#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zes s ARG 4 N 0.00 4.27 -0.12 5.56 3.52 -1.26 -1.19 118.95 129.73 1zes s ARG 4 Ca 0.00 0.42 0.01 0.00 -0.13 0.00 0.00 55.73 56.04 1zes s ARG 4 Cb 0.00 -3.49 0.02 0.00 -1.56 0.00 0.00 34.95 29.92 1zes s ARG 4 CO 0.00 0.03 -0.16 0.42 -0.81 0.00 0.00 175.30 174.78 1zes s ILE 5 N 1.05 1.57 -0.32 4.11 1.01 -0.77 0.16 121.20 128.01 1zes s ILE 5 Ca 0.25 -0.67 -0.19 0.00 0.00 0.00 0.00 60.65 60.04 1zes s ILE 5 Cb -0.15 -1.44 -0.01 0.00 0.01 0.00 0.00 42.46 40.87 1zes s ILE 5 CO 0.10 0.46 0.58 -0.22 0.00 0.00 0.00 174.94 175.85 1zes s LEU 6 N 1.10 4.20 -0.43 2.97 2.96 -0.76 -0.28 118.68 128.43 1zes s LEU 6 Ca -0.04 0.28 -0.16 0.00 -0.22 0.00 0.00 54.13 54.00 1zes s LEU 6 Cb -0.14 -2.72 0.04 0.00 0.50 0.00 0.00 46.19 43.86 1zes s LEU 6 CO -0.04 -0.46 0.36 -0.69 -1.32 0.00 0.00 176.35 174.20 1zes s VAL 7 N 2.52 5.21 -0.46 1.68 1.01 0.83 -0.67 120.40 130.51 1zes s VAL 7 Ca 0.23 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 1zes s VAL 7 Cb -0.15 -4.02 0.09 0.00 0.00 0.00 0.00 36.38 32.30 1zes s VAL 7 CO 0.12 -0.43 0.35 -0.69 0.00 0.00 0.00 175.10 174.45 1zes s VAL 8 N 1.78 4.66 -0.22 2.92 1.01 0.71 -1.10 120.40 130.15 1zes s VAL 8 Ca 0.06 -1.37 -0.10 0.00 0.00 0.00 0.00 61.98 60.57 1zes s VAL 8 Cb -0.20 -3.88 0.09 0.00 0.00 0.00 0.00 36.38 32.38 1zes s VAL 8 CO 0.10 -0.62 0.51 -0.70 0.00 0.00 0.00 175.10 174.39 1zes s GLU 9 N 1.50 0.47 0.33 2.72 2.56 -0.71 -0.90 118.70 124.67 1zes s GLU 9 Ca 0.04 1.07 0.17 0.00 0.00 0.00 0.00 54.97 56.26 1zes s GLU 9 Cb -0.25 0.28 0.37 0.00 2.00 0.00 0.00 34.13 36.54 1zes s GLU 9 CO 0.03 -0.19 1.59 0.38 -0.56 0.00 0.00 175.26 176.50 1zes h ASP 10 N 7.58 0.00 -3.21 -1.70 2.03 -1.81 -3.38 116.42 115.93 1zes h ASP 10 Ca -0.25 0.00 -0.62 0.00 -0.73 0.00 0.00 57.03 55.43 1zes h ASP 10 Cb 1.15 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.53 1zes h ASP 10 CO 0.18 0.42 0.49 -1.61 -1.03 0.00 0.00 179.24 177.69 1zes s GLU 11 N -3.25 3.30 0.20 4.15 2.02 -1.26 -4.95 118.70 118.91 1zes s GLU 11 Ca 0.02 -0.35 -0.21 0.00 0.02 0.00 0.00 54.97 54.46 1zes s GLU 11 Cb 0.09 -4.06 0.14 0.00 0.10 0.00 0.00 34.13 30.40 1zes s GLU 11 CO 0.71 -1.44 1.57 0.00 0.02 0.00 0.00 175.26 176.12 1zes h ALA 12 N 9.26 -0.04 -0.84 5.21 0.00 -1.97 -0.17 119.26 130.71 1zes h ALA 12 Ca -0.26 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1zes h ALA 12 Cb 1.08 0.89 -0.04 0.00 0.00 0.00 0.00 17.79 19.72 1zes h ALA 12 CO 1.07 -0.69 0.48 -1.35 0.00 0.00 0.00 179.25 178.76 1zes h PRO 13 N -0.12 1.15 -0.13 0.00 0.11 -1.98 -1.05 132.00 129.98 1zes h PRO 13 Ca 0.25 -0.11 -0.03 0.00 0.11 0.00 0.00 66.00 66.22 1zes h PRO 13 Cb 0.56 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.43 1zes h PRO 13 CO -0.77 0.82 -0.04 0.82 -0.21 0.00 0.00 178.00 178.62 1zes h ILE 14 N 1.16 1.29 -0.65 4.15 1.08 -1.82 -1.70 117.51 121.01 1zes h ILE 14 Ca 0.30 -0.99 0.03 0.00 -0.39 0.00 0.00 64.86 63.81 1zes h ILE 14 Cb -0.01 1.69 -0.04 0.00 -3.07 0.00 0.00 36.82 35.38 1zes h ILE 14 CO -0.05 0.29 0.40 -0.09 -0.69 0.00 0.00 178.15 178.00 1zes h ARG 15 N -0.07 0.75 -0.13 2.37 2.43 -0.77 0.73 114.38 119.69 1zes h ARG 15 Ca 0.03 -0.05 -0.17 0.00 -0.81 0.00 0.00 59.98 58.98 1zes h ARG 15 Cb 0.46 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1zes h ARG 15 CO 0.01 0.50 -0.64 0.93 -1.51 0.00 0.00 179.97 179.26 1zes h GLU 16 N 0.77 0.50 -0.19 0.20 5.08 -1.23 -0.89 114.58 118.83 1zes h GLU 16 Ca 0.27 -0.36 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1zes h GLU 16 Cb 0.05 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1zes h GLU 16 CO -0.12 0.98 0.10 1.98 -1.00 0.00 0.00 179.01 180.95 1zes h MET 17 N 0.36 0.27 -0.36 2.33 4.05 -0.70 -1.26 114.93 119.62 1zes h MET 17 Ca -0.01 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.38 1zes h MET 17 Cb 1.21 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.93 1zes h MET 17 CO 0.12 0.28 0.22 0.28 0.23 0.00 0.00 176.91 178.03 1zes h VAL 18 N 0.20 1.05 -0.70 -5.77 2.07 -0.61 -1.32 116.25 111.17 1zes h VAL 18 Ca 0.07 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.52 1zes h VAL 18 Cb 0.09 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.36 1zes h VAL 18 CO -0.01 0.08 0.35 0.00 0.02 0.00 0.00 177.57 178.01 1zes h PHE 20 N 0.61 0.54 -0.91 0.00 3.57 -0.61 0.11 116.94 120.25 1zes h PHE 20 Ca 0.34 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.85 1zes h PHE 20 Cb 0.33 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 1zes h PHE 20 CO -0.10 0.41 0.59 0.28 -2.23 0.00 0.00 178.31 177.26 1zes h VAL 21 N 0.52 1.18 -0.34 1.41 2.07 -0.70 -0.45 116.25 119.94 1zes h VAL 21 Ca 0.14 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 1zes h VAL 21 Cb 0.04 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.70 1zes h VAL 21 CO -0.02 0.21 0.00 -0.07 0.02 0.00 0.00 177.57 177.71 1zes h LEU 22 N 1.17 0.58 -0.56 2.57 3.38 -0.57 -2.81 115.31 119.07 1zes h LEU 22 Ca 0.35 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 58.10 1zes h LEU 22 Cb -0.04 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.49 1zes h LEU 22 CO -0.10 0.74 0.20 -0.33 0.09 0.00 0.00 178.44 179.04 1zes h GLU 23 N 0.40 0.36 -0.69 1.13 5.08 -0.44 -0.71 114.58 119.72 1zes h GLU 23 Ca 0.10 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.59 1zes h GLU 23 Cb 0.45 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 1zes h GLU 23 CO 0.02 0.24 0.47 1.96 -1.00 0.00 0.00 179.01 180.70 1zes h GLN 24 N 0.37 0.27 -0.54 2.33 4.20 -0.91 -2.41 115.11 118.42 1zes h GLN 24 Ca 0.28 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1zes h GLN 24 Cb 0.33 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1zes h GLN 24 CO -0.28 0.18 0.00 0.09 -0.67 0.00 0.00 178.83 178.14 1zes n ASN 25 N -4.44 5.34 0.00 1.46 3.02 -0.67 -4.93 115.26 115.03 1zes n ASN 25 Ca 0.13 -2.88 0.00 0.00 -0.03 0.00 0.00 54.58 51.80 1zes n ASN 25 Cb 0.56 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1zes n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zes n GLY 26 N 0.52 0.73 3.95 7.41 0.00 -0.91 -5.04 105.19 111.86 1zes n GLY 26 Ca 0.27 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.06 1zes n GLY 26 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1zes s PHE 27 N -2.21 3.48 -0.36 1.61 0.08 -0.36 -5.00 117.98 115.21 1zes s PHE 27 Ca 0.00 0.18 0.03 0.00 0.12 0.00 0.00 56.93 57.26 1zes s PHE 27 Cb 0.00 -1.75 0.10 0.00 -0.57 0.00 0.00 43.02 40.81 1zes s PHE 27 CO 0.00 0.29 0.09 -0.65 -0.10 0.00 0.00 175.22 174.85 1zes s GLN 28 N -4.08 1.62 0.42 0.44 -0.21 -0.33 -3.79 119.66 113.73 1zes s GLN 28 Ca 0.37 -1.91 -0.16 0.00 0.02 0.00 0.00 55.36 53.69 1zes s GLN 28 Cb -0.09 -3.30 -0.09 0.00 1.00 0.00 0.00 33.01 30.53 1zes s GLN 28 CO 0.32 -0.98 0.86 -2.14 -2.12 0.00 0.00 175.29 171.24 1zes s PRO 29 N 0.89 3.99 0.08 2.91 0.02 -1.26 -1.85 135.00 139.77 1zes s PRO 29 Ca 0.11 0.81 0.07 0.00 0.02 0.00 0.00 61.00 62.01 1zes s PRO 29 Cb -0.20 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 32.01 1zes s PRO 29 CO -0.07 -0.06 -0.19 0.14 -0.33 0.00 0.00 177.00 176.50 1zes s VAL 30 N -2.31 1.53 -0.04 3.83 -7.23 0.61 -4.90 120.40 111.89 1zes s VAL 30 Ca 0.57 -1.40 -0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1zes s VAL 30 Cb -0.10 -1.39 -0.03 0.00 0.56 0.00 0.00 36.38 35.41 1zes s VAL 30 CO 0.24 -0.05 0.01 -1.61 -0.31 0.00 0.00 175.10 173.37 1zes s GLU 31 N -1.71 2.90 -0.01 4.82 2.02 -1.26 -0.12 118.70 125.34 1zes s GLU 31 Ca 0.04 -0.50 0.02 0.00 0.02 0.00 0.00 54.97 54.55 1zes s GLU 31 Cb -0.10 -2.75 -0.00 0.00 0.10 0.00 0.00 34.13 31.39 1zes s GLU 31 CO 0.03 0.66 -0.06 0.00 0.02 0.00 0.00 175.26 175.92 1zes s ALA 32 N -1.00 0.53 -1.41 5.21 0.00 -0.26 -4.91 121.76 119.93 1zes s ALA 32 Ca 0.17 -0.23 0.15 0.00 0.00 0.00 0.00 51.96 52.05 1zes s ALA 32 Cb -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1zes s ALA 32 CO 0.07 0.11 0.83 -0.85 0.00 0.00 0.00 175.76 175.91 1zes n GLU 33 N 3.09 1.72 -3.83 0.00 0.28 -1.26 -1.74 120.64 118.90 1zes n GLU 33 Ca -0.15 -0.78 -0.07 0.00 -0.16 0.00 0.00 57.16 56.00 1zes n GLU 33 Cb 0.57 -1.25 0.02 0.00 1.43 0.00 0.00 31.44 32.20 1zes n GLU 33 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 1zes s ASP 34 N -1.84 -0.01 0.07 -1.84 1.47 -1.26 -3.90 116.67 109.36 1zes s ASP 34 Ca 0.13 -1.01 -0.36 0.00 1.18 0.00 0.00 52.55 52.49 1zes s ASP 34 Cb 0.12 0.76 -0.19 0.00 -0.34 0.00 0.00 42.92 43.28 1zes s ASP 34 CO 0.39 -1.51 1.59 0.22 0.68 0.00 0.00 175.17 176.54 1zes h TYR 35 N 2.00 -1.14 -0.97 2.11 5.03 -1.46 -1.72 116.97 120.82 1zes h TYR 35 Ca -0.31 -0.02 0.14 0.00 2.58 0.00 0.00 58.73 61.13 1zes h TYR 35 Cb 1.24 0.39 -0.08 0.00 1.55 0.00 0.00 36.73 39.83 1zes h TYR 35 CO 1.32 -0.67 0.61 -0.44 -1.32 0.00 0.00 178.16 177.66 1zes h ASP 36 N -1.13 0.82 -0.47 -2.11 3.32 -1.86 -0.12 116.42 114.87 1zes h ASP 36 Ca -0.10 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1zes h ASP 36 Cb 0.89 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.31 1zes h ASP 36 CO 0.14 0.40 0.22 0.28 -1.72 0.00 0.00 179.24 178.56 1zes h SER 37 N 0.86 0.66 -0.17 6.45 0.02 -1.91 -1.26 113.55 118.20 1zes h SER 37 Ca 0.50 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 61.32 1zes h SER 37 Cb 0.64 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1zes h SER 37 CO -0.27 0.59 -0.13 0.00 -1.14 0.00 0.00 176.83 175.87 1zes h ALA 38 N 1.51 0.25 -0.54 3.77 0.00 -0.11 -1.26 119.26 122.88 1zes h ALA 38 Ca 0.18 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1zes h ALA 38 Cb 0.12 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1zes h ALA 38 CO -0.02 0.12 0.33 0.28 0.00 0.00 0.00 179.25 179.96 1zes h VAL 39 N 0.05 1.07 -0.56 0.00 2.07 -1.17 -2.54 116.25 115.16 1zes h VAL 39 Ca 0.03 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1zes h VAL 39 Cb 0.65 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1zes h VAL 39 CO 0.04 0.12 0.25 0.78 0.02 0.00 0.00 177.57 178.77 1zes h ASN 40 N 0.66 0.72 0.62 0.57 2.35 -1.18 -2.73 115.58 116.59 1zes h ASN 40 Ca 0.21 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1zes h ASN 40 Cb 0.00 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.19 1zes h ASN 40 CO -0.09 0.63 0.00 1.67 -1.65 0.00 0.00 177.43 178.00 1zes n GLN 41 N -4.35 0.25 -2.48 0.81 -0.06 -0.48 -4.46 117.38 106.61 1zes n GLN 41 Ca 0.05 0.05 -0.40 0.00 -2.00 0.00 0.00 57.00 54.70 1zes n GLN 41 Cb 0.14 -1.50 -0.02 0.00 -4.06 0.00 0.00 30.24 24.81 1zes n GLN 41 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1zes s LEU 42 N -2.72 3.65 0.00 1.69 1.43 -1.03 -4.87 118.68 116.83 1zes s LEU 42 Ca 0.21 -2.15 0.05 0.00 -1.03 0.00 0.00 54.13 51.21 1zes s LEU 42 Cb 0.17 -2.58 0.09 0.00 0.03 0.00 0.00 46.19 43.90 1zes s LEU 42 CO 0.42 -1.57 0.89 0.59 0.23 0.00 0.00 176.35 176.91 1zes n ASN 43 N 9.61 -0.05 -3.73 2.29 4.13 -1.26 -5.05 115.26 121.20 1zes n ASN 43 Ca 0.46 -1.71 -0.13 0.00 1.68 0.00 0.00 54.58 54.88 1zes n ASN 43 Cb 0.47 -0.03 -0.10 0.00 -1.54 0.00 0.00 39.78 38.58 1zes n ASN 43 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1zes s TRP 46 N 0.00 -0.46 0.44 3.10 0.51 -1.26 -5.16 118.94 116.12 1zes s TRP 46 Ca 0.07 1.11 -0.13 0.00 -2.12 0.00 0.00 56.10 55.02 1zes s TRP 46 Cb 0.08 0.16 -0.07 0.00 -0.81 0.00 0.00 33.47 32.83 1zes s TRP 46 CO -0.04 -0.24 0.86 -1.25 -0.51 0.00 0.00 176.95 175.77 1zes s PRO 47 N 0.13 3.87 0.29 4.98 0.04 -1.26 -4.86 135.00 138.18 1zes s PRO 47 Ca -0.01 0.69 0.15 0.00 0.04 0.00 0.00 61.00 61.88 1zes s PRO 47 Cb -0.03 -2.29 0.08 0.00 0.04 0.00 0.00 34.50 32.31 1zes s PRO 47 CO 0.01 -0.12 1.46 -0.44 0.04 0.00 0.00 177.00 177.94 1zes h ASP 48 N 1.19 0.00 -4.30 6.66 3.32 -0.65 -3.47 116.42 119.17 1zes h ASP 48 Ca -0.47 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 1zes h ASP 48 Cb 1.19 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.53 1zes h ASP 48 CO 0.63 0.47 0.13 -0.22 -1.72 0.00 0.00 179.24 178.53 1zes s LEU 49 N -6.45 -0.65 -0.19 1.55 0.20 -1.08 -4.11 118.68 107.96 1zes s LEU 49 Ca 0.04 1.19 -0.03 0.00 0.69 0.00 0.00 54.13 56.03 1zes s LEU 49 Cb 0.07 2.43 -0.01 0.00 -0.43 0.00 0.00 46.19 48.25 1zes s LEU 49 CO 0.74 -0.35 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.74 1zes s ILE 50 N -0.11 3.25 -0.31 6.68 1.01 0.10 -1.83 121.20 129.99 1zes s ILE 50 Ca -0.03 -0.55 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 1zes s ILE 50 Cb -0.03 -2.44 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 1zes s ILE 50 CO 0.04 0.46 0.22 -0.22 0.00 0.00 0.00 174.94 175.44 1zes s LEU 51 N 1.09 4.27 -0.16 2.97 2.96 0.15 -0.72 118.68 129.24 1zes s LEU 51 Ca 0.01 -0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 1zes s LEU 51 Cb -0.15 -2.14 0.05 0.00 0.50 0.00 0.00 46.19 44.45 1zes s LEU 51 CO -0.01 -0.15 -0.01 -0.22 -1.32 0.00 0.00 176.35 174.64 1zes s LEU 52 N 1.75 1.30 0.62 -0.68 2.96 0.00 -0.20 118.68 124.44 1zes s LEU 52 Ca 0.07 -0.62 -0.15 0.00 -0.22 0.00 0.00 54.13 53.21 1zes s LEU 52 Cb -0.17 -0.72 -0.02 0.00 0.50 0.00 0.00 46.19 45.78 1zes s LEU 52 CO 0.11 -0.23 1.09 -0.62 -1.32 0.00 0.00 176.35 175.38 1zes s ASP 53 N 1.77 5.44 -0.09 3.68 2.15 -0.08 -0.70 116.67 128.83 1zes s ASP 53 Ca 0.01 1.92 -0.05 0.00 0.43 0.00 0.00 52.55 54.87 1zes s ASP 53 Cb -0.15 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.91 1zes s ASP 53 CO -0.07 -1.40 -0.09 -0.25 -0.17 0.00 0.00 175.17 173.18 1zes h TRP 54 N 0.26 0.00 -3.26 -5.34 2.91 -1.89 -3.28 115.95 105.34 1zes h TRP 54 Ca -0.47 0.00 -0.56 0.00 1.13 0.00 0.00 58.89 58.99 1zes h TRP 54 Cb 1.24 0.00 -0.06 0.00 -0.51 0.00 0.00 29.16 29.82 1zes h TRP 54 CO 0.56 0.00 1.02 -1.64 -1.03 0.00 0.00 178.44 177.35 1zes s MET 55 N -1.76 3.53 0.02 2.65 1.00 -1.26 0.08 119.30 123.56 1zes s MET 55 Ca -0.07 0.55 0.01 0.00 0.00 0.00 0.00 55.69 56.18 1zes s MET 55 Cb 0.01 -4.02 -0.02 0.00 0.00 0.00 0.00 34.83 30.81 1zes s MET 55 CO 0.11 -1.64 -0.05 -0.51 0.00 0.00 0.00 175.02 172.92 1zes s LEU 56 N 5.24 2.17 0.29 -0.03 1.43 -1.26 -4.69 118.68 121.83 1zes s LEU 56 Ca 0.51 -0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 52.94 1zes s LEU 56 Cb -0.10 -0.11 -0.11 0.00 0.03 0.00 0.00 46.19 45.91 1zes s LEU 56 CO 0.29 -0.14 1.52 -2.84 0.23 0.00 0.00 176.35 175.41 1zes s PRO 57 N -1.06 4.17 0.00 1.29 0.02 -1.26 -3.30 135.00 134.86 1zes s PRO 57 Ca -0.08 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.42 1zes s PRO 57 Cb -0.07 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.41 1zes s PRO 57 CO -0.00 -0.54 0.00 0.41 -0.33 0.00 0.00 177.00 176.54 1zes n GLY 58 N 1.89 0.84 0.00 0.52 0.00 -1.26 -1.36 105.19 105.82 1zes n GLY 58 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1zes n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zes n GLY 59 N -2.00 4.08 3.94 -0.02 0.00 -1.21 -4.77 105.19 105.22 1zes n GLY 59 Ca 0.00 -1.10 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 1zes n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zes s SER 60 N 0.00 5.66 0.45 1.61 1.04 -1.26 -4.18 113.70 117.02 1zes s SER 60 Ca 0.00 0.39 0.11 0.00 0.48 0.00 0.00 55.95 56.93 1zes s SER 60 Cb 0.00 -1.50 1.02 0.00 0.10 0.00 0.00 66.02 65.64 1zes s SER 60 CO 0.00 -0.90 2.09 1.23 0.98 0.00 0.00 173.24 176.65 1zes h GLY 61 N 0.15 0.36 0.77 7.32 0.00 -0.43 -0.76 103.07 110.48 1zes h GLY 61 Ca -0.45 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 46.75 1zes h GLY 61 CO 0.58 0.13 -0.14 -2.22 0.00 0.00 0.00 176.54 174.89 1zes h ILE 62 N 0.35 0.68 -0.84 2.60 1.08 -1.86 0.02 117.51 119.53 1zes h ILE 62 Ca 0.10 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.60 1zes h ILE 62 Cb -0.02 0.68 -0.05 0.00 -3.07 0.00 0.00 36.82 34.36 1zes h ILE 62 CO -0.02 0.00 0.54 1.56 -0.69 0.00 0.00 178.15 179.54 1zes h GLN 63 N -0.28 1.03 -0.68 2.37 1.08 -1.85 -2.18 115.11 114.60 1zes h GLN 63 Ca 0.02 -0.06 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1zes h GLN 63 Cb 0.29 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1zes h GLN 63 CO -0.07 0.68 0.45 0.35 -0.95 0.00 0.00 178.83 179.29 1zes h PHE 64 N 1.07 0.86 -0.18 2.96 3.57 -0.77 -0.49 116.94 123.96 1zes h PHE 64 Ca 0.33 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.87 1zes h PHE 64 Cb -0.01 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 1zes h PHE 64 CO -0.02 0.55 0.07 0.82 -2.23 0.00 0.00 178.31 177.50 1zes h ILE 65 N 0.93 0.97 -0.88 1.41 2.04 -0.76 -0.03 117.51 121.19 1zes h ILE 65 Ca 0.25 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 66.10 1zes h ILE 65 Cb -0.10 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 36.72 1zes h ILE 65 CO -0.05 0.03 0.58 0.11 0.00 0.00 0.00 178.15 178.82 1zes h LYS 66 N 0.16 1.04 0.49 2.37 1.57 -0.96 0.23 116.57 121.49 1zes h LYS 66 Ca 0.08 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1zes h LYS 66 Cb 0.03 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1zes h LYS 66 CO -0.07 0.69 -0.26 1.25 -0.57 0.00 0.00 179.45 180.49 1zes h HIS 67 N 1.07 -0.69 -0.91 -1.35 2.76 -0.70 -1.46 115.15 113.88 1zes h HIS 67 Ca 0.36 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.61 1zes h HIS 67 Cb 0.07 0.24 -0.08 0.00 1.55 0.00 0.00 27.41 29.19 1zes h HIS 67 CO -0.00 -0.42 0.56 -0.07 -1.30 0.00 0.00 177.93 176.70 1zes h LEU 68 N -0.70 0.83 -0.21 0.26 3.38 -0.44 -2.74 115.31 115.68 1zes h LEU 68 Ca -0.06 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1zes h LEU 68 Cb 0.56 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1zes h LEU 68 CO 0.09 0.47 -0.33 0.11 0.09 0.00 0.00 178.44 178.87 1zes h LYS 69 N 0.93 0.00 0.00 1.13 1.79 -0.73 -2.75 116.57 116.94 1zes h LYS 69 Ca 0.43 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 1zes h LYS 69 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1zes h LYS 69 CO -0.24 0.33 -0.05 0.07 -1.08 0.00 0.00 179.45 178.49 1zes h ARG 70 N 0.00 0.00 -4.87 3.15 0.11 -0.95 -3.44 114.38 108.38 1zes h ARG 70 Ca -0.00 0.00 -0.66 0.00 0.10 0.00 0.00 59.98 59.41 1zes h ARG 70 Cb 1.17 0.00 -0.18 0.00 1.11 0.00 0.00 29.97 32.08 1zes h ARG 70 CO 0.04 0.00 -0.38 -2.00 0.10 0.00 0.00 179.97 177.73 1zes s GLU 71 N -3.15 3.62 0.32 0.08 2.56 -1.17 -4.97 118.70 115.99 1zes s GLU 71 Ca 0.09 -0.45 0.11 0.00 0.00 0.00 0.00 54.97 54.71 1zes s GLU 71 Cb 0.10 -3.78 0.93 0.00 2.00 0.00 0.00 34.13 33.38 1zes s GLU 71 CO 0.63 -0.44 1.71 0.66 -0.56 0.00 0.00 175.26 177.27 1zes h SER 72 N 8.44 0.63 1.10 -1.70 4.64 -1.84 -0.02 113.55 124.80 1zes h SER 72 Ca -0.31 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1zes h SER 72 Cb 1.16 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1zes h SER 72 CO 0.65 0.04 0.00 0.23 -0.87 0.00 0.00 176.83 176.88 1zes n MET 73 N -4.93 0.15 0.00 4.77 2.81 -1.26 -3.30 117.12 115.37 1zes n MET 73 Ca 0.28 0.21 0.02 0.00 -1.81 0.00 0.00 57.70 56.40 1zes n MET 73 Cb 0.80 -1.71 -0.02 0.00 -0.71 0.00 0.00 33.22 31.58 1zes n MET 73 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1zes n THR 74 N -1.99 0.00 0.15 2.03 -2.24 -0.19 -4.73 114.28 107.31 1zes n THR 74 Ca 0.05 -0.41 0.19 0.00 -2.27 0.00 0.00 64.05 61.61 1zes n THR 74 Cb 0.34 1.02 0.78 0.00 -2.10 0.00 0.00 70.33 70.37 1zes n THR 74 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1zes h ARG 75 N 0.20 0.00 -0.01 -0.78 2.43 -0.79 -2.22 114.38 113.21 1zes h ARG 75 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1zes h ARG 75 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1zes h ARG 75 CO 0.00 0.00 -0.58 -0.25 -1.51 0.00 0.00 179.97 177.63 1zes n ASP 76 N -3.68 1.83 -4.68 -3.80 8.00 -1.26 -4.87 116.55 108.09 1zes n ASP 76 Ca 0.05 -1.42 -0.42 0.00 0.71 0.00 0.00 54.79 53.71 1zes n ASP 76 Cb 0.51 0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 42.16 1zes n ASP 76 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1zes s ILE 77 N -2.57 3.73 0.55 0.53 1.01 -0.83 -4.98 121.20 118.64 1zes s ILE 77 Ca 0.16 1.09 -0.19 0.00 0.00 0.00 0.00 60.65 61.71 1zes s ILE 77 Cb 0.18 -3.70 -0.05 0.00 0.01 0.00 0.00 42.46 38.89 1zes s ILE 77 CO 0.63 -0.02 1.09 -2.16 0.00 0.00 0.00 174.94 174.48 1zes s PRO 78 N 2.62 3.40 -0.09 2.79 0.04 -1.26 -4.89 135.00 137.62 1zes s PRO 78 Ca 0.64 1.45 0.01 0.00 0.04 0.00 0.00 61.00 63.14 1zes s PRO 78 Cb -0.31 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.22 1zes s PRO 78 CO 0.26 -0.78 -0.08 0.08 0.04 0.00 0.00 177.00 176.52 1zes s VAL 79 N -2.01 0.94 -0.22 -0.36 1.01 -1.26 -0.73 120.40 117.78 1zes s VAL 79 Ca 0.69 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.35 1zes s VAL 79 Cb -0.20 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.25 1zes s VAL 79 CO 0.28 0.34 -0.07 -0.69 0.00 0.00 0.00 175.10 174.96 1zes s VAL 80 N 1.30 3.08 0.33 2.92 1.01 0.10 -0.29 120.40 128.85 1zes s VAL 80 Ca -0.03 -0.64 -0.27 0.00 0.00 0.00 0.00 61.98 61.04 1zes s VAL 80 Cb -0.14 -2.41 -0.09 0.00 0.00 0.00 0.00 36.38 33.74 1zes s VAL 80 CO -0.03 0.41 1.03 -0.04 0.00 0.00 0.00 175.10 176.47 1zes s MET 81 N 1.43 4.48 -0.25 2.72 -1.94 -0.59 -0.81 119.30 124.33 1zes s MET 81 Ca 0.05 1.55 -0.03 0.00 -1.71 0.00 0.00 55.69 55.55 1zes s MET 81 Cb -0.14 -2.88 0.10 0.00 2.01 0.00 0.00 34.83 33.92 1zes s MET 81 CO -0.05 0.14 0.17 -1.17 -0.01 0.00 0.00 175.02 174.09 1zes s LEU 82 N -1.98 0.25 -0.03 -0.03 2.96 0.12 -0.21 118.68 119.75 1zes s LEU 82 Ca 0.50 -0.88 -0.16 0.00 -0.22 0.00 0.00 54.13 53.36 1zes s LEU 82 Cb -0.25 -0.05 0.03 0.00 0.50 0.00 0.00 46.19 46.42 1zes s LEU 82 CO 0.31 -0.39 0.35 0.28 -1.32 0.00 0.00 176.35 175.58 1zes s THR 83 N 2.19 0.05 -0.77 3.68 -1.32 -0.68 -3.72 115.64 115.08 1zes s THR 83 Ca 0.07 -0.38 0.20 0.00 -1.21 0.00 0.00 61.69 60.37 1zes s THR 83 Cb -0.16 -0.64 0.19 0.00 -1.51 0.00 0.00 72.50 70.39 1zes s THR 83 CO -0.27 -0.21 1.63 0.00 -2.21 0.00 0.00 174.62 173.56 1zes n ALA 84 N 1.40 1.76 -2.36 11.08 0.00 -1.26 -0.74 120.51 130.39 1zes n ALA 84 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.84 1zes n ALA 84 Cb 0.56 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.65 1zes n ALA 84 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1zes s ARG 85 N -3.14 2.98 0.00 0.00 0.52 -1.26 -4.76 118.95 113.29 1zes s ARG 85 Ca 0.07 0.06 0.12 0.00 -0.52 0.00 0.00 55.73 55.45 1zes s ARG 85 Cb 0.10 -4.28 0.24 0.00 0.52 0.00 0.00 34.95 31.53 1zes s ARG 85 CO 0.36 -2.38 1.12 0.41 0.02 0.00 0.00 175.30 174.83 1zes n GLY 86 N 5.53 1.52 3.86 -3.53 0.00 -1.26 -4.58 105.19 106.72 1zes n GLY 86 Ca 0.10 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1zes n GLY 86 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zes s GLU 87 N -1.00 3.82 0.21 1.61 2.02 -1.26 -4.82 118.70 119.27 1zes s GLU 87 Ca 0.21 0.79 -0.11 0.00 0.02 0.00 0.00 54.97 55.88 1zes s GLU 87 Cb 0.12 -2.17 0.28 0.00 0.10 0.00 0.00 34.13 32.46 1zes s GLU 87 CO 0.16 -0.30 1.65 1.49 0.02 0.00 0.00 175.26 178.28 1zes h GLU 88 N 0.63 0.09 -0.85 1.61 4.81 -1.99 0.93 114.58 119.80 1zes h GLU 88 Ca -0.46 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 58.82 1zes h GLU 88 Cb 1.19 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 30.49 1zes h GLU 88 CO 0.62 0.06 0.56 0.93 -0.73 0.00 0.00 179.01 180.44 1zes h GLU 89 N 0.09 0.94 -0.09 1.92 5.08 -1.99 -0.53 114.58 120.00 1zes h GLU 89 Ca 0.32 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1zes h GLU 89 Cb 0.51 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 1zes h GLU 89 CO -0.55 0.62 -0.04 -0.44 -1.00 0.00 0.00 179.01 177.60 1zes h ASP 90 N 0.97 0.20 -0.63 1.42 3.32 -1.19 0.22 116.42 120.72 1zes h ASP 90 Ca 0.36 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1zes h ASP 90 Cb 0.19 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1zes h ASP 90 CO -0.13 0.55 0.36 0.03 -1.72 0.00 0.00 179.24 178.33 1zes h ARG 91 N -0.16 0.87 -0.27 3.56 3.08 -1.05 -1.53 114.38 118.89 1zes h ARG 91 Ca 0.02 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1zes h ARG 91 Cb 0.47 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1zes h ARG 91 CO 0.01 0.65 0.13 0.28 -1.07 0.00 0.00 179.97 179.97 1zes h VAL 92 N 0.86 1.15 -0.40 2.04 2.07 -0.99 -2.83 116.25 118.15 1zes h VAL 92 Ca 0.22 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1zes h VAL 92 Cb 0.02 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1zes h VAL 92 CO -0.04 0.15 0.26 -0.09 0.02 0.00 0.00 177.57 177.87 1zes h ARG 93 N 0.30 0.51 -0.42 1.57 9.65 -0.25 0.91 114.38 126.65 1zes h ARG 93 Ca 0.09 -0.03 0.04 0.00 -1.10 0.00 0.00 59.98 58.98 1zes h ARG 93 Cb 0.12 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 1zes h ARG 93 CO -0.01 0.34 0.18 0.78 2.80 0.00 0.00 179.97 184.06 1zes h GLY 94 N 0.53 0.56 0.79 2.80 0.00 -1.29 0.00 103.07 106.46 1zes h GLY 94 Ca 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 1zes h GLY 94 CO -0.04 0.06 0.01 1.41 0.00 0.00 0.00 176.54 177.98 1zes h LEU 95 N 0.36 0.23 -1.95 3.11 3.38 -1.25 -1.81 115.31 117.38 1zes h LEU 95 Ca 0.19 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1zes h LEU 95 Cb 0.14 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1zes h LEU 95 CO -0.17 0.46 -0.09 -0.33 0.09 0.00 0.00 178.44 178.40 1zes h GLU 96 N -0.01 0.00 0.00 1.13 4.39 -0.53 -1.12 114.58 118.44 1zes h GLU 96 Ca 0.04 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.59 1zes h GLU 96 Cb 0.33 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 1zes h GLU 96 CO 0.00 0.09 -0.70 1.15 -1.16 0.00 0.00 179.01 178.40 1zes h THR 97 N 0.00 1.44 0.00 1.13 2.02 -0.79 -3.47 112.91 113.24 1zes h THR 97 Ca -0.00 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.74 1zes h THR 97 Cb 0.34 2.34 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 1zes h THR 97 CO 0.01 0.68 0.00 0.61 0.37 0.00 0.00 175.52 177.20 1zes n GLY 98 N 0.61 -0.81 3.77 2.16 0.00 -0.43 -4.76 105.19 105.74 1zes n GLY 98 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1zes n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zes s ALA 99 N -0.16 3.39 0.14 4.61 0.00 -0.70 -4.79 121.76 124.24 1zes s ALA 99 Ca 0.00 1.12 0.10 0.00 0.00 0.00 0.00 51.96 53.18 1zes s ALA 99 Cb 0.00 -3.43 0.07 0.00 0.00 0.00 0.00 23.12 19.76 1zes s ALA 99 CO 0.00 -0.53 1.44 -0.44 0.00 0.00 0.00 175.76 176.23 1zes h ASP 100 N 3.26 0.00 -5.11 0.00 3.32 -0.98 -3.41 116.42 113.50 1zes h ASP 100 Ca -0.48 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1zes h ASP 100 Cb 1.23 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.69 1zes h ASP 100 CO 0.65 0.77 0.04 -0.62 -1.72 0.00 0.00 179.24 178.36 1zes s ASP 101 N -6.70 -0.21 -0.19 6.45 -1.08 -1.18 -5.03 116.67 108.72 1zes s ASP 101 Ca 0.01 -0.64 -0.05 0.00 -0.52 0.00 0.00 52.55 51.35 1zes s ASP 101 Cb 0.11 0.62 0.10 0.00 -1.46 0.00 0.00 42.92 42.28 1zes s ASP 101 CO 0.78 -1.15 0.36 -0.47 0.52 0.00 0.00 175.17 175.21 1zes s TYR 102 N -3.93 -0.68 -0.10 -5.34 6.14 -1.26 -1.54 117.35 110.65 1zes s TYR 102 Ca 0.13 1.11 0.04 0.00 0.64 0.00 0.00 57.07 58.99 1zes s TYR 102 Cb -0.02 0.10 0.00 0.00 0.42 0.00 0.00 41.96 42.45 1zes s TYR 102 CO 0.03 -0.52 -0.23 0.42 0.64 0.00 0.00 175.55 175.88 1zes s ILE 103 N 2.53 1.99 0.15 3.14 1.01 0.70 -4.97 121.20 125.74 1zes s ILE 103 Ca 0.04 -0.98 -0.10 0.00 0.00 0.00 0.00 60.65 59.61 1zes s ILE 103 Cb -0.13 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.55 1zes s ILE 103 CO -0.12 0.54 0.48 0.42 0.00 0.00 0.00 174.94 176.26 1zes s THR 104 N 0.36 4.99 0.12 2.92 -4.23 -1.26 -1.68 115.64 116.86 1zes s THR 104 Ca -0.18 0.49 -0.13 0.00 -1.18 0.00 0.00 61.69 60.69 1zes s THR 104 Cb -0.18 -3.66 -0.06 0.00 1.34 0.00 0.00 72.50 69.94 1zes s THR 104 CO 0.09 0.13 0.49 -0.54 -0.54 0.00 0.00 174.62 174.25 1zes s LYS 105 N -2.30 3.90 0.42 3.99 1.02 0.08 -3.50 119.74 123.35 1zes s LYS 105 Ca 0.40 0.37 -0.23 0.00 0.02 0.00 0.00 55.97 56.53 1zes s LYS 105 Cb -0.13 -2.97 -0.09 0.00 -0.52 0.00 0.00 37.83 34.13 1zes s LYS 105 CO 0.20 0.52 1.07 -1.25 -0.92 0.00 0.00 175.35 174.97 1zes s PRO 106 N -1.91 4.04 0.30 -1.68 0.04 -1.26 -4.61 135.00 129.92 1zes s PRO 106 Ca 0.36 1.55 0.10 0.00 0.04 0.00 0.00 61.00 63.04 1zes s PRO 106 Cb -0.15 -2.46 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 1zes s PRO 106 CO 0.19 -0.26 -0.06 -0.59 0.04 0.00 0.00 177.00 176.32 1zes s PHE 107 N -1.67 2.50 -0.15 0.56 -0.12 -1.23 -5.12 117.98 112.76 1zes s PHE 107 Ca 0.60 -0.35 -0.26 0.00 -0.05 0.00 0.00 56.93 56.87 1zes s PHE 107 Cb -0.23 -1.24 -0.02 0.00 -0.63 0.00 0.00 43.02 40.90 1zes s PHE 107 CO 0.28 0.60 0.86 0.45 -0.05 0.00 0.00 175.22 177.36 1zes s SER 108 N -3.64 7.03 0.33 1.98 0.15 -1.26 -4.97 113.70 113.32 1zes s SER 108 Ca 0.32 1.26 0.11 0.00 0.70 0.00 0.00 55.95 58.34 1zes s SER 108 Cb -0.03 -2.48 0.58 0.00 -1.71 0.00 0.00 66.02 62.38 1zes s SER 108 CO 0.18 -0.39 1.75 1.55 1.20 0.00 0.00 173.24 177.53 1zes h PRO 109 N 7.23 0.05 -0.45 5.44 0.13 -1.99 0.15 132.00 142.56 1zes h PRO 109 Ca -0.31 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1zes h PRO 109 Cb 1.14 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 1zes h PRO 109 CO 0.84 0.48 0.26 0.87 -0.23 0.00 0.00 178.00 180.22 1zes h LYS 110 N 0.04 0.61 -0.21 0.86 1.57 -2.00 -2.09 116.57 115.35 1zes h LYS 110 Ca 0.00 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 1zes h LYS 110 Cb 0.79 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1zes h LYS 110 CO 0.06 0.46 -0.42 1.49 -0.57 0.00 0.00 179.45 180.48 1zes h GLU 111 N 0.59 0.50 -0.10 3.15 4.81 -1.84 -0.15 114.58 121.53 1zes h GLU 111 Ca 0.16 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1zes h GLU 111 Cb 0.02 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1zes h GLU 111 CO -0.03 0.83 0.05 1.25 -0.73 0.00 0.00 179.01 180.38 1zes h LEU 112 N 0.41 0.13 -0.27 1.64 5.85 -0.57 -0.14 115.31 122.36 1zes h LEU 112 Ca 0.03 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 1zes h LEU 112 Cb 0.90 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 1zes h LEU 112 CO 0.08 0.19 0.07 0.58 -0.34 0.00 0.00 178.44 179.01 1zes h VAL 113 N 0.06 1.21 -0.92 1.05 2.07 -1.23 -1.28 116.25 117.22 1zes h VAL 113 Ca 0.04 -0.69 0.15 0.00 0.82 0.00 0.00 66.70 67.01 1zes h VAL 113 Cb 0.09 1.15 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 1zes h VAL 113 CO -0.01 0.23 0.53 0.00 0.02 0.00 0.00 177.57 178.34 1zes h ALA 114 N 0.90 1.42 -0.19 1.67 0.00 -0.82 -1.40 119.26 120.84 1zes h ALA 114 Ca 0.09 0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 1zes h ALA 114 Cb 0.28 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1zes h ALA 114 CO 0.00 0.01 -0.70 0.00 0.00 0.00 0.00 179.25 178.56 1zes h ARG 115 N 0.76 0.76 -0.32 0.00 3.08 -0.73 -0.70 114.38 117.23 1zes h ARG 115 Ca 0.49 -0.57 0.05 0.00 0.07 0.00 0.00 59.98 60.02 1zes h ARG 115 Cb 0.65 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 1zes h ARG 115 CO -0.33 1.19 0.06 0.82 -1.07 0.00 0.00 179.97 180.64 1zes h ILE 116 N 0.54 0.84 -0.70 2.04 2.04 -0.93 -0.28 117.51 121.06 1zes h ILE 116 Ca -0.03 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1zes h ILE 116 Cb 1.31 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 1zes h ILE 116 CO 0.14 0.03 0.31 0.11 0.00 0.00 0.00 178.15 178.75 1zes h LYS 117 N 0.17 1.02 -0.05 2.37 1.57 -1.22 -0.27 116.57 120.16 1zes h LYS 117 Ca 0.15 -0.16 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1zes h LYS 117 Cb 0.17 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1zes h LYS 117 CO -0.20 0.82 -0.08 0.00 -0.57 0.00 0.00 179.45 179.41 1zes h ALA 118 N 1.15 -0.05 0.05 3.86 0.00 -0.76 0.18 119.26 123.70 1zes h ALA 118 Ca 0.24 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1zes h ALA 118 Cb 0.15 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1zes h ALA 118 CO -0.03 -0.56 -0.04 0.28 0.00 0.00 0.00 179.25 178.91 1zes h VAL 119 N -0.12 0.92 -0.09 0.00 2.07 -0.88 -2.82 116.25 115.32 1zes h VAL 119 Ca 0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 1zes h VAL 119 Cb 0.19 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1zes h VAL 119 CO -0.12 0.00 -0.12 0.24 0.02 0.00 0.00 177.57 177.59 1zes h MET 120 N -0.09 0.13 -0.81 1.57 2.07 -0.75 -2.06 114.93 114.98 1zes h MET 120 Ca -0.00 -0.02 0.24 0.00 -2.07 0.00 0.00 59.70 57.84 1zes h MET 120 Cb 0.08 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 29.76 1zes h MET 120 CO -0.00 0.26 0.66 -0.09 1.07 0.00 0.00 176.91 178.81 1zes h ARG 121 N 0.13 0.00 -0.02 1.72 2.43 -0.37 -3.51 114.38 114.75 1zes h ARG 121 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1zes h ARG 121 Cb 0.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1zes h ARG 121 CO 0.02 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.02