#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzm s SER 2 N 0.00 2.82 -1.36 1.61 0.01 -1.26 -4.72 113.70 110.80 2dzm s SER 2 Ca 0.00 -0.51 -0.06 0.00 1.31 0.00 0.00 55.95 56.69 2dzm s SER 2 Cb 0.00 -1.29 0.03 0.00 0.21 0.00 0.00 66.02 64.97 2dzm s SER 2 CO 0.00 0.13 0.98 -1.20 0.41 0.00 0.00 173.24 173.56 2dzm n SER 3 N 3.59 -3.84 -3.83 2.44 7.64 -1.26 -4.99 113.62 113.38 2dzm n SER 3 Ca -0.20 -0.69 -0.22 0.00 1.01 0.00 0.00 58.87 58.77 2dzm n SER 3 Cb 0.53 -4.52 -0.17 0.00 -1.01 0.00 0.00 64.21 59.04 2dzm n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dzm s GLY 4 N -3.78 0.50 -0.16 0.23 0.00 -1.26 -5.02 107.32 97.83 2dzm s GLY 4 Ca 0.35 -0.14 -0.08 0.00 0.00 0.00 0.00 44.72 44.85 2dzm s GLY 4 CO 0.78 0.86 -0.20 1.44 0.00 0.00 0.00 173.10 175.97 2dzm n SER 5 N 4.74 1.19 -3.99 1.64 7.64 -1.26 -4.90 113.62 118.68 2dzm n SER 5 Ca -0.14 0.18 -0.31 0.00 1.01 0.00 0.00 58.87 59.62 2dzm n SER 5 Cb 0.50 -0.46 0.01 0.00 -1.01 0.00 0.00 64.21 63.25 2dzm n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dzm n SER 6 N -3.68 -3.70 -2.94 6.43 2.88 -1.26 -4.96 113.62 106.38 2dzm n SER 6 Ca -0.31 -0.87 -0.09 0.00 -1.33 0.00 0.00 58.87 56.27 2dzm n SER 6 Cb 0.73 -3.52 -0.00 0.00 -0.75 0.00 0.00 64.21 60.66 2dzm n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dzm n GLY 7 N -1.63 3.04 3.24 0.46 0.00 -1.26 -5.14 105.19 103.90 2dzm n GLY 7 Ca -0.01 -2.22 -0.12 0.00 0.00 0.00 0.00 46.02 43.67 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 -2.74 0.39 0.09 1.61 1.70 -1.26 -5.09 118.95 113.64 2dzm s ARG 8 Ca 0.09 0.60 -0.30 0.00 -0.47 0.00 0.00 55.73 55.65 2dzm s ARG 8 Cb -0.01 0.09 -0.06 0.00 -0.57 0.00 0.00 34.95 34.40 2dzm s ARG 8 CO 0.06 -0.10 1.19 -1.64 -1.08 0.00 0.00 175.30 173.73 2dzm s MET 9 N 0.72 4.45 -0.30 3.89 -1.94 -1.26 -3.96 119.30 120.89 2dzm s MET 9 Ca -0.04 1.78 -0.10 0.00 -1.71 0.00 0.00 55.69 55.62 2dzm s MET 9 Cb -0.05 -3.33 -0.02 0.00 2.01 0.00 0.00 34.83 33.43 2dzm s MET 9 CO -0.05 -0.21 0.17 -0.51 -0.01 0.00 0.00 175.02 174.41 2dzm s LEU 10 N 0.80 4.09 -0.66 -0.03 1.43 -1.19 -4.95 118.68 118.16 2dzm s LEU 10 Ca 0.57 -0.31 -0.27 0.00 -1.03 0.00 0.00 54.13 53.10 2dzm s LEU 10 Cb -0.30 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 43.88 2dzm s LEU 10 CO 0.30 -0.14 1.44 -0.62 0.23 0.00 0.00 176.35 177.57 2dzm s ASP 11 N 1.68 5.95 -0.41 2.29 2.15 -1.15 -3.65 116.67 123.54 2dzm s ASP 11 Ca 0.06 -0.08 -0.10 0.00 0.43 0.00 0.00 52.55 52.86 2dzm s ASP 11 Cb -0.17 -2.55 0.06 0.00 -0.30 0.00 0.00 42.92 39.97 2dzm s ASP 11 CO 0.08 -1.92 0.25 -0.36 -0.17 0.00 0.00 175.17 173.05 2dzm s PHE 12 N 6.57 3.29 -0.55 -5.34 0.08 0.64 -0.17 117.98 122.51 2dzm s PHE 12 Ca 0.47 -1.28 -0.22 0.00 0.12 0.00 0.00 56.93 56.02 2dzm s PHE 12 Cb -0.10 -2.79 0.05 0.00 -0.57 0.00 0.00 43.02 39.61 2dzm s PHE 12 CO 0.19 -0.78 0.81 0.50 -0.10 0.00 0.00 175.22 175.84 2dzm s ARG 13 N 1.49 3.21 -0.53 0.44 6.06 -0.65 0.08 118.95 129.06 2dzm s ARG 13 Ca 0.03 -0.62 -0.21 0.00 -2.50 0.00 0.00 55.73 52.43 2dzm s ARG 13 Cb -0.22 -4.10 0.06 0.00 0.06 0.00 0.00 34.95 30.75 2dzm s ARG 13 CO 0.04 -1.42 0.72 0.08 -2.50 0.00 0.00 175.30 172.23 2dzm s VAL 14 N 3.38 4.72 -0.61 7.11 1.01 0.36 0.14 120.40 136.51 2dzm s VAL 14 Ca 0.23 -0.30 -0.25 0.00 0.00 0.00 0.00 61.98 61.65 2dzm s VAL 14 Cb -0.16 -4.38 0.04 0.00 0.00 0.00 0.00 36.38 31.88 2dzm s VAL 14 CO 0.15 -0.92 1.06 -0.70 0.00 0.00 0.00 175.10 174.68 2dzm s GLU 15 N 3.03 3.30 0.06 2.72 2.12 0.63 -1.16 118.70 129.39 2dzm s GLU 15 Ca 0.19 -0.27 0.06 0.00 0.36 0.00 0.00 54.97 55.31 2dzm s GLU 15 Cb -0.18 -4.10 -0.04 0.00 0.26 0.00 0.00 34.13 30.08 2dzm s GLU 15 CO 0.14 -1.71 -0.11 -0.47 -0.54 0.00 0.00 175.26 172.56 2dzm s TYR 16 N 4.50 2.73 0.13 5.30 5.04 -1.00 -2.77 117.35 131.28 2dzm s TYR 16 Ca 0.32 -0.15 -0.20 0.00 -2.44 0.00 0.00 57.07 54.61 2dzm s TYR 16 Cb -0.12 -1.49 0.01 0.00 0.35 0.00 0.00 41.96 40.71 2dzm s TYR 16 CO 0.18 0.36 1.11 0.54 -1.34 0.00 0.00 175.55 176.40 2dzm n ARG 17 N 1.19 -0.27 0.00 4.97 1.74 -1.26 0.18 116.66 123.21 2dzm n ARG 17 Ca -0.15 1.09 -0.13 0.00 -0.77 0.00 0.00 57.85 57.90 2dzm n ARG 17 Cb 0.52 -1.61 -0.06 0.00 -1.02 0.00 0.00 32.46 30.29 2dzm n ARG 17 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2dzm h ASP 18 N 0.00 -1.35 -5.00 0.55 3.32 -1.98 -3.46 116.42 108.49 2dzm h ASP 18 Ca 0.15 0.18 0.28 0.00 0.02 0.00 0.00 57.03 57.66 2dzm h ASP 18 Cb 0.33 0.55 -0.15 0.00 0.22 0.00 0.00 39.33 40.28 2dzm h ASP 18 CO -0.69 -0.43 0.80 0.00 -1.72 0.00 0.00 179.24 177.20 2dzm s ARG 19 N -5.87 0.38 -0.31 3.56 1.70 0.13 -5.13 118.95 113.41 2dzm s ARG 19 Ca -0.15 -0.18 -0.22 0.00 -0.47 0.00 0.00 55.73 54.70 2dzm s ARG 19 Cb 0.09 0.15 -0.00 0.00 -0.57 0.00 0.00 34.95 34.62 2dzm s ARG 19 CO 0.64 -0.17 0.73 -0.80 -1.08 0.00 0.00 175.30 174.61 2dzm s ASN 20 N -2.59 6.59 -0.01 -2.89 0.01 -1.26 -2.39 114.94 112.41 2dzm s ASN 20 Ca 0.12 0.56 -0.00 0.00 -0.71 0.00 0.00 52.86 52.83 2dzm s ASN 20 Cb 0.02 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.26 2dzm s ASN 20 CO -0.04 -0.56 0.06 0.54 -1.51 0.00 0.00 177.10 175.58 2dzm s VAL 21 N 2.82 4.57 -0.18 1.60 0.11 -0.31 -4.92 120.40 124.08 2dzm s VAL 21 Ca 0.29 -0.44 -0.13 0.00 -2.93 0.00 0.00 61.98 58.77 2dzm s VAL 21 Cb -0.14 -3.06 -0.05 0.00 -1.53 0.00 0.00 36.38 31.59 2dzm s VAL 21 CO 0.12 0.37 0.24 -0.62 -3.33 0.00 0.00 175.10 171.89 2dzm s ASP 22 N -1.64 6.35 0.04 3.54 -1.08 -1.26 -0.49 116.67 122.13 2dzm s ASP 22 Ca 0.21 0.40 0.08 0.00 -0.52 0.00 0.00 52.55 52.72 2dzm s ASP 22 Cb -0.12 -2.15 -0.03 0.00 -1.46 0.00 0.00 42.92 39.16 2dzm s ASP 22 CO 0.12 0.11 -0.22 -0.69 0.52 0.00 0.00 175.17 175.02 2dzm s VAL 23 N 0.51 2.51 -0.12 1.11 1.01 0.11 -4.97 120.40 120.56 2dzm s VAL 23 Ca 0.13 -1.25 -0.02 0.00 0.00 0.00 0.00 61.98 60.85 2dzm s VAL 23 Cb -0.12 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 34.28 2dzm s VAL 23 CO 0.02 0.37 0.01 -0.69 0.00 0.00 0.00 175.10 174.82 2dzm s VAL 24 N -0.85 0.44 -0.08 2.92 1.01 -1.26 -0.26 120.40 122.32 2dzm s VAL 24 Ca 0.13 -0.14 -0.08 0.00 0.00 0.00 0.00 61.98 61.89 2dzm s VAL 24 Cb -0.10 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.57 2dzm s VAL 24 CO 0.03 0.08 0.22 -1.48 0.00 0.00 0.00 175.10 173.96 2dzm s LEU 25 N 1.93 1.16 1.04 3.92 2.34 -1.24 -4.92 118.68 122.90 2dzm s LEU 25 Ca 0.03 0.42 -0.14 0.00 0.06 0.00 0.00 54.13 54.49 2dzm s LEU 25 Cb -0.14 0.77 0.12 0.00 -0.56 0.00 0.00 46.19 46.39 2dzm s LEU 25 CO -0.06 -0.10 0.53 1.21 -1.06 0.00 0.00 176.35 176.87 2dzm n GLU 26 N 2.86 -1.11 -0.20 1.48 2.13 -1.26 -3.19 120.64 121.35 2dzm n GLU 26 Ca -0.13 -0.29 -0.02 0.00 0.66 0.00 0.00 57.16 57.38 2dzm n GLU 26 Cb 0.58 -1.96 0.05 0.00 0.27 0.00 0.00 31.44 30.38 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 -2.62 2.57 -0.03 4.31 5.68 -1.25 -3.38 116.55 121.82 2dzm n ASP 27 Ca 0.05 -2.24 -0.01 0.00 -0.50 0.00 0.00 54.79 52.10 2dzm n ASP 27 Cb 0.56 -0.55 -0.08 0.00 -1.14 0.00 0.00 41.12 39.91 2dzm n ASP 27 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2dzm n THR 28 N 0.16 0.42 -1.65 2.12 -2.24 -1.26 -2.54 114.28 109.29 2dzm n THR 28 Ca 0.08 -0.36 -0.33 0.00 -2.27 0.00 0.00 64.05 61.17 2dzm n THR 28 Cb 0.58 -0.33 0.06 0.00 -2.10 0.00 0.00 70.33 68.54 2dzm n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dzm s THR 30 N -2.33 4.52 0.58 0.00 2.01 -1.26 -3.05 115.64 116.11 2dzm s THR 30 Ca 0.68 1.32 0.33 0.00 0.31 0.00 0.00 61.69 64.33 2dzm s THR 30 Cb -0.22 -3.82 0.48 0.00 0.01 0.00 0.00 72.50 68.96 2dzm s THR 30 CO 0.43 0.08 1.68 -0.37 -0.69 0.00 0.00 174.62 175.76 2dzm h VAL 31 N 2.51 0.25 -0.38 3.82 -1.51 -0.84 0.57 116.25 120.66 2dzm h VAL 31 Ca -0.48 0.00 -0.09 0.00 -1.23 0.00 0.00 66.70 64.90 2dzm h VAL 31 Cb 1.19 0.33 -0.02 0.00 -2.13 0.00 0.00 31.29 30.66 2dzm h VAL 31 CO 0.65 0.00 -0.15 1.23 -1.23 0.00 0.00 177.57 178.07 2dzm h GLY 32 N 0.00 0.75 -0.01 5.19 0.00 -1.77 -3.24 103.07 103.98 2dzm h GLY 32 Ca 0.48 -0.57 0.02 0.00 0.00 0.00 0.00 47.33 47.26 2dzm h GLY 32 CO -0.01 0.52 -0.51 -2.09 0.00 0.00 0.00 176.54 174.46 2dzm h GLU 33 N 0.62 -0.61 -0.73 4.80 4.57 -0.18 -1.16 114.58 121.89 2dzm h GLU 33 Ca 0.10 0.04 0.26 0.00 -1.18 0.00 0.00 59.36 58.58 2dzm h GLU 33 Cb 0.60 0.14 -0.13 0.00 -0.16 0.00 0.00 28.75 29.20 2dzm h GLU 33 CO 0.04 -0.41 0.22 -0.89 -1.18 0.00 0.00 179.01 176.80 2dzm n ILE 34 N -5.29 -0.31 0.30 2.32 5.41 -1.22 0.03 119.36 120.60 2dzm n ILE 34 Ca -0.07 1.54 -0.13 0.00 1.00 0.00 0.00 62.75 65.09 2dzm n ILE 34 Cb 0.37 -2.38 -0.06 0.00 -0.71 0.00 0.00 39.64 36.86 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 -0.78 -0.81 0.38 1.57 -1.35 -1.71 116.57 113.86 2dzm h LYS 35 Ca 0.54 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.46 2dzm h LYS 35 Cb 1.31 0.18 -0.05 0.00 0.08 0.00 0.00 32.23 33.74 2dzm h LYS 35 CO -0.62 -0.52 0.53 0.37 -0.57 0.00 0.00 179.45 178.64 2dzm h GLN 36 N -0.81 0.77 -0.70 3.15 4.15 -0.32 -1.67 115.11 119.67 2dzm h GLN 36 Ca -0.07 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.36 2dzm h GLN 36 Cb 0.64 -0.17 -0.06 0.00 0.21 0.00 0.00 27.48 28.10 2dzm h GLN 36 CO 0.09 0.51 0.40 0.82 -1.93 0.00 0.00 178.83 178.71 2dzm h ILE 37 N 0.79 0.97 -0.05 2.39 2.04 -0.40 0.03 117.51 123.28 2dzm h ILE 37 Ca 0.37 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 65.99 2dzm h ILE 37 Cb 0.38 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 2dzm h ILE 37 CO -0.14 0.13 0.07 -0.07 0.00 0.00 0.00 178.15 178.14 2dzm h LEU 38 N 0.73 0.00 -0.09 1.44 3.38 -0.36 0.23 115.31 120.65 2dzm h LEU 38 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2dzm h LEU 38 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2dzm h LEU 38 CO -0.19 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.55 2dzm n GLU 39 N -3.66 0.10 0.00 1.13 2.13 -0.01 0.05 120.64 120.38 2dzm n GLU 39 Ca -0.02 0.16 0.11 0.00 0.66 0.00 0.00 57.16 58.07 2dzm n GLU 39 Cb 0.16 -1.64 0.05 0.00 0.27 0.00 0.00 31.44 30.28 2dzm n GLU 39 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2dzm n ASN 40 N -1.81 0.95 -0.01 4.31 3.02 0.82 -2.58 115.26 119.95 2dzm n ASN 40 Ca 0.05 -0.80 -0.01 0.00 -0.03 0.00 0.00 54.58 53.79 2dzm n ASN 40 Cb 0.32 0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 40.12 2dzm n ASN 40 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2dzm n GLU 41 N -1.28 0.06 0.00 3.52 -0.58 -1.09 -4.73 120.64 116.54 2dzm n GLU 41 Ca 0.06 0.01 0.09 0.00 -0.42 0.00 0.00 57.16 56.90 2dzm n GLU 41 Cb 0.35 -1.04 -0.05 0.00 -0.57 0.00 0.00 31.44 30.13 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 -2.55 1.43 -3.02 -4.62 4.77 0.11 -4.95 117.00 108.16 2dzm n LEU 42 Ca -0.03 -0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 55.08 2dzm n LEU 42 Cb 0.54 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.65 2dzm n LEU 42 CO 0.02 0.29 -0.03 0.00 -1.33 0.00 0.00 177.39 176.34 2dzm n GLN 43 N -0.70 -4.32 -4.37 3.23 3.00 -1.07 -4.96 117.38 108.19 2dzm n GLN 43 Ca 0.06 0.83 -0.34 0.00 -0.01 0.00 0.00 57.00 57.53 2dzm n GLN 43 Cb 0.36 -5.64 -0.10 0.00 0.00 0.00 0.00 30.24 24.86 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 -3.11 4.20 -0.09 5.09 1.01 -1.26 -4.98 121.20 122.06 2dzm s ILE 44 Ca 0.29 -0.28 -0.30 0.00 0.00 0.00 0.00 60.65 60.37 2dzm s ILE 44 Cb -0.13 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 2dzm s ILE 44 CO 0.36 0.56 1.52 -2.16 0.00 0.00 0.00 174.94 175.22 2dzm s PRO 45 N -0.45 4.19 0.62 2.79 0.04 -1.26 -3.83 135.00 137.10 2dzm s PRO 45 Ca 0.08 2.00 0.25 0.00 0.04 0.00 0.00 61.00 63.37 2dzm s PRO 45 Cb -0.12 -3.91 1.11 0.00 0.04 0.00 0.00 34.50 31.61 2dzm s PRO 45 CO 0.02 -0.81 1.56 0.28 0.04 0.00 0.00 177.00 178.09 2dzm h VAL 46 N 5.56 0.13 -0.25 -0.36 2.07 -1.89 0.41 116.25 121.92 2dzm h VAL 46 Ca -0.35 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2dzm h VAL 46 Cb 1.15 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2dzm h VAL 46 CO 0.96 0.00 0.00 0.28 0.02 0.00 0.00 177.57 178.83 2dzm h SER 47 N 0.00 0.44 1.36 0.57 0.02 -1.98 -2.99 113.55 110.97 2dzm h SER 47 Ca 0.27 -0.31 -0.08 0.00 -0.84 0.00 0.00 61.79 60.83 2dzm h SER 47 Cb 1.89 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 64.30 2dzm h SER 47 CO -0.00 0.63 -0.39 0.11 -1.14 0.00 0.00 176.83 176.04 2dzm h LYS 48 N 0.22 0.00 -6.73 3.45 1.79 -0.60 -3.45 116.57 111.25 2dzm h LYS 48 Ca 0.07 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 58.05 2dzm h LYS 48 Cb 0.41 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.03 2dzm h LYS 48 CO 0.01 0.39 0.14 -1.64 -1.08 0.00 0.00 179.45 177.27 2dzm s MET 49 N -3.19 4.13 -0.31 3.15 -1.94 -0.69 -4.25 119.30 116.20 2dzm s MET 49 Ca 0.03 0.82 0.00 0.00 -1.71 0.00 0.00 55.69 54.83 2dzm s MET 49 Cb 0.08 -2.54 0.10 0.00 2.01 0.00 0.00 34.83 34.48 2dzm s MET 49 CO 0.71 0.20 0.09 -0.51 -0.01 0.00 0.00 175.02 175.50 2dzm s LEU 50 N -2.68 2.67 -0.13 -0.03 1.43 -1.24 -4.85 118.68 113.86 2dzm s LEU 50 Ca 0.52 -1.72 -0.29 0.00 -1.03 0.00 0.00 54.13 51.60 2dzm s LEU 50 Cb -0.12 -1.00 -0.06 0.00 0.03 0.00 0.00 46.19 45.04 2dzm s LEU 50 CO 0.18 -0.41 2.02 -0.22 0.23 0.00 0.00 176.35 178.16 2dzm s LEU 51 N 1.49 3.88 0.31 1.79 1.98 -1.26 -3.84 118.68 123.04 2dzm s LEU 51 Ca 0.10 2.12 0.04 0.00 -2.89 0.00 0.00 54.13 53.50 2dzm s LEU 51 Cb -0.18 -3.52 -0.04 0.00 0.66 0.00 0.00 46.19 43.12 2dzm s LEU 51 CO -0.22 -1.51 0.17 -0.54 -1.89 0.00 0.00 176.35 172.35 2dzm s LYS 52 N 5.38 1.63 0.00 1.98 1.02 -1.22 -4.91 119.74 123.62 2dzm s LYS 52 Ca 0.91 -1.94 0.00 0.00 0.02 0.00 0.00 55.97 54.96 2dzm s LYS 52 Cb -0.35 -0.11 0.00 0.00 -0.52 0.00 0.00 37.83 36.85 2dzm s LYS 52 CO 0.37 -0.47 0.00 0.41 -0.92 0.00 0.00 175.35 174.74 2dzm n GLY 53 N -0.61 1.98 2.41 -3.33 0.00 -1.26 -3.74 105.19 100.63 2dzm n GLY 53 Ca 0.01 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 2dzm n GLY 53 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2dzm n TRP 54 N 0.00 -0.04 0.08 1.61 7.02 -1.26 -4.84 117.44 120.01 2dzm n TRP 54 Ca 0.00 0.70 -0.13 0.00 -1.02 0.00 0.00 57.50 57.05 2dzm n TRP 54 Cb 0.00 -1.41 -0.08 0.00 -2.42 0.00 0.00 31.31 27.41 2dzm n TRP 54 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 2dzm h LYS 55 N 1.24 -0.13 -6.14 -0.99 1.79 -2.01 -3.39 116.57 106.94 2dzm h LYS 55 Ca -0.26 0.01 -0.60 0.00 -2.18 0.00 0.00 60.65 57.62 2dzm h LYS 55 Cb 1.01 0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 31.58 2dzm h LYS 55 CO 0.42 -0.01 0.60 -0.08 -1.08 0.00 0.00 179.45 179.30 2dzm s THR 56 N -5.79 4.44 0.00 -0.16 -1.32 -1.26 -4.95 115.64 106.60 2dzm s THR 56 Ca -0.14 0.69 0.00 0.00 -1.21 0.00 0.00 61.69 61.03 2dzm s THR 56 Cb 0.05 -4.46 0.00 0.00 -1.51 0.00 0.00 72.50 66.57 2dzm s THR 56 CO 0.65 -0.90 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 2dzm n GLY 57 N 4.97 1.62 2.98 6.08 0.00 -1.26 -3.97 105.19 115.61 2dzm n GLY 57 Ca 0.06 0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.77 3.77 0.52 1.61 1.01 -1.26 -4.57 116.67 114.98 2dzm s ASP 58 Ca 0.00 -1.10 -0.21 0.00 0.71 0.00 0.00 52.55 51.95 2dzm s ASP 58 Cb 0.00 -1.26 -0.06 0.00 1.01 0.00 0.00 42.92 42.61 2dzm s ASP 58 CO 0.00 -0.19 1.18 -0.69 0.21 0.00 0.00 175.17 175.68 2dzm s VAL 59 N 1.35 2.94 -0.01 -1.27 1.01 -1.25 -5.03 120.40 118.13 2dzm s VAL 59 Ca -0.05 0.64 -0.05 0.00 0.00 0.00 0.00 61.98 62.53 2dzm s VAL 59 Cb -0.18 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 2dzm s VAL 59 CO -0.07 -0.07 0.22 -1.83 0.00 0.00 0.00 175.10 173.36 2dzm s GLU 60 N -3.00 3.51 0.59 2.72 -1.05 -1.26 -4.96 118.70 115.25 2dzm s GLU 60 Ca 0.70 -0.18 0.23 0.00 -0.15 0.00 0.00 54.97 55.56 2dzm s GLU 60 Cb -0.29 -3.10 1.24 0.00 -0.44 0.00 0.00 34.13 31.55 2dzm s GLU 60 CO 0.33 0.67 1.67 0.38 0.95 0.00 0.00 175.26 179.27 2dzm h ASP 61 N 4.00 0.00 -0.08 0.83 2.03 -1.96 0.41 116.42 121.65 2dzm h ASP 61 Ca -0.50 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.80 2dzm h ASP 61 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2dzm h ASP 61 CO 0.67 0.00 0.00 -1.54 -1.03 0.00 0.00 179.24 177.34 2dzm n SER 62 N -2.65 1.37 -4.60 4.15 3.41 -1.26 -3.59 113.62 110.45 2dzm n SER 62 Ca -0.02 -2.10 -0.30 0.00 -0.26 0.00 0.00 58.87 56.20 2dzm n SER 62 Cb 0.44 -0.41 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 2dzm n SER 62 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2dzm s THR 63 N -1.40 3.50 -0.07 6.66 2.01 0.14 -5.03 115.64 121.45 2dzm s THR 63 Ca 0.07 -1.20 -0.01 0.00 0.31 0.00 0.00 61.69 60.87 2dzm s THR 63 Cb 0.05 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 2dzm s THR 63 CO 0.03 0.13 -0.00 0.54 -0.69 0.00 0.00 174.62 174.62 2dzm s VAL 64 N -1.22 4.23 0.11 3.82 0.11 -1.26 -0.30 120.40 125.89 2dzm s VAL 64 Ca 0.22 -0.32 -0.31 0.00 -2.93 0.00 0.00 61.98 58.64 2dzm s VAL 64 Cb -0.11 -2.79 -0.11 0.00 -1.53 0.00 0.00 36.38 31.83 2dzm s VAL 64 CO 0.14 0.57 1.50 -0.07 -3.33 0.00 0.00 175.10 173.91 2dzm h LEU 65 N 5.03 -1.62 -1.08 2.54 3.38 -1.78 0.30 115.31 122.07 2dzm h LEU 65 Ca -0.50 0.20 0.31 0.00 0.09 0.00 0.00 57.88 57.98 2dzm h LEU 65 Cb 1.19 0.64 -0.04 0.00 0.09 0.00 0.00 40.66 42.53 2dzm h LEU 65 CO 0.55 -0.42 1.23 2.29 0.09 0.00 0.00 178.44 182.17 2dzm n LYS 66 N -5.17 0.01 -0.06 1.13 2.85 -1.05 0.17 118.16 116.04 2dzm n LYS 66 Ca -0.05 1.02 -0.14 0.00 -1.05 0.00 0.00 58.31 58.09 2dzm n LYS 66 Cb 0.34 -2.52 -0.07 0.00 -0.65 0.00 0.00 35.03 32.13 2dzm n LYS 66 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2dzm h SER 67 N 0.00 0.50 0.85 -5.58 0.87 -0.72 -3.13 113.55 106.34 2dzm h SER 67 Ca 0.51 -0.51 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2dzm h SER 67 Cb 2.97 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 64.79 2dzm h SER 67 CO -0.01 0.91 -0.38 0.18 -0.53 0.00 0.00 176.83 177.01 2dzm n LEU 68 N -4.44 0.51 -4.04 2.23 4.77 0.46 -4.96 117.00 111.52 2dzm n LEU 68 Ca -0.06 0.25 -0.35 0.00 -0.03 0.00 0.00 56.01 55.82 2dzm n LEU 68 Cb 0.42 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 2dzm n LEU 68 CO 0.42 -0.00 -0.25 1.41 -1.33 0.00 0.00 177.39 177.63 2dzm n HIS 69 N -1.80 -1.51 -1.57 -1.77 8.25 0.29 -4.82 115.22 112.29 2dzm n HIS 69 Ca 0.05 0.44 -0.40 0.00 -0.26 0.00 0.00 57.72 57.55 2dzm n HIS 69 Cb 0.38 -3.13 0.02 0.00 1.12 0.00 0.00 29.99 28.39 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 -4.63 2.29 -4.77 2.41 7.99 -1.26 -4.94 117.00 114.08 2dzm n LEU 70 Ca -0.21 0.92 -0.32 0.00 -0.01 0.00 0.00 56.01 56.38 2dzm n LEU 70 Cb 0.63 -1.31 0.06 0.00 -0.11 0.00 0.00 43.42 42.69 2dzm n LEU 70 CO 0.76 -1.96 0.73 -2.16 -1.51 0.00 0.00 177.39 173.25 2dzm s PRO 71 N -2.14 2.66 0.24 3.23 0.04 -1.26 -4.93 135.00 132.83 2dzm s PRO 71 Ca 0.67 1.33 -0.16 0.00 0.04 0.00 0.00 61.00 62.88 2dzm s PRO 71 Cb -0.51 -1.94 0.27 0.00 0.04 0.00 0.00 34.50 32.36 2dzm s PRO 71 CO 0.54 -1.35 1.55 -0.22 0.04 0.00 0.00 177.00 177.56 2dzm h LYS 72 N -0.28 -0.00 -5.07 4.56 3.64 -1.94 -3.33 116.57 114.15 2dzm h LYS 72 Ca -0.46 0.00 -0.64 0.00 -1.27 0.00 0.00 60.65 58.28 2dzm h LYS 72 Cb 1.24 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.91 2dzm h LYS 72 CO 0.53 -0.00 -0.26 0.54 -2.27 0.00 0.00 179.45 177.99 2dzm s ASN 73 N -5.34 6.21 0.16 4.20 4.22 -1.26 -2.93 114.94 120.20 2dzm s ASN 73 Ca -0.14 0.05 0.11 0.00 -2.14 0.00 0.00 52.86 50.74 2dzm s ASN 73 Cb 0.21 -2.20 -0.04 0.00 1.28 0.00 0.00 41.25 40.50 2dzm s ASN 73 CO 0.72 -0.25 -0.25 0.20 -2.04 0.00 0.00 177.10 175.48 2dzm s ASN 74 N 1.69 3.41 -0.24 3.54 0.01 0.76 -5.01 114.94 119.11 2dzm s ASN 74 Ca 0.13 -0.80 -0.03 0.00 -0.71 0.00 0.00 52.86 51.46 2dzm s ASN 74 Cb -0.16 -0.26 0.10 0.00 0.41 0.00 0.00 41.25 41.35 2dzm s ASN 74 CO 0.11 0.15 0.23 -0.94 -1.51 0.00 0.00 177.10 175.14 2dzm s SER 75 N -2.37 1.74 0.55 -1.22 1.04 -1.26 -1.63 113.70 110.54 2dzm s SER 75 Ca 0.18 -0.50 0.05 0.00 0.48 0.00 0.00 55.95 56.15 2dzm s SER 75 Cb -0.09 0.32 0.05 0.00 0.10 0.00 0.00 66.02 66.39 2dzm s SER 75 CO 0.08 -0.36 0.39 0.18 0.98 0.00 0.00 173.24 174.51 2dzm n LEU 76 N 5.31 0.00 -3.64 2.42 4.77 0.37 -4.88 117.00 121.34 2dzm n LEU 76 Ca -0.05 -2.92 -0.15 0.00 -0.03 0.00 0.00 56.01 52.86 2dzm n LEU 76 Cb 0.48 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.47 2dzm n LEU 76 CO 0.06 -0.58 0.25 -0.72 -1.33 0.00 0.00 177.39 175.06 2dzm s TYR 77 N -2.77 -0.48 0.02 -1.77 1.13 -1.25 -0.27 117.35 111.96 2dzm s TYR 77 Ca 0.30 0.90 0.06 0.00 -1.41 0.00 0.00 57.07 56.92 2dzm s TYR 77 Cb -0.02 0.25 -0.03 0.00 -1.10 0.00 0.00 41.96 41.06 2dzm s TYR 77 CO 0.19 -0.46 -0.14 0.08 -2.51 0.00 0.00 175.55 172.70 2dzm s VAL 78 N -0.91 3.05 -0.15 -3.49 1.01 -1.12 -3.37 120.40 115.43 2dzm s VAL 78 Ca -0.09 -1.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.85 2dzm s VAL 78 Cb -0.03 -2.29 0.05 0.00 0.00 0.00 0.00 36.38 34.11 2dzm s VAL 78 CO 0.06 0.38 0.00 -0.76 0.00 0.00 0.00 175.10 174.79 2dzm s LEU 79 N -1.34 1.10 -0.63 3.92 1.43 -1.25 -4.55 118.68 117.37 2dzm s LEU 79 Ca 0.15 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.57 2dzm s LEU 79 Cb -0.11 -0.62 0.16 0.00 0.03 0.00 0.00 46.19 45.65 2dzm s LEU 79 CO 0.05 -0.24 0.54 0.42 0.23 0.00 0.00 176.35 177.35 2dzm s THR 80 N 1.84 4.94 0.02 5.49 -4.23 -1.26 -3.61 115.64 118.83 2dzm s THR 80 Ca 0.01 -2.04 -0.22 0.00 -1.18 0.00 0.00 61.69 58.27 2dzm s THR 80 Cb -0.15 -4.15 -0.16 0.00 1.34 0.00 0.00 72.50 69.38 2dzm s THR 80 CO -0.07 -0.90 1.33 1.55 -0.54 0.00 0.00 174.62 175.99 2dzm h PRO 81 N 8.23 0.27 0.45 3.99 0.13 -1.99 -3.35 132.00 139.72 2dzm h PRO 81 Ca -0.12 -0.14 -0.02 0.00 -0.87 0.00 0.00 66.00 64.85 2dzm h PRO 81 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2dzm h PRO 81 CO 0.87 0.67 -0.22 -0.44 -0.23 0.00 0.00 178.00 178.66 2dzm h ASP 82 N -0.13 -0.51 -1.35 1.44 5.19 -1.91 -3.44 116.42 115.70 2dzm h ASP 82 Ca 0.02 -0.02 -0.77 0.00 -0.62 0.00 0.00 57.03 55.64 2dzm h ASP 82 Cb 0.62 0.13 0.03 0.00 0.18 0.00 0.00 39.33 40.29 2dzm h ASP 82 CO 0.03 -0.09 0.60 -0.11 -3.12 0.00 0.00 179.24 176.54 2dzm n LEU 83 N -5.18 1.50 -4.68 1.55 7.94 -1.26 -4.92 117.00 111.95 2dzm n LEU 83 Ca -0.08 1.13 -0.29 0.00 -1.11 0.00 0.00 56.01 55.66 2dzm n LEU 83 Cb 0.26 -1.05 0.17 0.00 0.53 0.00 0.00 43.42 43.33 2dzm n LEU 83 CO 0.21 -0.94 0.65 -2.16 -1.11 0.00 0.00 177.39 174.03 2dzm s PRO 84 N 2.06 0.58 -0.26 1.96 0.04 -1.26 -4.92 135.00 133.20 2dzm s PRO 84 Ca 0.95 0.58 -0.29 0.00 0.04 0.00 0.00 61.00 62.29 2dzm s PRO 84 Cb -1.18 -1.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.59 2dzm s PRO 84 CO 0.64 -2.64 1.64 -1.25 0.04 0.00 0.00 177.00 175.42 2dzm s PRO 85 N -4.96 3.68 -1.05 0.56 0.04 -1.26 -4.92 135.00 127.09 2dzm s PRO 85 Ca 0.65 1.55 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 2dzm s PRO 85 Cb -0.18 -4.07 -0.07 0.00 0.04 0.00 0.00 34.50 30.22 2dzm s PRO 85 CO 0.57 -1.44 1.94 -1.25 0.04 0.00 0.00 177.00 176.87 2dzm s PRO 86 N 4.91 2.51 -0.61 0.56 0.04 -1.26 -4.77 135.00 136.38 2dzm s PRO 86 Ca 0.72 -0.75 0.00 0.00 0.04 0.00 0.00 61.00 61.02 2dzm s PRO 86 Cb -0.23 -5.16 0.43 0.00 0.04 0.00 0.00 34.50 29.58 2dzm s PRO 86 CO 0.30 -3.71 1.79 0.45 0.04 0.00 0.00 177.00 175.88 2dzm n SER 87 N 14.23 6.88 -3.67 6.66 2.88 -1.26 -4.91 113.62 134.42 2dzm n SER 87 Ca 0.43 -3.79 -0.09 0.00 -1.33 0.00 0.00 58.87 54.09 2dzm n SER 87 Cb 0.47 -0.83 -0.09 0.00 -0.75 0.00 0.00 64.21 63.01 2dzm n SER 87 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dzm s SER 88 N -2.18 -0.65 -0.53 -3.46 0.01 -1.26 -5.09 113.70 100.54 2dzm s SER 88 Ca 0.58 1.14 -0.36 0.00 1.31 0.00 0.00 55.95 58.62 2dzm s SER 88 Cb 0.47 1.13 -0.17 0.00 0.21 0.00 0.00 66.02 67.66 2dzm s SER 88 CO -0.10 -0.21 1.97 -1.20 0.41 0.00 0.00 173.24 174.11 2dzm n SER 89 N 4.51 0.57 -4.91 2.44 7.64 -1.26 -4.88 113.62 117.73 2dzm n SER 89 Ca -0.20 0.50 -0.27 0.00 1.01 0.00 0.00 58.87 59.91 2dzm n SER 89 Cb 0.55 -0.79 0.05 0.00 -1.01 0.00 0.00 64.21 63.01 2dzm n SER 89 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dzm s SER 90 N 5.80 5.31 0.20 6.43 1.04 -1.26 -5.08 113.70 126.14 2dzm s SER 90 Ca 1.08 0.72 -0.04 0.00 0.48 0.00 0.00 55.95 58.19 2dzm s SER 90 Cb -1.26 -1.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.23 2dzm s SER 90 CO 0.54 -1.29 0.43 -1.00 0.98 0.00 0.00 173.24 172.91 2dzm s HIS 91 N -3.15 3.47 -0.18 5.02 3.76 -1.26 -5.09 115.29 117.87 2dzm s HIS 91 Ca 0.57 0.53 -0.12 0.00 -0.15 0.00 0.00 55.06 55.89 2dzm s HIS 91 Cb -0.11 -2.00 -0.05 0.00 1.11 0.00 0.00 32.58 31.54 2dzm s HIS 91 CO 0.46 0.35 0.21 0.00 -0.85 0.00 0.00 174.74 174.91 2dzm s ALA 92 N -1.83 3.65 1.00 -1.40 0.00 -1.26 -5.03 121.76 116.89 2dzm s ALA 92 Ca 0.41 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.80 2dzm s ALA 92 Cb -0.11 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.74 2dzm s ALA 92 CO 0.27 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.59 2dzm n GLY 93 N 3.37 -2.25 3.76 0.00 0.00 -1.26 -4.98 105.19 103.83 2dzm n GLY 93 Ca -0.14 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.89 3.33 -0.25 4.61 0.00 -1.26 -4.97 121.76 120.32 2dzm s ALA 94 Ca 0.00 0.65 0.19 0.00 0.00 0.00 0.00 51.96 52.80 2dzm s ALA 94 Cb 0.00 -3.23 0.49 0.00 0.00 0.00 0.00 23.12 20.39 2dzm s ALA 94 CO 0.00 0.14 1.14 1.47 0.00 0.00 0.00 175.76 178.50 2dzm n LEU 95 N 1.28 2.37 -0.08 0.00 -0.00 -1.26 -4.79 117.00 114.52 2dzm n LEU 95 Ca -0.01 -3.39 -0.14 0.00 -0.00 0.00 0.00 56.01 52.46 2dzm n LEU 95 Cb 0.47 0.23 -0.06 0.00 -0.00 0.00 0.00 43.42 44.06 2dzm n LEU 95 CO 0.50 1.27 -1.03 0.00 -0.00 0.00 0.00 177.39 178.13 2dzm n GLN 96 N -0.57 0.36 -0.04 1.47 10.64 -1.26 -4.76 117.38 123.21 2dzm n GLN 96 Ca 0.16 0.12 -0.11 0.00 -1.83 0.00 0.00 57.00 55.34 2dzm n GLN 96 Cb 0.86 -1.19 -0.10 0.00 -0.86 0.00 0.00 30.24 28.96 2dzm n GLN 96 CO 0.00 0.00 0.00 0.93 -1.83 0.00 0.00 177.06 176.16 2dzm h GLU 97 N -0.30 -0.03 -5.43 2.61 4.39 -2.03 -3.42 114.58 110.37 2dzm h GLU 97 Ca -0.37 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 58.98 2dzm h GLU 97 Cb 1.44 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.08 2dzm h GLU 97 CO -0.15 0.66 1.28 0.43 -1.16 0.00 0.00 179.01 180.07 2dzm n SER 98 N -4.71 1.71 0.09 1.42 7.64 -1.26 -4.73 113.62 113.77 2dzm n SER 98 Ca -0.08 -0.67 0.06 0.00 1.01 0.00 0.00 58.87 59.19 2dzm n SER 98 Cb 0.34 -1.46 0.30 0.00 -1.01 0.00 0.00 64.21 62.38 2dzm n SER 98 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dzm n LEU 99 N 15.35 0.28 0.00 -3.43 -0.00 -1.26 -4.96 117.00 122.98 2dzm n LEU 99 Ca 0.45 0.58 0.00 0.00 -0.00 0.00 0.00 56.01 57.04 2dzm n LEU 99 Cb 0.43 -0.60 0.00 0.00 -0.00 0.00 0.00 43.42 43.25 2dzm n LEU 99 CO 0.72 -0.68 0.00 -3.20 -0.00 0.00 0.00 177.39 174.23