#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzm n SER 2 N 0.00 7.22 -4.49 1.61 3.41 -1.26 -4.88 113.62 115.23 2dzm n SER 2 Ca 0.00 -3.79 -0.41 0.00 -0.26 0.00 0.00 58.87 54.41 2dzm n SER 2 Cb 0.00 -0.89 -0.08 0.00 -0.26 0.00 0.00 64.21 62.98 2dzm n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dzm n SER 3 N -0.82 -1.64 -4.54 4.04 2.88 -1.26 -4.80 113.62 107.48 2dzm n SER 3 Ca 0.58 -1.23 -0.41 0.00 -1.33 0.00 0.00 58.87 56.48 2dzm n SER 3 Cb 0.63 -1.72 -0.03 0.00 -0.75 0.00 0.00 64.21 62.35 2dzm n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dzm s GLY 4 N -3.39 1.18 -0.21 0.46 0.00 -1.26 -4.96 107.32 99.14 2dzm s GLY 4 Ca 0.73 -1.95 -0.34 0.00 0.00 0.00 0.00 44.72 43.17 2dzm s GLY 4 CO 1.02 2.58 2.05 1.44 0.00 0.00 0.00 173.10 180.19 2dzm n SER 5 N 8.80 2.92 -4.24 1.64 7.64 -1.26 -4.95 113.62 124.17 2dzm n SER 5 Ca 0.19 0.63 -0.17 0.00 1.01 0.00 0.00 58.87 60.53 2dzm n SER 5 Cb 0.50 -1.36 -0.11 0.00 -1.01 0.00 0.00 64.21 62.23 2dzm n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dzm s SER 6 N 6.02 1.92 0.00 6.43 0.01 -1.26 -5.12 113.70 121.70 2dzm s SER 6 Ca 1.00 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 57.39 2dzm s SER 6 Cb -0.69 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 65.49 2dzm s SER 6 CO 0.48 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.54 2dzm n GLY 7 N 0.30 1.65 3.21 3.44 0.00 -1.26 -5.12 105.19 107.41 2dzm n GLY 7 Ca -0.14 0.24 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 2dzm n GLY 7 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dzm s ARG 8 N 3.69 0.78 0.15 1.61 1.70 -1.26 -5.12 118.95 120.50 2dzm s ARG 8 Ca 0.00 -0.71 -0.21 0.00 -0.47 0.00 0.00 55.73 54.34 2dzm s ARG 8 Cb 0.00 0.32 -0.08 0.00 -0.57 0.00 0.00 34.95 34.63 2dzm s ARG 8 CO 0.00 -0.24 0.68 -1.64 -1.08 0.00 0.00 175.30 173.02 2dzm s MET 9 N -3.02 4.30 -0.24 3.89 -1.94 -1.26 -4.07 119.30 116.96 2dzm s MET 9 Ca -0.02 0.87 -0.02 0.00 -1.71 0.00 0.00 55.69 54.82 2dzm s MET 9 Cb 0.01 -3.10 0.02 0.00 2.01 0.00 0.00 34.83 33.77 2dzm s MET 9 CO -0.06 0.52 -0.06 -0.51 -0.01 0.00 0.00 175.02 174.90 2dzm s LEU 10 N -1.49 3.06 -0.42 -0.03 1.43 -1.21 -4.97 118.68 115.05 2dzm s LEU 10 Ca 0.36 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.44 2dzm s LEU 10 Cb -0.19 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.37 2dzm s LEU 10 CO 0.22 -0.10 1.26 -0.62 0.23 0.00 0.00 176.35 177.34 2dzm s ASP 11 N 1.36 6.55 -0.34 2.29 -1.08 -1.24 -3.63 116.67 120.58 2dzm s ASP 11 Ca 0.02 0.74 -0.02 0.00 -0.52 0.00 0.00 52.55 52.77 2dzm s ASP 11 Cb -0.16 -2.54 0.08 0.00 -1.46 0.00 0.00 42.92 38.83 2dzm s ASP 11 CO -0.05 -1.27 0.08 -0.36 0.52 0.00 0.00 175.17 174.09 2dzm s PHE 12 N 4.75 3.42 -0.57 -5.34 0.08 0.46 -2.39 117.98 118.39 2dzm s PHE 12 Ca 0.54 -2.15 -0.21 0.00 0.12 0.00 0.00 56.93 55.22 2dzm s PHE 12 Cb -0.11 -2.59 0.06 0.00 -0.57 0.00 0.00 43.02 39.81 2dzm s PHE 12 CO 0.30 -0.88 0.81 0.50 -0.10 0.00 0.00 175.22 175.85 2dzm s ARG 13 N 1.19 3.16 -0.30 0.44 3.52 -1.09 -0.65 118.95 125.21 2dzm s ARG 13 Ca 0.01 -0.79 -0.20 0.00 -0.13 0.00 0.00 55.73 54.62 2dzm s ARG 13 Cb -0.21 -4.15 -0.01 0.00 -1.56 0.00 0.00 34.95 29.02 2dzm s ARG 13 CO -0.03 -1.50 0.63 0.08 -0.81 0.00 0.00 175.30 173.67 2dzm s VAL 14 N 3.36 4.94 -0.43 7.11 1.01 0.23 -0.22 120.40 136.40 2dzm s VAL 14 Ca 0.20 0.89 -0.21 0.00 0.00 0.00 0.00 61.98 62.87 2dzm s VAL 14 Cb -0.18 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.23 2dzm s VAL 14 CO 0.12 -0.13 0.64 -0.70 0.00 0.00 0.00 175.10 175.04 2dzm s GLU 15 N 2.61 3.32 0.17 2.72 2.12 0.65 -1.11 118.70 129.18 2dzm s GLU 15 Ca 0.25 -0.32 0.10 0.00 0.36 0.00 0.00 54.97 55.36 2dzm s GLU 15 Cb -0.15 -3.93 -0.04 0.00 0.26 0.00 0.00 34.13 30.26 2dzm s GLU 15 CO 0.11 -0.98 -0.23 -0.47 -0.54 0.00 0.00 175.26 173.16 2dzm s TYR 16 N 2.82 2.13 0.08 5.30 5.04 -0.79 -2.81 117.35 129.11 2dzm s TYR 16 Ca 0.23 -0.39 -0.15 0.00 -2.44 0.00 0.00 57.07 54.32 2dzm s TYR 16 Cb -0.14 -1.08 -0.03 0.00 0.35 0.00 0.00 41.96 41.06 2dzm s TYR 16 CO 0.19 0.40 0.99 0.54 -1.34 0.00 0.00 175.55 176.33 2dzm n ARG 17 N 0.46 -0.21 -0.15 4.97 3.00 -1.26 -0.48 116.66 122.99 2dzm n ARG 17 Ca -0.14 0.97 -0.13 0.00 -0.01 0.00 0.00 57.85 58.54 2dzm n ARG 17 Cb 0.56 -1.44 -0.09 0.00 0.00 0.00 0.00 32.46 31.48 2dzm n ARG 17 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.63 177.85 2dzm h ASP 18 N 0.00 -1.77 -5.74 0.55 1.82 -2.00 -3.47 116.42 105.82 2dzm h ASP 18 Ca 0.08 0.23 0.30 0.00 -0.39 0.00 0.00 57.03 57.25 2dzm h ASP 18 Cb 0.19 0.73 -0.06 0.00 0.68 0.00 0.00 39.33 40.87 2dzm h ASP 18 CO -0.44 -0.37 0.83 0.00 -1.61 0.00 0.00 179.24 177.65 2dzm s ARG 19 N -5.46 0.60 -0.25 0.28 1.70 0.37 -5.14 118.95 111.05 2dzm s ARG 19 Ca -0.13 -0.39 -0.15 0.00 -0.47 0.00 0.00 55.73 54.59 2dzm s ARG 19 Cb 0.08 0.16 -0.04 0.00 -0.57 0.00 0.00 34.95 34.59 2dzm s ARG 19 CO 0.57 -0.28 0.38 0.54 -1.08 0.00 0.00 175.30 175.43 2dzm s ASN 20 N -3.74 6.31 0.10 -2.89 2.20 -1.26 -1.88 114.94 113.78 2dzm s ASN 20 Ca 0.28 0.37 0.05 0.00 -0.94 0.00 0.00 52.86 52.62 2dzm s ASN 20 Cb -0.01 -2.22 -0.04 0.00 -2.00 0.00 0.00 41.25 36.98 2dzm s ASN 20 CO 0.01 -0.14 -0.00 0.54 -2.94 0.00 0.00 177.10 174.56 2dzm s VAL 21 N 1.80 3.98 -0.04 3.54 0.11 -0.27 -4.93 120.40 124.58 2dzm s VAL 21 Ca 0.16 -1.04 -0.04 0.00 -2.93 0.00 0.00 61.98 58.14 2dzm s VAL 21 Cb -0.15 -2.91 -0.04 0.00 -1.53 0.00 0.00 36.38 31.75 2dzm s VAL 21 CO 0.09 0.10 0.16 -0.62 -3.33 0.00 0.00 175.10 171.49 2dzm s ASP 22 N -2.37 6.29 -0.00 3.54 -1.08 -1.26 -0.60 116.67 121.18 2dzm s ASP 22 Ca 0.26 0.36 0.03 0.00 -0.52 0.00 0.00 52.55 52.68 2dzm s ASP 22 Cb -0.11 -1.98 -0.01 0.00 -1.46 0.00 0.00 42.92 39.36 2dzm s ASP 22 CO 0.18 0.31 -0.08 -0.69 0.52 0.00 0.00 175.17 175.41 2dzm s VAL 23 N -1.21 0.65 -0.13 1.11 1.01 0.17 -4.96 120.40 117.04 2dzm s VAL 23 Ca 0.23 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2dzm s VAL 23 Cb -0.12 -0.56 0.04 0.00 0.00 0.00 0.00 36.38 35.73 2dzm s VAL 23 CO 0.13 0.14 -0.03 -0.69 0.00 0.00 0.00 175.10 174.65 2dzm s VAL 24 N -0.29 0.76 -0.12 2.92 1.01 -1.26 -0.40 120.40 123.02 2dzm s VAL 24 Ca 0.02 -0.29 -0.13 0.00 0.00 0.00 0.00 61.98 61.58 2dzm s VAL 24 Cb -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.43 2dzm s VAL 24 CO -0.00 0.18 0.37 -1.48 0.00 0.00 0.00 175.10 174.16 2dzm s LEU 25 N 1.80 0.60 0.75 3.92 2.34 -1.24 -4.92 118.68 121.93 2dzm s LEU 25 Ca 0.03 0.65 -0.15 0.00 0.06 0.00 0.00 54.13 54.72 2dzm s LEU 25 Cb -0.14 1.29 0.04 0.00 -0.56 0.00 0.00 46.19 46.83 2dzm s LEU 25 CO -0.07 -0.18 1.16 1.21 -1.06 0.00 0.00 176.35 177.41 2dzm n GLU 26 N 2.62 0.48 0.00 1.48 2.13 -1.26 -3.35 120.64 122.74 2dzm n GLU 26 Ca -0.14 0.23 0.06 0.00 0.66 0.00 0.00 57.16 57.97 2dzm n GLU 26 Cb 0.57 -2.40 0.32 0.00 0.27 0.00 0.00 31.44 30.20 2dzm n GLU 26 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 2dzm n ASP 27 N -2.54 0.00 0.08 4.31 5.68 -1.26 -2.02 116.55 120.81 2dzm n ASP 27 Ca 0.14 -0.03 -0.03 0.00 -0.50 0.00 0.00 54.79 54.37 2dzm n ASP 27 Cb 0.50 -0.20 -0.06 0.00 -1.14 0.00 0.00 41.12 40.21 2dzm n ASP 27 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 2dzm h THR 28 N 0.00 1.28 -4.17 2.12 1.35 -1.93 0.68 112.91 112.23 2dzm h THR 28 Ca 0.00 -2.86 -0.52 0.00 -0.55 0.00 0.00 66.41 62.48 2dzm h THR 28 Cb 0.08 2.62 0.13 0.00 -1.73 0.00 0.00 68.15 69.25 2dzm h THR 28 CO 0.00 0.73 0.39 0.00 -0.25 0.00 0.00 175.52 176.39 2dzm s THR 30 N -2.07 4.53 0.56 0.00 -4.23 -1.26 -2.49 115.64 110.69 2dzm s THR 30 Ca 0.72 1.36 0.35 0.00 -1.18 0.00 0.00 61.69 62.94 2dzm s THR 30 Cb -0.26 -3.90 0.51 0.00 1.34 0.00 0.00 72.50 70.20 2dzm s THR 30 CO 0.42 0.24 1.74 -0.37 -0.54 0.00 0.00 174.62 176.11 2dzm h VAL 31 N 2.80 0.31 -0.22 2.29 -1.51 -1.33 0.59 116.25 119.19 2dzm h VAL 31 Ca -0.48 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.93 2dzm h VAL 31 Cb 1.19 0.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.70 2dzm h VAL 31 CO 0.65 0.00 -0.16 1.23 -1.23 0.00 0.00 177.57 178.06 2dzm h GLY 32 N 0.00 0.39 0.07 5.19 0.00 -1.77 -3.24 103.07 103.71 2dzm h GLY 32 Ca 0.51 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.58 2dzm h GLY 32 CO -0.01 0.25 -0.30 -2.09 0.00 0.00 0.00 176.54 174.39 2dzm h GLU 33 N 0.34 -0.41 -0.74 4.80 4.22 -0.13 -1.92 114.58 120.75 2dzm h GLU 33 Ca 0.06 0.03 0.22 0.00 0.08 0.00 0.00 59.36 59.75 2dzm h GLU 33 Cb 0.48 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.69 2dzm h GLU 33 CO 0.03 -0.27 0.07 -0.89 -2.18 0.00 0.00 179.01 175.77 2dzm n ILE 34 N -4.15 -0.31 0.04 2.32 5.41 -1.22 0.81 119.36 122.25 2dzm n ILE 34 Ca -0.05 1.60 -0.12 0.00 1.00 0.00 0.00 62.75 65.18 2dzm n ILE 34 Cb 0.23 -2.38 -0.06 0.00 -0.71 0.00 0.00 39.64 36.73 2dzm n ILE 34 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2dzm h LYS 35 N 0.00 -0.48 0.00 0.38 1.57 -1.47 -0.21 116.57 116.36 2dzm h LYS 35 Ca 0.47 0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 59.24 2dzm h LYS 35 Cb 1.03 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2dzm h LYS 35 CO -0.68 -0.32 -0.22 0.37 -0.57 0.00 0.00 179.45 178.03 2dzm h GLN 36 N -0.50 0.00 -0.02 3.15 5.75 0.48 -2.97 115.11 121.01 2dzm h GLN 36 Ca 0.07 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.57 2dzm h GLN 36 Cb 0.60 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.15 2dzm h GLN 36 CO -0.33 0.22 0.01 0.82 -2.65 0.00 0.00 178.83 176.91 2dzm h ILE 37 N 0.00 1.14 -0.03 2.39 2.04 0.57 -2.23 117.51 121.39 2dzm h ILE 37 Ca -0.00 -0.40 0.01 0.00 1.00 0.00 0.00 64.86 65.47 2dzm h ILE 37 Cb 0.44 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.89 2dzm h ILE 37 CO 0.03 0.11 0.21 -0.07 0.00 0.00 0.00 178.15 178.43 2dzm h LEU 38 N -0.13 0.00 -0.10 1.44 3.38 -0.94 0.45 115.31 119.41 2dzm h LEU 38 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2dzm h LEU 38 Cb 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 2dzm h LEU 38 CO -0.00 0.00 -0.10 -0.08 0.09 0.00 0.00 178.44 178.35 2dzm h GLU 39 N 0.00 0.00 -0.00 1.13 4.81 -1.43 0.46 114.58 119.55 2dzm h GLU 39 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2dzm h GLU 39 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2dzm h GLU 39 CO -0.00 0.10 -0.28 0.09 -0.73 0.00 0.00 179.01 178.19 2dzm n ASN 40 N -3.13 0.75 0.00 1.04 4.13 0.16 -1.65 115.26 116.56 2dzm n ASN 40 Ca 0.03 -0.62 0.00 0.00 1.68 0.00 0.00 54.58 55.67 2dzm n ASN 40 Cb 0.55 0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.89 2dzm n ASN 40 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2dzm n GLU 41 N -0.95 2.11 0.00 3.52 -0.58 -1.15 -4.73 120.64 118.86 2dzm n GLU 41 Ca 0.11 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.93 2dzm n GLU 41 Cb 0.33 -0.96 0.04 0.00 -0.57 0.00 0.00 31.44 30.29 2dzm n GLU 41 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2dzm n LEU 42 N -2.10 2.11 -1.93 -4.62 4.77 0.16 -4.96 117.00 110.43 2dzm n LEU 42 Ca 0.00 -0.91 -0.15 0.00 -0.03 0.00 0.00 56.01 54.92 2dzm n LEU 42 Cb 0.46 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.51 2dzm n LEU 42 CO 0.00 0.38 -0.17 0.00 -1.33 0.00 0.00 177.39 176.27 2dzm n GLN 43 N 0.53 -1.69 -3.68 3.23 3.00 -0.66 -4.93 117.38 113.19 2dzm n GLN 43 Ca 0.09 0.81 -0.37 0.00 -0.01 0.00 0.00 57.00 57.51 2dzm n GLN 43 Cb 0.39 -5.25 -0.06 0.00 0.00 0.00 0.00 30.24 25.31 2dzm n GLN 43 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2dzm s ILE 44 N -2.51 5.32 0.17 5.09 1.01 -1.25 -4.99 121.20 124.04 2dzm s ILE 44 Ca 0.00 0.46 -0.30 0.00 0.00 0.00 0.00 60.65 60.81 2dzm s ILE 44 Cb 0.00 -3.55 -0.08 0.00 0.01 0.00 0.00 42.46 38.84 2dzm s ILE 44 CO 0.00 0.53 1.32 -2.16 0.00 0.00 0.00 174.94 174.63 2dzm s PRO 45 N -0.50 4.38 0.18 2.79 0.04 -1.26 -3.92 135.00 136.71 2dzm s PRO 45 Ca 0.17 2.04 0.12 0.00 0.04 0.00 0.00 61.00 63.37 2dzm s PRO 45 Cb -0.13 -3.21 0.64 0.00 0.04 0.00 0.00 34.50 31.84 2dzm s PRO 45 CO 0.06 -0.29 1.36 0.28 0.04 0.00 0.00 177.00 178.44 2dzm n VAL 46 N 2.98 1.43 0.11 -0.36 0.31 -1.26 -0.56 118.33 120.98 2dzm n VAL 46 Ca 0.07 0.63 0.02 0.00 -0.01 0.00 0.00 64.34 65.06 2dzm n VAL 46 Cb 0.43 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 2dzm n VAL 46 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2dzm h SER 47 N 0.00 0.00 -0.31 4.52 0.02 -1.98 -3.25 113.55 112.55 2dzm h SER 47 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dzm h SER 47 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2dzm h SER 47 CO 0.00 0.50 0.00 0.29 -1.14 0.00 0.00 176.83 176.48 2dzm n LYS 48 N -3.13 2.25 -4.32 3.45 4.76 0.28 -4.95 118.16 116.49 2dzm n LYS 48 Ca -0.01 -2.07 -0.30 0.00 -2.87 0.00 0.00 58.31 53.06 2dzm n LYS 48 Cb 0.75 -1.43 -0.10 0.00 -1.84 0.00 0.00 35.03 32.41 2dzm n LYS 48 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2dzm s MET 49 N -1.33 2.10 -0.08 1.97 -1.94 -0.97 -4.22 119.30 114.83 2dzm s MET 49 Ca 0.32 -1.02 -0.01 0.00 -1.71 0.00 0.00 55.69 53.27 2dzm s MET 49 Cb 0.19 -2.27 0.03 0.00 2.01 0.00 0.00 34.83 34.78 2dzm s MET 49 CO 0.26 0.52 -0.03 -0.51 -0.01 0.00 0.00 175.02 175.25 2dzm s LEU 50 N -2.03 0.85 -0.15 -0.03 1.43 -1.23 -4.91 118.68 112.62 2dzm s LEU 50 Ca 0.20 -0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.85 2dzm s LEU 50 Cb -0.11 -0.55 -0.02 0.00 0.03 0.00 0.00 46.19 45.54 2dzm s LEU 50 CO 0.11 -0.15 1.21 -0.22 0.23 0.00 0.00 176.35 177.53 2dzm s LEU 51 N 1.75 4.20 0.08 1.79 1.98 -1.26 -3.60 118.68 123.62 2dzm s LEU 51 Ca 0.03 1.68 -0.03 0.00 -2.89 0.00 0.00 54.13 52.91 2dzm s LEU 51 Cb -0.13 -3.54 -0.03 0.00 0.66 0.00 0.00 46.19 43.15 2dzm s LEU 51 CO -0.05 -0.70 0.06 -0.54 -1.89 0.00 0.00 176.35 173.23 2dzm s LYS 52 N 3.11 0.77 0.00 1.98 1.02 -1.24 -4.88 119.74 120.50 2dzm s LYS 52 Ca 0.53 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 55.31 2dzm s LYS 52 Cb -0.21 0.26 0.00 0.00 -0.52 0.00 0.00 37.83 37.35 2dzm s LYS 52 CO 0.15 -0.20 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 2dzm n GLY 53 N 0.01 1.09 3.69 -3.33 0.00 -1.26 -3.55 105.19 101.83 2dzm n GLY 53 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 2dzm n GLY 53 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dzm s TRP 54 N -2.00 0.76 -0.10 1.61 0.52 -1.26 -4.89 118.94 113.58 2dzm s TRP 54 Ca 0.00 0.44 -0.20 0.00 0.02 0.00 0.00 56.10 56.35 2dzm s TRP 54 Cb 0.00 -3.64 -0.27 0.00 -1.15 0.00 0.00 33.47 28.40 2dzm s TRP 54 CO 0.00 -3.56 0.65 -0.22 0.02 0.00 0.00 176.95 173.84 2dzm h LYS 55 N -2.34 0.20 -4.84 4.98 1.63 -1.99 -3.44 116.57 110.78 2dzm h LYS 55 Ca -0.45 -0.34 -0.68 0.00 -0.85 0.00 0.00 60.65 58.33 2dzm h LYS 55 Cb 1.28 0.13 -0.28 0.00 -0.60 0.00 0.00 32.23 32.75 2dzm h LYS 55 CO 0.35 1.17 -0.66 -0.08 -3.45 0.00 0.00 179.45 176.77 2dzm s THR 56 N -2.41 3.60 0.00 1.00 -1.32 -1.26 -5.04 115.64 110.21 2dzm s THR 56 Ca -0.19 -0.81 0.00 0.00 -1.21 0.00 0.00 61.69 59.49 2dzm s THR 56 Cb 0.02 -2.85 0.00 0.00 -1.51 0.00 0.00 72.50 68.16 2dzm s THR 56 CO 0.76 0.12 0.00 0.61 -2.21 0.00 0.00 174.62 173.89 2dzm n GLY 57 N 4.80 1.79 3.26 6.08 0.00 -1.26 -3.91 105.19 115.94 2dzm n GLY 57 Ca -0.15 0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 2dzm n GLY 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dzm s ASP 58 N -2.87 4.79 0.13 1.61 1.01 -1.26 -4.47 116.67 115.60 2dzm s ASP 58 Ca 0.00 -0.89 -0.30 0.00 0.71 0.00 0.00 52.55 52.07 2dzm s ASP 58 Cb 0.00 -1.77 -0.06 0.00 1.01 0.00 0.00 42.92 42.10 2dzm s ASP 58 CO 0.00 -0.19 1.03 -0.69 0.21 0.00 0.00 175.17 175.53 2dzm s VAL 59 N 1.39 4.25 0.36 -1.27 1.01 -1.25 -5.04 120.40 119.84 2dzm s VAL 59 Ca 0.00 1.86 -0.12 0.00 0.00 0.00 0.00 61.98 63.72 2dzm s VAL 59 Cb -0.18 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 31.94 2dzm s VAL 59 CO -0.01 0.28 0.74 -1.83 0.00 0.00 0.00 175.10 174.28 2dzm s GLU 60 N -0.00 3.87 0.65 2.72 -1.05 -1.26 -4.95 118.70 118.68 2dzm s GLU 60 Ca 0.49 0.53 0.38 0.00 -0.15 0.00 0.00 54.97 56.23 2dzm s GLU 60 Cb -0.26 -2.42 2.12 0.00 -0.44 0.00 0.00 34.13 33.13 2dzm s GLU 60 CO 0.32 0.06 2.23 0.38 0.95 0.00 0.00 175.26 179.20 2dzm h ASP 61 N 1.73 0.00 0.36 0.83 3.04 -1.96 0.22 116.42 120.64 2dzm h ASP 61 Ca -0.47 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.32 2dzm h ASP 61 Cb 1.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 2dzm h ASP 61 CO 0.65 0.00 0.00 -0.24 -2.04 0.00 0.00 179.24 177.61 2dzm n SER 62 N -3.18 0.00 -4.92 4.15 2.88 -1.26 -3.57 113.62 107.72 2dzm n SER 62 Ca -0.02 -0.18 -0.27 0.00 -1.33 0.00 0.00 58.87 57.07 2dzm n SER 62 Cb 0.17 -0.23 -0.03 0.00 -0.75 0.00 0.00 64.21 63.37 2dzm n SER 62 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2dzm s THR 63 N -2.46 5.12 0.19 2.46 2.01 0.77 -5.00 115.64 118.71 2dzm s THR 63 Ca 0.25 -0.24 0.07 0.00 0.31 0.00 0.00 61.69 62.08 2dzm s THR 63 Cb 0.16 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2dzm s THR 63 CO 0.34 -0.32 0.01 0.54 -0.69 0.00 0.00 174.62 174.50 2dzm s VAL 64 N -2.05 3.74 0.05 3.82 0.11 -1.26 -1.18 120.40 123.64 2dzm s VAL 64 Ca 0.41 -1.46 -0.26 0.00 -2.93 0.00 0.00 61.98 57.73 2dzm s VAL 64 Cb -0.11 -2.90 -0.17 0.00 -1.53 0.00 0.00 36.38 31.68 2dzm s VAL 64 CO 0.31 -0.14 1.53 -0.07 -3.33 0.00 0.00 175.10 173.40 2dzm h LEU 65 N 2.57 -0.28 -1.23 2.54 3.38 -1.53 -2.22 115.31 118.54 2dzm h LEU 65 Ca -0.47 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2dzm h LEU 65 Cb 1.21 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2dzm h LEU 65 CO 0.58 -0.08 0.55 0.07 0.09 0.00 0.00 178.44 179.65 2dzm h LYS 66 N -0.47 0.00 -0.15 1.13 2.10 0.12 0.29 116.57 119.59 2dzm h LYS 66 Ca -0.03 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.55 2dzm h LYS 66 Cb 0.35 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.68 2dzm h LYS 66 CO 0.06 0.00 -0.15 1.03 -2.00 0.00 0.00 179.45 178.38 2dzm h SER 67 N 0.00 0.39 0.97 7.07 0.87 -1.67 -3.14 113.55 118.05 2dzm h SER 67 Ca 0.00 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 2dzm h SER 67 Cb 1.09 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2dzm h SER 67 CO 0.00 0.80 -0.38 0.18 -0.53 0.00 0.00 176.83 176.89 2dzm n LEU 68 N -4.54 0.62 -3.80 2.23 4.77 0.87 -4.96 117.00 112.19 2dzm n LEU 68 Ca -0.06 0.31 -0.23 0.00 -0.03 0.00 0.00 56.01 55.99 2dzm n LEU 68 Cb 0.37 -0.26 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2dzm n LEU 68 CO 0.39 -0.05 -0.12 1.41 -1.33 0.00 0.00 177.39 177.70 2dzm n HIS 69 N -1.98 -1.84 -1.53 -1.77 8.25 -0.35 -4.86 115.22 111.14 2dzm n HIS 69 Ca 0.05 0.81 -0.42 0.00 -0.26 0.00 0.00 57.72 57.90 2dzm n HIS 69 Cb 0.41 -4.14 0.00 0.00 1.12 0.00 0.00 29.99 27.39 2dzm n HIS 69 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2dzm n LEU 70 N -4.34 1.23 -4.60 2.41 7.99 -1.26 -4.96 117.00 113.47 2dzm n LEU 70 Ca -0.28 1.00 -0.30 0.00 -0.01 0.00 0.00 56.01 56.42 2dzm n LEU 70 Cb 0.67 -1.22 0.24 0.00 -0.11 0.00 0.00 43.42 43.00 2dzm n LEU 70 CO 0.71 -2.14 0.62 -2.16 -1.51 0.00 0.00 177.39 172.91 2dzm s PRO 71 N -1.74 -1.21 0.22 3.23 0.04 -1.26 -4.94 135.00 129.34 2dzm s PRO 71 Ca 0.63 -0.07 -0.09 0.00 0.04 0.00 0.00 61.00 61.51 2dzm s PRO 71 Cb -0.61 -1.60 0.20 0.00 0.04 0.00 0.00 34.50 32.53 2dzm s PRO 71 CO 0.57 -3.70 1.88 -0.22 0.04 0.00 0.00 177.00 175.57 2dzm h LYS 72 N -2.58 1.00 -5.49 4.56 3.64 -1.93 -3.41 116.57 112.36 2dzm h LYS 72 Ca -0.45 -0.06 -0.64 0.00 -1.27 0.00 0.00 60.65 58.23 2dzm h LYS 72 Cb 1.29 -0.23 -0.14 0.00 -0.41 0.00 0.00 32.23 32.75 2dzm h LYS 72 CO 0.34 0.66 -0.55 -0.80 -2.27 0.00 0.00 179.45 176.83 2dzm s ASN 73 N -5.87 5.76 0.03 4.20 0.01 -1.26 -3.62 114.94 114.19 2dzm s ASN 73 Ca -0.13 0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 52.12 2dzm s ASN 73 Cb 0.16 -1.90 0.00 0.00 0.41 0.00 0.00 41.25 39.92 2dzm s ASN 73 CO 0.78 0.26 0.18 0.20 -1.51 0.00 0.00 177.10 177.01 2dzm s ASN 74 N -0.17 0.05 -0.09 -1.22 0.01 -1.00 -5.02 114.94 107.48 2dzm s ASN 74 Ca 0.08 -0.35 -0.04 0.00 -0.71 0.00 0.00 52.86 51.84 2dzm s ASN 74 Cb -0.12 0.27 0.05 0.00 0.41 0.00 0.00 41.25 41.86 2dzm s ASN 74 CO 0.01 -0.52 0.18 -0.55 -1.51 0.00 0.00 177.10 174.71 2dzm s SER 75 N -1.96 0.40 0.50 -1.22 0.15 -1.26 -2.67 113.70 107.64 2dzm s SER 75 Ca -0.07 0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.98 2dzm s SER 75 Cb -0.02 0.34 -0.01 0.00 -1.71 0.00 0.00 66.02 64.62 2dzm s SER 75 CO -0.03 -0.22 0.03 -0.76 1.20 0.00 0.00 173.24 173.47 2dzm s LEU 76 N 1.97 2.19 -0.15 3.45 1.43 0.69 -4.91 118.68 123.36 2dzm s LEU 76 Ca -0.01 -1.68 -0.21 0.00 -1.03 0.00 0.00 54.13 51.20 2dzm s LEU 76 Cb -0.12 -0.58 0.05 0.00 0.03 0.00 0.00 46.19 45.57 2dzm s LEU 76 CO -0.06 -0.90 0.54 -0.72 0.23 0.00 0.00 176.35 175.43 2dzm s TYR 77 N -2.95 -0.55 -0.14 0.29 1.13 -1.23 -0.25 117.35 113.64 2dzm s TYR 77 Ca 0.07 1.23 -0.05 0.00 -1.41 0.00 0.00 57.07 56.91 2dzm s TYR 77 Cb 0.01 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 41.06 2dzm s TYR 77 CO 0.05 -0.36 0.05 0.08 -2.51 0.00 0.00 175.55 172.85 2dzm s VAL 78 N -0.22 4.72 -0.21 -3.49 1.01 -1.12 -3.67 120.40 117.41 2dzm s VAL 78 Ca -0.04 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.88 2dzm s VAL 78 Cb -0.03 -3.07 0.04 0.00 0.00 0.00 0.00 36.38 33.32 2dzm s VAL 78 CO 0.03 0.53 -0.12 -0.76 0.00 0.00 0.00 175.10 174.78 2dzm s LEU 79 N -0.25 2.61 -0.66 3.92 1.43 -1.24 -4.69 118.68 119.81 2dzm s LEU 79 Ca 0.08 -1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 52.06 2dzm s LEU 79 Cb -0.12 -1.37 0.17 0.00 0.03 0.00 0.00 46.19 44.90 2dzm s LEU 79 CO 0.02 -0.14 0.56 0.42 0.23 0.00 0.00 176.35 177.44 2dzm s THR 80 N 1.29 4.82 0.11 5.49 -4.23 -1.26 -3.58 115.64 118.28 2dzm s THR 80 Ca -0.03 -2.27 -0.14 0.00 -1.18 0.00 0.00 61.69 58.08 2dzm s THR 80 Cb -0.17 -4.07 -0.07 0.00 1.34 0.00 0.00 72.50 69.53 2dzm s THR 80 CO -0.08 -0.91 1.44 1.55 -0.54 0.00 0.00 174.62 176.07 2dzm h PRO 81 N 7.95 0.78 0.01 3.99 0.13 -1.98 -3.34 132.00 139.53 2dzm h PRO 81 Ca -0.06 -0.41 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2dzm h PRO 81 Cb 1.04 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2dzm h PRO 81 CO 0.81 1.04 -0.00 -0.44 -0.23 0.00 0.00 178.00 179.18 2dzm h ASP 82 N 0.55 -0.01 -2.00 1.44 3.32 -1.91 -3.46 116.42 114.35 2dzm h ASP 82 Ca 0.05 -0.55 -0.64 0.00 0.02 0.00 0.00 57.03 55.91 2dzm h ASP 82 Cb 0.90 0.00 0.07 0.00 0.22 0.00 0.00 39.33 40.52 2dzm h ASP 82 CO 0.08 0.76 0.41 -0.11 -1.72 0.00 0.00 179.24 178.66 2dzm n LEU 83 N -4.70 1.91 -4.68 1.55 7.94 -1.26 -4.95 117.00 112.83 2dzm n LEU 83 Ca -0.06 1.13 -0.29 0.00 -1.11 0.00 0.00 56.01 55.69 2dzm n LEU 83 Cb 0.27 -1.26 0.18 0.00 0.53 0.00 0.00 43.42 43.14 2dzm n LEU 83 CO 0.19 -1.04 0.64 -2.16 -1.11 0.00 0.00 177.39 173.92 2dzm s PRO 84 N -0.05 0.41 0.59 1.96 0.04 -1.26 -4.90 135.00 131.80 2dzm s PRO 84 Ca 0.76 0.52 -0.17 0.00 0.04 0.00 0.00 61.00 62.14 2dzm s PRO 84 Cb -0.84 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 31.94 2dzm s PRO 84 CO 0.49 -2.74 1.12 -1.25 0.04 0.00 0.00 177.00 174.66 2dzm s PRO 85 N -4.96 3.11 0.00 0.56 0.04 -1.26 -4.91 135.00 127.58 2dzm s PRO 85 Ca 0.65 1.51 0.16 0.00 0.04 0.00 0.00 61.00 63.36 2dzm s PRO 85 Cb -0.19 -1.98 0.92 0.00 0.04 0.00 0.00 34.50 33.29 2dzm s PRO 85 CO 0.58 -1.02 1.35 -0.35 0.04 0.00 0.00 177.00 177.60 2dzm n PRO 86 N -1.79 0.47 -1.24 0.56 -0.04 -1.26 -4.83 135.00 126.87 2dzm n PRO 86 Ca 0.11 0.01 -0.38 0.00 -0.04 0.00 0.00 63.50 63.20 2dzm n PRO 86 Cb 0.51 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 2dzm n PRO 86 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dzm n SER 87 N -1.02 0.32 -3.66 3.54 7.64 -1.26 -4.84 113.62 114.34 2dzm n SER 87 Ca 0.11 0.23 -0.05 0.00 1.01 0.00 0.00 58.87 60.17 2dzm n SER 87 Cb 0.06 -0.78 -0.07 0.00 -1.01 0.00 0.00 64.21 62.40 2dzm n SER 87 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dzm s SER 88 N 7.22 -0.64 -0.52 6.43 1.04 -1.26 -5.12 113.70 120.85 2dzm s SER 88 Ca 1.14 1.24 -0.10 0.00 0.48 0.00 0.00 55.95 58.71 2dzm s SER 88 Cb -1.11 1.73 0.13 0.00 0.10 0.00 0.00 66.02 66.87 2dzm s SER 88 CO 0.44 -0.23 0.41 -0.44 0.98 0.00 0.00 173.24 174.41 2dzm s SER 89 N 2.67 5.83 -0.14 7.02 0.01 -1.26 -5.01 113.70 122.81 2dzm s SER 89 Ca -0.04 -2.02 -0.34 0.00 1.31 0.00 0.00 55.95 54.87 2dzm s SER 89 Cb -0.12 -2.05 0.13 0.00 0.21 0.00 0.00 66.02 64.20 2dzm s SER 89 CO -0.15 -0.69 1.20 -0.55 0.41 0.00 0.00 173.24 173.45 2dzm s SER 90 N 2.66 -0.14 -1.19 2.44 0.15 -1.26 -5.08 113.70 111.28 2dzm s SER 90 Ca 0.07 -0.03 -0.15 0.00 0.70 0.00 0.00 55.95 56.54 2dzm s SER 90 Cb -0.25 0.17 0.16 0.00 -1.71 0.00 0.00 66.02 64.38 2dzm s SER 90 CO -0.01 -0.28 1.43 -2.28 1.20 0.00 0.00 173.24 173.30 2dzm s HIS 91 N -2.48 3.40 0.07 3.44 2.46 -1.26 -4.98 115.29 115.95 2dzm s HIS 91 Ca 0.10 -2.02 0.08 0.00 0.47 0.00 0.00 55.06 53.69 2dzm s HIS 91 Cb -0.00 -4.35 -0.03 0.00 -0.13 0.00 0.00 32.58 28.06 2dzm s HIS 91 CO -0.05 -1.44 -0.19 0.00 -2.47 0.00 0.00 174.74 170.59 2dzm s ALA 92 N 1.92 2.59 0.00 1.58 0.00 -1.26 -5.08 121.76 121.51 2dzm s ALA 92 Ca 0.43 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2dzm s ALA 92 Cb -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.42 2dzm s ALA 92 CO -0.00 0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.74 2dzm n GLY 93 N 1.30 0.21 3.43 0.00 0.00 -1.26 -5.15 105.19 103.71 2dzm n GLY 93 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 2dzm n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dzm s ALA 94 N -2.50 2.47 -0.40 4.61 0.00 -1.26 -5.07 121.76 119.60 2dzm s ALA 94 Ca 0.00 -1.55 -0.37 0.00 0.00 0.00 0.00 51.96 50.04 2dzm s ALA 94 Cb 0.00 0.97 -0.16 0.00 0.00 0.00 0.00 23.12 23.93 2dzm s ALA 94 CO 0.00 -0.43 1.44 -0.11 0.00 0.00 0.00 175.76 176.66 2dzm n LEU 95 N -0.77 0.85 0.17 0.00 7.94 -1.26 -4.72 117.00 119.22 2dzm n LEU 95 Ca -0.02 0.82 0.19 0.00 -1.11 0.00 0.00 56.01 55.89 2dzm n LEU 95 Cb 0.65 -0.72 0.80 0.00 0.53 0.00 0.00 43.42 44.68 2dzm n LEU 95 CO 0.35 -0.66 1.16 0.06 -1.11 0.00 0.00 177.39 177.19 2dzm h GLN 96 N 5.15 0.00 -6.78 1.96 3.07 -2.05 -3.41 115.11 113.05 2dzm h GLN 96 Ca -0.26 0.00 -0.49 0.00 0.09 0.00 0.00 58.65 57.99 2dzm h GLN 96 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.66 2dzm h GLN 96 CO 0.82 0.00 0.26 -1.21 0.09 0.00 0.00 178.83 178.79 2dzm s GLU 97 N -4.54 4.45 -0.30 0.06 2.02 -1.26 -4.95 118.70 114.18 2dzm s GLU 97 Ca -0.04 1.15 -0.34 0.00 0.02 0.00 0.00 54.97 55.76 2dzm s GLU 97 Cb 0.14 -2.81 -0.10 0.00 0.10 0.00 0.00 34.13 31.47 2dzm s GLU 97 CO 0.51 0.31 2.17 0.43 0.02 0.00 0.00 175.26 178.70 2dzm n SER 98 N 0.57 2.44 -4.73 -0.19 7.64 -1.26 -4.87 113.62 113.22 2dzm n SER 98 Ca 0.01 0.41 -0.42 0.00 1.01 0.00 0.00 58.87 59.88 2dzm n SER 98 Cb 0.51 -1.33 -0.03 0.00 -1.01 0.00 0.00 64.21 62.35 2dzm n SER 98 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dzm s LEU 99 N 7.27 4.37 0.00 -3.43 2.96 -1.26 -5.17 118.68 123.42 2dzm s LEU 99 Ca 1.07 2.68 0.31 0.00 -0.22 0.00 0.00 54.13 57.97 2dzm s LEU 99 Cb -0.74 -3.60 1.71 0.00 0.50 0.00 0.00 46.19 44.05 2dzm s LEU 99 CO 0.47 -0.82 2.12 0.59 -1.32 0.00 0.00 176.35 177.38