#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d93 s SER 2 N 0.00 6.12 -0.62 1.61 0.01 -1.26 -5.02 113.70 114.55 2d93 s SER 2 Ca 0.00 -1.22 -0.04 0.00 1.31 0.00 0.00 55.95 55.99 2d93 s SER 2 Cb 0.00 -2.17 0.16 0.00 0.21 0.00 0.00 66.02 64.22 2d93 s SER 2 CO 0.00 -0.59 0.45 -0.55 0.41 0.00 0.00 173.24 172.95 2d93 s SER 3 N 2.35 5.44 0.00 2.44 0.15 -1.26 -5.00 113.70 117.83 2d93 s SER 3 Ca 0.04 -2.70 0.00 0.00 0.70 0.00 0.00 55.95 53.99 2d93 s SER 3 Cb -0.23 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2d93 s SER 3 CO 0.07 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.69 2d93 n GLY 4 N 3.74 3.11 3.28 9.45 0.00 -1.26 -5.14 105.19 118.36 2d93 n GLY 4 Ca 0.06 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 2d93 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d93 s SER 5 N 0.00 0.13 0.05 1.61 1.04 -1.26 -5.18 113.70 110.09 2d93 s SER 5 Ca 0.00 -1.14 -0.25 0.00 0.48 0.00 0.00 55.95 55.04 2d93 s SER 5 Cb 0.00 0.40 0.06 0.00 0.10 0.00 0.00 66.02 66.58 2d93 s SER 5 CO 0.00 -0.87 0.58 -0.44 0.98 0.00 0.00 173.24 173.49 2d93 s SER 6 N -3.06 -0.52 0.00 7.02 0.01 -1.26 -5.15 113.70 110.74 2d93 s SER 6 Ca 0.27 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.79 2d93 s SER 6 Cb 0.05 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.81 2d93 s SER 6 CO 0.06 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 173.56 2d93 n GLY 7 N 0.32 0.86 0.25 3.44 0.00 -1.26 -4.96 105.19 103.84 2d93 n GLY 7 Ca -0.18 0.55 0.01 0.00 0.00 0.00 0.00 46.02 46.39 2d93 n GLY 7 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2d93 h ASP 8 N 0.00 -0.54 -1.83 1.61 1.82 -2.06 -0.60 116.42 114.82 2d93 h ASP 8 Ca 0.00 0.19 -0.74 0.00 -0.39 0.00 0.00 57.03 56.10 2d93 h ASP 8 Cb 0.00 0.39 -0.29 0.00 0.68 0.00 0.00 39.33 40.10 2d93 h ASP 8 CO 0.00 -0.20 0.79 -0.90 -1.61 0.00 0.00 179.24 177.32 2d93 n ASP 9 N -5.41 7.15 0.18 2.28 5.75 -1.26 -4.70 116.55 120.54 2d93 n ASP 9 Ca 0.09 -3.82 0.09 0.00 -0.01 0.00 0.00 54.79 51.14 2d93 n ASP 9 Cb 0.36 -0.97 0.61 0.00 -1.03 0.00 0.00 41.12 40.09 2d93 n ASP 9 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 2d93 h ASP 10 N 2.84 0.07 0.33 -1.12 2.03 -1.47 -2.82 116.42 116.29 2d93 h ASP 10 Ca 0.54 -0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.82 2d93 h ASP 10 Cb 0.23 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 2d93 h ASP 10 CO 1.37 0.05 -0.16 0.40 -1.03 0.00 0.00 179.24 179.87 2d93 h ILE 11 N 0.08 0.00 -0.99 4.15 2.04 -1.85 -2.32 117.51 118.62 2d93 h ILE 11 Ca 0.06 -0.14 0.35 0.00 1.00 0.00 0.00 64.86 66.13 2d93 h ILE 11 Cb 0.13 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.05 2d93 h ILE 11 CO -0.01 0.00 0.51 -0.33 0.00 0.00 0.00 178.15 178.32 2d93 h GLU 12 N -0.59 0.16 -0.42 2.37 5.08 -1.93 1.33 114.58 120.58 2d93 h GLU 12 Ca -0.05 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 2d93 h GLU 12 Cb 0.34 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2d93 h GLU 12 CO 0.07 0.11 -0.04 1.96 -1.00 0.00 0.00 179.01 180.11 2d93 h GLN 13 N 0.17 0.70 0.38 2.33 4.20 -1.48 -3.14 115.11 118.27 2d93 h GLN 13 Ca 0.76 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 59.26 2d93 h GLN 13 Cb 1.86 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.56 2d93 h GLN 13 CO -0.69 0.74 -0.18 -0.07 -0.67 0.00 0.00 178.83 177.96 2d93 h LEU 14 N 0.65 -0.44 -0.71 1.46 3.38 0.22 -3.22 115.31 116.66 2d93 h LEU 14 Ca 0.13 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.21 2d93 h LEU 14 Cb 0.47 0.11 -0.13 0.00 0.09 0.00 0.00 40.66 41.20 2d93 h LEU 14 CO 0.02 0.00 -0.21 0.18 0.09 0.00 0.00 178.44 178.53 2d93 n LEU 15 N -5.12 -0.33 0.04 1.67 7.99 -0.16 0.11 117.00 121.19 2d93 n LEU 15 Ca -0.07 1.22 -0.11 0.00 -0.01 0.00 0.00 56.01 57.04 2d93 n LEU 15 Cb 0.22 -0.34 -0.04 0.00 -0.11 0.00 0.00 43.42 43.15 2d93 n LEU 15 CO 0.17 -1.14 0.70 -0.33 -1.51 0.00 0.00 177.39 175.28 2d93 h GLU 16 N 0.00 -0.34 -0.91 3.23 5.08 -1.63 -1.24 114.58 118.77 2d93 h GLU 16 Ca 0.31 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.70 2d93 h GLU 16 Cb 0.48 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 2d93 h GLU 16 CO -0.72 -0.23 0.60 0.35 -1.00 0.00 0.00 179.01 178.02 2d93 h PHE 17 N -0.36 1.14 -0.22 4.33 3.57 0.71 -1.56 116.94 124.56 2d93 h PHE 17 Ca 0.08 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.64 2d93 h PHE 17 Cb 0.46 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2d93 h PHE 17 CO -0.30 0.71 0.15 0.52 -2.23 0.00 0.00 178.31 177.15 2d93 h MET 18 N 1.22 0.15 0.00 1.11 2.86 0.09 0.88 114.93 121.23 2d93 h MET 18 Ca 0.34 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 2d93 h MET 18 Cb -0.12 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.51 2d93 h MET 18 CO -0.08 0.10 0.00 1.25 1.06 0.00 0.00 176.91 179.24 2d93 h HIS 19 N 0.15 0.00 0.00 -0.22 -0.00 -0.19 -2.56 115.15 112.33 2d93 h HIS 19 Ca 0.10 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 60.29 2d93 h HIS 19 Cb 0.19 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.58 2d93 h HIS 19 CO -0.00 0.00 -0.88 1.96 -0.00 0.00 0.00 177.93 179.01 2d93 h GLN 20 N 0.00 0.00 -6.21 5.26 1.08 -0.80 -3.45 115.11 110.98 2d93 h GLN 20 Ca 0.00 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.62 2d93 h GLN 20 Cb 0.43 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.82 2d93 h GLN 20 CO 0.00 0.78 -0.09 -0.51 -0.95 0.00 0.00 178.83 178.05 2d93 s LEU 21 N -6.56 4.45 0.19 1.46 1.43 -0.96 -5.00 118.68 113.69 2d93 s LEU 21 Ca 0.02 1.12 -0.05 0.00 -1.03 0.00 0.00 54.13 54.19 2d93 s LEU 21 Cb 0.09 -2.96 0.11 0.00 0.03 0.00 0.00 46.19 43.46 2d93 s LEU 21 CO 0.79 0.22 1.54 1.55 0.23 0.00 0.00 176.35 180.69 2d93 h PRO 22 N 4.21 0.70 -0.20 1.29 0.13 -1.84 -1.29 132.00 135.00 2d93 h PRO 22 Ca -0.50 -0.37 -0.02 0.00 -0.87 0.00 0.00 66.00 64.25 2d93 h PRO 22 Cb 1.21 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2d93 h PRO 22 CO 0.64 0.98 0.05 0.00 -0.23 0.00 0.00 178.00 179.45 2d93 h ALA 23 N 0.97 1.73 0.00 -0.56 0.00 -1.91 -1.63 119.26 117.86 2d93 h ALA 23 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2d93 h ALA 23 Cb 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2d93 h ALA 23 CO 0.09 0.22 -0.99 1.19 0.00 0.00 0.00 179.25 179.75 2d93 n PHE 24 N -4.43 0.39 0.11 0.00 3.72 -1.15 -3.99 117.46 112.11 2d93 n PHE 24 Ca -0.00 0.11 -0.02 0.00 -0.05 0.00 0.00 57.45 57.50 2d93 n PHE 24 Cb 0.14 -0.54 0.02 0.00 -0.94 0.00 0.00 39.48 38.16 2d93 n PHE 24 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2d93 h ALA 25 N 2.45 0.61 -0.54 4.37 0.00 -0.30 -3.30 119.26 122.55 2d93 h ALA 25 Ca 0.00 -0.65 0.10 0.00 0.00 0.00 0.00 54.91 54.36 2d93 h ALA 25 Cb 0.77 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 2d93 h ALA 25 CO 0.00 0.89 0.06 -0.97 0.00 0.00 0.00 179.25 179.23 2d93 h ASN 26 N 0.00 -0.12 -3.12 0.00 -0.73 -1.53 -3.42 115.58 106.66 2d93 h ASN 26 Ca -0.01 0.11 -0.45 0.00 1.87 0.00 0.00 56.30 57.83 2d93 h ASN 26 Cb 1.46 0.18 0.07 0.00 0.27 0.00 0.00 38.32 40.30 2d93 h ASN 26 CO 0.09 -0.04 0.13 0.00 -0.37 0.00 0.00 177.43 177.25 2d93 s MET 27 N -6.14 2.15 0.84 6.67 0.23 -1.24 -5.10 119.30 116.70 2d93 s MET 27 Ca -0.13 -0.57 -0.08 0.00 -1.03 0.00 0.00 55.69 53.88 2d93 s MET 27 Cb 0.17 -2.28 0.18 0.00 -1.53 0.00 0.00 34.83 31.37 2d93 s MET 27 CO 0.73 -1.16 1.15 -2.37 -2.03 0.00 0.00 175.02 171.34 2d93 n THR 28 N -2.77 0.00 -0.04 3.16 5.66 -1.26 -4.94 114.28 114.10 2d93 n THR 28 Ca 0.09 -1.30 -0.11 0.00 -3.05 0.00 0.00 64.05 59.68 2d93 n THR 28 Cb 0.60 -1.18 -0.06 0.00 -1.55 0.00 0.00 70.33 68.15 2d93 n THR 28 CO 0.00 0.00 0.00 -0.03 -3.05 0.00 0.00 175.07 171.99 2d93 h MET 29 N 0.00 0.22 -0.81 1.09 4.05 -1.96 -2.79 114.93 114.73 2d93 h MET 29 Ca -0.38 -0.05 0.11 0.00 -0.28 0.00 0.00 59.70 59.11 2d93 h MET 29 Cb 1.20 -0.03 -0.13 0.00 -0.80 0.00 0.00 31.60 31.84 2d93 h MET 29 CO 0.33 0.34 -0.44 0.77 0.23 0.00 0.00 176.91 178.14 2d93 h SER 30 N 0.04 -1.58 0.02 1.39 0.02 -2.00 0.09 113.55 111.53 2d93 h SER 30 Ca 0.04 0.28 0.02 0.00 -0.84 0.00 0.00 61.79 61.30 2d93 h SER 30 Cb 0.22 0.75 -0.02 0.00 0.14 0.00 0.00 62.40 63.49 2d93 h SER 30 CO -0.00 -0.30 -0.11 0.58 -1.14 0.00 0.00 176.83 175.86 2d93 h VAL 31 N -0.10 0.72 -0.28 2.27 2.07 -1.91 -2.14 116.25 116.87 2d93 h VAL 31 Ca 0.24 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.79 2d93 h VAL 31 Cb 0.55 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2d93 h VAL 31 CO -0.84 0.00 -0.34 0.03 0.02 0.00 0.00 177.57 176.44 2d93 h ARG 32 N -0.20 -0.21 -0.52 1.57 3.08 -0.75 0.15 114.38 117.50 2d93 h ARG 32 Ca 0.04 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.20 2d93 h ARG 32 Cb 0.25 0.05 -0.10 0.00 0.08 0.00 0.00 29.97 30.24 2d93 h ARG 32 CO -0.10 -0.14 -0.20 0.00 -1.07 0.00 0.00 179.97 178.46 2d93 h ARG 33 N -0.22 -0.07 -0.45 0.04 3.08 -1.15 -0.82 114.38 114.80 2d93 h ARG 33 Ca 0.05 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.19 2d93 h ARG 33 Cb 0.35 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.34 2d93 h ARG 33 CO -0.38 -0.05 -0.04 0.93 -1.07 0.00 0.00 179.97 179.36 2d93 h GLU 34 N -0.08 0.07 -0.59 0.04 5.08 -0.58 -1.64 114.58 116.89 2d93 h GLU 34 Ca 0.24 -0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.72 2d93 h GLU 34 Cb 0.45 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.59 2d93 h GLU 34 CO -0.57 0.05 0.01 -0.07 -1.00 0.00 0.00 179.01 177.42 2d93 h LEU 35 N 0.07 -0.25 -1.48 1.33 3.38 0.72 0.36 115.31 119.44 2d93 h LEU 35 Ca 0.22 0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.44 2d93 h LEU 35 Cb 0.33 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2d93 h LEU 35 CO -0.40 -0.10 0.66 0.00 0.09 0.00 0.00 178.44 178.69 2d93 h SER 37 N 0.00 0.83 -0.14 0.00 4.64 -0.29 -3.10 113.55 115.50 2d93 h SER 37 Ca 0.17 -0.25 -0.03 0.00 -0.47 0.00 0.00 61.79 61.21 2d93 h SER 37 Cb 1.50 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 2d93 h SER 37 CO -0.00 0.95 -0.09 1.33 -0.87 0.00 0.00 176.83 178.15 2d93 n VAL 38 N -4.16 2.17 -2.67 0.95 0.24 0.19 -5.00 118.33 110.05 2d93 n VAL 38 Ca 0.01 -2.40 -0.43 0.00 -2.04 0.00 0.00 64.34 59.49 2d93 n VAL 38 Cb 0.37 -0.26 -0.02 0.00 -1.47 0.00 0.00 33.84 32.46 2d93 n VAL 38 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2d93 s MET 39 N -2.99 4.07 0.34 7.34 -1.94 -0.13 -4.54 119.30 121.44 2d93 s MET 39 Ca 0.38 1.05 -0.18 0.00 -1.71 0.00 0.00 55.69 55.23 2d93 s MET 39 Cb 0.33 -3.73 -0.09 0.00 2.01 0.00 0.00 34.83 33.35 2d93 s MET 39 CO 0.02 -0.86 0.80 0.42 -0.01 0.00 0.00 175.02 175.40 2d93 s ILE 40 N 3.55 4.56 -0.29 2.53 1.09 -0.24 -4.94 121.20 127.47 2d93 s ILE 40 Ca 0.44 1.19 -0.08 0.00 -1.10 0.00 0.00 60.65 61.10 2d93 s ILE 40 Cb -0.13 -3.67 -0.01 0.00 -1.06 0.00 0.00 42.46 37.59 2d93 s ILE 40 CO 0.14 -0.15 0.11 -0.36 -0.10 0.00 0.00 174.94 174.59 2d93 s PHE 41 N -1.95 3.14 -0.01 3.97 0.08 -1.26 -3.35 117.98 118.60 2d93 s PHE 41 Ca 0.54 -0.56 -0.02 0.00 0.12 0.00 0.00 56.93 57.01 2d93 s PHE 41 Cb -0.11 -2.30 0.00 0.00 -0.57 0.00 0.00 43.02 40.04 2d93 s PHE 41 CO 0.17 -0.43 0.04 -1.21 -0.10 0.00 0.00 175.22 173.69 2d93 s GLU 42 N 1.60 0.10 -0.05 0.44 0.41 -0.96 -5.04 118.70 115.21 2d93 s GLU 42 Ca 0.05 -0.03 -0.06 0.00 -0.41 0.00 0.00 54.97 54.52 2d93 s GLU 42 Cb -0.16 0.04 0.01 0.00 -1.78 0.00 0.00 34.13 32.24 2d93 s GLU 42 CO 0.05 -0.02 0.16 0.08 -0.49 0.00 0.00 175.26 175.04 2d93 s VAL 43 N -0.20 0.02 -0.17 2.63 1.01 -1.26 -0.57 120.40 121.86 2d93 s VAL 43 Ca -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 2d93 s VAL 43 Cb -0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 2d93 s VAL 43 CO 0.00 -0.10 -0.05 -0.69 0.00 0.00 0.00 175.10 174.26 2d93 s VAL 44 N -0.31 3.65 -0.18 2.92 1.01 0.41 -4.97 120.40 122.93 2d93 s VAL 44 Ca -0.04 -0.43 -0.08 0.00 0.00 0.00 0.00 61.98 61.44 2d93 s VAL 44 Cb -0.03 -2.61 -0.22 0.00 0.00 0.00 0.00 36.38 33.52 2d93 s VAL 44 CO 0.01 0.47 0.14 -0.62 0.00 0.00 0.00 175.10 175.10 2d93 n GLU 45 N 3.95 0.69 -2.64 2.72 1.02 -1.26 -1.48 120.64 123.64 2d93 n GLU 45 Ca -0.18 0.28 -0.43 0.00 -0.02 0.00 0.00 57.16 56.82 2d93 n GLU 45 Cb 0.52 -1.65 -0.02 0.00 -0.02 0.00 0.00 31.44 30.26 2d93 n GLU 45 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2d93 s GLN 46 N -2.52 3.83 1.01 3.49 -0.21 -1.26 -3.87 119.66 120.13 2d93 s GLN 46 Ca -0.28 0.70 -0.11 0.00 0.02 0.00 0.00 55.36 55.69 2d93 s GLN 46 Cb 0.08 -3.85 0.20 0.00 1.00 0.00 0.00 33.01 30.44 2d93 s GLN 46 CO 0.68 -1.20 1.09 0.00 -2.12 0.00 0.00 175.29 173.74 2d93 s ALA 47 N 4.11 0.71 -1.90 6.09 0.00 -1.26 -3.21 121.76 126.29 2d93 s ALA 47 Ca 0.46 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.62 2d93 s ALA 47 Cb -0.09 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2d93 s ALA 47 CO 0.26 -3.12 0.00 0.41 0.00 0.00 0.00 175.76 173.30 2d93 n GLY 48 N 0.21 1.51 3.79 0.00 0.00 -1.16 -4.96 105.19 104.58 2d93 n GLY 48 Ca 0.07 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 2d93 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d93 s ALA 49 N -2.71 3.32 0.08 4.61 0.00 -1.20 -4.63 121.76 121.23 2d93 s ALA 49 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 51.96 52.07 2d93 s ALA 49 Cb 0.00 -3.05 -0.05 0.00 0.00 0.00 0.00 23.12 20.02 2d93 s ALA 49 CO 0.00 0.24 1.09 0.42 0.00 0.00 0.00 175.76 177.51 2d93 s ILE 50 N -1.47 4.25 -0.22 0.00 1.09 -1.26 -1.45 121.20 122.14 2d93 s ILE 50 Ca 0.45 1.72 0.06 0.00 -1.10 0.00 0.00 60.65 61.78 2d93 s ILE 50 Cb -0.20 -4.10 -0.18 0.00 -1.06 0.00 0.00 42.46 36.93 2d93 s ILE 50 CO 0.24 0.19 -0.12 -0.38 -0.10 0.00 0.00 174.94 174.77 2d93 n ILE 51 N 3.40 1.32 -3.71 2.92 2.08 0.65 -4.97 119.36 121.05 2d93 n ILE 51 Ca 0.06 -0.60 -0.12 0.00 0.56 0.00 0.00 62.75 62.65 2d93 n ILE 51 Cb 0.48 -1.07 -0.11 0.00 -0.75 0.00 0.00 39.64 38.19 2d93 n ILE 51 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2d93 s LEU 52 N -6.05 0.15 0.31 1.39 1.43 -1.24 -4.98 118.68 109.68 2d93 s LEU 52 Ca -0.24 0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 53.69 2d93 s LEU 52 Cb 0.07 1.33 -0.04 0.00 0.03 0.00 0.00 46.19 47.59 2d93 s LEU 52 CO 0.61 -0.17 0.53 -1.61 0.23 0.00 0.00 176.35 175.94 2d93 s GLU 53 N 0.93 3.54 0.22 1.70 2.02 -1.26 -1.65 118.70 124.19 2d93 s GLU 53 Ca -0.06 -0.22 -0.31 0.00 0.02 0.00 0.00 54.97 54.41 2d93 s GLU 53 Cb -0.06 -2.68 -0.10 0.00 0.10 0.00 0.00 34.13 31.39 2d93 s GLU 53 CO -0.07 0.20 1.50 0.34 0.02 0.00 0.00 175.26 177.25 2d93 s ASP 54 N -3.63 6.61 -0.21 -0.19 -1.08 -1.03 -2.97 116.67 114.16 2d93 s ASP 54 Ca 0.41 2.67 -0.01 0.00 -0.52 0.00 0.00 52.55 55.10 2d93 s ASP 54 Cb -0.10 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2d93 s ASP 54 CO 0.33 -0.76 0.15 0.61 0.52 0.00 0.00 175.17 176.02 2d93 n GLY 55 N 2.78 0.67 3.47 2.66 0.00 0.27 -4.96 105.19 110.07 2d93 n GLY 55 Ca 0.09 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 2d93 n GLY 55 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2d93 s GLN 56 N -5.06 3.67 -0.96 1.61 0.74 -1.16 -4.82 119.66 113.69 2d93 s GLN 56 Ca 0.08 -0.49 -0.25 0.00 0.05 0.00 0.00 55.36 54.75 2d93 s GLN 56 Cb -0.03 -3.14 -0.09 0.00 1.10 0.00 0.00 33.01 30.84 2d93 s GLN 56 CO 0.09 0.01 2.05 -2.00 -0.55 0.00 0.00 175.29 174.90 2d93 s GLU 57 N 1.03 2.22 0.16 1.67 2.12 -1.26 -1.69 118.70 122.95 2d93 s GLU 57 Ca 0.03 -0.34 -0.31 0.00 0.36 0.00 0.00 54.97 54.70 2d93 s GLU 57 Cb -0.14 -5.04 -0.11 0.00 0.26 0.00 0.00 34.13 29.10 2d93 s GLU 57 CO 0.02 -3.92 1.70 -0.51 -0.54 0.00 0.00 175.26 172.00 2d93 s LEU 58 N 11.88 4.38 0.00 2.70 1.43 -0.55 -4.86 118.68 133.65 2d93 s LEU 58 Ca 0.75 2.72 0.00 0.00 -1.03 0.00 0.00 54.13 56.57 2d93 s LEU 58 Cb -0.06 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.57 2d93 s LEU 58 CO 0.06 -0.93 0.43 -0.90 0.23 0.00 0.00 176.35 175.24 2d93 n ASP 59 N 4.62 0.75 -3.95 2.29 5.75 -1.26 -4.08 116.55 120.67 2d93 n ASP 59 Ca 0.16 -1.16 -0.13 0.00 -0.01 0.00 0.00 54.79 53.64 2d93 n ASP 59 Cb 0.38 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 40.33 2d93 n ASP 59 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2d93 s SER 60 N -0.16 0.43 -0.28 -1.12 0.01 -1.26 -1.02 113.70 110.30 2d93 s SER 60 Ca 0.00 -0.18 -0.22 0.00 1.31 0.00 0.00 55.95 56.85 2d93 s SER 60 Cb 0.00 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 2d93 s SER 60 CO 0.00 -0.04 0.73 0.86 0.41 0.00 0.00 173.24 175.20 2d93 s TRP 61 N -0.44 3.25 -0.17 2.43 -0.00 -0.53 -3.54 118.94 119.95 2d93 s TRP 61 Ca -0.02 0.86 -0.10 0.00 -0.00 0.00 0.00 56.10 56.83 2d93 s TRP 61 Cb -0.04 -3.04 -0.05 0.00 -0.00 0.00 0.00 33.47 30.35 2d93 s TRP 61 CO -0.00 -0.45 0.17 0.71 -0.00 0.00 0.00 176.95 177.38 2d93 s TYR 62 N 2.75 3.48 -0.11 5.86 1.51 0.69 -2.70 117.35 128.84 2d93 s TYR 62 Ca 0.30 0.45 -0.00 0.00 -1.01 0.00 0.00 57.07 56.80 2d93 s TYR 62 Cb -0.15 -2.14 0.02 0.00 -0.11 0.00 0.00 41.96 39.59 2d93 s TYR 62 CO 0.10 0.41 -0.08 0.08 -1.11 0.00 0.00 175.55 174.95 2d93 s VAL 63 N -0.03 1.00 -0.21 0.71 1.01 -1.02 -0.67 120.40 121.19 2d93 s VAL 63 Ca 0.12 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.51 2d93 s VAL 63 Cb -0.12 -1.02 -0.07 0.00 0.00 0.00 0.00 36.38 35.17 2d93 s VAL 63 CO 0.01 0.36 2.16 -0.38 0.00 0.00 0.00 175.10 177.26 2d93 n ILE 64 N 4.87 0.37 0.02 2.22 5.41 -1.13 -2.83 119.36 128.30 2d93 n ILE 64 Ca -0.13 -0.36 -0.21 0.00 1.00 0.00 0.00 62.75 63.05 2d93 n ILE 64 Cb 0.50 -2.28 -0.14 0.00 -0.71 0.00 0.00 39.64 37.01 2d93 n ILE 64 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2d93 h LEU 65 N 13.56 0.43 -7.01 1.39 3.38 -1.34 -3.27 115.31 122.46 2d93 h LEU 65 Ca -0.39 -0.88 -0.03 0.00 0.09 0.00 0.00 57.88 56.66 2d93 h LEU 65 Cb 1.26 -0.14 -0.21 0.00 0.09 0.00 0.00 40.66 41.66 2d93 h LEU 65 CO 0.97 1.78 0.10 0.21 0.09 0.00 0.00 178.44 181.59 2d93 s ASN 66 N -7.03 -0.78 0.00 -0.43 2.47 -0.71 -4.88 114.94 103.58 2d93 s ASN 66 Ca -0.20 1.45 0.00 0.00 0.42 0.00 0.00 52.86 54.53 2d93 s ASN 66 Cb 0.06 1.44 0.00 0.00 -1.45 0.00 0.00 41.25 41.30 2d93 s ASN 66 CO 0.79 -0.25 0.00 0.61 -3.72 0.00 0.00 177.10 174.54 2d93 n GLY 67 N 3.03 -1.54 3.06 1.21 0.00 -1.26 -1.26 105.19 108.42 2d93 n GLY 67 Ca -0.15 -2.09 -0.21 0.00 0.00 0.00 0.00 46.02 43.57 2d93 n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d93 s THR 68 N -0.05 0.91 -0.04 2.61 2.01 -1.26 -3.26 115.64 116.56 2d93 s THR 68 Ca 0.00 -0.48 0.05 0.00 0.31 0.00 0.00 61.69 61.58 2d93 s THR 68 Cb 0.00 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 2d93 s THR 68 CO 0.00 0.26 -0.20 0.68 -0.69 0.00 0.00 174.62 174.67 2d93 s VAL 69 N -0.17 1.63 -0.09 3.82 -7.23 -1.24 -0.15 120.40 116.97 2d93 s VAL 69 Ca 0.03 -0.84 -0.04 0.00 -1.81 0.00 0.00 61.98 59.32 2d93 s VAL 69 Cb -0.06 -1.39 -0.04 0.00 0.56 0.00 0.00 36.38 35.46 2d93 s VAL 69 CO -0.00 0.46 0.06 -0.70 -0.31 0.00 0.00 175.10 174.61 2d93 s GLU 70 N -0.13 3.15 -0.06 4.82 2.12 0.11 -2.12 118.70 126.59 2d93 s GLU 70 Ca -0.01 -0.31 0.04 0.00 0.36 0.00 0.00 54.97 55.05 2d93 s GLU 70 Cb -0.11 -2.94 -0.02 0.00 0.26 0.00 0.00 34.13 31.32 2d93 s GLU 70 CO 0.02 0.73 -0.19 0.42 -0.54 0.00 0.00 175.26 175.70 2d93 s ILE 71 N -0.96 2.62 0.01 -3.70 1.01 0.10 -0.43 121.20 119.84 2d93 s ILE 71 Ca 0.15 -0.87 0.08 0.00 0.00 0.00 0.00 60.65 60.00 2d93 s ILE 71 Cb -0.12 -2.00 -0.02 0.00 0.01 0.00 0.00 42.46 40.33 2d93 s ILE 71 CO 0.04 0.57 -0.24 -0.55 0.00 0.00 0.00 174.94 174.76 2d93 s SER 72 N -0.37 2.81 0.06 3.58 0.15 0.62 -0.28 113.70 120.27 2d93 s SER 72 Ca 0.03 -0.48 0.07 0.00 0.70 0.00 0.00 55.95 56.27 2d93 s SER 72 Cb -0.12 -0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 63.86 2d93 s SER 72 CO 0.02 0.26 -0.13 -1.00 1.20 0.00 0.00 173.24 173.59 2d93 s HIS 73 N -0.65 2.67 -0.36 3.44 3.76 0.14 -0.58 115.29 123.72 2d93 s HIS 73 Ca 0.09 -0.18 0.26 0.00 -0.15 0.00 0.00 55.06 55.08 2d93 s HIS 73 Cb -0.09 -1.47 1.07 0.00 1.11 0.00 0.00 32.58 33.20 2d93 s HIS 73 CO 0.00 0.35 1.77 -1.00 -0.85 0.00 0.00 174.74 175.01 2d93 h PRO 74 N 4.15 0.00 0.20 8.40 0.13 -1.86 -2.99 132.00 140.03 2d93 h PRO 74 Ca -0.48 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.34 2d93 h PRO 74 Cb 1.16 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.33 2d93 h PRO 74 CO 0.50 0.00 -1.34 -0.44 -0.23 0.00 0.00 178.00 176.49 2d93 h ASP 75 N 0.00 0.83 0.00 1.44 3.32 -1.95 -3.47 116.42 116.58 2d93 h ASP 75 Ca 0.00 -0.89 0.00 0.00 0.02 0.00 0.00 57.03 56.16 2d93 h ASP 75 Cb 0.38 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2d93 h ASP 75 CO 0.00 1.65 0.00 0.61 -1.72 0.00 0.00 179.24 179.78 2d93 n GLY 76 N 1.60 0.28 3.10 2.75 0.00 -1.13 -5.16 105.19 106.63 2d93 n GLY 76 Ca -0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 2d93 n GLY 76 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2d93 s LYS 77 N 0.00 0.72 -0.16 1.61 2.47 -1.25 -5.00 119.74 118.13 2d93 s LYS 77 Ca 0.00 -0.75 -0.01 0.00 -1.56 0.00 0.00 55.97 53.66 2d93 s LYS 77 Cb 0.00 -0.65 0.04 0.00 -1.46 0.00 0.00 37.83 35.76 2d93 s LYS 77 CO 0.00 0.15 -0.05 0.08 0.16 0.00 0.00 175.35 175.69 2d93 s VAL 78 N -1.05 1.06 -0.27 4.02 1.01 -1.26 0.28 120.40 124.18 2d93 s VAL 78 Ca -0.03 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 2d93 s VAL 78 Cb -0.08 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 2d93 s VAL 78 CO 0.01 0.13 0.40 -1.61 0.00 0.00 0.00 175.10 174.03 2d93 s GLU 79 N 1.66 3.99 -0.29 2.72 8.01 0.61 -4.90 118.70 130.50 2d93 s GLU 79 Ca 0.01 0.06 -0.11 0.00 0.01 0.00 0.00 54.97 54.94 2d93 s GLU 79 Cb -0.15 -3.67 -0.04 0.00 -4.31 0.00 0.00 34.13 25.96 2d93 s GLU 79 CO -0.08 -0.31 0.18 0.54 0.01 0.00 0.00 175.26 175.61 2d93 s ASN 80 N 1.63 5.92 0.35 -0.19 2.20 -1.26 0.02 114.94 123.62 2d93 s ASN 80 Ca 0.16 -0.12 0.07 0.00 -0.94 0.00 0.00 52.86 52.03 2d93 s ASN 80 Cb -0.16 -2.10 -0.02 0.00 -2.00 0.00 0.00 41.25 36.97 2d93 s ASN 80 CO 0.10 -0.08 0.34 -0.76 -2.94 0.00 0.00 177.10 173.76 2d93 s LEU 81 N 1.73 3.61 0.19 3.54 1.43 -0.90 -5.02 118.68 123.26 2d93 s LEU 81 Ca 0.07 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 2d93 s LEU 81 Cb -0.16 -2.27 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2d93 s LEU 81 CO 0.10 -0.43 0.19 -0.36 0.23 0.00 0.00 176.35 176.07 2d93 s PHE 82 N -2.32 0.89 -0.39 0.29 0.08 -1.26 -3.71 117.98 111.56 2d93 s PHE 82 Ca 0.43 -1.18 -0.43 0.00 0.12 0.00 0.00 56.93 55.88 2d93 s PHE 82 Cb -0.06 -0.37 -0.17 0.00 -0.57 0.00 0.00 43.02 41.85 2d93 s PHE 82 CO 0.28 -0.68 1.80 -0.12 -0.10 0.00 0.00 175.22 176.39 2d93 n MET 83 N -0.25 0.59 0.00 0.44 0.00 -1.20 -1.21 117.12 115.49 2d93 n MET 83 Ca -0.01 0.21 0.00 0.00 -0.00 0.00 0.00 57.70 57.90 2d93 n MET 83 Cb 0.65 -1.85 0.00 0.00 0.00 0.00 0.00 33.22 32.01 2d93 n MET 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2d93 n GLY 84 N 4.86 2.23 3.61 -5.12 0.00 -1.23 -5.03 105.19 104.50 2d93 n GLY 84 Ca 0.34 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 2d93 n GLY 84 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d93 s ASN 85 N -0.33 2.28 0.11 1.61 -0.87 -0.35 -3.97 114.94 113.42 2d93 s ASN 85 Ca 0.00 1.62 0.02 0.00 -1.57 0.00 0.00 52.86 52.93 2d93 s ASN 85 Cb 0.00 -2.28 -0.04 0.00 -0.02 0.00 0.00 41.25 38.91 2d93 s ASN 85 CO 0.00 -3.41 -0.06 -0.94 -2.57 0.00 0.00 177.10 170.12 2d93 s SER 86 N -2.91 1.18 -0.16 -1.22 1.04 -1.26 -2.82 113.70 107.55 2d93 s SER 86 Ca 0.66 -1.03 -0.30 0.00 0.48 0.00 0.00 55.95 55.76 2d93 s SER 86 Cb -0.22 0.09 0.14 0.00 0.10 0.00 0.00 66.02 66.13 2d93 s SER 86 CO 0.60 -0.47 1.06 0.72 0.98 0.00 0.00 173.24 176.13 2d93 s PHE 87 N -3.61 -0.29 0.00 5.02 -0.12 0.15 -5.00 117.98 114.13 2d93 s PHE 87 Ca 0.14 0.45 0.00 0.00 -0.05 0.00 0.00 56.93 57.46 2d93 s PHE 87 Cb 0.05 0.47 0.00 0.00 -0.63 0.00 0.00 43.02 42.91 2d93 s PHE 87 CO -0.03 -0.30 0.00 0.41 -0.05 0.00 0.00 175.22 175.24 2d93 n GLY 88 N 0.51 0.61 1.82 1.99 0.00 -1.26 -0.22 105.19 108.64 2d93 n GLY 88 Ca -0.07 -0.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 2d93 n GLY 88 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2d93 n ILE 89 N 0.00 0.00 -4.12 -0.61 -5.35 -1.23 -4.89 119.36 103.16 2d93 n ILE 89 Ca 0.00 -1.23 -0.22 0.00 -0.27 0.00 0.00 62.75 61.03 2d93 n ILE 89 Cb 0.00 0.32 -0.05 0.00 -1.74 0.00 0.00 39.64 38.17 2d93 n ILE 89 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2d93 s THR 90 N -2.09 3.97 -2.00 7.28 -4.23 -1.26 -4.83 115.64 112.48 2d93 s THR 90 Ca 0.04 -1.55 0.11 0.00 -1.18 0.00 0.00 61.69 59.11 2d93 s THR 90 Cb 0.00 -3.20 0.31 0.00 1.34 0.00 0.00 72.50 70.95 2d93 s THR 90 CO 0.03 -0.32 1.08 -0.81 -0.54 0.00 0.00 174.62 174.06 2d93 n PRO 91 N -1.13 0.49 -3.93 3.99 -0.04 -1.26 -4.73 135.00 128.40 2d93 n PRO 91 Ca -0.06 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.09 2d93 n PRO 91 Cb 0.59 -1.34 -0.04 0.00 -0.04 0.00 0.00 33.50 32.66 2d93 n PRO 91 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2d93 s THR 92 N -2.00 5.36 -0.56 0.52 -4.23 -1.26 -3.84 115.64 109.63 2d93 s THR 92 Ca 0.16 -0.43 0.10 0.00 -1.18 0.00 0.00 61.69 60.35 2d93 s THR 92 Cb 0.07 -3.63 0.10 0.00 1.34 0.00 0.00 72.50 70.39 2d93 s THR 92 CO 0.13 0.12 1.29 0.18 -0.54 0.00 0.00 174.62 175.80 2d93 n LEU 93 N 0.22 0.27 -4.77 4.79 4.77 -1.26 -4.67 117.00 116.35 2d93 n LEU 93 Ca -0.05 0.61 -0.40 0.00 -0.03 0.00 0.00 56.01 56.13 2d93 n LEU 93 Cb 0.51 -0.63 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 2d93 n LEU 93 CO 0.52 -0.70 0.98 -1.81 -1.33 0.00 0.00 177.39 175.05 2d93 s ASP 94 N -3.45 6.53 0.50 -1.43 1.01 -1.26 -5.02 116.67 113.54 2d93 s ASP 94 Ca -0.01 2.70 -0.02 0.00 0.71 0.00 0.00 52.55 55.93 2d93 s ASP 94 Cb 0.03 -2.65 -0.00 0.00 1.01 0.00 0.00 42.92 41.31 2d93 s ASP 94 CO 0.09 -0.71 0.75 -1.59 0.21 0.00 0.00 175.17 173.93 2d93 s LYS 95 N -2.03 3.08 0.07 8.23 -2.85 -1.26 -4.71 119.74 120.28 2d93 s LYS 95 Ca 0.53 -0.26 -0.08 0.00 -1.00 0.00 0.00 55.97 55.17 2d93 s LYS 95 Cb -0.39 -2.45 -0.01 0.00 -2.06 0.00 0.00 37.83 32.92 2d93 s LYS 95 CO 0.52 -0.39 0.16 1.14 0.10 0.00 0.00 175.35 176.87 2d93 s GLN 96 N -4.71 0.77 -0.08 1.78 0.00 -1.26 -5.05 119.66 111.12 2d93 s GLN 96 Ca 0.50 -0.93 0.04 0.00 -0.00 0.00 0.00 55.36 54.97 2d93 s GLN 96 Cb -0.10 0.31 0.00 0.00 0.00 0.00 0.00 33.01 33.22 2d93 s GLN 96 CO 0.41 -0.23 -0.20 0.71 0.00 0.00 0.00 175.29 175.98 2d93 s TYR 97 N -3.57 2.13 0.22 9.60 2.02 -1.26 -1.48 117.35 125.00 2d93 s TYR 97 Ca 0.03 -0.79 -0.32 0.00 -0.37 0.00 0.00 57.07 55.62 2d93 s TYR 97 Cb 0.04 -1.44 -0.13 0.00 -0.40 0.00 0.00 41.96 40.03 2d93 s TYR 97 CO -0.09 -0.32 1.55 -0.12 -1.57 0.00 0.00 175.55 174.99 2d93 n MET 98 N 3.47 2.31 -1.20 -0.62 1.56 -0.68 -4.82 117.12 117.13 2d93 n MET 98 Ca -0.20 0.83 -0.19 0.00 -0.27 0.00 0.00 57.70 57.87 2d93 n MET 98 Cb 0.53 -2.57 0.14 0.00 2.15 0.00 0.00 33.22 33.47 2d93 n MET 98 CO 0.00 0.00 0.00 0.72 -0.73 0.00 0.00 175.97 175.96 2d93 n HIS 99 N 2.74 2.32 -2.75 1.12 8.25 -1.26 -0.57 115.22 125.08 2d93 n HIS 99 Ca 0.13 -2.07 0.00 0.00 -0.26 0.00 0.00 57.72 55.52 2d93 n HIS 99 Cb 0.32 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.62 2d93 n HIS 99 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2d93 n GLY 100 N -1.03 -1.32 3.36 -1.41 0.00 -1.26 -4.64 105.19 98.88 2d93 n GLY 100 Ca 0.48 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 2d93 n GLY 100 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d93 s ILE 101 N -2.84 2.48 -0.11 -0.61 1.01 0.26 -2.47 121.20 118.91 2d93 s ILE 101 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.72 2d93 s ILE 101 Cb 0.00 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2d93 s ILE 101 CO 0.00 0.58 -0.11 -0.69 0.00 0.00 0.00 174.94 174.71 2d93 s VAL 102 N -0.44 3.24 -0.06 2.92 1.01 -0.66 -0.27 120.40 126.13 2d93 s VAL 102 Ca 0.05 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 2d93 s VAL 102 Cb -0.12 -2.35 0.04 0.00 0.00 0.00 0.00 36.38 33.95 2d93 s VAL 102 CO 0.01 0.54 0.14 -0.13 0.00 0.00 0.00 175.10 175.66 2d93 s ARG 103 N 0.05 0.09 1.00 2.72 0.52 0.43 -0.26 118.95 123.50 2d93 s ARG 103 Ca -0.04 0.34 -0.12 0.00 -0.52 0.00 0.00 55.73 55.39 2d93 s ARG 103 Cb -0.14 -0.16 0.14 0.00 0.52 0.00 0.00 34.95 35.30 2d93 s ARG 103 CO 0.04 -0.15 0.75 0.25 0.02 0.00 0.00 175.30 176.21 2d93 n THR 104 N 4.10 0.00 0.10 0.02 -2.24 -0.53 0.08 114.28 115.81 2d93 n THR 104 Ca -0.25 -0.18 0.01 0.00 -2.27 0.00 0.00 64.05 61.35 2d93 n THR 104 Cb 0.52 -0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 67.91 2d93 n THR 104 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2d93 n LYS 105 N -3.34 6.18 -4.04 -0.78 4.76 0.79 -3.00 118.16 118.72 2d93 n LYS 105 Ca 0.07 -0.01 -0.11 0.00 -2.87 0.00 0.00 58.31 55.39 2d93 n LYS 105 Cb 0.54 -0.61 -0.05 0.00 -1.84 0.00 0.00 35.03 33.08 2d93 n LYS 105 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2d93 s VAL 106 N -1.18 0.00 0.41 -0.18 -7.23 -1.25 -4.80 120.40 106.17 2d93 s VAL 106 Ca 0.01 -1.52 0.01 0.00 -1.81 0.00 0.00 61.98 58.67 2d93 s VAL 106 Cb 0.02 -2.43 -0.01 0.00 0.56 0.00 0.00 36.38 34.51 2d93 s VAL 106 CO 0.08 0.00 0.61 1.51 -0.31 0.00 0.00 175.10 177.00 2d93 s ASP 107 N -3.12 5.98 -1.02 4.85 1.47 -1.26 -4.32 116.67 119.26 2d93 s ASP 107 Ca 0.27 0.28 -0.05 0.00 1.18 0.00 0.00 52.55 54.23 2d93 s ASP 107 Cb 0.00 -1.64 0.01 0.00 -0.34 0.00 0.00 42.92 40.94 2d93 s ASP 107 CO 0.14 -0.55 0.88 -0.67 0.68 0.00 0.00 175.17 175.64 2d93 n ASP 108 N -1.94 -4.32 -4.65 2.11 2.03 -0.76 -4.98 116.55 104.04 2d93 n ASP 108 Ca -0.01 -0.44 -0.39 0.00 0.52 0.00 0.00 54.79 54.47 2d93 n ASP 108 Cb 0.57 -4.07 -0.07 0.00 -0.72 0.00 0.00 41.12 36.83 2d93 n ASP 108 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d93 s GLN 110 N 1.79 3.85 0.03 0.00 -0.21 -0.39 -0.45 119.66 124.28 2d93 s GLN 110 Ca 0.23 0.25 -0.02 0.00 0.02 0.00 0.00 55.36 55.84 2d93 s GLN 110 Cb -0.15 -3.24 -0.02 0.00 1.00 0.00 0.00 33.01 30.60 2d93 s GLN 110 CO 0.09 0.65 0.02 -0.06 -2.12 0.00 0.00 175.29 173.88 2d93 s PHE 111 N -0.86 0.29 0.06 0.91 0.08 0.27 -0.84 117.98 117.88 2d93 s PHE 111 Ca 0.21 -0.63 0.08 0.00 0.12 0.00 0.00 56.93 56.71 2d93 s PHE 111 Cb -0.15 -0.22 -0.03 0.00 -0.57 0.00 0.00 43.02 42.06 2d93 s PHE 111 CO 0.10 -0.30 -0.22 0.54 -0.10 0.00 0.00 175.22 175.24 2d93 s VAL 112 N -2.44 1.76 0.06 -0.44 0.11 -1.13 -2.28 120.40 116.04 2d93 s VAL 112 Ca -0.07 -1.30 0.07 0.00 -2.93 0.00 0.00 61.98 57.75 2d93 s VAL 112 Cb -0.03 -1.54 -0.03 0.00 -1.53 0.00 0.00 36.38 33.26 2d93 s VAL 112 CO -0.04 0.17 -0.21 0.00 -3.33 0.00 0.00 175.10 171.70 2d93 s ILE 114 N -0.91 -0.31 0.30 0.00 1.01 -1.10 -1.08 121.20 119.12 2d93 s ILE 114 Ca 0.07 0.32 -0.28 0.00 0.00 0.00 0.00 60.65 60.76 2d93 s ILE 114 Cb -0.09 -0.35 -0.14 0.00 0.01 0.00 0.00 42.46 41.89 2d93 s ILE 114 CO 0.02 0.13 1.05 0.00 0.00 0.00 0.00 174.94 176.15 2d93 n ALA 115 N 5.30 0.00 -0.24 9.38 0.00 -1.26 -1.46 120.51 132.23 2d93 n ALA 115 Ca -0.06 0.38 -0.02 0.00 0.00 0.00 0.00 53.44 53.74 2d93 n ALA 115 Cb 0.50 -2.05 0.17 0.00 0.00 0.00 0.00 19.45 18.07 2d93 n ALA 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2d93 h GLN 116 N 2.04 1.05 -0.17 0.00 3.07 -1.45 0.50 115.11 120.14 2d93 h GLN 116 Ca -0.41 -0.12 0.05 0.00 0.09 0.00 0.00 58.65 58.26 2d93 h GLN 116 Cb 1.33 -0.21 -0.06 0.00 0.08 0.00 0.00 27.48 28.63 2d93 h GLN 116 CO 0.61 0.78 -0.18 1.96 0.09 0.00 0.00 178.83 182.08 2d93 h GLN 117 N 1.06 -0.20 -0.04 0.06 7.50 -1.89 -1.51 115.11 120.09 2d93 h GLN 117 Ca 0.27 0.01 -0.17 0.00 0.50 0.00 0.00 58.65 59.26 2d93 h GLN 117 Cb 0.04 0.05 -0.01 0.00 0.05 0.00 0.00 27.48 27.60 2d93 h GLN 117 CO -0.04 -0.13 -0.72 -0.44 -1.50 0.00 0.00 178.83 175.99 2d93 h ASP 118 N -0.21 0.25 0.26 1.46 3.32 -1.88 -2.87 116.42 116.74 2d93 h ASP 118 Ca 0.11 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2d93 h ASP 118 Cb 0.38 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2d93 h ASP 118 CO -0.30 0.89 0.00 0.00 -1.72 0.00 0.00 179.24 178.11 2d93 n TYR 119 N -3.77 0.05 0.28 4.55 9.36 0.15 -1.16 117.16 126.61 2d93 n TYR 119 Ca -0.03 0.02 0.03 0.00 3.32 0.00 0.00 57.90 61.25 2d93 n TYR 119 Cb 0.70 -0.54 0.01 0.00 -0.63 0.00 0.00 39.34 38.88 2d93 n TYR 119 CO 0.00 0.00 0.00 1.87 0.22 0.00 0.00 176.86 178.95 2d93 n TRP 120 N -1.55 0.00 0.03 2.98 -0.00 -0.64 -4.35 117.44 113.91 2d93 n TRP 120 Ca 0.02 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.63 2d93 n TRP 120 Cb 0.09 0.00 -0.16 0.00 -0.00 0.00 0.00 31.31 31.23 2d93 n TRP 120 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 177.69 175.56 2d93 n ARG 121 N 0.04 0.64 -0.04 5.87 0.63 -0.31 -3.94 116.66 119.54 2d93 n ARG 121 Ca 0.03 -0.19 -0.03 0.00 -0.92 0.00 0.00 57.85 56.75 2d93 n ARG 121 Cb 0.15 -1.53 -0.01 0.00 0.45 0.00 0.00 32.46 31.52 2d93 n ARG 121 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 2d93 h ILE 122 N 0.00 0.00 0.59 5.15 2.04 -1.68 -3.42 117.51 120.19 2d93 h ILE 122 Ca 0.00 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.25 2d93 h ILE 122 Cb 0.98 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2d93 h ILE 122 CO 0.00 0.00 -0.47 -0.07 0.00 0.00 0.00 178.15 177.61 2d93 h LEU 123 N -0.59 -1.23 -9.76 1.44 4.07 -1.82 -3.44 115.31 103.98 2d93 h LEU 123 Ca 0.00 0.09 -0.33 0.00 0.08 0.00 0.00 57.88 57.71 2d93 h LEU 123 Cb 0.28 0.39 0.20 0.00 1.08 0.00 0.00 40.66 42.60 2d93 h LEU 123 CO 0.00 -0.66 -0.16 0.59 -1.08 0.00 0.00 178.44 177.13 2d93 n ASN 124 N -5.32 -3.99 -1.58 -0.43 3.02 -1.25 -4.95 115.26 100.77 2d93 n ASN 124 Ca -0.12 -0.79 -0.15 0.00 -0.03 0.00 0.00 54.58 53.49 2d93 n ASN 124 Cb 0.45 -0.96 0.10 0.00 -0.61 0.00 0.00 39.78 38.76 2d93 n ASN 124 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2d93 n HIS 125 N -5.59 1.87 0.30 3.10 8.25 -1.26 -4.71 115.22 117.18 2d93 n HIS 125 Ca 0.12 -2.03 0.17 0.00 -0.26 0.00 0.00 57.72 55.73 2d93 n HIS 125 Cb 0.55 -0.47 0.77 0.00 1.12 0.00 0.00 29.99 31.95 2d93 n HIS 125 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2d93 h VAL 126 N 1.56 0.00 -2.91 1.59 3.04 -1.83 -3.45 116.25 114.26 2d93 h VAL 126 Ca 0.29 -0.33 0.02 0.00 -1.01 0.00 0.00 66.70 65.67 2d93 h VAL 126 Cb 1.38 1.26 -0.10 0.00 -2.01 0.00 0.00 31.29 31.82 2d93 h VAL 126 CO 0.61 0.00 0.25 -0.70 -1.01 0.00 0.00 177.57 176.72 2d93 s GLU 127 N -3.71 1.38 -0.27 4.17 2.12 -1.26 -5.07 118.70 116.05 2d93 s GLU 127 Ca 0.00 -0.61 0.17 0.00 0.36 0.00 0.00 54.97 54.90 2d93 s GLU 127 Cb 0.10 0.57 0.49 0.00 0.26 0.00 0.00 34.13 35.55 2d93 s GLU 127 CO 0.47 -0.61 1.13 1.63 -0.54 0.00 0.00 175.26 177.34 2d93 n LYS 128 N -0.39 2.39 -0.04 4.30 4.76 -1.26 -4.89 118.16 123.03 2d93 n LYS 128 Ca -0.12 -3.75 -0.03 0.00 -2.87 0.00 0.00 58.31 51.54 2d93 n LYS 128 Cb 0.63 -1.84 -0.01 0.00 -1.84 0.00 0.00 35.03 31.97 2d93 n LYS 128 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2d93 n SER 129 N -0.62 0.85 0.00 4.39 7.64 -1.26 -5.12 113.62 119.50 2d93 n SER 129 Ca 0.20 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.40 2d93 n SER 129 Cb 0.86 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2d93 n SER 129 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d93 n GLY 130 N 1.60 -1.76 0.00 0.23 0.00 -1.26 -4.33 105.19 99.67 2d93 n GLY 130 Ca -0.05 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 44.10 2d93 n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d93 n PRO 131 N 0.00 0.49 -1.28 1.61 -0.04 -1.26 -4.87 135.00 129.64 2d93 n PRO 131 Ca 0.00 0.00 -0.50 0.00 -0.04 0.00 0.00 63.50 62.96 2d93 n PRO 131 Cb 0.00 -1.39 -0.07 0.00 -0.04 0.00 0.00 33.50 32.00 2d93 n PRO 131 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d93 n SER 132 N -0.89 0.55 -4.60 3.54 3.41 -1.26 -4.87 113.62 109.50 2d93 n SER 132 Ca 0.09 0.92 -0.38 0.00 -0.26 0.00 0.00 58.87 59.23 2d93 n SER 132 Cb 0.04 -0.70 -0.10 0.00 -0.26 0.00 0.00 64.21 63.20 2d93 n SER 132 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d93 s SER 133 N 1.37 6.15 0.00 4.04 0.01 -1.26 -5.18 113.70 118.84 2d93 s SER 133 Ca 0.77 0.16 0.00 0.00 1.31 0.00 0.00 55.95 58.19 2d93 s SER 133 Cb -1.09 -2.17 0.00 0.00 0.21 0.00 0.00 66.02 62.97 2d93 s SER 133 CO 0.56 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.71