#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvb n LYS 2 N 0.00 0.00 -4.04 2.12 0.00 -1.26 -5.09 118.16 109.88 1dvb n LYS 2 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.02 1dvb n LYS 2 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 34.97 1dvb n LYS 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1dvb s SER 3 N -1.00 5.63 -0.06 -5.58 1.04 -1.26 -5.07 113.70 107.40 1dvb s SER 3 Ca 0.00 -0.01 0.13 0.00 0.48 0.00 0.00 55.95 56.55 1dvb s SER 3 Cb 0.00 -1.53 -0.23 0.00 0.10 0.00 0.00 66.02 64.36 1dvb s SER 3 CO 0.00 0.14 0.59 0.18 0.98 0.00 0.00 173.24 175.12 1dvb n LEU 4 N 0.16 0.76 -4.73 2.42 4.32 -1.26 -4.93 117.00 113.75 1dvb n LEU 4 Ca -0.08 0.36 -0.62 0.00 -0.02 0.00 0.00 56.01 55.65 1dvb n LEU 4 Cb 0.53 0.21 -0.08 0.00 -1.62 0.00 0.00 43.42 42.45 1dvb n LEU 4 CO 0.45 0.40 1.26 0.29 -1.22 0.00 0.00 177.39 178.57 1dvb n LYS 5 N -3.01 0.70 0.00 3.23 4.76 -1.26 -0.88 118.16 121.70 1dvb n LYS 5 Ca -0.19 0.26 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 1dvb n LYS 5 Cb 1.07 -1.87 0.00 0.00 -1.84 0.00 0.00 35.03 32.39 1dvb n LYS 5 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dvb n GLY 6 N 4.11 2.92 3.64 0.72 0.00 -1.26 -5.04 105.19 110.28 1dvb n GLY 6 Ca 0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 1dvb n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dvb s SER 7 N -1.31 2.56 0.17 1.61 1.04 -0.06 -4.95 113.70 112.76 1dvb s SER 7 Ca 0.00 1.71 -0.03 0.00 0.48 0.00 0.00 55.95 58.11 1dvb s SER 7 Cb 0.00 -2.34 0.04 0.00 0.10 0.00 0.00 66.02 63.82 1dvb s SER 7 CO 0.00 -3.24 1.43 -0.09 0.98 0.00 0.00 173.24 172.32 1dvb h ARG 8 N -1.97 0.50 -0.65 4.02 1.12 -1.96 -3.14 114.38 112.30 1dvb h ARG 8 Ca -0.51 -0.38 0.11 0.00 -1.11 0.00 0.00 59.98 58.09 1dvb h ARG 8 Cb 1.29 0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 31.28 1dvb h ARG 8 CO 0.49 1.01 0.43 1.15 -3.11 0.00 0.00 179.97 179.94 1dvb h THR 9 N 0.35 0.88 -0.02 0.20 2.02 -1.89 -0.24 112.91 114.20 1dvb h THR 9 Ca -0.02 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.01 1dvb h THR 9 Cb 1.27 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1dvb h THR 9 CO 0.12 0.08 -0.03 -0.08 0.37 0.00 0.00 175.52 175.99 1dvb h GLU 10 N 0.44 -0.04 0.00 6.66 4.81 -1.74 0.15 114.58 124.86 1dvb h GLU 10 Ca 0.30 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 1dvb h GLU 10 Cb 0.60 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 1dvb h GLU 10 CO -0.09 -0.03 -0.29 0.87 -0.73 0.00 0.00 179.01 178.74 1dvb h LYS 11 N -0.04 0.00 -0.32 1.92 1.57 -1.20 -2.76 116.57 115.74 1dvb h LYS 11 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1dvb h LYS 11 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1dvb h LYS 11 CO -0.05 0.29 -0.16 -0.91 -0.57 0.00 0.00 179.45 178.05 1dvb h ASN 12 N 0.00 0.71 -0.24 0.86 -0.26 0.51 -0.10 115.58 117.06 1dvb h ASN 12 Ca -0.00 -0.41 0.01 0.00 -0.56 0.00 0.00 56.30 55.33 1dvb h ASN 12 Cb 0.78 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.83 1dvb h ASN 12 CO 0.04 0.96 0.15 0.40 -1.06 0.00 0.00 177.43 177.92 1dvb h ILE 13 N 0.45 1.04 0.00 2.81 2.04 -0.72 -0.42 117.51 122.71 1dvb h ILE 13 Ca 0.07 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 1dvb h ILE 13 Cb 0.70 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1dvb h ILE 13 CO 0.05 0.06 -0.22 0.25 0.00 0.00 0.00 178.15 178.28 1dvb h LEU 14 N 0.31 0.00 -0.21 1.44 5.85 -1.28 -0.55 115.31 120.86 1dvb h LEU 14 Ca 0.09 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.60 1dvb h LEU 14 Cb -0.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.02 1dvb h LEU 14 CO -0.03 0.22 -0.70 0.74 -0.34 0.00 0.00 178.44 178.32 1dvb h THR 15 N 0.00 1.28 0.17 1.05 2.02 0.04 -0.35 112.91 117.12 1dvb h THR 15 Ca -0.00 -1.90 -0.01 0.00 0.77 0.00 0.00 66.41 65.27 1dvb h THR 15 Cb 0.39 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 1dvb h THR 15 CO 0.03 0.61 -0.08 0.00 0.37 0.00 0.00 175.52 176.44 1dvb h ALA 16 N 0.61 -0.23 -0.95 6.16 0.00 -0.84 -0.61 119.26 123.40 1dvb h ALA 16 Ca -0.03 -0.11 0.26 0.00 0.00 0.00 0.00 54.91 55.03 1dvb h ALA 16 Cb 1.33 0.09 -0.14 0.00 0.00 0.00 0.00 17.79 19.07 1dvb h ALA 16 CO 0.15 -0.55 0.46 0.35 0.00 0.00 0.00 179.25 179.66 1dvb h PHE 17 N -0.39 0.76 -0.32 0.00 3.57 -1.09 0.68 116.94 120.15 1dvb h PHE 17 Ca -0.02 0.04 -0.16 0.00 3.53 0.00 0.00 57.97 61.36 1dvb h PHE 17 Cb 0.30 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1dvb h PHE 17 CO -0.02 -0.10 -0.44 0.00 -2.23 0.00 0.00 178.31 175.52 1dvb h ALA 18 N 1.77 0.61 0.17 2.41 0.00 -0.46 -1.57 119.26 122.20 1dvb h ALA 18 Ca 0.63 -0.47 -0.30 0.00 0.00 0.00 0.00 54.91 54.77 1dvb h ALA 18 Cb 1.31 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 19.00 1dvb h ALA 18 CO -0.57 0.68 -1.38 0.78 0.00 0.00 0.00 179.25 178.75 1dvb h GLY 19 N 0.84 0.42 1.49 0.00 0.00 0.29 -2.84 103.07 103.27 1dvb h GLY 19 Ca 0.04 -1.07 -0.02 0.00 0.00 0.00 0.00 47.33 46.28 1dvb h GLY 19 CO 0.10 0.94 0.21 0.83 0.00 0.00 0.00 176.54 178.62 1dvb h GLU 20 N 0.10 0.66 -0.78 4.80 4.39 0.32 -1.17 114.58 122.91 1dvb h GLU 20 Ca -0.20 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.37 1dvb h GLU 20 Cb 2.05 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 30.54 1dvb h GLU 20 CO 0.22 0.53 0.30 0.77 -1.16 0.00 0.00 179.01 179.67 1dvb h SER 21 N 0.66 1.08 1.02 1.42 0.02 -1.30 -0.80 113.55 115.65 1dvb h SER 21 Ca 0.16 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.87 1dvb h SER 21 Cb 0.10 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1dvb h SER 21 CO -0.02 0.97 -0.28 1.56 -1.14 0.00 0.00 176.83 177.92 1dvb h GLN 22 N 1.13 0.00 -0.09 3.45 4.20 -1.19 -2.93 115.11 119.67 1dvb h GLN 22 Ca 0.26 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.75 1dvb h GLN 22 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1dvb h GLN 22 CO -0.02 0.28 -0.80 0.00 -0.67 0.00 0.00 178.83 177.62 1dvb h ALA 23 N 1.72 0.41 -0.53 3.87 0.00 -0.11 -0.97 119.26 123.65 1dvb h ALA 23 Ca -0.00 -0.62 0.09 0.00 0.00 0.00 0.00 54.91 54.38 1dvb h ALA 23 Cb 0.87 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 1dvb h ALA 23 CO 0.04 0.73 0.10 -0.09 0.00 0.00 0.00 179.25 180.03 1dvb h ARG 24 N 0.39 0.23 -0.10 0.00 2.43 -1.04 0.15 114.38 116.45 1dvb h ARG 24 Ca -0.05 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1dvb h ARG 24 Cb 1.41 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.91 1dvb h ARG 24 CO 0.15 0.15 0.03 -0.91 -1.51 0.00 0.00 179.97 177.89 1dvb h ASN 25 N 0.24 0.14 -0.68 -3.80 2.35 -1.32 0.50 115.58 113.01 1dvb h ASN 25 Ca 0.27 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1dvb h ASN 25 Cb 0.37 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 1dvb h ASN 25 CO -0.35 0.31 0.33 0.03 -1.65 0.00 0.00 177.43 176.09 1dvb h ARG 26 N -0.03 1.01 -0.70 0.81 3.08 -0.73 0.40 114.38 118.22 1dvb h ARG 26 Ca 0.03 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 1dvb h ARG 26 Cb 0.22 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 1dvb h ARG 26 CO -0.00 0.79 0.18 1.88 -1.07 0.00 0.00 179.97 181.75 1dvb h TYR 27 N 1.00 1.18 -0.75 3.04 0.05 -0.54 0.41 116.97 121.36 1dvb h TYR 27 Ca 0.24 -0.14 0.01 0.00 0.05 0.00 0.00 58.73 58.89 1dvb h TYR 27 Cb 0.12 -0.33 -0.04 0.00 1.01 0.00 0.00 36.73 37.49 1dvb h TYR 27 CO 0.01 0.95 0.49 -0.91 -1.05 0.00 0.00 178.16 177.66 1dvb h ASN 28 N 1.06 0.87 0.41 3.88 -0.26 0.27 0.47 115.58 122.29 1dvb h ASN 28 Ca 0.22 -0.03 -0.12 0.00 -0.56 0.00 0.00 56.30 55.81 1dvb h ASN 28 Cb 0.37 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.39 1dvb h ASN 28 CO 0.00 0.64 -0.53 1.88 -1.06 0.00 0.00 177.43 178.36 1dvb h TYR 29 N 1.02 0.16 -0.27 1.19 0.05 0.72 -2.46 116.97 117.38 1dvb h TYR 29 Ca 0.27 -0.05 -0.12 0.00 0.05 0.00 0.00 58.73 58.88 1dvb h TYR 29 Cb -0.11 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.59 1dvb h TYR 29 CO -0.02 0.64 -0.32 0.74 -1.05 0.00 0.00 178.16 178.15 1dvb h PHE 30 N 0.10 0.66 -0.92 4.88 0.04 0.50 -1.98 116.94 120.22 1dvb h PHE 30 Ca -0.00 -0.17 0.09 0.00 2.80 0.00 0.00 57.97 60.69 1dvb h PHE 30 Cb 0.97 -0.15 -0.07 0.00 2.20 0.00 0.00 35.95 38.90 1dvb h PHE 30 CO 0.01 0.82 0.57 0.78 -0.60 0.00 0.00 178.31 179.89 1dvb h GLY 31 N 1.03 1.44 1.17 -1.45 0.00 0.38 0.26 103.07 105.90 1dvb h GLY 31 Ca 0.06 -0.39 -0.15 0.00 0.00 0.00 0.00 47.33 46.84 1dvb h GLY 31 CO 0.06 0.20 -0.34 -1.33 0.00 0.00 0.00 176.54 175.14 1dvb h GLY 32 N 0.96 1.00 1.54 4.60 0.00 -1.19 -1.48 103.07 108.50 1dvb h GLY 32 Ca 0.43 -0.98 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1dvb h GLY 32 CO -0.23 0.89 -0.12 -1.61 0.00 0.00 0.00 176.54 175.47 1dvb h GLN 33 N 0.76 0.55 -0.40 4.80 5.75 -1.05 -1.82 115.11 123.71 1dvb h GLN 33 Ca 0.07 -0.16 -0.02 0.00 -0.15 0.00 0.00 58.65 58.39 1dvb h GLN 33 Cb 0.92 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 29.40 1dvb h GLN 33 CO 0.09 0.67 0.16 0.00 -2.65 0.00 0.00 178.83 177.10 1dvb h ALA 34 N 1.36 0.51 -0.36 3.38 0.00 -0.48 -0.55 119.26 123.13 1dvb h ALA 34 Ca 0.09 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1dvb h ALA 34 Cb 0.52 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1dvb h ALA 34 CO 0.03 0.11 0.25 -0.22 0.00 0.00 0.00 179.25 179.42 1dvb h LYS 35 N 0.50 0.21 -0.00 0.00 1.63 -1.11 -1.11 116.57 116.68 1dvb h LYS 35 Ca 0.13 -0.01 -0.18 0.00 -0.85 0.00 0.00 60.65 59.74 1dvb h LYS 35 Cb 0.18 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.75 1dvb h LYS 35 CO -0.01 0.14 -0.82 0.87 -3.45 0.00 0.00 179.45 176.18 1dvb h LYS 36 N 0.21 0.12 0.00 1.90 1.57 -0.38 -2.99 116.57 117.00 1dvb h LYS 36 Ca 0.16 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1dvb h LYS 36 Cb 0.37 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1dvb h LYS 36 CO -0.03 0.87 0.00 -0.25 -0.57 0.00 0.00 179.45 179.47 1dvb n ASP 37 N -3.65 0.03 -0.18 0.86 8.00 -0.32 -4.92 116.55 116.35 1dvb n ASP 37 Ca -0.02 0.51 0.00 0.00 0.71 0.00 0.00 54.79 55.98 1dvb n ASP 37 Cb 0.77 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1dvb n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dvb n GLY 38 N 0.66 0.88 2.67 0.44 0.00 -0.91 -5.06 105.19 103.88 1dvb n GLY 38 Ca 0.05 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 1dvb n GLY 38 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1dvb n PHE 39 N -2.54 2.17 -0.21 1.61 3.72 -1.09 -4.40 117.46 116.72 1dvb n PHE 39 Ca 0.00 -4.02 -0.06 0.00 -0.05 0.00 0.00 57.45 53.31 1dvb n PHE 39 Cb 0.37 -0.40 0.04 0.00 -0.94 0.00 0.00 39.48 38.54 1dvb n PHE 39 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1dvb h VAL 40 N 4.12 1.18 -0.77 -4.37 2.07 -1.72 0.28 116.25 117.04 1dvb h VAL 40 Ca 0.18 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1dvb h VAL 40 Cb 0.78 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1dvb h VAL 40 CO 0.64 0.18 0.39 -0.61 0.02 0.00 0.00 177.57 178.19 1dvb h GLN 41 N 0.82 1.09 -0.34 1.57 4.15 -1.85 -0.41 115.11 120.13 1dvb h GLN 41 Ca 0.22 -0.14 -0.11 0.00 0.77 0.00 0.00 58.65 59.38 1dvb h GLN 41 Cb -0.02 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 1dvb h GLN 41 CO -0.04 0.83 -0.24 0.82 -1.93 0.00 0.00 178.83 178.26 1dvb h ILE 42 N 1.09 1.27 0.06 2.39 2.04 -1.91 -2.00 117.51 120.45 1dvb h ILE 42 Ca 0.27 -1.33 0.02 0.00 1.00 0.00 0.00 64.86 64.82 1dvb h ILE 42 Cb 0.08 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 1dvb h ILE 42 CO -0.04 0.44 -0.19 -1.28 0.00 0.00 0.00 178.15 177.08 1dvb h SER 43 N 0.59 -0.53 0.15 1.72 0.87 -0.39 -2.17 113.55 113.79 1dvb h SER 43 Ca 0.08 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.69 1dvb h SER 43 Cb 0.72 0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1dvb h SER 43 CO 0.06 -0.26 -0.07 0.44 -0.53 0.00 0.00 176.83 176.47 1dvb h ASP 44 N -0.33 0.00 0.39 6.23 3.32 -0.93 -1.20 116.42 123.89 1dvb h ASP 44 Ca 0.04 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.82 1dvb h ASP 44 Cb 0.38 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.94 1dvb h ASP 44 CO -0.13 0.07 -1.13 0.40 -1.72 0.00 0.00 179.24 176.73 1dvb h ILE 45 N 0.00 1.40 -0.03 0.35 5.03 -0.85 0.13 117.51 123.54 1dvb h ILE 45 Ca -0.00 -2.67 0.04 0.00 -0.12 0.00 0.00 64.86 62.10 1dvb h ILE 45 Cb 0.17 2.68 -0.06 0.00 -3.03 0.00 0.00 36.82 36.58 1dvb h ILE 45 CO 0.01 0.79 -0.38 -0.26 -0.68 0.00 0.00 178.15 177.64 1dvb h PHE 46 N 0.18 -1.06 -0.78 1.37 0.04 -1.18 0.36 116.94 115.88 1dvb h PHE 46 Ca -0.13 0.04 0.05 0.00 2.80 0.00 0.00 57.97 60.73 1dvb h PHE 46 Cb 1.81 0.47 -0.05 0.00 2.20 0.00 0.00 35.95 40.38 1dvb h PHE 46 CO 0.08 -0.46 0.51 0.00 -0.60 0.00 0.00 178.31 177.84 1dvb h ALA 47 N 0.13 1.60 -0.45 2.45 0.00 -1.15 0.28 119.26 122.12 1dvb h ALA 47 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1dvb h ALA 47 Cb 0.61 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1dvb h ALA 47 CO -0.32 0.30 0.03 1.49 0.00 0.00 0.00 179.25 180.75 1dvb h GLU 48 N 0.89 0.78 -0.55 0.00 4.81 0.06 -2.28 114.58 118.28 1dvb h GLU 48 Ca 0.33 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1dvb h GLU 48 Cb 0.16 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1dvb h GLU 48 CO -0.11 0.82 0.36 1.15 -0.73 0.00 0.00 179.01 180.50 1dvb h THR 49 N 0.63 1.12 -0.75 0.32 2.02 0.78 0.11 112.91 117.15 1dvb h THR 49 Ca 0.13 -0.25 0.15 0.00 0.77 0.00 0.00 66.41 67.22 1dvb h THR 49 Cb 0.45 0.34 -0.14 0.00 -1.74 0.00 0.00 68.15 67.05 1dvb h THR 49 CO 0.02 0.13 -0.19 0.00 0.37 0.00 0.00 175.52 175.84 1dvb h ALA 50 N 1.21 0.48 -0.25 6.16 0.00 -0.36 0.20 119.26 126.70 1dvb h ALA 50 Ca 0.21 0.29 -0.12 0.00 0.00 0.00 0.00 54.91 55.29 1dvb h ALA 50 Cb -0.06 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1dvb h ALA 50 CO -0.06 -0.42 -0.34 -0.44 0.00 0.00 0.00 179.25 177.99 1dvb h ASP 51 N -0.00 0.56 0.21 0.00 3.32 -0.73 -1.64 116.42 118.12 1dvb h ASP 51 Ca 0.36 -0.22 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1dvb h ASP 51 Cb 0.55 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1dvb h ASP 51 CO -0.78 0.86 -0.41 1.56 -1.72 0.00 0.00 179.24 178.75 1dvb h GLN 52 N 0.45 0.27 -0.51 3.56 4.20 0.14 -2.65 115.11 120.57 1dvb h GLN 52 Ca 0.05 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1dvb h GLN 52 Cb 0.81 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.57 1dvb h GLN 52 CO 0.07 0.64 0.24 0.93 -0.67 0.00 0.00 178.83 180.03 1dvb h GLU 53 N 0.22 0.72 -0.13 1.46 4.39 0.07 -1.20 114.58 120.11 1dvb h GLU 53 Ca 0.02 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 1dvb h GLU 53 Cb 0.82 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 1dvb h GLU 53 CO 0.06 0.57 -0.02 -0.09 -1.16 0.00 0.00 179.01 178.37 1dvb h ARG 54 N 0.72 0.19 0.00 2.33 2.43 -0.99 0.17 114.38 119.23 1dvb h ARG 54 Ca 0.18 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 1dvb h ARG 54 Cb 0.09 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1dvb h ARG 54 CO -0.02 0.23 -1.16 0.93 -1.51 0.00 0.00 179.97 178.44 1dvb h GLU 55 N 0.18 0.00 -0.31 0.20 4.39 -0.97 -0.83 114.58 117.25 1dvb h GLU 55 Ca 0.04 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 1dvb h GLU 55 Cb 0.17 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 1dvb h GLU 55 CO 0.01 0.34 0.01 0.45 -1.16 0.00 0.00 179.01 178.66 1dvb h HIS 56 N 0.00 0.58 -0.80 4.33 3.86 -0.99 -2.77 115.15 119.35 1dvb h HIS 56 Ca -0.11 -0.10 0.04 0.00 -1.16 0.00 0.00 60.37 59.04 1dvb h HIS 56 Cb 1.51 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 29.78 1dvb h HIS 56 CO 0.00 0.66 0.50 0.00 0.86 0.00 0.00 177.93 179.95 1dvb h ALA 57 N 0.85 1.07 -0.49 2.45 0.00 -0.93 -2.37 119.26 119.85 1dvb h ALA 57 Ca 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1dvb h ALA 57 Cb 0.42 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1dvb h ALA 57 CO 0.01 0.29 0.08 -0.22 0.00 0.00 0.00 179.25 179.41 1dvb h LYS 58 N 0.96 0.82 -0.83 0.00 3.64 -1.08 0.17 116.57 120.25 1dvb h LYS 58 Ca 0.33 -0.22 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1dvb h LYS 58 Cb 0.07 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1dvb h LYS 58 CO -0.14 0.82 0.54 -0.09 -2.27 0.00 0.00 179.45 178.31 1dvb h ARG 59 N 0.70 1.04 0.84 1.90 9.65 -1.23 -1.54 114.38 125.74 1dvb h ARG 59 Ca 0.15 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1dvb h ARG 59 Cb 0.40 -0.23 0.01 0.00 -1.39 0.00 0.00 29.97 28.75 1dvb h ARG 59 CO 0.01 0.69 -0.40 -0.07 2.80 0.00 0.00 179.97 183.00 1dvb h LEU 60 N 1.07 -0.96 -1.07 3.80 3.38 -1.07 -3.07 115.31 117.40 1dvb h LEU 60 Ca 0.32 0.02 0.25 0.00 0.09 0.00 0.00 57.88 58.57 1dvb h LEU 60 Cb -0.05 0.25 -0.12 0.00 0.09 0.00 0.00 40.66 40.82 1dvb h LEU 60 CO -0.09 -0.64 0.61 0.15 0.09 0.00 0.00 178.44 178.56 1dvb h PHE 61 N -1.22 0.95 0.00 1.13 3.57 -0.59 1.48 116.94 122.26 1dvb h PHE 61 Ca -0.12 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.42 1dvb h PHE 61 Cb 0.87 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1dvb h PHE 61 CO -0.00 0.05 0.00 1.63 -2.23 0.00 0.00 178.31 177.76 1dvb n LYS 62 N -4.85 0.05 0.19 1.11 5.02 -0.59 -1.78 118.16 117.31 1dvb n LYS 62 Ca 0.27 0.46 0.10 0.00 -2.02 0.00 0.00 58.31 57.12 1dvb n LYS 62 Cb 0.79 -1.64 0.12 0.00 -0.02 0.00 0.00 35.03 34.27 1dvb n LYS 62 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1dvb h PHE 63 N 0.00 0.00 -3.90 2.13 0.04 0.21 -3.46 116.94 111.95 1dvb h PHE 63 Ca 0.00 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.25 1dvb h PHE 63 Cb 0.11 0.00 0.07 0.00 2.20 0.00 0.00 35.95 38.32 1dvb h PHE 63 CO 0.00 0.07 0.60 -0.51 -0.60 0.00 0.00 178.31 177.88 1dvb s LEU 64 N -6.08 4.34 0.00 1.54 1.43 -0.74 -4.92 118.68 114.25 1dvb s LEU 64 Ca 0.05 2.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1dvb s LEU 64 Cb 0.06 -3.77 0.00 0.00 0.03 0.00 0.00 46.19 42.51 1dvb s LEU 64 CO 0.70 -0.62 0.91 -1.84 0.23 0.00 0.00 176.35 175.73 1dvb n GLU 65 N 0.53 2.41 -0.67 1.70 0.28 -1.26 -5.09 120.64 118.55 1dvb n GLU 65 Ca 0.02 -1.32 0.00 0.00 -0.16 0.00 0.00 57.16 55.69 1dvb n GLU 65 Cb 0.43 -0.95 0.00 0.00 1.43 0.00 0.00 31.44 32.35 1dvb n GLU 65 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1dvb n GLY 66 N -0.41 1.24 0.00 -1.84 0.00 -1.26 -5.09 105.19 97.83 1dvb n GLY 66 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1dvb n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dvb n GLY 67 N 5.00 2.95 3.75 -0.02 0.00 -1.26 -5.10 105.19 110.52 1dvb n GLY 67 Ca 0.00 -1.73 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1dvb n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dvb s ASP 68 N -0.36 7.59 -0.08 1.61 1.01 -1.26 -5.07 116.67 120.10 1dvb s ASP 68 Ca 0.00 1.88 -0.04 0.00 0.71 0.00 0.00 52.55 55.10 1dvb s ASP 68 Cb 0.00 -2.59 0.04 0.00 1.01 0.00 0.00 42.92 41.39 1dvb s ASP 68 CO 0.00 0.15 0.18 -0.22 0.21 0.00 0.00 175.17 175.49 1dvb s LEU 69 N -1.07 0.54 0.10 1.23 2.96 -1.26 -5.16 118.68 116.03 1dvb s LEU 69 Ca 0.40 0.37 -0.29 0.00 -0.22 0.00 0.00 54.13 54.40 1dvb s LEU 69 Cb -0.25 0.47 -0.06 0.00 0.50 0.00 0.00 46.19 46.85 1dvb s LEU 69 CO 0.31 -0.16 0.91 -0.70 -1.32 0.00 0.00 176.35 175.38 1dvb s GLU 70 N 1.32 4.65 0.09 1.98 2.12 -1.26 -5.09 118.70 122.51 1dvb s GLU 70 Ca -0.08 1.35 0.03 0.00 0.36 0.00 0.00 54.97 56.63 1dvb s GLU 70 Cb -0.11 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 1dvb s GLU 70 CO -0.07 0.25 -0.08 0.96 -0.54 0.00 0.00 175.26 175.78 1dvb s ILE 71 N -0.08 0.76 -0.12 -3.70 -4.36 -1.26 -5.03 121.20 107.41 1dvb s ILE 71 Ca 0.44 -1.65 0.03 0.00 -0.26 0.00 0.00 60.65 59.21 1dvb s ILE 71 Cb -0.23 -1.34 0.00 0.00 1.25 0.00 0.00 42.46 42.14 1dvb s ILE 71 CO 0.28 -0.66 -0.22 -0.69 0.24 0.00 0.00 174.94 173.89 1dvb s VAL 72 N -2.73 2.18 -0.16 8.37 1.01 -1.26 -5.11 120.40 122.70 1dvb s VAL 72 Ca 0.05 -0.96 -0.34 0.00 0.00 0.00 0.00 61.98 60.72 1dvb s VAL 72 Cb -0.01 -1.85 0.13 0.00 0.00 0.00 0.00 36.38 34.65 1dvb s VAL 72 CO -0.02 0.55 1.18 0.00 0.00 0.00 0.00 175.10 176.81 1dvb s ALA 73 N 0.49 -2.05 0.05 5.51 0.00 -1.26 -5.11 121.76 119.40 1dvb s ALA 73 Ca -0.14 1.50 0.04 0.00 0.00 0.00 0.00 51.96 53.36 1dvb s ALA 73 Cb -0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1dvb s ALA 73 CO 0.05 -0.63 -0.05 0.00 0.00 0.00 0.00 175.76 175.14 1dvb s ALA 74 N -2.49 3.11 0.04 0.00 0.00 -1.26 -5.12 121.76 116.05 1dvb s ALA 74 Ca 0.09 -1.09 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 1dvb s ALA 74 Cb -0.01 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 21.99 1dvb s ALA 74 CO -0.05 0.65 0.19 -0.06 0.00 0.00 0.00 175.76 176.49 1dvb s PHE 75 N -1.14 0.06 0.26 0.00 0.08 -1.26 -5.08 117.98 110.91 1dvb s PHE 75 Ca 0.21 -0.30 -0.30 0.00 0.12 0.00 0.00 56.93 56.66 1dvb s PHE 75 Cb -0.11 -0.04 -0.10 0.00 -0.57 0.00 0.00 43.02 42.20 1dvb s PHE 75 CO 0.12 -0.43 1.46 -2.14 -0.10 0.00 0.00 175.22 174.13 1dvb s PRO 76 N -2.62 4.25 -1.08 0.24 0.02 -1.26 -4.91 135.00 129.64 1dvb s PRO 76 Ca -0.05 2.35 -0.07 0.00 0.02 0.00 0.00 61.00 63.25 1dvb s PRO 76 Cb -0.01 -3.09 0.27 0.00 0.02 0.00 0.00 34.50 31.69 1dvb s PRO 76 CO -0.04 -0.45 1.11 0.00 -0.33 0.00 0.00 177.00 177.29 1dvb n ALA 77 N 2.21 4.27 0.00 -1.55 0.00 -1.26 -4.91 120.51 119.27 1dvb n ALA 77 Ca 0.07 -4.68 0.00 0.00 0.00 0.00 0.00 53.44 48.83 1dvb n ALA 77 Cb 0.40 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1dvb n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dvb n GLY 78 N 2.45 -2.24 3.13 0.00 0.00 -1.26 -5.06 105.19 102.22 1dvb n GLY 78 Ca 0.24 -2.17 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 1dvb n GLY 78 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1dvb s ILE 79 N -0.67 0.15 -0.26 -0.61 -1.16 -1.26 -5.15 121.20 112.23 1dvb s ILE 79 Ca 0.00 -1.88 -0.07 0.00 -0.51 0.00 0.00 60.65 58.18 1dvb s ILE 79 Cb 0.00 -1.90 -0.02 0.00 0.61 0.00 0.00 42.46 41.15 1dvb s ILE 79 CO 0.00 -0.61 0.07 -0.63 -2.81 0.00 0.00 174.94 170.96 1dvb s ILE 80 N -4.00 4.18 0.00 2.00 1.01 -1.26 -5.02 121.20 118.11 1dvb s ILE 80 Ca 0.19 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1dvb s ILE 80 Cb 0.08 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.53 1dvb s ILE 80 CO -0.01 0.26 0.00 0.00 0.00 0.00 0.00 174.94 175.18 1dvb n ALA 81 N 4.91 0.00 -0.61 9.38 0.00 -1.26 -5.11 120.51 127.82 1dvb n ALA 81 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.98 1dvb n ALA 81 Cb 0.50 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.15 1dvb n ALA 81 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1dvb s ASP 82 N 0.11 2.14 0.13 0.00 2.15 -1.26 -4.67 116.67 115.28 1dvb s ASP 82 Ca 0.00 1.99 -0.18 0.00 0.43 0.00 0.00 52.55 54.79 1dvb s ASP 82 Cb 0.00 -2.50 -0.03 0.00 -0.30 0.00 0.00 42.92 40.09 1dvb s ASP 82 CO 0.00 -3.56 1.77 0.74 -0.17 0.00 0.00 175.17 173.96 1dvb h THR 83 N -2.18 1.10 -0.34 1.71 2.02 -1.96 0.15 112.91 113.41 1dvb h THR 83 Ca -0.50 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 66.53 1dvb h THR 83 Cb 1.29 0.70 -0.08 0.00 -1.74 0.00 0.00 68.15 68.31 1dvb h THR 83 CO 0.44 0.10 -0.42 -0.74 0.37 0.00 0.00 175.52 175.27 1dvb h HIS 84 N 0.40 -1.20 -0.92 3.16 6.17 -1.96 0.44 115.15 121.23 1dvb h HIS 84 Ca 0.11 0.06 0.05 0.00 0.71 0.00 0.00 60.37 61.30 1dvb h HIS 84 Cb -0.01 0.57 -0.06 0.00 2.52 0.00 0.00 27.41 30.44 1dvb h HIS 84 CO -0.05 -0.44 0.59 0.00 0.71 0.00 0.00 177.93 178.74 1dvb h ALA 85 N 0.39 1.25 -0.98 5.26 0.00 -1.85 -0.77 119.26 122.56 1dvb h ALA 85 Ca 0.13 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1dvb h ALA 85 Cb 0.59 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1dvb h ALA 85 CO -0.53 0.41 0.65 -0.91 0.00 0.00 0.00 179.25 178.87 1dvb h ASN 86 N 1.11 1.11 0.54 0.00 2.35 0.12 -0.22 115.58 120.59 1dvb h ASN 86 Ca 0.38 -0.02 -0.11 0.00 -0.55 0.00 0.00 56.30 55.99 1dvb h ASN 86 Cb 0.08 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1dvb h ASN 86 CO -0.15 0.79 -0.54 -0.07 -1.65 0.00 0.00 177.43 175.81 1dvb h LEU 87 N 1.30 0.00 -0.03 1.61 3.38 0.10 -1.78 115.31 119.90 1dvb h LEU 87 Ca 0.37 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.18 1dvb h LEU 87 Cb -0.11 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.65 1dvb h LEU 87 CO -0.09 0.55 -0.58 0.40 0.09 0.00 0.00 178.44 178.81 1dvb h ILE 88 N 0.00 1.41 -0.99 1.22 1.08 -0.27 -2.58 117.51 117.38 1dvb h ILE 88 Ca -0.01 -2.01 0.04 0.00 -0.39 0.00 0.00 64.86 62.49 1dvb h ILE 88 Cb 0.96 2.48 -0.06 0.00 -3.07 0.00 0.00 36.82 37.14 1dvb h ILE 88 CO 0.07 0.59 0.65 0.00 -0.69 0.00 0.00 178.15 178.77 1dvb h ALA 89 N 0.36 1.31 -0.75 1.87 0.00 -1.00 -1.08 119.26 119.97 1dvb h ALA 89 Ca -0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1dvb h ALA 89 Cb 1.27 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1dvb h ALA 89 CO 0.12 0.54 0.37 0.77 0.00 0.00 0.00 179.25 181.05 1dvb h SER 90 N 1.26 0.98 -0.54 0.00 0.02 -1.33 -2.20 113.55 111.73 1dvb h SER 90 Ca 0.39 -0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 61.11 1dvb h SER 90 Cb -0.00 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 1dvb h SER 90 CO -0.12 0.83 -0.07 0.00 -1.14 0.00 0.00 176.83 176.32 1dvb h ALA 91 N 1.19 0.74 -0.43 3.77 0.00 -1.05 -0.37 119.26 123.11 1dvb h ALA 91 Ca 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1dvb h ALA 91 Cb 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1dvb h ALA 91 CO -0.03 0.62 0.23 0.00 0.00 0.00 0.00 179.25 180.07 1dvb h ALA 92 N 0.93 1.60 0.00 0.00 0.00 -0.86 0.30 119.26 121.24 1dvb h ALA 92 Ca 0.14 -0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.74 1dvb h ALA 92 Cb 0.63 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1dvb h ALA 92 CO 0.04 0.33 -1.28 0.78 0.00 0.00 0.00 179.25 179.12 1dvb h GLY 93 N 0.67 0.01 1.03 0.00 0.00 -0.84 -1.99 103.07 101.94 1dvb h GLY 93 Ca 0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 1dvb h GLY 93 CO -0.03 0.01 0.34 0.83 0.00 0.00 0.00 176.54 177.69 1dvb h GLU 94 N 0.00 1.14 0.28 4.80 4.39 -0.86 -1.84 114.58 122.48 1dvb h GLU 94 Ca -0.12 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1dvb h GLU 94 Cb 1.87 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 30.31 1dvb h GLU 94 CO 0.11 0.91 -0.28 1.25 -1.16 0.00 0.00 179.01 179.84 1dvb h HIS 95 N 1.11 -0.74 -0.86 4.33 2.76 0.00 -2.21 115.15 119.54 1dvb h HIS 95 Ca 0.26 0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.53 1dvb h HIS 95 Cb 0.17 0.29 -0.07 0.00 1.55 0.00 0.00 27.41 29.35 1dvb h HIS 95 CO 0.02 -0.40 0.51 1.25 -1.30 0.00 0.00 177.93 178.00 1dvb h HIS 96 N -0.59 0.93 -0.38 5.26 -0.00 -1.28 -0.25 115.15 118.84 1dvb h HIS 96 Ca -0.01 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.39 1dvb h HIS 96 Cb 0.54 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.64 1dvb h HIS 96 CO -0.17 0.40 0.25 0.93 -0.00 0.00 0.00 177.93 179.34 1dvb h GLU 97 N 0.86 0.50 0.00 5.26 5.08 -0.97 0.46 114.58 125.77 1dvb h GLU 97 Ca 0.41 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.51 1dvb h GLU 97 Cb 0.33 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1dvb h GLU 97 CO -0.23 0.33 -1.38 0.10 -1.00 0.00 0.00 179.01 176.83 1dvb h TYR 98 N 0.51 0.00 0.11 4.33 -0.00 -0.98 -0.23 116.97 120.72 1dvb h TYR 98 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 58.73 58.56 1dvb h TYR 98 Cb -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.67 1dvb h TYR 98 CO -0.05 0.82 -1.62 1.79 -0.00 0.00 0.00 178.16 179.10 1dvb h THR 99 N 0.00 1.05 0.00 -0.90 1.35 -1.08 -3.40 112.91 109.94 1dvb h THR 99 Ca -0.17 -2.71 -0.12 0.00 -0.55 0.00 0.00 66.41 62.85 1dvb h THR 99 Cb 1.78 2.70 -0.02 0.00 -1.73 0.00 0.00 68.15 70.88 1dvb h THR 99 CO 0.08 0.80 -1.17 -0.62 -0.25 0.00 0.00 175.52 174.36 1dvb n GLU 100 N -3.43 0.33 -0.01 4.72 -0.58 0.15 -4.66 120.64 117.16 1dvb n GLU 100 Ca -0.19 0.14 -0.17 0.00 -0.42 0.00 0.00 57.16 56.52 1dvb n GLU 100 Cb 1.05 -1.07 -0.10 0.00 -0.57 0.00 0.00 31.44 30.75 1dvb n GLU 100 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1dvb h MET 101 N -0.60 0.47 0.01 3.49 4.05 -1.17 -2.97 114.93 118.22 1dvb h MET 101 Ca -0.18 -0.44 -0.21 0.00 -0.28 0.00 0.00 59.70 58.59 1dvb h MET 101 Cb 0.93 0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 1dvb h MET 101 CO -0.11 1.08 -0.93 1.88 0.23 0.00 0.00 176.91 179.06 1dvb h TYR 102 N 0.02 0.39 -0.33 1.39 0.05 -1.31 -2.07 116.97 115.10 1dvb h TYR 102 Ca -0.06 -0.22 0.07 0.00 0.05 0.00 0.00 58.73 58.57 1dvb h TYR 102 Cb 1.23 -0.04 -0.07 0.00 1.01 0.00 0.00 36.73 38.86 1dvb h TYR 102 CO 0.13 1.05 -0.15 -1.35 -1.05 0.00 0.00 178.16 176.79 1dvb h PRO 103 N 0.13 -0.09 0.12 4.88 0.11 -1.77 0.57 132.00 135.96 1dvb h PRO 103 Ca -0.06 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.07 1dvb h PRO 103 Cb 1.58 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.66 1dvb h PRO 103 CO 0.15 -0.06 -0.40 0.77 -0.21 0.00 0.00 178.00 178.25 1dvb h SER 104 N -0.09 -1.18 -0.75 -2.05 0.02 -1.53 -1.52 113.55 106.45 1dvb h SER 104 Ca 0.17 0.13 0.16 0.00 -0.84 0.00 0.00 61.79 61.41 1dvb h SER 104 Cb 0.35 0.44 -0.05 0.00 0.14 0.00 0.00 62.40 63.29 1dvb h SER 104 CO -0.40 -0.48 0.51 -0.26 -1.14 0.00 0.00 176.83 175.06 1dvb h PHE 105 N -0.64 0.41 -0.28 3.45 0.04 -1.18 -0.58 116.94 118.16 1dvb h PHE 105 Ca 0.02 0.01 -0.19 0.00 2.80 0.00 0.00 57.97 60.62 1dvb h PHE 105 Cb 0.67 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.69 1dvb h PHE 105 CO -0.35 0.15 -0.55 0.00 -0.60 0.00 0.00 178.31 176.95 1dvb h ALA 106 N 1.65 0.45 0.02 2.45 0.00 -0.33 -2.41 119.26 121.09 1dvb h ALA 106 Ca 0.37 -0.52 0.02 0.00 0.00 0.00 0.00 54.91 54.78 1dvb h ALA 106 Cb 0.95 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 1dvb h ALA 106 CO -0.11 0.67 -0.50 -0.09 0.00 0.00 0.00 179.25 179.23 1dvb h ARG 107 N 0.66 -0.64 -0.79 0.00 9.65 -0.13 -1.83 114.38 121.30 1dvb h ARG 107 Ca 0.01 0.04 -0.04 0.00 -1.10 0.00 0.00 59.98 58.89 1dvb h ARG 107 Cb 1.17 0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 29.86 1dvb h ARG 107 CO 0.12 -0.42 0.33 0.82 2.80 0.00 0.00 179.97 183.62 1dvb h ILE 108 N -0.66 1.26 -0.25 1.20 2.04 -1.42 0.71 117.51 120.38 1dvb h ILE 108 Ca 0.02 -0.79 0.05 0.00 1.00 0.00 0.00 64.86 65.14 1dvb h ILE 108 Cb 0.71 0.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 1dvb h ILE 108 CO -0.33 0.33 -0.10 0.00 0.00 0.00 0.00 178.15 178.04 1dvb h ALA 109 N 1.21 0.12 0.11 1.87 0.00 -1.32 1.42 119.26 122.66 1dvb h ALA 109 Ca 0.27 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.29 1dvb h ALA 109 Cb 0.19 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1dvb h ALA 109 CO -0.02 -0.51 -0.46 -0.09 0.00 0.00 0.00 179.25 178.17 1dvb h ARG 110 N -0.06 -0.66 0.00 0.00 2.43 -1.15 0.83 114.38 115.77 1dvb h ARG 110 Ca 0.13 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1dvb h ARG 110 Cb 0.25 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1dvb h ARG 110 CO -0.29 -0.44 -0.04 1.49 -1.51 0.00 0.00 179.97 179.18 1dvb h GLU 111 N -0.68 0.00 -0.53 0.20 4.81 0.94 -0.61 114.58 118.71 1dvb h GLU 111 Ca 0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1dvb h GLU 111 Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 1dvb h GLU 111 CO -0.27 0.04 0.00 0.39 -0.73 0.00 0.00 179.01 178.45 1dvb n GLU 112 N -3.37 2.48 -0.00 1.92 1.02 0.48 -4.91 120.64 118.26 1dvb n GLU 112 Ca -0.02 -2.27 0.00 0.00 -0.02 0.00 0.00 57.16 54.85 1dvb n GLU 112 Cb 0.17 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1dvb n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dvb n GLY 113 N 1.52 1.00 3.04 0.62 0.00 -0.23 -4.98 105.19 106.15 1dvb n GLY 113 Ca 0.21 -0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1dvb n GLY 113 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1dvb s TYR 114 N -2.00 3.63 0.05 1.61 2.02 0.28 -1.92 117.35 121.02 1dvb s TYR 114 Ca 0.00 -3.05 0.03 0.00 -0.37 0.00 0.00 57.07 53.68 1dvb s TYR 114 Cb 0.00 -3.06 -0.24 0.00 -0.40 0.00 0.00 41.96 38.26 1dvb s TYR 114 CO 0.00 -0.71 1.04 0.93 -1.57 0.00 0.00 175.55 175.23 1dvb h GLU 115 N 6.14 0.11 -0.67 -0.62 3.07 -1.86 -2.49 114.58 118.26 1dvb h GLU 115 Ca 0.09 -0.19 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1dvb h GLU 115 Cb 0.84 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.79 1dvb h GLU 115 CO 0.77 0.98 0.42 1.49 -1.40 0.00 0.00 179.01 181.27 1dvb h GLU 116 N 0.03 0.90 -0.64 2.33 4.57 -1.95 0.28 114.58 120.10 1dvb h GLU 116 Ca -0.14 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 57.92 1dvb h GLU 116 Cb 1.91 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 30.28 1dvb h GLU 116 CO 0.14 0.62 0.19 0.82 -1.18 0.00 0.00 179.01 179.61 1dvb h ILE 117 N 0.91 1.24 -0.67 2.32 2.04 -1.97 -0.91 117.51 120.48 1dvb h ILE 117 Ca 0.24 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 1dvb h ILE 117 Cb -0.06 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1dvb h ILE 117 CO -0.05 0.32 0.39 0.00 0.00 0.00 0.00 178.15 178.81 1dvb h ALA 118 N 1.26 0.85 -0.34 1.87 0.00 -0.59 0.97 119.26 123.28 1dvb h ALA 118 Ca 0.21 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1dvb h ALA 118 Cb 0.28 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1dvb h ALA 118 CO -0.01 0.35 0.15 0.00 0.00 0.00 0.00 179.25 179.74 1dvb h ARG 119 N 0.91 0.31 -0.97 0.00 -0.00 0.20 -0.87 114.38 113.95 1dvb h ARG 119 Ca 0.24 -0.02 0.02 0.00 -0.50 0.00 0.00 59.98 59.72 1dvb h ARG 119 Cb 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 29.97 29.85 1dvb h ARG 119 CO -0.04 0.20 0.64 0.28 0.00 0.00 0.00 179.97 181.05 1dvb h VAL 120 N 0.32 1.23 -0.23 2.04 2.07 -0.49 0.82 116.25 122.02 1dvb h VAL 120 Ca 0.15 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 67.09 1dvb h VAL 120 Cb 0.09 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 29.67 1dvb h VAL 120 CO -0.12 0.24 -0.41 -0.26 0.02 0.00 0.00 177.57 177.03 1dvb h PHE 121 N 1.29 0.64 -0.47 1.57 0.04 -0.32 -0.73 116.94 118.96 1dvb h PHE 121 Ca 0.36 -0.19 -0.11 0.00 2.80 0.00 0.00 57.97 60.84 1dvb h PHE 121 Cb -0.11 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 37.89 1dvb h PHE 121 CO -0.00 0.86 -0.12 0.00 -0.60 0.00 0.00 178.31 178.45 1dvb h ALA 122 N 1.11 0.65 -0.28 2.45 0.00 0.06 -2.82 119.26 120.43 1dvb h ALA 122 Ca 0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1dvb h ALA 122 Cb 0.91 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1dvb h ALA 122 CO 0.08 0.56 0.02 0.77 0.00 0.00 0.00 179.25 180.68 1dvb h SER 123 N 0.76 0.48 -0.94 0.00 0.02 0.90 -2.43 113.55 112.34 1dvb h SER 123 Ca 0.12 -0.29 0.14 0.00 -0.84 0.00 0.00 61.79 60.91 1dvb h SER 123 Cb 0.67 -0.13 -0.08 0.00 0.14 0.00 0.00 62.40 63.01 1dvb h SER 123 CO 0.05 0.65 0.60 0.40 -1.14 0.00 0.00 176.83 177.39 1dvb h ILE 124 N 0.29 0.86 -0.93 3.27 2.04 -1.18 -0.83 117.51 121.03 1dvb h ILE 124 Ca 0.08 -0.28 0.14 0.00 1.00 0.00 0.00 64.86 65.80 1dvb h ILE 124 Cb 0.40 -0.02 -0.09 0.00 -0.74 0.00 0.00 36.82 36.37 1dvb h ILE 124 CO 0.01 0.15 0.55 0.00 0.00 0.00 0.00 178.15 178.86 1dvb h ALA 125 N 1.58 1.43 -0.42 1.87 0.00 -1.18 0.11 119.26 122.65 1dvb h ALA 125 Ca 0.47 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.47 1dvb h ALA 125 Cb 0.64 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1dvb h ALA 125 CO -0.24 0.07 0.19 0.28 0.00 0.00 0.00 179.25 179.55 1dvb h VAL 126 N 0.82 0.94 -0.80 0.00 2.07 -0.84 0.13 116.25 118.57 1dvb h VAL 126 Ca 0.49 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.87 1dvb h VAL 126 Cb 0.59 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1dvb h VAL 126 CO -0.31 0.07 0.48 0.00 0.02 0.00 0.00 177.57 177.83 1dvb h ALA 127 N 1.24 1.02 0.00 1.67 0.00 -1.10 -0.01 119.26 122.08 1dvb h ALA 127 Ca 0.18 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1dvb h ALA 127 Cb 0.12 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1dvb h ALA 127 CO -0.15 0.50 -0.22 0.93 0.00 0.00 0.00 179.25 180.31 1dvb h GLU 128 N 1.10 0.00 -0.42 0.00 4.39 0.05 -1.20 114.58 118.49 1dvb h GLU 128 Ca 0.29 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.88 1dvb h GLU 128 Cb -0.03 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1dvb h GLU 128 CO -0.05 0.22 -0.17 1.49 -1.16 0.00 0.00 179.01 179.34 1dvb h GLU 129 N 0.00 0.79 -0.26 2.33 4.81 0.12 -2.08 114.58 120.29 1dvb h GLU 129 Ca -0.00 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 58.83 1dvb h GLU 129 Cb 0.69 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1dvb h GLU 129 CO 0.03 0.90 -0.29 0.35 -0.73 0.00 0.00 179.01 179.27 1dvb h PHE 130 N 0.70 0.60 -0.39 0.92 3.57 -1.11 -2.48 116.94 118.76 1dvb h PHE 130 Ca 0.11 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.47 1dvb h PHE 130 Cb 0.67 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1dvb h PHE 130 CO 0.04 0.76 0.25 0.45 -2.23 0.00 0.00 178.31 177.58 1dvb h HIS 131 N 0.46 0.48 -0.67 0.41 3.86 -0.96 -0.13 115.15 118.60 1dvb h HIS 131 Ca 0.06 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1dvb h HIS 131 Cb 0.74 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 29.02 1dvb h HIS 131 CO 0.03 0.29 0.43 1.49 0.86 0.00 0.00 177.93 181.03 1dvb h GLU 132 N 0.51 0.89 -0.26 2.45 4.81 -1.17 -1.45 114.58 120.37 1dvb h GLU 132 Ca 0.15 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1dvb h GLU 132 Cb -0.04 -0.20 -0.06 0.00 0.63 0.00 0.00 28.75 29.09 1dvb h GLU 132 CO -0.04 0.61 -0.11 -0.22 -0.73 0.00 0.00 179.01 178.52 1dvb h LYS 133 N 0.91 -0.07 -0.36 1.92 1.63 -0.97 0.10 116.57 119.73 1dvb h LYS 133 Ca 0.24 0.00 0.06 0.00 -0.85 0.00 0.00 60.65 60.11 1dvb h LYS 133 Cb -0.07 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.52 1dvb h LYS 133 CO -0.05 -0.05 0.00 0.00 -3.45 0.00 0.00 179.45 175.91 1dvb h ARG 134 N -0.07 0.10 -0.80 1.90 3.08 -0.68 -1.19 114.38 116.72 1dvb h ARG 134 Ca 0.13 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.13 1dvb h ARG 134 Cb 0.27 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1dvb h ARG 134 CO -0.30 0.07 0.33 0.74 -1.07 0.00 0.00 179.97 179.73 1dvb h PHE 135 N 0.10 1.21 -0.32 3.04 0.04 -0.34 -1.43 116.94 119.24 1dvb h PHE 135 Ca 0.18 -0.09 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 1dvb h PHE 135 Cb 0.24 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 1dvb h PHE 135 CO -0.25 0.91 0.03 -0.07 -0.60 0.00 0.00 178.31 178.34 1dvb h LEU 136 N 1.16 0.52 -0.77 1.54 3.38 -0.42 -0.40 115.31 120.32 1dvb h LEU 136 Ca 0.27 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1dvb h LEU 136 Cb 0.21 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1dvb h LEU 136 CO -0.02 0.67 0.36 0.44 0.09 0.00 0.00 178.44 179.98 1dvb h ASP 137 N 0.36 1.01 -0.78 -0.43 3.32 -0.93 0.97 116.42 119.95 1dvb h ASP 137 Ca 0.10 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 1dvb h ASP 137 Cb 0.38 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 1dvb h ASP 137 CO 0.01 0.87 0.29 -0.26 -1.72 0.00 0.00 179.24 178.42 1dvb h PHE 138 N 1.09 1.21 -0.36 4.55 0.04 -1.16 -0.85 116.94 121.45 1dvb h PHE 138 Ca 0.26 -0.10 -0.06 0.00 2.80 0.00 0.00 57.97 60.88 1dvb h PHE 138 Cb 0.13 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 37.90 1dvb h PHE 138 CO 0.01 0.93 -0.01 0.00 -0.60 0.00 0.00 178.31 178.63 1dvb h ALA 139 N 1.16 1.30 -0.12 2.45 0.00 -0.47 -1.77 119.26 121.81 1dvb h ALA 139 Ca 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1dvb h ALA 139 Cb 0.25 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1dvb h ALA 139 CO -0.02 0.47 0.01 -0.09 0.00 0.00 0.00 179.25 179.62 1dvb h ARG 140 N 0.54 0.21 -0.73 0.00 2.43 -0.05 0.68 114.38 117.46 1dvb h ARG 140 Ca 0.11 -0.06 0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1dvb h ARG 140 Cb 0.37 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.85 1dvb h ARG 140 CO 0.01 0.44 0.48 -0.91 -1.51 0.00 0.00 179.97 178.49 1dvb h ASN 141 N -0.04 0.56 0.22 -3.80 -0.26 -1.07 0.50 115.58 111.68 1dvb h ASN 141 Ca 0.04 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 1dvb h ASN 141 Cb 0.34 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.50 1dvb h ASN 141 CO 0.01 0.33 -0.10 0.40 -1.06 0.00 0.00 177.43 177.00 1dvb h ILE 142 N 0.62 0.86 -0.65 2.81 2.04 -0.89 -0.88 117.51 121.42 1dvb h ILE 142 Ca 0.34 -0.58 0.08 0.00 1.00 0.00 0.00 64.86 65.70 1dvb h ILE 142 Cb 0.50 1.19 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 1dvb h ILE 142 CO -0.12 0.13 0.31 0.50 0.00 0.00 0.00 178.15 178.97 1dvb h LYS 143 N -0.59 0.53 -0.66 2.37 3.64 -0.12 -2.66 116.57 119.08 1dvb h LYS 143 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1dvb h LYS 143 Cb 0.43 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1dvb h LYS 143 CO 0.05 0.35 0.00 0.39 -2.27 0.00 0.00 179.45 177.97 1dvb n GLU 144 N -4.89 2.34 -2.86 1.90 1.02 0.17 -4.91 120.64 113.41 1dvb n GLU 144 Ca 0.09 -1.25 -0.22 0.00 -0.02 0.00 0.00 57.16 55.76 1dvb n GLU 144 Cb 0.24 -1.64 0.02 0.00 -0.02 0.00 0.00 31.44 30.05 1dvb n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dvb n GLY 145 N 0.49 -0.52 0.28 0.62 0.00 -0.80 -4.92 105.19 100.35 1dvb n GLY 145 Ca 0.11 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.31 1dvb n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dvb n ARG 146 N -3.76 1.42 -0.03 1.61 1.74 -0.40 -4.52 116.66 112.73 1dvb n ARG 146 Ca -0.15 -2.84 -0.12 0.00 -0.77 0.00 0.00 57.85 53.97 1dvb n ARG 146 Cb 0.64 -1.55 -0.08 0.00 -1.02 0.00 0.00 32.46 30.45 1dvb n ARG 146 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1dvb h VAL 147 N 0.38 1.27 0.00 1.55 2.07 -1.91 -3.36 116.25 116.25 1dvb h VAL 147 Ca 0.00 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.66 1dvb h VAL 147 Cb 1.01 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 1dvb h VAL 147 CO 0.01 0.24 -0.14 0.49 0.02 0.00 0.00 177.57 178.19 1dvb n PHE 148 N -4.82 0.00 -3.65 1.57 3.72 -1.26 -4.87 117.46 108.15 1dvb n PHE 148 Ca -0.07 -1.02 -0.03 0.00 -0.05 0.00 0.00 57.45 56.28 1dvb n PHE 148 Cb 0.21 -0.16 -0.05 0.00 -0.94 0.00 0.00 39.48 38.54 1dvb n PHE 148 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1dvb s LEU 149 N -2.73 -1.03 0.43 4.37 2.96 -1.26 -1.93 118.68 119.49 1dvb s LEU 149 Ca 0.31 1.45 0.06 0.00 -0.22 0.00 0.00 54.13 55.73 1dvb s LEU 149 Cb 0.28 2.11 -0.06 0.00 0.50 0.00 0.00 46.19 49.02 1dvb s LEU 149 CO 0.01 -0.22 0.03 -0.13 -1.32 0.00 0.00 176.35 174.71 1dvb s ARG 150 N 2.79 2.03 -0.10 1.98 1.81 0.50 -4.32 118.95 123.63 1dvb s ARG 150 Ca -0.05 -2.15 0.14 0.00 -1.72 0.00 0.00 55.73 51.94 1dvb s ARG 150 Cb -0.12 -1.65 -0.24 0.00 -0.45 0.00 0.00 34.95 32.50 1dvb s ARG 150 CO -0.18 -0.13 0.43 0.39 -0.68 0.00 0.00 175.30 175.13 1dvb n GLU 151 N -1.06 0.66 -4.29 3.54 4.71 -1.26 -4.63 120.64 118.30 1dvb n GLU 151 Ca -0.08 0.19 -0.24 0.00 -0.01 0.00 0.00 57.16 57.02 1dvb n GLU 151 Cb 0.67 -1.69 -0.08 0.00 -1.01 0.00 0.00 31.44 29.33 1dvb n GLU 151 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 1dvb s GLN 152 N -2.56 2.20 0.03 3.49 0.00 -1.26 -5.01 119.66 116.55 1dvb s GLN 152 Ca -0.08 -1.36 -0.38 0.00 -0.00 0.00 0.00 55.36 53.54 1dvb s GLN 152 Cb 0.07 -2.16 -0.17 0.00 0.00 0.00 0.00 33.01 30.75 1dvb s GLN 152 CO 0.82 0.39 1.34 0.00 0.00 0.00 0.00 175.29 177.84 1dvb n ALA 153 N -0.53 -1.32 -2.67 2.60 0.00 -1.26 -4.60 120.51 112.73 1dvb n ALA 153 Ca -0.08 0.52 -0.17 0.00 0.00 0.00 0.00 53.44 53.71 1dvb n ALA 153 Cb 0.58 -2.04 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 1dvb n ALA 153 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1dvb s THR 154 N 0.71 0.00 -0.09 0.00 -1.32 0.47 -4.84 115.64 110.56 1dvb s THR 154 Ca 0.87 -1.75 -0.00 0.00 -1.21 0.00 0.00 61.69 59.60 1dvb s THR 154 Cb -1.02 -2.60 -0.03 0.00 -1.51 0.00 0.00 72.50 67.34 1dvb s THR 154 CO 0.50 0.00 -0.07 -1.59 -2.21 0.00 0.00 174.62 171.25 1dvb s LYS 155 N -3.15 2.98 -0.17 7.08 0.00 -1.26 -1.08 119.74 124.14 1dvb s LYS 155 Ca 0.34 -0.56 -0.07 0.00 0.00 0.00 0.00 55.97 55.68 1dvb s LYS 155 Cb 0.01 -2.65 -0.04 0.00 0.00 0.00 0.00 37.83 35.14 1dvb s LYS 155 CO 0.23 0.54 0.08 -1.58 0.00 0.00 0.00 175.35 174.62 1dvb s TRP 156 N -0.46 3.31 -0.07 1.78 0.52 -0.67 0.54 118.94 123.90 1dvb s TRP 156 Ca 0.07 0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.40 1dvb s TRP 156 Cb -0.12 -2.05 -0.02 0.00 -1.15 0.00 0.00 33.47 30.13 1dvb s TRP 156 CO 0.02 0.28 -0.14 0.50 0.02 0.00 0.00 176.95 177.63 1dvb s ARG 157 N 0.07 2.68 -0.17 4.98 3.52 0.92 -1.47 118.95 129.48 1dvb s ARG 157 Ca 0.06 -0.70 -0.29 0.00 -0.13 0.00 0.00 55.73 54.67 1dvb s ARG 157 Cb -0.12 -2.42 -0.02 0.00 -1.56 0.00 0.00 34.95 30.83 1dvb s ARG 157 CO 0.00 0.53 1.41 0.00 -0.81 0.00 0.00 175.30 176.44 1dvb h ARG 159 N 9.08 0.00 -0.11 0.00 3.08 -1.26 0.21 114.38 125.38 1dvb h ARG 159 Ca -0.30 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.54 1dvb h ARG 159 Cb 1.13 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.19 1dvb h ARG 159 CO 0.98 0.51 -0.75 -0.97 -1.07 0.00 0.00 179.97 178.67 1dvb h ASN 160 N 0.00 0.84 0.00 7.04 -1.24 -1.91 -3.40 115.58 116.92 1dvb h ASN 160 Ca -0.01 -0.66 0.00 0.00 0.71 0.00 0.00 56.30 56.35 1dvb h ASN 160 Cb 1.01 -0.25 0.00 0.00 0.73 0.00 0.00 38.32 39.81 1dvb h ASN 160 CO 0.07 1.37 0.00 0.00 -1.29 0.00 0.00 177.43 177.58 1dvb n GLY 162 N 0.03 0.78 3.75 0.00 0.00 0.74 -5.01 105.19 105.48 1dvb n GLY 162 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1dvb n GLY 162 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1dvb s TYR 163 N -3.07 2.89 -0.10 1.61 5.04 -1.25 -4.67 117.35 117.80 1dvb s TYR 163 Ca 0.00 1.01 -0.00 0.00 -2.44 0.00 0.00 57.07 55.64 1dvb s TYR 163 Cb 0.00 -3.90 -0.03 0.00 0.35 0.00 0.00 41.96 38.38 1dvb s TYR 163 CO 0.00 -2.90 -0.07 0.08 -1.34 0.00 0.00 175.55 171.32 1dvb s VAL 164 N -0.25 3.64 -0.14 3.14 1.01 -1.26 -0.74 120.40 125.80 1dvb s VAL 164 Ca 0.59 -0.48 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 1dvb s VAL 164 Cb -0.44 -2.52 0.03 0.00 0.00 0.00 0.00 36.38 33.45 1dvb s VAL 164 CO 0.48 0.56 -0.07 -2.28 0.00 0.00 0.00 175.10 173.79 1dvb s HIS 165 N -0.34 1.65 -0.24 5.22 2.46 -0.54 -5.00 115.29 118.49 1dvb s HIS 165 Ca 0.05 -0.92 -0.21 0.00 0.47 0.00 0.00 55.06 54.45 1dvb s HIS 165 Cb -0.12 -1.31 -0.02 0.00 -0.13 0.00 0.00 32.58 31.00 1dvb s HIS 165 CO 0.02 -0.57 0.64 -1.21 -2.47 0.00 0.00 174.74 171.15 1dvb s GLU 166 N 1.65 4.14 0.00 2.88 2.02 -1.26 -1.66 118.70 126.47 1dvb s GLU 166 Ca 0.03 0.58 0.00 0.00 0.02 0.00 0.00 54.97 55.60 1dvb s GLU 166 Cb -0.14 -3.63 0.00 0.00 0.10 0.00 0.00 34.13 30.46 1dvb s GLU 166 CO -0.08 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.24 1dvb n GLY 167 N 4.05 -0.58 0.10 -1.39 0.00 -0.24 -4.93 105.19 102.20 1dvb n GLY 167 Ca -0.01 -1.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.97 1dvb n GLY 167 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1dvb h THR 168 N 0.94 0.71 -3.06 2.61 1.35 -1.81 1.36 112.91 115.01 1dvb h THR 168 Ca 0.00 -2.25 -0.53 0.00 -0.55 0.00 0.00 66.41 63.09 1dvb h THR 168 Cb 0.00 2.22 -0.17 0.00 -1.73 0.00 0.00 68.15 68.47 1dvb h THR 168 CO 0.00 0.40 -0.77 -0.83 -0.25 0.00 0.00 175.52 174.07 1dvb s GLY 169 N -4.77 1.49 0.75 5.82 0.00 -1.26 0.19 107.32 109.53 1dvb s GLY 169 Ca -0.02 -1.59 -0.11 0.00 0.00 0.00 0.00 44.72 43.00 1dvb s GLY 169 CO 0.80 -1.65 1.09 0.00 0.00 0.00 0.00 173.10 173.33 1dvb s ALA 170 N -2.28 2.53 0.78 3.20 0.00 -0.81 -4.95 121.76 120.23 1dvb s ALA 170 Ca 0.19 -0.17 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1dvb s ALA 170 Cb -0.05 -3.10 0.06 0.00 0.00 0.00 0.00 23.12 20.03 1dvb s ALA 170 CO 0.08 -1.44 1.09 -1.25 0.00 0.00 0.00 175.76 174.24 1dvb s PRO 171 N -5.18 2.18 0.00 0.00 0.04 -1.26 -4.94 135.00 125.83 1dvb s PRO 171 Ca 0.59 1.11 0.19 0.00 0.04 0.00 0.00 61.00 62.94 1dvb s PRO 171 Cb -0.13 -1.89 0.87 0.00 0.04 0.00 0.00 34.50 33.38 1dvb s PRO 171 CO 0.54 -1.68 1.62 0.39 0.04 0.00 0.00 177.00 177.90 1dvb n GLU 172 N -3.54 0.07 -3.64 4.56 1.02 -1.26 -3.99 120.64 113.86 1dvb n GLU 172 Ca 0.09 0.15 -0.07 0.00 -0.02 0.00 0.00 57.16 57.31 1dvb n GLU 172 Cb 0.53 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.38 1dvb n GLU 172 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1dvb s LEU 173 N -2.89 -0.77 0.00 -4.62 0.20 -1.26 -3.37 118.68 105.96 1dvb s LEU 173 Ca 0.12 1.27 -0.30 0.00 0.69 0.00 0.00 54.13 55.90 1dvb s LEU 173 Cb 0.13 2.18 -0.05 0.00 -0.43 0.00 0.00 46.19 48.02 1dvb s LEU 173 CO 0.34 -0.20 1.27 0.00 -0.29 0.00 0.00 176.35 177.47 1dvb h PRO 175 N 7.35 0.43 0.00 0.00 0.10 -1.97 0.49 132.00 138.41 1dvb h PRO 175 Ca -0.38 -0.03 -0.02 0.00 0.10 0.00 0.00 66.00 65.68 1dvb h PRO 175 Cb 1.18 -0.10 -0.00 0.00 0.10 0.00 0.00 31.00 32.18 1dvb h PRO 175 CO 0.87 0.29 -0.11 0.00 0.10 0.00 0.00 178.00 179.15 1dvb h ALA 176 N 1.79 0.02 -0.01 -0.75 0.00 -1.98 -3.40 119.26 114.92 1dvb h ALA 176 Ca 0.12 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1dvb h ALA 176 Cb -0.04 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1dvb h ALA 176 CO -0.02 0.07 -0.31 0.00 0.00 0.00 0.00 179.25 178.99 1dvb n ALA 178 N -0.21 -0.28 -2.03 0.00 0.00 0.17 -4.93 120.51 113.23 1dvb n ALA 178 Ca 0.06 0.29 -0.31 0.00 0.00 0.00 0.00 53.44 53.47 1dvb n ALA 178 Cb 0.30 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.86 1dvb n ALA 178 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1dvb s HIS 179 N -2.68 3.46 0.91 0.00 3.76 -1.26 -4.59 115.29 114.89 1dvb s HIS 179 Ca 0.00 1.24 -0.14 0.00 -0.15 0.00 0.00 55.06 56.01 1dvb s HIS 179 Cb 0.00 -2.60 0.14 0.00 1.11 0.00 0.00 32.58 31.23 1dvb s HIS 179 CO 0.00 -0.22 1.19 -1.25 -0.85 0.00 0.00 174.74 173.61 1dvb s PRO 180 N -3.92 1.11 0.53 8.40 0.04 -1.26 0.16 135.00 140.05 1dvb s PRO 180 Ca 0.55 0.05 0.33 0.00 0.04 0.00 0.00 61.00 61.97 1dvb s PRO 180 Cb -0.10 -1.86 1.49 0.00 0.04 0.00 0.00 34.50 34.07 1dvb s PRO 180 CO 0.31 -2.17 1.84 -0.22 0.04 0.00 0.00 177.00 176.80 1dvb h LYS 181 N -1.48 0.03 -0.04 4.56 3.64 -1.68 -1.24 116.57 120.36 1dvb h LYS 181 Ca -0.47 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.92 1dvb h LYS 181 Cb 1.31 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.12 1dvb h LYS 181 CO 0.56 0.02 0.22 0.00 -2.27 0.00 0.00 179.45 177.98 1dvb h ALA 182 N 1.48 1.32 0.00 5.00 0.00 -1.90 0.27 119.26 125.43 1dvb h ALA 182 Ca 0.51 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1dvb h ALA 182 Cb 1.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1dvb h ALA 182 CO -0.03 -0.24 -0.17 0.72 0.00 0.00 0.00 179.25 179.54 1dvb n HIS 183 N -3.09 0.03 -3.09 0.00 8.25 -0.47 -2.41 115.22 114.44 1dvb n HIS 183 Ca -0.01 0.01 -0.33 0.00 -0.26 0.00 0.00 57.72 57.12 1dvb n HIS 183 Cb 0.29 -0.44 -0.06 0.00 1.12 0.00 0.00 29.99 30.90 1dvb n HIS 183 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1dvb s PHE 184 N -3.01 3.43 0.21 4.41 0.08 0.08 -0.73 117.98 122.46 1dvb s PHE 184 Ca 0.13 1.30 -0.01 0.00 0.12 0.00 0.00 56.93 58.47 1dvb s PHE 184 Cb 0.18 -2.59 -0.04 0.00 -0.57 0.00 0.00 43.02 40.00 1dvb s PHE 184 CO 0.59 0.13 0.12 -1.83 -0.10 0.00 0.00 175.22 174.13 1dvb s GLU 185 N -2.76 1.23 0.20 0.44 -1.05 0.84 -4.74 118.70 112.85 1dvb s GLU 185 Ca 0.52 -1.65 -0.30 0.00 -0.15 0.00 0.00 54.97 53.39 1dvb s GLU 185 Cb -0.12 0.18 -0.09 0.00 -0.44 0.00 0.00 34.13 33.66 1dvb s GLU 185 CO 0.18 -0.37 1.35 -0.51 0.95 0.00 0.00 175.26 176.86 1dvb s LEU 186 N -3.18 4.40 0.16 1.83 1.43 -1.26 -0.06 118.68 122.00 1dvb s LEU 186 Ca 0.38 2.46 -0.31 0.00 -1.03 0.00 0.00 54.13 55.64 1dvb s LEU 186 Cb 0.07 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.60 1dvb s LEU 186 CO 0.12 -0.59 1.37 -0.22 0.23 0.00 0.00 176.35 177.26 1dvb s LEU 187 N -0.03 4.39 0.03 1.79 0.20 0.19 -4.63 118.68 120.62 1dvb s LEU 187 Ca 0.58 2.41 0.07 0.00 0.69 0.00 0.00 54.13 57.88 1dvb s LEU 187 Cb -0.38 -3.60 -0.02 0.00 -0.43 0.00 0.00 46.19 41.76 1dvb s LEU 187 CO 0.38 -0.62 -0.20 -0.83 -0.29 0.00 0.00 176.35 174.80 1dvb s GLY 188 N 0.72 1.04 -0.13 7.98 0.00 -1.26 -4.94 107.32 110.73 1dvb s GLY 188 Ca 0.61 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1dvb s GLY 188 CO 0.35 -0.91 -0.14 -0.42 0.00 0.00 0.00 173.10 171.98 1dvb s ILE 189 N -0.74 2.96 -0.38 0.90 -1.09 -1.26 -5.05 121.20 116.54 1dvb s ILE 189 Ca 0.07 -0.69 0.12 0.00 -2.23 0.00 0.00 60.65 57.91 1dvb s ILE 189 Cb -0.08 -2.23 0.39 0.00 -1.58 0.00 0.00 42.46 38.95 1dvb s ILE 189 CO 0.01 0.53 1.03 -0.46 -1.23 0.00 0.00 174.94 174.82 1dvb n ASN 190 N 3.52 -0.29 0.00 3.58 2.04 -1.26 -5.33 115.26 117.53 1dvb n ASN 190 Ca -0.18 -2.91 0.00 0.00 -0.44 0.00 0.00 54.58 51.05 1dvb n ASN 190 Cb 0.53 0.32 0.00 0.00 -2.53 0.00 0.00 39.78 38.09 1dvb n ASN 190 CO 0.00 0.00 0.00 -2.67 -0.44 0.00 0.00 177.26 174.15