#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 1.76 -0.02 1.61 0.01 -1.26 -5.15 113.70 110.65 2d93 s SER 2 Ca 0.00 -0.75 0.01 0.00 1.31 0.00 0.00 55.95 56.53 2d93 s SER 2 Cb 0.00 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 66.15 2d93 s SER 2 CO 0.00 -0.15 -0.01 -0.94 0.41 0.00 0.00 173.24 172.55 2d93 s SER 3 N -2.21 5.06 0.40 2.44 1.04 -1.26 -5.00 113.70 114.17 2d93 s SER 3 Ca 0.04 0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2d93 s SER 3 Cb -0.06 -1.32 0.00 0.00 0.10 0.00 0.00 66.02 64.73 2d93 s SER 3 CO 0.02 0.30 0.00 0.61 0.98 0.00 0.00 173.24 175.15 2d93 n GLY 4 N 1.58 0.73 3.16 7.32 0.00 -1.26 -4.83 105.19 111.89 2d93 n GLY 4 Ca -0.15 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.36 -1.04 1.61 0.15 -1.26 -5.09 113.70 103.71 2d93 s SER 5 Ca 0.00 0.70 -0.23 0.00 0.70 0.00 0.00 55.95 57.12 2d93 s SER 5 Cb 0.00 0.60 0.03 0.00 -1.71 0.00 0.00 66.02 64.93 2d93 s SER 5 CO 0.00 -0.18 1.61 -0.55 1.20 0.00 0.00 173.24 175.32 2d93 s SER 6 N 1.38 6.22 0.00 5.45 0.15 -1.26 -4.85 113.70 120.78 2d93 s SER 6 Ca -0.09 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.12 2d93 s SER 6 Cb -0.10 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 2d93 s SER 6 CO -0.11 -1.77 0.00 0.61 1.20 0.00 0.00 173.24 173.17 2d93 n GLY 7 N 6.64 4.29 1.57 9.45 0.00 -1.26 -5.11 105.19 120.77 2d93 n GLY 7 Ca 0.37 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2d93 n GLY 7 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2d93 n ASP 8 N 0.00 0.19 -2.48 1.61 2.03 -1.26 -4.86 116.55 111.79 2d93 n ASP 8 Ca 0.00 0.17 -0.35 0.00 0.52 0.00 0.00 54.79 55.13 2d93 n ASP 8 Cb 0.00 0.05 0.06 0.00 -0.72 0.00 0.00 41.12 40.51 2d93 n ASP 8 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2d93 n ASP 9 N -3.11 7.55 -0.28 1.67 8.00 -1.26 -4.71 116.55 124.42 2d93 n ASP 9 Ca 0.00 -3.74 0.09 0.00 0.71 0.00 0.00 54.79 51.85 2d93 n ASP 9 Cb 0.11 -1.02 0.25 0.00 -0.02 0.00 0.00 41.12 40.44 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 2.29 0.20 -0.86 -2.24 1.82 -1.95 0.24 116.42 115.92 2d93 h ASP 10 Ca 0.57 0.15 0.05 0.00 -0.39 0.00 0.00 57.03 57.41 2d93 h ASP 10 Cb 0.59 0.15 -0.05 0.00 0.68 0.00 0.00 39.33 40.70 2d93 h ASP 10 CO 1.48 -0.00 0.56 0.40 -1.61 0.00 0.00 179.24 180.07 2d93 h ILE 11 N 0.36 1.09 -0.02 2.25 2.04 -1.99 -0.50 117.51 120.74 2d93 h ILE 11 Ca 0.49 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.96 2d93 h ILE 11 Cb 0.87 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2d93 h ILE 11 CO -0.51 0.18 -0.20 -0.33 0.00 0.00 0.00 178.15 177.29 2d93 h GLU 12 N 1.00 0.02 0.00 2.37 4.39 -0.92 0.20 114.58 121.65 2d93 h GLU 12 Ca 0.36 -0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.98 2d93 h GLU 12 Cb 0.13 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2d93 h GLU 12 CO -0.12 0.22 -0.52 1.96 -1.16 0.00 0.00 179.01 179.40 2d93 h GLN 13 N 0.02 0.00 0.00 2.33 4.20 -0.75 -3.30 115.11 117.61 2d93 h GLN 13 Ca 0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2d93 h GLN 13 Cb 0.37 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2d93 h GLN 13 CO 0.03 0.27 -0.72 1.25 -0.67 0.00 0.00 178.83 178.98 2d93 h LEU 14 N 0.00 0.00 -0.64 1.46 5.85 -0.50 -3.38 115.31 118.10 2d93 h LEU 14 Ca -0.02 -0.54 0.08 0.00 0.84 0.00 0.00 57.88 58.23 2d93 h LEU 14 Cb 1.25 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.17 2d93 h LEU 14 CO 0.04 1.19 -0.50 -0.07 -0.34 0.00 0.00 178.44 178.75 2d93 h LEU 15 N -1.00 -1.75 -1.47 2.25 3.38 -0.78 0.53 115.31 116.47 2d93 h LEU 15 Ca -0.18 0.27 0.48 0.00 0.09 0.00 0.00 57.88 58.54 2d93 h LEU 15 Cb 1.02 0.77 -0.13 0.00 0.09 0.00 0.00 40.66 42.41 2d93 h LEU 15 CO -0.11 -0.33 0.95 1.05 0.09 0.00 0.00 178.44 180.08 2d93 h GLU 16 N -0.22 0.02 0.21 1.13 4.11 -1.76 0.98 114.58 119.06 2d93 h GLU 16 Ca 0.15 -0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.30 2d93 h GLU 16 Cb 0.54 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.82 2d93 h GLU 16 CO -0.73 0.01 -1.25 0.35 0.07 0.00 0.00 179.01 177.46 2d93 h PHE 17 N 0.02 0.80 0.00 2.06 3.04 -0.19 -3.23 116.94 119.44 2d93 h PHE 17 Ca 0.88 -0.58 0.00 0.00 3.98 0.00 0.00 57.97 62.24 2d93 h PHE 17 Cb 2.90 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 41.38 2d93 h PHE 17 CO -0.01 1.48 0.00 -1.33 -2.02 0.00 0.00 178.31 176.44 2d93 n MET 18 N -3.87 0.09 0.07 1.11 2.81 0.32 -2.30 117.12 115.34 2d93 n MET 18 Ca -0.17 0.43 -0.22 0.00 -1.81 0.00 0.00 57.70 55.94 2d93 n MET 18 Cb 1.00 -1.71 -0.15 0.00 -0.71 0.00 0.00 33.22 31.65 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 -0.00 -0.86 -3.20 115.15 113.77 2d93 h HIS 19 Ca 0.00 -0.48 -0.04 0.00 -0.00 0.00 0.00 60.37 59.85 2d93 h HIS 19 Cb 0.19 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.56 2d93 h HIS 19 CO 0.00 1.51 -0.18 -0.56 -0.00 0.00 0.00 177.93 178.70 2d93 h GLN 20 N -0.14 0.00 -6.79 5.26 3.07 -1.51 -3.41 115.11 111.59 2d93 h GLN 20 Ca -0.25 0.00 -0.49 0.00 0.09 0.00 0.00 58.65 58.00 2d93 h GLN 20 Cb 1.89 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 29.43 2d93 h GLN 20 CO 0.16 0.18 0.35 -0.51 0.09 0.00 0.00 178.83 179.11 2d93 s LEU 21 N -7.32 4.57 -0.02 0.06 1.43 -1.14 -4.98 118.68 111.28 2d93 s LEU 21 Ca -0.02 1.94 -0.25 0.00 -1.03 0.00 0.00 54.13 54.76 2d93 s LEU 21 Cb 0.13 -3.71 -0.19 0.00 0.03 0.00 0.00 46.19 42.44 2d93 s LEU 21 CO 0.62 0.09 1.23 1.55 0.23 0.00 0.00 176.35 180.07 2d93 h PRO 22 N 3.90 -0.06 -0.92 1.29 0.13 -1.84 0.13 132.00 134.62 2d93 h PRO 22 Ca -0.45 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.80 2d93 h PRO 22 Cb 1.20 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.27 2d93 h PRO 22 CO 0.67 0.39 0.59 0.00 -0.23 0.00 0.00 178.00 179.43 2d93 h ALA 23 N 0.35 1.67 0.00 -0.56 0.00 -1.90 0.39 119.26 119.21 2d93 h ALA 23 Ca -0.01 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.71 2d93 h ALA 23 Cb 0.49 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2d93 h ALA 23 CO 0.01 0.11 -1.06 0.74 0.00 0.00 0.00 179.25 179.04 2d93 h PHE 24 N 0.85 0.00 -0.01 0.00 0.04 -1.74 -3.29 116.94 112.78 2d93 h PHE 24 Ca 0.45 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 61.06 2d93 h PHE 24 Cb 0.54 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 2d93 h PHE 24 CO -0.00 0.87 -0.76 0.00 -0.60 0.00 0.00 178.31 177.82 2d93 h ALA 25 N 1.13 0.73 -1.11 2.45 0.00 0.68 -3.24 119.26 119.90 2d93 h ALA 25 Ca -0.07 -0.67 0.42 0.00 0.00 0.00 0.00 54.91 54.59 2d93 h ALA 25 Cb 1.72 -0.11 -0.16 0.00 0.00 0.00 0.00 17.79 19.25 2d93 h ALA 25 CO 0.10 0.90 0.64 -0.97 0.00 0.00 0.00 179.25 179.93 2d93 h ASN 26 N 0.04 0.32 -5.72 0.00 -0.73 -0.37 -3.40 115.58 105.73 2d93 h ASN 26 Ca -0.02 0.22 -0.35 0.00 1.87 0.00 0.00 56.30 58.02 2d93 h ASN 26 Cb 1.33 0.21 0.01 0.00 0.27 0.00 0.00 38.32 40.15 2d93 h ASN 26 CO 0.10 -0.33 -0.07 1.15 -0.37 0.00 0.00 177.43 177.91 2d93 n MET 27 N -5.07 0.75 -2.21 6.67 0.00 -1.23 -5.13 117.12 110.90 2d93 n MET 27 Ca 0.37 -2.24 -0.22 0.00 0.00 0.00 0.00 57.70 55.61 2d93 n MET 27 Cb 1.31 -0.10 0.12 0.00 0.00 0.00 0.00 33.22 34.55 2d93 n MET 27 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 2d93 n THR 28 N -1.81 0.00 0.47 3.17 5.66 -1.26 -4.98 114.28 115.53 2d93 n THR 28 Ca 0.09 -1.29 0.13 0.00 -3.05 0.00 0.00 64.05 59.93 2d93 n THR 28 Cb 0.43 -1.08 0.46 0.00 -1.55 0.00 0.00 70.33 68.59 2d93 n THR 28 CO 0.00 0.00 0.00 0.24 -3.05 0.00 0.00 175.07 172.26 2d93 h MET 29 N 0.00 0.00 0.00 1.09 2.86 -1.95 -2.95 114.93 113.98 2d93 h MET 29 Ca -0.31 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.19 2d93 h MET 29 Cb 1.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.73 2d93 h MET 29 CO 0.31 0.00 -0.65 1.03 1.06 0.00 0.00 176.91 178.65 2d93 h SER 30 N 0.00 0.00 0.23 1.22 0.87 -2.01 -3.07 113.55 110.79 2d93 h SER 30 Ca 0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.22 2d93 h SER 30 Cb 0.54 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.53 2d93 h SER 30 CO 0.00 0.65 -1.59 0.58 -0.53 0.00 0.00 176.83 175.94 2d93 h VAL 31 N 0.00 1.14 0.38 2.23 2.07 -1.86 -3.27 116.25 116.94 2d93 h VAL 31 Ca -0.01 -2.62 -0.01 0.00 0.82 0.00 0.00 66.70 64.88 2d93 h VAL 31 Cb 1.23 2.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.93 2d93 h VAL 31 CO 0.08 0.83 -0.29 0.03 0.02 0.00 0.00 177.57 178.24 2d93 h ARG 32 N 0.13 -0.63 -0.83 1.57 3.08 -1.58 -1.05 114.38 115.07 2d93 h ARG 32 Ca -0.29 0.04 0.20 0.00 0.07 0.00 0.00 59.98 60.00 2d93 h ARG 32 Cb 2.14 0.14 -0.14 0.00 0.08 0.00 0.00 29.97 32.19 2d93 h ARG 32 CO 0.24 -0.42 0.06 -0.09 -1.07 0.00 0.00 179.97 178.69 2d93 h ARG 33 N -0.65 0.11 -0.72 0.04 2.43 -1.72 0.36 114.38 114.23 2d93 h ARG 33 Ca -0.05 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2d93 h ARG 33 Cb 0.54 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 2d93 h ARG 33 CO 0.01 0.07 0.44 0.93 -1.51 0.00 0.00 179.97 179.91 2d93 h GLU 34 N 0.11 0.80 -0.03 0.20 4.39 -1.55 -2.66 114.58 115.85 2d93 h GLU 34 Ca 0.48 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 60.13 2d93 h GLU 34 Cb 0.90 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2d93 h GLU 34 CO -0.71 0.53 0.02 -0.07 -1.16 0.00 0.00 179.01 177.61 2d93 h LEU 35 N 0.82 0.04 -1.26 1.33 3.38 1.00 -2.06 115.31 118.56 2d93 h LEU 35 Ca 0.31 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.19 2d93 h LEU 35 Cb 0.11 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2d93 h LEU 35 CO -0.15 0.14 0.62 0.00 0.09 0.00 0.00 178.44 179.14 2d93 h SER 37 N 0.00 0.63 -0.14 0.00 0.87 -1.29 -3.24 113.55 110.38 2d93 h SER 37 Ca 0.04 -0.38 -0.05 0.00 -1.23 0.00 0.00 61.79 60.17 2d93 h SER 37 Cb 1.27 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 63.02 2d93 h SER 37 CO -0.00 1.12 -0.16 1.33 -0.53 0.00 0.00 176.83 178.58 2d93 n VAL 38 N -3.91 2.23 -3.20 2.23 0.24 0.26 -5.02 118.33 111.15 2d93 n VAL 38 Ca -0.04 -2.60 -0.39 0.00 -2.04 0.00 0.00 64.34 59.27 2d93 n VAL 38 Cb 0.67 -0.26 -0.06 0.00 -1.47 0.00 0.00 33.84 32.72 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 -3.07 4.32 -0.15 7.34 -1.94 0.03 -4.45 119.30 121.37 2d93 s MET 39 Ca 0.39 0.73 -0.07 0.00 -1.71 0.00 0.00 55.69 55.03 2d93 s MET 39 Cb 0.35 -3.35 -0.04 0.00 2.01 0.00 0.00 34.83 33.80 2d93 s MET 39 CO 0.00 0.36 0.07 0.42 -0.01 0.00 0.00 175.02 175.87 2d93 s ILE 40 N -0.16 4.92 -0.27 2.53 1.01 -0.21 -4.94 121.20 124.08 2d93 s ILE 40 Ca 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 60.65 60.82 2d93 s ILE 40 Cb -0.18 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 2d93 s ILE 40 CO 0.17 0.52 0.34 -0.36 0.00 0.00 0.00 174.94 175.61 2d93 s PHE 41 N -0.18 3.25 -0.00 3.97 0.40 -1.26 -2.45 117.98 121.70 2d93 s PHE 41 Ca 0.08 0.37 -0.01 0.00 -0.60 0.00 0.00 56.93 56.77 2d93 s PHE 41 Cb -0.12 -2.53 -0.00 0.00 0.51 0.00 0.00 43.02 40.88 2d93 s PHE 41 CO 0.01 -0.19 0.03 -1.21 0.70 0.00 0.00 175.22 174.56 2d93 s GLU 42 N 1.94 0.15 -0.03 0.44 0.41 -1.08 -5.05 118.70 115.49 2d93 s GLU 42 Ca 0.14 -0.16 0.02 0.00 -0.41 0.00 0.00 54.97 54.55 2d93 s GLU 42 Cb -0.16 0.06 0.01 0.00 -1.78 0.00 0.00 34.13 32.26 2d93 s GLU 42 CO 0.10 -0.03 -0.07 0.08 -0.49 0.00 0.00 175.26 174.85 2d93 s VAL 43 N -0.50 0.65 -0.24 2.63 1.01 -1.26 -1.54 120.40 121.15 2d93 s VAL 43 Ca -0.06 -0.27 -0.10 0.00 0.00 0.00 0.00 61.98 61.56 2d93 s VAL 43 Cb -0.04 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 2d93 s VAL 43 CO -0.00 0.22 0.13 -0.69 0.00 0.00 0.00 175.10 174.76 2d93 s VAL 44 N 0.37 5.08 -0.21 2.92 1.01 0.30 -4.97 120.40 124.90 2d93 s VAL 44 Ca -0.05 0.08 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 2d93 s VAL 44 Cb -0.10 -3.37 -0.19 0.00 0.00 0.00 0.00 36.38 32.73 2d93 s VAL 44 CO 0.00 0.34 0.02 -0.62 0.00 0.00 0.00 175.10 174.84 2d93 n GLU 45 N 4.43 0.65 -2.28 2.72 -0.58 -1.26 -2.11 120.64 122.20 2d93 n GLU 45 Ca -0.15 0.30 -0.40 0.00 -0.42 0.00 0.00 57.16 56.49 2d93 n GLU 45 Cb 0.52 -1.62 -0.03 0.00 -0.57 0.00 0.00 31.44 29.74 2d93 n GLU 45 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2d93 s GLN 46 N -2.49 2.92 1.02 3.49 -0.21 -1.26 -4.26 119.66 118.87 2d93 s GLN 46 Ca -0.31 0.23 -0.15 0.00 0.02 0.00 0.00 55.36 55.16 2d93 s GLN 46 Cb 0.09 -4.28 0.08 0.00 1.00 0.00 0.00 33.01 29.90 2d93 s GLN 46 CO 0.62 -2.43 0.32 0.00 -2.12 0.00 0.00 175.29 171.69 2d93 n ALA 47 N 11.08 -3.12 -1.62 6.09 0.00 -1.26 -2.65 120.51 129.03 2d93 n ALA 47 Ca 0.12 -0.89 -0.21 0.00 0.00 0.00 0.00 53.44 52.47 2d93 n ALA 47 Cb 0.51 -1.72 -0.09 0.00 0.00 0.00 0.00 19.45 18.14 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 1.62 1.95 3.79 0.00 0.00 -1.19 -4.95 105.19 106.41 2d93 n GLY 48 Ca 0.04 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.78 2.90 -0.25 4.61 0.00 -1.08 -4.57 121.76 120.60 2d93 s ALA 49 Ca 0.00 0.65 -0.24 0.00 0.00 0.00 0.00 51.96 52.37 2d93 s ALA 49 Cb 0.00 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.85 2d93 s ALA 49 CO 0.00 -0.33 0.81 0.42 0.00 0.00 0.00 175.76 176.66 2d93 s ILE 50 N -1.89 4.85 -0.06 0.00 1.09 -1.26 -1.32 121.20 122.60 2d93 s ILE 50 Ca 0.66 1.52 -0.14 0.00 -1.10 0.00 0.00 60.65 61.59 2d93 s ILE 50 Cb -0.18 -4.10 -0.30 0.00 -1.06 0.00 0.00 42.46 36.82 2d93 s ILE 50 CO 0.22 -0.07 0.67 0.40 -0.10 0.00 0.00 174.94 176.06 2d93 h ILE 51 N 5.43 1.04 -3.79 2.92 1.08 -1.35 -3.49 117.51 119.37 2d93 h ILE 51 Ca -0.23 -2.48 -0.10 0.00 -0.39 0.00 0.00 64.86 61.66 2d93 h ILE 51 Cb 1.10 2.80 -0.15 0.00 -3.07 0.00 0.00 36.82 37.50 2d93 h ILE 51 CO 0.86 0.79 -0.41 -0.76 -0.69 0.00 0.00 178.15 177.94 2d93 s LEU 52 N -7.47 1.52 0.12 1.44 1.43 -1.24 -4.99 118.68 109.50 2d93 s LEU 52 Ca -0.17 -0.61 0.09 0.00 -1.03 0.00 0.00 54.13 52.42 2d93 s LEU 52 Cb 0.05 0.93 -0.04 0.00 0.03 0.00 0.00 46.19 47.15 2d93 s LEU 52 CO 0.83 -0.67 -0.20 -1.61 0.23 0.00 0.00 176.35 174.93 2d93 s GLU 53 N -3.49 1.70 -0.00 1.70 2.02 -1.26 -2.19 118.70 117.17 2d93 s GLU 53 Ca 0.02 -1.22 -0.30 0.00 0.02 0.00 0.00 54.97 53.49 2d93 s GLU 53 Cb 0.03 -2.06 -0.07 0.00 0.10 0.00 0.00 34.13 32.13 2d93 s GLU 53 CO -0.09 0.47 1.67 0.34 0.02 0.00 0.00 175.26 177.68 2d93 s ASP 54 N -2.14 6.63 0.00 -0.19 2.15 0.26 -2.19 116.67 121.19 2d93 s ASP 54 Ca 0.17 2.36 0.00 0.00 0.43 0.00 0.00 52.55 55.51 2d93 s ASP 54 Cb -0.10 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 2d93 s ASP 54 CO 0.09 -0.92 0.00 0.61 -0.17 0.00 0.00 175.17 174.79 2d93 n GLY 55 N 4.11 0.84 3.55 2.66 0.00 -0.56 -4.89 105.19 110.88 2d93 n GLY 55 Ca 0.17 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.62 3.55 -0.80 1.61 0.74 -0.93 -4.79 119.66 118.43 2d93 s GLN 56 Ca 0.00 -0.28 -0.23 0.00 0.05 0.00 0.00 55.36 54.91 2d93 s GLN 56 Cb 0.00 -3.83 -0.18 0.00 1.10 0.00 0.00 33.01 30.11 2d93 s GLN 56 CO 0.00 -0.65 2.38 -1.91 -0.55 0.00 0.00 175.29 174.57 2d93 n GLU 57 N 5.67 0.48 -1.83 1.67 2.13 -1.26 -2.50 120.64 124.99 2d93 n GLU 57 Ca -0.06 -0.45 -0.42 0.00 0.66 0.00 0.00 57.16 56.89 2d93 n GLU 57 Cb 0.49 -2.90 -0.03 0.00 0.27 0.00 0.00 31.44 29.27 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 10.71 4.37 -0.01 4.31 1.43 0.44 -4.87 118.68 135.07 2d93 s LEU 58 Ca 1.06 2.71 0.01 0.00 -1.03 0.00 0.00 54.13 56.88 2d93 s LEU 58 Cb -0.38 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.27 2d93 s LEU 58 CO 0.25 -0.91 0.74 0.47 0.23 0.00 0.00 176.35 177.14 2d93 n ASP 59 N 4.42 0.67 -3.76 2.29 8.00 -1.26 -3.79 116.55 123.12 2d93 n ASP 59 Ca 0.15 -1.54 -0.13 0.00 0.71 0.00 0.00 54.79 53.99 2d93 n ASP 59 Cb 0.38 -0.06 -0.11 0.00 -0.02 0.00 0.00 41.12 41.31 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 -0.59 -0.34 0.04 -2.24 0.01 -1.26 -2.78 113.70 106.53 2d93 s SER 60 Ca 0.02 0.66 -0.24 0.00 1.31 0.00 0.00 55.95 57.70 2d93 s SER 60 Cb 0.02 0.66 -0.05 0.00 0.21 0.00 0.00 66.02 66.85 2d93 s SER 60 CO 0.00 -0.12 0.74 0.86 0.41 0.00 0.00 173.24 175.14 2d93 s TRP 61 N 0.22 3.73 -0.05 2.43 -0.00 0.67 -3.85 118.94 122.10 2d93 s TRP 61 Ca -0.00 1.44 0.06 0.00 -0.00 0.00 0.00 56.10 57.59 2d93 s TRP 61 Cb -0.03 -2.79 -0.02 0.00 -0.00 0.00 0.00 33.47 30.64 2d93 s TRP 61 CO -0.00 0.29 -0.22 0.71 -0.00 0.00 0.00 176.95 177.73 2d93 s TYR 62 N -0.10 2.50 -0.06 5.86 1.51 -0.31 -1.82 117.35 124.93 2d93 s TYR 62 Ca 0.37 -0.49 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 2d93 s TYR 62 Cb -0.20 -1.60 0.02 0.00 -0.11 0.00 0.00 41.96 40.07 2d93 s TYR 62 CO 0.22 -0.06 -0.05 0.08 -1.11 0.00 0.00 175.55 174.63 2d93 s VAL 63 N -0.39 0.64 -0.11 0.71 1.01 -1.17 -0.78 120.40 120.30 2d93 s VAL 63 Ca 0.04 -0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.59 2d93 s VAL 63 Cb -0.12 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 2d93 s VAL 63 CO 0.02 0.27 1.72 -0.63 0.00 0.00 0.00 175.10 176.48 2d93 s ILE 64 N 1.29 3.51 -0.21 2.22 1.01 -1.15 -3.13 121.20 124.74 2d93 s ILE 64 Ca -0.05 0.60 0.07 0.00 0.00 0.00 0.00 60.65 61.28 2d93 s ILE 64 Cb -0.14 -3.45 -0.21 0.00 0.01 0.00 0.00 42.46 38.67 2d93 s ILE 64 CO -0.02 -0.12 0.00 0.18 0.00 0.00 0.00 174.94 174.98 2d93 n LEU 65 N 7.93 1.78 -3.64 2.97 4.77 -1.05 -2.43 117.00 127.32 2d93 n LEU 65 Ca 0.19 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 56.01 2d93 n LEU 65 Cb 0.43 -0.38 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 2d93 n LEU 65 CO 0.64 0.74 0.29 0.21 -1.33 0.00 0.00 177.39 177.94 2d93 s ASN 66 N -6.20 -0.57 0.00 -1.43 2.47 -1.15 -4.74 114.94 103.31 2d93 s ASN 66 Ca -0.23 0.93 0.00 0.00 0.42 0.00 0.00 52.86 53.98 2d93 s ASN 66 Cb 0.08 0.93 0.00 0.00 -1.45 0.00 0.00 41.25 40.80 2d93 s ASN 66 CO 0.71 -0.34 0.00 0.61 -3.72 0.00 0.00 177.10 174.36 2d93 n GLY 67 N 2.10 -2.43 3.06 1.21 0.00 -1.26 -2.35 105.19 105.52 2d93 n GLY 67 Ca -0.16 -1.95 -0.23 0.00 0.00 0.00 0.00 46.02 43.68 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 -0.30 1.12 -0.01 2.61 2.01 -1.26 -3.37 115.64 116.43 2d93 s THR 68 Ca 0.00 -0.53 0.08 0.00 0.31 0.00 0.00 61.69 61.54 2d93 s THR 68 Cb 0.00 -0.98 -0.02 0.00 0.01 0.00 0.00 72.50 71.51 2d93 s THR 68 CO 0.00 0.34 -0.25 0.68 -0.69 0.00 0.00 174.62 174.69 2d93 s VAL 69 N 0.20 1.99 0.06 3.82 -7.23 -1.24 -0.39 120.40 117.62 2d93 s VAL 69 Ca -0.05 -1.10 0.05 0.00 -1.81 0.00 0.00 61.98 59.07 2d93 s VAL 69 Cb -0.11 -1.66 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 2d93 s VAL 69 CO 0.02 0.54 -0.08 -0.70 -0.31 0.00 0.00 175.10 174.57 2d93 s GLU 70 N -0.65 2.35 0.03 4.82 2.12 0.80 -2.70 118.70 125.47 2d93 s GLU 70 Ca 0.10 -0.88 0.06 0.00 0.36 0.00 0.00 54.97 54.61 2d93 s GLU 70 Cb -0.10 -2.41 -0.02 0.00 0.26 0.00 0.00 34.13 31.86 2d93 s GLU 70 CO -0.01 0.55 -0.19 0.42 -0.54 0.00 0.00 175.26 175.50 2d93 s ILE 71 N -1.13 1.50 -0.04 -3.70 1.01 -0.86 -0.22 121.20 117.76 2d93 s ILE 71 Ca 0.20 -1.03 0.03 0.00 0.00 0.00 0.00 60.65 59.85 2d93 s ILE 71 Cb -0.11 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.07 2d93 s ILE 71 CO 0.12 0.23 -0.13 -0.44 0.00 0.00 0.00 174.94 174.72 2d93 s SER 72 N -0.94 1.71 0.04 3.58 0.01 -0.17 -1.36 113.70 116.57 2d93 s SER 72 Ca 0.06 -0.28 -0.01 0.00 1.31 0.00 0.00 55.95 57.04 2d93 s SER 72 Cb -0.08 -0.54 -0.04 0.00 0.21 0.00 0.00 66.02 65.57 2d93 s SER 72 CO 0.01 0.09 0.18 -1.00 0.41 0.00 0.00 173.24 172.93 2d93 s HIS 73 N 0.23 3.47 -0.68 2.43 3.76 0.63 -0.88 115.29 124.26 2d93 s HIS 73 Ca -0.06 0.26 0.20 0.00 -0.15 0.00 0.00 55.06 55.31 2d93 s HIS 73 Cb -0.11 -1.76 0.84 0.00 1.11 0.00 0.00 32.58 32.66 2d93 s HIS 73 CO 0.02 0.60 1.61 -0.35 -0.85 0.00 0.00 174.74 175.77 2d93 n PRO 74 N 0.58 0.12 0.02 8.40 -0.04 -1.26 -2.95 135.00 139.87 2d93 n PRO 74 Ca -0.08 0.36 -0.20 0.00 -0.04 0.00 0.00 63.50 63.54 2d93 n PRO 74 Cb 0.52 -1.73 -0.14 0.00 -0.04 0.00 0.00 33.50 32.10 2d93 n PRO 74 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2d93 h ASP 75 N 0.00 0.38 0.00 3.54 5.19 -1.94 -3.48 116.42 120.11 2d93 h ASP 75 Ca 0.00 -0.89 0.00 0.00 -0.62 0.00 0.00 57.03 55.52 2d93 h ASP 75 Cb 0.32 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.70 2d93 h ASP 75 CO 0.00 1.48 0.00 0.61 -3.12 0.00 0.00 179.24 178.21 2d93 n GLY 76 N 1.69 0.00 3.21 2.75 0.00 -1.15 -5.17 105.19 106.51 2d93 n GLY 76 Ca -0.20 0.00 -0.13 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 0.96 -0.12 1.61 2.20 -1.25 -4.99 119.74 118.13 2d93 s LYS 77 Ca 0.00 -1.39 -0.04 0.00 -0.36 0.00 0.00 55.97 54.18 2d93 s LYS 77 Cb 0.00 -0.44 0.06 0.00 -1.51 0.00 0.00 37.83 35.94 2d93 s LYS 77 CO 0.00 0.04 0.19 0.08 -0.36 0.00 0.00 175.35 175.30 2d93 s VAL 78 N -3.41 -0.29 0.30 4.02 1.01 -1.26 -0.26 120.40 120.50 2d93 s VAL 78 Ca 0.14 0.20 -0.06 0.00 0.00 0.00 0.00 61.98 62.27 2d93 s VAL 78 Cb 0.03 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 2d93 s VAL 78 CO -0.02 0.04 0.58 -1.61 0.00 0.00 0.00 175.10 174.09 2d93 s GLU 79 N 2.32 3.65 -0.22 2.72 0.41 -0.47 -4.93 118.70 122.17 2d93 s GLU 79 Ca 0.04 0.06 -0.01 0.00 -0.41 0.00 0.00 54.97 54.65 2d93 s GLU 79 Cb -0.13 -2.62 0.06 0.00 -1.78 0.00 0.00 34.13 29.67 2d93 s GLU 79 CO -0.08 0.18 -0.00 0.54 -0.49 0.00 0.00 175.26 175.41 2d93 s ASN 80 N -3.17 3.47 0.22 -0.19 4.22 -1.26 -2.02 114.94 116.20 2d93 s ASN 80 Ca 0.45 -1.07 0.06 0.00 -2.14 0.00 0.00 52.86 50.16 2d93 s ASN 80 Cb -0.11 -0.91 -0.03 0.00 1.28 0.00 0.00 41.25 41.48 2d93 s ASN 80 CO 0.30 -0.28 0.23 -0.76 -2.04 0.00 0.00 177.10 174.55 2d93 s LEU 81 N 1.60 3.99 0.12 3.54 1.43 -1.10 -5.07 118.68 123.20 2d93 s LEU 81 Ca -0.03 -0.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2d93 s LEU 81 Cb -0.18 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.45 2d93 s LEU 81 CO -0.08 -0.01 0.06 -0.36 0.23 0.00 0.00 176.35 176.19 2d93 s PHE 82 N -1.96 0.80 -0.44 0.29 0.08 -1.26 -3.59 117.98 111.90 2d93 s PHE 82 Ca 0.33 -1.19 -0.41 0.00 0.12 0.00 0.00 56.93 55.77 2d93 s PHE 82 Cb -0.09 -0.45 -0.18 0.00 -0.57 0.00 0.00 43.02 41.73 2d93 s PHE 82 CO 0.26 -0.51 1.48 -0.12 -0.10 0.00 0.00 175.22 176.23 2d93 n MET 83 N -0.08 0.00 0.00 0.44 1.56 -1.22 -0.65 117.12 117.18 2d93 n MET 83 Ca -0.06 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.37 2d93 n MET 83 Cb 0.63 -1.33 0.00 0.00 2.15 0.00 0.00 33.22 34.68 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 3.96 1.48 3.07 -5.12 0.00 -1.02 -5.02 105.19 102.55 2d93 n GLY 84 Ca 0.30 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 0.04 -3.82 -3.71 1.61 4.13 0.18 -3.86 115.26 109.84 2d93 n ASN 85 Ca 0.00 -0.88 -0.14 0.00 1.68 0.00 0.00 54.58 55.24 2d93 n ASN 85 Cb 0.00 -0.95 -0.08 0.00 -1.54 0.00 0.00 39.78 37.21 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 -3.23 -0.33 -0.07 6.41 1.04 -1.26 -2.93 113.70 113.32 2d93 s SER 86 Ca 0.64 0.34 -0.28 0.00 0.48 0.00 0.00 55.95 57.14 2d93 s SER 86 Cb -0.11 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.53 2d93 s SER 86 CO 0.53 -0.43 0.64 0.72 0.98 0.00 0.00 173.24 175.68 2d93 s PHE 87 N -1.05 -0.62 0.00 5.02 -0.12 0.04 -5.00 117.98 116.26 2d93 s PHE 87 Ca -0.11 1.12 0.00 0.00 -0.05 0.00 0.00 56.93 57.89 2d93 s PHE 87 Cb -0.04 0.35 0.00 0.00 -0.63 0.00 0.00 43.02 42.70 2d93 s PHE 87 CO 0.05 -0.55 0.00 0.41 -0.05 0.00 0.00 175.22 175.08 2d93 n GLY 88 N 1.20 0.52 2.31 1.99 0.00 -1.26 -1.17 105.19 108.78 2d93 n GLY 88 Ca -0.19 -0.46 -0.16 0.00 0.00 0.00 0.00 46.02 45.22 2d93 n GLY 88 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2d93 n ILE 89 N 0.00 0.00 -4.19 -0.61 -5.35 -1.25 -4.95 119.36 103.01 2d93 n ILE 89 Ca 0.00 -1.33 -0.23 0.00 -0.27 0.00 0.00 62.75 60.92 2d93 n ILE 89 Cb 0.00 -0.21 -0.06 0.00 -1.74 0.00 0.00 39.64 37.63 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 -1.66 3.97 -2.00 7.28 -4.23 -1.26 -4.86 115.64 112.89 2d93 s THR 90 Ca 0.19 -1.58 0.11 0.00 -1.18 0.00 0.00 61.69 59.23 2d93 s THR 90 Cb -0.01 -3.11 0.33 0.00 1.34 0.00 0.00 72.50 71.04 2d93 s THR 90 CO 0.12 -0.31 1.12 -0.81 -0.54 0.00 0.00 174.62 174.19 2d93 n PRO 91 N -0.88 0.49 -3.52 3.99 -0.04 -1.26 -4.74 135.00 129.04 2d93 n PRO 91 Ca -0.08 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.05 2d93 n PRO 91 Cb 0.58 -1.37 -0.05 0.00 -0.04 0.00 0.00 33.50 32.62 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 5.03 0.60 0.52 -4.23 -1.26 -4.10 115.64 110.20 2d93 s THR 92 Ca 0.17 0.48 0.28 0.00 -1.18 0.00 0.00 61.69 61.45 2d93 s THR 92 Cb 0.08 -3.66 0.36 0.00 1.34 0.00 0.00 72.50 70.62 2d93 s THR 92 CO 0.13 0.19 1.87 -0.07 -0.54 0.00 0.00 174.62 176.20 2d93 h LEU 93 N 3.38 0.00 -9.79 4.79 3.38 -1.94 -3.41 115.31 111.72 2d93 h LEU 93 Ca -0.48 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 56.96 2d93 h LEU 93 Cb 1.19 0.00 0.07 0.00 0.09 0.00 0.00 40.66 42.00 2d93 h LEU 93 CO 0.68 0.00 0.76 -1.81 0.09 0.00 0.00 178.44 178.15 2d93 s ASP 94 N -5.00 6.61 0.77 -0.43 1.01 -1.26 -5.00 116.67 113.37 2d93 s ASP 94 Ca -0.04 2.73 -0.12 0.00 0.71 0.00 0.00 52.55 55.84 2d93 s ASP 94 Cb 0.14 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.49 2d93 s ASP 94 CO 0.49 -0.72 1.13 -0.54 0.21 0.00 0.00 175.17 175.74 2d93 s LYS 95 N -0.72 2.33 0.01 8.23 3.01 -1.26 -4.70 119.74 126.64 2d93 s LYS 95 Ca 0.58 0.35 0.01 0.00 -1.01 0.00 0.00 55.97 55.89 2d93 s LYS 95 Cb -0.43 -1.97 -0.01 0.00 -1.01 0.00 0.00 37.83 34.41 2d93 s LYS 95 CO 0.47 -1.39 -0.04 -0.65 0.51 0.00 0.00 175.35 174.26 2d93 s GLN 96 N -5.41 0.28 -0.02 1.68 1.11 -1.25 -4.99 119.66 111.07 2d93 s GLN 96 Ca 0.60 -0.34 0.04 0.00 0.01 0.00 0.00 55.36 55.67 2d93 s GLN 96 Cb -0.12 -0.13 -0.03 0.00 -1.01 0.00 0.00 33.01 31.72 2d93 s GLN 96 CO 0.51 0.03 -0.13 0.71 0.01 0.00 0.00 175.29 176.41 2d93 s TYR 97 N -0.65 2.72 0.52 0.91 1.51 -1.26 -0.42 117.35 120.68 2d93 s TYR 97 Ca -0.05 -0.15 -0.22 0.00 -1.01 0.00 0.00 57.07 55.65 2d93 s TYR 97 Cb -0.05 -1.60 -0.06 0.00 -0.11 0.00 0.00 41.96 40.15 2d93 s TYR 97 CO -0.00 0.24 1.23 1.41 -1.11 0.00 0.00 175.55 177.32 2d93 s MET 98 N -1.01 3.39 -0.05 -0.62 1.75 -1.04 -4.89 119.30 116.83 2d93 s MET 98 Ca 0.13 1.92 0.07 0.00 -1.25 0.00 0.00 55.69 56.56 2d93 s MET 98 Cb -0.11 -2.24 0.11 0.00 2.84 0.00 0.00 34.83 35.43 2d93 s MET 98 CO 0.03 -0.90 0.99 -2.39 -0.65 0.00 0.00 175.02 172.10 2d93 n HIS 99 N -0.92 0.00 -2.11 4.11 1.44 -1.26 -1.50 115.22 114.98 2d93 n HIS 99 Ca 0.10 -0.55 0.00 0.00 -2.01 0.00 0.00 57.72 55.26 2d93 n HIS 99 Cb 0.48 -0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.51 2d93 n HIS 99 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2d93 n GLY 100 N -0.71 2.44 2.93 -1.39 0.00 -1.26 -4.22 105.19 102.98 2d93 n GLY 100 Ca 0.06 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.44 0.80 -0.14 -0.61 1.01 -0.06 0.89 121.20 120.64 2d93 s ILE 101 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 60.65 60.34 2d93 s ILE 101 Cb 0.00 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2d93 s ILE 101 CO 0.00 0.29 0.08 -0.69 0.00 0.00 0.00 174.94 174.62 2d93 s VAL 102 N 1.03 4.95 -0.11 2.92 1.01 -0.93 -1.00 120.40 128.27 2d93 s VAL 102 Ca -0.09 0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 2d93 s VAL 102 Cb -0.14 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.10 2d93 s VAL 102 CO -0.00 0.54 0.25 -0.13 0.00 0.00 0.00 175.10 175.76 2d93 s ARG 103 N -0.31 0.22 1.00 2.72 0.52 0.69 -0.79 118.95 122.99 2d93 s ARG 103 Ca 0.09 0.52 -0.11 0.00 -0.52 0.00 0.00 55.73 55.72 2d93 s ARG 103 Cb -0.12 -0.10 0.19 0.00 0.52 0.00 0.00 34.95 35.45 2d93 s ARG 103 CO 0.01 -0.15 1.10 0.95 0.02 0.00 0.00 175.30 177.24 2d93 s THR 104 N 1.18 2.09 -0.05 0.02 -4.23 -0.43 -0.14 115.64 114.08 2d93 s THR 104 Ca -0.09 0.03 0.08 0.00 -1.18 0.00 0.00 61.69 60.54 2d93 s THR 104 Cb -0.10 -2.08 -0.12 0.00 1.34 0.00 0.00 72.50 71.54 2d93 s THR 104 CO -0.08 -0.04 0.12 0.29 -0.54 0.00 0.00 174.62 174.37 2d93 n LYS 105 N -4.45 1.45 -3.53 3.99 4.76 0.48 -3.19 118.16 117.67 2d93 n LYS 105 Ca 0.09 -0.04 -0.15 0.00 -2.87 0.00 0.00 58.31 55.33 2d93 n LYS 105 Cb 0.53 -1.22 -0.05 0.00 -1.84 0.00 0.00 35.03 32.45 2d93 n LYS 105 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2d93 n VAL 106 N -2.07 0.00 -2.90 -0.18 0.24 -1.25 -4.64 118.33 107.53 2d93 n VAL 106 Ca -0.08 -1.58 -0.18 0.00 -2.04 0.00 0.00 64.34 60.46 2d93 n VAL 106 Cb 0.51 0.66 0.07 0.00 -1.47 0.00 0.00 33.84 33.62 2d93 n VAL 106 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2d93 n ASP 107 N -1.90 1.71 -2.46 -1.34 5.75 -1.26 -4.25 116.55 112.80 2d93 n ASP 107 Ca 0.00 -2.28 -0.14 0.00 -0.01 0.00 0.00 54.79 52.36 2d93 n ASP 107 Cb 0.40 -0.44 -0.01 0.00 -1.03 0.00 0.00 41.12 40.04 2d93 n ASP 107 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2d93 n ASP 108 N -2.55 -4.25 -4.64 -1.12 9.92 -0.95 -4.89 116.55 108.07 2d93 n ASP 108 Ca 0.15 0.14 -0.43 0.00 -0.53 0.00 0.00 54.79 54.12 2d93 n ASP 108 Cb 0.54 -3.59 -0.02 0.00 -0.64 0.00 0.00 41.12 37.41 2d93 n ASP 108 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2d93 s GLN 110 N 3.60 3.76 0.07 0.00 -0.21 -0.99 -0.54 119.66 125.36 2d93 s GLN 110 Ca 0.47 0.21 -0.05 0.00 0.02 0.00 0.00 55.36 56.01 2d93 s GLN 110 Cb -0.14 -3.14 -0.02 0.00 1.00 0.00 0.00 33.01 30.71 2d93 s GLN 110 CO 0.14 0.66 0.08 -0.06 -2.12 0.00 0.00 175.29 174.00 2d93 s PHE 111 N -1.19 0.35 0.05 0.91 0.08 -0.59 -2.53 117.98 115.06 2d93 s PHE 111 Ca 0.25 -0.83 0.07 0.00 0.12 0.00 0.00 56.93 56.54 2d93 s PHE 111 Cb -0.15 -0.23 -0.03 0.00 -0.57 0.00 0.00 43.02 42.05 2d93 s PHE 111 CO 0.14 -0.47 -0.19 0.54 -0.10 0.00 0.00 175.22 175.14 2d93 s VAL 112 N -3.89 1.49 0.03 -0.44 0.11 -1.18 -2.63 120.40 113.88 2d93 s VAL 112 Ca 0.06 -1.18 0.09 0.00 -2.93 0.00 0.00 61.98 58.03 2d93 s VAL 112 Cb 0.06 -1.32 -0.03 0.00 -1.53 0.00 0.00 36.38 33.57 2d93 s VAL 112 CO -0.10 0.11 -0.25 0.00 -3.33 0.00 0.00 175.10 171.52 2d93 s ILE 114 N -0.79 -0.34 0.76 0.00 1.01 -0.76 -1.05 121.20 120.03 2d93 s ILE 114 Ca 0.12 0.29 -0.15 0.00 0.00 0.00 0.00 60.65 60.91 2d93 s ILE 114 Cb -0.10 -0.40 0.01 0.00 0.01 0.00 0.00 42.46 41.98 2d93 s ILE 114 CO 0.02 0.12 0.84 0.00 0.00 0.00 0.00 174.94 175.92 2d93 n ALA 115 N 5.24 -0.75 0.31 9.38 0.00 -1.26 -0.24 120.51 133.19 2d93 n ALA 115 Ca -0.08 -0.26 -0.12 0.00 0.00 0.00 0.00 53.44 52.98 2d93 n ALA 115 Cb 0.50 -2.04 -0.06 0.00 0.00 0.00 0.00 19.45 17.85 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 -0.51 -0.78 -0.86 0.00 4.15 -1.91 -1.27 115.11 113.94 2d93 h GLN 116 Ca -0.46 0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.09 2d93 h GLN 116 Cb 1.33 0.18 -0.11 0.00 0.21 0.00 0.00 27.48 29.08 2d93 h GLN 116 CO 0.44 -0.52 -0.57 1.96 -1.93 0.00 0.00 178.83 178.21 2d93 h GLN 117 N -0.89 -0.09 -0.52 1.69 1.08 -1.92 1.01 115.11 115.47 2d93 h GLN 117 Ca -0.08 0.01 0.12 0.00 -1.45 0.00 0.00 58.65 57.24 2d93 h GLN 117 Cb 0.62 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.04 2d93 h GLN 117 CO 0.14 -0.06 0.36 -0.44 -0.95 0.00 0.00 178.83 177.88 2d93 h ASP 118 N -0.09 0.16 1.28 1.46 3.32 -1.94 0.42 116.42 121.02 2d93 h ASP 118 Ca 0.15 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2d93 h ASP 118 Cb 0.46 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2d93 h ASP 118 CO -0.86 0.09 0.00 0.22 -1.72 0.00 0.00 179.24 176.97 2d93 h TYR 119 N 0.17 0.00 -0.08 4.55 3.20 0.22 -2.97 116.97 122.06 2d93 h TYR 119 Ca 0.25 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.12 2d93 h TYR 119 Cb 0.75 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.02 2d93 h TYR 119 CO -0.00 0.00 0.00 1.87 -1.64 0.00 0.00 178.16 178.39 2d93 n TRP 120 N -2.45 0.10 0.25 -3.82 -0.00 0.12 -4.08 117.44 107.56 2d93 n TRP 120 Ca 0.04 -0.10 0.09 0.00 -0.00 0.00 0.00 57.50 57.53 2d93 n TRP 120 Cb 0.37 -0.01 0.16 0.00 -0.00 0.00 0.00 31.31 31.83 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 0.64 2.10 0.03 5.87 1.74 0.21 -4.01 116.66 123.24 2d93 n ARG 121 Ca 0.08 -1.95 0.00 0.00 -0.77 0.00 0.00 57.85 55.21 2d93 n ARG 121 Cb 0.32 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 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 1.06 0.48 0.12 0.55 5.41 -1.23 -4.69 119.36 121.07 2d93 n ILE 122 Ca 0.14 0.16 0.00 0.00 1.00 0.00 0.00 62.75 64.06 2d93 n ILE 122 Cb 0.49 -1.40 0.30 0.00 -0.71 0.00 0.00 39.64 38.32 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 0.00 0.18-10.62 1.39 4.07 -1.83 -3.44 115.31 105.06 2d93 h LEU 123 Ca 0.00 -0.06 -0.44 0.00 0.08 0.00 0.00 57.88 57.46 2d93 h LEU 123 Cb 0.48 -0.05 0.16 0.00 1.08 0.00 0.00 40.66 42.33 2d93 h LEU 123 CO 0.00 0.50 0.31 0.20 -1.08 0.00 0.00 178.44 178.37 2d93 s ASN 124 N -6.89 2.57 -0.48 -0.43 0.01 -1.26 -4.97 114.94 103.49 2d93 s ASN 124 Ca -0.04 0.53 0.03 0.00 -0.71 0.00 0.00 52.86 52.67 2d93 s ASN 124 Cb 0.14 -0.75 0.62 0.00 0.41 0.00 0.00 41.25 41.67 2d93 s ASN 124 CO 0.75 -3.10 1.91 1.41 -1.51 0.00 0.00 177.10 176.56 2d93 n HIS 125 N -4.06 3.00 -2.13 2.20 8.25 -1.26 -4.94 115.22 116.29 2d93 n HIS 125 Ca 0.13 -2.07 -0.32 0.00 -0.26 0.00 0.00 57.72 55.20 2d93 n HIS 125 Cb 0.59 -1.02 -0.00 0.00 1.12 0.00 0.00 29.99 30.68 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 -3.60 4.20 0.17 1.59 0.11 -1.26 -4.94 120.40 116.67 2d93 s VAL 126 Ca 0.58 0.99 -0.20 0.00 -2.93 0.00 0.00 61.98 60.41 2d93 s VAL 126 Cb 0.48 -3.56 -0.13 0.00 -1.53 0.00 0.00 36.38 31.64 2d93 s VAL 126 CO 0.08 -0.67 0.35 1.21 -3.33 0.00 0.00 175.10 172.74 2d93 n GLU 127 N -2.01 0.00 -0.59 1.54 4.07 -1.26 -4.65 120.64 117.74 2d93 n GLU 127 Ca 0.08 0.00 0.47 0.00 -0.06 0.00 0.00 57.16 57.64 2d93 n GLU 127 Cb 0.53 -0.75 0.76 0.00 -0.06 0.00 0.00 31.44 31.93 2d93 n GLU 127 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2d93 h LYS 128 N 0.68 0.01 -4.75 5.31 6.56 -1.93 -3.40 116.57 119.07 2d93 h LYS 128 Ca -0.22 -0.00 -0.46 0.00 -1.06 0.00 0.00 60.65 58.91 2d93 h LYS 128 Cb 1.07 -0.00 -0.09 0.00 -0.57 0.00 0.00 32.23 32.64 2d93 h LYS 128 CO 0.42 0.01 1.69 0.43 -2.06 0.00 0.00 179.45 179.93 2d93 n SER 129 N -4.28 0.14 0.00 0.86 7.64 -1.26 -4.75 113.62 111.97 2d93 n SER 129 Ca 0.42 0.12 0.00 0.00 1.01 0.00 0.00 58.87 60.42 2d93 n SER 129 Cb 1.79 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 64.15 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 6.10 0.78 0.21 0.23 0.00 -1.26 -4.92 105.19 106.33 2d93 n GLY 130 Ca 0.63 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.72 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 -7.20 1.61 0.13 -1.90 -3.45 132.00 121.19 2d93 h PRO 131 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.68 2d93 h PRO 131 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 2d93 h PRO 131 CO 0.00 0.30 0.16 -1.54 -0.23 0.00 0.00 178.00 176.70 2d93 s SER 132 N -6.43 4.76 -0.17 1.44 1.04 -1.26 -5.08 113.70 108.00 2d93 s SER 132 Ca -0.01 0.23 -0.07 0.00 0.48 0.00 0.00 55.95 56.58 2d93 s SER 132 Cb 0.12 -0.86 -0.04 0.00 0.10 0.00 0.00 66.02 65.33 2d93 s SER 132 CO 0.66 -1.59 0.08 -0.44 0.98 0.00 0.00 173.24 172.93 2d93 s SER 133 N -4.55 5.78 0.00 7.02 0.01 -1.26 -4.94 113.70 115.76 2d93 s SER 133 Ca 0.61 0.16 0.00 0.00 1.31 0.00 0.00 55.95 58.03 2d93 s SER 133 Cb -0.10 -1.95 0.00 0.00 0.21 0.00 0.00 66.02 64.18 2d93 s SER 133 CO 0.44 0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.92