#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d93 s SER 2 N 0.00 6.93 0.09 1.61 0.01 -1.26 -5.02 113.70 116.06 2d93 s SER 2 Ca 0.00 2.01 -0.01 0.00 1.31 0.00 0.00 55.95 59.26 2d93 s SER 2 Cb 0.00 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 2d93 s SER 2 CO 0.00 -0.66 0.26 -0.55 0.41 0.00 0.00 173.24 172.69 2d93 s SER 3 N 1.70 6.39 0.00 2.44 0.15 -1.26 -4.96 113.70 118.16 2d93 s SER 3 Ca 0.61 0.34 0.00 0.00 0.70 0.00 0.00 55.95 57.60 2d93 s SER 3 Cb -0.29 -1.99 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2d93 s SER 3 CO 0.25 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2d93 n GLY 4 N 0.17 1.60 3.38 9.45 0.00 -1.26 -5.14 105.19 113.40 2d93 n GLY 4 Ca -0.04 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 4.16 -0.01 1.61 0.15 -1.26 -5.11 113.70 113.24 2d93 s SER 5 Ca 0.00 -0.31 -0.02 0.00 0.70 0.00 0.00 55.95 56.32 2d93 s SER 5 Cb 0.00 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.61 2d93 s SER 5 CO 0.00 0.13 0.16 -0.55 1.20 0.00 0.00 173.24 174.19 2d93 s SER 6 N 0.54 6.23 0.00 5.45 0.15 -1.26 -5.03 113.70 119.78 2d93 s SER 6 Ca -0.07 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2d93 s SER 6 Cb -0.15 -1.92 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 2d93 s SER 6 CO 0.03 0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.35 2d93 n GLY 7 N 0.97 3.35 0.28 9.45 0.00 -1.26 -4.93 105.19 113.05 2d93 n GLY 7 Ca -0.11 -1.92 -0.21 0.00 0.00 0.00 0.00 46.02 43.78 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 1.74 -3.46 1.61 2.03 -1.26 -4.80 116.55 112.41 2d93 n ASP 8 Ca 0.00 0.17 -0.27 0.00 0.52 0.00 0.00 54.79 55.21 2d93 n ASP 8 Cb 0.00 -0.55 -0.09 0.00 -0.72 0.00 0.00 41.12 39.76 2d93 n ASP 8 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2d93 n ASP 9 N -3.75 3.03 0.20 1.67 5.68 -1.26 -4.95 116.55 117.16 2d93 n ASP 9 Ca -0.41 -3.27 -0.17 0.00 -0.50 0.00 0.00 54.79 50.44 2d93 n ASP 9 Cb 0.82 -0.68 -0.10 0.00 -1.14 0.00 0.00 41.12 40.03 2d93 n ASP 9 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2d93 h ASP 10 N 4.37 -1.45 -0.87 -1.12 5.19 -1.92 -2.52 116.42 118.11 2d93 h ASP 10 Ca 0.18 0.14 0.16 0.00 -0.62 0.00 0.00 57.03 56.89 2d93 h ASP 10 Cb 0.71 0.51 -0.16 0.00 0.18 0.00 0.00 39.33 40.58 2d93 h ASP 10 CO 0.75 -0.60 -0.27 0.40 -3.12 0.00 0.00 179.24 176.40 2d93 h ILE 11 N -0.86 0.10 -0.94 0.35 2.04 -1.99 0.56 117.51 116.76 2d93 h ILE 11 Ca -0.03 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.10 2d93 h ILE 11 Cb 0.80 0.10 -0.14 0.00 -0.74 0.00 0.00 36.82 36.84 2d93 h ILE 11 CO -0.18 0.00 0.42 -0.33 0.00 0.00 0.00 178.15 178.06 2d93 h GLU 12 N -0.02 0.32 0.00 2.37 5.08 -1.87 1.20 114.58 121.66 2d93 h GLU 12 Ca 0.38 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.66 2d93 h GLU 12 Cb 0.62 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2d93 h GLU 12 CO -0.90 0.21 -0.29 1.96 -1.00 0.00 0.00 179.01 178.99 2d93 h GLN 13 N 0.33 0.00 0.04 2.33 4.20 0.23 -3.05 115.11 119.19 2d93 h GLN 13 Ca 0.63 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.25 2d93 h GLN 13 Cb 1.31 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.10 2d93 h GLN 13 CO -0.59 0.29 -0.36 1.25 -0.67 0.00 0.00 178.83 178.75 2d93 h LEU 14 N 0.00 0.24 -0.35 1.46 5.85 0.18 -3.32 115.31 119.37 2d93 h LEU 14 Ca -0.00 -0.90 0.08 0.00 0.84 0.00 0.00 57.88 57.89 2d93 h LEU 14 Cb 0.68 -0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 2d93 h LEU 14 CO 0.04 1.12 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.91 2d93 h LEU 15 N -0.61 -0.92 -0.81 2.25 3.38 -0.78 -0.97 115.31 116.86 2d93 h LEU 15 Ca -0.06 0.17 0.18 0.00 0.09 0.00 0.00 57.88 58.26 2d93 h LEU 15 Cb 1.21 0.44 -0.15 0.00 0.09 0.00 0.00 40.66 42.25 2d93 h LEU 15 CO 0.07 -0.30 -0.11 -0.33 0.09 0.00 0.00 178.44 177.86 2d93 h GLU 16 N -0.23 0.03 0.86 1.13 4.39 -1.67 -1.07 114.58 118.02 2d93 h GLU 16 Ca 0.17 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.82 2d93 h GLU 16 Cb 0.50 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2d93 h GLU 16 CO -0.49 0.02 -0.41 0.35 -1.16 0.00 0.00 179.01 177.32 2d93 h PHE 17 N 0.03 -1.07 -0.92 4.33 3.57 -1.31 -2.96 116.94 118.62 2d93 h PHE 17 Ca 0.42 -0.03 0.23 0.00 3.53 0.00 0.00 57.97 62.12 2d93 h PHE 17 Cb 0.71 0.35 -0.17 0.00 2.79 0.00 0.00 35.95 39.63 2d93 h PHE 17 CO -0.55 -0.66 -0.01 0.52 -2.23 0.00 0.00 178.31 175.37 2d93 h MET 18 N -1.18 0.04 -0.94 1.11 2.86 -0.41 0.59 114.93 117.01 2d93 h MET 18 Ca -0.12 -0.00 0.26 0.00 -2.06 0.00 0.00 59.70 57.78 2d93 h MET 18 Cb 0.89 -0.01 -0.14 0.00 0.06 0.00 0.00 31.60 32.40 2d93 h MET 18 CO 0.19 0.03 0.41 1.25 1.06 0.00 0.00 176.91 179.85 2d93 h HIS 19 N 0.04 0.66 -0.63 -0.22 -0.00 -1.07 0.31 115.15 114.25 2d93 h HIS 19 Ca 0.53 0.04 0.04 0.00 -0.00 0.00 0.00 60.37 60.98 2d93 h HIS 19 Cb 1.01 -0.14 -0.04 0.00 -0.00 0.00 0.00 27.41 28.23 2d93 h HIS 19 CO -0.51 -0.15 0.37 1.96 -0.00 0.00 0.00 177.93 179.61 2d93 h GLN 20 N 0.31 0.70 -6.83 5.26 4.20 0.18 -3.38 115.11 115.55 2d93 h GLN 20 Ca 0.63 -0.04 -0.52 0.00 0.06 0.00 0.00 58.65 58.78 2d93 h GLN 20 Cb 1.32 -0.16 0.04 0.00 0.30 0.00 0.00 27.48 28.98 2d93 h GLN 20 CO -0.60 0.46 0.59 -0.51 -0.67 0.00 0.00 178.83 178.10 2d93 s LEU 21 N -10.22 4.47 0.20 1.46 1.43 0.11 -4.92 118.68 111.21 2d93 s LEU 21 Ca -0.13 2.51 -0.04 0.00 -1.03 0.00 0.00 54.13 55.44 2d93 s LEU 21 Cb 0.15 -3.64 0.14 0.00 0.03 0.00 0.00 46.19 42.87 2d93 s LEU 21 CO 0.76 -0.40 1.55 1.55 0.23 0.00 0.00 176.35 180.04 2d93 h PRO 22 N 3.80 0.65 -0.74 1.29 0.13 -1.81 0.18 132.00 135.51 2d93 h PRO 22 Ca -0.48 -0.35 0.01 0.00 -0.87 0.00 0.00 66.00 64.32 2d93 h PRO 22 Cb 1.22 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 2d93 h PRO 22 CO 0.68 0.95 0.49 0.00 -0.23 0.00 0.00 178.00 179.88 2d93 h ALA 23 N 1.00 1.47 0.14 -0.56 0.00 -1.90 -2.53 119.26 116.89 2d93 h ALA 23 Ca 0.04 -0.05 -0.36 0.00 0.00 0.00 0.00 54.91 54.54 2d93 h ALA 23 Cb 0.95 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2d93 h ALA 23 CO 0.09 0.49 -1.92 0.74 0.00 0.00 0.00 179.25 178.65 2d93 h PHE 24 N 1.00 0.55 -0.73 0.00 0.04 -1.76 -3.37 116.94 112.67 2d93 h PHE 24 Ca 0.27 -0.40 0.16 0.00 2.80 0.00 0.00 57.97 60.80 2d93 h PHE 24 Cb -0.11 -0.02 -0.12 0.00 2.20 0.00 0.00 35.95 37.90 2d93 h PHE 24 CO 0.00 1.74 0.09 0.00 -0.60 0.00 0.00 178.31 179.54 2d93 h ALA 25 N 0.10 0.85 -0.93 2.45 0.00 -0.49 0.14 119.26 121.38 2d93 h ALA 25 Ca -0.40 0.20 0.26 0.00 0.00 0.00 0.00 54.91 54.98 2d93 h ALA 25 Cb 2.06 0.32 -0.16 0.00 0.00 0.00 0.00 17.79 20.01 2d93 h ALA 25 CO 0.12 -0.39 0.15 -0.91 0.00 0.00 0.00 179.25 178.22 2d93 h ASN 26 N 0.17 -0.21 -4.34 0.00 2.35 -1.62 -3.40 115.58 108.53 2d93 h ASN 26 Ca 0.41 0.24 -0.51 0.00 -0.55 0.00 0.00 56.30 55.89 2d93 h ASN 26 Cb 0.71 0.37 0.09 0.00 0.05 0.00 0.00 38.32 39.55 2d93 h ASN 26 CO -0.58 -0.27 0.37 -0.04 -1.65 0.00 0.00 177.43 175.26 2d93 s MET 27 N -5.94 2.84 0.53 0.81 -1.94 0.04 -5.05 119.30 110.58 2d93 s MET 27 Ca -0.12 0.82 -0.07 0.00 -1.71 0.00 0.00 55.69 54.61 2d93 s MET 27 Cb 0.28 -1.99 -0.03 0.00 2.01 0.00 0.00 34.83 35.10 2d93 s MET 27 CO 0.77 -1.13 0.86 -0.08 -0.01 0.00 0.00 175.02 175.44 2d93 s THR 28 N -3.11 4.69 0.23 2.05 -1.32 -1.26 -4.87 115.64 112.05 2d93 s THR 28 Ca 0.58 0.34 -0.16 0.00 -1.21 0.00 0.00 61.69 61.25 2d93 s THR 28 Cb -0.13 -3.81 0.27 0.00 -1.51 0.00 0.00 72.50 67.31 2d93 s THR 28 CO 0.54 -0.87 1.53 0.80 -2.21 0.00 0.00 174.62 174.41 2d93 n MET 29 N -2.43 -0.21 0.00 7.08 1.56 -1.26 -1.69 117.12 120.17 2d93 n MET 29 Ca 0.02 1.52 0.00 0.00 -0.27 0.00 0.00 57.70 58.97 2d93 n MET 29 Cb 0.55 -2.25 0.00 0.00 2.15 0.00 0.00 33.22 33.67 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 -5.47 0.00 -0.31 6.12 7.64 -1.26 -2.07 113.62 118.27 2d93 n SER 30 Ca 0.11 0.99 -0.01 0.00 1.01 0.00 0.00 58.87 60.97 2d93 n SER 30 Cb 0.41 -0.49 0.03 0.00 -1.01 0.00 0.00 64.21 63.14 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 -2.59 -0.44 -0.25 0.44 0.31 -0.68 0.94 118.33 116.06 2d93 n VAL 31 Ca 0.00 1.91 0.02 0.00 -0.01 0.00 0.00 64.34 66.26 2d93 n VAL 31 Cb 0.00 -2.51 0.10 0.00 -0.91 0.00 0.00 33.84 30.52 2d93 n VAL 31 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2d93 h ARG 32 N 0.00 0.02 0.37 5.55 3.08 -0.86 0.15 114.38 122.69 2d93 h ARG 32 Ca 0.27 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.31 2d93 h ARG 32 Cb 0.48 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2d93 h ARG 32 CO -0.80 0.01 -0.18 -0.09 -1.07 0.00 0.00 179.97 177.84 2d93 h ARG 33 N 0.02 -0.49 -0.95 0.04 2.43 0.10 -2.58 114.38 112.96 2d93 h ARG 33 Ca 0.37 0.03 0.20 0.00 -0.81 0.00 0.00 59.98 59.77 2d93 h ARG 33 Cb 0.58 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 30.16 2d93 h ARG 33 CO -0.74 -0.27 0.61 0.93 -1.51 0.00 0.00 179.97 178.99 2d93 h GLU 34 N -0.59 0.50 -0.06 0.20 3.07 -0.22 -0.87 114.58 116.61 2d93 h GLU 34 Ca -0.05 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 2d93 h GLU 34 Cb 0.44 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.23 2d93 h GLU 34 CO 0.08 0.33 0.03 -0.07 -1.40 0.00 0.00 179.01 177.98 2d93 h LEU 35 N 0.51 0.07 -0.63 1.33 3.38 -0.44 -1.64 115.31 117.91 2d93 h LEU 35 Ca 0.51 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2d93 h LEU 35 Cb 1.12 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2d93 h LEU 35 CO -0.24 0.17 0.01 0.00 0.09 0.00 0.00 178.44 178.47 2d93 n SER 37 N -1.83 0.88 -0.43 0.00 2.88 -0.64 -4.26 113.62 110.22 2d93 n SER 37 Ca -0.01 -0.82 0.04 0.00 -1.33 0.00 0.00 58.87 56.75 2d93 n SER 37 Cb 0.02 0.83 0.06 0.00 -0.75 0.00 0.00 64.21 64.37 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 -1.51 0.72 -4.30 2.46 0.24 0.11 -5.07 118.33 110.97 2d93 n VAL 38 Ca 0.04 -0.95 -0.25 0.00 -2.04 0.00 0.00 64.34 61.14 2d93 n VAL 38 Cb 0.33 0.26 -0.09 0.00 -1.47 0.00 0.00 33.84 32.87 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 -1.09 2.11 -0.00 7.34 0.00 0.51 -4.12 119.30 124.05 2d93 s MET 39 Ca 0.14 -1.34 0.00 0.00 0.00 0.00 0.00 55.69 54.49 2d93 s MET 39 Cb 0.13 -2.14 -0.04 0.00 0.00 0.00 0.00 34.83 32.79 2d93 s MET 39 CO -0.00 0.41 0.04 0.42 0.00 0.00 0.00 175.02 175.89 2d93 s ILE 40 N -1.95 4.46 -0.47 3.16 1.01 0.24 -4.89 121.20 122.75 2d93 s ILE 40 Ca 0.27 -0.50 -0.14 0.00 0.00 0.00 0.00 60.65 60.29 2d93 s ILE 40 Cb -0.08 -3.01 0.09 0.00 0.01 0.00 0.00 42.46 39.47 2d93 s ILE 40 CO 0.17 0.36 0.38 -0.36 0.00 0.00 0.00 174.94 175.49 2d93 s PHE 41 N -1.14 3.28 0.15 3.97 0.08 -1.26 -2.44 117.98 120.62 2d93 s PHE 41 Ca 0.21 -1.22 0.07 0.00 0.12 0.00 0.00 56.93 56.11 2d93 s PHE 41 Cb -0.12 -3.27 -0.04 0.00 -0.57 0.00 0.00 43.02 39.02 2d93 s PHE 41 CO 0.12 -0.87 -0.15 -1.21 -0.10 0.00 0.00 175.22 173.01 2d93 s GLU 42 N 1.56 1.16 -0.20 0.44 2.02 -0.95 -5.05 118.70 117.67 2d93 s GLU 42 Ca 0.04 -1.39 -0.08 0.00 0.02 0.00 0.00 54.97 53.56 2d93 s GLU 42 Cb -0.25 -1.02 0.08 0.00 0.10 0.00 0.00 34.13 33.04 2d93 s GLU 42 CO 0.04 0.19 0.44 0.54 0.02 0.00 0.00 175.26 176.49 2d93 s VAL 43 N -2.46 -0.43 0.05 2.63 0.11 -1.26 -0.37 120.40 118.68 2d93 s VAL 43 Ca 0.15 0.13 -0.30 0.00 -2.93 0.00 0.00 61.98 59.02 2d93 s VAL 43 Cb -0.03 -0.68 -0.05 0.00 -1.53 0.00 0.00 36.38 34.09 2d93 s VAL 43 CO 0.04 0.05 1.03 -0.69 -3.33 0.00 0.00 175.10 172.21 2d93 s VAL 44 N 2.18 4.52 -0.19 2.04 1.01 0.30 -4.89 120.40 125.38 2d93 s VAL 44 Ca -0.05 1.90 0.00 0.00 0.00 0.00 0.00 61.98 63.83 2d93 s VAL 44 Cb -0.10 -4.21 -0.21 0.00 0.00 0.00 0.00 36.38 31.85 2d93 s VAL 44 CO -0.13 0.20 0.07 -0.62 0.00 0.00 0.00 175.10 174.61 2d93 n GLU 45 N 3.51 0.69 -3.15 2.72 1.02 -1.26 -1.26 120.64 122.91 2d93 n GLU 45 Ca 0.05 0.19 -0.43 0.00 -0.02 0.00 0.00 57.16 56.96 2d93 n GLU 45 Cb 0.49 -1.61 -0.07 0.00 -0.02 0.00 0.00 31.44 30.23 2d93 n GLU 45 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2d93 s GLN 46 N -2.54 3.36 0.92 3.49 -0.21 -1.26 -3.77 119.66 119.65 2d93 s GLN 46 Ca -0.27 -0.33 -0.13 0.00 0.02 0.00 0.00 55.36 54.66 2d93 s GLN 46 Cb 0.08 -3.91 0.21 0.00 1.00 0.00 0.00 33.01 30.38 2d93 s GLN 46 CO 0.69 -0.91 0.47 0.00 -2.12 0.00 0.00 175.29 173.42 2d93 n ALA 47 N 6.10 -2.83 -3.62 6.09 0.00 -1.26 -3.41 120.51 121.57 2d93 n ALA 47 Ca -0.03 -0.82 -0.25 0.00 0.00 0.00 0.00 53.44 52.34 2d93 n ALA 47 Cb 0.48 -0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.82 2d93 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d93 n GLY 48 N -2.35 -0.46 3.82 0.00 0.00 -1.24 -4.89 105.19 100.07 2d93 n GLY 48 Ca 0.07 0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.82 3.67 -0.40 4.61 0.00 -1.22 -4.74 121.76 120.86 2d93 s ALA 49 Ca 0.48 -0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.94 2d93 s ALA 49 Cb -0.27 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.43 2d93 s ALA 49 CO 0.59 0.42 1.43 0.42 0.00 0.00 0.00 175.76 178.61 2d93 s ILE 50 N -0.85 3.89 0.03 0.00 1.09 -1.26 -1.76 121.20 122.33 2d93 s ILE 50 Ca 0.24 0.92 -0.18 0.00 -1.10 0.00 0.00 60.65 60.53 2d93 s ILE 50 Cb -0.17 -4.16 -0.26 0.00 -1.06 0.00 0.00 42.46 36.82 2d93 s ILE 50 CO 0.13 -0.71 1.10 0.40 -0.10 0.00 0.00 174.94 175.76 2d93 h ILE 51 N 6.44 1.37 -3.83 2.92 1.08 -1.25 -3.47 117.51 120.77 2d93 h ILE 51 Ca -0.28 -2.26 -0.12 0.00 -0.39 0.00 0.00 64.86 61.81 2d93 h ILE 51 Cb 1.11 2.64 -0.17 0.00 -3.07 0.00 0.00 36.82 37.33 2d93 h ILE 51 CO 1.08 0.67 -0.51 -0.76 -0.69 0.00 0.00 178.15 177.94 2d93 s LEU 52 N -8.13 1.79 0.11 1.44 1.43 -1.24 -4.98 118.68 109.10 2d93 s LEU 52 Ca -0.12 -0.58 0.06 0.00 -1.03 0.00 0.00 54.13 52.47 2d93 s LEU 52 Cb 0.04 0.64 -0.04 0.00 0.03 0.00 0.00 46.19 46.86 2d93 s LEU 52 CO 0.87 -0.55 -0.06 -1.61 0.23 0.00 0.00 176.35 175.24 2d93 s GLU 53 N -2.87 2.28 0.31 1.70 2.02 -1.26 -1.94 118.70 118.94 2d93 s GLU 53 Ca -0.03 -0.98 -0.29 0.00 0.02 0.00 0.00 54.97 53.69 2d93 s GLU 53 Cb 0.00 -2.38 -0.10 0.00 0.10 0.00 0.00 34.13 31.76 2d93 s GLU 53 CO -0.06 0.51 1.32 0.16 0.02 0.00 0.00 175.26 177.22 2d93 s ASP 54 N -2.33 6.77 -0.61 -0.19 1.47 0.71 -3.22 116.67 119.27 2d93 s ASP 54 Ca 0.23 2.65 -0.04 0.00 1.18 0.00 0.00 52.55 56.58 2d93 s ASP 54 Cb -0.11 -2.64 0.00 0.00 -0.34 0.00 0.00 42.92 39.83 2d93 s ASP 54 CO 0.16 -0.55 0.53 0.61 0.68 0.00 0.00 175.17 176.60 2d93 n GLY 55 N 1.14 0.28 3.13 2.12 0.00 0.71 -4.89 105.19 107.69 2d93 n GLY 55 Ca 0.01 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 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 -5.58 2.61 -0.83 1.61 0.74 -1.20 -4.89 119.66 112.12 2d93 s GLN 56 Ca 0.26 -1.11 -0.22 0.00 0.05 0.00 0.00 55.36 54.34 2d93 s GLN 56 Cb -0.12 -2.89 -0.20 0.00 1.10 0.00 0.00 33.01 30.91 2d93 s GLN 56 CO 0.33 -0.45 2.39 -1.91 -0.55 0.00 0.00 175.29 175.10 2d93 n GLU 57 N 4.57 0.39 -2.17 1.67 2.13 -1.26 -3.21 120.64 122.75 2d93 n GLU 57 Ca -0.16 -0.27 -0.42 0.00 0.66 0.00 0.00 57.16 56.97 2d93 n GLU 57 Cb 0.45 -2.44 -0.03 0.00 0.27 0.00 0.00 31.44 29.70 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 8.87 4.35 0.00 4.31 1.43 0.22 -4.87 118.68 133.00 2d93 s LEU 58 Ca 1.14 2.26 0.00 0.00 -1.03 0.00 0.00 54.13 56.50 2d93 s LEU 58 Cb -0.57 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.08 2d93 s LEU 58 CO 0.34 -0.69 0.00 -0.67 0.23 0.00 0.00 176.35 175.56 2d93 n ASP 59 N 4.57 3.63 -4.82 2.29 2.03 -1.26 -3.82 116.55 119.16 2d93 n ASP 59 Ca 0.12 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 55.16 2d93 n ASP 59 Cb 0.43 0.41 -0.05 0.00 -0.72 0.00 0.00 41.12 41.18 2d93 n ASP 59 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2d93 s SER 60 N -2.33 5.70 0.02 1.67 0.01 -1.26 -2.31 113.70 115.20 2d93 s SER 60 Ca 0.00 -0.03 -0.06 0.00 1.31 0.00 0.00 55.95 57.17 2d93 s SER 60 Cb 0.00 -1.56 -0.05 0.00 0.21 0.00 0.00 66.02 64.63 2d93 s SER 60 CO 0.00 0.09 0.28 0.86 0.41 0.00 0.00 173.24 174.88 2d93 s TRP 61 N -1.66 3.57 -0.07 2.43 -0.00 0.61 -3.71 118.94 120.11 2d93 s TRP 61 Ca 0.31 0.56 0.02 0.00 -0.00 0.00 0.00 56.10 57.00 2d93 s TRP 61 Cb -0.11 -1.98 0.01 0.00 -0.00 0.00 0.00 33.47 31.39 2d93 s TRP 61 CO 0.24 0.59 -0.12 0.71 -0.00 0.00 0.00 176.95 178.38 2d93 s TYR 62 N -1.34 1.51 -0.06 5.86 1.51 -0.28 -2.03 117.35 122.53 2d93 s TYR 62 Ca 0.29 -0.60 0.05 0.00 -1.01 0.00 0.00 57.07 55.81 2d93 s TYR 62 Cb -0.13 -1.12 -0.01 0.00 -0.11 0.00 0.00 41.96 40.59 2d93 s TYR 62 CO 0.17 -0.32 -0.21 0.08 -1.11 0.00 0.00 175.55 174.16 2d93 s VAL 63 N 0.80 1.75 -0.51 0.71 1.01 -1.20 -0.75 120.40 122.20 2d93 s VAL 63 Ca -0.12 -0.89 -0.28 0.00 0.00 0.00 0.00 61.98 60.70 2d93 s VAL 63 Cb -0.15 -1.50 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 2d93 s VAL 63 CO 0.02 0.49 1.63 -0.63 0.00 0.00 0.00 175.10 176.62 2d93 s ILE 64 N 0.01 3.60 -0.05 2.22 1.01 -1.14 -3.35 121.20 123.50 2d93 s ILE 64 Ca -0.06 0.50 -0.15 0.00 0.00 0.00 0.00 60.65 60.94 2d93 s ILE 64 Cb -0.13 -4.10 -0.31 0.00 0.01 0.00 0.00 42.46 37.93 2d93 s ILE 64 CO 0.04 -0.90 0.73 -0.07 0.00 0.00 0.00 174.94 174.74 2d93 h LEU 65 N 14.15 0.57 -7.14 2.97 3.38 -1.79 -3.22 115.31 124.23 2d93 h LEU 65 Ca -0.28 -0.91 -0.07 0.00 0.09 0.00 0.00 57.88 56.70 2d93 h LEU 65 Cb 1.13 -0.19 -0.23 0.00 0.09 0.00 0.00 40.66 41.47 2d93 h LEU 65 CO 1.15 1.66 -0.05 0.21 0.09 0.00 0.00 178.44 181.50 2d93 s ASN 66 N -7.22 -0.62 0.00 -0.43 2.47 -1.13 -4.87 114.94 103.13 2d93 s ASN 66 Ca -0.15 1.17 0.00 0.00 0.42 0.00 0.00 52.86 54.29 2d93 s ASN 66 Cb 0.04 1.17 0.00 0.00 -1.45 0.00 0.00 41.25 41.01 2d93 s ASN 66 CO 0.84 -0.20 0.00 0.61 -3.72 0.00 0.00 177.10 174.63 2d93 n GLY 67 N 2.94 -3.31 3.26 1.21 0.00 -1.26 -1.69 105.19 106.33 2d93 n GLY 67 Ca -0.14 -2.12 -0.30 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.73 1.88 -0.05 2.61 2.01 -1.26 -3.90 115.64 116.20 2d93 s THR 68 Ca 0.00 -1.00 0.05 0.00 0.31 0.00 0.00 61.69 61.05 2d93 s THR 68 Cb 0.00 -1.57 -0.01 0.00 0.01 0.00 0.00 72.50 70.93 2d93 s THR 68 CO 0.00 0.53 -0.21 0.68 -0.69 0.00 0.00 174.62 174.93 2d93 s VAL 69 N -0.41 1.76 -0.04 3.82 -7.23 -1.21 0.67 120.40 117.76 2d93 s VAL 69 Ca 0.05 -0.91 0.02 0.00 -1.81 0.00 0.00 61.98 59.34 2d93 s VAL 69 Cb -0.10 -1.50 -0.03 0.00 0.56 0.00 0.00 36.38 35.31 2d93 s VAL 69 CO 0.00 0.50 -0.09 -0.70 -0.31 0.00 0.00 175.10 174.50 2d93 s GLU 70 N -0.11 2.60 -0.08 4.82 2.12 0.12 -2.02 118.70 126.14 2d93 s GLU 70 Ca -0.03 -0.65 0.02 0.00 0.36 0.00 0.00 54.97 54.68 2d93 s GLU 70 Cb -0.12 -2.50 -0.02 0.00 0.26 0.00 0.00 34.13 31.75 2d93 s GLU 70 CO 0.03 0.63 -0.15 0.42 -0.54 0.00 0.00 175.26 175.65 2d93 s ILE 71 N -0.85 2.95 -0.09 -3.70 1.01 -0.94 -0.30 121.20 119.28 2d93 s ILE 71 Ca 0.14 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.09 2d93 s ILE 71 Cb -0.11 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 2d93 s ILE 71 CO 0.03 0.56 -0.22 -0.55 0.00 0.00 0.00 174.94 174.77 2d93 s SER 72 N -0.25 3.31 0.03 3.58 0.15 0.15 -0.26 113.70 120.41 2d93 s SER 72 Ca 0.01 -0.49 -0.00 0.00 0.70 0.00 0.00 55.95 56.17 2d93 s SER 72 Cb -0.13 -1.30 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 2d93 s SER 72 CO 0.03 0.19 0.16 -1.00 1.20 0.00 0.00 173.24 173.81 2d93 s HIS 73 N 0.18 3.43 -0.29 3.44 3.76 0.29 -0.96 115.29 125.14 2d93 s HIS 73 Ca -0.13 0.25 0.27 0.00 -0.15 0.00 0.00 55.06 55.30 2d93 s HIS 73 Cb -0.16 -1.75 1.11 0.00 1.11 0.00 0.00 32.58 32.89 2d93 s HIS 73 CO 0.07 0.59 1.80 -1.00 -0.85 0.00 0.00 174.74 175.35 2d93 h PRO 74 N 3.50 0.00 -0.01 8.40 0.13 -1.87 -3.08 132.00 139.07 2d93 h PRO 74 Ca -0.47 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 2d93 h PRO 74 Cb 1.17 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 -0.42 0.22 -0.23 0.00 0.00 178.00 178.27 2d93 h ASP 75 N 0.00 0.39 0.00 1.44 3.58 -1.94 -3.47 116.42 116.41 2d93 h ASP 75 Ca 0.00 -0.75 0.00 0.00 0.42 0.00 0.00 57.03 56.70 2d93 h ASP 75 Cb 0.40 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2d93 h ASP 75 CO 0.00 1.08 0.00 0.61 -2.88 0.00 0.00 179.24 178.05 2d93 n GLY 76 N 1.01 0.00 3.35 -0.78 0.00 -1.16 -5.17 105.19 102.44 2d93 n GLY 76 Ca -0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 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 1.36 -0.14 1.61 2.20 -1.25 -5.00 119.74 118.51 2d93 s LYS 77 Ca 0.00 -1.65 -0.05 0.00 -0.36 0.00 0.00 55.97 53.91 2d93 s LYS 77 Cb 0.00 -0.91 0.07 0.00 -1.51 0.00 0.00 37.83 35.48 2d93 s LYS 77 CO 0.00 0.04 0.29 0.08 -0.36 0.00 0.00 175.35 175.41 2d93 s VAL 78 N -3.16 -0.46 0.55 4.02 1.01 -1.26 -0.55 120.40 120.55 2d93 s VAL 78 Ca 0.25 0.26 -0.00 0.00 0.00 0.00 0.00 61.98 62.49 2d93 s VAL 78 Cb 0.03 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.95 2d93 s VAL 78 CO 0.08 0.11 0.79 -1.61 0.00 0.00 0.00 175.10 174.46 2d93 s GLU 79 N 2.46 2.62 -0.22 2.72 0.41 0.64 -4.92 118.70 122.40 2d93 s GLU 79 Ca 0.01 -0.62 -0.04 0.00 -0.41 0.00 0.00 54.97 53.91 2d93 s GLU 79 Cb -0.12 -2.45 0.10 0.00 -1.78 0.00 0.00 34.13 29.87 2d93 s GLU 79 CO -0.09 -0.69 0.21 -0.80 -0.49 0.00 0.00 175.26 173.40 2d93 s ASN 80 N -4.39 1.80 0.17 -0.19 0.01 -1.26 -2.21 114.94 108.87 2d93 s ASN 80 Ca 0.56 -0.49 0.03 0.00 -0.71 0.00 0.00 52.86 52.25 2d93 s ASN 80 Cb -0.10 0.24 -0.03 0.00 0.41 0.00 0.00 41.25 41.76 2d93 s ASN 80 CO 0.39 -0.35 0.29 -0.76 -1.51 0.00 0.00 177.10 175.16 2d93 s LEU 81 N 2.28 4.32 0.43 0.60 1.43 -0.86 -5.05 118.68 121.83 2d93 s LEU 81 Ca 0.07 0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.34 2d93 s LEU 81 Cb -0.15 -2.88 -0.02 0.00 0.03 0.00 0.00 46.19 43.16 2d93 s LEU 81 CO -0.18 0.03 0.10 -0.36 0.23 0.00 0.00 176.35 176.17 2d93 s PHE 82 N -1.79 1.83 -0.17 0.29 0.08 -1.26 -3.31 117.98 113.65 2d93 s PHE 82 Ca 0.34 -1.19 -0.35 0.00 0.12 0.00 0.00 56.93 55.86 2d93 s PHE 82 Cb -0.11 -1.27 -0.12 0.00 -0.57 0.00 0.00 43.02 40.95 2d93 s PHE 82 CO 0.28 -0.15 1.92 -0.12 -0.10 0.00 0.00 175.22 177.05 2d93 n MET 83 N -0.98 1.83 0.00 0.44 0.00 -1.25 -1.80 117.12 115.36 2d93 n MET 83 Ca -0.09 0.65 0.00 0.00 -0.00 0.00 0.00 57.70 58.26 2d93 n MET 83 Cb 0.65 -2.56 0.00 0.00 0.00 0.00 0.00 33.22 31.32 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 4.76 1.06 3.65 -5.12 0.00 -1.22 -5.01 105.19 103.31 2d93 n GLY 84 Ca 0.26 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.67 2.23 -0.02 1.61 -0.87 -0.74 -3.77 114.94 112.71 2d93 s ASN 85 Ca 0.00 1.16 -0.03 0.00 -1.57 0.00 0.00 52.86 52.43 2d93 s ASN 85 Cb 0.00 -1.83 0.00 0.00 -0.02 0.00 0.00 41.25 39.41 2d93 s ASN 85 CO 0.00 -3.37 0.07 -0.94 -2.57 0.00 0.00 177.10 170.29 2d93 s SER 86 N -3.37 -0.02 -0.01 -1.22 1.04 -1.26 -2.88 113.70 105.96 2d93 s SER 86 Ca 0.66 0.02 -0.08 0.00 0.48 0.00 0.00 55.95 57.04 2d93 s SER 86 Cb -0.19 0.15 0.01 0.00 0.10 0.00 0.00 66.02 66.09 2d93 s SER 86 CO 0.58 -0.10 0.16 0.72 0.98 0.00 0.00 173.24 175.58 2d93 s PHE 87 N -0.32 -0.03 0.00 5.02 -0.12 0.07 -5.03 117.98 117.56 2d93 s PHE 87 Ca -0.04 0.04 0.00 0.00 -0.05 0.00 0.00 56.93 56.88 2d93 s PHE 87 Cb -0.03 -0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.35 2d93 s PHE 87 CO 0.00 -0.26 0.00 0.41 -0.05 0.00 0.00 175.22 175.33 2d93 n GLY 88 N 1.77 0.75 3.44 1.99 0.00 -1.26 -1.13 105.19 110.74 2d93 n GLY 88 Ca -0.20 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.20 2d93 n GLY 88 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2d93 s ILE 89 N 0.00 2.29 0.49 -0.61 -4.36 -1.24 -4.92 121.20 112.84 2d93 s ILE 89 Ca 0.00 -2.35 -0.07 0.00 -0.26 0.00 0.00 60.65 57.97 2d93 s ILE 89 Cb 0.00 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.44 2d93 s ILE 89 CO 0.00 -0.44 0.82 0.42 0.24 0.00 0.00 174.94 175.98 2d93 s THR 90 N -2.59 4.85 -2.00 8.37 -4.23 -1.26 -4.82 115.64 113.96 2d93 s THR 90 Ca 0.28 0.40 0.11 0.00 -1.18 0.00 0.00 61.69 61.30 2d93 s THR 90 Cb -0.04 -3.84 0.32 0.00 1.34 0.00 0.00 72.50 70.28 2d93 s THR 90 CO 0.13 -0.83 1.11 -0.81 -0.54 0.00 0.00 174.62 173.68 2d93 n PRO 91 N -2.13 0.49 -3.70 3.99 -0.04 -1.26 -4.68 135.00 127.66 2d93 n PRO 91 Ca 0.02 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.12 2d93 n PRO 91 Cb 0.55 -1.36 -0.08 0.00 -0.04 0.00 0.00 33.50 32.57 2d93 n PRO 91 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2d93 s THR 92 N -2.00 5.39 0.33 0.52 -4.23 -1.26 -4.16 115.64 110.23 2d93 s THR 92 Ca 0.17 0.27 0.24 0.00 -1.18 0.00 0.00 61.69 61.19 2d93 s THR 92 Cb 0.08 -3.50 0.37 0.00 1.34 0.00 0.00 72.50 70.79 2d93 s THR 92 CO 0.13 0.45 1.18 0.18 -0.54 0.00 0.00 174.62 176.02 2d93 n LEU 93 N 3.36 0.17 -4.46 4.79 4.77 -1.26 -4.49 117.00 119.87 2d93 n LEU 93 Ca -0.16 1.06 -0.46 0.00 -0.03 0.00 0.00 56.01 56.43 2d93 n LEU 93 Cb 0.52 -0.52 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 2d93 n LEU 93 CO 0.37 -1.16 0.17 0.47 -1.33 0.00 0.00 177.39 175.91 2d93 n ASP 94 N -4.24 -0.45 -4.87 -1.43 8.00 -1.26 -4.94 116.55 107.36 2d93 n ASP 94 Ca 0.30 1.10 -0.29 0.00 0.71 0.00 0.00 54.79 56.61 2d93 n ASP 94 Cb 1.16 -1.08 0.10 0.00 -0.02 0.00 0.00 41.12 41.28 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 -1.26 1.88 -0.09 -1.24 3.01 -1.26 -4.74 119.74 116.04 2d93 s LYS 95 Ca 0.62 0.21 -0.05 0.00 -1.01 0.00 0.00 55.97 55.74 2d93 s LYS 95 Cb -0.80 -1.93 0.04 0.00 -1.01 0.00 0.00 37.83 34.13 2d93 s LYS 95 CO 0.58 -1.68 0.22 -0.65 0.51 0.00 0.00 175.35 174.33 2d93 s GLN 96 N -5.47 0.19 -0.07 1.68 1.11 -1.25 -4.95 119.66 110.90 2d93 s GLN 96 Ca 0.62 0.44 0.01 0.00 0.01 0.00 0.00 55.36 56.44 2d93 s GLN 96 Cb -0.12 -0.08 -0.03 0.00 -1.01 0.00 0.00 33.01 31.77 2d93 s GLN 96 CO 0.50 -0.13 -0.07 0.71 0.01 0.00 0.00 175.29 176.31 2d93 s TYR 97 N 0.97 2.92 0.31 0.91 2.02 -1.26 -0.61 117.35 122.61 2d93 s TYR 97 Ca -0.07 0.01 -0.28 0.00 -0.37 0.00 0.00 57.07 56.36 2d93 s TYR 97 Cb -0.09 -1.70 -0.09 0.00 -0.40 0.00 0.00 41.96 39.68 2d93 s TYR 97 CO -0.06 0.32 1.01 1.41 -1.57 0.00 0.00 175.55 176.66 2d93 s MET 98 N -0.80 4.58 -0.20 -0.62 1.75 -1.20 -4.93 119.30 117.88 2d93 s MET 98 Ca 0.12 1.54 0.13 0.00 -1.25 0.00 0.00 55.69 56.23 2d93 s MET 98 Cb -0.11 -2.97 0.43 0.00 2.84 0.00 0.00 34.83 35.02 2d93 s MET 98 CO 0.01 0.23 1.21 0.72 -0.65 0.00 0.00 175.02 176.54 2d93 n HIS 99 N 0.83 0.44 -3.75 4.11 8.25 -1.26 -0.21 115.22 123.63 2d93 n HIS 99 Ca 0.01 -1.49 0.00 0.00 -0.26 0.00 0.00 57.72 55.97 2d93 n HIS 99 Cb 0.48 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.34 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 -0.83 0.68 3.12 -1.41 0.00 -1.26 -4.45 105.19 101.04 2d93 n GLY 100 Ca 0.21 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.16 1.65 -0.11 -0.61 1.01 -0.13 -0.21 121.20 120.63 2d93 s ILE 101 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 60.65 59.80 2d93 s ILE 101 Cb 0.00 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 2d93 s ILE 101 CO 0.00 0.47 0.17 -0.69 0.00 0.00 0.00 174.94 174.89 2d93 s VAL 102 N 0.62 5.45 -0.09 2.92 1.01 -0.82 -0.68 120.40 128.81 2d93 s VAL 102 Ca -0.14 0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.07 2d93 s VAL 102 Cb -0.16 -3.44 0.03 0.00 0.00 0.00 0.00 36.38 32.81 2d93 s VAL 102 CO 0.04 0.60 0.22 -0.13 0.00 0.00 0.00 175.10 175.83 2d93 s ARG 103 N -0.93 0.21 1.07 2.72 0.52 0.59 -0.64 118.95 122.49 2d93 s ARG 103 Ca 0.16 0.41 -0.12 0.00 -0.52 0.00 0.00 55.73 55.65 2d93 s ARG 103 Cb -0.12 -0.03 0.21 0.00 0.52 0.00 0.00 34.95 35.53 2d93 s ARG 103 CO 0.05 -0.11 0.97 0.25 0.02 0.00 0.00 175.30 176.48 2d93 n THR 104 N 3.69 0.00 -0.04 0.02 -2.24 -0.72 0.12 114.28 115.11 2d93 n THR 104 Ca -0.20 -0.26 -0.03 0.00 -2.27 0.00 0.00 64.05 61.29 2d93 n THR 104 Cb 0.55 -0.95 -0.09 0.00 -2.10 0.00 0.00 70.33 67.73 2d93 n THR 104 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2d93 n LYS 105 N -4.35 1.62 -3.89 -0.78 4.76 0.21 -3.70 118.16 112.03 2d93 n LYS 105 Ca 0.06 -0.04 -0.16 0.00 -2.87 0.00 0.00 58.31 55.31 2d93 n LYS 105 Cb 0.54 -1.30 -0.06 0.00 -1.84 0.00 0.00 35.03 32.36 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 -2.31 0.00 -3.20 -0.18 0.24 -1.25 -4.74 118.33 106.90 2d93 n VAL 106 Ca -0.15 -2.03 -0.23 0.00 -2.04 0.00 0.00 64.34 59.90 2d93 n VAL 106 Cb 0.74 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 34.15 2d93 n VAL 106 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2d93 s ASP 107 N -2.99 6.04 -0.86 -1.34 1.11 -1.26 -4.22 116.67 113.14 2d93 s ASP 107 Ca 0.33 0.31 -0.02 0.00 0.18 0.00 0.00 52.55 53.35 2d93 s ASP 107 Cb 0.01 -1.71 0.00 0.00 1.07 0.00 0.00 42.92 42.29 2d93 s ASP 107 CO 0.24 -0.50 0.73 -0.67 1.18 0.00 0.00 175.17 176.14 2d93 n ASP 108 N -1.91 -3.03 -4.71 0.27 2.03 -1.01 -4.97 116.55 103.22 2d93 n ASP 108 Ca -0.01 -0.41 -0.37 0.00 0.52 0.00 0.00 54.79 54.51 2d93 n ASP 108 Cb 0.57 -3.67 -0.07 0.00 -0.72 0.00 0.00 41.12 37.23 2d93 n ASP 108 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2d93 s GLN 110 N 0.79 3.57 0.26 0.00 -0.21 -0.68 0.11 119.66 123.49 2d93 s GLN 110 Ca 0.21 -0.08 -0.06 0.00 0.02 0.00 0.00 55.36 55.46 2d93 s GLN 110 Cb -0.14 -3.10 -0.02 0.00 1.00 0.00 0.00 33.01 30.75 2d93 s GLN 110 CO 0.07 0.67 0.35 -0.06 -2.12 0.00 0.00 175.29 174.20 2d93 s PHE 111 N -1.25 0.86 -0.02 0.91 0.08 0.51 -2.22 117.98 116.83 2d93 s PHE 111 Ca 0.26 -1.12 -0.02 0.00 0.12 0.00 0.00 56.93 56.16 2d93 s PHE 111 Cb -0.13 -0.17 0.01 0.00 -0.57 0.00 0.00 43.02 42.16 2d93 s PHE 111 CO 0.14 -0.90 0.07 0.54 -0.10 0.00 0.00 175.22 174.97 2d93 s VAL 112 N -3.83 0.00 -0.12 -0.44 0.11 -1.21 -2.25 120.40 112.66 2d93 s VAL 112 Ca 0.31 -0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.33 2d93 s VAL 112 Cb 0.02 -0.11 -0.01 0.00 -1.53 0.00 0.00 36.38 34.74 2d93 s VAL 112 CO 0.13 -0.02 -0.15 0.00 -3.33 0.00 0.00 175.10 171.73 2d93 s ILE 114 N 0.27 0.61 0.65 0.00 1.01 -0.86 0.81 121.20 123.68 2d93 s ILE 114 Ca -0.11 -0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.23 2d93 s ILE 114 Cb -0.16 -0.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.66 2d93 s ILE 114 CO 0.06 0.25 1.27 0.00 0.00 0.00 0.00 174.94 176.52 2d93 s ALA 115 N 1.09 2.35 0.04 9.38 0.00 -1.26 -0.28 121.76 133.08 2d93 s ALA 115 Ca -0.08 1.13 -0.24 0.00 0.00 0.00 0.00 51.96 52.77 2d93 s ALA 115 Cb -0.14 -3.52 -0.13 0.00 0.00 0.00 0.00 23.12 19.32 2d93 s ALA 115 CO -0.01 -1.58 1.32 0.37 0.00 0.00 0.00 175.76 175.85 2d93 h GLN 116 N 0.45 -0.84 -0.88 0.00 4.15 -1.84 -0.80 115.11 115.36 2d93 h GLN 116 Ca -0.50 0.06 0.12 0.00 0.77 0.00 0.00 58.65 59.10 2d93 h GLN 116 Cb 1.32 0.19 -0.13 0.00 0.21 0.00 0.00 27.48 29.07 2d93 h GLN 116 CO 0.53 -0.56 -0.38 1.04 -1.93 0.00 0.00 178.83 177.52 2d93 n GLN 117 N -4.44 -0.25 -0.08 1.69 3.00 -1.26 0.19 117.38 116.24 2d93 n GLN 117 Ca -0.11 1.34 0.01 0.00 -0.01 0.00 0.00 57.00 58.23 2d93 n GLN 117 Cb 0.34 -1.99 0.30 0.00 0.00 0.00 0.00 30.24 28.90 2d93 n GLN 117 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 2d93 h ASP 118 N 0.00 0.63 -0.39 1.08 3.32 -1.94 0.88 116.42 120.00 2d93 h ASP 118 Ca 0.27 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2d93 h ASP 118 Cb 0.49 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2d93 h ASP 118 CO -0.86 0.55 -0.01 0.22 -1.72 0.00 0.00 179.24 177.42 2d93 h TYR 119 N 0.70 0.83 -0.18 4.55 3.20 0.37 -1.62 116.97 124.82 2d93 h TYR 119 Ca 0.17 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2d93 h TYR 119 Cb 0.10 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.14 2d93 h TYR 119 CO 0.01 0.78 0.00 1.87 -1.64 0.00 0.00 178.16 179.17 2d93 n TRP 120 N -4.21 0.22 -0.07 -3.82 -0.00 0.67 -3.49 117.44 106.75 2d93 n TRP 120 Ca 0.02 -0.11 -0.03 0.00 -0.00 0.00 0.00 57.50 57.38 2d93 n TRP 120 Cb 0.31 0.00 -0.15 0.00 -0.00 0.00 0.00 31.31 31.46 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 0.77 0.84 -0.07 5.87 3.00 0.25 -4.06 116.66 123.25 2d93 n ARG 121 Ca 0.17 -0.06 -0.05 0.00 -0.00 0.00 0.00 57.85 57.91 2d93 n ARG 121 Cb 0.45 -1.48 -0.02 0.00 0.00 0.00 0.00 32.46 31.41 2d93 n ARG 121 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 2d93 h ILE 122 N 0.00 0.07 0.36 5.15 2.04 -1.44 -3.41 117.51 120.27 2d93 h ILE 122 Ca -0.35 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2d93 h ILE 122 Cb 1.78 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 2d93 h ILE 122 CO 0.02 0.02 -0.28 -0.07 0.00 0.00 0.00 178.15 177.84 2d93 h LEU 123 N -1.00 -0.73 0.00 1.44 4.07 -1.81 -3.44 115.31 113.84 2d93 h LEU 123 Ca -0.02 0.05 -0.21 0.00 0.08 0.00 0.00 57.88 57.78 2d93 h LEU 123 Cb 0.52 0.23 0.13 0.00 1.08 0.00 0.00 40.66 42.61 2d93 h LEU 123 CO -0.01 -0.40 -0.10 0.59 -1.08 0.00 0.00 178.44 177.44 2d93 n ASN 124 N -4.05 -3.20 -2.61 -0.43 3.02 -1.26 -4.92 115.26 101.81 2d93 n ASN 124 Ca -0.07 -0.51 -0.32 0.00 -0.03 0.00 0.00 54.58 53.65 2d93 n ASN 124 Cb 0.27 -0.73 0.02 0.00 -0.61 0.00 0.00 39.78 38.72 2d93 n ASN 124 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2d93 n HIS 125 N -4.62 3.23 -1.45 3.10 8.25 -1.26 -4.88 115.22 117.59 2d93 n HIS 125 Ca 0.08 -2.80 -0.52 0.00 -0.26 0.00 0.00 57.72 54.22 2d93 n HIS 125 Cb 0.35 -0.51 -0.05 0.00 1.12 0.00 0.00 29.99 30.90 2d93 n HIS 125 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2d93 n VAL 126 N -0.52 1.21 -0.31 1.59 0.31 -1.26 -4.68 118.33 114.67 2d93 n VAL 126 Ca 0.45 -0.30 0.28 0.00 -0.01 0.00 0.00 64.34 64.75 2d93 n VAL 126 Cb 0.52 -0.05 0.48 0.00 -0.91 0.00 0.00 33.84 33.89 2d93 n VAL 126 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 2d93 n GLU 127 N 1.21 -0.03 -3.85 5.55 0.00 -1.26 -2.51 120.64 119.74 2d93 n GLU 127 Ca 0.19 0.98 -0.30 0.00 0.00 0.00 0.00 57.16 58.02 2d93 n GLU 127 Cb 0.19 -1.85 -0.14 0.00 0.00 0.00 0.00 31.44 29.63 2d93 n GLU 127 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2d93 s LYS 128 N -4.96 1.49 0.86 3.44 -0.14 -1.26 -5.11 119.74 114.05 2d93 s LYS 128 Ca -0.06 -2.09 -0.12 0.00 -1.36 0.00 0.00 55.97 52.34 2d93 s LYS 128 Cb 0.24 -2.79 0.10 0.00 -1.68 0.00 0.00 37.83 33.71 2d93 s LYS 128 CO 0.60 -1.08 1.13 -1.54 -0.76 0.00 0.00 175.35 173.70 2d93 s SER 129 N 0.37 4.02 0.00 2.83 1.04 -1.05 -4.93 113.70 115.98 2d93 s SER 129 Ca 0.15 1.04 0.00 0.00 0.48 0.00 0.00 55.95 57.62 2d93 s SER 129 Cb -0.23 -1.65 0.00 0.00 0.10 0.00 0.00 66.02 64.23 2d93 s SER 129 CO -0.04 -2.24 0.00 0.61 0.98 0.00 0.00 173.24 172.55 2d93 n GLY 130 N -2.38 -1.71 3.56 7.32 0.00 -1.26 -4.83 105.19 105.88 2d93 n GLY 130 Ca 0.07 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.65 2d93 n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d93 s PRO 131 N -4.68 2.57 -0.32 1.61 0.04 -1.26 -4.93 135.00 128.03 2d93 s PRO 131 Ca 0.00 -0.12 -0.28 0.00 0.04 0.00 0.00 61.00 60.64 2d93 s PRO 131 Cb 0.00 -4.94 -0.02 0.00 0.04 0.00 0.00 34.50 29.58 2d93 s PRO 131 CO 0.00 -3.26 1.84 0.45 0.04 0.00 0.00 177.00 176.07 2d93 s SER 132 N 8.05 5.84 -0.09 6.66 0.15 -1.26 -4.96 113.70 128.09 2d93 s SER 132 Ca 0.70 1.35 -0.25 0.00 0.70 0.00 0.00 55.95 58.45 2d93 s SER 132 Cb -0.08 -2.52 -0.03 0.00 -1.71 0.00 0.00 66.02 61.68 2d93 s SER 132 CO 0.03 -1.74 0.78 -0.55 1.20 0.00 0.00 173.24 172.96 2d93 s SER 133 N 6.35 7.03 0.00 5.45 0.15 -1.26 -5.28 113.70 126.14 2d93 s SER 133 Ca 0.82 1.25 0.00 0.00 0.70 0.00 0.00 55.95 58.72 2d93 s SER 133 Cb -0.23 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2d93 s SER 133 CO 0.34 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.16