#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d93 s SER 2 N 0.00 3.07 -0.24 1.61 0.01 -1.26 -5.02 113.70 111.88 2d93 s SER 2 Ca 0.00 -0.57 -0.18 0.00 1.31 0.00 0.00 55.95 56.51 2d93 s SER 2 Cb 0.00 -1.41 -0.15 0.00 0.21 0.00 0.00 66.02 64.67 2d93 s SER 2 CO 0.00 0.13 -0.05 -1.54 0.41 0.00 0.00 173.24 172.18 2d93 n SER 3 N 3.74 1.90 0.00 2.44 3.41 -1.26 -5.05 113.62 118.79 2d93 n SER 3 Ca -0.19 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2d93 n SER 3 Cb 0.52 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 2d93 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d93 n GLY 4 N 1.36 0.70 3.62 5.00 0.00 -1.26 -5.12 105.19 109.50 2d93 n GLY 4 Ca -0.40 0.25 -0.48 0.00 0.00 0.00 0.00 46.02 45.38 2d93 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d93 n SER 5 N 0.00 2.19 -4.93 1.61 7.64 -1.26 -4.97 113.62 113.89 2d93 n SER 5 Ca 0.00 1.12 -0.23 0.00 1.01 0.00 0.00 58.87 60.77 2d93 n SER 5 Cb 0.00 -1.30 -0.03 0.00 -1.01 0.00 0.00 64.21 61.87 2d93 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d93 s SER 6 N 0.47 6.18 0.27 6.43 0.01 -1.26 -5.10 113.70 120.70 2d93 s SER 6 Ca 0.78 0.05 -0.13 0.00 1.31 0.00 0.00 55.95 57.96 2d93 s SER 6 Cb -0.80 -1.80 -0.08 0.00 0.21 0.00 0.00 66.02 63.55 2d93 s SER 6 CO 0.46 -0.02 0.64 -0.83 0.41 0.00 0.00 173.24 173.90 2d93 s GLY 7 N -3.68 2.33 0.09 3.44 0.00 -1.26 -5.00 107.32 103.24 2d93 s GLY 7 Ca 0.34 -0.10 -0.16 0.00 0.00 0.00 0.00 44.72 44.80 2d93 s GLY 7 CO 0.28 0.09 1.44 -1.80 0.00 0.00 0.00 173.10 173.11 2d93 h ASP 8 N 2.49 0.64 -3.07 1.64 3.58 -2.06 -3.37 116.42 116.27 2d93 h ASP 8 Ca -0.47 -0.43 -0.62 0.00 0.42 0.00 0.00 57.03 55.93 2d93 h ASP 8 Cb 1.17 -0.18 -0.41 0.00 1.72 0.00 0.00 39.33 41.63 2d93 h ASP 8 CO 0.67 0.92 -0.62 -1.81 -2.88 0.00 0.00 179.24 175.53 2d93 s ASP 9 N -6.34 4.44 -0.11 2.28 1.11 -1.26 -4.93 116.67 111.87 2d93 s ASP 9 Ca -0.13 -3.73 -0.20 0.00 0.18 0.00 0.00 52.55 48.67 2d93 s ASP 9 Cb 0.08 -1.50 -0.17 0.00 1.07 0.00 0.00 42.92 42.40 2d93 s ASP 9 CO 0.80 -0.10 0.59 -0.78 1.18 0.00 0.00 175.17 176.86 2d93 h ASP 10 N 5.47 -0.03 0.55 0.27 3.58 -2.00 -3.29 116.42 120.97 2d93 h ASP 10 Ca 0.15 -0.60 -0.02 0.00 0.42 0.00 0.00 57.03 56.98 2d93 h ASP 10 Cb 0.78 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 2d93 h ASP 10 CO 0.68 0.74 -0.47 0.40 -2.88 0.00 0.00 179.24 177.71 2d93 h ILE 11 N -0.96 0.07 -0.84 2.25 2.04 -1.95 -1.69 117.51 116.44 2d93 h ILE 11 Ca -0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 2d93 h ILE 11 Cb 0.63 0.07 -0.14 0.00 -0.74 0.00 0.00 36.82 36.64 2d93 h ILE 11 CO 0.01 0.00 -0.29 -0.62 0.00 0.00 0.00 178.15 177.24 2d93 n GLU 12 N -5.56 -0.16 -0.13 2.37 -0.58 -1.26 0.10 120.64 115.42 2d93 n GLU 12 Ca -0.12 1.30 -0.09 0.00 -0.42 0.00 0.00 57.16 57.83 2d93 n GLU 12 Cb 0.45 -1.93 -0.00 0.00 -0.57 0.00 0.00 31.44 29.39 2d93 n GLU 12 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2d93 h GLN 13 N 0.00 0.56 -0.21 3.49 1.08 -1.57 -2.93 115.11 115.53 2d93 h GLN 13 Ca 0.33 -0.07 0.05 0.00 -1.45 0.00 0.00 58.65 57.50 2d93 h GLN 13 Cb 0.54 -0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.81 2d93 h GLN 13 CO -0.84 0.48 -0.08 1.25 -0.95 0.00 0.00 178.83 178.68 2d93 h LEU 14 N 0.50 -0.28 -0.01 1.46 7.12 0.16 -1.75 115.31 122.51 2d93 h LEU 14 Ca 0.14 0.08 0.00 0.00 0.13 0.00 0.00 57.88 58.23 2d93 h LEU 14 Cb 0.09 0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.38 2d93 h LEU 14 CO -0.02 -0.11 -0.07 -0.07 -0.13 0.00 0.00 178.44 178.04 2d93 h LEU 15 N -0.05 -0.22 -1.37 2.25 -0.00 -0.63 0.19 115.31 115.48 2d93 h LEU 15 Ca 0.11 0.03 0.36 0.00 -0.00 0.00 0.00 57.88 58.37 2d93 h LEU 15 Cb 0.21 0.08 -0.11 0.00 -0.00 0.00 0.00 40.66 40.84 2d93 h LEU 15 CO -0.25 -0.07 0.76 1.05 -0.00 0.00 0.00 178.44 179.93 2d93 h GLU 16 N -0.08 0.22 -0.18 1.13 4.11 -1.45 0.34 114.58 118.66 2d93 h GLU 16 Ca 0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.39 2d93 h GLU 16 Cb 0.09 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2d93 h GLU 16 CO -0.05 0.14 -0.01 0.35 0.07 0.00 0.00 179.01 179.51 2d93 h PHE 17 N 0.22 0.36 -1.00 2.06 3.57 -0.24 -3.01 116.94 118.91 2d93 h PHE 17 Ca 0.72 -0.07 0.29 0.00 3.53 0.00 0.00 57.97 62.44 2d93 h PHE 17 Cb 2.07 -0.09 -0.14 0.00 2.79 0.00 0.00 35.95 40.58 2d93 h PHE 17 CO -0.00 0.55 0.56 0.52 -2.23 0.00 0.00 178.31 177.71 2d93 h MET 18 N 0.07 0.40 -0.91 1.11 2.86 0.27 0.61 114.93 119.33 2d93 h MET 18 Ca 0.05 -0.02 0.21 0.00 -2.06 0.00 0.00 59.70 57.88 2d93 h MET 18 Cb 0.41 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 2d93 h MET 18 CO 0.01 0.26 0.61 0.45 1.06 0.00 0.00 176.91 179.30 2d93 h HIS 19 N 0.41 0.50 -0.64 -0.22 3.86 -1.38 0.45 115.15 118.15 2d93 h HIS 19 Ca 0.69 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.91 2d93 h HIS 19 Cb 1.49 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 29.78 2d93 h HIS 19 CO -0.02 0.12 0.34 1.96 0.86 0.00 0.00 177.93 181.20 2d93 h GLN 20 N 0.37 0.89 -6.31 2.45 1.08 0.12 -3.42 115.11 110.29 2d93 h GLN 20 Ca 0.48 -0.11 -0.55 0.00 -1.45 0.00 0.00 58.65 57.02 2d93 h GLN 20 Cb 1.24 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 28.46 2d93 h GLN 20 CO -0.17 0.68 0.12 -0.51 -0.95 0.00 0.00 178.83 178.00 2d93 s LEU 21 N -9.93 4.48 0.24 1.46 1.43 0.15 -4.98 118.68 111.53 2d93 s LEU 21 Ca -0.13 1.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.41 2d93 s LEU 21 Cb 0.13 -3.17 0.26 0.00 0.03 0.00 0.00 46.19 43.45 2d93 s LEU 21 CO 0.78 0.09 1.61 1.55 0.23 0.00 0.00 176.35 180.61 2d93 h PRO 22 N 5.27 0.45 -0.97 1.29 0.13 -1.80 -1.45 132.00 134.93 2d93 h PRO 22 Ca -0.45 -0.24 0.11 0.00 -0.87 0.00 0.00 66.00 64.55 2d93 h PRO 22 Cb 1.21 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.27 2d93 h PRO 22 CO 0.69 0.81 0.62 0.00 -0.23 0.00 0.00 178.00 179.89 2d93 h ALA 23 N 1.16 1.55 0.00 -0.56 0.00 -1.90 -2.04 119.26 117.47 2d93 h ALA 23 Ca 0.03 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2d93 h ALA 23 Cb 0.92 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2d93 h ALA 23 CO 0.08 0.23 -0.76 0.74 0.00 0.00 0.00 179.25 179.54 2d93 h PHE 24 N 0.98 0.02 -1.02 0.00 0.04 -1.77 -3.36 116.94 111.83 2d93 h PHE 24 Ca 0.47 -0.01 0.38 0.00 2.80 0.00 0.00 57.97 61.60 2d93 h PHE 24 Cb 0.44 -0.00 -0.16 0.00 2.20 0.00 0.00 35.95 38.42 2d93 h PHE 24 CO -0.00 1.30 0.57 0.00 -0.60 0.00 0.00 178.31 179.58 2d93 h ALA 25 N -0.28 2.12 -0.64 2.45 0.00 -1.12 0.27 119.26 122.05 2d93 h ALA 25 Ca -0.21 0.23 0.13 0.00 0.00 0.00 0.00 54.91 55.06 2d93 h ALA 25 Cb 1.20 0.25 -0.12 0.00 0.00 0.00 0.00 17.79 19.12 2d93 h ALA 25 CO -0.12 -0.82 -0.17 -0.91 0.00 0.00 0.00 179.25 177.23 2d93 h ASN 26 N 0.14 -0.62 -4.17 0.00 4.21 -1.52 -3.41 115.58 110.22 2d93 h ASN 26 Ca 0.80 0.19 -0.48 0.00 1.21 0.00 0.00 56.30 58.02 2d93 h ASN 26 Cb 2.03 0.41 0.13 0.00 -1.12 0.00 0.00 38.32 39.76 2d93 h ASN 26 CO -0.68 -0.22 0.29 -0.04 -1.29 0.00 0.00 177.43 175.49 2d93 s MET 27 N -6.23 1.60 0.41 0.81 -1.94 0.96 -5.05 119.30 109.87 2d93 s MET 27 Ca -0.14 0.72 -0.04 0.00 -1.71 0.00 0.00 55.69 54.51 2d93 s MET 27 Cb 0.19 -1.86 -0.04 0.00 2.01 0.00 0.00 34.83 35.14 2d93 s MET 27 CO 0.74 -1.98 0.70 -0.08 -0.01 0.00 0.00 175.02 174.39 2d93 s THR 28 N -3.04 4.96 0.12 2.05 -1.32 -1.26 -4.91 115.64 112.23 2d93 s THR 28 Ca 0.62 0.08 -0.23 0.00 -1.21 0.00 0.00 61.69 60.95 2d93 s THR 28 Cb -0.16 -3.83 -0.05 0.00 -1.51 0.00 0.00 72.50 66.94 2d93 s THR 28 CO 0.56 -0.67 1.34 0.80 -2.21 0.00 0.00 174.62 174.43 2d93 n MET 29 N -1.85 -0.33 -0.14 7.08 1.56 -1.26 -1.45 117.12 120.73 2d93 n MET 29 Ca -0.01 1.31 -0.04 0.00 -0.27 0.00 0.00 57.70 58.70 2d93 n MET 29 Cb 0.55 -1.94 -0.03 0.00 2.15 0.00 0.00 33.22 33.95 2d93 n MET 29 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 2d93 n SER 30 N -4.72 -0.35 -0.41 6.12 7.64 -1.26 -0.99 113.62 119.64 2d93 n SER 30 Ca 0.01 1.17 -0.10 0.00 1.01 0.00 0.00 58.87 60.96 2d93 n SER 30 Cb 0.19 -0.36 -0.09 0.00 -1.01 0.00 0.00 64.21 62.94 2d93 n SER 30 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2d93 n VAL 31 N -3.73 -0.66 0.00 0.44 0.31 -0.53 -2.09 118.33 112.08 2d93 n VAL 31 Ca 0.01 2.37 0.00 0.00 -0.01 0.00 0.00 64.34 66.70 2d93 n VAL 31 Cb 0.09 -2.94 0.00 0.00 -0.91 0.00 0.00 33.84 30.08 2d93 n VAL 31 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2d93 n ARG 32 N -5.24 0.00 -0.28 5.55 1.74 -0.16 -0.60 116.66 117.66 2d93 n ARG 32 Ca 0.02 0.81 -0.02 0.00 -0.77 0.00 0.00 57.85 57.89 2d93 n ARG 32 Cb 0.26 -1.31 0.01 0.00 -1.02 0.00 0.00 32.46 30.39 2d93 n ARG 32 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2d93 n ARG 33 N -2.25 -0.21 -0.29 5.56 0.63 -0.89 0.22 116.66 119.43 2d93 n ARG 33 Ca 0.00 1.11 0.04 0.00 -0.92 0.00 0.00 57.85 58.08 2d93 n ARG 33 Cb 0.00 -1.64 0.18 0.00 0.45 0.00 0.00 32.46 31.45 2d93 n ARG 33 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2d93 h GLU 34 N 0.00 0.73 -0.35 -0.14 4.39 -0.71 -1.79 114.58 116.71 2d93 h GLU 34 Ca 0.22 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 2d93 h GLU 34 Cb 0.40 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 2d93 h GLU 34 CO -0.71 0.48 0.15 -0.07 -1.16 0.00 0.00 179.01 177.70 2d93 h LEU 35 N 0.75 0.47 -1.78 1.33 3.38 0.51 -1.73 115.31 118.23 2d93 h LEU 35 Ca 0.42 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2d93 h LEU 35 Cb 0.44 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2d93 h LEU 35 CO -0.28 0.48 0.25 0.00 0.09 0.00 0.00 178.44 178.98 2d93 n SER 37 N -2.64 0.19 -0.60 0.00 7.64 -0.71 -4.22 113.62 113.29 2d93 n SER 37 Ca -0.02 0.08 0.06 0.00 1.01 0.00 0.00 58.87 60.00 2d93 n SER 37 Cb 0.29 1.59 0.17 0.00 -1.01 0.00 0.00 64.21 65.25 2d93 n SER 37 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2d93 n VAL 38 N -2.38 1.55 -4.35 0.44 0.24 0.16 -4.99 118.33 108.99 2d93 n VAL 38 Ca -0.05 -1.43 -0.31 0.00 -2.04 0.00 0.00 64.34 60.51 2d93 n VAL 38 Cb 0.60 0.16 -0.10 0.00 -1.47 0.00 0.00 33.84 33.03 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 -1.83 2.42 0.22 7.34 0.00 0.21 -4.24 119.30 123.41 2d93 s MET 39 Ca 0.28 -0.83 -0.02 0.00 0.00 0.00 0.00 55.69 55.13 2d93 s MET 39 Cb 0.20 -2.45 -0.04 0.00 0.00 0.00 0.00 34.83 32.54 2d93 s MET 39 CO 0.10 0.57 0.43 0.42 0.00 0.00 0.00 175.02 176.53 2d93 s ILE 40 N -1.10 5.16 -0.25 3.16 1.01 0.60 -4.91 121.20 124.87 2d93 s ILE 40 Ca 0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 60.65 60.56 2d93 s ILE 40 Cb -0.11 -3.73 0.03 0.00 0.01 0.00 0.00 42.46 38.66 2d93 s ILE 40 CO 0.11 -0.21 -0.07 -0.36 0.00 0.00 0.00 174.94 174.42 2d93 s PHE 41 N -1.92 3.10 0.03 3.97 0.08 -1.26 -3.25 117.98 118.73 2d93 s PHE 41 Ca 0.40 -1.69 -0.00 0.00 0.12 0.00 0.00 56.93 55.76 2d93 s PHE 41 Cb -0.11 -2.04 -0.03 0.00 -0.57 0.00 0.00 43.02 40.27 2d93 s PHE 41 CO 0.29 -0.76 -0.03 -1.21 -0.10 0.00 0.00 175.22 173.41 2d93 s GLU 42 N 1.29 0.41 -0.11 0.44 0.41 -1.00 -5.05 118.70 115.09 2d93 s GLU 42 Ca -0.01 -0.81 -0.04 0.00 -0.41 0.00 0.00 54.97 53.70 2d93 s GLU 42 Cb -0.17 0.13 0.06 0.00 -1.78 0.00 0.00 34.13 32.36 2d93 s GLU 42 CO -0.05 -0.07 0.22 0.54 -0.49 0.00 0.00 175.26 175.42 2d93 s VAL 43 N -2.23 -0.32 -0.08 2.63 0.11 -1.26 -0.82 120.40 118.43 2d93 s VAL 43 Ca -0.09 0.29 -0.28 0.00 -2.93 0.00 0.00 61.98 58.97 2d93 s VAL 43 Cb -0.04 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2d93 s VAL 43 CO -0.04 0.12 0.94 -0.69 -3.33 0.00 0.00 175.10 172.11 2d93 s VAL 44 N 2.23 4.85 -0.11 2.04 1.01 0.23 -4.91 120.40 125.74 2d93 s VAL 44 Ca 0.01 1.93 -0.10 0.00 0.00 0.00 0.00 61.98 63.81 2d93 s VAL 44 Cb -0.12 -4.26 -0.26 0.00 0.00 0.00 0.00 36.38 31.74 2d93 s VAL 44 CO -0.07 0.08 0.43 -0.33 0.00 0.00 0.00 175.10 175.20 2d93 h GLU 45 N 7.02 0.26 -5.71 2.72 5.08 -1.95 -1.53 114.58 120.46 2d93 h GLU 45 Ca -0.34 -0.45 -0.60 0.00 -1.00 0.00 0.00 59.36 56.96 2d93 h GLU 45 Cb 1.17 0.17 -0.10 0.00 0.50 0.00 0.00 28.75 30.49 2d93 h GLU 45 CO 0.81 1.22 0.38 -0.65 -1.00 0.00 0.00 179.01 179.77 2d93 s GLN 46 N -2.54 4.13 1.34 2.33 -0.21 -1.26 -3.73 119.66 119.72 2d93 s GLN 46 Ca -0.22 0.79 -0.21 0.00 0.02 0.00 0.00 55.36 55.74 2d93 s GLN 46 Cb 0.06 -3.66 0.34 0.00 1.00 0.00 0.00 33.01 30.75 2d93 s GLN 46 CO 0.77 -0.51 1.00 0.00 -2.12 0.00 0.00 175.29 174.43 2d93 s ALA 47 N 2.77 -0.22 -1.07 6.09 0.00 -1.26 -3.56 121.76 124.51 2d93 s ALA 47 Ca 0.32 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2d93 s ALA 47 Cb -0.15 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2d93 s ALA 47 CO 0.08 -4.22 0.00 0.41 0.00 0.00 0.00 175.76 172.03 2d93 n GLY 48 N 0.46 0.23 3.77 0.00 0.00 -1.04 -4.91 105.19 103.70 2d93 n GLY 48 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.28 3.37 -0.24 4.61 0.00 -1.23 -4.70 121.76 121.29 2d93 s ALA 49 Ca 0.00 0.44 -0.29 0.00 0.00 0.00 0.00 51.96 52.11 2d93 s ALA 49 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2d93 s ALA 49 CO 0.00 0.25 1.14 0.42 0.00 0.00 0.00 175.76 177.57 2d93 s ILE 50 N -1.28 4.47 -0.11 0.00 1.09 -1.26 -1.99 121.20 122.12 2d93 s ILE 50 Ca 0.40 1.75 -0.13 0.00 -1.10 0.00 0.00 60.65 61.57 2d93 s ILE 50 Cb -0.23 -4.23 -0.26 0.00 -1.06 0.00 0.00 42.46 36.68 2d93 s ILE 50 CO 0.27 -0.27 0.47 0.40 -0.10 0.00 0.00 174.94 175.71 2d93 h ILE 51 N 5.58 0.87 -3.30 2.92 1.08 -1.78 -3.49 117.51 119.40 2d93 h ILE 51 Ca -0.22 -2.37 -0.15 0.00 -0.39 0.00 0.00 64.86 61.73 2d93 h ILE 51 Cb 1.08 2.60 -0.22 0.00 -3.07 0.00 0.00 36.82 37.20 2d93 h ILE 51 CO 1.00 0.74 -0.43 -0.76 -0.69 0.00 0.00 178.15 178.01 2d93 s LEU 52 N -7.39 1.27 0.13 1.44 1.43 -1.25 -4.98 118.68 109.32 2d93 s LEU 52 Ca -0.21 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 2d93 s LEU 52 Cb 0.05 0.84 -0.04 0.00 0.03 0.00 0.00 46.19 47.07 2d93 s LEU 52 CO 0.76 -0.30 0.04 -1.61 0.23 0.00 0.00 176.35 175.47 2d93 s GLU 53 N -0.91 2.62 0.23 1.70 2.02 -1.26 -1.30 118.70 121.79 2d93 s GLU 53 Ca -0.10 -0.92 -0.30 0.00 0.02 0.00 0.00 54.97 53.67 2d93 s GLU 53 Cb -0.05 -2.52 -0.10 0.00 0.10 0.00 0.00 34.13 31.56 2d93 s GLU 53 CO 0.02 0.50 1.39 0.16 0.02 0.00 0.00 175.26 177.35 2d93 s ASP 54 N -2.71 6.74 0.00 -0.19 -4.77 0.13 -3.14 116.67 112.72 2d93 s ASP 54 Ca 0.28 2.57 0.00 0.00 -3.30 0.00 0.00 52.55 52.10 2d93 s ASP 54 Cb -0.11 -2.62 0.00 0.00 -1.09 0.00 0.00 42.92 39.11 2d93 s ASP 54 CO 0.20 -0.64 0.00 0.61 0.70 0.00 0.00 175.17 176.04 2d93 n GLY 55 N 2.27 0.79 3.40 2.12 0.00 0.31 -4.93 105.19 109.16 2d93 n GLY 55 Ca 0.07 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.28 3.50 -0.96 1.61 0.74 -1.19 -4.87 119.66 115.21 2d93 s GLN 56 Ca 0.00 -0.60 -0.25 0.00 0.05 0.00 0.00 55.36 54.57 2d93 s GLN 56 Cb 0.00 -2.88 -0.09 0.00 1.10 0.00 0.00 33.01 31.14 2d93 s GLN 56 CO 0.00 0.09 2.06 -2.00 -0.55 0.00 0.00 175.29 174.88 2d93 s GLU 57 N 0.74 2.20 0.00 1.67 2.12 -1.26 -1.12 118.70 123.06 2d93 s GLU 57 Ca -0.03 -0.35 -0.34 0.00 0.36 0.00 0.00 54.97 54.61 2d93 s GLU 57 Cb -0.15 -5.04 -0.13 0.00 0.26 0.00 0.00 34.13 29.08 2d93 s GLU 57 CO 0.02 -3.96 1.75 1.28 -0.54 0.00 0.00 175.26 173.81 2d93 n LEU 58 N 15.63 3.23 0.00 2.70 4.77 -0.20 -4.82 117.00 138.31 2d93 n LEU 58 Ca 0.43 1.02 0.00 0.00 -0.03 0.00 0.00 56.01 57.43 2d93 n LEU 58 Cb 0.46 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.17 2d93 n LEU 58 CO 0.60 -0.18 0.09 -0.90 -1.33 0.00 0.00 177.39 175.67 2d93 n ASP 59 N 5.28 0.35 -3.87 -1.43 5.68 -1.26 -4.17 116.55 117.13 2d93 n ASP 59 Ca 0.20 -0.77 -0.21 0.00 -0.50 0.00 0.00 54.79 53.52 2d93 n ASP 59 Cb 0.28 0.16 -0.17 0.00 -1.14 0.00 0.00 41.12 40.26 2d93 n ASP 59 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2d93 s SER 60 N -0.16 1.20 -0.07 -1.12 0.01 -1.26 -2.39 113.70 109.90 2d93 s SER 60 Ca 0.00 -0.13 -0.30 0.00 1.31 0.00 0.00 55.95 56.83 2d93 s SER 60 Cb 0.00 -0.48 -0.03 0.00 0.21 0.00 0.00 66.02 65.72 2d93 s SER 60 CO 0.00 -0.09 1.20 0.86 0.41 0.00 0.00 173.24 175.62 2d93 s TRP 61 N 1.20 3.17 0.09 2.43 -0.00 -0.76 -4.22 118.94 120.86 2d93 s TRP 61 Ca -0.06 1.21 0.02 0.00 -0.00 0.00 0.00 56.10 57.26 2d93 s TRP 61 Cb -0.14 -3.42 -0.04 0.00 -0.00 0.00 0.00 33.47 29.88 2d93 s TRP 61 CO -0.02 -1.29 0.19 0.71 -0.00 0.00 0.00 176.95 176.54 2d93 s TYR 62 N 2.38 3.41 0.03 5.86 1.51 0.32 -2.56 117.35 128.30 2d93 s TYR 62 Ca 0.55 0.16 -0.00 0.00 -1.01 0.00 0.00 57.07 56.77 2d93 s TYR 62 Cb -0.24 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 39.90 2d93 s TYR 62 CO 0.21 0.55 -0.03 0.08 -1.11 0.00 0.00 175.55 175.25 2d93 s VAL 63 N -1.56 0.15 -0.60 0.71 1.01 -1.17 -0.56 120.40 118.38 2d93 s VAL 63 Ca 0.33 -1.21 -0.17 0.00 0.00 0.00 0.00 61.98 60.93 2d93 s VAL 63 Cb -0.12 -0.68 0.13 0.00 0.00 0.00 0.00 36.38 35.71 2d93 s VAL 63 CO 0.27 -0.66 0.63 -0.63 0.00 0.00 0.00 175.10 174.70 2d93 s ILE 64 N -2.27 5.06 0.06 2.22 1.01 -0.92 -3.39 121.20 122.97 2d93 s ILE 64 Ca -0.08 -1.36 -0.07 0.00 0.00 0.00 0.00 60.65 59.13 2d93 s ILE 64 Cb -0.04 -4.43 -0.30 0.00 0.01 0.00 0.00 42.46 37.70 2d93 s ILE 64 CO -0.04 -1.01 1.08 -0.07 0.00 0.00 0.00 174.94 174.90 2d93 h LEU 65 N 9.31 0.53 -7.11 2.97 3.38 -1.59 -2.19 115.31 120.61 2d93 h LEU 65 Ca -0.25 -0.58 -0.07 0.00 0.09 0.00 0.00 57.88 57.07 2d93 h LEU 65 Cb 1.09 -0.17 -0.22 0.00 0.09 0.00 0.00 40.66 41.45 2d93 h LEU 65 CO 1.05 1.45 0.02 0.21 0.09 0.00 0.00 178.44 181.26 2d93 s ASN 66 N -7.25 -0.63 0.00 -0.43 2.47 -1.09 -4.79 114.94 103.23 2d93 s ASN 66 Ca -0.06 1.14 0.00 0.00 0.42 0.00 0.00 52.86 54.36 2d93 s ASN 66 Cb 0.06 1.14 0.00 0.00 -1.45 0.00 0.00 41.25 41.01 2d93 s ASN 66 CO 0.90 -0.27 0.00 0.61 -3.72 0.00 0.00 177.10 174.62 2d93 n GLY 67 N 2.49 0.07 3.25 1.21 0.00 -1.26 -1.53 105.19 109.42 2d93 n GLY 67 Ca -0.15 -1.92 -0.31 0.00 0.00 0.00 0.00 46.02 43.64 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 -1.30 2.00 -0.00 2.61 2.01 -1.26 -2.99 115.64 116.70 2d93 s THR 68 Ca 0.00 -1.03 0.06 0.00 0.31 0.00 0.00 61.69 61.03 2d93 s THR 68 Cb 0.00 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 2d93 s THR 68 CO 0.00 0.56 -0.19 0.68 -0.69 0.00 0.00 174.62 174.98 2d93 s VAL 69 N -0.13 2.68 -0.04 3.82 -7.23 -1.20 -0.03 120.40 118.28 2d93 s VAL 69 Ca -0.04 -1.03 0.04 0.00 -1.81 0.00 0.00 61.98 59.14 2d93 s VAL 69 Cb -0.14 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.72 2d93 s VAL 69 CO 0.04 0.48 -0.15 -0.70 -0.31 0.00 0.00 175.10 174.46 2d93 s GLU 70 N -1.01 2.46 -0.01 4.82 2.12 0.78 -2.41 118.70 125.45 2d93 s GLU 70 Ca 0.12 -0.72 0.05 0.00 0.36 0.00 0.00 54.97 54.78 2d93 s GLU 70 Cb -0.10 -2.35 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 2d93 s GLU 70 CO 0.02 0.62 -0.14 0.42 -0.54 0.00 0.00 175.26 175.63 2d93 s ILE 71 N -0.75 3.07 -0.07 -3.70 1.01 -1.19 -0.82 121.20 118.75 2d93 s ILE 71 Ca 0.12 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 59.90 2d93 s ILE 71 Cb -0.11 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.11 2d93 s ILE 71 CO 0.01 0.46 -0.14 -0.55 0.00 0.00 0.00 174.94 174.72 2d93 s SER 72 N -1.11 1.99 0.06 3.58 0.15 0.27 -1.78 113.70 116.86 2d93 s SER 72 Ca 0.14 -0.34 0.01 0.00 0.70 0.00 0.00 55.95 56.46 2d93 s SER 72 Cb -0.11 -0.90 -0.04 0.00 -1.71 0.00 0.00 66.02 63.26 2d93 s SER 72 CO 0.04 0.06 0.14 -1.00 1.20 0.00 0.00 173.24 173.68 2d93 s HIS 73 N 0.57 3.36 -0.40 3.44 3.76 0.10 -0.15 115.29 125.97 2d93 s HIS 73 Ca -0.15 0.17 0.25 0.00 -0.15 0.00 0.00 55.06 55.19 2d93 s HIS 73 Cb -0.16 -1.70 1.04 0.00 1.11 0.00 0.00 32.58 32.87 2d93 s HIS 73 CO 0.04 0.56 1.74 -1.00 -0.85 0.00 0.00 174.74 175.24 2d93 h PRO 74 N 3.29 0.00 0.07 8.40 0.13 -1.87 -3.10 132.00 138.92 2d93 h PRO 74 Ca -0.46 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 2d93 h PRO 74 Cb 1.16 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 2d93 h PRO 74 CO 0.70 0.00 -0.49 -0.44 -0.23 0.00 0.00 178.00 177.54 2d93 h ASP 75 N 0.00 0.30 0.00 1.44 3.32 -1.94 -3.48 116.42 116.06 2d93 h ASP 75 Ca 0.00 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 56.12 2d93 h ASP 75 Cb 0.37 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2d93 h ASP 75 CO 0.00 1.21 0.00 0.61 -1.72 0.00 0.00 179.24 179.34 2d93 n GLY 76 N 1.54 0.00 3.22 2.75 0.00 -1.17 -5.17 105.19 106.36 2d93 n GLY 76 Ca -0.12 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 1.20 -0.26 1.61 2.20 -1.26 -4.99 119.74 118.24 2d93 s LYS 77 Ca 0.00 -0.91 -0.02 0.00 -0.36 0.00 0.00 55.97 54.68 2d93 s LYS 77 Cb 0.00 -1.30 0.08 0.00 -1.51 0.00 0.00 37.83 35.10 2d93 s LYS 77 CO 0.00 0.33 0.08 0.08 -0.36 0.00 0.00 175.35 175.48 2d93 s VAL 78 N -0.87 0.51 1.04 4.02 1.01 -1.26 0.00 120.40 124.86 2d93 s VAL 78 Ca 0.05 -0.92 -0.15 0.00 0.00 0.00 0.00 61.98 60.97 2d93 s VAL 78 Cb -0.09 -1.25 0.21 0.00 0.00 0.00 0.00 36.38 35.25 2d93 s VAL 78 CO 0.02 -0.51 1.13 -1.61 0.00 0.00 0.00 175.10 174.13 2d93 s GLU 79 N 1.83 0.10 -0.21 2.72 0.41 -0.73 -4.89 118.70 117.93 2d93 s GLU 79 Ca 0.05 0.20 -0.04 0.00 -0.41 0.00 0.00 54.97 54.77 2d93 s GLU 79 Cb -0.17 -1.73 0.10 0.00 -1.78 0.00 0.00 34.13 30.55 2d93 s GLU 79 CO -0.21 -2.88 0.24 0.54 -0.49 0.00 0.00 175.26 172.46 2d93 s ASN 80 N -3.85 1.25 0.15 -0.19 2.20 -1.26 -3.20 114.94 110.04 2d93 s ASN 80 Ca 0.67 -0.18 0.05 0.00 -0.94 0.00 0.00 52.86 52.46 2d93 s ASN 80 Cb -0.14 0.47 -0.04 0.00 -2.00 0.00 0.00 41.25 39.55 2d93 s ASN 80 CO 0.56 -0.33 0.08 -0.76 -2.94 0.00 0.00 177.10 173.72 2d93 s LEU 81 N 2.35 3.65 0.17 3.54 1.43 -1.01 -5.07 118.68 123.74 2d93 s LEU 81 Ca 0.08 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.02 2d93 s LEU 81 Cb -0.16 -2.29 -0.05 0.00 0.03 0.00 0.00 46.19 43.73 2d93 s LEU 81 CO -0.13 0.09 -0.05 -0.36 0.23 0.00 0.00 176.35 176.14 2d93 s PHE 82 N -1.67 1.26 -0.46 0.29 0.08 -1.26 -3.23 117.98 112.98 2d93 s PHE 82 Ca 0.29 -0.89 -0.42 0.00 0.12 0.00 0.00 56.93 56.03 2d93 s PHE 82 Cb -0.10 -0.69 -0.18 0.00 -0.57 0.00 0.00 43.02 41.48 2d93 s PHE 82 CO 0.22 -0.06 1.68 -0.12 -0.10 0.00 0.00 175.22 176.83 2d93 n MET 83 N -0.23 0.00 0.00 0.44 0.00 -1.16 -1.23 117.12 114.93 2d93 n MET 83 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.62 2d93 n MET 83 Cb 0.62 -1.37 0.00 0.00 0.00 0.00 0.00 33.22 32.47 2d93 n MET 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2d93 n GLY 84 N 5.05 3.35 3.41 -5.12 0.00 -0.82 -4.98 105.19 106.07 2d93 n GLY 84 Ca 0.38 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.05 -0.07 -0.02 1.61 -0.87 -0.36 -4.09 114.94 111.08 2d93 s ASN 85 Ca 0.00 1.07 -0.13 0.00 -1.57 0.00 0.00 52.86 52.23 2d93 s ASN 85 Cb 0.00 -1.60 0.02 0.00 -0.02 0.00 0.00 41.25 39.65 2d93 s ASN 85 CO 0.00 -4.79 0.27 -0.94 -2.57 0.00 0.00 177.10 169.07 2d93 s SER 86 N -3.00 -0.15 0.17 -1.22 1.04 -1.26 -2.18 113.70 107.11 2d93 s SER 86 Ca 0.69 0.05 -0.11 0.00 0.48 0.00 0.00 55.95 57.06 2d93 s SER 86 Cb -0.17 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2d93 s SER 86 CO 0.60 -0.41 0.34 0.72 0.98 0.00 0.00 173.24 175.47 2d93 s PHE 87 N -1.25 0.27 0.00 5.02 -0.71 0.28 -4.99 117.98 116.60 2d93 s PHE 87 Ca -0.13 -0.63 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 2d93 s PHE 87 Cb -0.06 0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.80 2d93 s PHE 87 CO 0.03 -0.76 0.00 0.41 -1.34 0.00 0.00 175.22 173.56 2d93 n GLY 88 N -0.24 1.22 2.44 1.99 0.00 -1.26 0.12 105.19 109.46 2d93 n GLY 88 Ca -0.08 -0.58 -0.19 0.00 0.00 0.00 0.00 46.02 45.17 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 -4.10 -0.61 -5.35 -1.26 -4.92 119.36 103.12 2d93 n ILE 89 Ca 0.00 -1.70 -0.22 0.00 -0.27 0.00 0.00 62.75 60.56 2d93 n ILE 89 Cb 0.00 0.54 -0.04 0.00 -1.74 0.00 0.00 39.64 38.39 2d93 n ILE 89 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2d93 s THR 90 N -2.55 4.32 -1.96 7.28 -4.23 -1.26 -4.82 115.64 112.42 2d93 s THR 90 Ca 0.11 -1.43 0.16 0.00 -1.18 0.00 0.00 61.69 59.35 2d93 s THR 90 Cb 0.01 -3.36 0.43 0.00 1.34 0.00 0.00 72.50 70.92 2d93 s THR 90 CO 0.08 -0.34 1.35 -0.81 -0.54 0.00 0.00 174.62 174.36 2d93 n PRO 91 N -1.18 0.47 -3.65 3.99 -0.04 -1.26 -4.68 135.00 128.65 2d93 n PRO 91 Ca -0.07 0.01 -0.36 0.00 -0.04 0.00 0.00 63.50 63.04 2d93 n PRO 91 Cb 0.58 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 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 -2.04 5.36 0.34 0.52 -4.23 -1.26 -4.10 115.64 110.23 2d93 s THR 92 Ca 0.23 0.38 0.27 0.00 -1.18 0.00 0.00 61.69 61.39 2d93 s THR 92 Cb 0.11 -3.55 0.41 0.00 1.34 0.00 0.00 72.50 70.81 2d93 s THR 92 CO 0.18 0.44 1.14 0.18 -0.54 0.00 0.00 174.62 176.02 2d93 n LEU 93 N 3.33 0.11 -4.44 4.79 4.77 -1.26 -4.50 117.00 119.80 2d93 n LEU 93 Ca -0.14 0.94 -0.47 0.00 -0.03 0.00 0.00 56.01 56.30 2d93 n LEU 93 Cb 0.52 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2d93 n LEU 93 CO 0.38 -1.00 0.12 0.47 -1.33 0.00 0.00 177.39 176.02 2d93 n ASP 94 N -3.96 -0.68 -4.80 -1.43 8.00 -1.26 -4.96 116.55 107.46 2d93 n ASP 94 Ca 0.30 1.14 -0.22 0.00 0.71 0.00 0.00 54.79 56.72 2d93 n ASP 94 Cb 1.23 -1.03 0.08 0.00 -0.02 0.00 0.00 41.12 41.39 2d93 n ASP 94 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2d93 s LYS 95 N -1.12 1.97 0.03 -1.24 3.01 -1.26 -4.72 119.74 116.41 2d93 s LYS 95 Ca 0.63 -1.15 -0.28 0.00 -1.01 0.00 0.00 55.97 54.16 2d93 s LYS 95 Cb -0.88 -2.43 0.09 0.00 -1.01 0.00 0.00 37.83 33.61 2d93 s LYS 95 CO 0.57 -1.18 0.86 1.14 0.51 0.00 0.00 175.35 177.25 2d93 s GLN 96 N -4.97 0.91 0.06 1.68 0.00 -1.26 -5.02 119.66 111.06 2d93 s GLN 96 Ca 0.64 -0.36 0.06 0.00 -0.00 0.00 0.00 55.36 55.70 2d93 s GLN 96 Cb -0.06 0.40 -0.03 0.00 0.00 0.00 0.00 33.01 33.32 2d93 s GLN 96 CO 0.42 -0.40 -0.18 0.71 0.00 0.00 0.00 175.29 175.84 2d93 s TYR 97 N -3.21 1.52 0.28 9.60 1.51 -1.26 -1.03 117.35 124.76 2d93 s TYR 97 Ca 0.05 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.43 2d93 s TYR 97 Cb -0.01 -0.88 -0.10 0.00 -0.11 0.00 0.00 41.96 40.85 2d93 s TYR 97 CO -0.08 0.09 1.39 1.41 -1.11 0.00 0.00 175.55 177.24 2d93 s MET 98 N -1.38 4.30 -0.27 -0.62 1.75 -0.27 -4.87 119.30 117.94 2d93 s MET 98 Ca 0.04 2.26 0.10 0.00 -1.25 0.00 0.00 55.69 56.84 2d93 s MET 98 Cb -0.09 -3.10 0.49 0.00 2.84 0.00 0.00 34.83 34.97 2d93 s MET 98 CO 0.02 -0.34 1.41 0.72 -0.65 0.00 0.00 175.02 176.18 2d93 n HIS 99 N 1.79 0.84 -2.77 4.11 8.25 -1.26 -0.53 115.22 125.64 2d93 n HIS 99 Ca 0.04 -1.56 0.00 0.00 -0.26 0.00 0.00 57.72 55.94 2d93 n HIS 99 Cb 0.41 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.09 2d93 n HIS 99 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2d93 n GLY 100 N -1.11 1.25 2.96 -1.41 0.00 -1.26 -4.43 105.19 101.19 2d93 n GLY 100 Ca 0.30 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.24 0.96 -0.02 -0.61 1.01 0.79 0.18 121.20 121.27 2d93 s ILE 101 Ca 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 60.65 60.26 2d93 s ILE 101 Cb 0.00 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 2d93 s ILE 101 CO 0.00 0.33 0.22 -0.69 0.00 0.00 0.00 174.94 174.80 2d93 s VAL 102 N 0.99 5.37 -0.23 2.92 1.01 -0.42 -0.56 120.40 129.48 2d93 s VAL 102 Ca -0.09 0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.83 2d93 s VAL 102 Cb -0.15 -3.53 0.07 0.00 0.00 0.00 0.00 36.38 32.77 2d93 s VAL 102 CO -0.00 0.39 0.58 -0.13 0.00 0.00 0.00 175.10 175.94 2d93 s ARG 103 N -1.70 0.59 0.64 2.72 0.52 -0.00 -1.97 118.95 119.75 2d93 s ARG 103 Ca 0.25 1.02 -0.18 0.00 -0.52 0.00 0.00 55.73 56.31 2d93 s ARG 103 Cb -0.13 0.11 -0.01 0.00 0.52 0.00 0.00 34.95 35.44 2d93 s ARG 103 CO 0.15 -0.14 1.22 0.95 0.02 0.00 0.00 175.30 177.49 2d93 s THR 104 N 1.37 2.49 -0.16 0.02 -4.23 -0.84 -0.16 115.64 114.13 2d93 s THR 104 Ca -0.08 0.28 0.18 0.00 -1.18 0.00 0.00 61.69 60.88 2d93 s THR 104 Cb -0.06 -3.03 -0.25 0.00 1.34 0.00 0.00 72.50 70.50 2d93 s THR 104 CO -0.14 -0.08 0.24 0.29 -0.54 0.00 0.00 174.62 174.38 2d93 n LYS 105 N -1.94 0.67 -4.41 3.99 4.76 0.96 -2.50 118.16 119.68 2d93 n LYS 105 Ca 0.14 0.03 -0.21 0.00 -2.87 0.00 0.00 58.31 55.40 2d93 n LYS 105 Cb 0.50 -1.58 -0.09 0.00 -1.84 0.00 0.00 35.03 32.02 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 -2.63 0.64 0.67 -0.18 -7.23 -1.24 -4.69 120.40 105.74 2d93 s VAL 106 Ca -0.09 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.07 2d93 s VAL 106 Cb 0.07 -2.55 0.09 0.00 0.56 0.00 0.00 36.38 34.55 2d93 s VAL 106 CO 0.84 0.00 0.94 1.51 -0.31 0.00 0.00 175.10 178.07 2d93 s ASP 107 N -3.46 4.66 -1.58 4.85 -4.77 -1.26 -4.40 116.67 110.71 2d93 s ASP 107 Ca 0.33 -0.12 -0.04 0.00 -3.30 0.00 0.00 52.55 49.42 2d93 s ASP 107 Cb 0.06 -0.45 0.00 0.00 -1.09 0.00 0.00 42.92 41.44 2d93 s ASP 107 CO 0.16 -1.63 0.53 0.47 0.70 0.00 0.00 175.17 175.40 2d93 n ASP 108 N -2.72 -6.09 -4.72 2.11 8.00 -0.95 -4.93 116.55 107.25 2d93 n ASP 108 Ca 0.12 -0.25 -0.41 0.00 0.71 0.00 0.00 54.79 54.96 2d93 n ASP 108 Cb 0.60 -4.93 -0.04 0.00 -0.02 0.00 0.00 41.12 36.74 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 0.53 2.93 0.27 0.00 -0.21 -0.58 0.78 119.66 123.38 2d93 s GLN 110 Ca 0.45 -0.44 -0.00 0.00 0.02 0.00 0.00 55.36 55.39 2d93 s GLN 110 Cb -0.21 -2.75 -0.02 0.00 1.00 0.00 0.00 33.01 31.03 2d93 s GLN 110 CO 0.26 0.69 0.29 -0.06 -2.12 0.00 0.00 175.29 174.35 2d93 s PHE 111 N -0.88 1.22 -0.06 0.91 0.08 -0.00 -1.50 117.98 117.74 2d93 s PHE 111 Ca 0.13 -1.37 -0.09 0.00 0.12 0.00 0.00 56.93 55.73 2d93 s PHE 111 Cb -0.11 -0.41 0.02 0.00 -0.57 0.00 0.00 43.02 41.94 2d93 s PHE 111 CO 0.02 -0.86 0.22 0.54 -0.10 0.00 0.00 175.22 175.05 2d93 s VAL 112 N -3.70 0.02 -0.11 -0.44 0.11 -1.22 -2.36 120.40 112.71 2d93 s VAL 112 Ca 0.36 -0.17 0.02 0.00 -2.93 0.00 0.00 61.98 59.26 2d93 s VAL 112 Cb 0.03 -0.38 -0.01 0.00 -1.53 0.00 0.00 36.38 34.49 2d93 s VAL 112 CO 0.18 -0.09 -0.17 0.00 -3.33 0.00 0.00 175.10 171.69 2d93 s ILE 114 N 0.18 0.96 0.31 0.00 1.01 -1.06 -0.29 121.20 122.31 2d93 s ILE 114 Ca -0.10 -0.28 -0.29 0.00 0.00 0.00 0.00 60.65 59.98 2d93 s ILE 114 Cb -0.16 -0.97 -0.12 0.00 0.01 0.00 0.00 42.46 41.23 2d93 s ILE 114 CO 0.06 0.35 1.50 0.00 0.00 0.00 0.00 174.94 176.84 2d93 n ALA 115 N 4.67 2.13 0.11 9.38 0.00 -1.26 -1.82 120.51 133.72 2d93 n ALA 115 Ca -0.15 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 2d93 n ALA 115 Cb 0.50 -2.40 -0.08 0.00 0.00 0.00 0.00 19.45 17.47 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 3.91 -0.68 -0.98 0.00 4.15 -1.86 0.43 115.11 120.09 2d93 h GLN 116 Ca -0.48 0.05 0.15 0.00 0.77 0.00 0.00 58.65 59.14 2d93 h GLN 116 Cb 1.24 0.15 -0.16 0.00 0.21 0.00 0.00 27.48 28.93 2d93 h GLN 116 CO 0.72 -0.45 -0.40 1.96 -1.93 0.00 0.00 178.83 178.73 2d93 h GLN 117 N -0.70 -0.01 -0.04 1.69 1.08 -1.91 1.04 115.11 116.26 2d93 h GLN 117 Ca 0.01 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.11 2d93 h GLN 117 Cb 0.72 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2d93 h GLN 117 CO -0.27 -0.01 -0.45 -0.44 -0.95 0.00 0.00 178.83 176.71 2d93 h ASP 118 N -0.01 0.10 0.91 1.46 5.19 -1.82 -0.90 116.42 121.35 2d93 h ASP 118 Ca 0.33 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.68 2d93 h ASP 118 Cb 0.58 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.06 2d93 h ASP 118 CO -0.97 0.54 -0.06 0.22 -3.12 0.00 0.00 179.24 175.85 2d93 h TYR 119 N 0.08 0.00 -0.08 4.55 3.20 0.56 -2.56 116.97 122.71 2d93 h TYR 119 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2d93 h TYR 119 Cb 0.83 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.10 2d93 h TYR 119 CO 0.01 0.06 0.00 1.87 -1.64 0.00 0.00 178.16 178.45 2d93 n TRP 120 N -3.20 0.09 0.67 -3.82 -0.00 0.12 -4.07 117.44 107.24 2d93 n TRP 120 Ca 0.00 -0.09 0.10 0.00 -0.00 0.00 0.00 57.50 57.51 2d93 n TRP 120 Cb 0.32 -0.00 -0.13 0.00 -0.00 0.00 0.00 31.31 31.49 2d93 n TRP 120 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 177.69 175.56 2d93 n ARG 121 N 0.67 0.22 -0.11 5.87 0.63 -0.38 -3.72 116.66 119.83 2d93 n ARG 121 Ca 0.08 -0.06 -0.24 0.00 -0.92 0.00 0.00 57.85 56.71 2d93 n ARG 121 Cb 0.33 -1.51 -0.08 0.00 0.45 0.00 0.00 32.46 31.65 2d93 n ARG 121 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 2d93 n ILE 122 N -1.75 1.28 0.06 5.15 5.41 -1.11 -4.46 119.36 123.94 2d93 n ILE 122 Ca 0.01 -0.30 -0.01 0.00 1.00 0.00 0.00 62.75 63.46 2d93 n ILE 122 Cb 0.41 -1.84 0.27 0.00 -0.71 0.00 0.00 39.64 37.77 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 -0.83 0.36 0.00 1.39 4.07 -1.80 -3.45 115.31 115.05 2d93 h LEU 123 Ca -0.56 -0.11 -0.22 0.00 0.08 0.00 0.00 57.88 57.07 2d93 h LEU 123 Cb 1.48 -0.10 0.07 0.00 1.08 0.00 0.00 40.66 43.20 2d93 h LEU 123 CO -0.34 0.60 0.16 0.59 -1.08 0.00 0.00 178.44 178.37 2d93 n ASN 124 N -4.16 0.25 -2.93 -0.43 3.02 -1.24 -5.01 115.26 104.76 2d93 n ASN 124 Ca -0.00 -1.35 -0.33 0.00 -0.03 0.00 0.00 54.58 52.86 2d93 n ASN 124 Cb 0.37 -0.46 0.01 0.00 -0.61 0.00 0.00 39.78 39.08 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 -2.68 3.32 -3.23 3.10 8.25 -1.26 -4.90 115.22 117.83 2d93 n HIS 125 Ca 0.08 -3.00 -0.39 0.00 -0.26 0.00 0.00 57.72 54.16 2d93 n HIS 125 Cb 0.30 -0.69 -0.06 0.00 1.12 0.00 0.00 29.99 30.66 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 -4.94 4.71 -0.92 1.59 1.01 -1.26 -5.02 120.40 115.56 2d93 s VAL 126 Ca 0.48 1.29 -0.14 0.00 0.00 0.00 0.00 61.98 63.60 2d93 s VAL 126 Cb 0.34 -3.93 0.21 0.00 0.00 0.00 0.00 36.38 32.99 2d93 s VAL 126 CO -0.23 0.54 0.94 -1.61 0.00 0.00 0.00 175.10 174.74 2d93 s GLU 127 N -1.02 3.72 0.18 2.72 0.41 -1.26 -4.99 118.70 118.47 2d93 s GLU 127 Ca 0.30 -2.42 -0.08 0.00 -0.41 0.00 0.00 54.97 52.36 2d93 s GLU 127 Cb -0.20 -4.60 -0.02 0.00 -1.78 0.00 0.00 34.13 27.54 2d93 s GLU 127 CO 0.20 -1.42 0.27 0.15 -0.49 0.00 0.00 175.26 173.97 2d93 s LYS 128 N 0.61 1.20 0.34 1.61 -0.14 -1.26 -5.14 119.74 116.96 2d93 s LYS 128 Ca 0.25 -1.27 -0.29 0.00 -1.36 0.00 0.00 55.97 53.29 2d93 s LYS 128 Cb -0.08 0.36 -0.11 0.00 -1.68 0.00 0.00 37.83 36.32 2d93 s LYS 128 CO -0.08 -0.44 1.53 0.45 -0.76 0.00 0.00 175.35 176.05 2d93 s SER 129 N -3.01 6.36 0.00 2.83 0.15 -1.26 -5.01 113.70 113.76 2d93 s SER 129 Ca 0.22 3.00 0.00 0.00 0.70 0.00 0.00 55.95 59.87 2d93 s SER 129 Cb 0.04 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2d93 s SER 129 CO 0.03 -0.89 0.00 0.61 1.20 0.00 0.00 173.24 174.20 2d93 n GLY 130 N 1.22 -1.39 0.00 9.45 0.00 -1.26 -4.86 105.19 108.35 2d93 n GLY 130 Ca 0.04 -1.46 0.07 0.00 0.00 0.00 0.00 46.02 44.67 2d93 n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d93 n PRO 131 N 0.00 0.18 -2.34 1.61 -0.04 -1.26 -4.76 135.00 128.38 2d93 n PRO 131 Ca 0.00 0.16 -0.41 0.00 -0.04 0.00 0.00 63.50 63.21 2d93 n PRO 131 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2d93 n PRO 131 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2d93 s SER 132 N -2.64 7.03 -0.34 3.54 0.15 -1.26 -4.98 113.70 115.21 2d93 s SER 132 Ca 0.13 2.23 -0.26 0.00 0.70 0.00 0.00 55.95 58.75 2d93 s SER 132 Cb 0.10 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 2d93 s SER 132 CO 0.23 -0.43 0.91 -0.55 1.20 0.00 0.00 173.24 174.60 2d93 s SER 133 N 0.40 6.73 0.00 5.45 0.15 -1.26 -5.05 113.70 120.12 2d93 s SER 133 Ca 0.55 0.71 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2d93 s SER 133 Cb -0.33 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.52 2d93 s SER 133 CO 0.35 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.62