#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 6.03 1.20 1.61 1.04 -1.26 -4.99 113.70 117.34 2dzm s SER 2 Ca 0.00 0.79 -0.16 0.00 0.48 0.00 0.00 55.95 57.06 2dzm s SER 2 Cb 0.00 -2.54 0.25 0.00 0.10 0.00 0.00 66.02 63.83 2dzm s SER 2 CO 0.00 -1.69 0.63 -1.20 0.98 0.00 0.00 173.24 171.96 2dzm n SER 3 N 9.90 -2.38 -4.34 7.02 7.64 -1.26 -4.92 113.62 125.27 2dzm n SER 3 Ca 0.18 -0.28 -0.46 0.00 1.01 0.00 0.00 58.87 59.32 2dzm n SER 3 Cb 0.48 -1.10 -0.03 0.00 -1.01 0.00 0.00 64.21 62.56 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 -2.26 2.37 -0.08 0.23 0.00 -1.26 -5.03 107.32 101.29 2dzm s GLY 4 Ca 0.63 -2.99 -0.01 0.00 0.00 0.00 0.00 44.72 42.35 2dzm s GLY 4 CO 0.63 1.37 -0.01 -1.35 0.00 0.00 0.00 173.10 173.74 2dzm s SER 5 N 2.77 5.10 0.42 1.64 1.04 -1.26 -5.09 113.70 118.32 2dzm s SER 5 Ca 0.16 0.10 -0.25 0.00 0.48 0.00 0.00 55.95 56.45 2dzm s SER 5 Cb -0.15 -1.40 -0.08 0.00 0.10 0.00 0.00 66.02 64.49 2dzm s SER 5 CO -0.05 0.37 1.20 -0.55 0.98 0.00 0.00 173.24 175.19 2dzm s SER 6 N -0.90 6.33 0.09 7.02 0.15 -1.26 -5.02 113.70 120.10 2dzm s SER 6 Ca 0.13 2.41 -0.02 0.00 0.70 0.00 0.00 55.95 59.18 2dzm s SER 6 Cb -0.11 -2.62 0.01 0.00 -1.71 0.00 0.00 66.02 61.59 2dzm s SER 6 CO 0.02 -0.82 0.15 0.61 1.20 0.00 0.00 173.24 174.41 2dzm n GLY 7 N 0.59 2.33 2.86 9.45 0.00 -1.26 -5.16 105.19 114.01 2dzm n GLY 7 Ca 0.05 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.10 -0.00 0.23 1.61 1.70 -1.26 -5.12 118.95 114.01 2dzm s ARG 8 Ca 0.05 0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.04 2dzm s ARG 8 Cb -0.01 -0.02 -0.09 0.00 -0.57 0.00 0.00 34.95 34.26 2dzm s ARG 8 CO 0.04 -0.02 1.07 -1.64 -1.08 0.00 0.00 175.30 173.67 2dzm s MET 9 N 0.11 4.66 -0.26 3.89 -1.94 -1.26 -3.93 119.30 120.57 2dzm s MET 9 Ca -0.01 1.72 -0.04 0.00 -1.71 0.00 0.00 55.69 55.65 2dzm s MET 9 Cb -0.01 -3.24 0.01 0.00 2.01 0.00 0.00 34.83 33.60 2dzm s MET 9 CO -0.00 0.21 -0.01 -0.51 -0.01 0.00 0.00 175.02 174.69 2dzm s LEU 10 N -0.96 3.34 0.06 -0.03 1.43 -1.16 -4.97 118.68 116.40 2dzm s LEU 10 Ca 0.46 -0.71 -0.28 0.00 -1.03 0.00 0.00 54.13 52.57 2dzm s LEU 10 Cb -0.30 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 2dzm s LEU 10 CO 0.37 -0.12 0.88 -0.62 0.23 0.00 0.00 176.35 177.09 2dzm s ASP 11 N 1.42 7.35 -0.25 2.29 -1.08 -1.18 -3.02 116.67 122.20 2dzm s ASP 11 Ca 0.02 1.62 -0.01 0.00 -0.52 0.00 0.00 52.55 53.66 2dzm s ASP 11 Cb -0.16 -2.53 0.08 0.00 -1.46 0.00 0.00 42.92 38.84 2dzm s ASP 11 CO -0.02 -0.07 0.05 -0.36 0.52 0.00 0.00 175.17 175.30 2dzm s PHE 12 N 0.15 1.49 -0.57 -5.34 0.40 0.03 -1.29 117.98 112.85 2dzm s PHE 12 Ca 0.44 -1.36 -0.24 0.00 -0.60 0.00 0.00 56.93 55.18 2dzm s PHE 12 Cb -0.22 -1.40 0.05 0.00 0.51 0.00 0.00 43.02 41.96 2dzm s PHE 12 CO 0.27 -0.75 0.94 0.50 0.70 0.00 0.00 175.22 176.87 2dzm s ARG 13 N 1.70 3.28 -0.50 0.44 6.06 0.39 -1.52 118.95 128.80 2dzm s ARG 13 Ca 0.03 -0.39 -0.20 0.00 -2.50 0.00 0.00 55.73 52.67 2dzm s ARG 13 Cb -0.17 -4.09 0.05 0.00 0.06 0.00 0.00 34.95 30.80 2dzm s ARG 13 CO -0.16 -1.55 0.67 0.08 -2.50 0.00 0.00 175.30 171.84 2dzm s VAL 14 N 3.95 4.80 -0.55 7.11 1.01 -0.32 0.13 120.40 136.52 2dzm s VAL 14 Ca 0.28 -0.30 -0.26 0.00 0.00 0.00 0.00 61.98 61.70 2dzm s VAL 14 Cb -0.14 -4.32 0.03 0.00 0.00 0.00 0.00 36.38 31.96 2dzm s VAL 14 CO 0.17 -0.81 1.04 -0.70 0.00 0.00 0.00 175.10 174.80 2dzm s GLU 15 N 2.83 3.44 0.17 2.72 2.12 0.67 -2.02 118.70 128.63 2dzm s GLU 15 Ca 0.18 0.01 0.11 0.00 0.36 0.00 0.00 54.97 55.63 2dzm s GLU 15 Cb -0.18 -4.02 -0.04 0.00 0.26 0.00 0.00 34.13 30.15 2dzm s GLU 15 CO 0.14 -1.52 -0.24 -0.47 -0.54 0.00 0.00 175.26 172.62 2dzm s TYR 16 N 4.31 2.25 0.01 5.30 5.04 -0.42 -3.02 117.35 130.82 2dzm s TYR 16 Ca 0.36 -0.38 -0.02 0.00 -2.44 0.00 0.00 57.07 54.60 2dzm s TYR 16 Cb -0.10 -1.15 -0.01 0.00 0.35 0.00 0.00 41.96 41.05 2dzm s TYR 16 CO 0.23 0.43 0.70 0.54 -1.34 0.00 0.00 175.55 176.10 2dzm n ARG 17 N 0.51 -0.03 -0.33 4.97 1.74 -1.26 -0.26 116.66 122.00 2dzm n ARG 17 Ca -0.15 0.69 -0.10 0.00 -0.77 0.00 0.00 57.85 57.53 2dzm n ARG 17 Cb 0.55 -1.04 -0.08 0.00 -1.02 0.00 0.00 32.46 30.88 2dzm n ARG 17 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 2dzm h ASP 18 N 0.00 -1.94 -1.59 0.55 2.03 -1.97 -3.46 116.42 110.04 2dzm h ASP 18 Ca 0.01 0.30 0.19 0.00 -0.73 0.00 0.00 57.03 56.81 2dzm h ASP 18 Cb 0.03 0.86 -0.04 0.00 -0.83 0.00 0.00 39.33 39.35 2dzm h ASP 18 CO -0.07 -0.29 0.54 -2.11 -1.03 0.00 0.00 179.24 176.28 2dzm n ARG 19 N -5.32 0.21 -3.73 4.15 1.85 0.65 -5.14 116.66 109.33 2dzm n ARG 19 Ca 0.02 -0.65 -0.37 0.00 -1.00 0.00 0.00 57.85 55.85 2dzm n ARG 19 Cb 0.31 0.99 -0.12 0.00 -1.05 0.00 0.00 32.46 32.58 2dzm n ARG 19 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2dzm s ASN 20 N -2.81 5.25 0.17 2.89 4.22 -1.26 -1.30 114.94 122.10 2dzm s ASN 20 Ca 0.19 -0.48 0.04 0.00 -2.14 0.00 0.00 52.86 50.46 2dzm s ASN 20 Cb -0.01 -1.93 -0.04 0.00 1.28 0.00 0.00 41.25 40.55 2dzm s ASN 20 CO 0.01 -0.14 0.24 0.54 -2.04 0.00 0.00 177.10 175.71 2dzm s VAL 21 N 1.57 5.01 -0.13 3.54 0.11 -0.86 -4.90 120.40 124.74 2dzm s VAL 21 Ca 0.04 -0.88 -0.03 0.00 -2.93 0.00 0.00 61.98 58.18 2dzm s VAL 21 Cb -0.16 -3.60 -0.03 0.00 -1.53 0.00 0.00 36.38 31.06 2dzm s VAL 21 CO 0.04 -0.14 -0.03 -0.62 -3.33 0.00 0.00 175.10 171.02 2dzm s ASP 22 N -3.31 4.90 -0.01 3.54 2.15 -1.26 -1.18 116.67 121.50 2dzm s ASP 22 Ca 0.33 -0.05 0.08 0.00 0.43 0.00 0.00 52.55 53.33 2dzm s ASP 22 Cb -0.10 -1.66 -0.02 0.00 -0.30 0.00 0.00 42.92 40.84 2dzm s ASP 22 CO 0.27 0.23 -0.24 -0.69 -0.17 0.00 0.00 175.17 174.57 2dzm s VAL 23 N -0.01 1.92 -0.15 1.11 1.01 -0.57 -4.95 120.40 118.76 2dzm s VAL 23 Ca 0.01 -1.07 -0.00 0.00 0.00 0.00 0.00 61.98 60.93 2dzm s VAL 23 Cb -0.13 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.68 2dzm s VAL 23 CO 0.02 0.52 -0.09 -0.69 0.00 0.00 0.00 175.10 174.86 2dzm s VAL 24 N -0.59 1.26 -0.11 2.92 1.01 -1.26 -0.79 120.40 122.83 2dzm s VAL 24 Ca 0.09 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.42 2dzm s VAL 24 Cb -0.09 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 35.02 2dzm s VAL 24 CO -0.01 0.30 0.30 -1.48 0.00 0.00 0.00 175.10 174.21 2dzm s LEU 25 N 1.60 0.79 0.86 3.92 2.34 -1.17 -4.93 118.68 122.09 2dzm s LEU 25 Ca 0.03 0.60 -0.13 0.00 0.06 0.00 0.00 54.13 54.69 2dzm s LEU 25 Cb -0.14 1.01 0.05 0.00 -0.56 0.00 0.00 46.19 46.55 2dzm s LEU 25 CO -0.09 -0.11 0.73 1.21 -1.06 0.00 0.00 176.35 177.03 2dzm n GLU 26 N 3.08 -0.06 0.00 1.48 2.13 -1.26 -2.96 120.64 123.05 2dzm n GLU 26 Ca -0.14 0.04 0.09 0.00 0.66 0.00 0.00 57.16 57.81 2dzm n GLU 26 Cb 0.57 -2.07 0.53 0.00 0.27 0.00 0.00 31.44 30.75 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 -1.95 0.00 0.11 4.31 5.75 -1.25 -2.25 116.55 121.27 2dzm n ASP 27 Ca 0.10 -0.43 0.12 0.00 -0.01 0.00 0.00 54.79 54.57 2dzm n ASP 27 Cb 0.52 -0.07 0.16 0.00 -1.03 0.00 0.00 41.12 40.70 2dzm n ASP 27 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2dzm h THR 28 N 0.00 0.00 -4.18 2.12 1.35 -1.93 0.33 112.91 110.60 2dzm h THR 28 Ca 0.00 -0.72 -0.49 0.00 -0.55 0.00 0.00 66.41 64.65 2dzm h THR 28 Cb 0.04 1.42 0.05 0.00 -1.73 0.00 0.00 68.15 67.94 2dzm h THR 28 CO 0.00 0.00 0.38 0.00 -0.25 0.00 0.00 175.52 175.65 2dzm s THR 30 N -2.41 4.45 0.56 0.00 2.01 -1.26 -2.68 115.64 116.31 2dzm s THR 30 Ca 0.64 1.42 0.33 0.00 0.31 0.00 0.00 61.69 64.38 2dzm s THR 30 Cb -0.16 -3.79 0.48 0.00 0.01 0.00 0.00 72.50 69.05 2dzm s THR 30 CO 0.34 -0.02 1.80 -0.37 -0.69 0.00 0.00 174.62 175.68 2dzm h VAL 31 N 2.35 0.38 -0.56 3.82 -1.51 -0.85 0.27 116.25 120.15 2dzm h VAL 31 Ca -0.48 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 64.94 2dzm h VAL 31 Cb 1.19 0.45 -0.03 0.00 -2.13 0.00 0.00 31.29 30.77 2dzm h VAL 31 CO 0.64 0.00 0.14 1.23 -1.23 0.00 0.00 177.57 178.35 2dzm h GLY 32 N 0.00 0.93 -0.27 5.19 0.00 -1.79 -3.19 103.07 103.94 2dzm h GLY 32 Ca 0.44 -0.54 0.04 0.00 0.00 0.00 0.00 47.33 47.26 2dzm h GLY 32 CO -0.00 0.51 -0.51 0.83 0.00 0.00 0.00 176.54 177.36 2dzm h GLU 33 N 0.84 -0.42 -0.87 4.80 4.39 -0.79 0.59 114.58 123.11 2dzm h GLU 33 Ca 0.18 0.03 0.33 0.00 0.34 0.00 0.00 59.36 60.24 2dzm h GLU 33 Cb 0.30 0.10 -0.12 0.00 -0.10 0.00 0.00 28.75 28.93 2dzm h GLU 33 CO -0.00 -0.28 0.52 -0.89 -1.16 0.00 0.00 179.01 177.20 2dzm n ILE 34 N -5.18 -0.24 0.14 3.13 5.41 -1.20 -0.20 119.36 121.21 2dzm n ILE 34 Ca -0.04 1.40 -0.06 0.00 1.00 0.00 0.00 62.75 65.04 2dzm n ILE 34 Cb 0.33 -2.28 -0.03 0.00 -0.71 0.00 0.00 39.64 36.95 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 -0.36 -0.87 0.38 1.57 -1.03 -2.68 116.57 113.58 2dzm h LYS 35 Ca 0.63 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 59.58 2dzm h LYS 35 Cb 1.86 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 34.18 2dzm h LYS 35 CO -0.45 -0.24 0.57 0.37 -0.57 0.00 0.00 179.45 179.13 2dzm h GLN 36 N -0.46 0.62 -0.52 3.15 4.15 -0.50 -1.31 115.11 120.24 2dzm h GLN 36 Ca -0.04 -0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.42 2dzm h GLN 36 Cb 0.29 -0.14 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 2dzm h GLN 36 CO 0.06 0.41 0.17 0.82 -1.93 0.00 0.00 178.83 178.36 2dzm h ILE 37 N 0.64 0.79 -0.04 2.39 2.04 -0.57 0.11 117.51 122.87 2dzm h ILE 37 Ca 0.44 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 66.20 2dzm h ILE 37 Cb 0.77 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2dzm h ILE 37 CO -0.19 0.06 0.07 -0.07 0.00 0.00 0.00 178.15 178.02 2dzm h LEU 38 N 0.33 0.00 -0.08 1.44 3.38 -0.88 0.23 115.31 119.74 2dzm h LEU 38 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2dzm h LEU 38 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2dzm h LEU 38 CO -0.28 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.46 2dzm n GLU 39 N -3.48 0.26 0.00 1.13 2.13 0.38 0.34 120.64 121.41 2dzm n GLU 39 Ca -0.02 0.24 0.11 0.00 0.66 0.00 0.00 57.16 58.15 2dzm n GLU 39 Cb 0.15 -1.82 0.11 0.00 0.27 0.00 0.00 31.44 30.16 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 -2.27 0.70 -0.00 4.31 3.02 0.81 -2.23 115.26 119.59 2dzm n ASN 40 Ca 0.05 -0.54 -0.00 0.00 -0.03 0.00 0.00 54.58 54.06 2dzm n ASN 40 Cb 0.41 0.53 -0.00 0.00 -0.61 0.00 0.00 39.78 40.11 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 -1.49 2.65 0.00 3.52 -0.58 -1.15 -4.71 120.64 118.88 2dzm n GLU 41 Ca 0.05 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.86 2dzm n GLU 41 Cb 0.33 -1.01 0.03 0.00 -0.57 0.00 0.00 31.44 30.22 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 -2.18 1.80 -2.41 -4.62 4.77 0.15 -4.97 117.00 109.54 2dzm n LEU 42 Ca -0.01 -0.87 -0.14 0.00 -0.03 0.00 0.00 56.01 54.96 2dzm n LEU 42 Cb 0.52 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.60 2dzm n LEU 42 CO 0.01 0.34 -0.18 0.00 -1.33 0.00 0.00 177.39 176.23 2dzm n GLN 43 N 0.27 -2.08 -3.95 3.23 3.00 -0.95 -4.94 117.38 111.95 2dzm n GLN 43 Ca 0.07 0.70 -0.35 0.00 -0.01 0.00 0.00 57.00 57.40 2dzm n GLN 43 Cb 0.32 -5.30 -0.08 0.00 0.00 0.00 0.00 30.24 25.18 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 -2.70 5.09 -0.10 5.09 1.01 -1.25 -4.98 121.20 123.35 2dzm s ILE 44 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 60.65 60.42 2dzm s ILE 44 Cb 0.00 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 2dzm s ILE 44 CO 0.00 0.53 1.52 -2.16 0.00 0.00 0.00 174.94 174.83 2dzm s PRO 45 N -0.25 4.18 0.63 2.79 0.04 -1.26 -3.80 135.00 137.34 2dzm s PRO 45 Ca 0.09 1.99 0.23 0.00 0.04 0.00 0.00 61.00 63.35 2dzm s PRO 45 Cb -0.12 -3.92 1.12 0.00 0.04 0.00 0.00 34.50 31.62 2dzm s PRO 45 CO 0.01 -0.82 1.60 0.28 0.04 0.00 0.00 177.00 178.11 2dzm h VAL 46 N 5.57 0.11 -0.61 -0.36 2.07 -1.90 0.46 116.25 121.59 2dzm h VAL 46 Ca -0.35 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.09 2dzm h VAL 46 Cb 1.15 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2dzm h VAL 46 CO 0.96 0.00 0.06 0.28 0.02 0.00 0.00 177.57 178.89 2dzm h SER 47 N 0.00 1.00 1.49 0.57 0.02 -1.98 -2.86 113.55 111.79 2dzm h SER 47 Ca 0.16 -0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 60.76 2dzm h SER 47 Cb 1.55 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 2dzm h SER 47 CO -0.00 1.03 -0.53 0.11 -1.14 0.00 0.00 176.83 176.31 2dzm h LYS 48 N 0.94 0.00 -6.90 3.45 1.79 -0.48 -3.46 116.57 111.90 2dzm h LYS 48 Ca 0.18 0.00 -0.47 0.00 -2.18 0.00 0.00 60.65 58.18 2dzm h LYS 48 Cb 0.49 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.12 2dzm h LYS 48 CO 0.02 0.30 0.21 -1.64 -1.08 0.00 0.00 179.45 177.26 2dzm s MET 49 N -3.06 4.03 -0.31 3.15 -1.94 -0.89 -4.11 119.30 116.18 2dzm s MET 49 Ca 0.04 0.81 -0.01 0.00 -1.71 0.00 0.00 55.69 54.82 2dzm s MET 49 Cb 0.07 -2.31 0.10 0.00 2.01 0.00 0.00 34.83 34.70 2dzm s MET 49 CO 0.74 0.02 0.10 -0.51 -0.01 0.00 0.00 175.02 175.36 2dzm s LEU 50 N -3.31 1.96 0.07 -0.03 1.43 -1.23 -4.89 118.68 112.69 2dzm s LEU 50 Ca 0.57 -1.58 -0.30 0.00 -1.03 0.00 0.00 54.13 51.79 2dzm s LEU 50 Cb -0.10 -0.78 -0.09 0.00 0.03 0.00 0.00 46.19 45.25 2dzm s LEU 50 CO 0.20 -0.42 1.86 -0.22 0.23 0.00 0.00 176.35 178.00 2dzm s LEU 51 N 1.70 4.41 0.28 1.79 1.98 -1.26 -3.87 118.68 123.70 2dzm s LEU 51 Ca 0.10 2.67 -0.06 0.00 -2.89 0.00 0.00 54.13 53.94 2dzm s LEU 51 Cb -0.17 -3.55 -0.01 0.00 0.66 0.00 0.00 46.19 43.12 2dzm s LEU 51 CO -0.27 -1.01 0.41 -0.54 -1.89 0.00 0.00 176.35 173.05 2dzm s LYS 52 N 3.52 1.63 0.00 1.98 1.02 -1.25 -4.94 119.74 121.70 2dzm s LYS 52 Ca 0.83 -1.53 0.00 0.00 0.02 0.00 0.00 55.97 55.28 2dzm s LYS 52 Cb -0.43 0.42 0.00 0.00 -0.52 0.00 0.00 37.83 37.30 2dzm s LYS 52 CO 0.38 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.56 2dzm n GLY 53 N -0.44 0.80 2.30 -3.33 0.00 -1.26 -3.89 105.19 99.37 2dzm n GLY 53 Ca 0.00 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.87 -3.59 -0.03 1.61 7.02 -1.26 -4.88 117.44 113.45 2dzm n TRP 54 Ca 0.00 -0.65 -0.17 0.00 -1.02 0.00 0.00 57.50 55.66 2dzm n TRP 54 Cb 0.21 -0.75 -0.13 0.00 -2.42 0.00 0.00 31.31 28.22 2dzm n TRP 54 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 2dzm h LYS 55 N 0.00 0.11 -5.01 -0.99 3.64 -2.00 -3.45 116.57 108.88 2dzm h LYS 55 Ca -0.27 -0.20 -0.67 0.00 -1.27 0.00 0.00 60.65 58.25 2dzm h LYS 55 Cb 0.82 0.07 -0.32 0.00 -0.41 0.00 0.00 32.23 32.39 2dzm h LYS 55 CO 0.18 1.09 -0.80 -0.08 -2.27 0.00 0.00 179.45 177.57 2dzm s THR 56 N -2.31 2.59 0.00 1.00 -1.32 -1.26 -5.05 115.64 109.28 2dzm s THR 56 Ca -0.18 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.46 2dzm s THR 56 Cb -0.01 -2.17 0.00 0.00 -1.51 0.00 0.00 72.50 68.81 2dzm s THR 56 CO 0.74 0.43 0.00 0.61 -2.21 0.00 0.00 174.62 174.19 2dzm n GLY 57 N 4.68 1.72 3.26 6.08 0.00 -1.26 -3.95 105.19 115.71 2dzm n GLY 57 Ca -0.19 0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2dzm n GLY 57 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dzm s ASP 58 N -2.91 4.40 0.27 1.61 -4.77 -1.26 -4.43 116.67 109.58 2dzm s ASP 58 Ca 0.00 -0.66 -0.22 0.00 -3.30 0.00 0.00 52.55 48.37 2dzm s ASP 58 Cb 0.00 -1.72 -0.09 0.00 -1.09 0.00 0.00 42.92 40.02 2dzm s ASP 58 CO 0.00 -0.09 0.81 -0.69 0.70 0.00 0.00 175.17 175.90 2dzm s VAL 59 N 1.41 4.44 0.18 2.11 1.01 -1.25 -5.06 120.40 123.23 2dzm s VAL 59 Ca 0.03 1.47 -0.09 0.00 0.00 0.00 0.00 61.98 63.39 2dzm s VAL 59 Cb -0.16 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 2dzm s VAL 59 CO -0.03 0.15 0.50 -1.83 0.00 0.00 0.00 175.10 173.89 2dzm s GLU 60 N -2.08 3.79 0.08 2.72 -1.05 -1.26 -4.94 118.70 115.95 2dzm s GLU 60 Ca 0.47 0.22 0.05 0.00 -0.15 0.00 0.00 54.97 55.56 2dzm s GLU 60 Cb -0.17 -2.77 0.27 0.00 -0.44 0.00 0.00 34.13 31.02 2dzm s GLU 60 CO 0.22 0.40 1.13 -0.25 0.95 0.00 0.00 175.26 177.70 2dzm n ASP 61 N 0.17 0.13 -0.92 0.83 9.92 -1.26 -0.73 116.55 124.69 2dzm n ASP 61 Ca -0.02 0.54 0.04 0.00 -0.53 0.00 0.00 54.79 54.82 2dzm n ASP 61 Cb 0.52 -0.55 0.17 0.00 -0.64 0.00 0.00 41.12 40.62 2dzm n ASP 61 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2dzm n SER 62 N -1.66 2.58 -4.67 -2.24 7.64 -1.26 -3.78 113.62 110.24 2dzm n SER 62 Ca -0.00 -2.24 -0.31 0.00 1.01 0.00 0.00 58.87 57.32 2dzm n SER 62 Cb 0.04 -0.43 -0.09 0.00 -1.01 0.00 0.00 64.21 62.72 2dzm n SER 62 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2dzm s THR 63 N -1.69 3.97 -0.05 0.44 2.01 0.09 -5.02 115.64 115.39 2dzm s THR 63 Ca 0.24 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 2dzm s THR 63 Cb 0.16 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2dzm s THR 63 CO 0.11 0.23 0.10 -0.69 -0.69 0.00 0.00 174.62 173.68 2dzm s VAL 64 N -1.20 4.98 0.16 3.82 1.01 -1.26 -0.29 120.40 127.62 2dzm s VAL 64 Ca 0.22 -0.18 -0.18 0.00 0.00 0.00 0.00 61.98 61.84 2dzm s VAL 64 Cb -0.12 -3.23 0.07 0.00 0.00 0.00 0.00 36.38 33.10 2dzm s VAL 64 CO 0.14 0.45 1.68 -0.07 0.00 0.00 0.00 175.10 177.30 2dzm h LEU 65 N 4.44 -0.32 -2.82 3.92 3.38 -1.59 0.23 115.31 122.55 2dzm h LEU 65 Ca -0.51 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2dzm h LEU 65 Cb 1.20 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 42.16 2dzm h LEU 65 CO 0.61 -0.11 0.06 0.07 0.09 0.00 0.00 178.44 179.16 2dzm h LYS 66 N 0.00 0.00 -0.13 1.13 2.10 -1.20 -0.34 116.57 118.13 2dzm h LYS 66 Ca 0.17 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.70 2dzm h LYS 66 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 2dzm h LYS 66 CO -0.36 0.00 -0.39 1.03 -2.00 0.00 0.00 179.45 177.73 2dzm h SER 67 N 0.00 0.57 1.70 7.07 0.87 -0.82 -3.21 113.55 119.74 2dzm h SER 67 Ca 0.00 -0.60 -0.03 0.00 -1.23 0.00 0.00 61.79 59.93 2dzm h SER 67 Cb 0.12 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2dzm h SER 67 CO -0.00 1.07 -0.30 -0.07 -0.53 0.00 0.00 176.83 177.00 2dzm h LEU 68 N 0.11 0.00 -1.44 2.23 3.38 -1.08 -3.48 115.31 115.03 2dzm h LEU 68 Ca -0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2dzm h LEU 68 Cb 1.01 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.80 2dzm h LEU 68 CO 0.08 0.14 -0.18 1.41 0.09 0.00 0.00 178.44 179.98 2dzm n HIS 69 N -3.07 -0.64 -1.52 1.13 8.25 -0.24 -4.96 115.22 114.17 2dzm n HIS 69 Ca 0.02 0.25 -0.44 0.00 -0.26 0.00 0.00 57.72 57.29 2dzm n HIS 69 Cb 0.59 -2.40 -0.01 0.00 1.12 0.00 0.00 29.99 29.29 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 -1.71 0.85 0.00 2.41 7.99 -1.20 -4.96 117.00 120.37 2dzm n LEU 70 Ca -0.04 1.11 -0.11 0.00 -0.01 0.00 0.00 56.01 56.96 2dzm n LEU 70 Cb 0.53 -1.19 0.09 0.00 -0.11 0.00 0.00 43.42 42.75 2dzm n LEU 70 CO 0.16 -2.03 0.23 -0.81 -1.51 0.00 0.00 177.39 173.42 2dzm n PRO 71 N 0.72 -1.82 -0.13 3.23 -0.04 -1.26 -4.96 135.00 130.74 2dzm n PRO 71 Ca 0.12 -0.65 -0.12 0.00 -0.04 0.00 0.00 63.50 62.81 2dzm n PRO 71 Cb 0.32 -0.61 -0.02 0.00 -0.04 0.00 0.00 33.50 33.15 2dzm n PRO 71 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2dzm h LYS 72 N 0.00 0.81 -4.70 0.54 3.64 -1.93 -3.44 116.57 111.50 2dzm h LYS 72 Ca -0.15 -0.35 -0.48 0.00 -1.27 0.00 0.00 60.65 58.40 2dzm h LYS 72 Cb 0.47 -0.03 -0.32 0.00 -0.41 0.00 0.00 32.23 31.94 2dzm h LYS 72 CO 0.10 0.98 -0.80 1.21 -2.27 0.00 0.00 179.45 178.67 2dzm s ASN 73 N -6.52 1.54 0.14 4.20 3.84 -1.26 -3.08 114.94 113.81 2dzm s ASN 73 Ca -0.12 -0.25 0.05 0.00 0.21 0.00 0.00 52.86 52.75 2dzm s ASN 73 Cb 0.10 -0.52 -0.04 0.00 -0.55 0.00 0.00 41.25 40.24 2dzm s ASN 73 CO 0.83 0.07 -0.11 0.20 -2.79 0.00 0.00 177.10 175.30 2dzm s ASN 74 N 0.33 1.90 -0.27 -4.21 0.01 -0.41 -5.01 114.94 107.28 2dzm s ASN 74 Ca -0.07 -0.96 -0.02 0.00 -0.71 0.00 0.00 52.86 51.11 2dzm s ASN 74 Cb -0.11 -0.04 0.09 0.00 0.41 0.00 0.00 41.25 41.60 2dzm s ASN 74 CO 0.02 -0.27 0.08 -0.94 -1.51 0.00 0.00 177.10 174.48 2dzm s SER 75 N -2.98 3.57 0.58 -1.22 1.04 -1.26 -0.46 113.70 112.97 2dzm s SER 75 Ca 0.15 -1.30 0.09 0.00 0.48 0.00 0.00 55.95 55.37 2dzm s SER 75 Cb 0.00 -0.67 0.09 0.00 0.10 0.00 0.00 66.02 65.54 2dzm s SER 75 CO 0.02 -0.38 0.75 0.18 0.98 0.00 0.00 173.24 174.79 2dzm n LEU 76 N 4.99 0.00 -3.73 2.42 4.77 0.34 -4.90 117.00 120.89 2dzm n LEU 76 Ca -0.05 -2.56 -0.13 0.00 -0.03 0.00 0.00 56.01 53.23 2dzm n LEU 76 Cb 0.44 -0.38 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 2dzm n LEU 76 CO 0.10 -0.70 0.08 -0.72 -1.33 0.00 0.00 177.39 174.83 2dzm s TYR 77 N -2.63 -0.43 -0.10 -1.77 1.13 -1.25 -0.24 117.35 112.07 2dzm s TYR 77 Ca 0.57 1.02 -0.03 0.00 -1.41 0.00 0.00 57.07 57.22 2dzm s TYR 77 Cb -0.05 0.15 -0.03 0.00 -1.10 0.00 0.00 41.96 40.93 2dzm s TYR 77 CO 0.36 -0.24 0.03 0.08 -2.51 0.00 0.00 175.55 173.28 2dzm s VAL 78 N 0.06 4.58 -0.25 -3.49 1.01 -1.17 -3.79 120.40 117.35 2dzm s VAL 78 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 61.83 2dzm s VAL 78 Cb -0.03 -2.95 0.07 0.00 0.00 0.00 0.00 36.38 33.47 2dzm s VAL 78 CO 0.01 0.60 -0.01 -0.76 0.00 0.00 0.00 175.10 174.95 2dzm s LEU 79 N -0.86 2.57 -0.64 3.92 1.43 -1.25 -4.69 118.68 119.16 2dzm s LEU 79 Ca 0.13 -1.31 -0.12 0.00 -1.03 0.00 0.00 54.13 51.81 2dzm s LEU 79 Cb -0.12 -1.10 0.16 0.00 0.03 0.00 0.00 46.19 45.17 2dzm s LEU 79 CO 0.03 -0.29 0.55 0.42 0.23 0.00 0.00 176.35 177.29 2dzm s THR 80 N 1.44 4.87 0.04 5.49 -4.23 -1.26 -3.50 115.64 118.49 2dzm s THR 80 Ca -0.01 -2.16 -0.21 0.00 -1.18 0.00 0.00 61.69 58.14 2dzm s THR 80 Cb -0.18 -4.10 -0.15 0.00 1.34 0.00 0.00 72.50 69.41 2dzm s THR 80 CO -0.10 -0.91 1.34 1.55 -0.54 0.00 0.00 174.62 175.97 2dzm h PRO 81 N 8.08 0.34 0.27 3.99 0.13 -1.99 -3.36 132.00 139.46 2dzm h PRO 81 Ca -0.09 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 64.85 2dzm h PRO 81 Cb 1.05 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2dzm h PRO 81 CO 0.84 0.73 -0.13 -0.44 -0.23 0.00 0.00 178.00 178.77 2dzm h ASP 82 N -0.03 -0.31 -1.74 1.44 5.19 -1.91 -3.44 116.42 115.62 2dzm h ASP 82 Ca 0.02 0.01 -0.69 0.00 -0.62 0.00 0.00 57.03 55.76 2dzm h ASP 82 Cb 0.67 0.08 0.03 0.00 0.18 0.00 0.00 39.33 40.29 2dzm h ASP 82 CO 0.03 0.03 0.77 -0.11 -3.12 0.00 0.00 179.24 176.84 2dzm n LEU 83 N -4.33 2.37 -4.75 1.55 7.94 -1.26 -4.93 117.00 113.59 2dzm n LEU 83 Ca -0.04 1.07 -0.31 0.00 -1.11 0.00 0.00 56.01 55.62 2dzm n LEU 83 Cb 0.14 -1.22 0.11 0.00 0.53 0.00 0.00 43.42 42.98 2dzm n LEU 83 CO 0.11 -0.56 0.69 -2.16 -1.11 0.00 0.00 177.39 174.35 2dzm s PRO 84 N 2.35 1.90 0.17 1.96 0.04 -1.26 -4.86 135.00 135.29 2dzm s PRO 84 Ca 0.91 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 2dzm s PRO 84 Cb -0.94 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 31.66 2dzm s PRO 84 CO 0.55 -1.86 1.32 -1.25 0.04 0.00 0.00 177.00 175.80 2dzm s PRO 85 N -4.91 4.37 0.24 0.56 0.04 -1.26 -4.99 135.00 129.05 2dzm s PRO 85 Ca 0.62 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 63.40 2dzm s PRO 85 Cb -0.17 -3.22 -0.09 0.00 0.04 0.00 0.00 34.50 31.06 2dzm s PRO 85 CO 0.56 -0.30 1.28 -1.25 0.04 0.00 0.00 177.00 177.33 2dzm s PRO 86 N 0.29 4.42 0.06 0.56 0.04 -1.26 -4.98 135.00 134.14 2dzm s PRO 86 Ca 0.59 2.05 -0.31 0.00 0.04 0.00 0.00 61.00 63.37 2dzm s PRO 86 Cb -0.36 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 30.95 2dzm s PRO 86 CO 0.35 -0.17 1.34 0.45 0.04 0.00 0.00 177.00 179.01 2dzm s SER 87 N 0.00 6.91 -0.48 6.66 0.15 -1.26 -4.89 113.70 120.79 2dzm s SER 87 Ca 0.53 2.17 -0.30 0.00 0.70 0.00 0.00 55.95 59.05 2dzm s SER 87 Cb -0.36 -2.58 -0.10 0.00 -1.71 0.00 0.00 66.02 61.27 2dzm s SER 87 CO 0.42 -0.62 2.36 -1.20 1.20 0.00 0.00 173.24 175.40 2dzm n SER 88 N 4.39 2.11 -4.05 5.45 7.64 -1.26 -4.91 113.62 122.99 2dzm n SER 88 Ca 0.11 -0.01 -0.16 0.00 1.01 0.00 0.00 58.87 59.82 2dzm n SER 88 Cb 0.44 -1.39 -0.13 0.00 -1.01 0.00 0.00 64.21 62.12 2dzm n SER 88 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dzm s SER 89 N 9.64 0.97 0.55 6.43 0.01 -1.26 -5.13 113.70 124.91 2dzm s SER 89 Ca 1.08 -0.37 -0.20 0.00 1.31 0.00 0.00 55.95 57.77 2dzm s SER 89 Cb -0.57 -0.03 -0.07 0.00 0.21 0.00 0.00 66.02 65.56 2dzm s SER 89 CO 0.38 -0.06 0.85 -1.54 0.41 0.00 0.00 173.24 173.29 2dzm n SER 90 N 2.07 0.37 -4.40 2.44 3.41 -1.26 -4.92 113.62 111.33 2dzm n SER 90 Ca -0.18 0.83 -0.31 0.00 -0.26 0.00 0.00 58.87 58.95 2dzm n SER 90 Cb 0.56 -1.32 0.18 0.00 -0.26 0.00 0.00 64.21 63.36 2dzm n SER 90 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2dzm n HIS 91 N -1.46 -1.15 -3.69 7.33 -0.00 -1.26 -5.05 115.22 109.94 2dzm n HIS 91 Ca 0.12 0.13 -0.13 0.00 0.46 0.00 0.00 57.72 58.30 2dzm n HIS 91 Cb 0.46 -1.70 -0.09 0.00 -0.12 0.00 0.00 29.99 28.54 2dzm n HIS 91 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2dzm s ALA 92 N -2.36 -1.31 0.00 1.57 0.00 -1.26 -5.14 121.76 113.26 2dzm s ALA 92 Ca 0.60 1.53 0.00 0.00 0.00 0.00 0.00 51.96 54.09 2dzm s ALA 92 Cb -0.19 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.04 2dzm s ALA 92 CO 0.65 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.57 2dzm n GLY 93 N 2.97 -0.69 3.39 0.00 0.00 -1.26 -5.04 105.19 104.55 2dzm n GLY 93 Ca -0.14 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.33 -1.21 -0.16 4.61 0.00 -1.26 -5.15 121.76 117.27 2dzm s ALA 94 Ca 0.00 1.36 -0.04 0.00 0.00 0.00 0.00 51.96 53.28 2dzm s ALA 94 Cb 0.00 -0.78 0.07 0.00 0.00 0.00 0.00 23.12 22.41 2dzm s ALA 94 CO 0.00 -0.23 0.13 -1.17 0.00 0.00 0.00 175.76 174.49 2dzm s LEU 95 N 0.21 0.15 -0.53 0.00 0.20 -1.26 -5.10 118.68 112.34 2dzm s LEU 95 Ca -0.00 -0.34 -0.04 0.00 0.69 0.00 0.00 54.13 54.43 2dzm s LEU 95 Cb -0.03 -0.00 0.14 0.00 -0.43 0.00 0.00 46.19 45.87 2dzm s LEU 95 CO 0.01 -0.32 0.36 -1.58 -0.29 0.00 0.00 176.35 174.52 2dzm s GLN 96 N 2.21 2.39 -0.37 1.98 2.00 -1.26 -5.02 119.66 121.59 2dzm s GLN 96 Ca 0.04 -2.17 0.02 0.00 -2.00 0.00 0.00 55.36 51.25 2dzm s GLN 96 Cb -0.15 -3.73 0.11 0.00 0.80 0.00 0.00 33.01 30.04 2dzm s GLN 96 CO -0.09 -1.15 0.12 -2.00 -0.50 0.00 0.00 175.29 171.68 2dzm s GLU 97 N 0.57 1.29 -0.67 1.67 2.56 -1.26 -4.98 118.70 117.88 2dzm s GLU 97 Ca 0.12 -1.77 -0.00 0.00 0.00 0.00 0.00 54.97 53.32 2dzm s GLU 97 Cb -0.22 -2.73 0.41 0.00 2.00 0.00 0.00 34.13 33.60 2dzm s GLU 97 CO -0.04 -1.01 1.84 0.45 -0.56 0.00 0.00 175.26 175.94 2dzm n SER 98 N 4.15 7.01 -2.44 -1.70 2.88 -1.26 -4.82 113.62 117.44 2dzm n SER 98 Ca 0.03 -3.80 -0.14 0.00 -1.33 0.00 0.00 58.87 53.64 2dzm n SER 98 Cb 0.39 -0.89 0.05 0.00 -0.75 0.00 0.00 64.21 63.02 2dzm n SER 98 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2dzm n LEU 99 N -0.70 -2.98 0.00 2.46 0.00 -1.26 -5.38 117.00 109.14 2dzm n LEU 99 Ca 0.55 -0.35 0.00 0.00 0.00 0.00 0.00 56.01 56.21 2dzm n LEU 99 Cb 0.52 -2.09 0.00 0.00 0.00 0.00 0.00 43.42 41.86 2dzm n LEU 99 CO 0.59 0.36 0.00 -3.20 0.00 0.00 0.00 177.39 175.14