#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 6.76 0.07 1.61 0.01 -1.26 -4.96 113.70 115.93 2d93 s SER 2 Ca 0.00 0.93 -0.19 0.00 1.31 0.00 0.00 55.95 58.00 2d93 s SER 2 Cb 0.00 -2.39 -0.10 0.00 0.21 0.00 0.00 66.02 63.75 2d93 s SER 2 CO 0.00 -0.36 1.47 0.77 0.41 0.00 0.00 173.24 175.53 2d93 h SER 3 N 7.54 0.42 0.00 2.44 4.64 -2.06 -3.47 113.55 123.06 2d93 h SER 3 Ca -0.29 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 2d93 h SER 3 Cb 1.13 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2d93 h SER 3 CO 0.80 0.68 0.00 0.61 -0.87 0.00 0.00 176.83 178.06 2d93 n GLY 4 N -0.17 2.15 3.41 -0.77 0.00 -1.26 -4.81 105.19 103.74 2d93 n GLY 4 Ca -0.04 -0.32 -0.45 0.00 0.00 0.00 0.00 46.02 45.21 2d93 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d93 s SER 5 N -4.00 6.64 -0.20 1.61 0.15 -1.26 -5.01 113.70 111.63 2d93 s SER 5 Ca 0.00 -2.19 -0.29 0.00 0.70 0.00 0.00 55.95 54.16 2d93 s SER 5 Cb 0.00 -2.34 -0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2d93 s SER 5 CO 0.00 -0.92 1.15 -0.44 1.20 0.00 0.00 173.24 174.23 2d93 s SER 6 N 3.19 7.02 0.00 5.45 0.01 -1.26 -5.03 113.70 123.08 2d93 s SER 6 Ca 0.27 1.53 0.00 0.00 1.31 0.00 0.00 55.95 59.06 2d93 s SER 6 Cb -0.07 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2d93 s SER 6 CO -0.08 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.46 2d93 n GLY 7 N 3.47 -1.76 0.11 3.44 0.00 -1.26 -5.01 105.19 104.18 2d93 n GLY 7 Ca 0.13 -1.32 -0.22 0.00 0.00 0.00 0.00 46.02 44.61 2d93 n GLY 7 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2d93 h ASP 8 N 0.00 0.05 -3.33 1.61 3.32 -2.07 -3.44 116.42 112.57 2d93 h ASP 8 Ca 0.00 -0.57 -0.61 0.00 0.02 0.00 0.00 57.03 55.87 2d93 h ASP 8 Cb 0.00 -0.02 -0.40 0.00 0.22 0.00 0.00 39.33 39.13 2d93 h ASP 8 CO 0.00 1.53 -0.73 -1.81 -1.72 0.00 0.00 179.24 176.51 2d93 s ASP 9 N -6.88 3.62 0.07 6.45 1.01 -1.26 -4.99 116.67 114.69 2d93 s ASP 9 Ca -0.28 -2.97 -0.35 0.00 0.71 0.00 0.00 52.55 49.66 2d93 s ASP 9 Cb 0.06 -1.12 -0.19 0.00 1.01 0.00 0.00 42.92 42.68 2d93 s ASP 9 CO 0.62 -0.21 1.60 0.44 0.21 0.00 0.00 175.17 177.82 2d93 h ASP 10 N 6.28 -1.00 -0.83 0.27 3.32 -1.97 0.73 116.42 123.22 2d93 h ASP 10 Ca 0.06 0.04 0.21 0.00 0.02 0.00 0.00 57.03 57.36 2d93 h ASP 10 Cb 0.89 0.27 -0.13 0.00 0.22 0.00 0.00 39.33 40.58 2d93 h ASP 10 CO 0.53 -0.67 0.16 0.40 -1.72 0.00 0.00 179.24 177.94 2d93 h ILE 11 N -1.10 0.35 -0.47 0.35 1.08 -1.98 0.55 117.51 116.30 2d93 h ILE 11 Ca -0.10 -0.06 -0.10 0.00 -0.39 0.00 0.00 64.86 64.20 2d93 h ILE 11 Cb 0.86 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.74 2d93 h ILE 11 CO 0.15 0.03 -0.10 -0.33 -0.69 0.00 0.00 178.15 177.21 2d93 h GLU 12 N 0.19 0.89 0.00 2.37 5.08 -1.93 0.25 114.58 121.43 2d93 h GLU 12 Ca 0.49 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2d93 h GLU 12 Cb 0.94 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2d93 h GLU 12 CO -0.64 0.98 0.00 1.96 -1.00 0.00 0.00 179.01 180.31 2d93 h GLN 13 N 0.73 0.00 0.08 2.33 1.08 0.18 -2.64 115.11 116.86 2d93 h GLN 13 Ca 0.12 0.00 -0.37 0.00 -1.45 0.00 0.00 58.65 56.95 2d93 h GLN 13 Cb 0.64 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.04 2d93 h GLN 13 CO 0.04 0.00 -2.14 -0.11 -0.95 0.00 0.00 178.83 175.67 2d93 n LEU 14 N -2.77 2.70 0.30 1.46 7.94 0.16 -4.28 117.00 122.51 2d93 n LEU 14 Ca 0.01 0.11 -0.17 0.00 -1.11 0.00 0.00 56.01 54.85 2d93 n LEU 14 Cb 0.29 -1.04 -0.09 0.00 0.53 0.00 0.00 43.42 43.11 2d93 n LEU 14 CO 0.25 0.85 0.69 -0.07 -1.11 0.00 0.00 177.39 178.00 2d93 h LEU 15 N -0.03 -0.61 -1.37 -1.96 3.38 -0.44 -2.43 115.31 111.85 2d93 h LEU 15 Ca -0.48 0.02 0.42 0.00 0.09 0.00 0.00 57.88 57.93 2d93 h LEU 15 Cb 1.95 0.16 -0.13 0.00 0.09 0.00 0.00 40.66 42.73 2d93 h LEU 15 CO 0.00 -0.43 0.82 1.05 0.09 0.00 0.00 178.44 179.98 2d93 h GLU 16 N -0.73 0.10 0.11 1.13 4.11 -1.69 0.32 114.58 117.93 2d93 h GLU 16 Ca -0.07 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.35 2d93 h GLU 16 Cb 0.56 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2d93 h GLU 16 CO 0.12 0.07 -0.05 0.35 0.07 0.00 0.00 179.01 179.56 2d93 h PHE 17 N 0.10 -0.14 -0.69 2.06 3.57 -1.63 -3.06 116.94 117.15 2d93 h PHE 17 Ca 0.81 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 62.51 2d93 h PHE 17 Cb 2.49 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 41.25 2d93 h PHE 17 CO -0.01 0.30 0.56 0.52 -2.23 0.00 0.00 178.31 177.45 2d93 h MET 18 N -0.64 0.00 0.00 1.11 2.86 -0.05 0.49 114.93 118.70 2d93 h MET 18 Ca -0.02 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 2d93 h MET 18 Cb 0.50 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 2d93 h MET 18 CO 0.02 0.00 -0.33 1.25 1.06 0.00 0.00 176.91 178.91 2d93 h HIS 19 N 0.00 0.00 -0.18 -0.22 -0.00 -1.22 -3.00 115.15 110.54 2d93 h HIS 19 Ca 0.33 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.63 2d93 h HIS 19 Cb 1.44 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.85 2d93 h HIS 19 CO 0.00 0.33 -0.16 1.96 -0.00 0.00 0.00 177.93 180.06 2d93 h GLN 20 N 0.00 0.42 -6.85 5.26 4.20 -0.06 -3.41 115.11 114.68 2d93 h GLN 20 Ca -0.00 -0.22 -0.51 0.00 0.06 0.00 0.00 58.65 57.98 2d93 h GLN 20 Cb 0.62 0.00 0.04 0.00 0.30 0.00 0.00 27.48 28.44 2d93 h GLN 20 CO 0.04 0.78 0.55 -0.51 -0.67 0.00 0.00 178.83 179.02 2d93 s LEU 21 N -9.10 4.48 0.16 1.46 1.43 -1.14 -4.92 118.68 111.04 2d93 s LEU 21 Ca -0.14 2.46 -0.09 0.00 -1.03 0.00 0.00 54.13 55.33 2d93 s LEU 21 Cb 0.06 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.62 2d93 s LEU 21 CO 0.77 -0.34 1.50 1.55 0.23 0.00 0.00 176.35 180.05 2d93 h PRO 22 N 3.55 0.88 0.00 1.29 0.13 -1.84 0.14 132.00 136.15 2d93 h PRO 22 Ca -0.48 -0.46 -0.00 0.00 -0.87 0.00 0.00 66.00 64.19 2d93 h PRO 22 Cb 1.22 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2d93 h PRO 22 CO 0.66 1.11 -0.01 0.00 -0.23 0.00 0.00 178.00 179.53 2d93 h ALA 23 N 0.83 1.10 0.00 -0.56 0.00 -1.90 -1.42 119.26 117.31 2d93 h ALA 23 Ca 0.06 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.62 2d93 h ALA 23 Cb 0.97 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 2d93 h ALA 23 CO 0.09 0.01 -2.30 1.19 0.00 0.00 0.00 179.25 178.24 2d93 n PHE 24 N -3.23 0.00 0.28 0.00 3.72 -1.10 -4.40 117.46 112.73 2d93 n PHE 24 Ca -0.03 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 2d93 n PHE 24 Cb 0.10 -0.88 0.80 0.00 -0.94 0.00 0.00 39.48 38.55 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 -0.01 1.61 -1.06 4.37 0.00 -0.47 -2.29 119.26 121.40 2d93 h ALA 25 Ca -0.51 -0.03 0.29 0.00 0.00 0.00 0.00 54.91 54.66 2d93 h ALA 25 Cb 1.79 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 2d93 h ALA 25 CO -0.08 0.04 0.72 -0.91 0.00 0.00 0.00 179.25 179.02 2d93 h ASN 26 N 0.00 0.25 -1.73 0.00 4.21 -1.47 -3.41 115.58 113.43 2d93 h ASN 26 Ca -0.00 0.05 -0.50 0.00 1.21 0.00 0.00 56.30 57.05 2d93 h ASN 26 Cb 0.07 0.01 -0.04 0.00 -1.12 0.00 0.00 38.32 37.24 2d93 h ASN 26 CO 0.00 0.05 -0.43 0.00 -1.29 0.00 0.00 177.43 175.76 2d93 s MET 27 N -5.25 2.61 1.10 0.81 0.23 -0.86 -5.13 119.30 112.81 2d93 s MET 27 Ca -0.07 -1.42 -0.18 0.00 -1.03 0.00 0.00 55.69 52.99 2d93 s MET 27 Cb 0.24 -2.40 0.26 0.00 -1.53 0.00 0.00 34.83 31.40 2d93 s MET 27 CO 0.80 -0.01 1.22 -0.08 -2.03 0.00 0.00 175.02 174.92 2d93 s THR 28 N -2.38 1.77 0.04 3.16 -1.32 -1.26 -4.91 115.64 110.73 2d93 s THR 28 Ca 0.43 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.64 2d93 s THR 28 Cb -0.04 -2.74 -0.17 0.00 -1.51 0.00 0.00 72.50 68.04 2d93 s THR 28 CO 0.26 0.00 1.42 -0.03 -2.21 0.00 0.00 174.62 174.07 2d93 h MET 29 N -2.19 -0.45 -0.93 7.08 4.05 -1.95 -3.02 114.93 117.52 2d93 h MET 29 Ca -0.44 0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.10 2d93 h MET 29 Cb 1.26 0.10 -0.11 0.00 -0.80 0.00 0.00 31.60 32.05 2d93 h MET 29 CO 0.33 -0.19 -0.54 0.45 0.23 0.00 0.00 176.91 177.19 2d93 n SER 30 N -5.21 -0.97 -0.25 1.39 2.88 -1.26 0.61 113.62 110.80 2d93 n SER 30 Ca -0.10 1.65 0.06 0.00 -1.33 0.00 0.00 58.87 59.14 2d93 n SER 30 Cb 0.25 -0.22 0.19 0.00 -0.75 0.00 0.00 64.21 63.68 2d93 n SER 30 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2d93 h VAL 31 N 0.00 0.57 0.48 2.46 2.07 -1.91 -2.25 116.25 117.67 2d93 h VAL 31 Ca 0.15 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2d93 h VAL 31 Cb 0.38 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 2d93 h VAL 31 CO -0.87 0.06 -0.30 0.03 0.02 0.00 0.00 177.57 176.51 2d93 h ARG 32 N 0.34 -0.71 -0.99 1.57 3.08 0.30 -2.07 114.38 115.91 2d93 h ARG 32 Ca 0.42 0.05 0.18 0.00 0.07 0.00 0.00 59.98 60.70 2d93 h ARG 32 Cb 0.69 0.16 -0.18 0.00 0.08 0.00 0.00 29.97 30.72 2d93 h ARG 32 CO -0.46 -0.47 -0.30 -2.13 -1.07 0.00 0.00 179.97 175.53 2d93 n ARG 33 N -4.25 -0.14 -0.08 0.04 0.00 -0.24 0.31 116.66 112.29 2d93 n ARG 33 Ca -0.09 1.53 -0.07 0.00 -0.00 0.00 0.00 57.85 59.22 2d93 n ARG 33 Cb 0.31 -2.28 -0.01 0.00 0.00 0.00 0.00 32.46 30.48 2d93 n ARG 33 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2d93 h GLU 34 N 0.00 0.01 -0.46 -0.14 4.39 -1.27 -2.27 114.58 114.84 2d93 h GLU 34 Ca 0.42 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.21 2d93 h GLU 34 Cb 0.67 -0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.23 2d93 h GLU 34 CO -1.00 0.01 -0.09 -0.07 -1.16 0.00 0.00 179.01 176.69 2d93 h LEU 35 N 0.01 -0.39 -1.45 1.33 3.38 0.58 0.24 115.31 119.02 2d93 h LEU 35 Ca 0.14 0.13 0.15 0.00 0.09 0.00 0.00 57.88 58.40 2d93 h LEU 35 Cb 0.21 0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2d93 h LEU 35 CO -0.30 -0.14 0.75 0.00 0.09 0.00 0.00 178.44 178.85 2d93 h SER 37 N 0.00 0.97 -0.33 0.00 0.87 -0.49 -3.11 113.55 111.45 2d93 h SER 37 Ca 0.24 -0.38 -0.08 0.00 -1.23 0.00 0.00 61.79 60.35 2d93 h SER 37 Cb 1.75 -0.27 -0.05 0.00 -0.44 0.00 0.00 62.40 63.39 2d93 h SER 37 CO -0.00 1.16 0.01 1.33 -0.53 0.00 0.00 176.83 178.79 2d93 n VAL 38 N -4.10 2.43 -3.02 2.23 0.24 0.22 -4.98 118.33 111.35 2d93 n VAL 38 Ca -0.00 -2.15 -0.41 0.00 -2.04 0.00 0.00 64.34 59.74 2d93 n VAL 38 Cb 0.47 -0.29 -0.05 0.00 -1.47 0.00 0.00 33.84 32.50 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 -2.98 4.18 0.22 7.34 -1.94 -0.15 -4.36 119.30 121.60 2d93 s MET 39 Ca 0.44 0.73 -0.12 0.00 -1.71 0.00 0.00 55.69 55.03 2d93 s MET 39 Cb 0.37 -3.62 -0.07 0.00 2.01 0.00 0.00 34.83 33.51 2d93 s MET 39 CO 0.06 -0.40 0.59 0.42 -0.01 0.00 0.00 175.02 175.68 2d93 s ILE 40 N 2.44 4.85 -0.35 2.53 -1.09 -0.40 -4.92 121.20 124.26 2d93 s ILE 40 Ca 0.31 0.70 -0.07 0.00 -2.23 0.00 0.00 60.65 59.35 2d93 s ILE 40 Cb -0.16 -3.66 0.04 0.00 -1.58 0.00 0.00 42.46 37.10 2d93 s ILE 40 CO 0.09 0.03 0.12 -0.36 -1.23 0.00 0.00 174.94 173.59 2d93 s PHE 41 N -1.72 3.26 -0.02 3.97 0.40 -1.26 -3.37 117.98 119.24 2d93 s PHE 41 Ca 0.45 -1.38 -0.01 0.00 -0.60 0.00 0.00 56.93 55.40 2d93 s PHE 41 Cb -0.13 -2.32 0.01 0.00 0.51 0.00 0.00 43.02 41.10 2d93 s PHE 41 CO 0.20 -0.72 0.04 -1.21 0.70 0.00 0.00 175.22 174.22 2d93 s GLU 42 N 1.42 0.03 0.00 0.44 0.41 -1.01 -4.86 118.70 115.13 2d93 s GLU 42 Ca -0.01 0.09 0.00 0.00 -0.41 0.00 0.00 54.97 54.64 2d93 s GLU 42 Cb -0.20 -0.04 -0.00 0.00 -1.78 0.00 0.00 34.13 32.11 2d93 s GLU 42 CO 0.03 -0.04 -0.02 0.54 -0.49 0.00 0.00 175.26 175.28 2d93 s VAL 43 N 0.27 0.13 -0.25 2.63 0.11 -1.26 -0.14 120.40 121.88 2d93 s VAL 43 Ca -0.02 -0.10 -0.13 0.00 -2.93 0.00 0.00 61.98 58.79 2d93 s VAL 43 Cb -0.03 -0.12 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 2d93 s VAL 43 CO -0.01 0.01 0.29 -0.69 -3.33 0.00 0.00 175.10 171.37 2d93 s VAL 44 N -0.10 5.25 -0.03 2.04 1.01 0.57 -4.96 120.40 124.20 2d93 s VAL 44 Ca -0.00 0.43 -0.10 0.00 0.00 0.00 0.00 61.98 62.30 2d93 s VAL 44 Cb -0.01 -3.62 -0.31 0.00 0.00 0.00 0.00 36.38 32.44 2d93 s VAL 44 CO -0.00 0.25 0.75 -0.33 0.00 0.00 0.00 175.10 175.77 2d93 h GLU 45 N 7.84 0.39 -5.49 2.72 4.39 -1.96 -2.52 114.58 119.95 2d93 h GLU 45 Ca -0.35 -0.67 -0.61 0.00 0.34 0.00 0.00 59.36 58.06 2d93 h GLU 45 Cb 1.17 0.25 -0.12 0.00 -0.10 0.00 0.00 28.75 29.95 2d93 h GLU 45 CO 0.65 1.30 0.14 -0.65 -1.16 0.00 0.00 179.01 179.29 2d93 s GLN 46 N -2.59 4.03 1.18 2.33 -0.21 -1.26 -4.07 119.66 119.06 2d93 s GLN 46 Ca -0.14 0.43 -0.13 0.00 0.02 0.00 0.00 55.36 55.54 2d93 s GLN 46 Cb 0.05 -3.68 0.29 0.00 1.00 0.00 0.00 33.01 30.68 2d93 s GLN 46 CO 0.87 -0.46 1.03 0.00 -2.12 0.00 0.00 175.29 174.60 2d93 s ALA 47 N 2.52 -0.48 -2.05 6.09 0.00 -1.26 -3.30 121.76 123.28 2d93 s ALA 47 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.99 2d93 s ALA 47 Cb -0.15 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2d93 s ALA 47 CO 0.10 -3.86 0.00 0.41 0.00 0.00 0.00 175.76 172.41 2d93 n GLY 48 N 0.64 1.84 3.78 0.00 0.00 -1.17 -4.94 105.19 105.35 2d93 n GLY 48 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.64 3.15 -0.16 4.61 0.00 -1.21 -4.67 121.76 120.85 2d93 s ALA 49 Ca 0.00 0.68 -0.27 0.00 0.00 0.00 0.00 51.96 52.37 2d93 s ALA 49 Cb 0.00 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 2d93 s ALA 49 CO 0.00 -0.11 0.91 0.42 0.00 0.00 0.00 175.76 176.98 2d93 s ILE 50 N -1.59 4.82 -0.15 0.00 1.09 -1.26 -1.84 121.20 122.26 2d93 s ILE 50 Ca 0.54 1.81 -0.05 0.00 -1.10 0.00 0.00 60.65 61.85 2d93 s ILE 50 Cb -0.22 -4.21 -0.24 0.00 -1.06 0.00 0.00 42.46 36.72 2d93 s ILE 50 CO 0.28 -0.02 0.24 -0.38 -0.10 0.00 0.00 174.94 174.96 2d93 n ILE 51 N 4.79 1.72 -3.84 2.92 2.08 -0.66 -4.99 119.36 121.38 2d93 n ILE 51 Ca 0.07 -0.62 -0.11 0.00 0.56 0.00 0.00 62.75 62.65 2d93 n ILE 51 Cb 0.48 -1.68 -0.09 0.00 -0.75 0.00 0.00 39.64 37.60 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 -6.96 1.36 -0.00 1.39 1.43 -1.25 -4.98 118.68 109.66 2d93 s LEU 52 Ca -0.25 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 2d93 s LEU 52 Cb 0.07 0.89 -0.03 0.00 0.03 0.00 0.00 46.19 47.14 2d93 s LEU 52 CO 0.73 -0.46 -0.08 -1.61 0.23 0.00 0.00 176.35 175.16 2d93 s GLU 53 N -1.85 2.53 -0.27 1.70 2.02 -1.26 -1.92 118.70 119.65 2d93 s GLU 53 Ca -0.11 -0.73 -0.28 0.00 0.02 0.00 0.00 54.97 53.87 2d93 s GLU 53 Cb -0.05 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.67 2d93 s GLU 53 CO -0.00 0.60 2.00 0.16 0.02 0.00 0.00 175.26 178.04 2d93 s ASP 54 N -1.36 5.68 0.00 -0.19 -4.77 0.32 -2.14 116.67 114.22 2d93 s ASP 54 Ca 0.16 1.59 0.00 0.00 -3.30 0.00 0.00 52.55 51.01 2d93 s ASP 54 Cb -0.11 -2.52 0.00 0.00 -1.09 0.00 0.00 42.92 39.20 2d93 s ASP 54 CO 0.07 -1.83 0.00 0.61 0.70 0.00 0.00 175.17 174.72 2d93 n GLY 55 N 5.58 1.49 3.49 2.12 0.00 0.20 -4.84 105.19 113.22 2d93 n GLY 55 Ca 0.26 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.08 3.70 -0.63 1.61 0.74 -0.91 -4.84 119.66 119.25 2d93 s GLN 56 Ca 0.00 -0.47 -0.28 0.00 0.05 0.00 0.00 55.36 54.67 2d93 s GLN 56 Cb 0.00 -3.46 -0.12 0.00 1.10 0.00 0.00 33.01 30.54 2d93 s GLN 56 CO 0.00 -0.22 2.49 -1.91 -0.55 0.00 0.00 175.29 175.10 2d93 n GLU 57 N 4.97 0.76 -2.30 1.67 2.13 -1.26 -2.72 120.64 123.88 2d93 n GLU 57 Ca -0.15 0.02 -0.42 0.00 0.66 0.00 0.00 57.16 57.26 2d93 n GLU 57 Cb 0.51 -2.84 -0.03 0.00 0.27 0.00 0.00 31.44 29.36 2d93 n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2d93 s LEU 58 N 11.01 4.28 -0.05 4.31 1.43 -0.34 -4.87 118.68 134.44 2d93 s LEU 58 Ca 1.10 1.95 0.07 0.00 -1.03 0.00 0.00 54.13 56.22 2d93 s LEU 58 Cb -0.52 -3.55 0.11 0.00 0.03 0.00 0.00 46.19 42.26 2d93 s LEU 58 CO 0.34 -0.72 1.06 0.47 0.23 0.00 0.00 176.35 177.73 2d93 n ASP 59 N 5.83 0.88 -3.70 2.29 8.00 -1.26 -4.19 116.55 124.41 2d93 n ASP 59 Ca 0.13 -2.41 -0.11 0.00 0.71 0.00 0.00 54.79 53.11 2d93 n ASP 59 Cb 0.44 -0.29 -0.10 0.00 -0.02 0.00 0.00 41.12 41.16 2d93 n ASP 59 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2d93 s SER 60 N -1.71 -0.56 0.08 -2.24 0.01 -1.26 -2.45 113.70 105.58 2d93 s SER 60 Ca 0.12 1.00 -0.29 0.00 1.31 0.00 0.00 55.95 58.09 2d93 s SER 60 Cb 0.11 0.94 -0.05 0.00 0.21 0.00 0.00 66.02 67.22 2d93 s SER 60 CO 0.01 -0.19 0.92 0.86 0.41 0.00 0.00 173.24 175.25 2d93 s TRP 61 N 0.92 3.78 -0.00 2.43 -0.00 -0.54 -3.86 118.94 121.66 2d93 s TRP 61 Ca -0.05 1.72 0.04 0.00 -0.00 0.00 0.00 56.10 57.80 2d93 s TRP 61 Cb -0.06 -3.01 -0.03 0.00 -0.00 0.00 0.00 33.47 30.37 2d93 s TRP 61 CO -0.08 0.20 -0.11 0.71 -0.00 0.00 0.00 176.95 177.67 2d93 s TYR 62 N 0.10 2.78 -0.06 5.86 1.51 1.00 -2.35 117.35 126.18 2d93 s TYR 62 Ca 0.46 -0.11 -0.03 0.00 -1.01 0.00 0.00 57.07 56.38 2d93 s TYR 62 Cb -0.22 -1.58 0.04 0.00 -0.11 0.00 0.00 41.96 40.08 2d93 s TYR 62 CO 0.28 0.31 0.07 0.08 -1.11 0.00 0.00 175.55 175.18 2d93 s VAL 63 N -0.93 -0.12 -0.16 0.71 1.01 -1.14 -1.42 120.40 118.35 2d93 s VAL 63 Ca 0.15 0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 2d93 s VAL 63 Cb -0.11 -0.23 -0.07 0.00 0.00 0.00 0.00 36.38 35.97 2d93 s VAL 63 CO 0.05 0.10 2.13 -0.38 0.00 0.00 0.00 175.10 177.00 2d93 n ILE 64 N 5.30 0.45 -0.01 2.22 5.41 -1.22 -3.05 119.36 128.45 2d93 n ILE 64 Ca -0.04 -0.33 -0.22 0.00 1.00 0.00 0.00 62.75 63.17 2d93 n ILE 64 Cb 0.50 -2.32 -0.13 0.00 -0.71 0.00 0.00 39.64 36.97 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 13.09 0.34 -7.13 1.39 3.38 -1.63 -3.27 115.31 121.48 2d93 h LEU 65 Ca -0.42 -0.85 -0.06 0.00 0.09 0.00 0.00 57.88 56.64 2d93 h LEU 65 Cb 1.25 -0.11 -0.23 0.00 0.09 0.00 0.00 40.66 41.66 2d93 h LEU 65 CO 0.96 1.75 -0.11 0.21 0.09 0.00 0.00 178.44 181.34 2d93 s ASN 66 N -7.03 -0.67 0.00 -0.43 2.47 -1.06 -4.87 114.94 103.35 2d93 s ASN 66 Ca -0.23 1.16 0.00 0.00 0.42 0.00 0.00 52.86 54.22 2d93 s ASN 66 Cb 0.06 1.09 0.00 0.00 -1.45 0.00 0.00 41.25 40.95 2d93 s ASN 66 CO 0.74 -0.21 0.00 0.61 -3.72 0.00 0.00 177.10 174.52 2d93 n GLY 67 N 3.71 -3.07 3.24 1.21 0.00 -1.26 -1.59 105.19 107.43 2d93 n GLY 67 Ca -0.19 -2.16 -0.31 0.00 0.00 0.00 0.00 46.02 43.36 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 -0.89 2.01 -0.06 2.61 2.01 -1.26 -3.52 115.64 116.54 2d93 s THR 68 Ca 0.00 -1.02 0.03 0.00 0.31 0.00 0.00 61.69 61.01 2d93 s THR 68 Cb 0.00 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.77 2d93 s THR 68 CO 0.00 0.56 -0.14 0.68 -0.69 0.00 0.00 174.62 175.03 2d93 s VAL 69 N 0.07 3.12 -0.08 3.82 -7.23 -1.19 0.01 120.40 118.92 2d93 s VAL 69 Ca -0.10 -0.70 0.02 0.00 -1.81 0.00 0.00 61.98 59.39 2d93 s VAL 69 Cb -0.15 -2.23 -0.02 0.00 0.56 0.00 0.00 36.38 34.53 2d93 s VAL 69 CO 0.06 0.59 -0.12 -0.70 -0.31 0.00 0.00 175.10 174.62 2d93 s GLU 70 N -0.64 2.86 0.00 4.82 2.12 0.86 -2.37 118.70 126.35 2d93 s GLU 70 Ca 0.09 -0.65 0.06 0.00 0.36 0.00 0.00 54.97 54.83 2d93 s GLU 70 Cb -0.11 -2.53 -0.03 0.00 0.26 0.00 0.00 34.13 31.72 2d93 s GLU 70 CO 0.01 0.50 -0.16 0.42 -0.54 0.00 0.00 175.26 175.49 2d93 s ILE 71 N -0.40 2.91 -0.03 -3.70 1.01 0.09 -0.06 121.20 121.02 2d93 s ILE 71 Ca 0.05 -0.99 0.04 0.00 0.00 0.00 0.00 60.65 59.75 2d93 s ILE 71 Cb -0.12 -2.19 -0.00 0.00 0.01 0.00 0.00 42.46 40.16 2d93 s ILE 71 CO 0.02 0.44 -0.14 -0.44 0.00 0.00 0.00 174.94 174.83 2d93 s SER 72 N -1.14 1.75 0.12 3.58 0.01 0.36 -1.12 113.70 117.26 2d93 s SER 72 Ca 0.13 -0.28 0.05 0.00 1.31 0.00 0.00 55.95 57.16 2d93 s SER 72 Cb -0.11 -0.42 -0.04 0.00 0.21 0.00 0.00 66.02 65.66 2d93 s SER 72 CO 0.03 0.13 0.07 -1.00 0.41 0.00 0.00 173.24 172.88 2d93 s HIS 73 N 0.01 3.09 -0.31 2.43 3.76 0.76 -0.39 115.29 124.63 2d93 s HIS 73 Ca -0.02 -0.00 0.26 0.00 -0.15 0.00 0.00 55.06 55.16 2d93 s HIS 73 Cb -0.09 -1.54 1.10 0.00 1.11 0.00 0.00 32.58 33.16 2d93 s HIS 73 CO 0.01 0.51 1.79 -1.00 -0.85 0.00 0.00 174.74 175.20 2d93 h PRO 74 N 2.99 0.00 0.04 8.40 0.13 -1.87 -3.10 132.00 138.59 2d93 h PRO 74 Ca -0.47 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.56 2d93 h PRO 74 Cb 1.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.32 2d93 h PRO 74 CO 0.63 0.00 -0.40 -0.44 -0.23 0.00 0.00 178.00 177.55 2d93 h ASP 75 N 0.00 0.28 0.00 1.44 3.32 -1.94 -3.48 116.42 116.04 2d93 h ASP 75 Ca 0.00 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.17 2d93 h ASP 75 Cb 0.39 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2d93 h ASP 75 CO 0.00 1.13 0.00 0.61 -1.72 0.00 0.00 179.24 179.26 2d93 n GLY 76 N 1.36 0.00 3.29 2.75 0.00 -1.17 -5.17 105.19 106.25 2d93 n GLY 76 Ca -0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 1.14 -0.18 1.61 2.47 -1.26 -4.99 119.74 118.54 2d93 s LYS 77 Ca 0.00 -1.20 -0.03 0.00 -1.56 0.00 0.00 55.97 53.18 2d93 s LYS 77 Cb 0.00 -1.37 0.06 0.00 -1.46 0.00 0.00 37.83 35.06 2d93 s LYS 77 CO 0.00 0.31 0.05 0.08 0.16 0.00 0.00 175.35 175.95 2d93 s VAL 78 N -1.30 0.36 0.14 4.02 1.01 -1.26 -0.17 120.40 123.20 2d93 s VAL 78 Ca 0.08 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 2d93 s VAL 78 Cb -0.09 -0.87 -0.07 0.00 0.00 0.00 0.00 36.38 35.34 2d93 s VAL 78 CO 0.05 -0.18 0.64 -1.61 0.00 0.00 0.00 175.10 173.99 2d93 s GLU 79 N 1.94 4.23 -0.21 2.72 2.02 -0.27 -4.90 118.70 124.22 2d93 s GLU 79 Ca 0.00 0.79 0.02 0.00 0.02 0.00 0.00 54.97 55.80 2d93 s GLU 79 Cb -0.16 -3.10 0.04 0.00 0.10 0.00 0.00 34.13 31.01 2d93 s GLU 79 CO -0.08 0.54 -0.15 -0.80 0.02 0.00 0.00 175.26 174.79 2d93 s ASN 80 N -1.36 3.67 0.19 -0.19 0.01 -1.26 -0.73 114.94 115.27 2d93 s ASN 80 Ca 0.35 -0.97 0.07 0.00 -0.71 0.00 0.00 52.86 51.60 2d93 s ASN 80 Cb -0.19 -1.47 -0.04 0.00 0.41 0.00 0.00 41.25 39.97 2d93 s ASN 80 CO 0.21 -0.09 0.04 -0.76 -1.51 0.00 0.00 177.10 174.98 2d93 s LEU 81 N 1.23 3.43 0.23 0.60 1.43 -1.00 -5.06 118.68 119.54 2d93 s LEU 81 Ca -0.01 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 2d93 s LEU 81 Cb -0.16 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 2d93 s LEU 81 CO -0.09 0.06 0.05 -0.36 0.23 0.00 0.00 176.35 176.24 2d93 s PHE 82 N -1.85 1.48 -0.46 0.29 0.08 -1.26 -3.17 117.98 113.09 2d93 s PHE 82 Ca 0.29 -1.07 -0.45 0.00 0.12 0.00 0.00 56.93 55.82 2d93 s PHE 82 Cb -0.09 -0.87 -0.19 0.00 -0.57 0.00 0.00 43.02 41.31 2d93 s PHE 82 CO 0.20 -0.22 1.69 -0.12 -0.10 0.00 0.00 175.22 176.68 2d93 n MET 83 N -0.41 0.24 0.00 0.44 1.56 -1.23 -1.06 117.12 116.66 2d93 n MET 83 Ca -0.03 0.09 0.00 0.00 -0.27 0.00 0.00 57.70 57.49 2d93 n MET 83 Cb 0.65 -1.63 0.00 0.00 2.15 0.00 0.00 33.22 34.39 2d93 n MET 83 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2d93 n GLY 84 N 4.45 0.99 3.64 -5.12 0.00 -1.23 -5.00 105.19 102.91 2d93 n GLY 84 Ca 0.33 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.78 2.43 0.05 1.61 -0.87 -0.22 -3.37 114.94 113.79 2d93 s ASN 85 Ca 0.00 1.44 0.04 0.00 -1.57 0.00 0.00 52.86 52.76 2d93 s ASN 85 Cb 0.00 -2.12 -0.03 0.00 -0.02 0.00 0.00 41.25 39.08 2d93 s ASN 85 CO 0.00 -3.29 -0.11 -0.94 -2.57 0.00 0.00 177.10 170.20 2d93 s SER 86 N -3.13 1.22 0.01 -1.22 1.04 -1.26 -3.41 113.70 106.95 2d93 s SER 86 Ca 0.66 -0.56 -0.28 0.00 0.48 0.00 0.00 55.95 56.25 2d93 s SER 86 Cb -0.20 -0.01 0.08 0.00 0.10 0.00 0.00 66.02 65.99 2d93 s SER 86 CO 0.59 -0.13 0.73 0.72 0.98 0.00 0.00 173.24 176.14 2d93 s PHE 87 N -1.26 -0.53 0.00 5.02 -0.12 -0.51 -5.03 117.98 115.55 2d93 s PHE 87 Ca -0.06 0.67 0.00 0.00 -0.05 0.00 0.00 56.93 57.49 2d93 s PHE 87 Cb -0.10 0.48 0.00 0.00 -0.63 0.00 0.00 43.02 42.78 2d93 s PHE 87 CO 0.01 -0.63 0.00 0.41 -0.05 0.00 0.00 175.22 174.96 2d93 n GLY 88 N 0.30 0.90 3.56 1.99 0.00 -1.26 -0.00 105.19 110.68 2d93 n GLY 88 Ca -0.15 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.20 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 0.74 0.18 -0.61 -4.36 -1.25 -4.94 121.20 110.96 2d93 s ILE 89 Ca 0.00 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.36 2d93 s ILE 89 Cb 0.00 -2.34 -0.05 0.00 1.25 0.00 0.00 42.46 41.32 2d93 s ILE 89 CO 0.00 0.00 0.40 0.42 0.24 0.00 0.00 174.94 176.00 2d93 s THR 90 N -3.14 5.17 -2.00 8.37 -4.23 -1.26 -4.80 115.64 113.74 2d93 s THR 90 Ca 0.21 -0.13 0.12 0.00 -1.18 0.00 0.00 61.69 60.71 2d93 s THR 90 Cb 0.03 -3.68 0.34 0.00 1.34 0.00 0.00 72.50 70.52 2d93 s THR 90 CO 0.12 -0.09 1.14 -0.81 -0.54 0.00 0.00 174.62 174.44 2d93 n PRO 91 N -0.33 0.49 -3.67 3.99 -0.04 -1.26 -4.74 135.00 129.43 2d93 n PRO 91 Ca -0.03 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.13 2d93 n PRO 91 Cb 0.53 -1.38 -0.04 0.00 -0.04 0.00 0.00 33.50 32.57 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 5.19 0.64 0.52 -4.23 -1.26 -3.82 115.64 110.68 2d93 s THR 92 Ca 0.18 -0.14 0.27 0.00 -1.18 0.00 0.00 61.69 60.81 2d93 s THR 92 Cb 0.08 -3.67 0.30 0.00 1.34 0.00 0.00 72.50 70.55 2d93 s THR 92 CO 0.14 -0.06 1.81 -0.07 -0.54 0.00 0.00 174.62 175.90 2d93 h LEU 93 N 2.45 0.00-10.15 4.79 3.38 -1.93 -3.42 115.31 110.43 2d93 h LEU 93 Ca -0.47 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.01 2d93 h LEU 93 Cb 1.18 0.00 0.21 0.00 0.09 0.00 0.00 40.66 42.13 2d93 h LEU 93 CO 0.71 0.00 0.01 -0.67 0.09 0.00 0.00 178.44 178.57 2d93 n ASP 94 N -3.10 -0.61 -3.60 -0.43 2.03 -1.26 -5.02 116.55 104.56 2d93 n ASP 94 Ca 0.02 0.23 -0.18 0.00 0.52 0.00 0.00 54.79 55.38 2d93 n ASP 94 Cb 0.55 -1.37 -0.03 0.00 -0.72 0.00 0.00 41.12 39.56 2d93 n ASP 94 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2d93 n LYS 95 N -4.06 1.20 -3.57 -0.67 5.02 -1.26 -4.77 118.16 110.05 2d93 n LYS 95 Ca 0.08 -2.13 -0.05 0.00 -2.02 0.00 0.00 58.31 54.19 2d93 n LYS 95 Cb 0.53 0.47 -0.02 0.00 -0.02 0.00 0.00 35.03 35.99 2d93 n LYS 95 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 2d93 s GLN 96 N -3.15 0.43 0.08 1.97 0.00 -1.26 -4.96 119.66 112.77 2d93 s GLN 96 Ca 0.05 -0.16 0.10 0.00 -0.00 0.00 0.00 55.36 55.36 2d93 s GLN 96 Cb -0.00 0.20 -0.03 0.00 0.00 0.00 0.00 33.01 33.17 2d93 s GLN 96 CO 0.03 -0.19 -0.27 0.71 0.00 0.00 0.00 175.29 175.58 2d93 s TYR 97 N -2.58 2.32 -0.01 9.60 1.51 -1.26 -1.20 117.35 125.73 2d93 s TYR 97 Ca 0.08 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.45 2d93 s TYR 97 Cb -0.01 -1.33 -0.07 0.00 -0.11 0.00 0.00 41.96 40.44 2d93 s TYR 97 CO -0.06 0.23 1.74 1.41 -1.11 0.00 0.00 175.55 177.76 2d93 s MET 98 N -1.63 4.17 -0.54 -0.62 1.75 -1.10 -4.85 119.30 116.48 2d93 s MET 98 Ca 0.13 2.33 -0.02 0.00 -1.25 0.00 0.00 55.69 56.88 2d93 s MET 98 Cb -0.10 -3.97 0.34 0.00 2.84 0.00 0.00 34.83 33.94 2d93 s MET 98 CO 0.04 -0.86 2.06 1.58 -0.65 0.00 0.00 175.02 177.20 2d93 n HIS 99 N 6.98 2.54 -3.61 4.11 -0.00 -1.26 0.58 115.22 124.57 2d93 n HIS 99 Ca 0.18 -2.57 0.00 0.00 0.46 0.00 0.00 57.72 55.79 2d93 n HIS 99 Cb 0.42 -1.26 0.00 0.00 -0.12 0.00 0.00 29.99 29.03 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 -0.37 -0.76 3.02 1.57 0.00 -1.26 -4.59 105.19 102.80 2d93 n GLY 100 Ca 0.50 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.00 1.13 -0.07 -0.61 1.01 0.47 0.12 121.20 120.26 2d93 s ILE 101 Ca 0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.14 2d93 s ILE 101 Cb 0.00 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 2d93 s ILE 101 CO 0.00 0.36 0.12 -0.69 0.00 0.00 0.00 174.94 174.73 2d93 s VAL 102 N 0.71 5.18 -0.17 2.92 1.01 -0.81 -0.49 120.40 128.75 2d93 s VAL 102 Ca -0.14 -0.06 -0.10 0.00 0.00 0.00 0.00 61.98 61.69 2d93 s VAL 102 Cb -0.16 -3.31 0.06 0.00 0.00 0.00 0.00 36.38 32.97 2d93 s VAL 102 CO 0.03 0.50 0.43 -0.13 0.00 0.00 0.00 175.10 175.93 2d93 s ARG 103 N -1.36 0.42 0.82 2.72 0.52 0.91 -1.66 118.95 121.32 2d93 s ARG 103 Ca 0.19 0.80 -0.13 0.00 -0.52 0.00 0.00 55.73 56.07 2d93 s ARG 103 Cb -0.12 0.01 0.08 0.00 0.52 0.00 0.00 34.95 35.44 2d93 s ARG 103 CO 0.09 -0.15 1.17 0.25 0.02 0.00 0.00 175.30 176.68 2d93 n THR 104 N 4.14 1.86 -0.05 0.02 -2.24 -0.77 -0.10 114.28 117.15 2d93 n THR 104 Ca -0.22 -0.20 -0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2d93 n THR 104 Cb 0.56 -1.17 -0.14 0.00 -2.10 0.00 0.00 70.33 67.48 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 -3.27 0.94 -4.34 -0.78 4.76 0.10 -3.03 118.16 112.54 2d93 n LYS 105 Ca 0.13 -0.08 -0.20 0.00 -2.87 0.00 0.00 58.31 55.29 2d93 n LYS 105 Cb 0.51 -1.43 -0.08 0.00 -1.84 0.00 0.00 35.03 32.18 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 -2.80 0.18 0.78 -0.18 -7.23 -1.25 -4.73 120.40 105.17 2d93 s VAL 106 Ca -0.07 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.06 2d93 s VAL 106 Cb 0.08 -2.46 0.15 0.00 0.56 0.00 0.00 36.38 34.71 2d93 s VAL 106 CO 0.71 0.00 1.07 1.51 -0.31 0.00 0.00 175.10 178.09 2d93 s ASP 107 N -3.42 4.02 -1.47 4.85 -4.77 -1.26 -4.44 116.67 110.19 2d93 s ASP 107 Ca 0.36 -0.30 -0.07 0.00 -3.30 0.00 0.00 52.55 49.23 2d93 s ASP 107 Cb 0.03 0.04 0.05 0.00 -1.09 0.00 0.00 42.92 41.95 2d93 s ASP 107 CO 0.22 -2.09 0.70 0.47 0.70 0.00 0.00 175.17 175.17 2d93 n ASP 108 N -3.04 -2.24 -4.60 2.11 8.00 -1.07 -4.92 116.55 110.77 2d93 n ASP 108 Ca 0.16 -0.90 -0.40 0.00 0.71 0.00 0.00 54.79 54.36 2d93 n ASP 108 Cb 0.60 -3.47 -0.09 0.00 -0.02 0.00 0.00 41.12 38.14 2d93 n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d93 s GLN 110 N 2.16 3.74 0.02 0.00 -0.21 -0.62 -0.31 119.66 124.43 2d93 s GLN 110 Ca 0.17 0.17 -0.06 0.00 0.02 0.00 0.00 55.36 55.65 2d93 s GLN 110 Cb -0.16 -3.09 -0.00 0.00 1.00 0.00 0.00 33.01 30.75 2d93 s GLN 110 CO 0.10 0.64 0.11 -0.06 -2.12 0.00 0.00 175.29 173.96 2d93 s PHE 111 N -1.25 0.11 0.08 0.91 0.08 0.80 -1.52 117.98 117.19 2d93 s PHE 111 Ca 0.28 -0.30 0.10 0.00 0.12 0.00 0.00 56.93 57.12 2d93 s PHE 111 Cb -0.14 -0.09 -0.03 0.00 -0.57 0.00 0.00 43.02 42.18 2d93 s PHE 111 CO 0.15 -0.31 -0.25 0.54 -0.10 0.00 0.00 175.22 175.24 2d93 s VAL 112 N -1.86 2.09 0.10 -0.44 0.11 -1.17 -2.41 120.40 116.82 2d93 s VAL 112 Ca -0.11 -1.53 0.09 0.00 -2.93 0.00 0.00 61.98 57.50 2d93 s VAL 112 Cb -0.05 -1.82 -0.03 0.00 -1.53 0.00 0.00 36.38 32.94 2d93 s VAL 112 CO -0.01 0.20 -0.22 0.00 -3.33 0.00 0.00 175.10 171.74 2d93 s ILE 114 N -1.10 -0.23 0.50 0.00 1.01 -0.99 -1.28 121.20 119.11 2d93 s ILE 114 Ca 0.08 0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.73 2d93 s ILE 114 Cb -0.10 -0.40 -0.08 0.00 0.01 0.00 0.00 42.46 41.90 2d93 s ILE 114 CO 0.04 0.09 1.10 0.00 0.00 0.00 0.00 174.94 176.18 2d93 n ALA 115 N 4.83 0.64 0.21 9.38 0.00 -1.26 -1.47 120.51 132.84 2d93 n ALA 115 Ca -0.15 0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2d93 n ALA 115 Cb 0.51 -2.17 -0.04 0.00 0.00 0.00 0.00 19.45 17.75 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 1.29 -0.54 -1.50 0.00 4.15 -1.87 0.51 115.11 117.14 2d93 h GLN 116 Ca -0.48 0.04 0.47 0.00 0.77 0.00 0.00 58.65 59.46 2d93 h GLN 116 Cb 1.33 0.12 -0.11 0.00 0.21 0.00 0.00 27.48 29.03 2d93 h GLN 116 CO 0.55 -0.36 1.01 1.96 -1.93 0.00 0.00 178.83 180.06 2d93 h GLN 117 N -0.70 0.04 0.00 1.69 1.08 -1.92 1.78 115.11 117.08 2d93 h GLN 117 Ca -0.06 -0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.91 2d93 h GLN 117 Cb 0.43 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.81 2d93 h GLN 117 CO 0.09 0.03 -1.44 -0.44 -0.95 0.00 0.00 178.83 176.12 2d93 h ASP 118 N 0.04 0.00 0.68 1.46 3.32 -1.91 -3.16 116.42 116.86 2d93 h ASP 118 Ca 0.85 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.90 2d93 h ASP 118 Cb 2.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 42.47 2d93 h ASP 118 CO -0.30 0.86 0.00 0.00 -1.72 0.00 0.00 179.24 178.08 2d93 n TYR 119 N -3.07 0.00 0.46 4.55 9.36 0.59 -2.46 117.16 126.59 2d93 n TYR 119 Ca -0.11 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.16 2d93 n TYR 119 Cb 0.96 -0.48 -0.07 0.00 -0.63 0.00 0.00 39.34 39.12 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 -1.48 0.00 0.03 2.98 -0.00 -0.10 -4.18 117.44 114.69 2d93 n TRP 120 Ca 0.05 0.00 0.05 0.00 -0.00 0.00 0.00 57.50 57.60 2d93 n TRP 120 Cb 0.23 -0.03 -0.09 0.00 -0.00 0.00 0.00 31.31 31.43 2d93 n TRP 120 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 177.69 180.58 2d93 n ARG 121 N -1.34 0.63 -0.05 5.87 1.85 -1.06 -3.63 116.66 118.94 2d93 n ARG 121 Ca 0.02 0.07 -0.02 0.00 -1.00 0.00 0.00 57.85 56.92 2d93 n ARG 121 Cb 0.19 -1.72 -0.01 0.00 -1.05 0.00 0.00 32.46 29.87 2d93 n ARG 121 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 2d93 h ILE 122 N 0.00 0.00 0.35 8.89 2.04 -1.70 -3.42 117.51 123.67 2d93 h ILE 122 Ca -0.12 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 2d93 h ILE 122 Cb 1.35 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 2d93 h ILE 122 CO 0.02 0.00 -0.26 -0.07 0.00 0.00 0.00 178.15 177.84 2d93 h LEU 123 N -0.77 -0.67 0.00 1.44 4.07 -1.80 -3.44 115.31 114.14 2d93 h LEU 123 Ca 0.00 0.04 -0.16 0.00 0.08 0.00 0.00 57.88 57.85 2d93 h LEU 123 Cb 0.18 0.21 0.09 0.00 1.08 0.00 0.00 40.66 42.22 2d93 h LEU 123 CO 0.00 -0.37 -0.08 0.59 -1.08 0.00 0.00 178.44 177.50 2d93 n ASN 124 N -3.92 -2.72 -2.37 -0.43 3.02 -1.24 -4.94 115.26 102.66 2d93 n ASN 124 Ca -0.07 -0.38 -0.26 0.00 -0.03 0.00 0.00 54.58 53.84 2d93 n ASN 124 Cb 0.25 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 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 -4.11 3.25 -2.82 3.10 8.25 -1.26 -4.88 115.22 116.75 2d93 n HIS 125 Ca 0.06 -2.91 -0.43 0.00 -0.26 0.00 0.00 57.72 54.18 2d93 n HIS 125 Cb 0.26 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 2d93 n HIS 125 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2d93 s VAL 126 N -5.31 4.42 -0.79 1.59 0.11 -1.26 -4.94 120.40 114.22 2d93 s VAL 126 Ca 0.49 0.54 -0.23 0.00 -2.93 0.00 0.00 61.98 59.85 2d93 s VAL 126 Cb 0.40 -4.49 -0.16 0.00 -1.53 0.00 0.00 36.38 30.61 2d93 s VAL 126 CO -0.14 -0.97 1.91 -0.62 -3.33 0.00 0.00 175.10 171.95 2d93 n GLU 127 N 7.33 1.44 -0.03 1.54 1.02 -1.26 -4.23 120.64 126.46 2d93 n GLU 127 Ca 0.04 -1.90 -0.07 0.00 -0.02 0.00 0.00 57.16 55.22 2d93 n GLU 127 Cb 0.48 -3.02 -0.02 0.00 -0.02 0.00 0.00 31.44 28.86 2d93 n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2d93 n LYS 128 N 7.25 0.15 -3.81 3.49 4.76 -1.26 -5.14 118.16 123.60 2d93 n LYS 128 Ca 0.49 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.99 2d93 n LYS 128 Cb 0.41 -0.75 0.02 0.00 -1.84 0.00 0.00 35.03 32.87 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 -3.41 -1.35 -1.47 4.39 7.64 -1.26 -5.20 113.62 112.96 2d93 n SER 129 Ca -0.12 -1.51 -0.02 0.00 1.01 0.00 0.00 58.87 58.23 2d93 n SER 129 Cb 0.51 2.14 0.01 0.00 -1.01 0.00 0.00 64.21 65.86 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 -0.79 1.75 3.57 0.23 0.00 -1.26 -4.93 105.19 103.76 2d93 n GLY 130 Ca 0.01 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 2d93 n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d93 s PRO 131 N -2.03 2.54 -0.56 1.61 0.04 -1.26 -4.91 135.00 130.43 2d93 s PRO 131 Ca 0.04 -0.55 -0.27 0.00 0.04 0.00 0.00 61.00 60.26 2d93 s PRO 131 Cb -0.01 -5.12 -0.02 0.00 0.04 0.00 0.00 34.50 29.39 2d93 s PRO 131 CO 0.03 -3.56 1.89 -1.12 0.04 0.00 0.00 177.00 174.29 2d93 s SER 132 N 7.57 5.30 -0.25 6.66 0.01 -1.26 -4.91 113.70 126.82 2d93 s SER 132 Ca 0.70 0.54 -0.10 0.00 1.31 0.00 0.00 55.95 58.39 2d93 s SER 132 Cb -0.05 -2.53 0.10 0.00 0.21 0.00 0.00 66.02 63.76 2d93 s SER 132 CO 0.03 -2.32 0.55 -0.44 0.41 0.00 0.00 173.24 171.48 2d93 s SER 133 N 8.11 -0.74 0.00 2.44 0.01 -1.26 -5.27 113.70 117.00 2d93 s SER 133 Ca 0.71 1.30 0.00 0.00 1.31 0.00 0.00 55.95 59.27 2d93 s SER 133 Cb -0.14 1.70 0.00 0.00 0.21 0.00 0.00 66.02 67.79 2d93 s SER 133 CO 0.23 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.27