -0.80 -5.77 2.07 -0.94 -1.94 116.25 110.53 3abl h VAL 469 Ca 0.54 -0.18 0.18 0.00 0.82 0.00 0.00 66.70 68.06 3abl h VAL 469 Cb 0.90 1.06 -0.11 0.00 -1.52 0.00 0.00 31.29 31.62 3abl h VAL 469 CO -0.43 0.06 0.28 0.15 0.02 0.00 0.00 177.57 177.65 3abl h PHE 470 N 0.04 0.46 -0.25 1.57 3.57 -1.12 0.37 116.94 121.59 3abl h PHE 470 Ca 0.02 0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.42 3abl h PHE 470 Cb 0.06 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3abl h PHE 470 CO -0.05 -0.04 -0.43 0.82 -2.23 0.00 0.00 178.31 176.38 3abl h ILE 471 N 0.36 1.30 -0.21 1.41 2.04 -0.42 0.26 117.51 122.24 3abl h ILE 471 Ca 0.47 -1.62 -0.15 0.00 1.00 0.00 0.00 64.86 64.56 3abl h ILE 471 Cb 0.81 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.47 3abl h ILE 471 CO -0.49 0.51 -0.44 0.40 0.00 0.00 0.00 178.15 178.13 3abl h ILE 472 N 0.50 1.32 -0.41 -0.67 2.04 -0.71 -2.85 117.51 116.72 3abl h ILE 472 Ca 0.04 -1.66 0.05 0.00 1.00 0.00 0.00 64.86 64.29 3abl h ILE 472 Cb 0.96 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.82 3abl h ILE 472 CO 0.09 0.52 0.13 -0.25 0.00 0.00 0.00 178.15 178.64 3abl h TRP 473 N 0.37 0.23 -0.42 1.37 7.01 -0.14 -2.39 115.95 121.99 3abl h TRP 473 Ca 0.01 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.06 3abl h TRP 473 Cb 1.04 -0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 28.04 3abl h TRP 473 CO 0.09 0.08 0.28 1.49 -2.79 0.00 0.00 178.44 177.58 3abl h GLU 474 N 0.29 0.45 -0.02 2.65 4.22 -0.43 0.37 114.58 122.11 3abl h GLU 474 Ca 0.20 -0.03 -0.20 0.00 0.08 0.00 0.00 59.36 59.41 3abl h GLU 474 Cb 0.20 -0.10 0.02 0.00 0.50 0.00 0.00 28.75 29.36 3abl h GLU 474 CO -0.21 0.30 -0.77 0.00 -2.18 0.00 0.00 179.01 176.15 3abl h ALA 475 N 1.76 0.12 0.00 2.92 0.00 -1.31 -1.09 119.26 121.66 3abl h ALA 475 Ca 0.17 -0.61 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 3abl h ALA 475 Cb 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3abl h ALA 475 CO -0.04 0.50 -0.62 0.74 0.00 0.00 0.00 179.25 179.83 3abl h PHE 476 N 0.14 0.00 0.00 0.00 0.05 -0.98 -2.83 116.94 113.33 3abl h PHE 476 Ca -0.09 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 61.60 3abl h PHE 476 Cb 1.44 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.38 3abl h PHE 476 CO 0.12 0.62 -0.48 0.00 -0.18 0.00 0.00 178.31 178.39 3abl h ALA 477 N 1.38 1.18 0.00 2.45 0.00 -0.05 -3.33 119.26 120.88 3abl h ALA 477 Ca -0.01 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 3abl h ALA 477 Cb 1.15 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 3abl h ALA 477 CO 0.08 0.61 -2.00 0.43 0.00 0.00 0.00 179.25 178.36 3abl n SER 478 N -3.93 0.16 -3.50 0.00 7.64 -0.43 -5.03 113.62 108.52 3abl n SER 478 Ca -0.01 0.07 -0.19 0.00 1.01 0.00 0.00 58.87 59.75 3abl n SER 478 Cb 0.51 1.34 0.02 0.00 -1.01 0.00 0.00 64.21 65.06 3abl n SER 478 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3abl n LYS 479 N -2.53 -1.37 -3.18 1.43 5.02 -1.07 -4.95 118.16 111.51 3abl n LYS 479 Ca -0.14 0.91 -0.46 0.00 -2.02 0.00 0.00 58.31 56.60 3abl n LYS 479 Cb 0.80 -4.09 -0.02 0.00 -0.02 0.00 0.00 35.03 31.70 3abl n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3abl s ARG 480 N -4.62 3.58 0.18 1.97 0.52 -1.26 -5.04 118.95 114.27 3abl s ARG 480 Ca 0.16 -2.17 -0.30 0.00 -0.52 0.00 0.00 55.73 52.90 3abl s ARG 480 Cb -0.06 -4.60 -0.09 0.00 0.52 0.00 0.00 34.95 30.73 3abl s ARG 480 CO 0.83 -1.47 1.35 -1.21 0.02 0.00 0.00 175.30 174.82 3abl s GLU 481 N 1.16 4.35 0.37 3.54 2.02 -1.26 -2.06 118.70 126.83 3abl s GLU 481 Ca 0.23 2.09 -0.28 0.00 0.02 0.00 0.00 54.97 57.03 3abl s GLU 481 Cb -0.09 -3.20 -0.11 0.00 0.10 0.00 0.00 34.13 30.83 3abl s GLU 481 CO -0.09 -0.33 1.48 0.28 0.02 0.00 0.00 175.26 176.63 3abl n VAL 482 N 2.99 1.98 -0.03 2.63 0.31 0.82 -4.92 118.33 122.10 3abl n VAL 482 Ca 0.08 -0.49 -0.04 0.00 -0.01 0.00 0.00 64.34 63.87 3abl n VAL 482 Cb 0.42 -1.96 -0.01 0.00 -0.91 0.00 0.00 33.84 31.38 3abl n VAL 482 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3abl n LEU 483 N 0.50 1.06 -4.02 7.52 4.77 -1.26 -4.93 117.00 120.64 3abl n LEU 483 Ca 0.02 0.17 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 3abl n LEU 483 Cb 0.39 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.83 3abl n LEU 483 CO 0.64 -0.44 -0.38 -0.89 -1.33 0.00 0.00 177.39 174.99 3abl s THR 484 N -2.02 0.29 -0.02 -5.08 2.01 -1.26 -4.98 115.64 104.58 3abl s THR 484 Ca -0.13 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 60.85 3abl s THR 484 Cb 0.02 -0.49 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 3abl s THR 484 CO 0.19 -0.49 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.85 3abl s VAL 485 N -1.60 0.75 0.62 3.82 1.01 -1.26 -5.15 120.40 118.58 3abl s VAL 485 Ca -0.12 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 3abl s VAL 485 Cb -0.09 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 3abl s VAL 485 CO -0.01 0.22 1.00 -0.62 0.00 0.00 0.00 175.10 175.69 3abl s ASP 486 N -0.02 6.00 -1.27 3.32 -1.08 -1.26 -4.37 116.67 117.99 3abl s ASP 486 Ca 0.00 1.22 0.00 0.00 -0.52 0.00 0.00 52.55 53.26 3abl s ASP 486 Cb -0.06 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.15 3abl s ASP 486 CO -0.00 -0.95 0.00 0.18 0.52 0.00 0.00 175.17 174.92 3abl n LEU 487 N -2.72 -1.66 0.26 -1.34 4.77 -1.26 -4.89 117.00 110.16 3abl n LEU 487 Ca 0.05 -0.01 0.12 0.00 -0.03 0.00 0.00 56.01 56.14 3abl n LEU 487 Cb 0.55 -2.23 0.72 0.00 -2.33 0.00 0.00 43.42 40.13 3abl n LEU 487 CO 0.57 -0.17 0.99 0.71 -1.33 0.00 0.00 177.39 178.16 3abl h THR 488 N 0.00 0.68 0.00 -5.08 1.35 -1.84 -1.99 112.91 106.03 3abl h THR 488 Ca -0.35 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 65.07 3abl h THR 488 Cb 1.25 1.26 -0.00 0.00 -1.73 0.00 0.00 68.15 68.94 3abl h THR 488 CO 0.42 0.10 -0.04 0.71 -0.25 0.00 0.00 175.52 176.46 3abl h THR 489 N 0.00 0.44 -0.01 6.82 1.35 -1.96 -1.96 112.91 117.58 3abl h THR 489 Ca -0.00 -0.21 -0.05 0.00 -0.55 0.00 0.00 66.41 65.60 3abl h THR 489 Cb 0.25 1.14 -0.09 0.00 -1.73 0.00 0.00 68.15 67.73 3abl h THR 489 CO 0.01 0.04 -0.62 0.35 -0.25 0.00 0.00 175.52 175.06 3abl n THR 490 N -3.63 1.76 -2.91 6.82 -2.24 -0.76 -4.82 114.28 108.51 3abl n THR 490 Ca -0.02 -2.81 -0.11 0.00 -2.27 0.00 0.00 64.05 58.84 3abl n THR 490 Cb 0.14 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.37 3abl n THR 490 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3abl n ASN 491 N -0.78 -2.39 0.19 3.42 3.02 -0.74 -5.00 115.26 112.99 3abl n ASN 491 Ca 0.17 -2.93 0.06 0.00 -0.03 0.00 0.00 54.58 51.85 3abl n ASN 491 Cb 0.79 1.13 0.56 0.00 -0.61 0.00 0.00 39.78 41.66 3abl n ASN 491 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3abl h LEU 492 N 4.66 0.11 -2.20 3.41 5.85 -1.88 -2.06 115.31 123.20 3abl h LEU 492 Ca 0.03 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3abl h LEU 492 Cb 1.03 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3abl h LEU 492 CO 0.22 0.12 0.06 1.05 -0.34 0.00 0.00 178.44 179.55 3abl h GLU 493 N 0.13 0.00 -0.02 1.25 9.09 -1.92 -1.02 114.58 122.10 3abl h GLU 493 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 3abl h GLU 493 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 3abl h GLU 493 CO -0.00 0.00 -0.30 0.91 0.05 0.00 0.00 179.01 179.67 3abl n TRP 494 N -2.70 0.00 0.76 2.06 7.02 -0.77 -4.36 117.44 119.44 3abl n TRP 494 Ca -0.02 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.58 3abl n TRP 494 Cb 0.11 -0.04 0.50 0.00 -2.42 0.00 0.00 31.31 29.46 3abl n TRP 494 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 3abl n LEU 495 N 0.01 0.29 -1.45 -0.99 7.94 -0.39 -2.19 117.00 120.22 3abl n LEU 495 Ca 0.12 0.54 0.07 0.00 -1.11 0.00 0.00 56.01 55.62 3abl n LEU 495 Cb 0.44 -0.46 0.31 0.00 0.53 0.00 0.00 43.42 44.24 3abl n LEU 495 CO 0.25 -0.15 0.74 0.59 -1.11 0.00 0.00 177.39 177.71 3abl n ASN 496 N -1.78 4.28 -0.16 1.96 3.02 -1.26 -5.06 115.26 116.25 3abl n ASN 496 Ca 0.06 -2.50 0.00 0.00 -0.03 0.00 0.00 54.58 52.11 3abl n ASN 496 Cb 0.33 -0.57 -0.00 0.00 -0.61 0.00 0.00 39.78 38.93 3abl n ASN 496 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3abl n GLY 497 N 0.82 -1.95 2.75 7.41 0.00 -0.93 -4.34 105.19 108.94 3abl n GLY 497 Ca 0.22 -1.37 -0.26 0.00 0.00 0.00 0.00 46.02 44.60 3abl n GLY 497 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abl s PRO 499 N 1.90 3.13 0.79 0.00 0.04 -1.25 -4.27 135.00 135.35 3abl s PRO 499 Ca 0.01 0.92 -0.11 0.00 0.04 0.00 0.00 61.00 61.87 3abl s PRO 499 Cb -0.15 -2.02 0.07 0.00 0.04 0.00 0.00 34.50 32.44 3abl s PRO 499 CO -0.07 -0.95 1.09 -1.25 0.04 0.00 0.00 177.00 175.86 3abl s PRO 500 N -5.00 2.09 0.91 0.56 0.04 -1.03 -4.97 135.00 127.61 3abl s PRO 500 Ca 0.58 1.05 -0.11 0.00 0.04 0.00 0.00 61.00 62.56 3abl s PRO 500 Cb -0.13 -1.89 0.14 0.00 0.04 0.00 0.00 34.50 32.66 3abl s PRO 500 CO 0.53 -1.73 1.09 -1.25 0.04 0.00 0.00 177.00 175.69 3abl s PRO 501 N -4.93 1.13 0.20 0.56 0.04 -1.26 -4.91 135.00 125.82 3abl s PRO 501 Ca 0.61 1.04 -0.19 0.00 0.04 0.00 0.00 61.00 62.51 3abl s PRO 501 Cb -0.17 -1.78 0.17 0.00 0.04 0.00 0.00 34.50 32.76 3abl s PRO 501 CO 0.56 -2.39 1.59 -0.92 0.04 0.00 0.00 177.00 175.87 3abl h TYR 502 N -1.67 -0.84 -3.65 0.56 5.03 -2.01 -3.35 116.97 111.04 3abl h TYR 502 Ca -0.49 0.07 -0.64 0.00 2.58 0.00 0.00 58.73 60.26 3abl h TYR 502 Cb 1.28 0.47 -0.20 0.00 1.55 0.00 0.00 36.73 39.83 3abl h TYR 502 CO 0.45 -0.37 -0.58 -1.01 -1.32 0.00 0.00 178.16 175.33 3abl s HIS 503 N -6.04 3.16 0.31 -3.82 3.76 -1.26 -4.94 115.29 106.46 3abl s HIS 503 Ca -0.14 -0.17 0.09 0.00 -0.15 0.00 0.00 55.06 54.69 3abl s HIS 503 Cb 0.17 -2.25 -0.05 0.00 1.11 0.00 0.00 32.58 31.57 3abl s HIS 503 CO 0.70 -0.20 0.00 0.95 -0.85 0.00 0.00 174.74 175.34 3abl s THR 504 N 1.42 2.91 -1.31 1.30 -4.23 -1.26 -4.62 115.64 109.84 3abl s THR 504 Ca 0.06 -1.96 -0.09 0.00 -1.18 0.00 0.00 61.69 58.52 3abl s THR 504 Cb -0.15 -2.78 0.07 0.00 1.34 0.00 0.00 72.50 70.98 3abl s THR 504 CO 0.05 -0.27 0.50 0.49 -0.54 0.00 0.00 174.62 174.85 3abl n PHE 505 N -0.93 -1.80 -0.19 3.99 3.72 -1.26 -4.44 117.46 116.55 3abl n PHE 505 Ca -0.05 0.48 0.11 0.00 -0.05 0.00 0.00 57.45 57.94 3abl n PHE 505 Cb 0.61 -3.08 0.42 0.00 -0.94 0.00 0.00 39.48 36.49 3abl n PHE 505 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3abl h GLU 506 N -1.01 0.58 -4.94 -1.08 5.08 -1.94 -3.31 114.58 107.96 3abl h GLU 506 Ca -0.44 -0.04 -0.65 0.00 -1.00 0.00 0.00 59.36 57.23 3abl h GLU 506 Cb 1.30 -0.13 -0.23 0.00 0.50 0.00 0.00 28.75 30.18 3abl h GLU 506 CO 0.54 0.39 -0.63 -2.00 -1.00 0.00 0.00 179.01 176.30 3abl s GLU 507 N -5.57 3.57 1.07 2.33 2.12 -1.26 -5.10 118.70 115.87 3abl s GLU 507 Ca -0.09 -0.53 -0.12 0.00 0.36 0.00 0.00 54.97 54.59 3abl s GLU 507 Cb 0.21 -3.30 0.23 0.00 0.26 0.00 0.00 34.13 31.53 3abl s GLU 507 CO 0.77 -0.21 1.06 -2.14 -0.54 0.00 0.00 175.26 174.20 3abl s PRO 508 N 1.59 -0.20 0.66 4.30 0.02 -1.25 -5.00 135.00 135.14 3abl s PRO 508 Ca 0.06 0.94 -0.12 0.00 0.02 0.00 0.00 61.00 61.90 3abl s PRO 508 Cb -0.15 -1.63 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 3abl s PRO 508 CO 0.03 -3.27 1.06 0.95 -0.33 0.00 0.00 177.00 175.44 3abl s THR 509 N -2.60 4.00 -0.21 0.99 -4.23 -1.26 -5.02 115.64 107.30 3abl s THR 509 Ca 0.67 0.73 -0.08 0.00 -1.18 0.00 0.00 61.69 61.83 3abl s THR 509 Cb -0.23 -3.41 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 3abl s THR 509 CO 0.62 -0.77 0.07 -0.47 -0.54 0.00 0.00 174.62 173.53 3abl s TYR 510 N -2.89 3.17 -0.06 3.99 6.14 -1.26 -5.01 117.35 121.44 3abl s TYR 510 Ca 0.59 -0.12 -0.03 0.00 0.64 0.00 0.00 57.07 58.16 3abl s TYR 510 Cb -0.14 -2.16 0.04 0.00 0.42 0.00 0.00 41.96 40.11 3abl s TYR 510 CO 0.50 -0.07 0.07 0.08 0.64 0.00 0.00 175.55 176.77 3abl s VAL 511 N 0.96 -0.12 0.62 3.14 1.01 -1.26 -5.15 120.40 119.60 3abl s VAL 511 Ca 0.04 0.33 -0.14 0.00 0.00 0.00 0.00 61.98 62.22 3abl s VAL 511 Cb -0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 3abl s VAL 511 CO 0.03 0.11 1.05 0.20 0.00 0.00 0.00 175.10 176.48 3abl s ASN 512 N 2.18 5.78 -0.06 3.32 0.02 -1.26 -4.47 114.94 120.45 3abl s ASN 512 Ca 0.04 1.67 0.01 0.00 -1.02 0.00 0.00 52.86 53.57 3abl s ASN 512 Cb -0.13 -2.51 -0.25 0.00 0.02 0.00 0.00 41.25 38.38 3abl s ASN 512 CO -0.04 -1.17 0.60 -0.07 0.02 0.00 0.00 177.10 176.45 3abl h LEU 513 N 0.01 0.26 0.00 0.60 3.38 -1.98 -3.47 115.31 114.10 3abl h LEU 513 Ca -0.45 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.01 3abl h LEU 513 Cb 1.21 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3abl h LEU 513 CO 0.58 1.45 0.00 0.29 0.09 0.00 0.00 178.44 180.85