#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d93 h SER 2 N 0.00 -0.13 0.00 1.61 0.02 -2.05 -3.43 113.55 109.57 2d93 h SER 2 Ca 0.00 -0.44 -0.14 0.00 -0.84 0.00 0.00 61.79 60.37 2d93 h SER 2 Cb 0.00 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2d93 h SER 2 CO 0.00 0.46 -1.32 -1.20 -1.14 0.00 0.00 176.83 173.63 2d93 n SER 3 N -4.88 0.94 0.00 3.07 7.64 -1.26 -5.15 113.62 113.99 2d93 n SER 3 Ca -0.08 0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2d93 n SER 3 Cb 0.28 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.11 2d93 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d93 n GLY 4 N 2.40 1.99 3.14 0.23 0.00 -1.26 -5.05 105.19 106.64 2d93 n GLY 4 Ca -0.18 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.10 2d93 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d93 s SER 5 N 0.00 4.15 -0.29 1.61 0.01 -1.26 -5.07 113.70 112.85 2d93 s SER 5 Ca 0.00 -1.01 -0.16 0.00 1.31 0.00 0.00 55.95 56.09 2d93 s SER 5 Cb 0.00 -1.60 0.15 0.00 0.21 0.00 0.00 66.02 64.78 2d93 s SER 5 CO 0.00 -0.13 0.98 -0.94 0.41 0.00 0.00 173.24 173.56 2d93 s SER 6 N 1.25 -0.50 0.00 2.44 1.04 -1.26 -5.07 113.70 111.59 2d93 s SER 6 Ca -0.02 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.21 2d93 s SER 6 Cb -0.17 1.22 0.00 0.00 0.10 0.00 0.00 66.02 67.16 2d93 s SER 6 CO -0.06 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.64 2d93 n GLY 7 N 3.72 -0.60 0.15 7.32 0.00 -1.26 -4.96 105.19 109.56 2d93 n GLY 7 Ca -0.18 -0.91 0.08 0.00 0.00 0.00 0.00 46.02 45.01 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 0.00 -1.85 1.61 3.32 -2.07 -3.36 116.42 114.06 2d93 h ASP 8 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2d93 h ASP 8 Cb 0.00 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.14 2d93 h ASP 8 CO 0.00 0.17 -0.82 0.47 -1.72 0.00 0.00 179.24 177.34 2d93 n ASP 9 N -2.92 3.65 -0.06 6.45 8.00 -1.26 -4.88 116.55 125.54 2d93 n ASP 9 Ca -0.00 -3.48 -0.11 0.00 0.71 0.00 0.00 54.79 51.90 2d93 n ASP 9 Cb 0.62 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 41.13 2d93 n ASP 9 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 2d93 h ASP 10 N 2.86 0.31 0.33 -2.24 2.03 -1.93 -2.40 116.42 115.37 2d93 h ASP 10 Ca 0.15 -0.29 -0.02 0.00 -0.73 0.00 0.00 57.03 56.14 2d93 h ASP 10 Cb 0.78 -0.08 0.00 0.00 -0.83 0.00 0.00 39.33 39.20 2d93 h ASP 10 CO 0.74 0.53 -0.16 0.40 -1.03 0.00 0.00 179.24 179.72 2d93 h ILE 11 N 0.08 0.70 -0.22 4.15 2.04 -1.94 -2.15 117.51 120.17 2d93 h ILE 11 Ca 0.05 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.63 2d93 h ILE 11 Cb 0.36 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 2d93 h ILE 11 CO 0.01 0.07 -0.55 -0.33 0.00 0.00 0.00 178.15 177.34 2d93 h GLU 12 N -0.62 -0.51 -0.96 2.37 5.08 -1.94 0.26 114.58 118.26 2d93 h GLU 12 Ca -0.05 0.03 0.19 0.00 -1.00 0.00 0.00 59.36 58.54 2d93 h GLU 12 Cb 0.45 0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 2d93 h GLU 12 CO 0.07 -0.34 0.61 1.96 -1.00 0.00 0.00 179.01 180.31 2d93 h GLN 13 N -0.53 0.61 -0.24 2.33 4.20 -1.46 -0.77 115.11 119.25 2d93 h GLN 13 Ca 0.04 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 2d93 h GLN 13 Cb 0.66 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2d93 h GLN 13 CO -0.49 0.40 -0.02 1.25 -0.67 0.00 0.00 178.83 179.31 2d93 h LEU 14 N 0.63 0.43 -0.31 1.46 5.85 -0.23 -3.20 115.31 119.94 2d93 h LEU 14 Ca 0.52 -0.33 0.07 0.00 0.84 0.00 0.00 57.88 58.98 2d93 h LEU 14 Cb 0.98 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 2d93 h LEU 14 CO -0.27 0.66 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.15 2d93 h LEU 15 N 0.20 -0.85 -0.94 2.25 3.38 0.91 -0.95 115.31 119.30 2d93 h LEU 15 Ca 0.07 0.16 0.29 0.00 0.09 0.00 0.00 57.88 58.48 2d93 h LEU 15 Cb 0.45 0.41 -0.17 0.00 0.09 0.00 0.00 40.66 41.43 2d93 h LEU 15 CO 0.02 -0.29 0.12 -0.62 0.09 0.00 0.00 178.44 177.76 2d93 n GLU 16 N -5.39 -0.07 -0.10 1.13 1.02 -1.02 0.11 120.64 116.33 2d93 n GLU 16 Ca 0.00 1.38 -0.11 0.00 -0.02 0.00 0.00 57.16 58.41 2d93 n GLU 16 Cb 0.31 -2.25 -0.04 0.00 -0.02 0.00 0.00 31.44 29.44 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 0.60 0.00 -0.32 3.04 -1.28 -2.53 116.94 116.45 2d93 h PHE 17 Ca 0.62 -0.12 0.00 0.00 3.98 0.00 0.00 57.97 62.44 2d93 h PHE 17 Cb 1.37 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 39.73 2d93 h PHE 17 CO -0.38 0.72 0.24 -1.33 -2.02 0.00 0.00 178.31 175.54 2d93 n MET 18 N -4.53 0.10 0.06 1.11 2.81 0.30 -0.28 117.12 116.70 2d93 n MET 18 Ca -0.03 0.59 -0.22 0.00 -1.81 0.00 0.00 57.70 56.23 2d93 n MET 18 Cb 0.30 -2.08 -0.15 0.00 -0.71 0.00 0.00 33.22 30.59 2d93 n MET 18 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2d93 h HIS 19 N 0.00 0.66 0.00 2.03 2.76 -0.98 -3.13 115.15 116.49 2d93 h HIS 19 Ca 0.00 -0.48 0.00 0.00 -2.20 0.00 0.00 60.37 57.69 2d93 h HIS 19 Cb 0.49 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.42 2d93 h HIS 19 CO 0.00 1.67 0.00 0.00 -1.30 0.00 0.00 177.93 178.30 2d93 n GLN 20 N -3.56 0.07 -4.15 5.26 10.64 0.61 -4.49 117.38 121.76 2d93 n GLN 20 Ca -0.25 0.27 -0.36 0.00 -1.83 0.00 0.00 57.00 54.84 2d93 n GLN 20 Cb 1.07 -1.50 -0.08 0.00 -0.86 0.00 0.00 30.24 28.87 2d93 n GLN 20 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2d93 s LEU 21 N -2.73 3.88 0.10 2.61 1.43 -1.17 -5.02 118.68 117.78 2d93 s LEU 21 Ca 0.06 0.24 -0.15 0.00 -1.03 0.00 0.00 54.13 53.25 2d93 s LEU 21 Cb 0.05 -1.92 -0.08 0.00 0.03 0.00 0.00 46.19 44.26 2d93 s LEU 21 CO 0.12 0.35 1.42 1.55 0.23 0.00 0.00 176.35 180.02 2d93 h PRO 22 N 5.37 0.70 0.00 1.29 0.13 -1.81 0.57 132.00 138.26 2d93 h PRO 22 Ca -0.50 -0.37 -0.03 0.00 -0.87 0.00 0.00 66.00 64.23 2d93 h PRO 22 Cb 1.20 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2d93 h PRO 22 CO 0.58 0.99 -0.16 0.00 -0.23 0.00 0.00 178.00 179.18 2d93 h ALA 23 N 0.71 1.52 0.01 -0.56 0.00 -1.93 0.09 119.26 119.09 2d93 h ALA 23 Ca 0.05 -0.14 -0.34 0.00 0.00 0.00 0.00 54.91 54.47 2d93 h ALA 23 Cb 0.86 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 2d93 h ALA 23 CO 0.07 0.20 -2.10 1.19 0.00 0.00 0.00 179.25 178.61 2d93 n PHE 24 N -4.03 0.47 -0.07 0.00 3.72 -1.16 -4.32 117.46 112.08 2d93 n PHE 24 Ca -0.02 0.16 -0.14 0.00 -0.05 0.00 0.00 57.45 57.40 2d93 n PHE 24 Cb 0.24 -1.08 -0.02 0.00 -0.94 0.00 0.00 39.48 37.67 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 0.91 0.51 -0.92 4.37 0.00 0.42 -3.21 119.26 121.34 2d93 h ALA 25 Ca -0.44 -0.51 0.31 0.00 0.00 0.00 0.00 54.91 54.27 2d93 h ALA 25 Cb 2.13 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 19.67 2d93 h ALA 25 CO 0.05 0.68 0.21 0.09 0.00 0.00 0.00 179.25 180.28 2d93 n ASN 26 N -4.00 0.06 -4.95 0.00 3.02 -0.00 -4.33 115.26 105.06 2d93 n ASN 26 Ca -0.04 1.55 -0.25 0.00 -0.03 0.00 0.00 54.58 55.82 2d93 n ASN 26 Cb 0.62 -0.64 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 2d93 n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d93 s MET 27 N -5.70 3.48 1.11 3.52 0.23 -1.21 -5.09 119.30 115.63 2d93 s MET 27 Ca -0.10 -0.51 -0.17 0.00 -1.03 0.00 0.00 55.69 53.88 2d93 s MET 27 Cb 0.29 -2.84 0.18 0.00 -1.53 0.00 0.00 34.83 30.93 2d93 s MET 27 CO 0.72 0.38 0.29 -2.37 -2.03 0.00 0.00 175.02 172.00 2d93 n THR 28 N -1.09 0.00 0.46 3.16 5.66 -1.26 -4.87 114.28 116.34 2d93 n THR 28 Ca -0.06 -0.13 0.13 0.00 -3.05 0.00 0.00 64.05 60.94 2d93 n THR 28 Cb 0.55 -0.60 0.33 0.00 -1.55 0.00 0.00 70.33 69.07 2d93 n THR 28 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2d93 h MET 29 N -2.61 0.00 -0.29 1.09 -0.00 -1.91 -3.27 114.93 107.94 2d93 h MET 29 Ca -0.37 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 59.25 2d93 h MET 29 Cb 1.04 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.64 2d93 h MET 29 CO 0.25 0.00 -0.15 0.77 -0.00 0.00 0.00 176.91 177.77 2d93 h SER 30 N 0.00 0.64 0.09 -0.10 0.02 -1.99 -2.79 113.55 109.43 2d93 h SER 30 Ca 0.00 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2d93 h SER 30 Cb 0.81 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 2d93 h SER 30 CO 0.00 0.91 -0.02 0.58 -1.14 0.00 0.00 176.83 177.17 2d93 h VAL 31 N 0.37 0.31 0.14 2.27 2.07 -1.91 -3.11 116.25 116.39 2d93 h VAL 31 Ca 0.06 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 2d93 h VAL 31 Cb 0.68 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2d93 h VAL 31 CO 0.05 0.02 -0.07 0.03 0.02 0.00 0.00 177.57 177.61 2d93 h ARG 32 N 0.00 -0.18 -0.91 1.57 3.08 -1.63 -2.68 114.38 113.62 2d93 h ARG 32 Ca -0.00 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.21 2d93 h ARG 32 Cb 0.06 0.04 -0.15 0.00 0.08 0.00 0.00 29.97 30.01 2d93 h ARG 32 CO 0.00 -0.12 -0.35 0.54 -1.07 0.00 0.00 179.97 178.97 2d93 n ARG 33 N -2.83 -0.20 -0.08 0.04 1.74 -1.18 0.39 116.66 114.53 2d93 n ARG 33 Ca -0.02 1.41 -0.06 0.00 -0.77 0.00 0.00 57.85 58.40 2d93 n ARG 33 Cb 0.07 -2.09 -0.00 0.00 -1.02 0.00 0.00 32.46 29.43 2d93 n ARG 33 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2d93 h GLU 34 N 0.00 -0.07 -0.29 5.56 5.08 -1.64 -2.09 114.58 121.13 2d93 h GLU 34 Ca 0.33 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.73 2d93 h GLU 34 Cb 0.55 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2d93 h GLU 34 CO -0.91 -0.05 0.07 -0.07 -1.00 0.00 0.00 179.01 177.05 2d93 h LEU 35 N -0.07 0.04 -1.59 1.33 3.38 0.30 -0.32 115.31 118.38 2d93 h LEU 35 Ca 0.16 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.23 2d93 h LEU 35 Cb 0.31 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2d93 h LEU 35 CO -0.36 0.06 0.54 0.00 0.09 0.00 0.00 178.44 178.77 2d93 n SER 37 N -3.06 0.65 -0.70 0.00 2.88 -0.18 -4.09 113.62 109.12 2d93 n SER 37 Ca 0.03 0.29 0.06 0.00 -1.33 0.00 0.00 58.87 57.92 2d93 n SER 37 Cb 0.64 0.48 0.16 0.00 -0.75 0.00 0.00 64.21 64.74 2d93 n SER 37 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2d93 n VAL 38 N -2.79 0.86 -4.30 2.46 0.24 0.31 -4.96 118.33 110.15 2d93 n VAL 38 Ca -0.12 -0.93 -0.34 0.00 -2.04 0.00 0.00 64.34 60.91 2d93 n VAL 38 Cb 0.84 0.61 -0.11 0.00 -1.47 0.00 0.00 33.84 33.71 2d93 n VAL 38 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2d93 s MET 39 N -1.01 3.74 0.04 7.34 0.00 0.53 -4.29 119.30 125.66 2d93 s MET 39 Ca 0.25 -0.47 -0.20 0.00 0.00 0.00 0.00 55.69 55.27 2d93 s MET 39 Cb 0.13 -2.99 -0.06 0.00 0.00 0.00 0.00 34.83 31.91 2d93 s MET 39 CO 0.18 0.26 0.60 0.42 0.00 0.00 0.00 175.02 176.48 2d93 s ILE 40 N 0.33 4.79 -0.23 3.16 1.09 0.77 -4.87 121.20 126.24 2d93 s ILE 40 Ca -0.02 1.26 -0.19 0.00 -1.10 0.00 0.00 60.65 60.61 2d93 s ILE 40 Cb -0.14 -3.93 -0.03 0.00 -1.06 0.00 0.00 42.46 37.31 2d93 s ILE 40 CO 0.02 0.49 0.55 -0.36 -0.10 0.00 0.00 174.94 175.54 2d93 s PHE 41 N -0.70 3.33 0.04 3.97 0.40 -1.26 -2.17 117.98 121.58 2d93 s PHE 41 Ca 0.30 0.75 -0.05 0.00 -0.60 0.00 0.00 56.93 57.34 2d93 s PHE 41 Cb -0.19 -2.72 -0.01 0.00 0.51 0.00 0.00 43.02 40.60 2d93 s PHE 41 CO 0.19 -0.20 0.08 -1.21 0.70 0.00 0.00 175.22 174.78 2d93 s GLU 42 N 2.00 0.60 -0.20 0.44 0.41 -0.83 -5.03 118.70 116.09 2d93 s GLU 42 Ca 0.24 -0.83 -0.12 0.00 -0.41 0.00 0.00 54.97 53.85 2d93 s GLU 42 Cb -0.16 0.23 0.06 0.00 -1.78 0.00 0.00 34.13 32.49 2d93 s GLU 42 CO 0.09 -0.15 0.48 0.54 -0.49 0.00 0.00 175.26 175.74 2d93 s VAL 43 N -2.85 -0.02 -0.19 2.63 0.11 -1.26 -0.65 120.40 118.17 2d93 s VAL 43 Ca -0.03 0.06 -0.19 0.00 -2.93 0.00 0.00 61.98 58.89 2d93 s VAL 43 Cb 0.00 -0.70 -0.03 0.00 -1.53 0.00 0.00 36.38 34.12 2d93 s VAL 43 CO -0.06 0.02 0.52 -0.69 -3.33 0.00 0.00 175.10 171.57 2d93 s VAL 44 N 1.27 5.11 -0.07 2.04 1.01 0.20 -4.96 120.40 125.00 2d93 s VAL 44 Ca -0.08 0.97 -0.12 0.00 0.00 0.00 0.00 61.98 62.75 2d93 s VAL 44 Cb -0.07 -3.85 -0.30 0.00 0.00 0.00 0.00 36.38 32.17 2d93 s VAL 44 CO -0.12 0.19 0.63 -0.33 0.00 0.00 0.00 175.10 175.47 2d93 h GLU 45 N 7.36 0.36 -5.75 2.72 5.08 -1.96 -2.31 114.58 120.08 2d93 h GLU 45 Ca -0.35 -0.61 -0.60 0.00 -1.00 0.00 0.00 59.36 56.81 2d93 h GLU 45 Cb 1.16 0.23 -0.09 0.00 0.50 0.00 0.00 28.75 30.54 2d93 h GLU 45 CO 0.74 1.29 0.38 1.14 -1.00 0.00 0.00 179.01 181.57 2d93 s GLN 46 N -2.55 4.19 1.33 2.33 -2.07 -1.26 -3.82 119.66 117.80 2d93 s GLN 46 Ca -0.17 0.86 -0.21 0.00 -1.82 0.00 0.00 55.36 54.02 2d93 s GLN 46 Cb 0.05 -3.63 0.33 0.00 -1.09 0.00 0.00 33.01 28.67 2d93 s GLN 46 CO 0.83 -0.46 1.00 0.00 -1.32 0.00 0.00 175.29 175.35 2d93 s ALA 47 N 2.63 -0.23 -1.08 2.60 0.00 -1.26 -3.39 121.76 121.03 2d93 s ALA 47 Ca 0.33 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2d93 s ALA 47 Cb -0.15 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2d93 s ALA 47 CO 0.08 -4.20 0.00 0.41 0.00 0.00 0.00 175.76 172.06 2d93 n GLY 48 N 0.48 0.97 3.76 0.00 0.00 -1.19 -4.89 105.19 104.32 2d93 n GLY 48 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.81 3.37 -0.10 4.61 0.00 -1.22 -4.62 121.76 121.99 2d93 s ALA 49 Ca 0.00 0.83 -0.30 0.00 0.00 0.00 0.00 51.96 52.50 2d93 s ALA 49 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 2d93 s ALA 49 CO 0.00 -0.10 1.07 0.42 0.00 0.00 0.00 175.76 177.16 2d93 s ILE 50 N -1.21 4.61 -0.15 0.00 1.09 -1.26 -1.79 121.20 122.49 2d93 s ILE 50 Ca 0.45 1.90 0.00 0.00 -1.10 0.00 0.00 60.65 61.90 2d93 s ILE 50 Cb -0.30 -4.22 -0.23 0.00 -1.06 0.00 0.00 42.46 36.65 2d93 s ILE 50 CO 0.38 -0.02 0.23 -0.38 -0.10 0.00 0.00 174.94 175.05 2d93 n ILE 51 N 4.66 1.65 -3.71 2.92 2.08 0.56 -4.97 119.36 122.55 2d93 n ILE 51 Ca 0.10 -0.67 -0.13 0.00 0.56 0.00 0.00 62.75 62.61 2d93 n ILE 51 Cb 0.48 -1.46 -0.07 0.00 -0.75 0.00 0.00 39.64 37.83 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 -6.66 0.61 0.26 1.39 1.43 -1.24 -4.96 118.68 109.51 2d93 s LEU 52 Ca -0.22 0.04 0.10 0.00 -1.03 0.00 0.00 54.13 53.01 2d93 s LEU 52 Cb 0.07 1.53 -0.04 0.00 0.03 0.00 0.00 46.19 47.78 2d93 s LEU 52 CO 0.74 -0.57 -0.02 -1.61 0.23 0.00 0.00 176.35 175.11 2d93 s GLU 53 N -1.97 2.24 -0.01 1.70 2.02 -1.26 -1.40 118.70 120.00 2d93 s GLU 53 Ca -0.09 -1.44 -0.30 0.00 0.02 0.00 0.00 54.97 53.16 2d93 s GLU 53 Cb -0.02 -2.13 -0.05 0.00 0.10 0.00 0.00 34.13 32.03 2d93 s GLU 53 CO 0.01 0.36 1.34 0.16 0.02 0.00 0.00 175.26 177.16 2d93 s ASP 54 N -3.63 6.91 0.00 -0.19 -4.77 0.39 -3.15 116.67 112.23 2d93 s ASP 54 Ca 0.31 2.03 0.00 0.00 -3.30 0.00 0.00 52.55 51.59 2d93 s ASP 54 Cb -0.06 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.21 2d93 s ASP 54 CO 0.19 -0.68 0.00 0.61 0.70 0.00 0.00 175.17 175.99 2d93 n GLY 55 N 3.56 1.28 3.34 2.12 0.00 0.62 -4.93 105.19 111.18 2d93 n GLY 55 Ca 0.12 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.10 3.41 -0.68 1.61 0.74 -1.19 -4.91 119.66 116.54 2d93 s GLN 56 Ca 0.00 -0.61 -0.26 0.00 0.05 0.00 0.00 55.36 54.54 2d93 s GLN 56 Cb 0.00 -3.11 -0.10 0.00 1.10 0.00 0.00 33.01 30.89 2d93 s GLN 56 CO 0.00 -0.22 2.37 -2.00 -0.55 0.00 0.00 175.29 174.89 2d93 s GLU 57 N 1.51 1.86 0.09 1.67 2.12 -1.26 -2.69 118.70 122.00 2d93 s GLU 57 Ca 0.06 0.78 -0.31 0.00 0.36 0.00 0.00 54.97 55.86 2d93 s GLU 57 Cb -0.15 -4.71 -0.08 0.00 0.26 0.00 0.00 34.13 29.44 2d93 s GLU 57 CO -0.01 -3.92 1.59 -0.51 -0.54 0.00 0.00 175.26 171.86 2d93 s LEU 58 N 13.44 4.36 0.00 2.70 1.43 -0.77 -4.86 118.68 134.98 2d93 s LEU 58 Ca 0.92 2.48 0.00 0.00 -1.03 0.00 0.00 54.13 56.50 2d93 s LEU 58 Cb -0.14 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2d93 s LEU 58 CO 0.14 -0.84 0.61 -0.67 0.23 0.00 0.00 176.35 175.83 2d93 n ASP 59 N 4.99 0.75 -3.71 2.29 -0.08 -1.26 -4.11 116.55 115.41 2d93 n ASP 59 Ca 0.15 -1.34 -0.17 0.00 -1.51 0.00 0.00 54.79 51.92 2d93 n ASP 59 Cb 0.40 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.70 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 -0.34 0.56 -0.01 1.67 0.01 -1.26 -1.52 113.70 112.81 2d93 s SER 60 Ca 0.00 0.13 -0.30 0.00 1.31 0.00 0.00 55.95 57.09 2d93 s SER 60 Cb 0.00 -0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.17 2d93 s SER 60 CO 0.00 -0.19 1.15 0.86 0.41 0.00 0.00 173.24 175.46 2d93 s TRP 61 N 1.68 3.38 0.01 2.43 -0.00 -0.30 -4.21 118.94 121.94 2d93 s TRP 61 Ca -0.02 1.35 0.01 0.00 -0.00 0.00 0.00 56.10 57.44 2d93 s TRP 61 Cb -0.12 -3.35 -0.04 0.00 -0.00 0.00 0.00 33.47 29.96 2d93 s TRP 61 CO -0.04 -1.00 0.06 0.71 -0.00 0.00 0.00 176.95 176.68 2d93 s TYR 62 N 1.59 3.22 -0.04 5.86 1.51 0.29 -2.45 117.35 127.34 2d93 s TYR 62 Ca 0.56 0.16 -0.00 0.00 -1.01 0.00 0.00 57.07 56.77 2d93 s TYR 62 Cb -0.25 -1.70 0.03 0.00 -0.11 0.00 0.00 41.96 39.92 2d93 s TYR 62 CO 0.25 0.53 0.01 0.08 -1.11 0.00 0.00 175.55 175.31 2d93 s VAL 63 N -1.21 0.14 -0.29 0.71 1.01 -1.15 -0.38 120.40 119.23 2d93 s VAL 63 Ca 0.23 0.16 -0.29 0.00 0.00 0.00 0.00 61.98 62.09 2d93 s VAL 63 Cb -0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 2d93 s VAL 63 CO 0.15 0.16 1.77 -0.63 0.00 0.00 0.00 175.10 176.55 2d93 s ILE 64 N 1.37 3.50 -0.12 2.22 1.01 -0.71 -3.11 121.20 125.37 2d93 s ILE 64 Ca -0.05 0.53 0.14 0.00 0.00 0.00 0.00 60.65 61.26 2d93 s ILE 64 Cb -0.13 -3.62 -0.24 0.00 0.01 0.00 0.00 42.46 38.48 2d93 s ILE 64 CO -0.03 -0.36 0.39 0.18 0.00 0.00 0.00 174.94 175.12 2d93 n LEU 65 N 9.81 0.65 -3.63 2.97 4.77 -1.10 -2.25 117.00 128.22 2d93 n LEU 65 Ca 0.22 0.23 -0.12 0.00 -0.03 0.00 0.00 56.01 56.30 2d93 n LEU 65 Cb 0.46 0.22 -0.07 0.00 -2.33 0.00 0.00 43.42 41.70 2d93 n LEU 65 CO 0.67 0.47 0.54 0.21 -1.33 0.00 0.00 177.39 177.96 2d93 s ASN 66 N -5.90 -0.63 0.00 -1.43 2.47 -1.20 -4.81 114.94 103.43 2d93 s ASN 66 Ca -0.08 1.22 0.00 0.00 0.42 0.00 0.00 52.86 54.42 2d93 s ASN 66 Cb 0.07 1.24 0.00 0.00 -1.45 0.00 0.00 41.25 41.11 2d93 s ASN 66 CO 0.82 -0.21 0.00 0.61 -3.72 0.00 0.00 177.10 174.60 2d93 n GLY 67 N 2.50 -2.49 3.14 1.21 0.00 -1.26 -1.04 105.19 107.25 2d93 n GLY 67 Ca -0.13 -1.95 -0.24 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.33 1.30 -0.07 2.61 2.01 -1.26 -2.90 115.64 117.01 2d93 s THR 68 Ca 0.00 -0.68 0.05 0.00 0.31 0.00 0.00 61.69 61.36 2d93 s THR 68 Cb 0.00 -1.10 -0.00 0.00 0.01 0.00 0.00 72.50 71.41 2d93 s THR 68 CO 0.00 0.37 -0.22 0.68 -0.69 0.00 0.00 174.62 174.77 2d93 s VAL 69 N -0.24 1.82 -0.14 3.82 -7.23 -1.17 0.25 120.40 117.50 2d93 s VAL 69 Ca 0.03 -0.91 -0.04 0.00 -1.81 0.00 0.00 61.98 59.25 2d93 s VAL 69 Cb -0.08 -1.56 -0.03 0.00 0.56 0.00 0.00 36.38 35.27 2d93 s VAL 69 CO 0.00 0.51 -0.01 -0.70 -0.31 0.00 0.00 175.10 174.59 2d93 s GLU 70 N 0.10 3.56 -0.16 4.82 2.12 0.10 -2.23 118.70 127.02 2d93 s GLU 70 Ca -0.09 -0.46 -0.04 0.00 0.36 0.00 0.00 54.97 54.74 2d93 s GLU 70 Cb -0.15 -2.94 -0.03 0.00 0.26 0.00 0.00 34.13 31.28 2d93 s GLU 70 CO 0.05 0.36 -0.04 0.42 -0.54 0.00 0.00 175.26 175.51 2d93 s ILE 71 N 0.07 3.85 -0.01 -3.70 1.01 0.45 -0.94 121.20 121.93 2d93 s ILE 71 Ca 0.01 -0.37 0.03 0.00 0.00 0.00 0.00 60.65 60.32 2d93 s ILE 71 Cb -0.13 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 2d93 s ILE 71 CO 0.02 0.49 -0.09 -0.55 0.00 0.00 0.00 174.94 174.82 2d93 s SER 72 N 0.39 4.48 0.03 3.58 0.15 0.30 -0.24 113.70 122.40 2d93 s SER 72 Ca -0.04 -0.16 0.07 0.00 0.70 0.00 0.00 55.95 56.51 2d93 s SER 72 Cb -0.14 -1.02 -0.03 0.00 -1.71 0.00 0.00 66.02 63.12 2d93 s SER 72 CO 0.03 0.30 -0.18 -1.00 1.20 0.00 0.00 173.24 173.59 2d93 s HIS 73 N -0.94 2.57 -0.05 3.44 3.76 0.11 -0.18 115.29 124.01 2d93 s HIS 73 Ca 0.16 -0.25 0.31 0.00 -0.15 0.00 0.00 55.06 55.13 2d93 s HIS 73 Cb -0.11 -1.49 1.29 0.00 1.11 0.00 0.00 32.58 33.39 2d93 s HIS 73 CO 0.06 0.23 1.92 -1.00 -0.85 0.00 0.00 174.74 175.10 2d93 h PRO 74 N 4.67 0.00 -0.01 8.40 0.13 -1.86 -3.13 132.00 140.20 2d93 h PRO 74 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2d93 h PRO 74 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2d93 h PRO 74 CO 0.48 0.00 -0.20 -0.44 -0.23 0.00 0.00 178.00 177.61 2d93 h ASP 75 N 0.00 0.19 0.00 1.44 3.32 -1.95 -3.47 116.42 115.95 2d93 h ASP 75 Ca 0.00 -0.74 0.00 0.00 0.02 0.00 0.00 57.03 56.31 2d93 h ASP 75 Cb 0.45 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2d93 h ASP 75 CO 0.00 0.90 0.00 0.61 -1.72 0.00 0.00 179.24 179.03 2d93 n GLY 76 N 0.93 0.00 3.22 2.75 0.00 -1.18 -5.17 105.19 105.73 2d93 n GLY 76 Ca -0.09 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 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 0.97 -0.19 1.61 2.20 -1.25 -5.01 119.74 118.07 2d93 s LYS 77 Ca 0.00 -1.30 -0.04 0.00 -0.36 0.00 0.00 55.97 54.27 2d93 s LYS 77 Cb 0.00 -0.64 0.08 0.00 -1.51 0.00 0.00 37.83 35.77 2d93 s LYS 77 CO 0.00 0.09 0.21 0.08 -0.36 0.00 0.00 175.35 175.37 2d93 s VAL 78 N -2.78 -0.30 0.20 4.02 1.01 -1.26 0.08 120.40 121.38 2d93 s VAL 78 Ca 0.11 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.83 2d93 s VAL 78 Cb -0.01 -0.62 -0.08 0.00 0.00 0.00 0.00 36.38 35.67 2d93 s VAL 78 CO 0.01 -0.17 0.70 -1.61 0.00 0.00 0.00 175.10 174.03 2d93 s GLU 79 N 2.31 4.24 -0.22 2.72 2.02 0.67 -4.90 118.70 125.55 2d93 s GLU 79 Ca 0.06 0.84 0.02 0.00 0.02 0.00 0.00 54.97 55.91 2d93 s GLU 79 Cb -0.15 -2.92 0.04 0.00 0.10 0.00 0.00 34.13 31.20 2d93 s GLU 79 CO -0.11 0.42 -0.13 -0.80 0.02 0.00 0.00 175.26 174.67 2d93 s ASN 80 N -1.60 3.70 0.15 -0.19 -0.87 -1.26 -0.41 114.94 114.46 2d93 s ASN 80 Ca 0.41 -1.01 0.06 0.00 -1.57 0.00 0.00 52.86 50.75 2d93 s ASN 80 Cb -0.17 -1.40 -0.04 0.00 -0.02 0.00 0.00 41.25 39.62 2d93 s ASN 80 CO 0.21 -0.13 0.06 -0.76 -2.57 0.00 0.00 177.10 173.92 2d93 s LEU 81 N 1.27 3.57 0.25 0.60 1.43 -0.95 -5.05 118.68 119.80 2d93 s LEU 81 Ca -0.02 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2d93 s LEU 81 Cb -0.17 -2.22 -0.05 0.00 0.03 0.00 0.00 46.19 43.78 2d93 s LEU 81 CO -0.08 0.09 -0.00 -0.36 0.23 0.00 0.00 176.35 176.23 2d93 s PHE 82 N -1.67 1.66 -0.44 0.29 0.08 -1.26 -3.04 117.98 113.60 2d93 s PHE 82 Ca 0.29 -0.90 -0.43 0.00 0.12 0.00 0.00 56.93 56.01 2d93 s PHE 82 Cb -0.10 -0.98 -0.19 0.00 -0.57 0.00 0.00 43.02 41.19 2d93 s PHE 82 CO 0.21 0.01 1.46 -0.12 -0.10 0.00 0.00 175.22 176.68 2d93 n MET 83 N -0.47 0.00 0.00 0.44 0.00 -1.14 -1.04 117.12 114.90 2d93 n MET 83 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.65 2d93 n MET 83 Cb 0.64 -1.40 0.00 0.00 0.00 0.00 0.00 33.22 32.46 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 3.60 3.09 3.65 -5.12 0.00 -0.95 -5.03 105.19 104.43 2d93 n GLY 84 Ca 0.28 -1.11 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 2d93 n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2d93 n ASN 85 N 0.11 0.18 -4.33 1.61 4.13 -0.21 -4.18 115.26 112.57 2d93 n ASN 85 Ca 0.00 0.38 -0.18 0.00 1.68 0.00 0.00 54.58 56.46 2d93 n ASN 85 Cb 0.00 -1.46 -0.10 0.00 -1.54 0.00 0.00 39.78 36.68 2d93 n ASN 85 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2d93 s SER 86 N -2.62 2.41 -0.08 6.41 1.04 -1.26 -1.75 113.70 117.85 2d93 s SER 86 Ca 0.67 -1.03 -0.31 0.00 0.48 0.00 0.00 55.95 55.76 2d93 s SER 86 Cb -0.23 -0.11 0.12 0.00 0.10 0.00 0.00 66.02 65.90 2d93 s SER 86 CO 0.59 -0.21 1.01 0.72 0.98 0.00 0.00 173.24 176.33 2d93 s PHE 87 N -3.05 -0.27 0.00 5.02 -0.12 0.49 -4.97 117.98 115.08 2d93 s PHE 87 Ca 0.22 0.18 0.00 0.00 -0.05 0.00 0.00 56.93 57.28 2d93 s PHE 87 Cb 0.00 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.92 2d93 s PHE 87 CO 0.06 -0.41 0.00 0.41 -0.05 0.00 0.00 175.22 175.23 2d93 n GLY 88 N -0.14 1.54 2.94 1.99 0.00 -1.26 0.11 105.19 110.37 2d93 n GLY 88 Ca -0.05 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.96 -0.61 -5.35 -1.26 -4.85 119.36 103.33 2d93 n ILE 89 Ca 0.00 -2.04 -0.28 0.00 -0.27 0.00 0.00 62.75 60.16 2d93 n ILE 89 Cb 0.00 1.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.93 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 -3.10 5.19 -2.00 7.28 -4.23 -1.26 -4.84 115.64 112.67 2d93 s THR 90 Ca 0.33 -0.62 0.10 0.00 -1.18 0.00 0.00 61.69 60.33 2d93 s THR 90 Cb 0.01 -3.60 0.29 0.00 1.34 0.00 0.00 72.50 70.55 2d93 s THR 90 CO 0.24 0.02 1.06 -0.81 -0.54 0.00 0.00 174.62 174.58 2d93 n PRO 91 N -0.11 0.49 -3.80 3.99 -0.04 -1.26 -4.70 135.00 129.57 2d93 n PRO 91 Ca -0.07 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.03 2d93 n PRO 91 Cb 0.53 -1.33 -0.06 0.00 -0.04 0.00 0.00 33.50 32.59 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 5.43 0.47 0.52 -4.23 -1.26 -4.07 115.64 110.51 2d93 s THR 92 Ca 0.16 0.28 0.43 0.00 -1.18 0.00 0.00 61.69 61.38 2d93 s THR 92 Cb 0.07 -3.46 0.63 0.00 1.34 0.00 0.00 72.50 71.08 2d93 s THR 92 CO 0.12 0.57 1.32 0.18 -0.54 0.00 0.00 174.62 176.27 2d93 n LEU 93 N 2.34 0.00 -4.36 4.79 4.77 -1.26 -4.46 117.00 118.82 2d93 n LEU 93 Ca -0.18 0.84 -0.33 0.00 -0.03 0.00 0.00 56.01 56.31 2d93 n LEU 93 Cb 0.54 -0.42 0.14 0.00 -2.33 0.00 0.00 43.42 41.35 2d93 n LEU 93 CO 0.33 -0.84 -0.27 -0.67 -1.33 0.00 0.00 177.39 174.61 2d93 n ASP 94 N -3.62 -2.23 -4.65 -1.43 2.03 -1.26 -4.99 116.55 100.40 2d93 n ASP 94 Ca 0.38 0.14 -0.23 0.00 0.52 0.00 0.00 54.79 55.60 2d93 n ASP 94 Cb 1.71 -1.10 -0.08 0.00 -0.72 0.00 0.00 41.12 40.93 2d93 n ASP 94 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2d93 s LYS 95 N -3.55 2.21 0.03 -0.67 1.02 -1.26 -4.76 119.74 112.76 2d93 s LYS 95 Ca 0.56 -1.56 0.02 0.00 0.02 0.00 0.00 55.97 55.02 2d93 s LYS 95 Cb -0.17 -2.08 -0.02 0.00 -0.52 0.00 0.00 37.83 35.04 2d93 s LYS 95 CO 0.67 0.25 -0.07 -0.65 -0.92 0.00 0.00 175.35 174.63 2d93 s GLN 96 N -3.71 0.49 -0.11 1.68 1.11 -1.26 -4.99 119.66 112.88 2d93 s GLN 96 Ca 0.34 -0.63 0.00 0.00 0.01 0.00 0.00 55.36 55.08 2d93 s GLN 96 Cb -0.04 -0.30 -0.02 0.00 -1.01 0.00 0.00 33.01 31.64 2d93 s GLN 96 CO 0.20 0.06 -0.11 0.71 0.01 0.00 0.00 175.29 176.16 2d93 s TYR 97 N -1.10 2.84 0.05 0.91 2.02 -1.26 -1.85 117.35 118.96 2d93 s TYR 97 Ca -0.08 -0.38 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 2d93 s TYR 97 Cb -0.08 -1.80 -0.08 0.00 -0.40 0.00 0.00 41.96 39.60 2d93 s TYR 97 CO 0.00 -0.01 1.64 1.41 -1.57 0.00 0.00 175.55 177.02 2d93 s MET 98 N -0.06 4.20 -0.46 -0.62 1.75 -1.09 -4.90 119.30 118.12 2d93 s MET 98 Ca -0.01 2.29 0.03 0.00 -1.25 0.00 0.00 55.69 56.75 2d93 s MET 98 Cb -0.14 -3.66 0.47 0.00 2.84 0.00 0.00 34.83 34.34 2d93 s MET 98 CO 0.03 -0.74 1.61 0.72 -0.65 0.00 0.00 175.02 175.99 2d93 n HIS 99 N 5.84 2.77 -3.05 4.11 8.25 -1.26 -0.28 115.22 131.60 2d93 n HIS 99 Ca 0.16 -2.48 0.00 0.00 -0.26 0.00 0.00 57.72 55.14 2d93 n HIS 99 Cb 0.41 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.66 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 -0.87 -0.66 2.96 -1.41 0.00 -1.26 -4.49 105.19 99.46 2d93 n GLY 100 Ca 0.51 -0.64 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 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 0.95 -0.16 -0.61 1.01 0.75 -0.46 121.20 119.68 2d93 s ILE 101 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.21 2d93 s ILE 101 Cb 0.00 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 2d93 s ILE 101 CO 0.00 0.33 0.19 -0.69 0.00 0.00 0.00 174.94 174.77 2d93 s VAL 102 N 1.00 5.38 -0.11 2.92 1.01 -0.49 -0.54 120.40 129.57 2d93 s VAL 102 Ca -0.09 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.16 2d93 s VAL 102 Cb -0.15 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.77 2d93 s VAL 102 CO -0.00 0.47 0.25 -0.13 0.00 0.00 0.00 175.10 175.69 2d93 s ARG 103 N 0.03 0.22 0.98 2.72 0.52 -0.12 -0.32 118.95 122.98 2d93 s ARG 103 Ca 0.13 0.52 -0.11 0.00 -0.52 0.00 0.00 55.73 55.75 2d93 s ARG 103 Cb -0.12 -0.09 0.18 0.00 0.52 0.00 0.00 34.95 35.44 2d93 s ARG 103 CO 0.02 -0.15 1.11 0.95 0.02 0.00 0.00 175.30 177.24 2d93 s THR 104 N 1.16 2.12 -0.10 0.02 -4.23 -0.74 0.03 115.64 113.90 2d93 s THR 104 Ca -0.08 0.04 0.11 0.00 -1.18 0.00 0.00 61.69 60.57 2d93 s THR 104 Cb -0.09 -2.10 -0.15 0.00 1.34 0.00 0.00 72.50 71.50 2d93 s THR 104 CO -0.08 -0.05 0.08 0.29 -0.54 0.00 0.00 174.62 174.32 2d93 n LYS 105 N -4.40 1.79 -4.34 3.99 4.76 0.14 -3.18 118.16 116.93 2d93 n LYS 105 Ca 0.09 -0.03 -0.21 0.00 -2.87 0.00 0.00 58.31 55.30 2d93 n LYS 105 Cb 0.53 -1.30 -0.08 0.00 -1.84 0.00 0.00 35.03 32.34 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 -2.39 0.15 0.70 -0.18 -7.23 -1.25 -4.68 120.40 105.51 2d93 s VAL 106 Ca -0.05 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.10 2d93 s VAL 106 Cb 0.04 -2.46 0.11 0.00 0.56 0.00 0.00 36.38 34.64 2d93 s VAL 106 CO 0.48 0.00 0.97 1.51 -0.31 0.00 0.00 175.10 177.75 2d93 s ASP 107 N -3.42 4.50 -1.92 4.85 1.47 -1.26 -4.35 116.67 116.54 2d93 s ASP 107 Ca 0.36 -0.24 0.00 0.00 1.18 0.00 0.00 52.55 53.85 2d93 s ASP 107 Cb 0.03 -0.23 0.00 0.00 -0.34 0.00 0.00 42.92 42.38 2d93 s ASP 107 CO 0.23 -1.75 0.00 0.47 0.68 0.00 0.00 175.17 174.80 2d93 n ASP 108 N -2.78 -5.78 -4.70 2.11 8.00 -1.15 -4.91 116.55 107.34 2d93 n ASP 108 Ca 0.13 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.36 2d93 n ASP 108 Cb 0.60 -4.89 -0.03 0.00 -0.02 0.00 0.00 41.12 36.79 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 1.46 3.14 0.23 0.00 -0.21 -0.20 0.60 119.66 124.67 2d93 s GLN 110 Ca 0.53 -0.76 -0.18 0.00 0.02 0.00 0.00 55.36 54.96 2d93 s GLN 110 Cb -0.22 -2.78 0.02 0.00 1.00 0.00 0.00 33.01 31.03 2d93 s GLN 110 CO 0.25 0.49 0.59 -0.06 -2.12 0.00 0.00 175.29 174.44 2d93 s PHE 111 N -1.77 -0.11 0.01 0.91 0.08 0.17 -2.73 117.98 114.54 2d93 s PHE 111 Ca 0.33 -0.26 0.01 0.00 0.12 0.00 0.00 56.93 57.12 2d93 s PHE 111 Cb -0.10 0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 42.82 2d93 s PHE 111 CO 0.26 -1.03 -0.02 0.54 -0.10 0.00 0.00 175.22 174.87 2d93 s VAL 112 N -3.90 0.16 0.01 -0.44 0.11 -1.18 -1.96 120.40 113.20 2d93 s VAL 112 Ca 0.11 -0.31 0.06 0.00 -2.93 0.00 0.00 61.98 58.91 2d93 s VAL 112 Cb -0.03 -0.18 -0.03 0.00 -1.53 0.00 0.00 36.38 34.61 2d93 s VAL 112 CO 0.01 -0.10 -0.16 0.00 -3.33 0.00 0.00 175.10 171.52 2d93 s ILE 114 N -0.88 -0.17 0.42 0.00 1.01 -1.03 -0.16 121.20 120.39 2d93 s ILE 114 Ca 0.14 0.27 -0.25 0.00 0.00 0.00 0.00 60.65 60.81 2d93 s ILE 114 Cb -0.11 -0.28 -0.10 0.00 0.01 0.00 0.00 42.46 41.98 2d93 s ILE 114 CO 0.04 0.11 1.23 0.00 0.00 0.00 0.00 174.94 176.33 2d93 n ALA 115 N 4.83 1.13 0.17 9.38 0.00 -1.26 -1.15 120.51 133.61 2d93 n ALA 115 Ca -0.15 0.26 -0.17 0.00 0.00 0.00 0.00 53.44 53.38 2d93 n ALA 115 Cb 0.51 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.62 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 2.00 -0.81 -0.10 0.00 5.75 -1.67 0.25 115.11 120.54 2d93 h GLN 116 Ca -0.47 0.05 0.04 0.00 -0.15 0.00 0.00 58.65 58.12 2d93 h GLN 116 Cb 1.30 0.18 -0.06 0.00 1.07 0.00 0.00 27.48 29.97 2d93 h GLN 116 CO 0.59 -0.54 -0.37 1.96 -2.65 0.00 0.00 178.83 177.83 2d93 h GLN 117 N -0.84 -0.44 -0.06 1.69 1.08 -1.91 0.24 115.11 114.88 2d93 h GLN 117 Ca -0.02 0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 2d93 h GLN 117 Cb 0.80 0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 28.32 2d93 h GLN 117 CO -0.21 -0.29 0.11 -0.44 -0.95 0.00 0.00 178.83 177.05 2d93 h ASP 118 N -0.46 0.00 0.99 1.46 5.19 -1.88 0.34 116.42 122.06 2d93 h ASP 118 Ca 0.08 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.29 2d93 h ASP 118 Cb 0.59 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.07 2d93 h ASP 118 CO -0.36 0.00 -1.05 0.22 -3.12 0.00 0.00 179.24 174.93 2d93 h TYR 119 N 0.00 0.00 -0.11 4.55 3.20 0.26 -3.27 116.97 121.60 2d93 h TYR 119 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2d93 h TYR 119 Cb 0.25 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.52 2d93 h TYR 119 CO 0.00 0.88 0.00 1.87 -1.64 0.00 0.00 178.16 179.27 2d93 n TRP 120 N -3.24 0.11 1.07 -3.82 -0.00 0.19 -3.78 117.44 107.95 2d93 n TRP 120 Ca -0.03 -0.06 0.11 0.00 -0.00 0.00 0.00 57.50 57.53 2d93 n TRP 120 Cb 0.91 -0.00 0.10 0.00 -0.00 0.00 0.00 31.31 32.32 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 1.36 0.98 -0.02 5.87 1.74 0.97 -3.81 116.66 123.75 2d93 n ARG 121 Ca 0.15 -0.76 -0.06 0.00 -0.77 0.00 0.00 57.85 56.41 2d93 n ARG 121 Cb 0.59 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.53 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 -0.35 1.06 0.04 0.55 5.41 -1.25 -4.49 119.36 120.33 2d93 n ILE 122 Ca 0.09 0.14 0.08 0.00 1.00 0.00 0.00 62.75 64.06 2d93 n ILE 122 Cb 0.42 -1.79 0.50 0.00 -0.71 0.00 0.00 39.64 38.06 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 -0.38 0.32 0.00 1.39 4.07 -1.80 -3.43 115.31 115.47 2d93 h LEU 123 Ca -0.10 -0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.62 2d93 h LEU 123 Cb 0.70 -0.07 0.06 0.00 1.08 0.00 0.00 40.66 42.43 2d93 h LEU 123 CO -0.06 0.22 0.12 0.59 -1.08 0.00 0.00 178.44 178.22 2d93 n ASN 124 N -4.48 0.46 -3.18 -0.43 3.02 -1.25 -5.01 115.26 104.39 2d93 n ASN 124 Ca 0.04 -1.46 -0.36 0.00 -0.03 0.00 0.00 54.58 52.77 2d93 n ASN 124 Cb 0.17 -0.40 0.01 0.00 -0.61 0.00 0.00 39.78 38.95 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 -2.43 3.22 -3.01 3.10 8.25 -1.26 -4.91 115.22 118.19 2d93 n HIS 125 Ca 0.08 -2.95 -0.40 0.00 -0.26 0.00 0.00 57.72 54.19 2d93 n HIS 125 Cb 0.30 -0.88 -0.05 0.00 1.12 0.00 0.00 29.99 30.48 2d93 n HIS 125 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2d93 s VAL 126 N -4.67 4.99 -0.46 1.59 1.01 -1.26 -5.00 120.40 116.60 2d93 s VAL 126 Ca 0.45 1.46 -0.28 0.00 0.00 0.00 0.00 61.98 63.61 2d93 s VAL 126 Cb 0.29 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 2d93 s VAL 126 CO -0.20 0.15 1.70 -1.83 0.00 0.00 0.00 175.10 174.92 2d93 s GLU 127 N 1.46 3.15 -0.20 2.72 -1.05 -1.26 -4.91 118.70 118.61 2d93 s GLU 127 Ca 0.36 0.96 -0.30 0.00 -0.15 0.00 0.00 54.97 55.85 2d93 s GLU 127 Cb -0.17 -4.22 0.15 0.00 -0.44 0.00 0.00 34.13 29.45 2d93 s GLU 127 CO 0.15 -2.09 1.10 0.21 0.95 0.00 0.00 175.26 175.58 2d93 s LYS 128 N 5.94 0.44 -0.39 -4.83 2.20 -1.26 -5.13 119.74 116.71 2d93 s LYS 128 Ca 0.69 0.11 -0.17 0.00 -0.36 0.00 0.00 55.97 56.25 2d93 s LYS 128 Cb -0.16 0.21 0.01 0.00 -1.51 0.00 0.00 37.83 36.37 2d93 s LYS 128 CO 0.28 -0.14 0.41 -1.12 -0.36 0.00 0.00 175.35 174.43 2d93 s SER 129 N -1.07 6.19 0.00 1.43 0.01 -1.26 -4.94 113.70 114.05 2d93 s SER 129 Ca 0.01 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2d93 s SER 129 Cb -0.01 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.01 2d93 s SER 129 CO -0.01 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2d93 n GLY 130 N 5.04 -0.12 0.21 3.44 0.00 -1.26 -4.81 105.19 107.70 2d93 n GLY 130 Ca -0.08 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.01 2d93 n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d93 h PRO 131 N 0.00 0.00 -6.95 1.61 0.13 -1.95 -3.44 132.00 121.41 2d93 h PRO 131 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 2d93 h PRO 131 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2d93 h PRO 131 CO 0.00 0.31 0.37 -1.54 -0.23 0.00 0.00 178.00 176.92 2d93 s SER 132 N -6.45 7.01 -0.21 1.44 1.04 -1.26 -4.98 113.70 110.29 2d93 s SER 132 Ca -0.01 1.90 0.02 0.00 0.48 0.00 0.00 55.95 58.34 2d93 s SER 132 Cb 0.12 -2.58 -0.14 0.00 0.10 0.00 0.00 66.02 63.53 2d93 s SER 132 CO 0.67 -0.31 -0.18 -1.20 0.98 0.00 0.00 173.24 173.20 2d93 n SER 133 N 0.08 2.36 -0.53 7.02 7.64 -1.26 -4.96 113.62 123.97 2d93 n SER 133 Ca 0.04 -0.11 0.07 0.00 1.01 0.00 0.00 58.87 59.88 2d93 n SER 133 Cb 0.50 -0.30 0.05 0.00 -1.01 0.00 0.00 64.21 63.46 2d93 n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64