#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 4.10 -0.23 5.56 3.52 -1.26 -0.84 118.95 129.80 1zes s ARG 4 Ca 0.00 0.27 -0.02 0.00 -0.13 0.00 0.00 55.73 55.85 1zes s ARG 4 Cb 0.00 -3.62 0.01 0.00 -1.56 0.00 0.00 34.95 29.79 1zes s ARG 4 CO 0.00 -0.25 -0.08 0.42 -0.81 0.00 0.00 175.30 174.58 1zes s ILE 5 N 1.99 2.91 -0.37 4.11 -1.09 -0.32 0.04 121.20 128.47 1zes s ILE 5 Ca 0.20 -0.84 -0.28 0.00 -2.23 0.00 0.00 60.65 57.50 1zes s ILE 5 Cb -0.15 -2.40 0.02 0.00 -1.58 0.00 0.00 42.46 38.35 1zes s ILE 5 CO 0.09 0.32 1.05 -0.22 -1.23 0.00 0.00 174.94 174.95 1zes s LEU 6 N 1.37 3.88 -0.46 2.97 2.96 -0.22 -0.47 118.68 128.71 1zes s LEU 6 Ca 0.03 0.80 -0.15 0.00 -0.22 0.00 0.00 54.13 54.59 1zes s LEU 6 Cb -0.15 -3.47 0.07 0.00 0.50 0.00 0.00 46.19 43.13 1zes s LEU 6 CO -0.05 -0.96 0.37 -0.69 -1.32 0.00 0.00 176.35 173.70 1zes s VAL 7 N 3.78 5.12 -0.42 1.68 1.01 0.14 -0.36 120.40 131.35 1zes s VAL 7 Ca 0.44 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 1zes s VAL 7 Cb -0.11 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.30 1zes s VAL 7 CO 0.20 -0.54 0.28 -0.69 0.00 0.00 0.00 175.10 174.35 1zes s VAL 8 N 1.62 4.54 -0.29 2.92 1.01 0.10 -0.81 120.40 129.49 1zes s VAL 8 Ca 0.04 -1.21 -0.12 0.00 0.00 0.00 0.00 61.98 60.69 1zes s VAL 8 Cb -0.24 -3.71 0.12 0.00 0.00 0.00 0.00 36.38 32.55 1zes s VAL 8 CO 0.06 -0.47 0.69 -0.70 0.00 0.00 0.00 175.10 174.68 1zes s GLU 9 N 1.50 0.60 0.21 2.72 2.56 -0.77 -0.77 118.70 124.75 1zes s GLU 9 Ca 0.03 1.34 0.02 0.00 0.00 0.00 0.00 54.97 56.36 1zes s GLU 9 Cb -0.22 0.63 0.14 0.00 2.00 0.00 0.00 34.13 36.68 1zes s GLU 9 CO 0.04 -0.18 1.49 0.38 -0.56 0.00 0.00 175.26 176.43 1zes h ASP 10 N 7.64 0.32 -3.55 -1.70 2.03 -1.80 -3.39 116.42 115.98 1zes h ASP 10 Ca -0.22 -0.21 -0.57 0.00 -0.73 0.00 0.00 57.03 55.31 1zes h ASP 10 Cb 1.14 -0.10 -0.08 0.00 -0.83 0.00 0.00 39.33 39.46 1zes h ASP 10 CO 0.12 0.92 0.86 -1.61 -1.03 0.00 0.00 179.24 178.49 1zes s GLU 11 N -3.61 3.61 0.27 4.15 2.02 -1.26 -4.92 118.70 118.97 1zes s GLU 11 Ca -0.04 0.37 -0.01 0.00 0.02 0.00 0.00 54.97 55.31 1zes s GLU 11 Cb 0.11 -3.95 0.47 0.00 0.10 0.00 0.00 34.13 30.87 1zes s GLU 11 CO 0.82 -1.44 1.86 0.00 0.02 0.00 0.00 175.26 176.52 1zes h ALA 12 N 9.29 1.45 -0.08 5.21 0.00 -1.98 -1.12 119.26 132.04 1zes h ALA 12 Ca -0.24 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1zes h ALA 12 Cb 1.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1zes h ALA 12 CO 1.12 0.35 -0.12 -1.00 0.00 0.00 0.00 179.25 179.60 1zes h PRO 13 N 1.10 0.12 -0.01 0.00 0.13 -1.98 0.48 132.00 131.83 1zes h PRO 13 Ca 0.46 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.50 1zes h PRO 13 Cb 0.31 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.43 1zes h PRO 13 CO -0.22 0.24 -0.28 0.82 -0.23 0.00 0.00 178.00 178.34 1zes h ILE 14 N 0.12 1.51 -0.93 -3.56 2.04 -1.73 -3.16 117.51 111.79 1zes h ILE 14 Ca 0.02 -1.90 0.02 0.00 1.00 0.00 0.00 64.86 64.01 1zes h ILE 14 Cb 0.29 2.67 -0.05 0.00 -0.74 0.00 0.00 36.82 38.98 1zes h ILE 14 CO 0.02 0.53 0.61 -0.09 0.00 0.00 0.00 178.15 179.21 1zes h ARG 15 N -0.41 1.18 -0.12 2.37 2.43 -1.00 -0.43 114.38 118.39 1zes h ARG 15 Ca -0.03 -0.07 -0.22 0.00 -0.81 0.00 0.00 59.98 58.85 1zes h ARG 15 Cb 1.01 -0.27 0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1zes h ARG 15 CO 0.06 0.78 -0.79 0.93 -1.51 0.00 0.00 179.97 179.43 1zes h GLU 16 N 1.21 0.70 -0.74 0.20 5.08 -1.02 -0.36 114.58 119.65 1zes h GLU 16 Ca 0.36 -0.58 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 1zes h GLU 16 Cb -0.06 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1zes h GLU 16 CO -0.10 1.20 0.25 1.98 -1.00 0.00 0.00 179.01 181.34 1zes h MET 17 N 0.47 1.13 -0.58 2.33 4.05 -1.47 0.42 114.93 121.27 1zes h MET 17 Ca -0.05 -0.23 -0.03 0.00 -0.28 0.00 0.00 59.70 59.10 1zes h MET 17 Cb 1.41 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 32.02 1zes h MET 17 CO 0.16 0.95 0.24 0.28 0.23 0.00 0.00 176.91 178.77 1zes h VAL 18 N 1.08 1.22 -0.47 -5.77 2.07 -0.84 -1.43 116.25 112.13 1zes h VAL 18 Ca 0.24 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 67.08 1zes h VAL 18 Cb 0.28 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1zes h VAL 18 CO -0.01 0.27 0.29 0.00 0.02 0.00 0.00 177.57 178.14 1zes h PHE 20 N 0.59 -0.50 -0.98 0.00 3.57 -0.74 -0.20 116.94 118.69 1zes h PHE 20 Ca 0.18 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.83 1zes h PHE 20 Cb -0.03 0.23 -0.08 0.00 2.79 0.00 0.00 35.95 38.86 1zes h PHE 20 CO -0.06 -0.27 0.62 0.28 -2.23 0.00 0.00 178.31 176.65 1zes h VAL 21 N -0.27 0.88 -0.10 1.41 2.07 -0.93 0.13 116.25 119.44 1zes h VAL 21 Ca 0.08 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.21 1zes h VAL 21 Cb 0.38 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 1zes h VAL 21 CO -0.24 0.16 -0.26 -0.07 0.02 0.00 0.00 177.57 177.18 1zes h LEU 22 N 0.90 0.41 -1.04 2.57 3.38 -0.70 -2.22 115.31 118.60 1zes h LEU 22 Ca 0.49 -0.59 0.07 0.00 0.09 0.00 0.00 57.88 57.95 1zes h LEU 22 Cb 0.59 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1zes h LEU 22 CO -0.26 0.92 0.64 -0.33 0.09 0.00 0.00 178.44 179.50 1zes h GLU 23 N -0.09 1.09 -0.19 1.13 5.08 -0.59 -0.83 114.58 120.18 1zes h GLU 23 Ca -0.00 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1zes h GLU 23 Cb 0.87 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1zes h GLU 23 CO 0.06 0.72 0.13 1.96 -1.00 0.00 0.00 179.01 180.88 1zes h GLN 24 N 1.12 0.21 -0.59 2.33 4.20 -0.83 -2.65 115.11 118.89 1zes h GLN 24 Ca 0.43 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.13 1zes h GLN 24 Cb 0.22 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1zes h GLN 24 CO -0.18 0.14 0.00 0.09 -0.67 0.00 0.00 178.83 178.21 1zes n ASN 25 N -4.51 5.04 0.00 1.46 3.02 -0.59 -4.95 115.26 114.74 1zes n ASN 25 Ca 0.00 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.90 1zes n ASN 25 Cb 0.11 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 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 0.82 0.45 3.92 7.41 0.00 -1.00 -5.05 105.19 111.75 1zes n GLY 26 Ca 0.26 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.00 3.41 -0.55 1.61 0.08 -0.42 -4.36 117.98 115.75 1zes s PHE 27 Ca 0.00 0.05 -0.15 0.00 0.12 0.00 0.00 56.93 56.95 1zes s PHE 27 Cb 0.00 -1.61 0.14 0.00 -0.57 0.00 0.00 43.02 40.98 1zes s PHE 27 CO 0.00 0.50 0.50 -1.14 -0.10 0.00 0.00 175.22 174.98 1zes s GLN 28 N -3.43 2.98 0.47 0.44 2.00 -0.02 -3.78 119.66 118.32 1zes s GLN 28 Ca 0.34 -1.78 -0.20 0.00 -2.00 0.00 0.00 55.36 51.72 1zes s GLN 28 Cb -0.10 -4.26 -0.09 0.00 0.80 0.00 0.00 33.01 29.35 1zes s GLN 28 CO 0.28 -1.31 0.99 -1.25 -0.50 0.00 0.00 175.29 173.49 1zes s PRO 29 N 1.45 4.01 -0.01 1.67 0.04 -1.26 -1.18 135.00 139.72 1zes s PRO 29 Ca 0.05 1.17 0.02 0.00 0.04 0.00 0.00 61.00 62.28 1zes s PRO 29 Cb -0.28 -2.14 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 1zes s PRO 29 CO 0.02 -0.23 -0.07 0.08 0.04 0.00 0.00 177.00 176.84 1zes s VAL 30 N -2.20 0.61 -0.05 -0.36 1.01 0.38 -4.86 120.40 114.94 1zes s VAL 30 Ca 0.63 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 62.30 1zes s VAL 30 Cb -0.12 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1zes s VAL 30 CO 0.19 0.18 -0.01 -1.61 0.00 0.00 0.00 175.10 173.86 1zes s GLU 31 N -0.02 2.87 -0.04 2.72 2.02 -1.26 0.26 118.70 125.25 1zes s GLU 31 Ca 0.01 -0.52 0.01 0.00 0.02 0.00 0.00 54.97 54.49 1zes s GLU 31 Cb -0.05 -2.71 0.02 0.00 0.10 0.00 0.00 34.13 31.49 1zes s GLU 31 CO -0.00 0.66 -0.06 0.00 0.02 0.00 0.00 175.26 175.88 1zes s ALA 32 N -0.97 0.77 -1.99 5.21 0.00 0.01 -4.91 121.76 119.87 1zes s ALA 32 Ca 0.16 -0.13 0.23 0.00 0.00 0.00 0.00 51.96 52.22 1zes s ALA 32 Cb -0.11 -0.42 0.10 0.00 0.00 0.00 0.00 23.12 22.69 1zes s ALA 32 CO 0.06 0.03 1.16 -0.85 0.00 0.00 0.00 175.76 176.16 1zes n GLU 33 N 3.90 1.14 -3.49 0.00 0.28 -1.26 -1.84 120.64 119.37 1zes n GLU 33 Ca -0.24 -0.91 -0.07 0.00 -0.16 0.00 0.00 57.16 55.77 1zes n GLU 33 Cb 0.51 -1.48 0.03 0.00 1.43 0.00 0.00 31.44 31.93 1zes n GLU 33 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1zes n ASP 34 N -0.13 -1.98 0.13 -1.84 5.68 -1.26 -3.74 116.55 113.40 1zes n ASP 34 Ca 0.10 -2.33 -0.14 0.00 -0.50 0.00 0.00 54.79 51.92 1zes n ASP 34 Cb 0.45 3.29 -0.08 0.00 -1.14 0.00 0.00 41.12 43.64 1zes n ASP 34 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 1zes h TYR 35 N 1.88 -0.22 -0.18 2.11 3.20 -1.61 -2.03 116.97 120.12 1zes h TYR 35 Ca -0.29 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.48 1zes h TYR 35 Cb 1.10 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.43 1zes h TYR 35 CO 0.00 -0.12 -0.28 -0.44 -1.64 0.00 0.00 178.16 175.68 1zes h ASP 36 N -0.25 0.35 -0.86 -2.11 3.32 -1.88 -1.83 116.42 113.16 1zes h ASP 36 Ca -0.02 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1zes h ASP 36 Cb 0.19 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 1zes h ASP 36 CO 0.04 0.62 0.47 0.28 -1.72 0.00 0.00 179.24 178.93 1zes h SER 37 N 0.31 1.07 -0.25 6.45 0.02 -1.90 -1.01 113.55 118.24 1zes h SER 37 Ca 0.05 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1zes h SER 37 Cb 0.65 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1zes h SER 37 CO 0.05 0.86 0.06 0.00 -1.14 0.00 0.00 176.83 176.66 1zes h ALA 38 N 1.25 0.32 -0.63 3.77 0.00 -0.71 -2.97 119.26 120.29 1zes h ALA 38 Ca 0.30 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1zes h ALA 38 Cb 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 1zes h ALA 38 CO -0.05 -0.03 0.30 0.28 0.00 0.00 0.00 179.25 179.75 1zes h VAL 39 N 0.22 0.87 0.00 0.00 2.07 -1.23 -2.15 116.25 116.03 1zes h VAL 39 Ca 0.08 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1zes h VAL 39 Cb 0.27 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1zes h VAL 39 CO 0.00 0.10 0.00 0.78 0.02 0.00 0.00 177.57 178.47 1zes h ASN 40 N 0.54 0.00 -0.13 0.57 -0.26 -1.03 -1.44 115.58 113.82 1zes h ASN 40 Ca 0.30 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.04 1zes h ASN 40 Cb 0.29 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.55 1zes h ASN 40 CO -0.24 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.13 1zes n GLN 41 N -2.55 1.89 -1.97 0.81 1.13 -0.81 -4.57 117.38 111.31 1zes n GLN 41 Ca -0.02 -1.33 -0.42 0.00 -1.94 0.00 0.00 57.00 53.29 1zes n GLN 41 Cb 0.05 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 28.96 1zes n GLN 41 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1zes n LEU 42 N 0.57 6.53 -3.73 1.08 4.32 -0.54 -4.61 117.00 120.61 1zes n LEU 42 Ca 0.17 -4.20 -0.02 0.00 -0.02 0.00 0.00 56.01 51.94 1zes n LEU 42 Cb 0.41 -1.64 -0.01 0.00 -1.62 0.00 0.00 43.42 40.56 1zes n LEU 42 CO 0.15 1.01 0.79 0.54 -1.22 0.00 0.00 177.39 178.65 1zes s ASN 43 N 2.97 -0.15 0.33 -1.43 6.03 -1.26 -5.11 114.94 116.32 1zes s ASN 43 Ca 0.47 -0.36 -0.29 0.00 -1.03 0.00 0.00 52.86 51.65 1zes s ASN 43 Cb 0.11 0.43 -0.10 0.00 -3.03 0.00 0.00 41.25 38.66 1zes s ASN 43 CO -0.05 -0.79 1.28 -1.83 -2.03 0.00 0.00 177.10 173.68 1zes s GLU 44 N -3.11 4.37 0.03 3.55 -1.05 -1.26 -3.09 118.70 118.12 1zes s GLU 44 Ca 0.13 2.16 -0.30 0.00 -0.15 0.00 0.00 54.97 56.80 1zes s GLU 44 Cb -0.00 -3.06 -0.07 0.00 -0.44 0.00 0.00 34.13 30.56 1zes s GLU 44 CO 0.01 -0.16 1.56 -2.14 0.95 0.00 0.00 175.26 175.49 1zes s PRO 45 N -1.79 4.22 0.37 -4.83 0.02 -1.26 -5.12 135.00 126.63 1zes s PRO 45 Ca 0.49 2.18 -0.26 0.00 0.02 0.00 0.00 61.00 63.43 1zes s PRO 45 Cb -0.39 -3.64 -0.09 0.00 0.02 0.00 0.00 34.50 30.40 1zes s PRO 45 CO 0.51 -0.69 1.20 -1.58 -0.33 0.00 0.00 177.00 176.10 1zes s TRP 46 N 2.74 3.10 0.46 6.54 0.52 -1.18 -4.99 118.94 126.14 1zes s TRP 46 Ca 0.70 1.54 -0.24 0.00 0.02 0.00 0.00 56.10 58.12 1zes s TRP 46 Cb -0.36 -3.45 -0.07 0.00 -1.15 0.00 0.00 33.47 28.44 1zes s TRP 46 CO 0.30 -1.39 1.33 -1.25 0.02 0.00 0.00 176.95 175.96 1zes s PRO 47 N -2.11 3.64 0.25 4.98 0.04 -1.26 -4.83 135.00 135.71 1zes s PRO 47 Ca 0.54 2.19 0.18 0.00 0.04 0.00 0.00 61.00 63.95 1zes s PRO 47 Cb -0.33 -2.54 0.06 0.00 0.04 0.00 0.00 34.50 31.73 1zes s PRO 47 CO 0.42 -0.78 1.30 -0.44 0.04 0.00 0.00 177.00 177.55 1zes h ASP 48 N 2.16 0.00 -4.93 6.66 3.32 -0.77 -3.47 116.42 119.39 1zes h ASP 48 Ca -0.50 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.50 1zes h ASP 48 Cb 1.27 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.63 1zes h ASP 48 CO 0.60 0.37 0.22 -0.22 -1.72 0.00 0.00 179.24 178.50 1zes s LEU 49 N -6.15 -0.63 -0.20 1.55 0.20 -1.14 -4.28 118.68 108.02 1zes s LEU 49 Ca 0.03 0.65 -0.00 0.00 0.69 0.00 0.00 54.13 55.49 1zes s LEU 49 Cb 0.08 2.49 0.02 0.00 -0.43 0.00 0.00 46.19 48.34 1zes s LEU 49 CO 0.75 -0.61 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.43 1zes s ILE 50 N -1.35 2.45 -0.23 6.68 1.01 -0.04 -1.06 121.20 128.66 1zes s ILE 50 Ca -0.09 -0.91 -0.19 0.00 0.00 0.00 0.00 60.65 59.45 1zes s ILE 50 Cb -0.00 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 1zes s ILE 50 CO 0.08 0.43 0.56 -0.22 0.00 0.00 0.00 174.94 175.79 1zes s LEU 51 N 1.32 4.10 -0.23 2.97 2.96 0.51 0.08 118.68 130.40 1zes s LEU 51 Ca 0.03 0.67 -0.01 0.00 -0.22 0.00 0.00 54.13 54.60 1zes s LEU 51 Cb -0.14 -2.76 0.07 0.00 0.50 0.00 0.00 46.19 43.85 1zes s LEU 51 CO -0.09 -0.27 0.02 -0.22 -1.32 0.00 0.00 176.35 174.46 1zes s LEU 52 N 2.09 1.79 0.71 -0.68 2.96 0.64 -0.72 118.68 125.48 1zes s LEU 52 Ca 0.25 -1.07 -0.14 0.00 -0.22 0.00 0.00 54.13 52.94 1zes s LEU 52 Cb -0.16 -0.82 0.03 0.00 0.50 0.00 0.00 46.19 45.74 1zes s LEU 52 CO 0.09 -0.30 1.14 -0.62 -1.32 0.00 0.00 176.35 175.34 1zes s ASP 53 N 1.67 4.62 -0.13 3.68 2.15 0.05 -1.32 116.67 127.40 1zes s ASP 53 Ca -0.01 2.10 -0.08 0.00 0.43 0.00 0.00 52.55 55.00 1zes s ASP 53 Cb -0.18 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 39.86 1zes s ASP 53 CO -0.10 -1.96 -0.15 -0.25 -0.17 0.00 0.00 175.17 172.54 1zes h TRP 54 N -0.32 0.00 -3.58 -5.34 2.91 -1.89 -3.32 115.95 104.41 1zes h TRP 54 Ca -0.46 0.00 -0.60 0.00 1.13 0.00 0.00 58.89 58.96 1zes h TRP 54 Cb 1.26 0.00 -0.10 0.00 -0.51 0.00 0.00 29.16 29.81 1zes h TRP 54 CO 0.52 0.00 0.63 -1.64 -1.03 0.00 0.00 178.44 176.92 1zes s MET 55 N -2.10 3.51 0.07 2.65 1.00 -1.26 -0.74 119.30 122.44 1zes s MET 55 Ca -0.12 0.13 0.04 0.00 0.00 0.00 0.00 55.69 55.74 1zes s MET 55 Cb 0.02 -3.95 -0.03 0.00 0.00 0.00 0.00 34.83 30.87 1zes s MET 55 CO 0.18 -1.30 -0.11 -0.51 0.00 0.00 0.00 175.02 173.28 1zes s LEU 56 N 3.90 2.32 0.26 -0.03 1.43 -1.26 -4.73 118.68 120.57 1zes s LEU 56 Ca 0.37 -0.67 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 1zes s LEU 56 Cb -0.10 -0.33 -0.10 0.00 0.03 0.00 0.00 46.19 45.69 1zes s LEU 56 CO 0.26 -0.19 1.42 -2.84 0.23 0.00 0.00 176.35 175.23 1zes s PRO 57 N -2.08 4.28 0.00 1.29 0.02 -1.26 -3.37 135.00 133.87 1zes s PRO 57 Ca -0.02 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.29 1zes s PRO 57 Cb -0.07 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.34 1zes s PRO 57 CO 0.01 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 1zes n GLY 58 N 2.02 1.23 0.00 0.52 0.00 -1.26 -1.90 105.19 105.80 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 3.89 3.94 -0.02 0.00 -1.22 -4.82 105.19 104.96 1zes n GLY 59 Ca 0.00 -1.04 -0.25 0.00 0.00 0.00 0.00 46.02 44.73 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 5.33 0.37 1.61 1.04 -1.26 -4.11 113.70 116.69 1zes s SER 60 Ca 0.00 0.44 0.12 0.00 0.48 0.00 0.00 55.95 56.98 1zes s SER 60 Cb 0.00 -1.34 0.73 0.00 0.10 0.00 0.00 66.02 65.51 1zes s SER 60 CO 0.00 -1.19 1.85 1.23 0.98 0.00 0.00 173.24 176.11 1zes h GLY 61 N -0.17 0.08 0.79 7.32 0.00 -1.04 -0.14 103.07 109.90 1zes h GLY 61 Ca -0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 1zes h GLY 61 CO 0.58 0.05 -0.00 -2.22 0.00 0.00 0.00 176.54 174.96 1zes h ILE 62 N 0.06 1.16 -0.44 2.60 1.08 -1.87 -1.18 117.51 118.92 1zes h ILE 62 Ca 0.01 -0.48 -0.02 0.00 -0.39 0.00 0.00 64.86 63.97 1zes h ILE 62 Cb 0.59 1.49 -0.02 0.00 -3.07 0.00 0.00 36.82 35.80 1zes h ILE 62 CO 0.04 0.13 0.19 1.56 -0.69 0.00 0.00 178.15 179.38 1zes h GLN 63 N -0.21 0.62 -0.86 2.37 4.20 -1.80 -2.63 115.11 116.80 1zes h GLN 63 Ca -0.00 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.66 1zes h GLN 63 Cb 0.21 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 1zes h GLN 63 CO 0.00 0.51 0.56 0.35 -0.67 0.00 0.00 178.83 179.58 1zes h PHE 64 N 0.62 1.06 -0.62 2.96 3.57 -0.50 -1.38 116.94 122.66 1zes h PHE 64 Ca 0.15 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 1zes h PHE 64 Cb 0.11 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.47 1zes h PHE 64 CO 0.01 0.63 0.13 0.82 -2.23 0.00 0.00 178.31 177.66 1zes h ILE 65 N 1.11 1.25 -0.49 1.41 2.04 -0.86 -0.84 117.51 121.13 1zes h ILE 65 Ca 0.33 -0.94 -0.09 0.00 1.00 0.00 0.00 64.86 65.17 1zes h ILE 65 Cb -0.04 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1zes h ILE 65 CO -0.10 0.35 -0.05 0.11 0.00 0.00 0.00 178.15 178.47 1zes h LYS 66 N 0.93 0.90 -0.44 2.37 1.57 -1.30 -0.68 116.57 119.92 1zes h LYS 66 Ca 0.19 -0.31 0.09 0.00 -1.87 0.00 0.00 60.65 58.75 1zes h LYS 66 Cb 0.37 -0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.53 1zes h LYS 66 CO 0.00 0.95 -0.10 1.25 -0.57 0.00 0.00 179.45 180.99 1zes h HIS 67 N 0.75 -0.22 -0.81 -1.35 2.76 -0.93 -2.39 115.15 112.96 1zes h HIS 67 Ca 0.13 0.04 0.03 0.00 -2.20 0.00 0.00 60.37 58.37 1zes h HIS 67 Cb 0.58 0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.66 1zes h HIS 67 CO 0.04 -0.18 0.53 -0.07 -1.30 0.00 0.00 177.93 176.96 1zes h LEU 68 N 0.01 0.88 0.00 0.26 3.38 -0.31 -2.44 115.31 117.08 1zes h LEU 68 Ca 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1zes h LEU 68 Cb 0.32 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1zes h LEU 68 CO -0.44 0.61 0.00 0.29 0.09 0.00 0.00 178.44 178.99 1zes n LYS 69 N -4.44 0.13 0.16 1.13 5.02 -0.34 -2.02 118.16 117.80 1zes n LYS 69 Ca 0.10 0.09 0.13 0.00 -2.02 0.00 0.00 58.31 56.61 1zes n LYS 69 Cb 0.09 -1.50 0.42 0.00 -0.02 0.00 0.00 35.03 34.02 1zes n LYS 69 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1zes h ARG 70 N 0.00 0.00 -5.01 1.97 2.47 -1.23 -3.46 114.38 109.12 1zes h ARG 70 Ca 0.00 0.00 -0.39 0.00 -1.26 0.00 0.00 59.98 58.33 1zes h ARG 70 Cb 0.33 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 28.40 1zes h ARG 70 CO 0.00 0.00 -0.78 -1.21 0.56 0.00 0.00 179.97 178.54 1zes s GLU 71 N -3.27 0.78 0.15 0.04 8.01 -1.19 -5.05 118.70 118.16 1zes s GLU 71 Ca 0.07 -0.67 -0.25 0.00 0.01 0.00 0.00 54.97 54.13 1zes s GLU 71 Cb 0.09 -0.73 0.00 0.00 -4.31 0.00 0.00 34.13 29.19 1zes s GLU 71 CO 0.55 0.18 1.61 0.77 0.01 0.00 0.00 175.26 178.38 1zes h SER 72 N 5.02 -0.99 -0.83 -0.19 0.02 -1.89 0.17 113.55 114.86 1zes h SER 72 Ca -0.36 0.16 0.08 0.00 -0.84 0.00 0.00 61.79 60.83 1zes h SER 72 Cb 1.19 0.44 -0.06 0.00 0.14 0.00 0.00 62.40 64.11 1zes h SER 72 CO 0.44 -0.34 0.54 0.24 -1.14 0.00 0.00 176.83 176.57 1zes h MET 73 N -0.34 0.80 0.00 3.45 2.86 -1.97 -3.07 114.93 116.67 1zes h MET 73 Ca 0.12 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1zes h MET 73 Cb 0.53 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1zes h MET 73 CO -0.40 0.53 -2.02 0.25 1.06 0.00 0.00 176.91 176.33 1zes n THR 74 N -4.50 0.42 0.41 2.22 -2.24 -1.02 -4.27 114.28 105.30 1zes n THR 74 Ca 0.13 -0.60 0.09 0.00 -2.27 0.00 0.00 64.05 61.40 1zes n THR 74 Cb 0.28 -0.16 0.38 0.00 -2.10 0.00 0.00 70.33 68.73 1zes n THR 74 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1zes n ARG 75 N -2.43 0.09 0.09 -0.78 1.85 0.57 -2.06 116.66 113.98 1zes n ARG 75 Ca -0.11 0.36 0.12 0.00 -1.00 0.00 0.00 57.85 57.21 1zes n ARG 75 Cb 0.72 -1.68 0.12 0.00 -1.05 0.00 0.00 32.46 30.58 1zes n ARG 75 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1zes h ASP 76 N 0.00 0.00 -3.03 2.89 5.19 -1.74 -3.47 116.42 116.26 1zes h ASP 76 Ca 0.00 -0.13 -0.57 0.00 -0.62 0.00 0.00 57.03 55.71 1zes h ASP 76 Cb 0.27 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.73 1zes h ASP 76 CO 0.00 0.07 0.82 -0.63 -3.12 0.00 0.00 179.24 176.37 1zes s ILE 77 N -3.23 4.54 0.60 0.35 1.01 -0.87 -4.99 121.20 118.61 1zes s ILE 77 Ca 0.04 1.86 -0.18 0.00 0.00 0.00 0.00 60.65 62.37 1zes s ILE 77 Cb 0.12 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 1zes s ILE 77 CO 0.74 -0.15 1.18 -2.16 0.00 0.00 0.00 174.94 174.55 1zes s PRO 78 N 3.19 2.95 -0.08 2.79 0.04 -1.26 -4.85 135.00 137.78 1zes s PRO 78 Ca 0.48 1.73 0.02 0.00 0.04 0.00 0.00 61.00 63.27 1zes s PRO 78 Cb -0.18 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.44 1zes s PRO 78 CO 0.10 -1.20 -0.13 0.08 0.04 0.00 0.00 177.00 175.90 1zes s VAL 79 N -1.75 1.22 -0.23 -0.36 1.01 -1.26 -0.86 120.40 118.18 1zes s VAL 79 Ca 0.75 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.22 1zes s VAL 79 Cb -0.28 -1.13 0.03 0.00 0.00 0.00 0.00 36.38 35.01 1zes s VAL 79 CO 0.34 0.38 -0.12 -0.69 0.00 0.00 0.00 175.10 175.01 1zes s VAL 80 N 0.83 2.50 0.30 2.92 1.01 0.11 -0.79 120.40 127.27 1zes s VAL 80 Ca -0.11 -1.09 -0.28 0.00 0.00 0.00 0.00 61.98 60.50 1zes s VAL 80 Cb -0.15 -2.23 -0.09 0.00 0.00 0.00 0.00 36.38 33.90 1zes s VAL 80 CO 0.02 0.28 1.03 -0.04 0.00 0.00 0.00 175.10 176.39 1zes s MET 81 N 1.28 4.60 -0.28 2.72 -1.94 -0.64 -0.26 119.30 124.78 1zes s MET 81 Ca 0.00 1.62 -0.02 0.00 -1.71 0.00 0.00 55.69 55.58 1zes s MET 81 Cb -0.16 -3.05 0.12 0.00 2.01 0.00 0.00 34.83 33.75 1zes s MET 81 CO -0.07 0.23 0.22 -1.17 -0.01 0.00 0.00 175.02 174.22 1zes s LEU 82 N -1.66 0.08 -0.05 -0.03 2.96 -0.43 0.29 118.68 119.83 1zes s LEU 82 Ca 0.47 -0.91 -0.12 0.00 -0.22 0.00 0.00 54.13 53.35 1zes s LEU 82 Cb -0.27 0.15 0.02 0.00 0.50 0.00 0.00 46.19 46.59 1zes s LEU 82 CO 0.34 -0.40 0.28 0.28 -1.32 0.00 0.00 176.35 175.53 1zes s THR 83 N 2.25 0.04 -0.87 3.68 -1.32 -0.55 -3.70 115.64 115.17 1zes s THR 83 Ca 0.09 -0.30 0.11 0.00 -1.21 0.00 0.00 61.69 60.38 1zes s THR 83 Cb -0.15 -0.50 0.10 0.00 -1.51 0.00 0.00 72.50 70.44 1zes s THR 83 CO -0.32 -0.16 1.36 0.00 -2.21 0.00 0.00 174.62 173.28 1zes n ALA 84 N 2.02 1.39 -2.59 11.08 0.00 -1.26 -1.01 120.51 130.13 1zes n ALA 84 Ca -0.18 0.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 1zes n ALA 84 Cb 0.57 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 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 -3.09 3.68 0.00 0.00 0.52 -1.26 -4.78 118.95 114.02 1zes s ARG 85 Ca 0.04 0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.70 1zes s ARG 85 Cb 0.06 -3.90 0.00 0.00 0.52 0.00 0.00 34.95 31.63 1zes s ARG 85 CO 0.19 -1.28 0.45 0.41 0.02 0.00 0.00 175.30 175.08 1zes n GLY 86 N 4.80 -0.87 3.74 -3.53 0.00 -1.26 -4.66 105.19 103.41 1zes n GLY 86 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.05 2.49 0.21 1.61 0.41 -1.26 -4.79 118.70 117.31 1zes s GLU 87 Ca 0.00 1.75 -0.17 0.00 -0.41 0.00 0.00 54.97 56.13 1zes s GLU 87 Cb 0.00 -1.88 0.19 0.00 -1.78 0.00 0.00 34.13 30.67 1zes s GLU 87 CO 0.00 -1.56 1.59 1.49 -0.49 0.00 0.00 175.26 176.29 1zes h GLU 88 N 0.14 -0.09 -0.12 1.61 4.81 -2.00 -1.03 114.58 117.90 1zes h GLU 88 Ca -0.49 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.71 1zes h GLU 88 Cb 1.29 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 1zes h GLU 88 CO 0.52 -0.06 -0.10 1.05 -0.73 0.00 0.00 179.01 179.69 1zes h GLU 89 N -0.09 0.17 0.30 1.92 9.09 -1.99 -2.13 114.58 121.85 1zes h GLU 89 Ca 0.28 -0.03 -0.01 0.00 0.05 0.00 0.00 59.36 59.65 1zes h GLU 89 Cb 0.55 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.63 1zes h GLU 89 CO -0.73 0.28 -0.14 -0.44 0.05 0.00 0.00 179.01 178.02 1zes h ASP 90 N 0.17 -0.34 -0.41 3.06 3.32 -1.56 -0.76 116.42 119.89 1zes h ASP 90 Ca 0.04 -0.15 0.07 0.00 0.02 0.00 0.00 57.03 57.00 1zes h ASP 90 Cb 0.28 0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.86 1zes h ASP 90 CO 0.02 -0.02 0.04 0.03 -1.72 0.00 0.00 179.24 177.58 1zes h ARG 91 N -0.69 0.15 -0.64 3.56 3.08 -1.11 -0.72 114.38 118.01 1zes h ARG 91 Ca -0.04 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1zes h ARG 91 Cb 0.48 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1zes h ARG 91 CO 0.07 0.10 0.25 0.28 -1.07 0.00 0.00 179.97 179.59 1zes h VAL 92 N 0.15 1.24 -0.62 2.04 2.07 -1.42 -2.32 116.25 117.39 1zes h VAL 92 Ca 0.20 -0.76 -0.10 0.00 0.82 0.00 0.00 66.70 66.86 1zes h VAL 92 Cb 0.27 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1zes h VAL 92 CO -0.30 0.30 0.01 -0.09 0.02 0.00 0.00 177.57 177.51 1zes h ARG 93 N 0.91 1.08 0.20 1.57 2.43 -0.52 0.11 114.38 120.16 1zes h ARG 93 Ca 0.21 -0.34 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1zes h ARG 93 Cb 0.22 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1zes h ARG 93 CO -0.02 1.05 -0.10 0.78 -1.51 0.00 0.00 179.97 180.18 1zes h GLY 94 N 1.00 -0.28 0.99 2.80 0.00 -1.03 -0.38 103.07 106.16 1zes h GLY 94 Ca 0.18 0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 1zes h GLY 94 CO 0.03 -0.10 0.26 1.41 0.00 0.00 0.00 176.54 178.14 1zes h LEU 95 N -0.32 0.51 -1.03 3.11 3.38 -1.34 -2.08 115.31 117.53 1zes h LEU 95 Ca -0.03 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1zes h LEU 95 Cb 0.25 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1zes h LEU 95 CO 0.05 0.40 0.26 -0.08 0.09 0.00 0.00 178.44 179.16 1zes h GLU 96 N 0.57 0.95 0.00 1.13 4.57 -0.70 -2.15 114.58 118.95 1zes h GLU 96 Ca 0.15 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1zes h GLU 96 Cb -0.02 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1zes h GLU 96 CO -0.03 0.78 -0.17 1.15 -1.18 0.00 0.00 179.01 179.55 1zes h THR 97 N 0.94 0.86 0.00 0.32 2.02 -1.01 -3.46 112.91 112.57 1zes h THR 97 Ca 0.22 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.74 1zes h THR 97 Cb 0.18 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1zes h THR 97 CO -0.02 0.17 0.00 0.61 0.37 0.00 0.00 175.52 176.65 1zes n GLY 98 N -0.78 -0.98 3.77 2.16 0.00 -0.81 -4.75 105.19 103.80 1zes n GLY 98 Ca -0.02 0.00 -0.39 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 0.00 3.22 0.12 4.61 0.00 -0.80 -4.76 121.76 124.15 1zes s ALA 99 Ca 0.00 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.28 1zes s ALA 99 Cb 0.00 -3.50 -0.21 0.00 0.00 0.00 0.00 23.12 19.42 1zes s ALA 99 CO 0.00 -0.88 1.27 -0.44 0.00 0.00 0.00 175.76 175.71 1zes h ASP 100 N 2.55 0.00 -5.20 0.00 3.32 -1.29 -3.41 116.42 112.38 1zes h ASP 100 Ca -0.50 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.51 1zes h ASP 100 Cb 1.25 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.72 1zes h ASP 100 CO 0.62 1.00 -0.04 -0.62 -1.72 0.00 0.00 179.24 178.48 1zes s ASP 101 N -6.70 -0.06 -0.24 6.45 -1.08 -1.17 -5.04 116.67 108.84 1zes s ASP 101 Ca 0.01 -0.91 -0.05 0.00 -0.52 0.00 0.00 52.55 51.08 1zes s ASP 101 Cb 0.10 0.63 0.13 0.00 -1.46 0.00 0.00 42.92 42.32 1zes s ASP 101 CO 0.82 -1.22 0.46 -0.47 0.52 0.00 0.00 175.17 175.28 1zes s TYR 102 N -3.86 -1.00 -0.08 -5.34 6.14 -1.26 -1.62 117.35 110.33 1zes s TYR 102 Ca 0.20 1.42 0.04 0.00 0.64 0.00 0.00 57.07 59.38 1zes s TYR 102 Cb -0.02 0.31 -0.01 0.00 0.42 0.00 0.00 41.96 42.66 1zes s TYR 102 CO 0.09 -0.65 -0.22 0.42 0.64 0.00 0.00 175.55 175.84 1zes s ILE 103 N 2.66 2.28 0.16 3.14 1.01 0.14 -4.95 121.20 125.65 1zes s ILE 103 Ca 0.06 -0.96 -0.08 0.00 0.00 0.00 0.00 60.65 59.67 1zes s ILE 103 Cb -0.14 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.40 1zes s ILE 103 CO -0.16 0.56 0.45 0.42 0.00 0.00 0.00 174.94 176.21 1zes s THR 104 N 0.05 5.05 0.01 2.92 -4.23 -1.26 -1.48 115.64 116.70 1zes s THR 104 Ca -0.09 0.32 -0.16 0.00 -1.18 0.00 0.00 61.69 60.58 1zes s THR 104 Cb -0.15 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 70.00 1zes s THR 104 CO 0.06 0.07 0.45 -0.54 -0.54 0.00 0.00 174.62 174.11 1zes s LYS 105 N -2.50 4.01 0.53 3.99 1.02 -0.18 -3.78 119.74 122.83 1zes s LYS 105 Ca 0.41 0.48 -0.17 0.00 0.02 0.00 0.00 55.97 56.71 1zes s LYS 105 Cb -0.12 -3.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.88 1zes s LYS 105 CO 0.22 0.64 1.01 -1.25 -0.92 0.00 0.00 175.35 175.05 1zes s PRO 106 N -0.96 3.76 0.11 -1.68 0.04 -1.26 -4.71 135.00 130.30 1zes s PRO 106 Ca 0.25 1.10 0.05 0.00 0.04 0.00 0.00 61.00 62.44 1zes s PRO 106 Cb -0.17 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 1zes s PRO 106 CO 0.14 -0.44 -0.13 -0.59 0.04 0.00 0.00 177.00 176.02 1zes s PHE 107 N -2.45 1.33 -0.09 0.56 -0.71 -1.25 -5.12 117.98 110.24 1zes s PHE 107 Ca 0.62 -0.57 -0.30 0.00 -1.04 0.00 0.00 56.93 55.64 1zes s PHE 107 Cb -0.12 -0.70 -0.02 0.00 -1.21 0.00 0.00 43.02 40.96 1zes s PHE 107 CO 0.30 0.11 1.15 0.45 -1.34 0.00 0.00 175.22 175.90 1zes s SER 108 N -2.42 7.09 0.36 1.98 0.15 -1.26 -4.95 113.70 114.65 1zes s SER 108 Ca 0.08 1.70 0.14 0.00 0.70 0.00 0.00 55.95 58.57 1zes s SER 108 Cb -0.05 -2.55 0.70 0.00 -1.71 0.00 0.00 66.02 62.40 1zes s SER 108 CO 0.02 -0.58 1.79 1.55 1.20 0.00 0.00 173.24 177.23 1zes h PRO 109 N 7.47 0.00 -0.55 5.44 0.13 -2.00 0.38 132.00 142.87 1zes h PRO 109 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1zes h PRO 109 Cb 1.14 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 1zes h PRO 109 CO 0.89 0.40 0.35 0.87 -0.23 0.00 0.00 178.00 180.28 1zes h LYS 110 N 0.00 0.74 -0.26 0.86 6.56 -1.99 -1.10 116.57 121.38 1zes h LYS 110 Ca -0.00 -0.06 -0.15 0.00 -1.06 0.00 0.00 60.65 59.38 1zes h LYS 110 Cb 0.74 -0.16 -0.01 0.00 -0.57 0.00 0.00 32.23 32.24 1zes h LYS 110 CO 0.05 0.51 -0.46 1.49 -2.06 0.00 0.00 179.45 178.99 1zes h GLU 111 N 0.75 0.67 -0.29 3.15 4.81 -1.86 -0.97 114.58 120.85 1zes h GLU 111 Ca 0.20 -0.38 0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1zes h GLU 111 Cb -0.05 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.30 1zes h GLU 111 CO -0.04 0.99 -0.09 1.25 -0.73 0.00 0.00 179.01 180.39 1zes h LEU 112 N 0.54 -0.31 -0.92 1.64 5.85 -0.86 -0.26 115.31 120.99 1zes h LEU 112 Ca 0.03 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1zes h LEU 112 Cb 1.00 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1zes h LEU 112 CO 0.09 -0.11 0.22 0.58 -0.34 0.00 0.00 178.44 178.88 1zes h VAL 113 N -0.02 1.24 -0.37 1.05 2.07 -1.02 -2.14 116.25 117.06 1zes h VAL 113 Ca 0.14 -0.82 -0.10 0.00 0.82 0.00 0.00 66.70 66.74 1zes h VAL 113 Cb 0.24 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1zes h VAL 113 CO -0.31 0.32 -0.15 0.00 0.02 0.00 0.00 177.57 177.46 1zes h ALA 114 N 1.26 0.52 -0.60 1.67 0.00 -0.82 -1.93 119.26 119.36 1zes h ALA 114 Ca 0.22 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1zes h ALA 114 Cb 0.26 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1zes h ALA 114 CO -0.01 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1zes h ARG 115 N 0.55 1.05 -0.04 0.00 3.08 -0.95 -0.92 114.38 117.15 1zes h ARG 115 Ca 0.09 -0.33 0.03 0.00 0.07 0.00 0.00 59.98 59.84 1zes h ARG 115 Cb 0.68 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 1zes h ARG 115 CO 0.05 1.02 -0.14 0.82 -1.07 0.00 0.00 179.97 180.65 1zes h ILE 116 N 0.96 0.65 -0.65 2.04 2.04 -1.24 -0.76 117.51 120.56 1zes h ILE 116 Ca 0.17 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.05 1zes h ILE 116 Cb 0.55 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1zes h ILE 116 CO 0.03 0.00 0.42 0.11 0.00 0.00 0.00 178.15 178.71 1zes h LYS 117 N -0.21 0.81 -0.26 2.37 1.57 -1.26 -1.64 116.57 117.94 1zes h LYS 117 Ca 0.06 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1zes h LYS 117 Cb 0.29 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 1zes h LYS 117 CO -0.16 0.53 -0.13 0.00 -0.57 0.00 0.00 179.45 179.12 1zes h ALA 118 N 1.26 0.08 -0.47 3.86 0.00 -0.80 0.16 119.26 123.35 1zes h ALA 118 Ca 0.25 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 1zes h ALA 118 Cb -0.04 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1zes h ALA 118 CO -0.08 -0.54 0.11 0.28 0.00 0.00 0.00 179.25 179.02 1zes h VAL 119 N -0.10 1.24 -0.42 0.00 2.07 -0.95 -3.11 116.25 114.99 1zes h VAL 119 Ca 0.14 -0.84 -0.09 0.00 0.82 0.00 0.00 66.70 66.73 1zes h VAL 119 Cb 0.31 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1zes h VAL 119 CO -0.33 0.30 -0.09 0.24 0.02 0.00 0.00 177.57 177.71 1zes h MET 120 N 0.63 0.74 -0.67 1.57 2.07 -1.02 -2.20 114.93 116.04 1zes h MET 120 Ca 0.15 -0.23 0.15 0.00 -2.07 0.00 0.00 59.70 57.69 1zes h MET 120 Cb 0.34 -0.07 -0.04 0.00 -1.87 0.00 0.00 31.60 29.96 1zes h MET 120 CO 0.00 0.81 0.46 -0.09 1.07 0.00 0.00 176.91 179.16 1zes h ARG 121 N 0.67 0.26 -0.00 1.72 2.43 -0.62 -3.51 114.38 115.32 1zes h ARG 121 Ca 0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1zes h ARG 121 Cb 0.55 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1zes h ARG 121 CO 0.03 0.17 0.00 -2.13 -1.51 0.00 0.00 179.97 176.53