#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dps s LEU 15 N 0.00 3.54 0.27 2.23 1.43 0.26 -5.01 118.68 121.40 1dps s LEU 15 Ca 0.00 1.78 -0.29 0.00 -1.03 0.00 0.00 54.13 54.59 1dps s LEU 15 Cb 0.00 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.60 1dps s LEU 15 CO 0.00 -1.05 1.04 -0.47 0.23 0.00 0.00 176.35 176.10 1dps s TYR 16 N -2.45 3.71 -0.05 0.29 5.04 -1.26 -4.58 117.35 118.05 1dps s TYR 16 Ca 0.63 1.77 -0.21 0.00 -2.44 0.00 0.00 57.07 56.82 1dps s TYR 16 Cb -0.15 -3.18 0.04 0.00 0.35 0.00 0.00 41.96 39.03 1dps s TYR 16 CO 0.35 -0.21 0.47 -0.08 -1.34 0.00 0.00 175.55 174.74 1dps s THR 17 N -1.18 0.03 -0.57 4.34 -1.32 -1.26 -5.00 115.64 110.67 1dps s THR 17 Ca 0.44 -0.24 0.23 0.00 -1.21 0.00 0.00 61.69 60.91 1dps s THR 17 Cb -0.30 -0.77 0.24 0.00 -1.51 0.00 0.00 72.50 70.16 1dps s THR 17 CO 0.38 -0.13 1.70 0.54 -2.21 0.00 0.00 174.62 174.89 1dps n ARG 18 N 1.31 0.18 -1.67 7.08 1.74 -1.26 -4.70 116.66 119.35 1dps n ARG 18 Ca -0.20 0.37 -0.43 0.00 -0.77 0.00 0.00 57.85 56.83 1dps n ARG 18 Cb 0.56 -1.82 -0.03 0.00 -1.02 0.00 0.00 32.46 30.15 1dps n ARG 18 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1dps n ASN 19 N -2.15 4.07 -1.43 0.55 2.85 -1.26 -4.88 115.26 113.00 1dps n ASN 19 Ca 0.03 0.92 0.04 0.00 -0.11 0.00 0.00 54.58 55.45 1dps n ASN 19 Cb 0.25 -1.51 0.26 0.00 1.24 0.00 0.00 39.78 40.02 1dps n ASN 19 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1dps n ASP 20 N 7.29 4.10 -4.75 1.20 5.75 -1.26 -4.93 116.55 123.94 1dps n ASP 20 Ca 0.20 -2.63 -0.41 0.00 -0.01 0.00 0.00 54.79 51.95 1dps n ASP 20 Cb 0.39 -0.63 0.01 0.00 -1.03 0.00 0.00 41.12 39.86 1dps n ASP 20 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1dps n VAL 21 N 0.37 2.43 -1.69 2.12 0.31 -1.26 -4.90 118.33 115.71 1dps n VAL 21 Ca 0.19 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.65 1dps n VAL 21 Cb 0.89 -1.81 0.06 0.00 -0.91 0.00 0.00 33.84 32.07 1dps n VAL 21 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1dps n SER 22 N 0.17 1.71 -0.24 4.52 3.41 -1.26 -4.74 113.62 117.19 1dps n SER 22 Ca 0.04 0.84 0.06 0.00 -0.26 0.00 0.00 58.87 59.55 1dps n SER 22 Cb 0.40 -1.50 0.31 0.00 -0.26 0.00 0.00 64.21 63.16 1dps n SER 22 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1dps h ASP 23 N 0.62 0.75 -0.35 4.04 5.19 -1.98 0.59 116.42 125.29 1dps h ASP 23 Ca -0.50 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 55.90 1dps h ASP 23 Cb 1.34 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.69 1dps h ASP 23 CO 0.53 0.47 0.14 -1.28 -3.12 0.00 0.00 179.24 175.99 1dps h SER 24 N 0.85 0.48 0.10 6.45 0.87 -2.00 -0.38 113.55 119.93 1dps h SER 24 Ca 0.36 -0.16 -0.15 0.00 -1.23 0.00 0.00 61.79 60.61 1dps h SER 24 Cb 0.30 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1dps h SER 24 CO -0.13 0.51 -0.55 -0.08 -0.53 0.00 0.00 176.83 176.05 1dps h GLU 25 N 0.42 0.47 -0.16 2.24 4.81 -1.80 -2.26 114.58 118.30 1dps h GLU 25 Ca 0.12 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1dps h GLU 25 Cb 0.18 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1dps h GLU 25 CO -0.01 0.90 0.09 0.87 -0.73 0.00 0.00 179.01 180.13 1dps h LYS 26 N 0.36 0.23 -0.40 1.92 1.57 -0.70 -0.08 116.57 119.46 1dps h LYS 26 Ca 0.01 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1dps h LYS 26 Cb 1.07 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1dps h LYS 26 CO 0.10 0.23 0.23 0.87 -0.57 0.00 0.00 179.45 180.31 1dps h LYS 27 N 0.17 0.55 -0.69 3.15 1.79 -0.98 -0.64 116.57 119.91 1dps h LYS 27 Ca 0.06 -0.06 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1dps h LYS 27 Cb 0.07 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.57 1dps h LYS 27 CO -0.01 0.43 0.22 0.00 -1.08 0.00 0.00 179.45 179.01 1dps h ALA 28 N 1.09 0.91 -0.42 3.86 0.00 -1.25 -2.14 119.26 121.30 1dps h ALA 28 Ca 0.14 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1dps h ALA 28 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1dps h ALA 28 CO -0.03 0.58 -0.11 1.15 0.00 0.00 0.00 179.25 180.85 1dps h THR 29 N 1.01 1.27 -0.53 0.00 2.02 -0.79 -2.03 112.91 113.87 1dps h THR 29 Ca 0.22 -1.21 -0.03 0.00 0.77 0.00 0.00 66.41 66.17 1dps h THR 29 Cb 0.29 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1dps h THR 29 CO -0.01 0.41 0.23 0.58 0.37 0.00 0.00 175.52 177.11 1dps h VAL 30 N 0.64 1.21 -0.43 3.16 2.07 -1.02 -0.08 116.25 121.79 1dps h VAL 30 Ca 0.11 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1dps h VAL 30 Cb 0.64 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1dps h VAL 30 CO 0.04 0.24 0.26 -0.33 0.02 0.00 0.00 177.57 177.81 1dps h GLU 31 N 0.71 0.58 -0.11 1.57 4.39 -1.31 -0.67 114.58 119.75 1dps h GLU 31 Ca 0.18 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 1dps h GLU 31 Cb 0.16 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1dps h GLU 31 CO -0.02 0.43 0.06 1.25 -1.16 0.00 0.00 179.01 179.57 1dps h LEU 32 N 0.57 0.13 -0.72 1.33 6.46 -1.10 -2.55 115.31 119.44 1dps h LEU 32 Ca 0.16 -0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.79 1dps h LEU 32 Cb -0.01 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 39.85 1dps h LEU 32 CO -0.03 0.17 0.25 -0.07 -0.62 0.00 0.00 178.44 178.14 1dps h LEU 33 N 0.08 1.02 -1.40 2.25 3.38 -0.81 -2.66 115.31 117.18 1dps h LEU 33 Ca 0.04 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1dps h LEU 33 Cb 0.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1dps h LEU 33 CO -0.01 0.94 -0.27 0.78 0.09 0.00 0.00 178.44 179.97 1dps h ASN 34 N 1.05 0.04 -0.43 -0.43 2.35 -1.04 0.61 115.58 117.73 1dps h ASN 34 Ca 0.24 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1dps h ASN 34 Cb 0.27 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1dps h ASN 34 CO -0.01 0.31 0.02 0.03 -1.65 0.00 0.00 177.43 176.13 1dps h ARG 35 N 0.04 0.75 -0.53 0.81 3.08 -1.19 -1.85 114.38 115.48 1dps h ARG 35 Ca 0.00 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 59.74 1dps h ARG 35 Cb 0.50 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1dps h ARG 35 CO 0.04 0.81 -0.01 1.96 -1.07 0.00 0.00 179.97 181.70 1dps h GLN 36 N 0.59 0.94 -0.76 0.04 1.08 -1.05 -2.93 115.11 113.02 1dps h GLN 36 Ca 0.12 -0.30 0.01 0.00 -1.45 0.00 0.00 58.65 57.03 1dps h GLN 36 Cb 0.46 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.77 1dps h GLN 36 CO 0.02 0.96 0.50 0.28 -0.95 0.00 0.00 178.83 179.64 1dps h VAL 37 N 0.81 1.18 -0.04 -0.54 2.07 -0.73 -0.77 116.25 118.23 1dps h VAL 37 Ca 0.15 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1dps h VAL 37 Cb 0.54 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1dps h VAL 37 CO 0.03 0.19 0.02 0.40 0.02 0.00 0.00 177.57 178.22 1dps h ILE 38 N 1.02 1.00 -0.01 4.57 2.04 -1.28 -0.25 117.51 124.60 1dps h ILE 38 Ca 0.29 -0.01 -0.15 0.00 1.00 0.00 0.00 64.86 65.98 1dps h ILE 38 Cb -0.09 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1dps h ILE 38 CO -0.07 0.01 -0.69 0.06 0.00 0.00 0.00 178.15 177.45 1dps h GLN 39 N 0.04 0.05 -0.33 2.37 3.07 -1.31 -1.72 115.11 117.29 1dps h GLN 39 Ca 0.01 -0.04 -0.10 0.00 0.09 0.00 0.00 58.65 58.61 1dps h GLN 39 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 27.56 1dps h GLN 39 CO -0.01 0.72 -0.19 0.74 0.09 0.00 0.00 178.83 180.18 1dps h PHE 40 N 0.04 0.82 -0.21 0.06 -1.00 -1.01 0.71 116.94 116.35 1dps h PHE 40 Ca -0.01 -0.21 -0.01 0.00 2.81 0.00 0.00 57.97 60.55 1dps h PHE 40 Cb 1.22 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.59 1dps h PHE 40 CO 0.01 0.93 0.09 0.82 -1.61 0.00 0.00 178.31 178.55 1dps h ILE 41 N 0.48 1.16 -0.73 -0.55 2.04 -0.95 -0.86 117.51 118.08 1dps h ILE 41 Ca 0.07 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 1dps h ILE 41 Cb 0.73 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.85 1dps h ILE 41 CO 0.05 0.15 0.43 -0.78 0.00 0.00 0.00 178.15 178.01 1dps h ASP 42 N 0.19 0.89 -0.16 1.72 3.58 -1.26 -1.55 116.42 119.84 1dps h ASP 42 Ca 0.07 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.40 1dps h ASP 42 Cb 0.16 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 1dps h ASP 42 CO -0.01 0.70 -0.05 0.25 -2.88 0.00 0.00 179.24 177.25 1dps h LEU 43 N 1.00 0.42 -0.73 2.28 5.85 -0.70 -1.43 115.31 122.01 1dps h LEU 43 Ca 0.26 -0.09 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 1dps h LEU 43 Cb -0.02 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1dps h LEU 43 CO -0.05 0.53 -0.32 0.77 -0.34 0.00 0.00 178.44 179.03 1dps h SER 44 N 0.43 0.63 -0.35 1.25 4.64 -0.31 -0.43 113.55 119.41 1dps h SER 44 Ca 0.09 -0.25 -0.10 0.00 -0.47 0.00 0.00 61.79 61.06 1dps h SER 44 Cb 0.36 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1dps h SER 44 CO 0.02 0.91 -0.18 -0.07 -0.87 0.00 0.00 176.83 176.64 1dps h LEU 45 N 0.52 0.75 -0.96 5.97 3.38 -0.86 -3.02 115.31 121.09 1dps h LEU 45 Ca 0.06 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.56 1dps h LEU 45 Cb 0.81 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1dps h LEU 45 CO 0.07 1.00 0.07 0.40 0.09 0.00 0.00 178.44 180.07 1dps h ILE 46 N 0.51 1.24 -0.51 1.22 2.04 -1.12 -1.39 117.51 119.50 1dps h ILE 46 Ca 0.08 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 65.04 1dps h ILE 46 Cb 0.72 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1dps h ILE 46 CO 0.05 0.33 0.32 0.74 0.00 0.00 0.00 178.15 179.60 1dps h THR 47 N 0.79 1.10 -0.28 -0.27 2.02 -1.01 -1.56 112.91 113.70 1dps h THR 47 Ca 0.16 -0.22 -0.18 0.00 0.77 0.00 0.00 66.41 66.94 1dps h THR 47 Cb 0.37 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1dps h THR 47 CO 0.01 0.12 -0.53 0.11 0.37 0.00 0.00 175.52 175.59 1dps h LYS 48 N 0.65 0.86 -0.62 6.66 1.79 -1.40 -1.69 116.57 122.83 1dps h LYS 48 Ca 0.19 -0.55 0.11 0.00 -2.18 0.00 0.00 60.65 58.23 1dps h LYS 48 Cb -0.04 0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 30.59 1dps h LYS 48 CO -0.06 1.18 0.18 0.37 -1.08 0.00 0.00 179.45 180.04 1dps h GLN 49 N 0.64 0.31 -0.08 3.15 5.75 -0.93 -0.84 115.11 123.12 1dps h GLN 49 Ca 0.01 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 1dps h GLN 49 Cb 1.14 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.62 1dps h GLN 49 CO 0.12 0.21 -0.10 0.00 -2.65 0.00 0.00 178.83 176.41 1dps h ALA 50 N 1.47 0.11 -0.61 3.38 0.00 -1.27 -3.13 119.26 119.21 1dps h ALA 50 Ca 0.32 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1dps h ALA 50 Cb 0.46 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1dps h ALA 50 CO -0.38 -0.04 0.40 1.25 0.00 0.00 0.00 179.25 180.48 1dps h HIS 51 N -0.24 0.77 -0.15 0.00 -0.00 -0.88 -2.57 115.15 112.07 1dps h HIS 51 Ca 0.01 0.02 -0.17 0.00 -0.00 0.00 0.00 60.37 60.22 1dps h HIS 51 Cb 0.63 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 27.77 1dps h HIS 51 CO 0.10 0.49 -0.62 -1.49 -0.00 0.00 0.00 177.93 176.41 1dps h TRP 52 N 0.83 0.68 -0.57 5.26 6.55 -1.24 -3.35 115.95 124.11 1dps h TRP 52 Ca 0.22 -0.26 0.00 0.00 0.95 0.00 0.00 58.89 59.80 1dps h TRP 52 Cb -0.09 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.09 1dps h TRP 52 CO 0.00 1.01 0.00 0.09 -1.05 0.00 0.00 178.44 178.49 1dps n ASN 53 N -3.92 4.89 -4.86 -3.49 3.02 -0.99 -4.99 115.26 104.92 1dps n ASN 53 Ca -0.04 -2.64 -0.26 0.00 -0.03 0.00 0.00 54.58 51.61 1dps n ASN 53 Cb 0.64 -0.59 -0.04 0.00 -0.61 0.00 0.00 39.78 39.18 1dps n ASN 53 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dps s MET 54 N -2.20 3.11 0.07 3.52 0.23 -1.09 -4.38 119.30 118.56 1dps s MET 54 Ca 0.50 -0.77 -0.26 0.00 -1.03 0.00 0.00 55.69 54.13 1dps s MET 54 Cb 0.35 -2.77 0.07 0.00 -1.53 0.00 0.00 34.83 30.95 1dps s MET 54 CO 0.20 0.50 0.63 -0.98 -2.03 0.00 0.00 175.02 173.34 1dps s ARG 55 N -3.17 1.19 0.00 3.16 1.70 0.02 -4.95 118.95 116.90 1dps s ARG 55 Ca 0.32 -0.17 0.00 0.00 -0.47 0.00 0.00 55.73 55.42 1dps s ARG 55 Cb -0.10 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.83 1dps s ARG 55 CO 0.25 -0.46 0.00 0.41 -1.08 0.00 0.00 175.30 174.42 1dps n GLY 56 N 0.16 0.43 3.62 3.88 0.00 -1.26 -1.72 105.19 110.30 1dps n GLY 56 Ca -0.18 -2.26 -0.45 0.00 0.00 0.00 0.00 46.02 43.13 1dps n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dps n ALA 57 N -1.00 0.16 -2.07 4.61 0.00 -1.26 -2.21 120.51 118.75 1dps n ALA 57 Ca 0.00 0.41 -0.19 0.00 0.00 0.00 0.00 53.44 53.66 1dps n ALA 57 Cb 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 1dps n ALA 57 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1dps n ASN 58 N 1.51 -5.38 0.33 0.00 5.15 -1.26 -4.79 115.26 110.82 1dps n ASN 58 Ca 0.10 0.15 -0.18 0.00 -0.60 0.00 0.00 54.58 54.06 1dps n ASN 58 Cb 0.31 -4.47 -0.09 0.00 -0.53 0.00 0.00 39.78 35.00 1dps n ASN 58 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 1dps h PHE 59 N 0.00 -1.21 -0.31 1.20 3.57 -1.82 -2.94 116.94 115.43 1dps h PHE 59 Ca -0.43 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.10 1dps h PHE 59 Cb 1.29 0.45 -0.03 0.00 2.79 0.00 0.00 35.95 40.46 1dps h PHE 59 CO 0.51 -0.64 0.15 0.97 -2.23 0.00 0.00 178.31 177.07 1dps h ILE 60 N -1.00 0.98 -0.52 1.41 6.09 -1.92 0.17 117.51 122.72 1dps h ILE 60 Ca -0.07 -0.11 -0.06 0.00 -1.37 0.00 0.00 64.86 63.26 1dps h ILE 60 Cb 0.84 0.64 -0.02 0.00 0.47 0.00 0.00 36.82 38.75 1dps h ILE 60 CO 0.01 0.06 0.10 0.00 -3.07 0.00 0.00 178.15 175.25 1dps h ALA 61 N 1.16 0.68 -0.32 0.18 0.00 -2.00 -0.47 119.26 118.50 1dps h ALA 61 Ca 0.13 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1dps h ALA 61 Cb 0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1dps h ALA 61 CO -0.10 0.40 -0.08 0.28 0.00 0.00 0.00 179.25 179.76 1dps h VAL 62 N 0.73 1.28 -0.22 0.00 2.07 -1.34 -0.98 116.25 117.79 1dps h VAL 62 Ca 0.16 -1.12 0.05 0.00 0.82 0.00 0.00 66.70 66.61 1dps h VAL 62 Cb 0.37 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 1dps h VAL 62 CO 0.01 0.36 -0.08 -0.74 0.02 0.00 0.00 177.57 177.14 1dps h HIS 63 N 0.40 -0.18 -0.46 1.57 6.17 -0.42 -1.39 115.15 120.83 1dps h HIS 63 Ca 0.08 0.02 -0.09 0.00 0.71 0.00 0.00 60.37 61.09 1dps h HIS 63 Cb 0.57 0.12 -0.02 0.00 2.52 0.00 0.00 27.41 30.59 1dps h HIS 63 CO 0.05 -0.13 -0.09 0.93 0.71 0.00 0.00 177.93 179.40 1dps h GLU 64 N -0.04 0.82 -0.59 5.26 5.08 -1.07 -2.86 114.58 121.17 1dps h GLU 64 Ca 0.11 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1dps h GLU 64 Cb 0.21 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1dps h GLU 64 CO -0.25 0.88 0.33 1.98 -1.00 0.00 0.00 179.01 180.95 1dps h MET 65 N 0.74 0.82 -0.29 2.33 4.05 -0.79 -2.42 114.93 119.37 1dps h MET 65 Ca 0.13 -0.09 -0.07 0.00 -0.28 0.00 0.00 59.70 59.39 1dps h MET 65 Cb 0.58 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.20 1dps h MET 65 CO 0.04 0.61 -0.12 -0.07 0.23 0.00 0.00 176.91 177.59 1dps h LEU 66 N 0.80 0.47 -0.88 3.39 3.38 -1.19 -2.08 115.31 119.20 1dps h LEU 66 Ca 0.21 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1dps h LEU 66 Cb 0.03 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1dps h LEU 66 CO -0.04 0.63 0.40 -0.78 0.09 0.00 0.00 178.44 178.74 1dps h ASP 67 N 0.45 1.10 -0.67 -0.43 3.58 -1.21 -1.66 116.42 117.57 1dps h ASP 67 Ca 0.08 -0.13 -0.06 0.00 0.42 0.00 0.00 57.03 57.34 1dps h ASP 67 Cb 0.49 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 41.23 1dps h ASP 67 CO 0.03 0.93 0.20 1.23 -2.88 0.00 0.00 179.24 178.74 1dps h GLY 68 N 1.20 1.16 1.00 -0.78 0.00 -1.11 -2.72 103.07 101.82 1dps h GLY 68 Ca 0.29 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1dps h GLY 68 CO -0.04 0.64 0.33 0.74 0.00 0.00 0.00 176.54 178.22 1dps h PHE 69 N 1.03 0.66 -0.66 5.60 0.04 -0.86 -2.66 116.94 120.08 1dps h PHE 69 Ca 0.22 0.01 0.10 0.00 2.80 0.00 0.00 57.97 61.10 1dps h PHE 69 Cb 0.32 -0.22 -0.07 0.00 2.20 0.00 0.00 35.95 38.18 1dps h PHE 69 CO 0.02 0.43 0.28 -0.09 -0.60 0.00 0.00 178.31 178.36 1dps h ARG 70 N 0.69 0.47 -0.19 1.51 1.12 -1.01 -0.83 114.38 116.14 1dps h ARG 70 Ca 0.19 -0.03 0.01 0.00 -1.11 0.00 0.00 59.98 59.04 1dps h ARG 70 Cb -0.05 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 29.78 1dps h ARG 70 CO -0.04 0.31 0.09 1.15 -3.11 0.00 0.00 179.97 178.37 1dps h THR 71 N 0.49 0.99 -0.61 0.20 2.02 -1.31 -1.55 112.91 113.13 1dps h THR 71 Ca 0.34 -0.06 -0.03 0.00 0.77 0.00 0.00 66.41 67.42 1dps h THR 71 Cb 0.40 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1dps h THR 71 CO -0.30 0.03 0.27 0.00 0.37 0.00 0.00 175.52 175.89 1dps h ALA 72 N 1.10 0.78 -0.48 6.16 0.00 -1.10 -2.33 119.26 123.39 1dps h ALA 72 Ca 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1dps h ALA 72 Cb 0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1dps h ALA 72 CO -0.06 0.37 0.21 -0.07 0.00 0.00 0.00 179.25 179.70 1dps h LEU 73 N 0.84 0.65 -1.37 0.00 3.38 -0.94 -1.63 115.31 116.24 1dps h LEU 73 Ca 0.21 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1dps h LEU 73 Cb 0.16 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1dps h LEU 73 CO -0.02 0.62 -0.30 0.16 0.09 0.00 0.00 178.44 178.98 1dps h ILE 74 N 0.64 1.05 -0.19 1.22 3.07 -1.11 -1.16 117.51 121.02 1dps h ILE 74 Ca 0.16 -1.11 -0.11 0.00 1.55 0.00 0.00 64.86 65.35 1dps h ILE 74 Cb 0.16 1.63 -0.00 0.00 -0.27 0.00 0.00 36.82 38.34 1dps h ILE 74 CO -0.02 0.30 -0.31 0.44 -1.05 0.00 0.00 178.15 177.51 1dps h ASP 75 N 0.00 0.60 -0.14 2.16 3.32 -1.03 -1.89 116.42 119.45 1dps h ASP 75 Ca -0.00 -0.53 -0.01 0.00 0.02 0.00 0.00 57.03 56.51 1dps h ASP 75 Cb 0.60 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1dps h ASP 75 CO 0.04 1.02 0.06 0.45 -1.72 0.00 0.00 179.24 179.09 1dps h HIS 76 N 0.20 0.20 -0.31 4.55 3.86 -1.09 -2.23 115.15 120.34 1dps h HIS 76 Ca 0.01 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1dps h HIS 76 Cb 0.90 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 1dps h HIS 76 CO 0.09 0.25 -0.02 1.37 0.86 0.00 0.00 177.93 180.48 1dps h LEU 77 N 0.09 0.45 -0.58 2.43 8.10 -1.24 -1.58 115.31 122.99 1dps h LEU 77 Ca 0.05 -0.09 -0.05 0.00 0.11 0.00 0.00 57.88 57.91 1dps h LEU 77 Cb 0.13 -0.12 -0.02 0.00 -0.44 0.00 0.00 40.66 40.21 1dps h LEU 77 CO -0.01 0.54 0.18 0.44 -4.11 0.00 0.00 178.44 175.49 1dps h ASP 78 N 0.46 0.84 -0.88 0.17 5.19 -1.23 -0.71 116.42 120.25 1dps h ASP 78 Ca 0.10 -0.21 0.01 0.00 -0.62 0.00 0.00 57.03 56.31 1dps h ASP 78 Cb 0.34 -0.22 -0.04 0.00 0.18 0.00 0.00 39.33 39.59 1dps h ASP 78 CO 0.01 0.82 0.58 0.74 -3.12 0.00 0.00 179.24 178.27 1dps h THR 79 N 0.81 1.23 -0.41 0.35 2.02 -0.80 -0.05 112.91 116.05 1dps h THR 79 Ca 0.19 -0.42 -0.09 0.00 0.77 0.00 0.00 66.41 66.86 1dps h THR 79 Cb 0.28 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.61 1dps h THR 79 CO -0.01 0.22 -0.09 0.24 0.37 0.00 0.00 175.52 176.26 1dps h MET 80 N 1.20 0.79 -0.50 6.66 2.86 -1.01 -1.76 114.93 123.17 1dps h MET 80 Ca 0.32 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1dps h MET 80 Cb -0.13 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 1dps h MET 80 CO -0.07 0.91 0.16 0.00 1.06 0.00 0.00 176.91 178.97 1dps h ALA 81 N 0.85 0.66 -0.77 6.32 0.00 -0.80 -1.65 119.26 123.87 1dps h ALA 81 Ca 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1dps h ALA 81 Cb 0.61 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1dps h ALA 81 CO 0.04 0.32 0.34 0.93 0.00 0.00 0.00 179.25 180.87 1dps h GLU 82 N 0.68 1.12 -0.55 0.00 5.08 -0.91 -2.09 114.58 117.91 1dps h GLU 82 Ca 0.16 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1dps h GLU 82 Cb 0.27 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1dps h GLU 82 CO -0.01 0.89 0.22 -0.09 -1.00 0.00 0.00 179.01 179.02 1dps h ARG 83 N 1.11 0.83 -0.39 2.33 9.65 -0.94 -1.19 114.38 125.78 1dps h ARG 83 Ca 0.26 -0.15 0.04 0.00 -1.10 0.00 0.00 59.98 59.03 1dps h ARG 83 Cb 0.16 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.56 1dps h ARG 83 CO -0.03 0.73 0.15 0.00 2.80 0.00 0.00 179.97 183.62 1dps h ALA 84 N 1.07 0.47 0.00 2.80 0.00 -0.83 -2.26 119.26 120.51 1dps h ALA 84 Ca 0.18 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1dps h ALA 84 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1dps h ALA 84 CO -0.01 -0.23 -0.57 -0.39 0.00 0.00 0.00 179.25 178.04 1dps h VAL 85 N 0.32 1.38 -0.29 0.00 -1.51 -1.18 -1.74 116.25 113.24 1dps h VAL 85 Ca 0.18 -1.98 -0.03 0.00 -1.23 0.00 0.00 66.70 63.64 1dps h VAL 85 Cb 0.14 2.07 -0.02 0.00 -2.13 0.00 0.00 31.29 31.36 1dps h VAL 85 CO -0.17 0.56 0.06 1.56 -1.23 0.00 0.00 177.57 178.35 1dps h GLN 86 N 0.00 0.42 -0.05 5.19 4.20 -0.74 -1.33 115.11 122.79 1dps h GLN 86 Ca -0.01 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1dps h GLN 86 Cb 1.03 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1dps h GLN 86 CO 0.07 0.40 0.00 1.28 -0.67 0.00 0.00 178.83 179.91 1dps n LEU 87 N -4.36 0.59 0.00 1.46 4.77 -0.89 -4.89 117.00 113.67 1dps n LEU 87 Ca 0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1dps n LEU 87 Cb 0.18 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1dps n LEU 87 CO 0.37 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1dps n GLY 88 N 0.95 0.71 3.99 -0.72 0.00 -0.50 -4.84 105.19 104.78 1dps n GLY 88 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 1dps n GLY 88 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1dps s GLY 89 N -1.51 1.75 -0.24 -0.02 0.00 -0.68 -0.57 107.32 106.05 1dps s GLY 89 Ca 0.00 -1.82 -0.06 0.00 0.00 0.00 0.00 44.72 42.85 1dps s GLY 89 CO 0.00 -1.16 0.02 0.14 0.00 0.00 0.00 173.10 172.10 1dps s VAL 90 N -3.30 3.85 0.08 1.40 1.01 -1.26 -4.20 120.40 117.98 1dps s VAL 90 Ca 0.69 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 1dps s VAL 90 Cb -0.04 -2.78 -0.06 0.00 0.00 0.00 0.00 36.38 33.50 1dps s VAL 90 CO 0.46 0.38 1.14 0.00 0.00 0.00 0.00 175.10 177.08 1dps s ALA 91 N 1.55 3.35 -0.26 5.51 0.00 -1.26 -4.97 121.76 125.68 1dps s ALA 91 Ca 0.06 0.79 -0.05 0.00 0.00 0.00 0.00 51.96 52.76 1dps s ALA 91 Cb -0.15 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.57 1dps s ALA 91 CO 0.00 -0.34 0.02 -0.51 0.00 0.00 0.00 175.76 174.93 1dps s LEU 92 N 0.67 3.44 0.00 0.00 1.43 -1.26 -4.95 118.68 118.01 1dps s LEU 92 Ca 0.55 -0.63 0.13 0.00 -1.03 0.00 0.00 54.13 53.16 1dps s LEU 92 Cb -0.28 -1.80 0.22 0.00 0.03 0.00 0.00 46.19 44.36 1dps s LEU 92 CO 0.31 -0.12 1.05 0.61 0.23 0.00 0.00 176.35 178.42 1dps n GLY 93 N 4.81 0.80 3.89 -3.19 0.00 -1.26 -4.54 105.19 105.70 1dps n GLY 93 Ca -0.16 -0.44 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 1dps n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dps s THR 94 N 0.00 4.83 0.25 2.61 -4.23 -1.26 -4.92 115.64 112.92 1dps s THR 94 Ca 0.17 0.47 -0.04 0.00 -1.18 0.00 0.00 61.69 61.11 1dps s THR 94 Cb 0.20 -3.83 0.22 0.00 1.34 0.00 0.00 72.50 70.43 1dps s THR 94 CO -0.09 -0.81 1.81 0.74 -0.54 0.00 0.00 174.62 175.73 1dps h THR 95 N 0.37 0.92 -0.70 3.99 2.02 -1.99 -0.91 112.91 116.62 1dps h THR 95 Ca -0.46 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 66.40 1dps h THR 95 Cb 1.20 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1dps h THR 95 CO 0.62 0.15 0.28 1.56 0.37 0.00 0.00 175.52 178.50 1dps h GLN 96 N 0.81 1.04 -0.18 6.66 7.50 -1.99 0.48 115.11 129.44 1dps h GLN 96 Ca 0.40 -0.19 -0.03 0.00 0.50 0.00 0.00 58.65 59.33 1dps h GLN 96 Cb 0.36 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.72 1dps h GLN 96 CO -0.24 0.86 -0.02 0.28 -1.50 0.00 0.00 178.83 178.21 1dps h VAL 97 N 0.99 1.27 -0.12 -0.54 2.07 -1.81 -2.29 116.25 115.82 1dps h VAL 97 Ca 0.23 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1dps h VAL 97 Cb 0.21 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1dps h VAL 97 CO -0.02 0.28 0.08 0.40 0.02 0.00 0.00 177.57 178.33 1dps h ILE 98 N 0.06 1.05 -0.84 4.57 2.04 -1.01 0.46 117.51 123.83 1dps h ILE 98 Ca 0.05 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1dps h ILE 98 Cb 0.44 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.38 1dps h ILE 98 CO 0.01 0.04 0.52 -1.13 0.00 0.00 0.00 178.15 177.59 1dps h ASN 99 N 0.14 0.99 0.29 1.72 -0.73 -0.93 0.78 115.58 117.84 1dps h ASN 99 Ca 0.04 -0.05 -0.19 0.00 1.87 0.00 0.00 56.30 57.98 1dps h ASN 99 Cb 0.00 -0.25 -0.00 0.00 0.27 0.00 0.00 38.32 38.34 1dps h ASN 99 CO -0.01 0.75 -0.76 -1.28 -0.37 0.00 0.00 177.43 175.76 1dps h SER 100 N 1.15 0.47 -0.00 1.15 0.87 -1.05 -3.38 113.55 112.76 1dps h SER 100 Ca 0.30 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1dps h SER 100 Cb -0.07 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 1dps h SER 100 CO -0.06 1.06 -0.38 0.29 -0.53 0.00 0.00 176.83 177.21 1dps n LYS 101 N -3.82 3.34 -1.72 2.24 5.02 0.12 -5.03 118.16 118.32 1dps n LYS 101 Ca -0.04 -0.17 -0.43 0.00 -2.02 0.00 0.00 58.31 55.64 1dps n LYS 101 Cb 0.73 -0.99 -0.02 0.00 -0.02 0.00 0.00 35.03 34.73 1dps n LYS 101 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1dps n THR 102 N -0.95 1.33 1.19 -0.18 5.66 0.24 -4.89 114.28 116.68 1dps n THR 102 Ca 0.02 -0.33 0.13 0.00 -3.05 0.00 0.00 64.05 60.83 1dps n THR 102 Cb 0.17 -1.73 0.47 0.00 -1.55 0.00 0.00 70.33 67.69 1dps n THR 102 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1dps n PRO 103 N 1.57 0.38 -3.30 1.09 -0.04 -1.26 -4.89 135.00 128.54 1dps n PRO 103 Ca 0.08 -0.16 -0.38 0.00 -0.04 0.00 0.00 63.50 63.00 1dps n PRO 103 Cb 0.35 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.26 1dps n PRO 103 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1dps s LEU 104 N -2.73 4.37 0.30 1.53 1.43 -1.26 -5.04 118.68 117.28 1dps s LEU 104 Ca 0.20 0.98 -0.29 0.00 -1.03 0.00 0.00 54.13 53.99 1dps s LEU 104 Cb 0.19 -2.77 -0.10 0.00 0.03 0.00 0.00 46.19 43.54 1dps s LEU 104 CO 0.56 0.10 1.37 -0.75 0.23 0.00 0.00 176.35 177.86 1dps s LYS 105 N -0.01 4.30 -0.08 1.70 2.20 -1.26 -4.88 119.74 121.71 1dps s LYS 105 Ca 0.28 2.28 -0.40 0.00 -0.36 0.00 0.00 55.97 57.77 1dps s LYS 105 Cb -0.17 -3.08 -0.18 0.00 -1.51 0.00 0.00 37.83 32.89 1dps s LYS 105 CO 0.14 -0.31 1.35 0.45 -0.36 0.00 0.00 175.35 176.62 1dps n SER 106 N 1.39 1.17 -4.73 1.43 2.88 -1.26 -4.87 113.62 109.63 1dps n SER 106 Ca 0.03 1.13 -0.41 0.00 -1.33 0.00 0.00 58.87 58.29 1dps n SER 106 Cb 0.41 -1.05 -0.03 0.00 -0.75 0.00 0.00 64.21 62.78 1dps n SER 106 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1dps s TYR 107 N 1.15 3.45 0.18 0.66 5.04 -1.26 -4.97 117.35 121.59 1dps s TYR 107 Ca 0.91 1.43 -0.32 0.00 -2.44 0.00 0.00 57.07 56.66 1dps s TYR 107 Cb -1.15 -3.41 -0.11 0.00 0.35 0.00 0.00 41.96 37.64 1dps s TYR 107 CO 0.58 -1.14 1.72 -1.25 -1.34 0.00 0.00 175.55 174.12 1dps s PRO 108 N -0.07 4.14 0.00 4.97 0.04 -1.26 -4.90 135.00 137.92 1dps s PRO 108 Ca 0.53 2.56 0.27 0.00 0.04 0.00 0.00 61.00 64.39 1dps s PRO 108 Cb -0.32 -3.22 0.75 0.00 0.04 0.00 0.00 34.50 31.76 1dps s PRO 108 CO 0.35 -0.75 1.57 1.28 0.04 0.00 0.00 177.00 179.50 1dps n LEU 109 N 4.41 1.79 -0.35 -3.56 4.77 -1.26 -4.36 117.00 118.44 1dps n LEU 109 Ca 0.16 -0.59 0.08 0.00 -0.03 0.00 0.00 56.01 55.63 1dps n LEU 109 Cb 0.37 -0.02 0.16 0.00 -2.33 0.00 0.00 43.42 41.60 1dps n LEU 109 CO 0.64 0.30 0.61 -0.90 -1.33 0.00 0.00 177.39 176.71 1dps n ASP 110 N 0.29 2.81 -4.80 -1.43 5.75 -1.26 -5.02 116.55 112.89 1dps n ASP 110 Ca 0.16 -2.85 -0.29 0.00 -0.01 0.00 0.00 54.79 51.80 1dps n ASP 110 Cb 0.41 -0.40 -0.06 0.00 -1.03 0.00 0.00 41.12 40.05 1dps n ASP 110 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1dps s ILE 111 N -2.50 4.61 0.00 2.12 -4.36 -1.26 -5.03 121.20 114.78 1dps s ILE 111 Ca 0.30 -0.86 0.00 0.00 -0.26 0.00 0.00 60.65 59.84 1dps s ILE 111 Cb 0.25 -3.28 0.00 0.00 1.25 0.00 0.00 42.46 40.68 1dps s ILE 111 CO 0.05 0.03 0.00 1.41 0.24 0.00 0.00 174.94 176.67 1dps n HIS 112 N 0.09 0.00 -1.67 1.37 8.25 -1.26 -4.82 115.22 117.18 1dps n HIS 112 Ca -0.08 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 56.93 1dps n HIS 112 Cb 0.53 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 1dps n HIS 112 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1dps n ASN 113 N -1.40 2.82 -0.28 0.41 5.15 -1.26 -0.80 115.26 119.90 1dps n ASN 113 Ca 0.00 1.13 0.06 0.00 -0.60 0.00 0.00 54.58 55.17 1dps n ASN 113 Cb 0.12 -1.43 0.21 0.00 -0.53 0.00 0.00 39.78 38.15 1dps n ASN 113 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1dps h VAL 114 N 3.17 0.68 -0.41 3.44 2.07 -1.64 -1.25 116.25 122.32 1dps h VAL 114 Ca -0.45 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 1dps h VAL 114 Cb 1.27 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1dps h VAL 114 CO 0.78 0.10 0.04 1.56 0.02 0.00 0.00 177.57 180.07 1dps h GLN 115 N 0.53 0.63 -0.32 1.57 1.08 -1.89 -0.12 115.11 116.60 1dps h GLN 115 Ca 0.44 -0.14 -0.07 0.00 -1.45 0.00 0.00 58.65 57.44 1dps h GLN 115 Cb 0.66 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 1dps h GLN 115 CO -0.39 0.63 -0.07 -0.44 -0.95 0.00 0.00 178.83 177.61 1dps h ASP 116 N 0.61 0.61 -0.59 1.46 3.32 -1.61 -2.56 116.42 117.64 1dps h ASP 116 Ca 0.13 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 1dps h ASP 116 Cb 0.33 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1dps h ASP 116 CO 0.01 0.82 0.21 0.45 -1.72 0.00 0.00 179.24 179.01 1dps h HIS 117 N 0.38 0.93 -0.97 4.55 3.86 -1.08 -2.33 115.15 120.49 1dps h HIS 117 Ca 0.08 -0.08 0.02 0.00 -1.16 0.00 0.00 60.37 59.23 1dps h HIS 117 Cb 0.55 -0.27 -0.05 0.00 1.06 0.00 0.00 27.41 28.70 1dps h HIS 117 CO 0.05 0.76 0.64 -0.07 0.86 0.00 0.00 177.93 180.17 1dps h LEU 118 N 0.83 1.10 -0.39 2.43 3.38 -0.98 0.67 115.31 122.36 1dps h LEU 118 Ca 0.19 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 1dps h LEU 118 Cb 0.24 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1dps h LEU 118 CO -0.01 0.79 -0.28 0.11 0.09 0.00 0.00 178.44 179.14 1dps h LYS 119 N 1.30 0.87 -0.66 1.13 1.57 -1.23 0.91 116.57 120.46 1dps h LYS 119 Ca 0.36 -0.42 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1dps h LYS 119 Cb -0.12 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 1dps h LYS 119 CO -0.09 1.07 0.09 0.93 -0.57 0.00 0.00 179.45 180.89 1dps h GLU 120 N 0.68 1.10 -0.36 3.15 4.39 -1.09 -2.27 114.58 120.19 1dps h GLU 120 Ca 0.07 -0.30 -0.08 0.00 0.34 0.00 0.00 59.36 59.40 1dps h GLU 120 Cb 0.86 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 1dps h GLU 120 CO 0.08 1.02 -0.07 -0.07 -1.16 0.00 0.00 179.01 178.80 1dps h LEU 121 N 1.02 0.69 -1.07 1.33 3.38 -0.79 -2.85 115.31 117.01 1dps h LEU 121 Ca 0.20 -0.36 0.04 0.00 0.09 0.00 0.00 57.88 57.85 1dps h LEU 121 Cb 0.46 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 1dps h LEU 121 CO 0.02 0.88 0.62 0.00 0.09 0.00 0.00 178.44 180.05 1dps h ALA 122 N 0.83 1.39 -0.55 1.53 0.00 -0.62 0.20 119.26 122.03 1dps h ALA 122 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1dps h ALA 122 Cb 0.57 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1dps h ALA 122 CO 0.03 0.51 0.06 -0.44 0.00 0.00 0.00 179.25 179.42 1dps h ASP 123 N 1.19 0.91 -0.02 0.00 3.32 -1.38 -1.42 116.42 119.01 1dps h ASP 123 Ca 0.38 -0.28 -0.26 0.00 0.02 0.00 0.00 57.03 56.89 1dps h ASP 123 Cb 0.02 -0.24 0.02 0.00 0.22 0.00 0.00 39.33 39.35 1dps h ASP 123 CO -0.12 0.95 -1.00 0.03 -1.72 0.00 0.00 179.24 177.38 1dps h ARG 124 N 0.82 0.72 -0.46 3.56 3.08 -1.12 -2.47 114.38 118.51 1dps h ARG 124 Ca 0.16 -0.75 -0.05 0.00 0.07 0.00 0.00 59.98 59.42 1dps h ARG 124 Cb 0.45 0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1dps h ARG 124 CO 0.02 1.32 0.09 1.88 -1.07 0.00 0.00 179.97 182.21 1dps h TYR 125 N 0.42 0.71 -0.59 3.04 -1.99 -0.65 -2.40 116.97 115.51 1dps h TYR 125 Ca -0.12 -0.06 -0.10 0.00 2.00 0.00 0.00 58.73 60.45 1dps h TYR 125 Cb 1.65 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 40.15 1dps h TYR 125 CO 0.10 0.62 -0.01 0.00 -0.00 0.00 0.00 178.16 178.87 1dps h ALA 126 N 1.43 0.86 -0.08 3.88 0.00 -1.18 0.29 119.26 124.46 1dps h ALA 126 Ca 0.15 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1dps h ALA 126 Cb 0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1dps h ALA 126 CO 0.00 0.66 0.01 0.82 0.00 0.00 0.00 179.25 180.74 1dps h ILE 127 N 0.94 0.96 -0.20 0.00 1.08 -1.02 -0.40 117.51 118.87 1dps h ILE 127 Ca 0.17 -0.02 -0.04 0.00 -0.39 0.00 0.00 64.86 64.58 1dps h ILE 127 Cb 0.56 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 1dps h ILE 127 CO 0.03 0.01 -0.03 0.58 -0.69 0.00 0.00 178.15 178.05 1dps h VAL 128 N 0.05 1.27 -0.38 1.67 2.07 -1.28 -2.37 116.25 117.29 1dps h VAL 128 Ca 0.04 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 1dps h VAL 128 Cb 0.03 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1dps h VAL 128 CO -0.05 0.29 0.22 0.00 0.02 0.00 0.00 177.57 178.05 1dps h ALA 129 N 0.76 0.48 -0.40 1.67 0.00 -0.33 -0.60 119.26 120.84 1dps h ALA 129 Ca 0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1dps h ALA 129 Cb 0.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1dps h ALA 129 CO 0.02 -0.01 -0.08 -0.91 0.00 0.00 0.00 179.25 178.26 1dps h ASN 130 N 0.49 0.66 -0.08 0.00 2.35 -1.12 -1.98 115.58 115.90 1dps h ASN 130 Ca 0.13 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 1dps h ASN 130 Cb 0.02 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.22 1dps h ASN 130 CO -0.02 0.78 -0.31 -0.78 -1.65 0.00 0.00 177.43 175.44 1dps h ASP 131 N 0.62 0.41 0.20 5.81 3.58 -1.11 -2.75 116.42 123.19 1dps h ASP 131 Ca 0.11 -0.63 -0.08 0.00 0.42 0.00 0.00 57.03 56.85 1dps h ASP 131 Cb 0.51 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.43 1dps h ASP 131 CO 0.03 0.98 -0.31 1.62 -2.88 0.00 0.00 179.24 178.67 1dps h VAL 132 N -0.13 1.26 -0.64 2.25 3.04 -1.09 -0.62 116.25 120.32 1dps h VAL 132 Ca -0.02 -1.23 -0.05 0.00 -1.01 0.00 0.00 66.70 64.39 1dps h VAL 132 Cb 0.96 1.53 -0.03 0.00 -2.01 0.00 0.00 31.29 31.74 1dps h VAL 132 CO 0.07 0.37 0.19 -0.09 -1.01 0.00 0.00 177.57 177.10 1dps h ARG 133 N 0.16 1.00 -0.30 4.17 2.43 -1.37 -2.36 114.38 118.12 1dps h ARG 133 Ca 0.02 -0.22 -0.12 0.00 -0.81 0.00 0.00 59.98 58.85 1dps h ARG 133 Cb 0.64 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1dps h ARG 133 CO 0.05 0.88 -0.32 0.87 -1.51 0.00 0.00 179.97 179.94 1dps h LYS 134 N 0.93 0.65 -0.23 0.20 1.57 -1.17 -3.09 116.57 115.44 1dps h LYS 134 Ca 0.21 -0.30 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1dps h LYS 134 Cb 0.31 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 1dps h LYS 134 CO -0.01 0.89 0.13 0.00 -0.57 0.00 0.00 179.45 179.89 1dps h ALA 135 N 1.09 1.79 -0.34 3.86 0.00 -0.62 -2.58 119.26 122.46 1dps h ALA 135 Ca 0.06 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1dps h ALA 135 Cb 0.83 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1dps h ALA 135 CO 0.07 0.18 -0.11 0.82 0.00 0.00 0.00 179.25 180.21 1dps h ILE 136 N 0.31 0.61 0.00 0.00 2.04 -1.37 -0.99 117.51 118.11 1dps h ILE 136 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.94 1dps h ILE 136 Cb 0.01 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1dps h ILE 136 CO -0.01 0.00 0.00 1.23 0.00 0.00 0.00 178.15 179.37 1dps h GLY 137 N -0.04 0.00 0.29 5.37 0.00 -1.60 -2.98 103.07 104.11 1dps h GLY 137 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1dps h GLY 137 CO -0.37 0.00 -1.51 1.18 0.00 0.00 0.00 176.54 175.84 1dps n GLU 138 N -2.47 0.49 -2.37 4.80 1.02 -0.44 -4.88 120.64 116.78 1dps n GLU 138 Ca 0.00 -0.08 -0.41 0.00 -0.02 0.00 0.00 57.16 56.65 1dps n GLU 138 Cb 0.18 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 1dps n GLU 138 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dps s ALA 139 N -3.36 2.78 0.24 0.62 0.00 -0.80 -4.87 121.76 116.36 1dps s ALA 139 Ca -0.02 -0.67 0.16 0.00 0.00 0.00 0.00 51.96 51.42 1dps s ALA 139 Cb 0.14 -4.11 0.63 0.00 0.00 0.00 0.00 23.12 19.77 1dps s ALA 139 CO 0.86 -2.97 1.73 0.87 0.00 0.00 0.00 175.76 176.25 1dps h LYS 140 N 11.22 0.00 -6.36 0.00 1.79 -1.89 -3.42 116.57 117.90 1dps h LYS 140 Ca -0.27 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.63 1dps h LYS 140 Cb 1.09 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.70 1dps h LYS 140 CO 1.18 0.43 0.98 0.34 -1.08 0.00 0.00 179.45 181.30 1dps s ASP 141 N -6.61 6.64 0.21 0.86 2.15 -1.26 -4.92 116.67 113.75 1dps s ASP 141 Ca -0.01 1.21 -0.09 0.00 0.43 0.00 0.00 52.55 54.09 1dps s ASP 141 Cb 0.12 -2.54 0.31 0.00 -0.30 0.00 0.00 42.92 40.51 1dps s ASP 141 CO 0.71 -1.10 1.72 0.44 -0.17 0.00 0.00 175.17 176.77 1dps h ASP 142 N 9.42 0.13 -0.78 -0.34 3.32 -2.00 -1.13 116.42 125.04 1dps h ASP 142 Ca -0.27 0.10 0.01 0.00 0.02 0.00 0.00 57.03 56.89 1dps h ASP 142 Cb 1.10 0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.72 1dps h ASP 142 CO 1.03 0.07 0.52 0.44 -1.72 0.00 0.00 179.24 179.58 1dps h ASP 143 N 0.34 0.89 -0.45 6.45 3.32 -1.96 -1.97 116.42 123.04 1dps h ASP 143 Ca 0.32 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.26 1dps h ASP 143 Cb 0.45 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1dps h ASP 143 CO -0.36 0.64 -0.08 0.74 -1.72 0.00 0.00 179.24 178.45 1dps h THR 144 N 1.05 1.27 -0.72 0.35 2.02 -1.79 -2.09 112.91 113.00 1dps h THR 144 Ca 0.29 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.30 1dps h THR 144 Cb -0.10 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 1dps h THR 144 CO -0.07 0.40 0.47 0.00 0.37 0.00 0.00 175.52 176.69 1dps h ALA 145 N 0.88 1.47 -0.25 6.16 0.00 -0.91 -0.52 119.26 126.09 1dps h ALA 145 Ca 0.12 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1dps h ALA 145 Cb 0.61 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1dps h ALA 145 CO 0.04 0.49 -0.01 0.22 0.00 0.00 0.00 179.25 179.99 1dps h ASP 146 N 0.98 0.43 -0.59 0.00 3.58 -1.14 -0.75 116.42 118.94 1dps h ASP 146 Ca 0.26 -0.32 0.03 0.00 0.42 0.00 0.00 57.03 57.43 1dps h ASP 146 Cb -0.10 -0.12 -0.04 0.00 1.72 0.00 0.00 39.33 40.79 1dps h ASP 146 CO -0.06 0.64 0.35 0.40 -2.88 0.00 0.00 179.24 177.70 1dps h ILE 147 N 0.21 1.06 -0.18 2.25 2.04 -0.90 -2.21 117.51 119.78 1dps h ILE 147 Ca 0.07 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.62 1dps h ILE 147 Cb 0.43 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1dps h ILE 147 CO 0.01 0.13 -0.21 -0.07 0.00 0.00 0.00 178.15 178.01 1dps h LEU 148 N 0.70 0.31 -0.47 1.44 3.38 -0.93 -2.23 115.31 117.51 1dps h LEU 148 Ca 0.24 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 1dps h LEU 148 Cb 0.04 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1dps h LEU 148 CO -0.11 0.54 -0.12 0.74 0.09 0.00 0.00 178.44 179.58 1dps h THR 149 N 0.29 1.27 -0.65 0.22 2.02 -0.65 0.10 112.91 115.51 1dps h THR 149 Ca 0.05 -1.25 -0.07 0.00 0.77 0.00 0.00 66.41 65.91 1dps h THR 149 Cb 0.54 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 1dps h THR 149 CO 0.04 0.43 0.13 0.00 0.37 0.00 0.00 175.52 176.49 1dps h ALA 150 N 0.88 0.86 -0.38 6.16 0.00 -1.24 -0.86 119.26 124.68 1dps h ALA 150 Ca 0.12 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1dps h ALA 150 Cb 0.67 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1dps h ALA 150 CO 0.05 0.61 -0.03 0.00 0.00 0.00 0.00 179.25 179.87 1dps h ALA 151 N 1.05 0.51 -0.49 0.00 0.00 -1.22 -2.89 119.26 116.23 1dps h ALA 151 Ca 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1dps h ALA 151 Cb 0.40 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1dps h ALA 151 CO 0.01 0.31 0.27 1.03 0.00 0.00 0.00 179.25 180.87 1dps h SER 152 N 0.50 0.61 -0.89 0.00 0.87 -0.61 -0.77 113.55 113.25 1dps h SER 152 Ca 0.10 -0.09 0.06 0.00 -1.23 0.00 0.00 61.79 60.63 1dps h SER 152 Cb 0.52 -0.16 -0.06 0.00 -0.44 0.00 0.00 62.40 62.26 1dps h SER 152 CO 0.03 0.52 0.56 0.03 -0.53 0.00 0.00 176.83 177.44 1dps h ARG 153 N 0.65 1.01 -0.21 2.24 3.08 -1.10 -0.61 114.38 119.44 1dps h ARG 153 Ca 0.17 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.06 1dps h ARG 153 Cb 0.05 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 1dps h ARG 153 CO -0.03 0.67 -0.26 -0.44 -1.07 0.00 0.00 179.97 178.85 1dps h ASP 154 N 1.04 0.59 -0.80 7.04 3.32 -1.25 -2.46 116.42 123.90 1dps h ASP 154 Ca 0.38 -0.50 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 1dps h ASP 154 Cb 0.13 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 1dps h ASP 154 CO -0.16 0.97 0.49 -0.07 -1.72 0.00 0.00 179.24 178.75 1dps h LEU 155 N 0.22 0.95 -0.61 1.55 -0.00 -0.82 0.46 115.31 117.05 1dps h LEU 155 Ca 0.03 -0.05 -0.15 0.00 -0.00 0.00 0.00 57.88 57.71 1dps h LEU 155 Cb 0.82 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 41.23 1dps h LEU 155 CO 0.06 0.73 -0.48 0.44 -0.00 0.00 0.00 178.44 179.19 1dps h ASP 156 N 1.10 0.57 -0.39 -0.43 5.19 -1.12 -0.57 116.42 120.77 1dps h ASP 156 Ca 0.29 -0.28 -0.05 0.00 -0.62 0.00 0.00 57.03 56.36 1dps h ASP 156 Cb -0.05 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 1dps h ASP 156 CO -0.06 0.96 0.03 0.50 -3.12 0.00 0.00 179.24 177.56 1dps h LYS 157 N 0.41 0.67 -0.44 3.56 3.64 -0.92 -2.22 116.57 121.27 1dps h LYS 157 Ca 0.02 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.16 1dps h LYS 157 Cb 1.00 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.73 1dps h LYS 157 CO 0.09 0.74 0.09 0.74 -2.27 0.00 0.00 179.45 178.84 1dps h PHE 158 N 0.50 0.75 -0.25 1.91 0.04 -0.66 -0.57 116.94 118.66 1dps h PHE 158 Ca 0.11 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 60.82 1dps h PHE 158 Cb 0.42 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1dps h PHE 158 CO 0.03 0.70 0.07 1.25 -0.60 0.00 0.00 178.31 179.77 1dps h LEU 159 N 0.58 0.07 -0.18 1.54 5.85 -1.10 -0.50 115.31 121.57 1dps h LEU 159 Ca 0.14 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1dps h LEU 159 Cb 0.34 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1dps h LEU 159 CO 0.00 0.07 0.02 -0.25 -0.34 0.00 0.00 178.44 177.94 1dps h TRP 160 N 0.18 0.02 -1.00 1.25 7.01 -1.13 -0.23 115.95 122.07 1dps h TRP 160 Ca 0.11 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.14 1dps h TRP 160 Cb 0.09 0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.12 1dps h TRP 160 CO -0.14 -0.00 0.66 0.74 -2.79 0.00 0.00 178.44 176.91 1dps h PHE 161 N 0.08 1.24 0.12 2.65 -1.00 -0.76 0.43 116.94 119.70 1dps h PHE 161 Ca 0.08 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1dps h PHE 161 Cb 0.09 -0.42 0.00 0.00 3.61 0.00 0.00 35.95 39.23 1dps h PHE 161 CO -0.15 0.76 -0.06 0.82 -1.61 0.00 0.00 178.31 178.07 1dps h ILE 162 N 1.32 1.01 -0.90 -0.55 2.04 -0.72 -3.04 117.51 116.67 1dps h ILE 162 Ca 0.37 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1dps h ILE 162 Cb -0.11 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1dps h ILE 162 CO -0.09 0.13 0.55 -0.33 0.00 0.00 0.00 178.15 178.41 1dps h GLU 163 N -0.41 1.22 0.00 2.37 5.08 -0.85 -2.17 114.58 119.82 1dps h GLU 163 Ca -0.02 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1dps h GLU 163 Cb 0.33 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1dps h GLU 163 CO 0.03 0.85 0.00 0.00 -1.00 0.00 0.00 179.01 178.88 1dps n ASN 165 N -3.01 0.93 -4.70 0.00 3.02 -0.82 -4.86 115.26 105.81 1dps n ASN 165 Ca -0.01 -0.79 -0.41 0.00 -0.03 0.00 0.00 54.58 53.34 1dps n ASN 165 Cb 0.18 0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 39.45 1dps n ASN 165 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1dps s ILE 166 N -2.57 4.95 -2.00 2.41 1.01 -0.74 -5.01 121.20 119.25 1dps s ILE 166 Ca 0.23 1.68 0.11 0.00 0.00 0.00 0.00 60.65 62.66 1dps s ILE 166 Cb 0.19 -4.15 0.30 0.00 0.01 0.00 0.00 42.46 38.81 1dps s ILE 166 CO 0.54 0.16 1.07 -0.62 0.00 0.00 0.00 174.94 176.09