#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dai s SER 2 N 0.00 -0.08 0.27 1.61 0.15 -1.26 -5.19 113.70 109.21 2dai s SER 2 Ca 0.00 -0.15 -0.21 0.00 0.70 0.00 0.00 55.95 56.29 2dai s SER 2 Cb 0.00 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.53 2dai s SER 2 CO 0.00 -0.36 0.72 -0.55 1.20 0.00 0.00 173.24 174.26 2dai s SER 3 N -2.93 -0.27 0.22 5.45 0.15 -1.26 -5.19 113.70 109.88 2dai s SER 3 Ca 0.14 -0.58 -0.10 0.00 0.70 0.00 0.00 55.95 56.11 2dai s SER 3 Cb 0.04 0.72 0.04 0.00 -1.71 0.00 0.00 66.02 65.11 2dai s SER 3 CO -0.03 -1.32 0.51 0.61 1.20 0.00 0.00 173.24 174.21 2dai n GLY 4 N -0.46 1.29 3.64 9.45 0.00 -1.26 -5.19 105.19 112.66 2dai n GLY 4 Ca -0.05 -1.15 0.02 0.00 0.00 0.00 0.00 46.02 44.85 2dai n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dai s SER 5 N -2.31 -0.03 -0.13 1.61 0.01 -1.26 -5.19 113.70 106.40 2dai s SER 5 Ca 0.10 -0.10 -0.33 0.00 1.31 0.00 0.00 55.95 56.93 2dai s SER 5 Cb -0.03 0.11 0.13 0.00 0.21 0.00 0.00 66.02 66.44 2dai s SER 5 CO 0.07 -0.21 1.23 -0.94 0.41 0.00 0.00 173.24 173.80 2dai s SER 6 N -3.08 -0.11 0.00 2.44 1.04 -1.26 -5.18 113.70 107.54 2dai s SER 6 Ca 0.16 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.54 2dai s SER 6 Cb 0.05 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2dai s SER 6 CO -0.04 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.52 2dai n GLY 7 N -0.23 3.39 3.60 7.32 0.00 -1.26 -5.16 105.19 112.85 2dai n GLY 7 Ca -0.03 -1.88 -0.01 0.00 0.00 0.00 0.00 46.02 44.10 2dai n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dai s ASP 8 N -0.15 -0.50 0.09 1.61 1.47 -1.26 -5.18 116.67 112.75 2dai s ASP 8 Ca 0.00 0.78 -0.13 0.00 1.18 0.00 0.00 52.55 54.37 2dai s ASP 8 Cb 0.00 1.29 0.02 0.00 -0.34 0.00 0.00 42.92 43.89 2dai s ASP 8 CO 0.00 -0.12 0.32 0.00 0.68 0.00 0.00 175.17 176.05 2dai s ALA 9 N 1.54 -0.67 -0.23 2.11 0.00 -1.26 -5.15 121.76 118.10 2dai s ALA 9 Ca -0.08 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 2dai s ALA 9 Cb -0.04 0.52 0.12 0.00 0.00 0.00 0.00 23.12 23.72 2dai s ALA 9 CO -0.15 -0.54 0.44 0.54 0.00 0.00 0.00 175.76 176.05 2dai s VAL 10 N -3.44 -0.69 -0.31 0.00 0.11 -1.26 -5.06 120.40 109.75 2dai s VAL 10 Ca 0.01 0.05 -0.05 0.00 -2.93 0.00 0.00 61.98 59.06 2dai s VAL 10 Cb 0.02 -0.77 0.26 0.00 -1.53 0.00 0.00 36.38 34.36 2dai s VAL 10 CO -0.09 -0.01 1.25 1.21 -3.33 0.00 0.00 175.10 174.13 2dai n GLU 11 N 5.39 0.03 -3.78 1.54 2.13 -1.26 -5.17 120.64 119.52 2dai n GLU 11 Ca -0.06 -0.55 0.01 0.00 0.66 0.00 0.00 57.16 57.21 2dai n GLU 11 Cb 0.50 0.06 0.00 0.00 0.27 0.00 0.00 31.44 32.27 2dai n GLU 11 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 2dai s LEU 12 N 0.23 -0.04 0.30 4.31 2.34 -1.26 -5.16 118.68 119.40 2dai s LEU 12 Ca 0.25 -0.24 0.00 0.00 0.06 0.00 0.00 54.13 54.20 2dai s LEU 12 Cb 0.19 1.50 0.00 0.00 -0.56 0.00 0.00 46.19 47.32 2dai s LEU 12 CO -0.07 -0.42 0.00 0.33 -1.06 0.00 0.00 176.35 175.13 2dai n PHE 13 N -0.65 -2.47 -2.15 3.48 7.35 -1.26 -4.99 117.46 116.77 2dai n PHE 13 Ca -0.04 1.28 -0.04 0.00 -0.76 0.00 0.00 57.45 57.90 2dai n PHE 13 Cb 0.61 -2.25 -0.03 0.00 0.35 0.00 0.00 39.48 38.16 2dai n PHE 13 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2dai n LYS 14 N -3.39 -2.75 -2.68 -4.13 0.00 -1.26 -5.06 118.16 98.90 2dai n LYS 14 Ca -0.02 2.27 -0.05 0.00 0.00 0.00 0.00 58.31 60.52 2dai n LYS 14 Cb 0.62 -3.43 0.09 0.00 0.00 0.00 0.00 35.03 32.31 2dai n LYS 14 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2dai n LYS 15 N 1.01 0.25 -4.45 1.64 4.81 -1.26 -5.16 118.16 115.02 2dai n LYS 15 Ca -0.26 -0.88 -0.31 0.00 -0.87 0.00 0.00 58.31 56.00 2dai n LYS 15 Cb 0.40 -0.36 -0.11 0.00 0.02 0.00 0.00 35.03 34.97 2dai n LYS 15 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dai s ALA 16 N 0.15 2.79 0.70 3.14 0.00 -1.26 -5.11 121.76 122.16 2dai s ALA 16 Ca 0.24 -1.20 -0.15 0.00 0.00 0.00 0.00 51.96 50.85 2dai s ALA 16 Cb 0.25 -0.84 0.02 0.00 0.00 0.00 0.00 23.12 22.55 2dai s ALA 16 CO -0.14 0.60 1.18 1.21 0.00 0.00 0.00 175.76 178.62 2dai s ASN 17 N -1.75 4.53 0.16 0.00 3.84 -1.26 -4.93 114.94 115.53 2dai s ASN 17 Ca 0.17 2.28 -0.31 0.00 0.21 0.00 0.00 52.86 55.22 2dai s ASN 17 Cb -0.11 -2.58 -0.08 0.00 -0.55 0.00 0.00 41.25 37.93 2dai s ASN 17 CO 0.09 -2.03 1.36 0.00 -2.79 0.00 0.00 177.10 173.73 2dai s ALA 18 N -2.02 3.57 0.00 1.71 0.00 -1.26 -5.02 121.76 118.75 2dai s ALA 18 Ca 0.73 1.14 0.04 0.00 0.00 0.00 0.00 51.96 53.87 2dai s ALA 18 Cb -0.27 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.32 2dai s ALA 18 CO 0.43 -0.60 -0.13 1.41 0.00 0.00 0.00 175.76 176.87 2dai s MET 19 N 0.49 1.02 0.00 0.00 1.75 -1.26 -5.13 119.30 116.17 2dai s MET 19 Ca 0.61 -0.53 0.00 0.00 -1.25 0.00 0.00 55.69 54.52 2dai s MET 19 Cb -0.37 -1.00 0.00 0.00 2.84 0.00 0.00 34.83 36.30 2dai s MET 19 CO 0.34 0.27 0.00 -0.11 -0.65 0.00 0.00 175.02 174.87 2dai n LEU 20 N 2.56 0.00 0.00 4.11 7.94 -1.26 -4.92 117.00 125.43 2dai n LEU 20 Ca -0.15 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.75 2dai n LEU 20 Cb 0.55 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.50 2dai n LEU 20 CO 0.24 0.00 0.00 -0.67 -1.11 0.00 0.00 177.39 175.85 2dai n ASP 21 N 0.00 0.00 -3.15 1.96 2.03 -1.26 -4.70 116.55 111.43 2dai n ASP 21 Ca 0.00 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.19 2dai n ASP 21 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 2dai n ASP 21 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2dai n GLU 22 N 0.00 -1.84 -2.37 -0.67 2.13 -1.26 -4.95 120.64 111.68 2dai n GLU 22 Ca 0.00 1.62 -0.33 0.00 0.66 0.00 0.00 57.16 59.11 2dai n GLU 22 Cb 0.00 -4.68 -0.02 0.00 0.27 0.00 0.00 31.44 27.00 2dai n GLU 22 CO 0.00 0.00 0.00 0.16 -0.41 0.00 0.00 177.13 176.88 2dai s ASP 23 N -2.62 6.32 0.48 4.31 1.47 -1.26 -4.99 116.67 120.38 2dai s ASP 23 Ca 0.15 1.75 -0.24 0.00 1.18 0.00 0.00 52.55 55.39 2dai s ASP 23 Cb -0.03 -2.53 -0.07 0.00 -0.34 0.00 0.00 42.92 39.94 2dai s ASP 23 CO 0.80 -0.79 1.40 1.21 0.68 0.00 0.00 175.17 178.46 2dai n GLU 24 N -1.46 2.06 -4.06 2.11 0.00 -1.26 -5.02 120.64 113.02 2dai n GLU 24 Ca 0.08 0.74 -0.08 0.00 0.00 0.00 0.00 57.16 57.90 2dai n GLU 24 Cb 0.53 -2.60 -0.10 0.00 0.00 0.00 0.00 31.44 29.27 2dai n GLU 24 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 2dai s ASP 25 N -0.60 0.42 -0.15 4.31 1.47 -1.26 -5.09 116.67 115.76 2dai s ASP 25 Ca 0.64 -0.86 -0.16 0.00 1.18 0.00 0.00 52.55 53.35 2dai s ASP 25 Cb -0.44 0.18 -0.05 0.00 -0.34 0.00 0.00 42.92 42.26 2dai s ASP 25 CO 0.55 -0.53 -0.31 -0.62 0.68 0.00 0.00 175.17 174.94 2dai n GLU 26 N 0.48 0.48 -3.45 2.11 -0.58 -1.26 -5.00 120.64 113.42 2dai n GLU 26 Ca -0.17 0.19 -0.32 0.00 -0.42 0.00 0.00 57.16 56.44 2dai n GLU 26 Cb 0.60 -1.34 -0.05 0.00 -0.57 0.00 0.00 31.44 30.07 2dai n GLU 26 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2dai s ARG 27 N -2.81 3.79 1.01 3.49 0.52 -1.26 -5.05 118.95 118.64 2dai s ARG 27 Ca -0.26 0.24 -0.20 0.00 -0.52 0.00 0.00 55.73 54.99 2dai s ARG 27 Cb 0.04 -2.68 -0.09 0.00 0.52 0.00 0.00 34.95 32.73 2dai s ARG 27 CO 0.39 0.34 -0.70 0.28 0.02 0.00 0.00 175.30 175.63 2dai n VAL 28 N -0.07 0.00 -3.24 3.52 0.31 -1.26 -4.90 118.33 112.68 2dai n VAL 28 Ca -0.00 -0.26 -0.39 0.00 -0.01 0.00 0.00 64.34 63.68 2dai n VAL 28 Cb 0.52 -0.20 -0.06 0.00 -0.91 0.00 0.00 33.84 33.19 2dai n VAL 28 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2dai s ASP 29 N -1.31 7.07 -0.18 4.52 -1.08 -1.26 -4.99 116.67 119.44 2dai s ASP 29 Ca 0.44 1.27 -0.21 0.00 -0.52 0.00 0.00 52.55 53.53 2dai s ASP 29 Cb -0.09 -2.37 -0.19 0.00 -1.46 0.00 0.00 42.92 38.82 2dai s ASP 29 CO 0.72 0.24 0.30 -0.33 0.52 0.00 0.00 175.17 176.63 2dai h GLU 30 N 4.70 0.00 -0.84 4.34 5.08 -1.98 -2.85 114.58 123.04 2dai h GLU 30 Ca -0.49 0.00 0.20 0.00 -1.00 0.00 0.00 59.36 58.07 2dai h GLU 30 Cb 1.21 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.31 2dai h GLU 30 CO 0.65 0.87 -0.04 0.00 -1.00 0.00 0.00 179.01 179.49 2dai h ALA 31 N -0.44 0.83 0.33 3.43 0.00 -2.00 0.57 119.26 121.99 2dai h ALA 31 Ca -0.22 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2dai h ALA 31 Cb 1.11 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.42 2dai h ALA 31 CO -0.13 -0.45 -0.16 0.00 0.00 0.00 0.00 179.25 178.51 2dai h ALA 32 N 1.81 -0.45 -0.83 0.00 0.00 -1.94 -3.07 119.26 114.78 2dai h ALA 32 Ca 0.46 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.32 2dai h ALA 32 Cb 0.82 0.17 -0.15 0.00 0.00 0.00 0.00 17.79 18.64 2dai h ALA 32 CO -0.78 -0.57 -0.33 1.25 0.00 0.00 0.00 179.25 178.82 2dai h LEU 33 N -0.80 -1.19 -0.77 0.00 5.85 -0.66 0.55 115.31 118.29 2dai h LEU 33 Ca -0.05 0.27 0.16 0.00 0.84 0.00 0.00 57.88 59.10 2dai h LEU 33 Cb 0.52 0.64 -0.15 0.00 0.37 0.00 0.00 40.66 42.05 2dai h LEU 33 CO 0.07 -0.29 -0.18 -0.09 -0.34 0.00 0.00 178.44 177.61 2dai h ARG 34 N -0.05 0.01 -0.51 1.25 9.65 0.07 0.24 114.38 125.02 2dai h ARG 34 Ca 0.33 -0.00 0.10 0.00 -1.10 0.00 0.00 59.98 59.31 2dai h ARG 34 Cb 0.59 -0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 29.07 2dai h ARG 34 CO -0.86 0.00 -0.27 1.96 2.80 0.00 0.00 179.97 183.60 2dai h GLN 35 N 0.01 -0.14 0.26 0.20 1.08 0.20 1.41 115.11 118.13 2dai h GLN 35 Ca 0.37 0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.57 2dai h GLN 35 Cb 0.58 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2dai h GLN 35 CO -0.78 -0.09 -0.13 -0.07 -0.95 0.00 0.00 178.83 176.81 2dai h LEU 36 N -0.14 -0.30 -1.22 1.46 3.38 -0.37 -1.30 115.31 116.82 2dai h LEU 36 Ca 0.23 0.01 0.38 0.00 0.09 0.00 0.00 57.88 58.59 2dai h LEU 36 Cb 0.51 0.08 -0.14 0.00 0.09 0.00 0.00 40.66 41.20 2dai h LEU 36 CO -0.60 -0.20 0.70 0.71 0.09 0.00 0.00 178.44 179.14 2dai h THR 37 N -0.38 0.19 -0.69 0.22 1.35 -0.51 1.47 112.91 114.56 2dai h THR 37 Ca -0.04 -0.06 -0.04 0.00 -0.55 0.00 0.00 66.41 65.73 2dai h THR 37 Cb 0.27 0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.67 2dai h THR 37 CO 0.06 0.03 0.28 -0.33 -0.25 0.00 0.00 175.52 175.31 2dai h GLU 38 N 0.17 1.03 0.56 4.72 4.39 0.22 -3.15 114.58 122.52 2dai h GLU 38 Ca 0.78 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 60.27 2dai h GLU 38 Cb 2.16 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 30.65 2dai h GLU 38 CO -0.52 0.85 -0.27 0.52 -1.16 0.00 0.00 179.01 178.43 2dai h MET 39 N 0.98 -0.72 0.00 2.33 2.86 0.32 -3.47 114.93 117.22 2dai h MET 39 Ca 0.23 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.92 2dai h MET 39 Cb 0.20 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.02 2dai h MET 39 CO -0.02 -0.42 0.00 0.41 1.06 0.00 0.00 176.91 177.94 2dai n GLY 40 N -0.88 -0.45 3.20 8.32 0.00 -0.54 -5.11 105.19 109.73 2dai n GLY 40 Ca -0.12 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.79 2dai n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dai s PHE 41 N 0.00 1.27 -0.10 1.61 0.08 -1.23 -5.01 117.98 114.61 2dai s PHE 41 Ca 0.00 -0.51 -0.30 0.00 0.12 0.00 0.00 56.93 56.25 2dai s PHE 41 Cb 0.00 -0.69 -0.03 0.00 -0.57 0.00 0.00 43.02 41.73 2dai s PHE 41 CO 0.00 0.08 1.24 -1.25 -0.10 0.00 0.00 175.22 175.19 2dai s PRO 42 N -2.14 4.30 0.22 0.24 0.04 -1.26 -4.20 135.00 132.21 2dai s PRO 42 Ca 0.02 1.68 -0.10 0.00 0.04 0.00 0.00 61.00 62.65 2dai s PRO 42 Cb -0.08 -3.65 0.33 0.00 0.04 0.00 0.00 34.50 31.14 2dai s PRO 42 CO 0.02 -0.57 1.65 1.49 0.04 0.00 0.00 177.00 179.64 2dai h GLU 43 N 7.81 0.09 -0.42 4.56 4.81 -1.96 0.98 114.58 130.45 2dai h GLU 43 Ca -0.31 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 58.96 2dai h GLU 43 Cb 1.14 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.43 2dai h GLU 43 CO 0.92 0.06 -0.44 -2.95 -0.73 0.00 0.00 179.01 175.87 2dai h ASN 44 N 0.10 -1.52 0.64 1.04 -1.07 -1.99 1.46 115.58 114.25 2dai h ASN 44 Ca 0.35 0.21 -0.03 0.00 0.07 0.00 0.00 56.30 56.89 2dai h ASN 44 Cb 0.58 0.63 0.01 0.00 -2.07 0.00 0.00 38.32 37.46 2dai h ASN 44 CO -0.59 -0.29 -0.31 0.03 0.07 0.00 0.00 177.43 176.34 2dai h ARG 45 N -0.25 -0.83 -0.99 4.14 3.08 -1.65 -2.70 114.38 115.18 2dai h ARG 45 Ca 0.07 0.06 0.25 0.00 0.07 0.00 0.00 59.98 60.43 2dai h ARG 45 Cb 0.44 0.19 -0.18 0.00 0.08 0.00 0.00 29.97 30.49 2dai h ARG 45 CO -0.52 -0.51 -0.04 0.00 -1.07 0.00 0.00 179.97 177.82 2dai h ALA 46 N -0.95 1.04 -0.33 0.04 0.00 0.13 1.16 119.26 120.35 2dai h ALA 46 Ca -0.09 0.35 0.06 0.00 0.00 0.00 0.00 54.91 55.23 2dai h ALA 46 Cb 0.70 0.63 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2dai h ALA 46 CO 0.15 -0.52 -0.00 1.15 0.00 0.00 0.00 179.25 180.02 2dai h THR 47 N 0.01 0.75 0.90 0.00 2.02 0.21 0.12 112.91 116.93 2dai h THR 47 Ca 0.57 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.67 2dai h THR 47 Cb 1.10 0.65 0.01 0.00 -1.74 0.00 0.00 68.15 68.17 2dai h THR 47 CO -0.94 0.02 -0.46 0.50 0.37 0.00 0.00 175.52 175.00 2dai h LYS 48 N 0.09 -1.20 -0.78 6.66 3.64 0.16 -2.06 116.57 123.08 2dai h LYS 48 Ca 0.16 0.08 0.09 0.00 -1.27 0.00 0.00 60.65 59.71 2dai h LYS 48 Cb 0.22 0.27 -0.12 0.00 -0.41 0.00 0.00 32.23 32.20 2dai h LYS 48 CO -0.27 -0.80 -0.52 0.00 -2.27 0.00 0.00 179.45 175.59 2dai h ALA 49 N -1.35 -0.43 -0.90 5.00 0.00 -0.49 0.87 119.26 121.96 2dai h ALA 49 Ca -0.12 0.12 0.23 0.00 0.00 0.00 0.00 54.91 55.14 2dai h ALA 49 Cb 0.97 1.17 -0.16 0.00 0.00 0.00 0.00 17.79 19.77 2dai h ALA 49 CO 0.18 -0.90 0.07 -0.07 0.00 0.00 0.00 179.25 178.53 2dai h LEU 50 N -0.13 -0.33 -1.02 0.00 3.38 -0.63 1.76 115.31 118.34 2dai h LEU 50 Ca 0.18 0.24 -0.03 0.00 0.09 0.00 0.00 57.88 58.35 2dai h LEU 50 Cb 0.51 0.39 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 2dai h LEU 50 CO -0.82 -0.26 0.34 1.56 0.09 0.00 0.00 178.44 179.35 2dai h GLN 51 N 0.08 1.04 -0.54 1.13 4.20 0.14 1.55 115.11 122.71 2dai h GLN 51 Ca 0.54 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 59.10 2dai h GLN 51 Cb 1.06 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.65 2dai h GLN 51 CO -0.79 0.81 0.00 1.28 -0.67 0.00 0.00 178.83 179.46 2dai n LEU 52 N -4.32 2.76 -1.66 1.46 4.77 0.50 -3.65 117.00 116.85 2dai n LEU 52 Ca 0.07 -1.39 0.01 0.00 -0.03 0.00 0.00 56.01 54.68 2dai n LEU 52 Cb 0.14 -0.39 0.06 0.00 -2.33 0.00 0.00 43.42 40.90 2dai n LEU 52 CO 0.39 0.54 0.11 0.59 -1.33 0.00 0.00 177.39 177.69 2dai n ASN 53 N 0.62 1.56 -2.38 -1.43 3.02 0.38 -4.95 115.26 112.09 2dai n ASN 53 Ca 0.15 -2.50 -0.01 0.00 -0.03 0.00 0.00 54.58 52.19 2dai n ASN 53 Cb 0.50 -0.39 -0.00 0.00 -0.61 0.00 0.00 39.78 39.29 2dai n ASN 53 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2dai n HIS 54 N -0.14 -1.85 -2.74 3.10 8.25 -0.87 0.20 115.22 121.17 2dai n HIS 54 Ca 0.12 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.49 2dai n HIS 54 Cb 0.97 -1.21 0.04 0.00 1.12 0.00 0.00 29.99 30.92 2dai n HIS 54 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2dai n MET 55 N -2.42 -3.16 -3.67 -0.41 2.81 0.51 -5.01 117.12 105.78 2dai n MET 55 Ca -0.02 0.38 -0.37 0.00 -1.81 0.00 0.00 57.70 55.88 2dai n MET 55 Cb 0.48 -4.02 -0.06 0.00 -0.71 0.00 0.00 33.22 28.90 2dai n MET 55 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2dai s SER 56 N -3.48 6.53 -0.08 7.83 0.15 0.52 -4.98 113.70 120.20 2dai s SER 56 Ca 0.07 0.63 -0.25 0.00 0.70 0.00 0.00 55.95 57.11 2dai s SER 56 Cb -0.03 -2.16 -0.26 0.00 -1.71 0.00 0.00 66.02 61.86 2dai s SER 56 CO 0.33 0.30 0.93 0.58 1.20 0.00 0.00 173.24 176.57 2dai h VAL 57 N 4.08 1.61 0.15 4.45 2.07 -1.91 -2.94 116.25 123.76 2dai h VAL 57 Ca -0.50 -2.19 -0.01 0.00 0.82 0.00 0.00 66.70 64.82 2dai h VAL 57 Cb 1.21 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 34.02 2dai h VAL 57 CO 0.64 0.59 -0.07 1.55 0.02 0.00 0.00 177.57 180.31 2dai h PRO 58 N -0.61 -0.19 -0.93 1.57 0.13 -1.97 -3.20 132.00 126.80 2dai h PRO 58 Ca -0.05 0.01 0.24 0.00 -0.87 0.00 0.00 66.00 65.33 2dai h PRO 58 Cb 1.14 0.04 -0.17 0.00 0.13 0.00 0.00 31.00 32.15 2dai h PRO 58 CO 0.06 -0.13 0.01 1.96 -0.23 0.00 0.00 178.00 179.67 2dai h GLN 59 N -0.62 0.04 -0.63 0.86 1.08 -1.94 0.84 115.11 114.75 2dai h GLN 59 Ca -0.02 -0.00 0.13 0.00 -1.45 0.00 0.00 58.65 57.31 2dai h GLN 59 Cb 0.15 -0.01 -0.11 0.00 -0.05 0.00 0.00 27.48 27.46 2dai h GLN 59 CO 0.03 0.03 -0.07 0.00 -0.95 0.00 0.00 178.83 177.87 2dai h ALA 60 N 1.90 0.53 -0.17 3.87 0.00 -1.63 -1.23 119.26 122.54 2dai h ALA 60 Ca 0.54 0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.69 2dai h ALA 60 Cb 1.05 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 19.21 2dai h ALA 60 CO -0.85 -0.41 -0.24 1.98 0.00 0.00 0.00 179.25 179.72 2dai h MET 61 N 0.06 -0.17 -0.79 0.00 1.85 0.73 0.26 114.93 116.88 2dai h MET 61 Ca 0.32 0.01 0.19 0.00 -0.61 0.00 0.00 59.70 59.61 2dai h MET 61 Cb 0.51 0.04 -0.13 0.00 0.43 0.00 0.00 31.60 32.45 2dai h MET 61 CO -0.59 -0.11 0.11 0.93 -0.40 0.00 0.00 176.91 176.85 2dai h GLU 62 N -0.17 0.17 -0.82 0.39 5.08 -1.27 1.52 114.58 119.47 2dai h GLU 62 Ca 0.03 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.49 2dai h GLU 62 Cb 0.26 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.41 2dai h GLU 62 CO -0.26 0.11 0.53 2.35 -1.00 0.00 0.00 179.01 180.75 2dai h TRP 63 N 0.17 0.78 -0.05 4.33 7.01 0.07 1.17 115.95 129.42 2dai h TRP 63 Ca 0.45 0.02 -0.21 0.00 2.11 0.00 0.00 58.89 61.27 2dai h TRP 63 Cb 0.84 -0.25 0.00 0.00 -2.10 0.00 0.00 29.16 27.65 2dai h TRP 63 CO -0.34 0.34 -0.83 -0.07 -2.79 0.00 0.00 178.44 174.75 2dai h LEU 64 N 0.70 0.56 -0.91 0.65 3.38 0.52 0.18 115.31 120.39 2dai h LEU 64 Ca 0.39 -0.40 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2dai h LEU 64 Cb 0.54 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2dai h LEU 64 CO -0.16 1.17 -0.50 0.40 0.09 0.00 0.00 178.44 179.44 2dai h ILE 65 N 0.29 1.36 0.00 1.22 2.04 0.33 0.10 117.51 122.85 2dai h ILE 65 Ca -0.05 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 64.06 2dai h ILE 65 Cb 1.43 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 39.41 2dai h ILE 65 CO 0.15 0.51 -0.01 -0.08 0.00 0.00 0.00 178.15 178.71 2dai h GLU 66 N 0.08 0.00 -0.10 2.37 4.81 0.13 -3.33 114.58 118.55 2dai h GLU 66 Ca 0.00 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2dai h GLU 66 Cb 0.92 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.30 2dai h GLU 66 CO 0.07 0.00 0.30 0.45 -0.73 0.00 0.00 179.01 179.10 2dai h HIS 67 N -0.24 0.00 -0.99 0.92 3.86 -0.77 -1.41 115.15 116.53 2dai h HIS 67 Ca 0.00 0.00 0.35 0.00 -1.16 0.00 0.00 60.37 59.56 2dai h HIS 67 Cb 0.01 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 28.31 2dai h HIS 67 CO -0.00 0.00 0.42 0.00 0.86 0.00 0.00 177.93 179.21 2dai h ALA 68 N 1.50 1.85 -0.85 2.45 0.00 -0.89 1.34 119.26 124.66 2dai h ALA 68 Ca 0.05 0.26 -0.65 0.00 0.00 0.00 0.00 54.91 54.57 2dai h ALA 68 Cb 0.64 0.34 -0.24 0.00 0.00 0.00 0.00 17.79 18.53 2dai h ALA 68 CO -0.00 -0.75 0.82 0.39 0.00 0.00 0.00 179.25 179.71 2dai n GLU 69 N -5.26 2.58 -4.33 0.00 1.02 -0.53 -4.89 120.64 109.24 2dai n GLU 69 Ca 0.32 -3.04 -0.27 0.00 -0.02 0.00 0.00 57.16 54.15 2dai n GLU 69 Cb 1.06 -2.19 -0.17 0.00 -0.02 0.00 0.00 31.44 30.13 2dai n GLU 69 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dai s ASP 70 N -0.83 2.22 0.26 1.62 2.15 0.46 -5.00 116.67 117.54 2dai s ASP 70 Ca 0.55 -0.37 0.25 0.00 0.43 0.00 0.00 52.55 53.41 2dai s ASP 70 Cb 0.43 -0.97 0.90 0.00 -0.30 0.00 0.00 42.92 42.98 2dai s ASP 70 CO -0.25 -0.02 1.75 1.55 -0.17 0.00 0.00 175.17 178.04 2dai h PRO 71 N 7.53 0.00 -2.43 4.34 0.13 -1.90 -3.33 132.00 136.33 2dai h PRO 71 Ca -0.31 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.22 2dai h PRO 71 Cb 1.16 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.88 2dai h PRO 71 CO 0.47 0.00 -0.67 0.25 -0.23 0.00 0.00 178.00 177.82 2dai n THR 72 N -2.32 1.61 -0.10 1.56 -2.24 -1.26 -4.55 114.28 106.97 2dai n THR 72 Ca 0.04 -4.88 -0.19 0.00 -2.27 0.00 0.00 64.05 56.74 2dai n THR 72 Cb 0.34 -2.08 -0.08 0.00 -2.10 0.00 0.00 70.33 66.40 2dai n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dai n ILE 73 N 1.34 1.14 -0.01 2.28 3.06 -1.25 -4.90 119.36 121.02 2dai n ILE 73 Ca 0.26 -0.35 -0.03 0.00 -2.50 0.00 0.00 62.75 60.14 2dai n ILE 73 Cb 0.41 -1.56 -0.01 0.00 0.54 0.00 0.00 39.64 39.02 2dai n ILE 73 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 2dai n ASP 74 N -3.61 0.98 -4.09 9.51 5.68 -1.26 -5.07 116.55 118.69 2dai n ASP 74 Ca -0.39 0.15 -0.17 0.00 -0.50 0.00 0.00 54.79 53.88 2dai n ASP 74 Cb 0.82 -0.41 -0.13 0.00 -1.14 0.00 0.00 41.12 40.26 2dai n ASP 74 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2dai s THR 75 N -1.92 0.82 0.67 2.12 2.01 -1.26 -5.15 115.64 112.92 2dai s THR 75 Ca -0.08 -0.96 -0.12 0.00 0.31 0.00 0.00 61.69 60.83 2dai s THR 75 Cb 0.01 -0.79 -0.00 0.00 0.01 0.00 0.00 72.50 71.73 2dai s THR 75 CO 0.12 -0.15 1.06 -2.16 -0.69 0.00 0.00 174.62 172.80 2dai s PRO 76 N -1.24 3.05 0.43 4.92 0.04 -1.26 -4.67 135.00 136.26 2dai s PRO 76 Ca -0.03 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.01 2dai s PRO 76 Cb -0.08 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2dai s PRO 76 CO 0.01 -1.01 0.00 1.28 0.04 0.00 0.00 177.00 177.31 2dai n LEU 77 N -2.87 -0.78 -4.00 -3.56 4.77 -1.26 -4.82 117.00 104.48 2dai n LEU 77 Ca 0.08 1.79 -0.30 0.00 -0.03 0.00 0.00 56.01 57.54 2dai n LEU 77 Cb 0.53 -4.39 -0.16 0.00 -2.33 0.00 0.00 43.42 37.08 2dai n LEU 77 CO 0.54 -2.88 -0.46 -0.94 -1.33 0.00 0.00 177.39 172.32 2dai s SER 78 N -6.82 3.31 -0.48 -1.43 1.04 -1.26 -5.07 113.70 102.99 2dai s SER 78 Ca 0.00 -0.84 -0.05 0.00 0.48 0.00 0.00 55.95 55.55 2dai s SER 78 Cb 0.00 -1.23 0.13 0.00 0.10 0.00 0.00 66.02 65.02 2dai s SER 78 CO 0.00 -0.13 0.31 -0.83 0.98 0.00 0.00 173.24 173.56 2dai s GLY 79 N 1.41 2.14 -1.13 7.32 0.00 -1.26 -4.99 107.32 110.80 2dai s GLY 79 Ca -0.00 -2.73 -0.16 0.00 0.00 0.00 0.00 44.72 41.83 2dai s GLY 79 CO -0.08 1.07 2.17 -1.55 0.00 0.00 0.00 173.10 174.71 2dai n PRO 80 N 4.39 2.31 -0.10 2.90 -0.04 -1.26 -4.26 135.00 138.95 2dai n PRO 80 Ca -0.01 -2.10 -0.20 0.00 -0.04 0.00 0.00 63.50 61.15 2dai n PRO 80 Cb 0.40 -2.97 -0.07 0.00 -0.04 0.00 0.00 33.50 30.83 2dai n PRO 80 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dai n SER 81 N 6.09 1.44 -4.81 3.54 3.41 -1.26 -5.01 113.62 117.02 2dai n SER 81 Ca 0.53 0.25 -0.32 0.00 -0.26 0.00 0.00 58.87 59.07 2dai n SER 81 Cb 0.34 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.63 2dai n SER 81 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dai s SER 82 N -6.73 5.83 0.00 4.04 1.04 -1.26 -5.36 113.70 111.26 2dai s SER 82 Ca -0.27 0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.31 2dai s SER 82 Cb 0.10 -1.69 0.00 0.00 0.10 0.00 0.00 66.02 64.53 2dai s SER 82 CO 0.35 0.24 0.00 0.61 0.98 0.00 0.00 173.24 175.42