#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 3.86 0.43 1.61 0.15 -1.26 -5.14 113.70 113.35 2d93 s SER 2 Ca 0.00 -0.66 -0.02 0.00 0.70 0.00 0.00 55.95 55.97 2d93 s SER 2 Cb 0.00 -0.51 -0.03 0.00 -1.71 0.00 0.00 66.02 63.78 2d93 s SER 2 CO 0.00 0.14 0.68 -0.55 1.20 0.00 0.00 173.24 174.71 2d93 s SER 3 N -2.53 6.16 0.00 5.45 0.15 -1.26 -5.10 113.70 116.58 2d93 s SER 3 Ca 0.21 0.63 0.00 0.00 0.70 0.00 0.00 55.95 57.48 2d93 s SER 3 Cb -0.09 -2.01 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 2d93 s SER 3 CO 0.12 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.65 2d93 n GLY 4 N -2.07 3.87 1.75 9.45 0.00 -1.26 -5.02 105.19 111.91 2d93 n GLY 4 Ca -0.01 -1.07 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 2d93 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d93 n SER 5 N -0.15 5.75 -4.89 1.61 7.64 -1.26 -4.91 113.62 117.41 2d93 n SER 5 Ca 0.00 -2.67 -0.29 0.00 1.01 0.00 0.00 58.87 56.92 2d93 n SER 5 Cb 0.00 -1.15 -0.01 0.00 -1.01 0.00 0.00 64.21 62.04 2d93 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d93 s SER 6 N 1.34 6.36 0.00 6.43 0.01 -1.26 -5.03 113.70 121.55 2d93 s SER 6 Ca 0.22 1.05 0.00 0.00 1.31 0.00 0.00 55.95 58.53 2d93 s SER 6 Cb 0.14 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 64.07 2d93 s SER 6 CO -0.02 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 173.71 2d93 n GLY 7 N -1.92 3.82 0.15 3.44 0.00 -1.26 -4.95 105.19 104.47 2d93 n GLY 7 Ca 0.02 -0.79 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 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 0.57 -2.62 1.61 3.58 -2.05 -3.39 116.42 114.13 2d93 h ASP 8 Ca 0.00 -0.69 -0.60 0.00 0.42 0.00 0.00 57.03 56.15 2d93 h ASP 8 Cb 0.00 -0.17 -0.41 0.00 1.72 0.00 0.00 39.33 40.47 2d93 h ASP 8 CO 0.00 1.18 -0.73 0.47 -2.88 0.00 0.00 179.24 177.29 2d93 n ASP 9 N -4.23 2.08 0.16 2.28 8.00 -1.26 -4.95 116.55 118.63 2d93 n ASP 9 Ca -0.09 -3.02 -0.12 0.00 0.71 0.00 0.00 54.79 52.27 2d93 n ASP 9 Cb 0.63 -0.68 -0.07 0.00 -0.02 0.00 0.00 41.12 40.97 2d93 n ASP 9 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2d93 h ASP 10 N 5.04 -0.38 -0.81 -2.24 3.58 -1.93 -3.26 116.42 116.43 2d93 h ASP 10 Ca 0.18 -0.17 0.16 0.00 0.42 0.00 0.00 57.03 57.62 2d93 h ASP 10 Cb 0.78 0.10 -0.15 0.00 1.72 0.00 0.00 39.33 41.78 2d93 h ASP 10 CO 0.64 0.03 -0.21 0.40 -2.88 0.00 0.00 179.24 177.22 2d93 h ILE 11 N -0.88 0.18 -0.74 2.25 2.04 -1.96 0.17 117.51 118.58 2d93 h ILE 11 Ca -0.05 0.00 0.16 0.00 1.00 0.00 0.00 64.86 65.97 2d93 h ILE 11 Cb 0.53 0.18 -0.14 0.00 -0.74 0.00 0.00 36.82 36.65 2d93 h ILE 11 CO 0.08 0.00 -0.10 -0.33 0.00 0.00 0.00 178.15 177.80 2d93 h GLU 12 N -0.01 0.04 -0.38 2.37 4.39 -1.98 0.12 114.58 119.14 2d93 h GLU 12 Ca 0.38 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.09 2d93 h GLU 12 Cb 0.59 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 2d93 h GLU 12 CO -0.83 0.03 0.23 1.96 -1.16 0.00 0.00 179.01 179.24 2d93 h GLN 13 N 0.04 0.46 0.43 2.33 4.20 -0.71 -2.86 115.11 119.00 2d93 h GLN 13 Ca 0.38 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.06 2d93 h GLN 13 Cb 0.63 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 2d93 h GLN 13 CO -0.71 0.30 -0.42 -0.07 -0.67 0.00 0.00 178.83 177.26 2d93 h LEU 14 N 0.47 -1.13 -0.22 1.46 3.38 -0.35 -2.98 115.31 115.94 2d93 h LEU 14 Ca 0.15 0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.23 2d93 h LEU 14 Cb -0.02 0.37 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2d93 h LEU 14 CO -0.06 -0.57 -0.16 -0.07 0.09 0.00 0.00 178.44 177.67 2d93 h LEU 15 N -0.86 -0.58 -1.77 1.67 3.38 -1.02 0.90 115.31 117.04 2d93 h LEU 15 Ca -0.04 0.08 0.51 0.00 0.09 0.00 0.00 57.88 58.53 2d93 h LEU 15 Cb 0.76 0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.69 2d93 h LEU 15 CO -0.06 -0.08 1.37 -0.62 0.09 0.00 0.00 178.44 179.14 2d93 n GLU 16 N -3.57 0.00 0.01 1.13 1.02 -1.09 0.22 120.64 118.36 2d93 n GLU 16 Ca -0.00 1.06 -0.16 0.00 -0.02 0.00 0.00 57.16 58.03 2d93 n GLU 16 Cb 0.08 -2.49 -0.14 0.00 -0.02 0.00 0.00 31.44 28.87 2d93 n GLU 16 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2d93 h PHE 17 N 0.00 0.32 0.46 -0.32 3.04 0.67 -3.33 116.94 117.78 2d93 h PHE 17 Ca 0.84 -0.23 -0.02 0.00 3.98 0.00 0.00 57.97 62.53 2d93 h PHE 17 Cb 3.58 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 42.08 2d93 h PHE 17 CO 0.00 1.46 -0.22 0.52 -2.02 0.00 0.00 178.31 178.05 2d93 h MET 18 N 0.05 -0.60 -1.00 1.11 2.86 0.80 -3.00 114.93 115.15 2d93 h MET 18 Ca -0.35 0.04 0.34 0.00 -2.06 0.00 0.00 59.70 57.67 2d93 h MET 18 Cb 2.03 0.14 -0.16 0.00 0.06 0.00 0.00 31.60 33.67 2d93 h MET 18 CO 0.10 -0.40 0.54 1.12 1.06 0.00 0.00 176.91 179.32 2d93 h HIS 19 N -0.67 0.86 -0.62 -0.22 2.07 -1.48 0.42 115.15 115.49 2d93 h HIS 19 Ca -0.06 0.04 0.12 0.00 -2.85 0.00 0.00 60.37 57.61 2d93 h HIS 19 Cb 0.48 -0.21 -0.09 0.00 2.57 0.00 0.00 27.41 30.15 2d93 h HIS 19 CO 0.10 -0.26 0.15 1.96 -3.07 0.00 0.00 177.93 176.82 2d93 h GLN 20 N 0.23 0.28 -6.88 5.12 1.08 -1.64 -3.36 115.11 109.93 2d93 h GLN 20 Ca 0.75 -0.02 -0.49 0.00 -1.45 0.00 0.00 58.65 57.45 2d93 h GLN 20 Cb 1.78 -0.06 0.01 0.00 -0.05 0.00 0.00 27.48 29.15 2d93 h GLN 20 CO -0.65 0.18 0.41 -0.51 -0.95 0.00 0.00 178.83 177.30 2d93 s LEU 21 N -10.51 4.34 0.25 1.46 1.43 0.15 -4.93 118.68 110.86 2d93 s LEU 21 Ca -0.13 2.04 0.03 0.00 -1.03 0.00 0.00 54.13 55.04 2d93 s LEU 21 Cb 0.18 -3.95 0.31 0.00 0.03 0.00 0.00 46.19 42.76 2d93 s LEU 21 CO 0.74 -0.24 1.63 1.55 0.23 0.00 0.00 176.35 180.26 2d93 h PRO 22 N 3.15 0.38 0.00 1.29 0.13 -1.80 0.11 132.00 135.26 2d93 h PRO 22 Ca -0.47 -0.20 -0.02 0.00 -0.87 0.00 0.00 66.00 64.44 2d93 h PRO 22 Cb 1.21 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2d93 h PRO 22 CO 0.65 0.76 -0.09 0.00 -0.23 0.00 0.00 178.00 179.09 2d93 h ALA 23 N 1.22 1.29 0.00 -0.56 0.00 -1.90 -2.86 119.26 116.44 2d93 h ALA 23 Ca 0.02 -0.08 -0.40 0.00 0.00 0.00 0.00 54.91 54.46 2d93 h ALA 23 Cb 0.91 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 2d93 h ALA 23 CO 0.08 0.11 -2.46 1.19 0.00 0.00 0.00 179.25 178.16 2d93 n PHE 24 N -3.61 0.00 -0.27 0.00 3.72 -1.09 -4.38 117.46 111.83 2d93 n PHE 24 Ca -0.02 0.00 0.28 0.00 -0.05 0.00 0.00 57.45 57.66 2d93 n PHE 24 Cb 0.21 -0.98 0.65 0.00 -0.94 0.00 0.00 39.48 38.41 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 -0.15 2.69 -0.88 4.37 0.00 -0.70 0.27 119.26 124.86 2d93 h ALA 25 Ca -0.59 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 54.51 2d93 h ALA 25 Cb 1.84 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 19.57 2d93 h ALA 25 CO -0.14 -1.02 0.40 -0.97 0.00 0.00 0.00 179.25 177.52 2d93 h ASN 26 N 0.15 0.37 -4.17 0.00 -1.24 -1.71 -3.41 115.58 105.58 2d93 h ASN 26 Ca 0.52 0.14 -0.50 0.00 0.71 0.00 0.00 56.30 57.16 2d93 h ASN 26 Cb 1.76 0.10 0.06 0.00 0.73 0.00 0.00 38.32 40.97 2d93 h ASN 26 CO -0.10 0.06 0.34 -0.04 -1.29 0.00 0.00 177.43 176.40 2d93 s MET 27 N -5.92 3.50 0.48 6.67 -1.94 0.08 -5.07 119.30 117.11 2d93 s MET 27 Ca -0.12 0.58 -0.05 0.00 -1.71 0.00 0.00 55.69 54.40 2d93 s MET 27 Cb 0.24 -2.15 -0.03 0.00 2.01 0.00 0.00 34.83 34.90 2d93 s MET 27 CO 0.78 -0.53 0.77 -0.08 -0.01 0.00 0.00 175.02 175.95 2d93 s THR 28 N -3.09 4.79 0.02 2.05 -1.32 -1.26 -4.83 115.64 112.00 2d93 s THR 28 Ca 0.53 0.10 -0.03 0.00 -1.21 0.00 0.00 61.69 61.08 2d93 s THR 28 Cb -0.11 -3.82 -0.01 0.00 -1.51 0.00 0.00 72.50 67.06 2d93 s THR 28 CO 0.51 -0.77 0.78 0.80 -2.21 0.00 0.00 174.62 173.73 2d93 n MET 29 N -2.24 -0.05 -0.07 7.08 1.56 -1.26 -1.28 117.12 120.86 2d93 n MET 29 Ca 0.00 0.77 -0.02 0.00 -0.27 0.00 0.00 57.70 58.19 2d93 n MET 29 Cb 0.55 -1.16 -0.02 0.00 2.15 0.00 0.00 33.22 34.75 2d93 n MET 29 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 2d93 n SER 30 N -3.05 -0.17 -0.37 6.12 7.64 -1.26 -0.49 113.62 122.04 2d93 n SER 30 Ca 0.00 0.95 -0.05 0.00 1.01 0.00 0.00 58.87 60.78 2d93 n SER 30 Cb 0.03 -0.37 -0.01 0.00 -1.01 0.00 0.00 64.21 62.85 2d93 n SER 30 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2d93 h VAL 31 N 0.00 0.01 -0.84 0.44 2.07 -1.54 0.20 116.25 116.59 2d93 h VAL 31 Ca 0.03 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.69 2d93 h VAL 31 Cb 0.06 0.01 -0.15 0.00 -1.52 0.00 0.00 31.29 29.70 2d93 h VAL 31 CO -0.15 0.00 -0.31 0.03 0.02 0.00 0.00 177.57 177.16 2d93 h ARG 32 N -0.03 -0.04 0.73 1.57 3.08 0.26 -0.73 114.38 119.23 2d93 h ARG 32 Ca 0.27 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.29 2d93 h ARG 32 Cb 0.54 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.60 2d93 h ARG 32 CO -0.94 -0.03 -0.35 -0.09 -1.07 0.00 0.00 179.97 177.49 2d93 h ARG 33 N -0.04 -0.95 -1.00 0.04 2.43 -0.05 -2.68 114.38 112.13 2d93 h ARG 33 Ca 0.34 0.06 0.37 0.00 -0.81 0.00 0.00 59.98 59.95 2d93 h ARG 33 Cb 0.60 0.22 -0.18 0.00 -0.42 0.00 0.00 29.97 30.18 2d93 h ARG 33 CO -0.87 -0.61 0.36 0.93 -1.51 0.00 0.00 179.97 178.27 2d93 h GLU 34 N -1.08 0.01 -0.31 0.20 5.08 -0.03 0.85 114.58 119.28 2d93 h GLU 34 Ca -0.10 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 2d93 h GLU 34 Cb 0.77 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2d93 h GLU 34 CO 0.17 0.00 0.08 -0.07 -1.00 0.00 0.00 179.01 178.19 2d93 h LEU 35 N 0.01 0.47 -1.83 1.33 3.38 -0.97 -2.51 115.31 115.19 2d93 h LEU 35 Ca 0.76 -0.23 0.22 0.00 0.09 0.00 0.00 57.88 58.73 2d93 h LEU 35 Cb 1.89 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.48 2d93 h LEU 35 CO -0.83 0.58 0.70 0.00 0.09 0.00 0.00 178.44 178.98 2d93 h SER 37 N 0.00 0.55 -0.24 0.00 0.87 -1.18 -3.06 113.55 110.48 2d93 h SER 37 Ca 0.37 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.67 2d93 h SER 37 Cb 1.77 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.56 2d93 h SER 37 CO -0.00 0.85 -0.01 1.33 -0.53 0.00 0.00 176.83 178.47 2d93 n VAL 38 N -4.06 2.29 -2.97 2.23 0.24 0.20 -4.96 118.33 111.29 2d93 n VAL 38 Ca -0.01 -2.08 -0.43 0.00 -2.04 0.00 0.00 64.34 59.78 2d93 n VAL 38 Cb 0.48 -0.27 -0.05 0.00 -1.47 0.00 0.00 33.84 32.52 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 -2.91 3.46 0.30 7.34 -1.94 0.42 -4.34 119.30 121.63 2d93 s MET 39 Ca 0.41 -0.05 -0.22 0.00 -1.71 0.00 0.00 55.69 54.12 2d93 s MET 39 Cb 0.35 -3.92 -0.09 0.00 2.01 0.00 0.00 34.83 33.18 2d93 s MET 39 CO 0.07 -1.07 0.85 0.42 -0.01 0.00 0.00 175.02 175.28 2d93 s ILE 40 N 3.23 4.40 -0.24 2.53 1.09 0.63 -4.91 121.20 127.93 2d93 s ILE 40 Ca 0.30 1.52 -0.12 0.00 -1.10 0.00 0.00 60.65 61.24 2d93 s ILE 40 Cb -0.12 -3.88 -0.05 0.00 -1.06 0.00 0.00 42.46 37.35 2d93 s ILE 40 CO 0.22 0.09 0.25 -0.36 -0.10 0.00 0.00 174.94 175.03 2d93 s PHE 41 N -1.67 3.30 -0.03 3.97 0.08 -1.26 -2.35 117.98 120.01 2d93 s PHE 41 Ca 0.49 0.32 -0.02 0.00 0.12 0.00 0.00 56.93 57.84 2d93 s PHE 41 Cb -0.16 -2.39 0.02 0.00 -0.57 0.00 0.00 43.02 39.91 2d93 s PHE 41 CO 0.21 -0.04 0.08 -1.21 -0.10 0.00 0.00 175.22 174.17 2d93 s GLU 42 N 1.40 0.07 0.01 0.44 0.41 -0.87 -5.00 118.70 115.16 2d93 s GLU 42 Ca 0.11 0.17 -0.00 0.00 -0.41 0.00 0.00 54.97 54.84 2d93 s GLU 42 Cb -0.15 -0.04 -0.01 0.00 -1.78 0.00 0.00 34.13 32.15 2d93 s GLU 42 CO 0.07 -0.06 -0.02 0.08 -0.49 0.00 0.00 175.26 174.84 2d93 s VAL 43 N 0.40 0.08 -0.16 2.63 1.01 -1.26 -0.44 120.40 122.65 2d93 s VAL 43 Ca -0.03 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.28 2d93 s VAL 43 Cb -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.13 2d93 s VAL 43 CO -0.01 -0.36 -0.09 -0.69 0.00 0.00 0.00 175.10 173.95 2d93 s VAL 44 N -1.05 3.31 -0.20 2.92 1.01 0.53 -5.00 120.40 121.92 2d93 s VAL 44 Ca -0.11 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 2d93 s VAL 44 Cb -0.07 -2.43 -0.21 0.00 0.00 0.00 0.00 36.38 33.67 2d93 s VAL 44 CO -0.01 0.50 0.06 -0.62 0.00 0.00 0.00 175.10 175.03 2d93 n GLU 45 N 3.82 0.68 -2.76 2.72 1.02 -1.26 -2.09 120.64 122.77 2d93 n GLU 45 Ca -0.18 0.26 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 2d93 n GLU 45 Cb 0.52 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 30.28 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 3.52 1.23 3.49 -0.21 -1.26 -4.12 119.66 119.80 2d93 s GLN 46 Ca -0.29 0.16 -0.18 0.00 0.02 0.00 0.00 55.36 55.06 2d93 s GLN 46 Cb 0.08 -3.96 0.27 0.00 1.00 0.00 0.00 33.01 30.41 2d93 s GLN 46 CO 0.66 -1.36 0.61 0.00 -2.12 0.00 0.00 175.29 173.08 2d93 n ALA 47 N 7.49 -2.85 -1.20 6.09 0.00 -1.26 -2.98 120.51 125.80 2d93 n ALA 47 Ca 0.07 -1.46 -0.09 0.00 0.00 0.00 0.00 53.44 51.96 2d93 n ALA 47 Cb 0.48 -1.25 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 2d93 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d93 n GLY 48 N 2.12 0.88 3.77 0.00 0.00 -1.17 -4.89 105.19 105.90 2d93 n GLY 48 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.72 3.25 -0.24 4.61 0.00 -1.16 -4.62 121.76 121.88 2d93 s ALA 49 Ca 0.00 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.44 2d93 s ALA 49 Cb 0.00 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.85 2d93 s ALA 49 CO 0.00 -0.13 1.03 0.42 0.00 0.00 0.00 175.76 177.08 2d93 s ILE 50 N -1.40 4.66 -0.06 0.00 1.09 -1.26 -1.49 121.20 122.73 2d93 s ILE 50 Ca 0.50 1.96 -0.07 0.00 -1.10 0.00 0.00 60.65 61.94 2d93 s ILE 50 Cb -0.26 -4.32 -0.28 0.00 -1.06 0.00 0.00 42.46 36.54 2d93 s ILE 50 CO 0.33 -0.22 0.62 0.40 -0.10 0.00 0.00 174.94 175.97 2d93 h ILE 51 N 5.49 0.88 -2.58 2.92 1.08 -1.42 -3.48 117.51 120.40 2d93 h ILE 51 Ca -0.19 -2.53 -0.10 0.00 -0.39 0.00 0.00 64.86 61.64 2d93 h ILE 51 Cb 1.06 2.67 -0.25 0.00 -3.07 0.00 0.00 36.82 37.23 2d93 h ILE 51 CO 0.98 0.84 -0.23 -0.76 -0.69 0.00 0.00 178.15 178.29 2d93 s LEU 52 N -7.09 -0.05 0.35 1.44 1.43 -1.24 -4.98 118.68 108.53 2d93 s LEU 52 Ca -0.16 0.96 -0.07 0.00 -1.03 0.00 0.00 54.13 53.83 2d93 s LEU 52 Cb 0.06 1.51 -0.05 0.00 0.03 0.00 0.00 46.19 47.74 2d93 s LEU 52 CO 0.83 -0.19 0.64 -1.61 0.23 0.00 0.00 176.35 176.26 2d93 s GLU 53 N 1.04 3.67 0.14 1.70 2.02 -1.26 -1.13 118.70 124.87 2d93 s GLU 53 Ca -0.06 0.16 -0.31 0.00 0.02 0.00 0.00 54.97 54.77 2d93 s GLU 53 Cb -0.06 -2.54 -0.10 0.00 0.10 0.00 0.00 34.13 31.53 2d93 s GLU 53 CO -0.09 0.09 1.63 0.16 0.02 0.00 0.00 175.26 177.07 2d93 s ASP 54 N -3.27 6.56 0.00 -0.19 -4.77 -1.09 -2.18 116.67 111.72 2d93 s ASP 54 Ca 0.46 2.61 0.00 0.00 -3.30 0.00 0.00 52.55 52.33 2d93 s ASP 54 Cb -0.10 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.14 2d93 s ASP 54 CO 0.32 -0.87 0.00 0.61 0.70 0.00 0.00 175.17 175.93 2d93 n GLY 55 N 3.88 0.60 3.59 2.12 0.00 0.32 -4.96 105.19 110.74 2d93 n GLY 55 Ca 0.15 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.19 3.81 -0.84 1.61 0.74 -0.93 -4.78 119.66 118.09 2d93 s GLN 56 Ca 0.00 0.31 -0.25 0.00 0.05 0.00 0.00 55.36 55.47 2d93 s GLN 56 Cb 0.00 -3.77 -0.17 0.00 1.10 0.00 0.00 33.01 30.17 2d93 s GLN 56 CO 0.00 -0.72 2.34 -1.91 -0.55 0.00 0.00 175.29 174.45 2d93 n GLU 57 N 6.16 0.45 -1.66 1.67 2.13 -1.26 -2.15 120.64 125.98 2d93 n GLU 57 Ca 0.01 -0.92 -0.48 0.00 0.66 0.00 0.00 57.16 56.43 2d93 n GLU 57 Cb 0.48 -3.54 -0.05 0.00 0.27 0.00 0.00 31.44 28.60 2d93 n GLU 57 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2d93 n LEU 58 N 18.00 3.36 -0.00 4.31 4.77 -0.89 -4.81 117.00 141.75 2d93 n LEU 58 Ca 0.47 0.88 0.00 0.00 -0.03 0.00 0.00 56.01 57.33 2d93 n LEU 58 Cb 0.42 -1.38 -0.01 0.00 -2.33 0.00 0.00 43.42 40.12 2d93 n LEU 58 CO 0.58 -0.13 -0.52 -0.67 -1.33 0.00 0.00 177.39 175.32 2d93 n ASP 59 N 7.24 4.71 -4.47 -1.43 -0.08 -1.26 -4.02 116.55 117.23 2d93 n ASP 59 Ca 0.24 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 53.23 2d93 n ASP 59 Cb 0.30 0.92 -0.12 0.00 2.34 0.00 0.00 41.12 44.57 2d93 n ASP 59 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2d93 s SER 60 N -2.40 3.78 -0.05 1.67 0.01 -1.26 -3.06 113.70 112.39 2d93 s SER 60 Ca -0.00 -0.55 -0.19 0.00 1.31 0.00 0.00 55.95 56.52 2d93 s SER 60 Cb 0.01 -0.52 -0.05 0.00 0.21 0.00 0.00 66.02 65.67 2d93 s SER 60 CO 0.05 0.20 0.55 0.86 0.41 0.00 0.00 173.24 175.31 2d93 s TRP 61 N -1.07 3.62 -0.10 2.43 -0.00 -0.93 -3.28 118.94 119.61 2d93 s TRP 61 Ca 0.16 1.08 0.03 0.00 -0.00 0.00 0.00 56.10 57.37 2d93 s TRP 61 Cb -0.10 -2.58 -0.01 0.00 -0.00 0.00 0.00 33.47 30.77 2d93 s TRP 61 CO 0.08 0.29 -0.18 0.71 -0.00 0.00 0.00 176.95 177.85 2d93 s TYR 62 N 0.11 2.66 -0.14 5.86 1.51 0.20 -2.72 117.35 124.83 2d93 s TYR 62 Ca 0.29 -0.69 -0.01 0.00 -1.01 0.00 0.00 57.07 55.66 2d93 s TYR 62 Cb -0.17 -1.73 0.03 0.00 -0.11 0.00 0.00 41.96 39.98 2d93 s TYR 62 CO 0.15 -0.21 -0.06 0.08 -1.11 0.00 0.00 175.55 174.39 2d93 s VAL 63 N 0.10 1.05 -0.48 0.71 1.01 -1.15 -0.58 120.40 121.05 2d93 s VAL 63 Ca -0.08 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.16 2d93 s VAL 63 Cb -0.15 -1.14 -0.10 0.00 0.00 0.00 0.00 36.38 34.98 2d93 s VAL 63 CO 0.05 0.25 2.36 -0.38 0.00 0.00 0.00 175.10 177.38 2d93 n ILE 64 N 4.92 0.08 0.08 2.22 5.41 -1.21 -3.19 119.36 127.66 2d93 n ILE 64 Ca -0.12 -0.45 -0.16 0.00 1.00 0.00 0.00 62.75 63.02 2d93 n ILE 64 Cb 0.49 -2.04 -0.14 0.00 -0.71 0.00 0.00 39.64 37.24 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 15.40 0.40 -7.00 1.39 3.38 -1.78 -3.24 115.31 123.86 2d93 h LEU 65 Ca -0.25 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.23 2d93 h LEU 65 Cb 1.29 -0.13 -0.23 0.00 0.09 0.00 0.00 40.66 41.68 2d93 h LEU 65 CO 1.12 1.41 0.31 0.21 0.09 0.00 0.00 178.44 181.57 2d93 s ASN 66 N -7.03 -0.58 0.00 -0.43 2.47 -1.15 -4.90 114.94 103.32 2d93 s ASN 66 Ca -0.07 1.06 0.00 0.00 0.42 0.00 0.00 52.86 54.27 2d93 s ASN 66 Cb 0.07 1.05 0.00 0.00 -1.45 0.00 0.00 41.25 40.92 2d93 s ASN 66 CO 0.86 -0.24 0.00 0.61 -3.72 0.00 0.00 177.10 174.62 2d93 n GLY 67 N 2.21 -1.70 3.00 1.21 0.00 -1.26 -2.02 105.19 106.63 2d93 n GLY 67 Ca -0.13 -2.05 -0.19 0.00 0.00 0.00 0.00 46.02 43.65 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 0.00 0.70 -0.06 2.61 2.01 -1.26 -3.58 115.64 116.06 2d93 s THR 68 Ca 0.00 -0.35 0.05 0.00 0.31 0.00 0.00 61.69 61.71 2d93 s THR 68 Cb 0.00 -0.60 -0.01 0.00 0.01 0.00 0.00 72.50 71.90 2d93 s THR 68 CO 0.00 0.21 -0.22 0.68 -0.69 0.00 0.00 174.62 174.59 2d93 s VAL 69 N -0.01 1.85 -0.14 3.82 -7.23 -1.25 -0.49 120.40 116.96 2d93 s VAL 69 Ca 0.00 -0.95 -0.05 0.00 -1.81 0.00 0.00 61.98 59.17 2d93 s VAL 69 Cb -0.06 -1.58 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 2d93 s VAL 69 CO -0.00 0.52 0.03 -0.70 -0.31 0.00 0.00 175.10 174.64 2d93 s GLU 70 N -0.06 3.58 -0.10 4.82 2.12 0.10 -2.64 118.70 126.53 2d93 s GLU 70 Ca -0.05 -0.38 -0.00 0.00 0.36 0.00 0.00 54.97 54.90 2d93 s GLU 70 Cb -0.13 -3.03 -0.03 0.00 0.26 0.00 0.00 34.13 31.20 2d93 s GLU 70 CO 0.04 0.44 -0.08 0.42 -0.54 0.00 0.00 175.26 175.53 2d93 s ILE 71 N -0.12 3.57 -0.08 -3.70 1.01 0.58 -0.72 121.20 121.73 2d93 s ILE 71 Ca 0.06 -0.51 0.05 0.00 0.00 0.00 0.00 60.65 60.24 2d93 s ILE 71 Cb -0.12 -2.48 -0.00 0.00 0.01 0.00 0.00 42.46 39.86 2d93 s ILE 71 CO 0.02 0.56 -0.22 -0.55 0.00 0.00 0.00 174.94 174.74 2d93 s SER 72 N -0.33 2.85 0.03 3.58 0.15 0.54 -0.62 113.70 119.88 2d93 s SER 72 Ca 0.04 -0.49 -0.00 0.00 0.70 0.00 0.00 55.95 56.20 2d93 s SER 72 Cb -0.13 -1.07 -0.04 0.00 -1.71 0.00 0.00 66.02 63.07 2d93 s SER 72 CO 0.02 0.17 0.14 -1.00 1.20 0.00 0.00 173.24 173.77 2d93 s HIS 73 N 0.17 3.38 0.03 3.44 3.76 0.16 -0.39 115.29 125.84 2d93 s HIS 73 Ca -0.12 0.22 0.33 0.00 -0.15 0.00 0.00 55.06 55.34 2d93 s HIS 73 Cb -0.16 -1.74 1.35 0.00 1.11 0.00 0.00 32.58 33.14 2d93 s HIS 73 CO 0.06 0.58 1.96 -1.00 -0.85 0.00 0.00 174.74 175.48 2d93 h PRO 74 N 3.61 0.00 0.03 8.40 0.13 -1.86 -3.10 132.00 139.21 2d93 h PRO 74 Ca -0.48 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.52 2d93 h PRO 74 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.32 2d93 h PRO 74 CO 0.68 0.00 -0.54 -0.44 -0.23 0.00 0.00 178.00 177.47 2d93 h ASP 75 N 0.00 0.42 0.00 1.44 3.32 -1.94 -3.47 116.42 116.18 2d93 h ASP 75 Ca 0.00 -0.82 0.00 0.00 0.02 0.00 0.00 57.03 56.23 2d93 h ASP 75 Cb 0.47 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2d93 h ASP 75 CO 0.00 1.19 0.00 0.61 -1.72 0.00 0.00 179.24 179.32 2d93 n GLY 76 N 1.21 0.00 3.15 2.75 0.00 -1.17 -5.16 105.19 105.97 2d93 n GLY 76 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 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 0.99 -0.10 1.61 2.20 -1.26 -4.99 119.74 118.19 2d93 s LYS 77 Ca 0.00 -0.76 0.01 0.00 -0.36 0.00 0.00 55.97 54.86 2d93 s LYS 77 Cb 0.00 -1.00 0.02 0.00 -1.51 0.00 0.00 37.83 35.33 2d93 s LYS 77 CO 0.00 0.25 -0.12 0.08 -0.36 0.00 0.00 175.35 175.20 2d93 s VAL 78 N -0.82 1.27 -0.14 4.02 1.01 -1.26 0.38 120.40 124.86 2d93 s VAL 78 Ca 0.02 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2d93 s VAL 78 Cb -0.08 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2d93 s VAL 78 CO 0.01 0.40 0.11 -1.61 0.00 0.00 0.00 175.10 174.01 2d93 s GLU 79 N 1.08 3.59 -0.24 2.72 8.01 0.20 -4.94 118.70 129.13 2d93 s GLU 79 Ca -0.06 -0.21 -0.02 0.00 0.01 0.00 0.00 54.97 54.69 2d93 s GLU 79 Cb -0.15 -3.18 0.02 0.00 -4.31 0.00 0.00 34.13 26.51 2d93 s GLU 79 CO -0.02 0.61 -0.07 0.54 0.01 0.00 0.00 175.26 176.33 2d93 s ASN 80 N -0.56 4.23 0.34 -0.19 4.22 -1.26 -0.31 114.94 121.41 2d93 s ASN 80 Ca 0.12 -0.77 0.08 0.00 -2.14 0.00 0.00 52.86 50.14 2d93 s ASN 80 Cb -0.12 -1.67 -0.03 0.00 1.28 0.00 0.00 41.25 40.72 2d93 s ASN 80 CO 0.02 -0.10 0.29 -0.76 -2.04 0.00 0.00 177.10 174.51 2d93 s LEU 81 N 1.35 3.56 0.19 3.54 1.43 -1.08 -5.06 118.68 122.61 2d93 s LEU 81 Ca 0.02 -0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 52.51 2d93 s LEU 81 Cb -0.16 -2.17 -0.02 0.00 0.03 0.00 0.00 46.19 43.88 2d93 s LEU 81 CO -0.05 -0.37 0.28 -0.36 0.23 0.00 0.00 176.35 176.08 2d93 s PHE 82 N -2.32 0.58 -0.41 0.29 0.08 -1.26 -3.79 117.98 111.14 2d93 s PHE 82 Ca 0.41 -0.92 -0.42 0.00 0.12 0.00 0.00 56.93 56.12 2d93 s PHE 82 Cb -0.05 -0.14 -0.17 0.00 -0.57 0.00 0.00 43.02 42.09 2d93 s PHE 82 CO 0.26 -0.75 1.87 -0.12 -0.10 0.00 0.00 175.22 176.39 2d93 n MET 83 N -0.25 0.51 0.00 0.44 0.00 -1.24 -1.35 117.12 115.24 2d93 n MET 83 Ca -0.04 0.17 0.00 0.00 -0.00 0.00 0.00 57.70 57.83 2d93 n MET 83 Cb 0.63 -1.83 0.00 0.00 0.00 0.00 0.00 33.22 32.03 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 5.33 1.53 3.64 -5.12 0.00 -1.22 -5.08 105.19 104.27 2d93 n GLY 84 Ca 0.37 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.50 1.66 -0.09 1.61 -0.87 -0.45 -4.17 114.94 112.13 2d93 s ASN 85 Ca 0.00 0.81 -0.08 0.00 -1.57 0.00 0.00 52.86 52.02 2d93 s ASN 85 Cb 0.00 -1.20 0.02 0.00 -0.02 0.00 0.00 41.25 40.05 2d93 s ASN 85 CO 0.00 -3.68 0.24 -0.94 -2.57 0.00 0.00 177.10 170.14 2d93 s SER 86 N -3.80 -0.25 -0.01 -1.22 1.04 -1.26 -3.35 113.70 104.85 2d93 s SER 86 Ca 0.69 0.48 -0.10 0.00 0.48 0.00 0.00 55.95 57.50 2d93 s SER 86 Cb -0.13 0.48 0.01 0.00 0.10 0.00 0.00 66.02 66.49 2d93 s SER 86 CO 0.56 -0.09 0.20 0.72 0.98 0.00 0.00 173.24 175.62 2d93 s PHE 87 N 0.17 -0.06 0.00 5.02 -0.71 0.25 -5.02 117.98 117.63 2d93 s PHE 87 Ca -0.00 0.07 0.00 0.00 -1.04 0.00 0.00 56.93 55.96 2d93 s PHE 87 Cb -0.02 0.01 0.00 0.00 -1.21 0.00 0.00 43.02 41.80 2d93 s PHE 87 CO -0.00 -0.30 0.00 0.41 -1.34 0.00 0.00 175.22 173.98 2d93 n GLY 88 N 1.54 0.61 4.01 1.99 0.00 -1.26 -0.63 105.19 111.45 2d93 n GLY 88 Ca -0.21 -0.90 -0.23 0.00 0.00 0.00 0.00 46.02 44.68 2d93 n GLY 88 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2d93 s ILE 89 N 0.00 2.04 0.27 -0.61 -4.36 -1.20 -4.96 121.20 112.38 2d93 s ILE 89 Ca 0.00 -0.73 0.09 0.00 -0.26 0.00 0.00 60.65 59.75 2d93 s ILE 89 Cb 0.00 -2.31 -0.04 0.00 1.25 0.00 0.00 42.46 41.35 2d93 s ILE 89 CO 0.00 0.00 0.08 0.42 0.24 0.00 0.00 174.94 175.68 2d93 s THR 90 N -3.04 3.71 -2.00 8.37 -4.23 -1.26 -4.82 115.64 112.37 2d93 s THR 90 Ca 0.66 -1.73 0.12 0.00 -1.18 0.00 0.00 61.69 59.56 2d93 s THR 90 Cb -0.05 -3.03 0.33 0.00 1.34 0.00 0.00 72.50 71.10 2d93 s THR 90 CO 0.43 -0.34 1.13 -0.81 -0.54 0.00 0.00 174.62 174.49 2d93 n PRO 91 N -1.02 0.49 -4.00 3.99 -0.04 -1.26 -4.70 135.00 128.47 2d93 n PRO 91 Ca -0.06 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.04 2d93 n PRO 91 Cb 0.59 -1.38 -0.07 0.00 -0.04 0.00 0.00 33.50 32.60 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 5.15 0.59 0.52 -4.23 -1.26 -4.04 115.64 110.37 2d93 s THR 92 Ca 0.18 0.08 0.33 0.00 -1.18 0.00 0.00 61.69 61.09 2d93 s THR 92 Cb 0.08 -3.24 0.48 0.00 1.34 0.00 0.00 72.50 71.16 2d93 s THR 92 CO 0.14 0.59 1.51 -0.07 -0.54 0.00 0.00 174.62 176.24 2d93 h LEU 93 N 5.33 0.00 -9.70 4.79 3.38 -1.94 -3.41 115.31 113.76 2d93 h LEU 93 Ca -0.51 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 56.91 2d93 h LEU 93 Cb 1.21 0.00 0.20 0.00 0.09 0.00 0.00 40.66 42.16 2d93 h LEU 93 CO 0.60 0.00 -0.56 0.47 0.09 0.00 0.00 178.44 179.04 2d93 n ASP 94 N -3.55 -1.88 -4.99 -0.43 8.00 -1.26 -5.01 116.55 107.42 2d93 n ASP 94 Ca 0.25 0.43 -0.19 0.00 0.71 0.00 0.00 54.79 56.00 2d93 n ASP 94 Cb 1.47 -1.19 0.02 0.00 -0.02 0.00 0.00 41.12 41.40 2d93 n ASP 94 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2d93 s LYS 95 N -3.19 2.55 0.17 -1.24 1.02 -1.26 -4.75 119.74 113.04 2d93 s LYS 95 Ca 0.60 -1.49 -0.10 0.00 0.02 0.00 0.00 55.97 54.99 2d93 s LYS 95 Cb -0.27 -2.61 -0.00 0.00 -0.52 0.00 0.00 37.83 34.43 2d93 s LYS 95 CO 0.64 -0.50 0.32 -0.65 -0.92 0.00 0.00 175.35 174.24 2d93 s GLN 96 N -4.43 1.20 -0.04 1.68 1.11 -1.26 -4.98 119.66 112.95 2d93 s GLN 96 Ca 0.55 -1.15 0.01 0.00 0.01 0.00 0.00 55.36 54.78 2d93 s GLN 96 Cb -0.07 0.40 0.02 0.00 -1.01 0.00 0.00 33.01 32.35 2d93 s GLN 96 CO 0.33 -0.45 -0.03 0.71 0.01 0.00 0.00 175.29 175.87 2d93 s TYR 97 N -3.96 0.57 -0.14 0.91 2.02 -1.26 -2.09 117.35 113.39 2d93 s TYR 97 Ca 0.17 -0.12 -0.29 0.00 -0.37 0.00 0.00 57.07 56.46 2d93 s TYR 97 Cb 0.03 -0.56 -0.07 0.00 -0.40 0.00 0.00 41.96 40.96 2d93 s TYR 97 CO 0.00 -0.16 2.13 -0.12 -1.57 0.00 0.00 175.55 175.83 2d93 n MET 98 N 4.07 2.22 -0.80 -0.62 1.56 -0.91 -4.84 117.12 117.80 2d93 n MET 98 Ca -0.26 0.70 -0.16 0.00 -0.27 0.00 0.00 57.70 57.71 2d93 n MET 98 Cb 0.51 -3.11 0.06 0.00 2.15 0.00 0.00 33.22 32.83 2d93 n MET 98 CO 0.00 0.00 0.00 1.58 -0.73 0.00 0.00 175.97 176.82 2d93 n HIS 99 N 10.12 1.63 -1.82 1.12 -0.00 -1.26 -0.52 115.22 124.48 2d93 n HIS 99 Ca 0.27 -1.69 0.00 0.00 0.46 0.00 0.00 57.72 56.76 2d93 n HIS 99 Cb 0.42 -0.83 0.00 0.00 -0.12 0.00 0.00 29.99 29.46 2d93 n HIS 99 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2d93 n GLY 100 N 0.01 -1.74 3.47 1.57 0.00 -1.26 -4.61 105.19 102.62 2d93 n GLY 100 Ca 0.32 -1.12 -0.33 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.51 3.30 -0.10 -0.61 1.01 0.48 -2.69 121.20 120.08 2d93 s ILE 101 Ca 0.00 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 2d93 s ILE 101 Cb 0.00 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 40.08 2d93 s ILE 101 CO 0.00 0.56 -0.02 -0.69 0.00 0.00 0.00 174.94 174.79 2d93 s VAL 102 N -0.27 4.08 -0.11 2.92 1.01 -0.28 -0.34 120.40 127.40 2d93 s VAL 102 Ca 0.03 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.62 2d93 s VAL 102 Cb -0.13 -2.73 0.05 0.00 0.00 0.00 0.00 36.38 33.57 2d93 s VAL 102 CO 0.03 0.57 0.27 -0.13 0.00 0.00 0.00 175.10 175.84 2d93 s ARG 103 N -0.50 0.24 1.01 2.72 0.52 0.10 -0.95 118.95 122.09 2d93 s ARG 103 Ca 0.08 0.55 -0.11 0.00 -0.52 0.00 0.00 55.73 55.73 2d93 s ARG 103 Cb -0.12 -0.08 0.20 0.00 0.52 0.00 0.00 34.95 35.47 2d93 s ARG 103 CO 0.02 -0.15 1.10 0.95 0.02 0.00 0.00 175.30 177.25 2d93 s THR 104 N 1.16 2.04 -0.04 0.02 -4.23 -0.56 0.01 115.64 114.04 2d93 s THR 104 Ca -0.08 0.01 0.09 0.00 -1.18 0.00 0.00 61.69 60.53 2d93 s THR 104 Cb -0.09 -2.04 -0.13 0.00 1.34 0.00 0.00 72.50 71.58 2d93 s THR 104 CO -0.08 -0.02 0.14 0.29 -0.54 0.00 0.00 174.62 174.41 2d93 n LYS 105 N -4.50 1.15 -4.27 3.99 4.76 0.36 -3.01 118.16 116.64 2d93 n LYS 105 Ca 0.09 -0.06 -0.19 0.00 -2.87 0.00 0.00 58.31 55.28 2d93 n LYS 105 Cb 0.53 -1.23 -0.08 0.00 -1.84 0.00 0.00 35.03 32.41 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 -2.50 0.00 0.73 -0.18 -7.23 -1.26 -4.69 120.40 105.27 2d93 s VAL 106 Ca -0.04 -1.97 0.01 0.00 -1.81 0.00 0.00 61.98 58.17 2d93 s VAL 106 Cb 0.05 -2.51 0.14 0.00 0.56 0.00 0.00 36.38 34.62 2d93 s VAL 106 CO 0.39 0.00 1.00 1.51 -0.31 0.00 0.00 175.10 177.69 2d93 s ASP 107 N -3.36 4.29 -1.45 4.85 1.47 -1.26 -4.35 116.67 116.87 2d93 s ASP 107 Ca 0.40 -0.54 0.00 0.00 1.18 0.00 0.00 52.55 53.59 2d93 s ASP 107 Cb 0.02 0.24 0.00 0.00 -0.34 0.00 0.00 42.92 42.84 2d93 s ASP 107 CO 0.27 -1.92 0.00 -0.67 0.68 0.00 0.00 175.17 173.53 2d93 n ASP 108 N -2.82 -4.67 -4.68 2.11 2.03 -0.97 -4.91 116.55 102.65 2d93 n ASP 108 Ca 0.17 0.17 -0.43 0.00 0.52 0.00 0.00 54.79 55.22 2d93 n ASP 108 Cb 0.61 -3.99 -0.02 0.00 -0.72 0.00 0.00 41.12 37.00 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 2.57 3.61 -0.15 0.00 -0.21 -0.86 -0.35 119.66 124.28 2d93 s GLN 110 Ca 0.50 -0.07 -0.13 0.00 0.02 0.00 0.00 55.36 55.67 2d93 s GLN 110 Cb -0.19 -2.97 0.04 0.00 1.00 0.00 0.00 33.01 30.89 2d93 s GLN 110 CO 0.15 0.56 0.39 -0.06 -2.12 0.00 0.00 175.29 174.20 2d93 s PHE 111 N -1.48 -0.43 0.01 0.91 0.08 0.41 -2.13 117.98 115.36 2d93 s PHE 111 Ca 0.35 1.04 0.02 0.00 0.12 0.00 0.00 56.93 58.46 2d93 s PHE 111 Cb -0.13 0.15 -0.04 0.00 -0.57 0.00 0.00 43.02 42.43 2d93 s PHE 111 CO 0.21 -0.21 -0.01 0.54 -0.10 0.00 0.00 175.22 175.65 2d93 s VAL 112 N 0.24 4.05 0.05 -0.44 0.11 -1.19 -2.06 120.40 121.16 2d93 s VAL 112 Ca -0.00 -0.68 0.08 0.00 -2.93 0.00 0.00 61.98 58.45 2d93 s VAL 112 Cb -0.03 -2.81 -0.03 0.00 -1.53 0.00 0.00 36.38 31.98 2d93 s VAL 112 CO 0.00 0.35 -0.22 0.00 -3.33 0.00 0.00 175.10 171.90 2d93 s ILE 114 N -0.85 -0.35 0.54 0.00 1.01 -1.10 -0.27 121.20 120.18 2d93 s ILE 114 Ca 0.09 0.26 -0.20 0.00 0.00 0.00 0.00 60.65 60.80 2d93 s ILE 114 Cb -0.09 -0.43 -0.08 0.00 0.01 0.00 0.00 42.46 41.87 2d93 s ILE 114 CO 0.02 0.11 0.85 0.00 0.00 0.00 0.00 174.94 175.92 2d93 n ALA 115 N 5.16 -0.21 0.51 9.38 0.00 -1.26 -2.19 120.51 131.90 2d93 n ALA 115 Ca -0.09 0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.22 2d93 n ALA 115 Cb 0.50 -2.02 -0.09 0.00 0.00 0.00 0.00 19.45 17.84 2d93 n ALA 115 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2d93 h GLN 116 N 0.73 -1.24 -0.58 0.00 4.15 -1.92 -1.60 115.11 114.64 2d93 h GLN 116 Ca -0.46 0.08 0.05 0.00 0.77 0.00 0.00 58.65 59.09 2d93 h GLN 116 Cb 1.37 0.28 -0.07 0.00 0.21 0.00 0.00 27.48 29.27 2d93 h GLN 116 CO 0.52 -0.83 -0.34 1.04 -1.93 0.00 0.00 178.83 177.28 2d93 n GLN 117 N -5.50 -0.25 -0.20 1.69 1.13 -1.26 0.18 117.38 113.17 2d93 n GLN 117 Ca -0.16 1.08 0.07 0.00 -1.94 0.00 0.00 57.00 56.05 2d93 n GLN 117 Cb 0.51 -1.59 0.35 0.00 0.11 0.00 0.00 30.24 29.61 2d93 n GLN 117 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 2d93 h ASP 118 N 0.00 0.68 0.49 1.08 5.19 -1.94 0.24 116.42 122.17 2d93 h ASP 118 Ca 0.09 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2d93 h ASP 118 Cb 0.24 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.61 2d93 h ASP 118 CO -0.54 0.43 0.00 0.00 -3.12 0.00 0.00 179.24 176.01 2d93 n TYR 119 N -4.49 0.37 0.13 4.55 9.36 0.47 -1.86 117.16 125.69 2d93 n TYR 119 Ca 0.11 0.15 0.02 0.00 3.32 0.00 0.00 57.90 61.51 2d93 n TYR 119 Cb 0.25 -0.75 0.02 0.00 -0.63 0.00 0.00 39.34 38.23 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 -1.85 0.01 0.62 2.98 -0.00 0.62 -4.31 117.44 115.52 2d93 n TRP 120 Ca 0.02 -0.03 0.07 0.00 -0.00 0.00 0.00 57.50 57.56 2d93 n TRP 120 Cb 0.16 -0.00 -0.03 0.00 -0.00 0.00 0.00 31.31 31.45 2d93 n TRP 120 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2d93 n ARG 121 N 0.17 2.08 -0.06 5.87 1.74 0.11 -4.10 116.66 122.47 2d93 n ARG 121 Ca 0.02 -0.50 -0.12 0.00 -0.77 0.00 0.00 57.85 56.49 2d93 n ARG 121 Cb 0.09 -1.18 -0.04 0.00 -1.02 0.00 0.00 32.46 30.31 2d93 n ARG 121 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2d93 n ILE 122 N -0.54 1.25 0.06 0.55 5.41 -0.94 -4.49 119.36 120.66 2d93 n ILE 122 Ca 0.05 0.04 -0.13 0.00 1.00 0.00 0.00 62.75 63.70 2d93 n ILE 122 Cb 0.27 -1.95 -0.08 0.00 -0.71 0.00 0.00 39.64 37.16 2d93 n ILE 122 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2d93 h LEU 123 N -0.66 -0.12 0.00 1.39 4.07 -1.81 -3.45 115.31 114.73 2d93 h LEU 123 Ca -0.19 -0.24 -0.26 0.00 0.08 0.00 0.00 57.88 57.28 2d93 h LEU 123 Cb 0.96 0.03 0.15 0.00 1.08 0.00 0.00 40.66 42.88 2d93 h LEU 123 CO -0.11 0.17 -0.12 0.59 -1.08 0.00 0.00 178.44 177.89 2d93 n ASN 124 N -5.02 -3.56 -2.51 -0.43 3.02 -1.26 -4.88 115.26 100.61 2d93 n ASN 124 Ca -0.08 -0.62 -0.34 0.00 -0.03 0.00 0.00 54.58 53.51 2d93 n ASN 124 Cb 0.19 -0.70 0.04 0.00 -0.61 0.00 0.00 39.78 38.70 2d93 n ASN 124 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2d93 n HIS 125 N -5.01 2.73 -4.27 3.10 -0.00 -1.26 -4.90 115.22 105.62 2d93 n HIS 125 Ca 0.10 -2.52 -0.35 0.00 -0.00 0.00 0.00 57.72 54.95 2d93 n HIS 125 Cb 0.42 -1.29 -0.09 0.00 -0.00 0.00 0.00 29.99 29.03 2d93 n HIS 125 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2d93 s VAL 126 N -4.29 4.55 -1.44 3.57 1.01 -1.26 -4.55 120.40 117.99 2d93 s VAL 126 Ca 0.56 -0.18 -0.13 0.00 0.00 0.00 0.00 61.98 62.23 2d93 s VAL 126 Cb 0.44 -2.94 0.13 0.00 0.00 0.00 0.00 36.38 34.00 2d93 s VAL 126 CO -0.18 0.59 0.31 1.21 0.00 0.00 0.00 175.10 177.03 2d93 n GLU 127 N 2.03 -0.83 -0.47 2.72 2.13 -1.26 -4.65 120.64 120.31 2d93 n GLU 127 Ca -0.18 0.10 0.38 0.00 0.66 0.00 0.00 57.16 58.11 2d93 n GLU 127 Cb 0.54 -3.50 0.61 0.00 0.27 0.00 0.00 31.44 29.36 2d93 n GLU 127 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2d93 n LYS 128 N -3.57 -0.02 -1.31 5.31 -0.00 -1.26 -2.52 118.16 114.78 2d93 n LYS 128 Ca -0.03 0.99 -0.40 0.00 -0.00 0.00 0.00 58.31 58.87 2d93 n LYS 128 Cb 0.44 -2.07 -0.03 0.00 -0.00 0.00 0.00 35.03 33.36 2d93 n LYS 128 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2d93 n SER 129 N -4.07 3.83 -2.74 -5.58 2.88 -1.26 -4.89 113.62 101.80 2d93 n SER 129 Ca 0.35 -2.68 0.00 0.00 -1.33 0.00 0.00 58.87 55.21 2d93 n SER 129 Cb 1.46 -1.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2d93 n SER 129 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d93 n GLY 130 N 4.20 -0.22 0.00 0.46 0.00 -1.05 -4.88 105.19 103.70 2d93 n GLY 130 Ca 0.52 -1.64 0.06 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.95 1.61 -0.04 -1.26 -4.68 135.00 129.17 2d93 n PRO 131 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2d93 n PRO 131 Cb 0.00 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.02 2d93 n PRO 131 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d93 s SER 132 N -1.90 5.02 0.38 3.54 0.15 -1.26 -4.95 113.70 114.68 2d93 s SER 132 Ca 0.19 0.08 -0.24 0.00 0.70 0.00 0.00 55.95 56.67 2d93 s SER 132 Cb 0.09 -2.54 -0.09 0.00 -1.71 0.00 0.00 66.02 61.77 2d93 s SER 132 CO 0.15 -2.67 1.03 -0.94 1.20 0.00 0.00 173.24 172.00 2d93 s SER 133 N 8.78 6.88 0.00 5.45 1.04 -1.26 -5.09 113.70 129.51 2d93 s SER 133 Ca 0.74 2.00 0.26 0.00 0.48 0.00 0.00 55.95 59.43 2d93 s SER 133 Cb -0.11 -2.58 0.68 0.00 0.10 0.00 0.00 66.02 64.11 2d93 s SER 133 CO 0.13 -0.40 1.54 0.61 0.98 0.00 0.00 173.24 176.10