#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pdn n SER 2 N 0.00 0.74 -4.24 0.00 3.41 -1.26 -4.89 113.62 107.38 2pdn n SER 2 Ca 0.00 -0.74 -0.21 0.00 -0.26 0.00 0.00 58.87 57.67 2pdn n SER 2 Cb 0.00 1.24 -0.12 0.00 -0.26 0.00 0.00 64.21 65.07 2pdn n SER 2 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2pdn s ARG 3 N -3.13 1.00 -0.05 4.33 0.52 -1.26 -0.48 118.95 119.88 2pdn s ARG 3 Ca 0.04 -1.12 0.04 0.00 -0.52 0.00 0.00 55.73 54.18 2pdn s ARG 3 Cb 0.15 -1.10 -0.02 0.00 0.52 0.00 0.00 34.95 34.50 2pdn s ARG 3 CO 0.88 0.24 -0.17 -1.50 0.02 0.00 0.00 175.30 174.77 2pdn s ILE 4 N -1.43 2.84 -0.10 1.52 2.07 0.67 -4.85 121.20 121.92 2pdn s ILE 4 Ca 0.04 -0.80 -0.30 0.00 -1.41 0.00 0.00 60.65 58.18 2pdn s ILE 4 Cb -0.09 -2.09 -0.03 0.00 0.13 0.00 0.00 42.46 40.38 2pdn s ILE 4 CO 0.03 0.59 1.29 -0.22 -1.91 0.00 0.00 174.94 174.72 2pdn s LEU 5 N -0.63 4.24 0.61 8.50 2.96 -1.26 -0.63 118.68 132.47 2pdn s LEU 5 Ca 0.09 1.83 -0.06 0.00 -0.22 0.00 0.00 54.13 55.78 2pdn s LEU 5 Cb -0.11 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 43.05 2pdn s LEU 5 CO 0.01 -0.71 0.91 -0.76 -1.32 0.00 0.00 176.35 174.48 2pdn s LEU 6 N 2.97 3.16 0.00 -0.68 1.43 0.49 -4.96 118.68 121.09 2pdn s LEU 6 Ca 0.58 0.62 0.13 0.00 -1.03 0.00 0.00 54.13 54.43 2pdn s LEU 6 Cb -0.25 -3.42 0.76 0.00 0.03 0.00 0.00 46.19 43.31 2pdn s LEU 6 CO 0.20 -1.17 1.20 -0.46 0.23 0.00 0.00 176.35 176.34 2pdn n ASN 7 N -2.63 0.00 -0.85 2.29 0.23 -1.26 -1.95 115.26 111.09 2pdn n ASN 7 Ca 0.05 -0.68 0.09 0.00 -0.53 0.00 0.00 54.58 53.51 2pdn n ASN 7 Cb 0.58 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.44 2pdn n ASN 7 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2pdn n ASN 8 N -0.87 2.97 0.00 0.53 6.94 -1.26 -4.95 115.26 118.62 2pdn n ASN 8 Ca 0.10 -1.87 0.00 0.00 -0.02 0.00 0.00 54.58 52.79 2pdn n ASN 8 Cb 0.04 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 2pdn n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2pdn n GLY 9 N 1.01 0.93 3.92 4.83 0.00 -0.82 -5.04 105.19 110.02 2pdn n GLY 9 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 2pdn n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pdn s ALA 10 N -3.69 3.57 -0.17 4.61 0.00 -1.26 -4.86 121.76 119.96 2pdn s ALA 10 Ca 0.00 -0.70 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 2pdn s ALA 10 Cb 0.00 -2.33 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 2pdn s ALA 10 CO 0.00 -0.12 -0.03 0.15 0.00 0.00 0.00 175.76 175.76 2pdn s LYS 11 N -4.40 3.65 -0.20 0.00 -0.14 -1.26 -0.38 119.74 117.02 2pdn s LYS 11 Ca 0.43 -0.52 -0.06 0.00 -1.36 0.00 0.00 55.97 54.46 2pdn s LYS 11 Cb -0.10 -2.95 -0.03 0.00 -1.68 0.00 0.00 37.83 33.07 2pdn s LYS 11 CO 0.39 0.18 0.02 1.41 -0.76 0.00 0.00 175.35 176.59 2pdn s MET 12 N 0.53 3.72 0.26 1.68 -2.45 0.20 -4.86 119.30 118.39 2pdn s MET 12 Ca -0.03 -0.47 -0.30 0.00 -1.25 0.00 0.00 55.69 53.64 2pdn s MET 12 Cb -0.14 -3.13 -0.11 0.00 1.25 0.00 0.00 34.83 32.70 2pdn s MET 12 CO 0.03 0.08 1.57 -2.14 1.05 0.00 0.00 175.02 175.61 2pdn s PRO 13 N 0.84 4.16 0.25 4.11 0.02 -1.26 -0.24 135.00 142.89 2pdn s PRO 13 Ca 0.02 2.50 0.25 0.00 0.02 0.00 0.00 61.00 63.79 2pdn s PRO 13 Cb -0.14 -3.06 0.85 0.00 0.02 0.00 0.00 34.50 32.17 2pdn s PRO 13 CO 0.02 -0.59 1.76 -0.84 -0.33 0.00 0.00 177.00 177.01 2pdn h ILE 14 N 3.53 0.00 -3.25 2.83 3.07 -1.12 -3.41 117.51 119.15 2pdn h ILE 14 Ca -0.46 -0.44 -0.67 0.00 1.55 0.00 0.00 64.86 64.84 2pdn h ILE 14 Cb 1.22 1.37 -0.35 0.00 -0.27 0.00 0.00 36.82 38.79 2pdn h ILE 14 CO 0.82 0.00 -0.83 -0.22 -1.05 0.00 0.00 178.15 176.87 2pdn s LEU 15 N -4.69 2.49 0.43 0.16 2.96 -1.26 -0.02 118.68 118.74 2pdn s LEU 15 Ca 0.08 -0.77 0.03 0.00 -0.22 0.00 0.00 54.13 53.25 2pdn s LEU 15 Cb 0.11 -1.53 -0.03 0.00 0.50 0.00 0.00 46.19 45.25 2pdn s LEU 15 CO 0.54 -0.04 0.09 -0.83 -1.32 0.00 0.00 176.35 174.79 2pdn s GLY 16 N 1.28 2.67 -0.26 7.98 0.00 -0.28 -4.37 107.32 114.34 2pdn s GLY 16 Ca 0.02 -1.11 -0.10 0.00 0.00 0.00 0.00 44.72 43.53 2pdn s GLY 16 CO -0.10 -1.92 0.15 -2.27 0.00 0.00 0.00 173.10 168.96 2pdn s LEU 17 N -3.66 3.90 0.46 0.66 2.96 0.03 -3.31 118.68 119.71 2pdn s LEU 17 Ca 0.21 -0.03 -0.22 0.00 -0.22 0.00 0.00 54.13 53.86 2pdn s LEU 17 Cb 0.03 -2.07 -0.08 0.00 0.50 0.00 0.00 46.19 44.57 2pdn s LEU 17 CO 0.12 -0.02 1.08 -0.83 -1.32 0.00 0.00 176.35 175.38 2pdn s GLY 18 N 1.57 2.65 0.00 7.98 0.00 -0.52 -0.98 107.32 118.03 2pdn s GLY 18 Ca 0.07 0.73 0.00 0.00 0.00 0.00 0.00 44.72 45.52 2pdn s GLY 18 CO 0.08 1.12 0.60 -1.30 0.00 0.00 0.00 173.10 173.60 2pdn n THR 19 N -0.62 0.34 -2.12 0.90 -2.24 -1.13 -4.21 114.28 105.20 2pdn n THR 19 Ca 0.08 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 61.05 2pdn n THR 19 Cb 0.50 0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 69.67 2pdn n THR 19 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2pdn s TRP 20 N -0.34 3.05 0.00 4.78 -0.00 -1.26 -2.20 118.94 122.98 2pdn s TRP 20 Ca 0.00 0.81 0.00 0.00 -0.00 0.00 0.00 56.10 56.91 2pdn s TRP 20 Cb 0.00 -3.74 0.00 0.00 -0.00 0.00 0.00 33.47 29.73 2pdn s TRP 20 CO 0.00 -2.69 0.00 1.63 -0.00 0.00 0.00 176.95 175.89 2pdn n LYS 21 N 4.43 -0.12 -2.47 5.86 5.02 -1.26 -5.00 118.16 124.62 2pdn n LYS 21 Ca 0.13 0.03 -0.43 0.00 -2.02 0.00 0.00 58.31 56.02 2pdn n LYS 21 Cb 0.42 -3.00 -0.02 0.00 -0.02 0.00 0.00 35.03 32.41 2pdn n LYS 21 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2pdn s SER 22 N -2.42 6.62 0.60 4.39 0.01 -0.93 -5.00 113.70 116.97 2pdn s SER 22 Ca 0.00 0.94 -0.20 0.00 1.31 0.00 0.00 55.95 58.01 2pdn s SER 22 Cb 0.00 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 2pdn s SER 22 CO 0.00 -1.17 1.34 -2.65 0.41 0.00 0.00 173.24 171.17 2pdn n PRO 23 N 7.54 1.41 0.14 12.44 -0.02 -1.26 -4.60 135.00 150.65 2pdn n PRO 23 Ca 0.14 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 62.30 2pdn n PRO 23 Cb 0.47 -2.57 0.69 0.00 -0.02 0.00 0.00 33.50 32.08 2pdn n PRO 23 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2pdn h PRO 24 N 0.98 0.00 0.00 0.52 0.11 -1.93 0.22 132.00 131.90 2pdn h PRO 24 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2pdn h PRO 24 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2pdn h PRO 24 CO 0.55 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.75 2pdn n GLY 25 N -1.56 -1.00 0.00 -0.55 0.00 -1.26 -3.92 105.19 96.90 2pdn n GLY 25 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2pdn n GLY 25 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2pdn n GLN 26 N -2.22 3.48 0.18 1.61 3.00 -0.19 -4.87 117.38 118.37 2pdn n GLN 26 Ca -0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 2pdn n GLN 26 Cb 0.10 -0.42 0.28 0.00 0.00 0.00 0.00 30.24 30.21 2pdn n GLN 26 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 2pdn h VAL 27 N 0.00 0.91 -0.16 5.09 3.04 -0.76 -2.30 116.25 122.07 2pdn h VAL 27 Ca 0.00 -1.66 -0.01 0.00 -1.01 0.00 0.00 66.70 64.02 2pdn h VAL 27 Cb 0.00 2.01 -0.01 0.00 -2.01 0.00 0.00 31.29 31.29 2pdn h VAL 27 CO 0.00 0.40 0.05 0.74 -1.01 0.00 0.00 177.57 177.75 2pdn h THR 28 N 0.00 1.19 -0.80 3.17 2.02 -1.77 -1.04 112.91 115.68 2pdn h THR 28 Ca -0.00 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 2pdn h THR 28 Cb 0.98 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 68.64 2pdn h THR 28 CO 0.05 0.18 0.46 -0.33 0.37 0.00 0.00 175.52 176.25 2pdn h GLU 29 N 0.07 1.10 -0.36 6.66 4.39 -1.89 -1.81 114.58 122.74 2pdn h GLU 29 Ca 0.05 -0.12 0.07 0.00 0.34 0.00 0.00 59.36 59.71 2pdn h GLU 29 Cb 0.24 -0.22 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 2pdn h GLU 29 CO -0.00 0.80 -0.06 0.00 -1.16 0.00 0.00 179.01 178.59 2pdn h ALA 30 N 1.24 0.28 -0.38 3.43 0.00 -1.03 -0.57 119.26 122.23 2pdn h ALA 30 Ca 0.28 0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.23 2pdn h ALA 30 Cb -0.00 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2pdn h ALA 30 CO -0.05 -0.44 -0.13 0.28 0.00 0.00 0.00 179.25 178.91 2pdn h VAL 31 N 0.04 1.28 -0.62 0.00 2.07 -1.06 0.16 116.25 118.12 2pdn h VAL 31 Ca 0.18 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.46 2pdn h VAL 31 Cb 0.26 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2pdn h VAL 31 CO -0.34 0.41 0.40 0.11 0.02 0.00 0.00 177.57 178.17 2pdn h LYS 32 N 0.57 0.82 -0.49 1.57 1.57 -0.99 -0.46 116.57 119.16 2pdn h LYS 32 Ca 0.09 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 2pdn h LYS 32 Cb 0.67 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 2pdn h LYS 32 CO 0.05 0.56 0.06 0.28 -0.57 0.00 0.00 179.45 179.82 2pdn h VAL 33 N 0.84 1.25 -0.26 0.50 2.07 -0.98 -2.06 116.25 117.61 2pdn h VAL 33 Ca 0.23 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.83 2pdn h VAL 33 Cb -0.07 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2pdn h VAL 33 CO -0.05 0.34 0.01 0.00 0.02 0.00 0.00 177.57 177.89 2pdn h ALA 34 N 0.95 0.24 -0.82 1.67 0.00 -0.35 -0.94 119.26 120.02 2pdn h ALA 34 Ca 0.15 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2pdn h ALA 34 Cb 0.42 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2pdn h ALA 34 CO 0.01 -0.40 0.35 0.82 0.00 0.00 0.00 179.25 180.03 2pdn h ILE 35 N 0.10 1.26 -0.89 0.00 2.04 -1.04 -0.26 117.51 118.71 2pdn h ILE 35 Ca 0.12 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 2pdn h ILE 35 Cb 0.15 0.25 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 2pdn h ILE 35 CO -0.20 0.33 0.49 0.44 0.00 0.00 0.00 178.15 179.21 2pdn h ASP 36 N 1.18 1.11 -0.41 1.72 3.32 -0.85 -2.72 116.42 119.78 2pdn h ASP 36 Ca 0.28 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2pdn h ASP 36 Cb 0.18 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2pdn h ASP 36 CO -0.03 0.89 0.00 1.33 -1.72 0.00 0.00 179.24 179.71 2pdn n VAL 37 N -4.33 0.54 0.00 -1.35 0.24 -0.40 -4.92 118.33 108.11 2pdn n VAL 37 Ca 0.10 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 2pdn n VAL 37 Cb 0.10 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 2pdn n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pdn n GLY 38 N 1.33 1.01 3.76 7.63 0.00 -0.66 -5.05 105.19 113.22 2pdn n GLY 38 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2pdn n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pdn s TYR 39 N -1.57 3.06 0.00 1.61 1.51 -0.20 -4.88 117.35 116.87 2pdn s TYR 39 Ca 0.00 1.32 0.00 0.00 -1.01 0.00 0.00 57.07 57.38 2pdn s TYR 39 Cb 0.00 -3.70 0.00 0.00 -0.11 0.00 0.00 41.96 38.15 2pdn s TYR 39 CO 0.00 -2.03 0.25 0.54 -1.11 0.00 0.00 175.55 173.21 2pdn n ARG 40 N 1.27 2.64 -4.41 -0.62 5.12 -1.26 -4.29 116.66 115.11 2pdn n ARG 40 Ca 0.02 -0.25 -0.32 0.00 -1.93 0.00 0.00 57.85 55.37 2pdn n ARG 40 Cb 0.42 -0.74 -0.16 0.00 -1.16 0.00 0.00 32.46 30.81 2pdn n ARG 40 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 2pdn s HIS 41 N -0.45 2.56 -0.13 -1.55 2.46 -1.26 0.57 115.29 117.49 2pdn s HIS 41 Ca 0.00 -1.37 0.02 0.00 0.47 0.00 0.00 55.06 54.18 2pdn s HIS 41 Cb 0.00 -1.77 0.01 0.00 -0.13 0.00 0.00 32.58 30.69 2pdn s HIS 41 CO 0.00 -0.66 -0.21 0.42 -2.47 0.00 0.00 174.74 171.82 2pdn s ILE 42 N 1.05 1.95 -0.32 0.89 -1.09 -1.01 -0.79 121.20 121.89 2pdn s ILE 42 Ca -0.02 -0.92 -0.15 0.00 -2.23 0.00 0.00 60.65 57.33 2pdn s ILE 42 Cb -0.14 -1.73 -0.02 0.00 -1.58 0.00 0.00 42.46 38.98 2pdn s ILE 42 CO -0.06 0.53 0.36 -0.62 -1.23 0.00 0.00 174.94 173.92 2pdn s ASP 43 N 0.83 6.20 0.38 3.58 2.15 -0.15 -1.48 116.67 128.17 2pdn s ASP 43 Ca -0.07 -0.06 0.06 0.00 0.43 0.00 0.00 52.55 52.90 2pdn s ASP 43 Cb -0.15 -2.20 -0.07 0.00 -0.30 0.00 0.00 42.92 40.19 2pdn s ASP 43 CO -0.01 -0.29 0.03 0.00 -0.17 0.00 0.00 175.17 174.73 2pdn s ALA 45 N -2.94 -1.83 0.37 0.00 0.00 -1.26 -3.69 121.76 112.41 2pdn s ALA 45 Ca 0.35 1.93 0.06 0.00 0.00 0.00 0.00 51.96 54.29 2pdn s ALA 45 Cb 0.09 -1.15 0.77 0.00 0.00 0.00 0.00 23.12 22.83 2pdn s ALA 45 CO 0.17 -0.31 1.98 1.25 0.00 0.00 0.00 175.76 178.84 2pdn h HIS 46 N 4.57 0.70 0.00 0.00 -0.00 -1.98 -0.82 115.15 117.63 2pdn h HIS 46 Ca -0.28 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.10 2pdn h HIS 46 Cb 1.16 -0.23 0.00 0.00 -0.00 0.00 0.00 27.41 28.34 2pdn h HIS 46 CO 0.37 0.39 0.00 -0.24 -0.00 0.00 0.00 177.93 178.45 2pdn h VAL 47 N 0.71 0.00 0.00 5.26 3.04 -1.96 -2.43 116.25 120.87 2pdn h VAL 47 Ca 0.28 -0.25 0.00 0.00 -1.01 0.00 0.00 66.70 65.71 2pdn h VAL 47 Cb 0.19 1.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 2pdn h VAL 47 CO -0.08 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.26 2pdn n TYR 48 N -2.39 0.00 -3.76 3.17 4.01 -0.31 -4.92 117.16 112.96 2pdn n TYR 48 Ca 0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.47 2pdn n TYR 48 Cb 0.22 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 38.85 2pdn n TYR 48 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2pdn n GLN 49 N -1.39 -2.95 -0.01 -0.72 1.13 -0.91 -4.77 117.38 107.76 2pdn n GLN 49 Ca 0.11 0.36 0.00 0.00 -1.94 0.00 0.00 57.00 55.52 2pdn n GLN 49 Cb 0.28 -5.04 0.00 0.00 0.11 0.00 0.00 30.24 25.59 2pdn n GLN 49 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 2pdn n ASN 50 N -2.38 0.74 -0.12 1.08 2.04 -1.26 -4.85 115.26 110.50 2pdn n ASN 50 Ca 0.04 -1.41 0.00 0.00 -0.44 0.00 0.00 54.58 52.78 2pdn n ASN 50 Cb 0.51 -0.01 0.28 0.00 -2.53 0.00 0.00 39.78 38.02 2pdn n ASN 50 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 2pdn h GLU 51 N 0.00 0.79 -0.61 -3.83 5.08 -1.87 -1.46 114.58 112.69 2pdn h GLU 51 Ca 0.00 -0.09 0.08 0.00 -1.00 0.00 0.00 59.36 58.35 2pdn h GLU 51 Cb 0.84 -0.16 -0.10 0.00 0.50 0.00 0.00 28.75 29.82 2pdn h GLU 51 CO 0.00 0.60 -0.48 -0.91 -1.00 0.00 0.00 179.01 177.22 2pdn h ASN 52 N 0.80 -1.65 0.44 1.42 2.35 -1.91 0.15 115.58 117.17 2pdn h ASN 52 Ca 0.20 0.26 -0.12 0.00 -0.55 0.00 0.00 56.30 56.09 2pdn h ASN 52 Cb 0.05 0.73 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 2pdn h ASN 52 CO -0.03 -0.34 -0.53 -0.33 -1.65 0.00 0.00 177.43 174.55 2pdn h GLU 53 N -0.23 0.10 -0.46 0.81 3.07 -1.60 -0.55 114.58 115.72 2pdn h GLU 53 Ca 0.16 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.89 2pdn h GLU 53 Cb 0.56 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.45 2pdn h GLU 53 CO -0.71 0.61 0.02 0.28 -1.40 0.00 0.00 179.01 177.82 2pdn h VAL 54 N 0.08 1.26 -0.40 3.13 2.07 -0.96 -2.94 116.25 118.49 2pdn h VAL 54 Ca -0.00 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.47 2pdn h VAL 54 Cb 0.97 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 2pdn h VAL 54 CO 0.08 0.35 0.09 1.23 0.02 0.00 0.00 177.57 179.34 2pdn h GLY 55 N 0.65 0.63 0.77 2.17 0.00 0.02 -1.99 103.07 105.31 2pdn h GLY 55 Ca 0.13 -0.33 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2pdn h GLY 55 CO 0.02 0.31 0.14 -2.08 0.00 0.00 0.00 176.54 174.93 2pdn h VAL 56 N 0.57 0.94 -0.33 4.60 2.07 -1.02 -0.93 116.25 122.16 2pdn h VAL 56 Ca 0.13 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 2pdn h VAL 56 Cb 0.22 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2pdn h VAL 56 CO -0.00 0.05 0.08 0.00 0.02 0.00 0.00 177.57 177.72 2pdn h ALA 57 N 1.20 0.43 -0.28 1.67 0.00 -1.30 -2.26 119.26 118.72 2pdn h ALA 57 Ca 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2pdn h ALA 57 Cb 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2pdn h ALA 57 CO -0.13 0.10 0.18 0.82 0.00 0.00 0.00 179.25 180.22 2pdn h ILE 58 N 0.37 1.08 -0.72 0.00 2.04 -1.14 -1.83 117.51 117.32 2pdn h ILE 58 Ca 0.10 -0.16 0.07 0.00 1.00 0.00 0.00 64.86 65.87 2pdn h ILE 58 Cb 0.30 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 2pdn h ILE 58 CO 0.00 0.08 0.40 -0.61 0.00 0.00 0.00 178.15 178.02 2pdn h GLN 59 N 0.37 0.69 -0.24 2.37 4.15 -1.04 -0.92 115.11 120.48 2pdn h GLN 59 Ca 0.10 -0.04 -0.20 0.00 0.77 0.00 0.00 58.65 59.28 2pdn h GLN 59 Cb -0.03 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.51 2pdn h GLN 59 CO -0.02 0.45 -0.62 1.49 -1.93 0.00 0.00 178.83 178.20 2pdn h GLU 60 N 0.71 0.82 0.00 1.69 4.81 -1.18 -1.21 114.58 120.22 2pdn h GLU 60 Ca 0.33 -0.56 -0.06 0.00 -0.13 0.00 0.00 59.36 58.94 2pdn h GLU 60 Cb 0.25 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 2pdn h GLU 60 CO -0.21 1.19 -0.26 0.87 -0.73 0.00 0.00 179.01 179.86 2pdn h LYS 61 N 0.61 0.00 -0.55 1.92 1.79 -0.75 0.51 116.57 120.10 2pdn h LYS 61 Ca -0.01 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 2pdn h LYS 61 Cb 1.23 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.85 2pdn h LYS 61 CO 0.13 0.26 0.15 -0.07 -1.08 0.00 0.00 179.45 178.85 2pdn h LEU 62 N 0.00 0.81 -0.65 2.94 3.38 -1.01 -0.96 115.31 119.84 2pdn h LEU 62 Ca -0.00 -0.22 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 2pdn h LEU 62 Cb 0.80 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2pdn h LEU 62 CO 0.03 0.82 -0.53 0.03 0.09 0.00 0.00 178.44 178.88 2pdn h ARG 63 N 0.77 0.40 0.00 1.13 3.08 -0.41 -2.51 114.38 116.83 2pdn h ARG 63 Ca 0.17 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2pdn h ARG 63 Cb 0.31 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.38 2pdn h ARG 63 CO -0.00 0.83 0.00 0.39 -1.07 0.00 0.00 179.97 180.12 2pdn n GLU 64 N -3.95 0.22 -2.41 0.04 1.02 0.09 -4.92 120.64 110.75 2pdn n GLU 64 Ca -0.02 0.10 -0.14 0.00 -0.02 0.00 0.00 57.16 57.07 2pdn n GLU 64 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.50 2pdn n GLU 64 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2pdn n GLN 65 N -1.34 -1.73 0.08 3.49 6.02 -0.95 -4.93 117.38 118.02 2pdn n GLN 65 Ca 0.09 0.66 -0.16 0.00 -0.01 0.00 0.00 57.00 57.57 2pdn n GLN 65 Cb 0.19 -4.92 -0.14 0.00 1.02 0.00 0.00 30.24 26.39 2pdn n GLN 65 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2pdn h VAL 66 N -0.26 1.33 -3.96 5.09 2.07 -1.41 -3.47 116.25 115.63 2pdn h VAL 66 Ca -0.34 -2.94 -0.10 0.00 0.82 0.00 0.00 66.70 64.14 2pdn h VAL 66 Cb 1.24 2.85 -0.14 0.00 -1.52 0.00 0.00 31.29 33.72 2pdn h VAL 66 CO 0.39 0.85 -0.47 0.68 0.02 0.00 0.00 177.57 179.03 2pdn s VAL 67 N -2.64 0.16 0.14 2.57 -7.23 -1.22 -5.06 120.40 107.13 2pdn s VAL 67 Ca -0.06 -1.41 0.04 0.00 -1.81 0.00 0.00 61.98 58.74 2pdn s VAL 67 Cb 0.07 -1.43 -0.04 0.00 0.56 0.00 0.00 36.38 35.54 2pdn s VAL 67 CO 0.87 -0.75 0.13 -0.54 -0.31 0.00 0.00 175.10 174.50 2pdn s LYS 68 N -3.89 2.93 0.27 4.82 1.02 -1.26 -4.39 119.74 119.24 2pdn s LYS 68 Ca 0.06 -0.79 -0.01 0.00 0.02 0.00 0.00 55.97 55.25 2pdn s LYS 68 Cb 0.06 -2.70 0.59 0.00 -0.52 0.00 0.00 37.83 35.26 2pdn s LYS 68 CO -0.10 0.51 1.69 -0.09 -0.92 0.00 0.00 175.35 176.45 2pdn h ARG 69 N 2.67 0.34 0.00 1.68 9.65 -1.97 -1.72 114.38 125.04 2pdn h ARG 69 Ca -0.47 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.38 2pdn h ARG 69 Cb 1.19 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.69 2pdn h ARG 69 CO 0.64 0.23 -0.02 0.93 2.80 0.00 0.00 179.97 184.55 2pdn h GLU 70 N 0.35 0.00 0.00 0.20 3.07 -2.03 -1.77 114.58 114.41 2pdn h GLU 70 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 2pdn h GLU 70 Cb 0.87 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 2pdn h GLU 70 CO -0.51 0.02 -0.33 0.93 -1.40 0.00 0.00 179.01 177.71 2pdn h GLU 71 N 0.00 0.00 -6.71 2.33 5.08 -1.72 -3.46 114.58 110.10 2pdn h GLU 71 Ca -0.00 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.86 2pdn h GLU 71 Cb 0.04 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2pdn h GLU 71 CO 0.00 0.00 0.09 -0.51 -1.00 0.00 0.00 179.01 177.59 2pdn s LEU 72 N -5.48 4.08 -0.40 1.33 1.43 -0.67 -4.85 118.68 114.13 2pdn s LEU 72 Ca 0.06 1.26 0.01 0.00 -1.03 0.00 0.00 54.13 54.43 2pdn s LEU 72 Cb 0.08 -4.05 0.12 0.00 0.03 0.00 0.00 46.19 42.38 2pdn s LEU 72 CO 0.69 -0.19 0.19 0.12 0.23 0.00 0.00 176.35 177.39 2pdn s PHE 73 N -1.96 1.98 -0.24 0.29 2.19 0.19 -4.96 117.98 115.48 2pdn s PHE 73 Ca 0.53 -2.25 -0.10 0.00 0.33 0.00 0.00 56.93 55.44 2pdn s PHE 73 Cb -0.10 -1.89 -0.05 0.00 -1.31 0.00 0.00 43.02 39.67 2pdn s PHE 73 CO 0.18 -0.82 0.15 0.42 1.83 0.00 0.00 175.22 176.98 2pdn s ILE 74 N 0.75 5.29 -0.12 3.12 -1.09 -1.26 -2.40 121.20 125.49 2pdn s ILE 74 Ca 0.15 0.16 -0.02 0.00 -2.23 0.00 0.00 60.65 58.70 2pdn s ILE 74 Cb -0.22 -3.46 -0.03 0.00 -1.58 0.00 0.00 42.46 37.16 2pdn s ILE 74 CO -0.07 0.35 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.26 2pdn s VAL 75 N 1.05 3.90 0.35 2.92 1.01 -0.55 -1.27 120.40 127.80 2pdn s VAL 75 Ca 0.07 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2pdn s VAL 75 Cb -0.14 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 2pdn s VAL 75 CO 0.04 0.53 0.25 -0.55 0.00 0.00 0.00 175.10 175.38 2pdn s SER 76 N -0.09 1.91 -0.01 3.32 0.15 -0.89 -0.99 113.70 117.11 2pdn s SER 76 Ca 0.02 -1.75 -0.00 0.00 0.70 0.00 0.00 55.95 54.92 2pdn s SER 76 Cb -0.13 0.56 0.01 0.00 -1.71 0.00 0.00 66.02 64.75 2pdn s SER 76 CO 0.03 -1.05 0.01 -0.54 1.20 0.00 0.00 173.24 172.89 2pdn s LYS 77 N -3.49 -0.01 -0.21 5.44 1.02 -1.24 -0.76 119.74 120.49 2pdn s LYS 77 Ca 0.37 0.05 -0.29 0.00 0.02 0.00 0.00 55.97 56.12 2pdn s LYS 77 Cb 0.02 -0.06 -0.02 0.00 -0.52 0.00 0.00 37.83 37.25 2pdn s LYS 77 CO 0.25 -0.04 1.47 -1.17 -0.92 0.00 0.00 175.35 174.94 2pdn s LEU 78 N 0.27 4.00 0.64 3.17 2.96 0.73 -3.96 118.68 126.49 2pdn s LEU 78 Ca -0.02 1.61 -0.14 0.00 -0.22 0.00 0.00 54.13 55.36 2pdn s LEU 78 Cb -0.03 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.11 2pdn s LEU 78 CO -0.01 -1.07 1.06 0.86 -1.32 0.00 0.00 176.35 175.87 2pdn s TRP 79 N 4.50 3.01 0.60 5.38 -0.11 -1.26 -2.07 118.94 128.98 2pdn s TRP 79 Ca 0.64 1.48 0.30 0.00 1.22 0.00 0.00 56.10 59.75 2pdn s TRP 79 Cb -0.23 -2.97 1.79 0.00 -1.50 0.00 0.00 33.47 30.56 2pdn s TRP 79 CO 0.25 -1.19 2.19 0.00 -4.62 0.00 0.00 176.95 173.57 2pdn n THR 81 N -3.75 0.21 -1.24 0.00 -2.24 -1.26 -0.15 114.28 105.86 2pdn n THR 81 Ca -0.01 -0.30 0.09 0.00 -2.27 0.00 0.00 64.05 61.56 2pdn n THR 81 Cb 0.20 0.22 0.16 0.00 -2.10 0.00 0.00 70.33 68.81 2pdn n THR 81 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2pdn n TYR 82 N 0.14 0.00 0.54 4.78 4.01 -0.81 -4.27 117.16 121.56 2pdn n TYR 82 Ca 0.14 -1.16 0.13 0.00 -0.16 0.00 0.00 57.90 56.85 2pdn n TYR 82 Cb 0.27 -0.18 0.44 0.00 -0.31 0.00 0.00 39.34 39.56 2pdn n TYR 82 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2pdn n HIS 83 N -1.34 0.87 -1.87 -0.72 8.25 -1.24 -3.88 115.22 115.29 2pdn n HIS 83 Ca 0.17 0.29 -0.41 0.00 -0.26 0.00 0.00 57.72 57.51 2pdn n HIS 83 Cb 0.66 -0.97 -0.01 0.00 1.12 0.00 0.00 29.99 30.79 2pdn n HIS 83 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2pdn s GLU 84 N -3.18 4.17 0.35 -0.41 8.01 -1.26 -4.52 118.70 121.85 2pdn s GLU 84 Ca 0.08 2.49 0.06 0.00 0.01 0.00 0.00 54.97 57.61 2pdn s GLU 84 Cb 0.11 -3.00 0.72 0.00 -4.31 0.00 0.00 34.13 27.65 2pdn s GLU 84 CO 0.52 -0.47 1.93 0.87 0.01 0.00 0.00 175.26 178.11 2pdn h LYS 85 N 3.46 0.77 0.00 1.61 1.57 -1.88 0.44 116.57 122.54 2pdn h LYS 85 Ca -0.50 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 2pdn h LYS 85 Cb 1.23 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2pdn h LYS 85 CO 0.67 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 180.47 2pdn n GLY 86 N -1.44 -0.80 0.00 3.86 0.00 -1.26 -3.11 105.19 102.45 2pdn n GLY 86 Ca 0.13 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 46.11 2pdn n GLY 86 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pdn n LEU 87 N -1.23 0.22 -0.18 0.99 4.77 0.13 -4.72 117.00 116.97 2pdn n LEU 87 Ca 0.09 -0.22 -0.08 0.00 -0.03 0.00 0.00 56.01 55.77 2pdn n LEU 87 Cb 0.12 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2pdn n LEU 87 CO 0.13 0.05 0.92 0.58 -1.33 0.00 0.00 177.39 177.74 2pdn h VAL 88 N 0.00 1.23 -0.53 4.08 2.07 -1.46 -2.33 116.25 119.31 2pdn h VAL 88 Ca 0.00 -0.79 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 2pdn h VAL 88 Cb 0.39 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2pdn h VAL 88 CO 0.00 0.29 0.17 0.50 0.02 0.00 0.00 177.57 178.56 2pdn h LYS 89 N 0.72 0.83 -0.67 1.57 3.64 -1.85 -1.04 116.57 119.76 2pdn h LYS 89 Ca 0.17 -0.17 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2pdn h LYS 89 Cb 0.29 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2pdn h LYS 89 CO -0.00 0.75 0.40 0.78 -2.27 0.00 0.00 179.45 179.11 2pdn h GLY 90 N 0.73 0.98 1.05 5.01 0.00 -1.85 0.22 103.07 109.21 2pdn h GLY 90 Ca 0.17 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 2pdn h GLY 90 CO -0.01 0.40 0.38 0.00 0.00 0.00 0.00 176.54 177.32 2pdn h ALA 91 N 1.20 1.09 -0.14 3.60 0.00 -1.01 0.16 119.26 124.16 2pdn h ALA 91 Ca 0.24 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2pdn h ALA 91 Cb -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2pdn h ALA 91 CO -0.04 0.67 -0.08 0.00 0.00 0.00 0.00 179.25 179.80 2pdn h GLN 93 N -0.03 0.23 -0.51 0.00 4.20 -0.45 0.25 115.11 118.81 2pdn h GLN 93 Ca 0.03 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2pdn h GLN 93 Cb 0.56 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 2pdn h GLN 93 CO 0.02 0.27 -0.07 -0.22 -0.67 0.00 0.00 178.83 178.17 2pdn h LYS 94 N 0.23 0.94 -0.50 1.46 1.63 -0.76 0.31 116.57 119.88 2pdn h LYS 94 Ca 0.06 -0.33 -0.04 0.00 -0.85 0.00 0.00 60.65 59.48 2pdn h LYS 94 Cb 0.18 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 2pdn h LYS 94 CO 0.00 0.99 0.14 1.15 -3.45 0.00 0.00 179.45 178.29 2pdn h THR 95 N 0.80 1.23 -0.70 1.00 2.02 -0.98 -0.14 112.91 116.15 2pdn h THR 95 Ca 0.14 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.51 2pdn h THR 95 Cb 0.61 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 2pdn h THR 95 CO 0.04 0.29 0.44 -0.07 0.37 0.00 0.00 175.52 176.59 2pdn h LEU 96 N 0.69 0.82 -0.31 2.58 3.38 -0.78 0.15 115.31 121.83 2pdn h LEU 96 Ca 0.16 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2pdn h LEU 96 Cb 0.30 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2pdn h LEU 96 CO -0.00 0.63 0.00 -1.28 0.09 0.00 0.00 178.44 177.88 2pdn h SER 97 N 0.95 0.54 -0.68 -0.43 0.87 -0.58 -0.78 113.55 113.45 2pdn h SER 97 Ca 0.25 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 2pdn h SER 97 Cb -0.06 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 2pdn h SER 97 CO -0.05 0.72 0.39 0.44 -0.53 0.00 0.00 176.83 177.80 2pdn h ASP 98 N 0.35 0.83 0.06 6.23 3.32 -0.90 -2.23 116.42 124.08 2pdn h ASP 98 Ca 0.09 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2pdn h ASP 98 Cb 0.44 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2pdn h ASP 98 CO 0.02 0.67 -0.00 0.18 -1.72 0.00 0.00 179.24 178.38 2pdn n LEU 99 N -4.54 0.19 -3.64 1.55 4.77 0.03 -3.85 117.00 111.51 2pdn n LEU 99 Ca 0.06 -0.03 -0.27 0.00 -0.03 0.00 0.00 56.01 55.74 2pdn n LEU 99 Cb 0.07 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.17 2pdn n LEU 99 CO 0.37 0.03 0.13 0.29 -1.33 0.00 0.00 177.39 176.88 2pdn n LYS 100 N -0.89 -6.08 -4.46 3.23 5.02 -0.41 -4.42 118.16 110.15 2pdn n LYS 100 Ca 0.22 0.71 -0.25 0.00 -2.02 0.00 0.00 58.31 56.97 2pdn n LYS 100 Cb 0.15 -5.64 -0.10 0.00 -0.02 0.00 0.00 35.03 29.43 2pdn n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2pdn s LEU 101 N -7.15 2.82 -0.01 -0.35 1.43 -0.54 -5.01 118.68 109.87 2pdn s LEU 101 Ca 0.57 -1.11 0.18 0.00 -1.03 0.00 0.00 54.13 52.74 2pdn s LEU 101 Cb -0.27 -1.14 -0.24 0.00 0.03 0.00 0.00 46.19 44.56 2pdn s LEU 101 CO 0.71 -0.20 0.54 0.47 0.23 0.00 0.00 176.35 178.10 2pdn n ASP 102 N -0.85 0.86 -3.66 2.29 9.92 -1.26 -4.55 116.55 119.31 2pdn n ASP 102 Ca -0.05 -0.39 -0.12 0.00 -0.53 0.00 0.00 54.79 53.70 2pdn n ASP 102 Cb 0.63 1.47 -0.06 0.00 -0.64 0.00 0.00 41.12 42.52 2pdn n ASP 102 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2pdn s TYR 103 N -2.99 -0.25 0.03 1.24 -0.85 -1.26 -4.75 117.35 108.53 2pdn s TYR 103 Ca -0.01 0.14 0.02 0.00 -0.52 0.00 0.00 57.07 56.70 2pdn s TYR 103 Cb 0.12 0.23 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 2pdn s TYR 103 CO 0.73 -0.60 0.05 -0.51 -1.52 0.00 0.00 175.55 173.70 2pdn s LEU 104 N -2.19 3.72 0.22 -3.49 1.43 -0.81 -5.00 118.68 112.56 2pdn s LEU 104 Ca -0.03 0.02 0.09 0.00 -1.03 0.00 0.00 54.13 53.18 2pdn s LEU 104 Cb -0.00 -2.26 0.16 0.00 0.03 0.00 0.00 46.19 44.12 2pdn s LEU 104 CO -0.05 0.23 1.50 0.44 0.23 0.00 0.00 176.35 178.70 2pdn h ASP 105 N 3.85 0.00 -3.37 2.29 3.32 -1.53 -0.26 116.42 120.73 2pdn h ASP 105 Ca -0.48 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.47 2pdn h ASP 105 Cb 1.17 -0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.47 2pdn h ASP 105 CO 0.62 0.75 -0.23 -0.22 -1.72 0.00 0.00 179.24 178.44 2pdn s LEU 106 N -7.30 -0.11 -0.09 1.55 2.96 -1.15 -2.70 118.68 111.85 2pdn s LEU 106 Ca -0.01 0.97 0.01 0.00 -0.22 0.00 0.00 54.13 54.89 2pdn s LEU 106 Cb 0.12 1.53 0.02 0.00 0.50 0.00 0.00 46.19 48.35 2pdn s LEU 106 CO 0.78 -0.19 -0.12 -0.47 -1.32 0.00 0.00 176.35 175.04 2pdn s TYR 107 N 1.14 1.56 -0.02 5.38 5.04 -0.60 -2.09 117.35 127.76 2pdn s TYR 107 Ca -0.07 -0.66 0.03 0.00 -2.44 0.00 0.00 57.07 53.93 2pdn s TYR 107 Cb -0.07 -1.18 -0.03 0.00 0.35 0.00 0.00 41.96 41.03 2pdn s TYR 107 CO -0.10 -0.38 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.12 2pdn s LEU 108 N 0.99 2.99 -0.26 6.97 1.43 0.06 -1.30 118.68 129.56 2pdn s LEU 108 Ca -0.08 -0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 52.57 2pdn s LEU 108 Cb -0.15 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 2pdn s LEU 108 CO -0.00 0.31 1.70 -0.63 0.23 0.00 0.00 176.35 177.95 2pdn s ILE 109 N -0.88 3.59 0.18 -0.59 1.01 -0.54 -0.19 121.20 123.78 2pdn s ILE 109 Ca 0.14 0.64 -0.10 0.00 0.00 0.00 0.00 60.65 61.34 2pdn s ILE 109 Cb -0.11 -3.68 0.08 0.00 0.01 0.00 0.00 42.46 38.76 2pdn s ILE 109 CO 0.04 -0.35 1.67 -0.74 0.00 0.00 0.00 174.94 175.56 2pdn h HIS 110 N 11.61 1.13 -3.79 3.97 2.76 -1.70 -1.31 115.15 127.83 2pdn h HIS 110 Ca -0.34 -0.17 -0.17 0.00 -2.20 0.00 0.00 60.37 57.49 2pdn h HIS 110 Cb 1.16 -0.31 -0.22 0.00 1.55 0.00 0.00 27.41 29.60 2pdn h HIS 110 CO 0.93 0.97 -0.63 -1.58 -1.30 0.00 0.00 177.93 176.31 2pdn s TRP 111 N -5.16 0.15 0.03 5.26 0.52 -1.25 -4.37 118.94 114.12 2pdn s TRP 111 Ca -0.12 -0.31 0.32 0.00 0.02 0.00 0.00 56.10 56.00 2pdn s TRP 111 Cb 0.14 -0.12 1.47 0.00 -1.15 0.00 0.00 33.47 33.81 2pdn s TRP 111 CO 0.84 -0.19 1.95 -1.00 0.02 0.00 0.00 176.95 178.57 2pdn h PRO 112 N 4.76 0.00 -6.13 4.98 0.13 -1.79 -3.44 132.00 130.52 2pdn h PRO 112 Ca -0.30 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.27 2pdn h PRO 112 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2pdn h PRO 112 CO 0.42 0.00 0.30 0.95 -0.23 0.00 0.00 178.00 179.44 2pdn s THR 113 N -3.66 4.92 -0.01 1.56 -4.23 -1.26 -4.72 115.64 108.24 2pdn s THR 113 Ca 0.00 1.73 -0.21 0.00 -1.18 0.00 0.00 61.69 62.03 2pdn s THR 113 Cb 0.09 -4.17 -0.05 0.00 1.34 0.00 0.00 72.50 69.71 2pdn s THR 113 CO 0.42 0.14 0.60 -0.83 -0.54 0.00 0.00 174.62 174.41 2pdn s GLY 114 N 0.99 2.60 0.15 3.99 0.00 -1.26 -4.58 107.32 109.21 2pdn s GLY 114 Ca 0.43 0.03 0.07 0.00 0.00 0.00 0.00 44.72 45.25 2pdn s GLY 114 CO 0.19 0.79 -0.03 -1.36 0.00 0.00 0.00 173.10 172.69 2pdn s PHE 115 N -0.08 2.82 -0.10 1.90 0.08 0.79 -1.37 117.98 122.02 2pdn s PHE 115 Ca 0.31 -0.14 -0.39 0.00 0.12 0.00 0.00 56.93 56.84 2pdn s PHE 115 Cb -0.18 -1.40 -0.16 0.00 -0.57 0.00 0.00 43.02 40.71 2pdn s PHE 115 CO 0.17 0.50 1.52 1.17 -0.10 0.00 0.00 175.22 178.47 2pdn n LYS 116 N 0.13 1.06 -1.96 0.44 4.81 0.38 -4.24 118.16 118.78 2pdn n LYS 116 Ca -0.11 0.39 -0.38 0.00 -0.87 0.00 0.00 58.31 57.34 2pdn n LYS 116 Cb 0.54 -2.04 0.02 0.00 0.02 0.00 0.00 35.03 33.58 2pdn n LYS 116 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2pdn s PRO 117 N 1.92 3.42 0.00 1.64 0.04 -1.26 -4.82 135.00 135.94 2pdn s PRO 117 Ca 0.92 2.08 0.00 0.00 0.04 0.00 0.00 61.00 64.03 2pdn s PRO 117 Cb -1.04 -2.35 0.00 0.00 0.04 0.00 0.00 34.50 31.15 2pdn s PRO 117 CO 0.57 -0.92 0.00 0.41 0.04 0.00 0.00 177.00 177.10 2pdn n GLY 118 N 0.62 0.41 0.22 0.56 0.00 -1.26 -4.98 105.19 100.75 2pdn n GLY 118 Ca 0.09 -1.48 -0.04 0.00 0.00 0.00 0.00 46.02 44.59 2pdn n GLY 118 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pdn h LYS 119 N 0.00 0.40 -6.52 1.61 1.79 -1.98 -3.43 116.57 108.44 2pdn h LYS 119 Ca 0.00 -0.18 -0.53 0.00 -2.18 0.00 0.00 60.65 57.75 2pdn h LYS 119 Cb 0.00 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 30.65 2pdn h LYS 119 CO 0.00 0.72 0.58 -1.21 -1.08 0.00 0.00 179.45 178.46 2pdn s GLU 120 N -4.27 4.43 0.21 3.15 0.41 -1.26 -4.94 118.70 116.42 2pdn s GLU 120 Ca -0.06 1.83 0.08 0.00 -0.41 0.00 0.00 54.97 56.41 2pdn s GLU 120 Cb 0.13 -3.31 0.13 0.00 -1.78 0.00 0.00 34.13 29.30 2pdn s GLU 120 CO 0.79 -0.25 1.48 0.74 -0.49 0.00 0.00 175.26 177.52 2pdn h PHE 121 N 6.55 0.05 -2.73 1.61 0.04 -1.96 -3.35 116.94 117.15 2pdn h PHE 121 Ca -0.42 -0.02 -0.61 0.00 2.80 0.00 0.00 57.97 59.72 2pdn h PHE 121 Cb 1.21 -0.01 -0.40 0.00 2.20 0.00 0.00 35.95 38.95 2pdn h PHE 121 CO 0.66 0.79 -0.74 1.19 -0.60 0.00 0.00 178.31 179.61 2pdn n PHE 122 N -3.65 1.62 -1.97 -0.55 3.72 -1.26 -4.77 117.46 110.60 2pdn n PHE 122 Ca -0.01 -3.91 -0.42 0.00 -0.05 0.00 0.00 57.45 53.06 2pdn n PHE 122 Cb 0.74 -0.29 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 2pdn n PHE 122 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2pdn s PRO 123 N -0.96 4.21 0.27 -1.08 0.04 -1.26 -4.97 135.00 131.25 2pdn s PRO 123 Ca 0.29 2.28 0.10 0.00 0.04 0.00 0.00 61.00 63.71 2pdn s PRO 123 Cb 0.01 -3.57 -0.05 0.00 0.04 0.00 0.00 34.50 30.93 2pdn s PRO 123 CO -0.17 -0.70 -0.07 -0.51 0.04 0.00 0.00 177.00 175.59 2pdn s LEU 124 N 2.53 3.00 0.00 -3.56 2.01 -1.26 -0.47 118.68 120.93 2pdn s LEU 124 Ca 0.72 -0.76 0.00 0.00 0.01 0.00 0.00 54.13 54.10 2pdn s LEU 124 Cb -0.39 -1.52 0.00 0.00 0.01 0.00 0.00 46.19 44.29 2pdn s LEU 124 CO 0.31 0.02 0.00 -0.90 1.01 0.00 0.00 176.35 176.79 2pdn n ASP 125 N -0.78 0.00 0.30 2.29 5.68 -0.57 -4.83 116.55 118.65 2pdn n ASP 125 Ca -0.06 -0.92 0.18 0.00 -0.50 0.00 0.00 54.79 53.49 2pdn n ASP 125 Cb 0.59 0.00 0.95 0.00 -1.14 0.00 0.00 41.12 41.52 2pdn n ASP 125 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2pdn h GLU 126 N 0.00 0.00 0.00 0.11 3.07 -2.01 -2.83 114.58 112.92 2pdn h GLU 126 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2pdn h GLU 126 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2pdn h GLU 126 CO 0.00 0.03 -0.67 1.03 -1.40 0.00 0.00 179.01 178.00 2pdn h SER 127 N 0.00 0.00 0.00 1.42 0.87 -2.04 -3.48 113.55 110.32 2pdn h SER 127 Ca -0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2pdn h SER 127 Cb 0.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2pdn h SER 127 CO 0.00 0.05 0.00 0.61 -0.53 0.00 0.00 176.83 176.97 2pdn n GLY 128 N 1.25 0.74 3.81 5.77 0.00 -1.07 -5.07 105.19 110.63 2pdn n GLY 128 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 2pdn n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pdn s ASN 129 N -2.53 7.06 0.24 1.61 0.01 -1.26 -4.79 114.94 115.27 2pdn s ASN 129 Ca 0.00 1.35 -0.30 0.00 -0.71 0.00 0.00 52.86 53.20 2pdn s ASN 129 Cb 0.00 -2.39 -0.09 0.00 0.41 0.00 0.00 41.25 39.18 2pdn s ASN 129 CO 0.00 0.12 1.17 0.54 -1.51 0.00 0.00 177.10 177.42 2pdn s VAL 130 N -1.37 3.46 -0.42 1.60 0.11 -0.65 -1.51 120.40 121.62 2pdn s VAL 130 Ca 0.38 1.34 -0.27 0.00 -2.93 0.00 0.00 61.98 60.49 2pdn s VAL 130 Cb -0.18 -3.85 0.02 0.00 -1.53 0.00 0.00 36.38 30.84 2pdn s VAL 130 CO 0.21 0.27 1.03 -0.69 -3.33 0.00 0.00 175.10 172.58 2pdn s VAL 131 N -0.59 4.41 0.89 2.04 1.01 0.38 -4.90 120.40 123.64 2pdn s VAL 131 Ca 0.49 1.21 -0.12 0.00 0.00 0.00 0.00 61.98 63.56 2pdn s VAL 131 Cb -0.33 -4.47 0.12 0.00 0.00 0.00 0.00 36.38 31.71 2pdn s VAL 131 CO 0.40 -0.76 1.10 -2.16 0.00 0.00 0.00 175.10 173.68 2pdn s PRO 132 N 3.92 1.35 0.22 2.72 0.04 -1.26 -0.47 135.00 141.52 2pdn s PRO 132 Ca 0.43 0.66 0.08 0.00 0.04 0.00 0.00 61.00 62.21 2pdn s PRO 132 Cb -0.10 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 2pdn s PRO 132 CO 0.24 -2.14 0.00 -1.54 0.04 0.00 0.00 177.00 173.61 2pdn s SER 133 N -3.63 4.68 -1.29 6.66 1.04 -0.47 -3.33 113.70 117.36 2pdn s SER 133 Ca 0.63 -0.51 -0.08 0.00 0.48 0.00 0.00 55.95 56.46 2pdn s SER 133 Cb -0.17 -0.94 0.16 0.00 0.10 0.00 0.00 66.02 65.17 2pdn s SER 133 CO 0.56 0.04 2.00 -0.67 0.98 0.00 0.00 173.24 176.15 2pdn n ASP 134 N -0.54 5.90 -4.44 7.02 2.03 -1.26 -4.79 116.55 120.47 2pdn n ASP 134 Ca -0.08 -3.13 -0.23 0.00 0.52 0.00 0.00 54.79 51.87 2pdn n ASP 134 Cb 0.57 -1.44 -0.10 0.00 -0.72 0.00 0.00 41.12 39.43 2pdn n ASP 134 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2pdn s THR 135 N -0.11 2.30 0.21 5.18 -4.23 -1.26 -5.06 115.64 112.67 2pdn s THR 135 Ca 0.43 -2.36 0.05 0.00 -1.18 0.00 0.00 61.69 58.63 2pdn s THR 135 Cb 0.12 -2.24 -0.05 0.00 1.34 0.00 0.00 72.50 71.67 2pdn s THR 135 CO -0.02 -0.45 -0.07 0.54 -0.54 0.00 0.00 174.62 174.08 2pdn s ASN 136 N -3.46 2.12 0.24 3.99 4.22 -1.26 -4.78 114.94 116.00 2pdn s ASN 136 Ca 0.28 -1.11 -0.07 0.00 -2.14 0.00 0.00 52.86 49.83 2pdn s ASN 136 Cb -0.04 -0.05 0.25 0.00 1.28 0.00 0.00 41.25 42.69 2pdn s ASN 136 CO 0.13 -0.36 1.91 0.40 -2.04 0.00 0.00 177.10 177.15 2pdn h ILE 137 N 2.56 1.23 -0.30 0.54 2.04 -1.99 -2.05 117.51 119.54 2pdn h ILE 137 Ca -0.38 -0.44 -0.18 0.00 1.00 0.00 0.00 64.86 64.86 2pdn h ILE 137 Cb 1.21 -0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2pdn h ILE 137 CO 0.64 0.23 -0.52 -0.07 0.00 0.00 0.00 178.15 178.43 2pdn h LEU 138 N 1.28 0.96 -0.36 1.44 3.38 -1.96 -0.25 115.31 119.80 2pdn h LEU 138 Ca 0.36 -0.50 -0.14 0.00 0.09 0.00 0.00 57.88 57.69 2pdn h LEU 138 Cb -0.12 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.35 2pdn h LEU 138 CO -0.09 1.30 -0.30 0.44 0.09 0.00 0.00 178.44 179.88 2pdn h ASP 139 N 0.67 0.89 -0.84 -0.43 3.32 -1.95 -1.18 116.42 116.90 2pdn h ASP 139 Ca 0.02 -0.45 0.00 0.00 0.02 0.00 0.00 57.03 56.62 2pdn h ASP 139 Cb 1.13 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.38 2pdn h ASP 139 CO 0.12 1.16 0.53 0.74 -1.72 0.00 0.00 179.24 180.06 2pdn h THR 140 N 0.64 1.23 -0.50 0.35 2.02 -1.25 -1.60 112.91 113.80 2pdn h THR 140 Ca 0.06 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 2pdn h THR 140 Cb 0.88 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2pdn h THR 140 CO 0.08 0.23 0.25 -0.25 0.37 0.00 0.00 175.52 176.20 2pdn h TRP 141 N 1.15 0.71 -0.94 3.16 2.91 -0.57 -1.31 115.95 121.06 2pdn h TRP 141 Ca 0.31 -0.03 0.14 0.00 1.13 0.00 0.00 58.89 60.44 2pdn h TRP 141 Cb -0.08 -0.22 -0.08 0.00 -0.51 0.00 0.00 29.16 28.27 2pdn h TRP 141 CO -0.01 0.55 0.60 0.00 -1.03 0.00 0.00 178.44 178.56 2pdn h ALA 142 N 1.09 1.72 -0.22 2.65 0.00 -0.85 0.15 119.26 123.81 2pdn h ALA 142 Ca 0.17 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 2pdn h ALA 142 Cb 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2pdn h ALA 142 CO -0.02 0.02 -0.34 0.00 0.00 0.00 0.00 179.25 178.90 2pdn h ALA 143 N 1.58 1.01 -0.57 0.00 0.00 -0.35 -2.48 119.26 118.45 2pdn h ALA 143 Ca 0.48 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2pdn h ALA 143 Cb 0.67 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2pdn h ALA 143 CO -0.24 0.60 -0.05 0.52 0.00 0.00 0.00 179.25 180.08 2pdn h MET 144 N 0.39 1.04 -0.91 0.00 2.86 0.11 -2.90 114.93 115.53 2pdn h MET 144 Ca 0.04 -0.36 0.08 0.00 -2.06 0.00 0.00 59.70 57.41 2pdn h MET 144 Cb 0.79 -0.08 -0.07 0.00 0.06 0.00 0.00 31.60 32.30 2pdn h MET 144 CO 0.06 1.05 0.56 0.93 1.06 0.00 0.00 176.91 180.58 2pdn h GLU 145 N 0.93 0.95 -0.53 1.72 5.08 -0.39 -1.65 114.58 120.69 2pdn h GLU 145 Ca 0.16 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 2pdn h GLU 145 Cb 0.61 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 2pdn h GLU 145 CO 0.04 0.63 0.35 0.93 -1.00 0.00 0.00 179.01 179.96 2pdn h GLU 146 N 0.97 0.54 -0.38 2.33 4.39 -1.25 -1.60 114.58 119.58 2pdn h GLU 146 Ca 0.42 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.05 2pdn h GLU 146 Cb 0.28 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 2pdn h GLU 146 CO -0.21 0.35 0.07 -0.07 -1.16 0.00 0.00 179.01 177.99 2pdn h LEU 147 N 0.55 0.53 -0.18 1.33 3.38 -1.29 0.51 115.31 120.15 2pdn h LEU 147 Ca 0.22 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2pdn h LEU 147 Cb 0.18 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2pdn h LEU 147 CO -0.06 0.55 -0.06 0.58 0.09 0.00 0.00 178.44 179.54 2pdn h VAL 148 N 0.56 1.30 0.00 1.22 2.07 -1.26 -1.78 116.25 118.35 2pdn h VAL 148 Ca 0.13 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.59 2pdn h VAL 148 Cb 0.25 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2pdn h VAL 148 CO 0.00 0.32 0.00 0.47 0.02 0.00 0.00 177.57 178.38 2pdn n ASP 149 N -4.64 0.68 -0.54 0.57 8.00 -0.74 -1.61 116.55 118.27 2pdn n ASP 149 Ca -0.05 0.70 0.10 0.00 0.71 0.00 0.00 54.79 56.25 2pdn n ASP 149 Cb 0.28 -0.83 0.01 0.00 -0.02 0.00 0.00 41.12 40.56 2pdn n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2pdn n GLU 150 N -2.28 1.46 -0.61 -1.24 1.02 0.09 -4.99 120.64 114.09 2pdn n GLU 150 Ca 0.01 -1.10 0.00 0.00 -0.02 0.00 0.00 57.16 56.05 2pdn n GLU 150 Cb 0.18 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2pdn n GLU 150 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pdn n GLY 151 N 1.34 0.76 0.11 0.62 0.00 -0.63 -4.96 105.19 102.43 2pdn n GLY 151 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 2pdn n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2pdn h LEU 152 N 0.00 0.00 -8.00 0.99 3.38 -1.56 -3.45 115.31 106.67 2pdn h LEU 152 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 2pdn h LEU 152 Cb 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 40.52 2pdn h LEU 152 CO 0.00 0.75 -0.72 0.68 0.09 0.00 0.00 178.44 179.25 2pdn s VAL 153 N -3.13 0.25 -0.26 1.22 -7.23 -1.18 -1.92 120.40 108.16 2pdn s VAL 153 Ca 0.00 -0.79 0.20 0.00 -1.81 0.00 0.00 61.98 59.59 2pdn s VAL 153 Cb 0.11 -0.34 0.09 0.00 0.56 0.00 0.00 36.38 36.79 2pdn s VAL 153 CO 0.78 -0.35 1.25 0.11 -0.31 0.00 0.00 175.10 176.58 2pdn h LYS 154 N 4.91 0.00 -2.64 4.82 1.57 -1.15 -3.39 116.57 120.70 2pdn h LYS 154 Ca -0.32 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.37 2pdn h LYS 154 Cb 1.21 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.32 2pdn h LYS 154 CO 0.43 0.15 -0.07 0.00 -0.57 0.00 0.00 179.45 179.39 2pdn s ALA 155 N -3.16 -1.19 0.10 3.86 0.00 -1.10 -4.97 121.76 115.31 2pdn s ALA 155 Ca 0.02 0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.74 2pdn s ALA 155 Cb 0.08 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 2pdn s ALA 155 CO 0.75 -0.33 -0.13 0.96 0.00 0.00 0.00 175.76 177.01 2pdn s ILE 156 N -1.44 1.20 0.00 0.00 -4.36 -1.26 -1.56 121.20 113.78 2pdn s ILE 156 Ca -0.11 -1.60 0.00 0.00 -0.26 0.00 0.00 60.65 58.68 2pdn s ILE 156 Cb -0.03 -1.38 0.00 0.00 1.25 0.00 0.00 42.46 42.30 2pdn s ILE 156 CO 0.05 -0.39 0.00 0.61 0.24 0.00 0.00 174.94 175.45 2pdn n GLY 157 N 0.73 2.49 3.37 6.27 0.00 -0.42 -1.80 105.19 115.83 2pdn n GLY 157 Ca -0.17 -1.02 -0.18 0.00 0.00 0.00 0.00 46.02 44.65 2pdn n GLY 157 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2pdn s ILE 158 N -2.86 1.01 -0.08 -0.61 -4.36 -0.31 -1.47 121.20 112.51 2pdn s ILE 158 Ca 0.00 -2.02 -0.05 0.00 -0.26 0.00 0.00 60.65 58.32 2pdn s ILE 158 Cb 0.00 -2.55 0.03 0.00 1.25 0.00 0.00 42.46 41.19 2pdn s ILE 158 CO 0.00 -0.16 0.20 -0.55 0.24 0.00 0.00 174.94 174.67 2pdn s SER 159 N -3.37 -0.19 -1.35 4.36 0.15 -0.49 -1.41 113.70 111.39 2pdn s SER 159 Ca 0.33 0.40 -0.00 0.00 0.70 0.00 0.00 55.95 57.38 2pdn s SER 159 Cb 0.07 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.72 2pdn s SER 159 CO 0.12 -0.12 0.03 0.59 1.20 0.00 0.00 173.24 175.06 2pdn n ASN 160 N 3.67 -4.78 -4.77 5.45 3.02 -0.34 -3.82 115.26 113.69 2pdn n ASN 160 Ca -0.20 -0.03 -0.38 0.00 -0.03 0.00 0.00 54.58 53.94 2pdn n ASN 160 Cb 0.55 -3.89 -0.06 0.00 -0.61 0.00 0.00 39.78 35.78 2pdn n ASN 160 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2pdn s PHE 161 N -2.81 3.62 0.81 3.10 0.40 -1.26 -4.49 117.98 117.34 2pdn s PHE 161 Ca 0.01 0.94 -0.12 0.00 -0.60 0.00 0.00 56.93 57.17 2pdn s PHE 161 Cb -0.01 -2.43 0.08 0.00 0.51 0.00 0.00 43.02 41.18 2pdn s PHE 161 CO 0.02 0.40 1.17 0.54 0.70 0.00 0.00 175.22 178.05 2pdn s ASN 162 N -0.20 4.48 0.42 1.36 2.20 -1.26 -4.83 114.94 117.10 2pdn s ASN 162 Ca 0.25 0.75 0.11 0.00 -0.94 0.00 0.00 52.86 53.03 2pdn s ASN 162 Cb -0.16 -1.23 0.89 0.00 -2.00 0.00 0.00 41.25 38.75 2pdn s ASN 162 CO 0.12 -1.91 1.97 1.12 -2.94 0.00 0.00 177.10 175.45 2pdn h HIS 163 N -1.05 0.16 -0.21 1.54 2.07 -1.93 -1.16 115.15 114.58 2pdn h HIS 163 Ca -0.46 -0.01 -0.13 0.00 -2.85 0.00 0.00 60.37 56.91 2pdn h HIS 163 Cb 1.33 -0.05 -0.01 0.00 2.57 0.00 0.00 27.41 31.25 2pdn h HIS 163 CO 0.27 0.28 -0.43 -0.07 -3.07 0.00 0.00 177.93 174.91 2pdn h LEU 164 N 0.16 0.53 -0.54 6.12 3.38 -1.93 -1.13 115.31 121.89 2pdn h LEU 164 Ca 0.03 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.61 2pdn h LEU 164 Cb 0.30 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2pdn h LEU 164 CO 0.02 0.90 -0.38 1.56 0.09 0.00 0.00 178.44 180.63 2pdn h GLN 165 N 0.41 0.75 -0.71 1.13 4.20 -1.65 -2.21 115.11 117.02 2pdn h GLN 165 Ca 0.03 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.31 2pdn h GLN 165 Cb 0.92 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.68 2pdn h GLN 165 CO 0.08 1.01 0.25 0.28 -0.67 0.00 0.00 178.83 179.78 2pdn h VAL 166 N 0.62 1.25 -0.54 -0.54 2.07 -1.19 -3.02 116.25 114.91 2pdn h VAL 166 Ca 0.05 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.74 2pdn h VAL 166 Cb 0.93 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 2pdn h VAL 166 CO 0.08 0.33 0.35 -0.08 0.02 0.00 0.00 177.57 178.28 2pdn h GLU 167 N 1.03 0.70 -0.43 1.57 4.81 -0.94 -1.42 114.58 119.90 2pdn h GLU 167 Ca 0.23 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.51 2pdn h GLU 167 Cb 0.26 -0.16 -0.08 0.00 0.63 0.00 0.00 28.75 29.40 2pdn h GLU 167 CO -0.01 0.46 -0.08 0.52 -0.73 0.00 0.00 179.01 179.17 2pdn h MET 168 N 0.72 0.02 -0.16 1.92 2.86 -1.28 0.50 114.93 119.52 2pdn h MET 168 Ca 0.20 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 2pdn h MET 168 Cb -0.08 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2pdn h MET 168 CO -0.05 0.01 0.08 0.82 1.06 0.00 0.00 176.91 178.83 2pdn h ILE 169 N 0.02 1.13 -1.01 -1.22 2.04 -1.38 -1.39 117.51 115.71 2pdn h ILE 169 Ca 0.21 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.76 2pdn h ILE 169 Cb 0.32 1.09 -0.07 0.00 -0.74 0.00 0.00 36.82 37.42 2pdn h ILE 169 CO -0.43 0.12 0.65 -0.07 0.00 0.00 0.00 178.15 178.42 2pdn h LEU 170 N 0.13 1.04 -0.81 1.44 3.38 -0.37 -1.35 115.31 118.77 2pdn h LEU 170 Ca 0.05 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2pdn h LEU 170 Cb 0.13 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2pdn h LEU 170 CO -0.01 0.66 0.00 0.59 0.09 0.00 0.00 178.44 179.77 2pdn n ASN 171 N -4.50 1.23 -4.70 -0.43 3.02 0.08 -4.90 115.26 105.06 2pdn n ASN 171 Ca 0.16 -1.53 -0.56 0.00 -0.03 0.00 0.00 54.58 52.62 2pdn n ASN 171 Cb 0.19 -0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.25 2pdn n ASN 171 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2pdn n LYS 172 N -0.00 1.30 -1.96 3.52 4.81 -0.51 -4.89 118.16 120.43 2pdn n LYS 172 Ca 0.18 0.48 -0.42 0.00 -0.87 0.00 0.00 58.31 57.68 2pdn n LYS 172 Cb 0.28 -2.19 -0.02 0.00 0.02 0.00 0.00 35.03 33.12 2pdn n LYS 172 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2pdn s PRO 173 N 3.72 4.23 -0.40 1.64 0.04 -1.26 -1.87 135.00 141.11 2pdn s PRO 173 Ca 0.98 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.37 2pdn s PRO 173 Cb -1.01 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2pdn s PRO 173 CO 0.64 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 177.58 2pdn n GLY 174 N 2.77 0.66 3.58 0.56 0.00 -1.26 -4.99 105.19 106.51 2pdn n GLY 174 Ca 0.09 -0.53 -0.50 0.00 0.00 0.00 0.00 46.02 45.08 2pdn n GLY 174 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2pdn n LEU 175 N -0.43 1.45 -0.09 0.99 7.94 -0.78 -4.91 117.00 121.18 2pdn n LEU 175 Ca -0.04 1.14 -0.11 0.00 -1.11 0.00 0.00 56.01 55.89 2pdn n LEU 175 Cb 0.17 -1.19 -0.09 0.00 0.53 0.00 0.00 43.42 42.84 2pdn n LEU 175 CO 0.06 -1.29 -1.06 0.29 -1.11 0.00 0.00 177.39 174.28 2pdn n LYS 176 N 1.93 0.70 -4.15 1.96 5.02 -1.26 -4.97 118.16 117.38 2pdn n LYS 176 Ca 0.16 0.08 -0.19 0.00 -2.02 0.00 0.00 58.31 56.34 2pdn n LYS 176 Cb 0.23 -1.36 -0.16 0.00 -0.02 0.00 0.00 35.03 33.72 2pdn n LYS 176 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2pdn s TYR 177 N -2.35 0.69 0.52 2.13 2.02 -1.26 -5.14 117.35 113.95 2pdn s TYR 177 Ca -0.21 -0.18 -0.18 0.00 -0.37 0.00 0.00 57.07 56.13 2pdn s TYR 177 Cb 0.06 -0.62 -0.07 0.00 -0.40 0.00 0.00 41.96 40.92 2pdn s TYR 177 CO 0.44 -0.18 1.03 0.15 -1.57 0.00 0.00 175.55 175.43 2pdn s LYS 178 N 0.89 3.72 0.37 -0.62 1.02 -1.26 -4.99 119.74 118.87 2pdn s LYS 178 Ca -0.12 1.23 -0.28 0.00 0.02 0.00 0.00 55.97 56.83 2pdn s LYS 178 Cb -0.14 -2.09 -0.11 0.00 -0.52 0.00 0.00 37.83 34.97 2pdn s LYS 178 CO 0.00 -0.48 1.49 -2.14 -0.92 0.00 0.00 175.35 173.31 2pdn s PRO 179 N -3.59 4.10 -0.04 -1.68 0.02 -1.26 -4.85 135.00 127.69 2pdn s PRO 179 Ca 0.64 2.58 0.02 0.00 0.02 0.00 0.00 61.00 64.27 2pdn s PRO 179 Cb -0.15 -2.97 -0.25 0.00 0.02 0.00 0.00 34.50 31.15 2pdn s PRO 179 CO 0.26 -0.54 0.68 0.00 -0.33 0.00 0.00 177.00 177.06 2pdn h ALA 180 N 3.07 0.51 -3.23 -1.55 0.00 -1.71 -3.44 119.26 112.91 2pdn h ALA 180 Ca -0.51 -1.31 -0.18 0.00 0.00 0.00 0.00 54.91 52.91 2pdn h ALA 180 Cb 1.24 0.45 -0.24 0.00 0.00 0.00 0.00 17.79 19.24 2pdn h ALA 180 CO 0.65 1.36 -0.61 0.08 0.00 0.00 0.00 179.25 180.73 2pdn s VAL 181 N -2.60 0.04 -0.20 0.00 1.01 -1.26 -1.52 120.40 115.88 2pdn s VAL 181 Ca -0.10 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2pdn s VAL 181 Cb 0.07 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.27 2pdn s VAL 181 CO 0.82 -0.20 -0.12 0.21 0.00 0.00 0.00 175.10 175.81 2pdn s ASN 182 N -0.61 3.48 -0.25 3.32 3.04 -0.62 -1.17 114.94 122.13 2pdn s ASN 182 Ca -0.07 -0.91 -0.17 0.00 0.04 0.00 0.00 52.86 51.75 2pdn s ASN 182 Cb -0.04 -1.31 -0.03 0.00 -1.54 0.00 0.00 41.25 38.33 2pdn s ASN 182 CO 0.00 -0.13 0.48 -1.58 -3.04 0.00 0.00 177.10 172.83 2pdn s GLN 183 N 1.34 4.08 0.10 0.43 0.74 -0.50 -1.85 119.66 123.99 2pdn s GLN 183 Ca -0.01 0.26 0.02 0.00 0.05 0.00 0.00 55.36 55.68 2pdn s GLN 183 Cb -0.16 -3.64 -0.04 0.00 1.10 0.00 0.00 33.01 30.27 2pdn s GLN 183 CO -0.08 -0.30 -0.07 0.96 -0.55 0.00 0.00 175.29 175.24 2pdn s ILE 184 N 2.13 0.76 0.18 -2.34 -4.36 0.06 -1.19 121.20 116.44 2pdn s ILE 184 Ca 0.20 -1.83 -0.31 0.00 -0.26 0.00 0.00 60.65 58.45 2pdn s ILE 184 Cb -0.16 -1.56 -0.10 0.00 1.25 0.00 0.00 42.46 41.90 2pdn s ILE 184 CO 0.09 -0.78 1.51 -0.70 0.24 0.00 0.00 174.94 175.31 2pdn s GLU 185 N -3.48 4.24 -0.25 0.37 2.12 -1.26 -0.30 118.70 120.14 2pdn s GLU 185 Ca 0.09 2.31 -0.13 0.00 0.36 0.00 0.00 54.97 57.61 2pdn s GLU 185 Cb 0.03 -3.15 0.08 0.00 0.26 0.00 0.00 34.13 31.34 2pdn s GLU 185 CO -0.03 -0.54 0.59 0.00 -0.54 0.00 0.00 175.26 174.75 2pdn s HIS 187 N 1.71 -0.02 0.60 0.00 -3.43 -0.88 -4.22 115.29 109.05 2pdn s HIS 187 Ca -0.09 -0.24 0.34 0.00 -0.80 0.00 0.00 55.06 54.26 2pdn s HIS 187 Cb -0.07 0.63 1.97 0.00 -1.43 0.00 0.00 32.58 33.68 2pdn s HIS 187 CO -0.18 -0.64 2.28 -1.35 -2.00 0.00 0.00 174.74 172.86 2pdn h PRO 188 N 2.00 0.00 -0.00 -0.38 0.11 -1.88 -0.07 132.00 131.78 2pdn h PRO 188 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2pdn h PRO 188 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2pdn h PRO 188 CO 0.30 0.00 -0.13 0.66 -0.21 0.00 0.00 178.00 178.63 2pdn n TYR 189 N -3.64 0.00 -3.27 0.65 4.01 -1.26 -1.27 117.16 112.38 2pdn n TYR 189 Ca -0.03 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.52 2pdn n TYR 189 Cb 0.09 -0.24 -0.07 0.00 -0.31 0.00 0.00 39.34 38.80 2pdn n TYR 189 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2pdn s LEU 190 N -2.61 0.29 0.20 7.72 2.96 -0.05 -1.02 118.68 126.18 2pdn s LEU 190 Ca 0.25 -2.19 0.25 0.00 -0.22 0.00 0.00 54.13 52.21 2pdn s LEU 190 Cb 0.20 0.37 0.49 0.00 0.50 0.00 0.00 46.19 47.75 2pdn s LEU 190 CO 0.51 -0.19 1.51 0.71 -1.32 0.00 0.00 176.35 177.56 2pdn h THR 191 N 4.88 0.00 -3.88 3.68 1.35 -1.77 -2.35 112.91 114.82 2pdn h THR 191 Ca 0.13 -0.59 -0.39 0.00 -0.55 0.00 0.00 66.41 65.01 2pdn h THR 191 Cb 1.01 1.38 0.01 0.00 -1.73 0.00 0.00 68.15 68.82 2pdn h THR 191 CO 0.23 0.00 -0.55 0.00 -0.25 0.00 0.00 175.52 174.95 2pdn n GLN 192 N -2.35 -3.21 -0.25 4.72 1.13 -1.26 -4.84 117.38 111.32 2pdn n GLN 192 Ca 0.04 0.89 0.03 0.00 -1.94 0.00 0.00 57.00 56.02 2pdn n GLN 192 Cb 0.46 -5.64 0.16 0.00 0.11 0.00 0.00 30.24 25.33 2pdn n GLN 192 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2pdn h GLU 193 N -0.65 0.53 -0.09 -1.09 5.08 -1.99 -1.03 114.58 115.33 2pdn h GLU 193 Ca -0.49 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 57.79 2pdn h GLU 193 Cb 1.35 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2pdn h GLU 193 CO 0.55 0.35 -0.13 0.87 -1.00 0.00 0.00 179.01 179.65 2pdn h LYS 194 N 0.54 0.26 -0.49 2.33 1.57 -1.98 -0.79 116.57 118.00 2pdn h LYS 194 Ca 0.38 -0.15 -0.09 0.00 -1.87 0.00 0.00 60.65 58.92 2pdn h LYS 194 Cb 0.48 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 2pdn h LYS 194 CO -0.32 0.71 -0.07 1.25 -0.57 0.00 0.00 179.45 180.44 2pdn h LEU 195 N -0.18 0.86 -0.59 2.94 5.85 -1.92 0.13 115.31 122.40 2pdn h LEU 195 Ca 0.01 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 2pdn h LEU 195 Cb 0.68 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2pdn h LEU 195 CO 0.03 0.96 0.33 0.40 -0.34 0.00 0.00 178.44 179.82 2pdn h ILE 196 N 0.80 1.19 -0.31 4.05 2.04 -1.16 -0.39 117.51 123.73 2pdn h ILE 196 Ca 0.14 -0.48 0.02 0.00 1.00 0.00 0.00 64.86 65.54 2pdn h ILE 196 Cb 0.58 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2pdn h ILE 196 CO 0.04 0.21 0.15 -0.61 0.00 0.00 0.00 178.15 177.93 2pdn h GLN 197 N 0.80 0.30 0.39 2.37 -0.00 -0.70 -0.71 115.11 117.57 2pdn h GLN 197 Ca 0.21 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.82 2pdn h GLN 197 Cb 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 27.46 2pdn h GLN 197 CO -0.03 0.20 -0.19 -0.92 0.00 0.00 0.00 178.83 177.89 2pdn h TYR 198 N 0.31 -0.49 -0.44 3.99 3.20 -0.65 -2.35 116.97 120.54 2pdn h TYR 198 Ca 0.13 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 2pdn h TYR 198 Cb 0.05 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 2pdn h TYR 198 CO -0.10 -0.28 0.26 0.00 -1.64 0.00 0.00 178.16 176.40 2pdn h GLN 200 N 0.51 0.00 0.00 0.00 4.20 -1.12 -0.77 115.11 117.94 2pdn h GLN 200 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2pdn h GLN 200 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2pdn h GLN 200 CO -0.09 0.31 0.00 0.66 -0.67 0.00 0.00 178.83 179.04 2pdn h SER 201 N 0.00 0.00 -0.60 1.46 4.64 -0.85 -2.55 113.55 115.65 2pdn h SER 201 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2pdn h SER 201 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2pdn h SER 201 CO 0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 2pdn n LYS 202 N -2.96 2.67 -3.18 4.77 4.76 -0.61 -4.96 118.16 118.65 2pdn n LYS 202 Ca 0.02 -2.48 -0.17 0.00 -2.87 0.00 0.00 58.31 52.81 2pdn n LYS 202 Cb 0.34 -1.51 0.05 0.00 -1.84 0.00 0.00 35.03 32.07 2pdn n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pdn n GLY 203 N 1.45 -0.12 3.18 0.72 0.00 -0.94 -5.00 105.19 104.48 2pdn n GLY 203 Ca 0.21 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2pdn n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pdn s ILE 204 N -3.18 2.39 0.22 -0.61 1.01 -0.39 -4.71 121.20 115.92 2pdn s ILE 204 Ca 0.38 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 2pdn s ILE 204 Cb -0.17 -2.02 -0.08 0.00 0.01 0.00 0.00 42.46 40.20 2pdn s ILE 204 CO 0.47 0.52 1.15 -0.69 0.00 0.00 0.00 174.94 176.38 2pdn s VAL 205 N 1.20 3.57 -0.15 2.92 1.01 -0.57 -3.66 120.40 124.71 2pdn s VAL 205 Ca 0.02 1.41 -0.07 0.00 0.00 0.00 0.00 61.98 63.35 2pdn s VAL 205 Cb -0.14 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 2pdn s VAL 205 CO -0.08 0.27 0.09 -0.69 0.00 0.00 0.00 175.10 174.68 2pdn s VAL 206 N -0.48 5.02 -0.19 2.92 1.01 -1.26 -1.58 120.40 125.84 2pdn s VAL 206 Ca 0.49 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 2pdn s VAL 206 Cb -0.32 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2pdn s VAL 206 CO 0.38 0.52 0.02 -0.89 0.00 0.00 0.00 175.10 175.13 2pdn s THR 207 N -0.20 4.25 -0.24 3.92 2.01 -0.77 -0.89 115.64 123.72 2pdn s THR 207 Ca 0.09 -0.22 -0.19 0.00 0.31 0.00 0.00 61.69 61.68 2pdn s THR 207 Cb -0.12 -2.91 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 2pdn s THR 207 CO 0.01 0.44 0.54 0.00 -0.69 0.00 0.00 174.62 174.93 2pdn s ALA 208 N 0.69 3.58 0.45 7.40 0.00 0.13 -0.76 121.76 133.26 2pdn s ALA 208 Ca 0.01 -0.50 0.08 0.00 0.00 0.00 0.00 51.96 51.55 2pdn s ALA 208 Cb -0.14 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.10 2pdn s ALA 208 CO 0.02 -0.66 0.52 1.52 0.00 0.00 0.00 175.76 177.17 2pdn s TYR 209 N 2.13 2.48 -1.49 0.00 -0.85 0.59 -2.98 117.35 117.23 2pdn s TYR 209 Ca 0.23 -0.51 -0.02 0.00 -0.52 0.00 0.00 57.07 56.25 2pdn s TYR 209 Cb -0.16 -2.25 0.00 0.00 0.38 0.00 0.00 41.96 39.94 2pdn s TYR 209 CO 0.09 -0.43 0.17 0.43 -1.52 0.00 0.00 175.55 174.29 2pdn n SER 210 N -1.79 0.29 0.19 -0.18 7.64 -1.26 -2.13 113.62 116.38 2pdn n SER 210 Ca 0.07 -1.19 0.14 0.00 1.01 0.00 0.00 58.87 58.90 2pdn n SER 210 Cb 0.61 -2.08 0.60 0.00 -1.01 0.00 0.00 64.21 62.33 2pdn n SER 210 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2pdn h PRO 211 N -1.84 0.00 -0.36 1.43 0.13 -1.81 -1.57 132.00 127.98 2pdn h PRO 211 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2pdn h PRO 211 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2pdn h PRO 211 CO 0.67 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.72 2pdn n LEU 212 N -2.55 3.27 -0.18 1.56 4.77 -1.26 -4.78 117.00 117.82 2pdn n LEU 212 Ca 0.01 -1.54 -0.02 0.00 -0.03 0.00 0.00 56.01 54.43 2pdn n LEU 212 Cb 0.23 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 2pdn n LEU 212 CO 0.21 0.72 -0.02 0.61 -1.33 0.00 0.00 177.39 177.58 2pdn n GLY 213 N 1.29 0.49 3.93 -0.72 0.00 -0.59 -4.22 105.19 105.37 2pdn n GLY 213 Ca 0.17 -0.95 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 2pdn n GLY 213 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2pdn n SER 214 N 1.64 -3.91 0.19 1.61 2.88 -1.26 -4.82 113.62 109.94 2pdn n SER 214 Ca -0.02 -1.17 0.13 0.00 -1.33 0.00 0.00 58.87 56.48 2pdn n SER 214 Cb 0.16 -2.45 0.67 0.00 -0.75 0.00 0.00 64.21 61.84 2pdn n SER 214 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2pdn h PRO 215 N -2.23 0.00 -0.30 -1.46 0.13 -1.98 -1.02 132.00 125.13 2pdn h PRO 215 Ca -0.69 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 2pdn h PRO 215 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2pdn h PRO 215 CO 0.53 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.90 2pdn n ASP 216 N -2.38 2.68 -4.73 1.44 5.75 -1.26 -4.94 116.55 113.10 2pdn n ASP 216 Ca -0.01 -1.88 -0.42 0.00 -0.01 0.00 0.00 54.79 52.46 2pdn n ASP 216 Cb 0.06 -0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 39.94 2pdn n ASP 216 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2pdn n ARG 217 N 0.98 2.67 0.13 0.11 1.85 -0.39 -4.85 116.66 117.16 2pdn n ARG 217 Ca 0.18 0.95 0.12 0.00 -1.00 0.00 0.00 57.85 58.10 2pdn n ARG 217 Cb 0.48 -2.74 0.49 0.00 -1.05 0.00 0.00 32.46 29.64 2pdn n ARG 217 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2pdn n PRO 218 N 2.56 0.19 -0.59 2.89 -0.04 -1.26 -2.07 135.00 136.68 2pdn n PRO 218 Ca 0.10 0.42 0.09 0.00 -0.04 0.00 0.00 63.50 64.07 2pdn n PRO 218 Cb 0.36 -1.87 0.33 0.00 -0.04 0.00 0.00 33.50 32.28 2pdn n PRO 218 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2pdn n TRP 219 N -2.23 1.39 -1.73 0.54 2.14 -1.26 -5.00 117.44 111.28 2pdn n TRP 219 Ca 0.02 -0.65 -0.41 0.00 2.07 0.00 0.00 57.50 58.53 2pdn n TRP 219 Cb 0.23 -0.27 0.01 0.00 -0.81 0.00 0.00 31.31 30.47 2pdn n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2pdn n ALA 220 N 0.78 1.70 -2.42 -1.67 0.00 -0.88 -5.01 120.51 113.01 2pdn n ALA 220 Ca 0.24 0.27 -0.32 0.00 0.00 0.00 0.00 53.44 53.64 2pdn n ALA 220 Cb 0.89 -2.33 -0.14 0.00 0.00 0.00 0.00 19.45 17.87 2pdn n ALA 220 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2pdn s LYS 221 N -2.28 2.23 0.57 0.00 1.02 -1.26 -5.04 119.74 114.98 2pdn s LYS 221 Ca 0.60 -0.86 0.32 0.00 0.02 0.00 0.00 55.97 56.05 2pdn s LYS 221 Cb -0.48 -2.21 1.72 0.00 -0.52 0.00 0.00 37.83 36.33 2pdn s LYS 221 CO 0.59 0.58 2.16 -1.35 -0.92 0.00 0.00 175.35 176.40 2pdn h PRO 222 N 5.11 0.00 0.00 -1.68 0.11 -2.02 0.36 132.00 133.89 2pdn h PRO 222 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2pdn h PRO 222 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2pdn h PRO 222 CO 0.48 0.06 -0.02 -0.85 -0.21 0.00 0.00 178.00 177.46 2pdn n GLU 223 N -3.47 0.17 -1.69 1.05 0.00 -1.26 -4.88 120.64 110.56 2pdn n GLU 223 Ca -0.02 0.14 -0.37 0.00 0.00 0.00 0.00 57.16 56.91 2pdn n GLU 223 Cb 0.19 -1.70 0.06 0.00 0.00 0.00 0.00 31.44 29.99 2pdn n GLU 223 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2pdn n ASP 224 N -2.00 1.63 -4.74 -1.84 8.00 0.11 -4.93 116.55 112.79 2pdn n ASP 224 Ca 0.06 0.83 -0.36 0.00 0.71 0.00 0.00 54.79 56.02 2pdn n ASP 224 Cb 0.40 -1.50 0.05 0.00 -0.02 0.00 0.00 41.12 40.05 2pdn n ASP 224 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2pdn s PRO 225 N -3.13 2.74 -0.25 -0.24 0.04 -1.26 -5.00 135.00 127.89 2pdn s PRO 225 Ca 0.80 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.78 2pdn s PRO 225 Cb -0.39 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.33 2pdn s PRO 225 CO 0.43 -1.42 -0.04 0.45 0.04 0.00 0.00 177.00 176.46 2pdn s SER 226 N -1.53 3.95 0.10 6.66 0.15 -1.26 -5.01 113.70 116.76 2pdn s SER 226 Ca 0.80 -1.29 -0.21 0.00 0.70 0.00 0.00 55.95 55.95 2pdn s SER 226 Cb -0.34 -1.20 -0.10 0.00 -1.71 0.00 0.00 66.02 62.67 2pdn s SER 226 CO 0.37 -0.26 1.72 -0.07 1.20 0.00 0.00 173.24 176.20 2pdn h LEU 227 N 7.93 0.18 -2.61 3.45 3.38 -1.90 -1.71 115.31 124.02 2pdn h LEU 227 Ca -0.17 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2pdn h LEU 227 Cb 1.06 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2pdn h LEU 227 CO 0.43 0.18 -0.01 -0.07 0.09 0.00 0.00 178.44 179.05 2pdn h LEU 228 N 0.16 0.00 -2.29 1.67 3.38 -1.96 -1.86 115.31 114.41 2pdn h LEU 228 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2pdn h LEU 228 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2pdn h LEU 228 CO -0.01 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.91 2pdn n GLU 229 N -3.34 2.28 -2.07 1.13 -0.58 -0.80 -4.86 120.64 112.39 2pdn n GLU 229 Ca -0.03 -2.09 -0.43 0.00 -0.42 0.00 0.00 57.16 54.19 2pdn n GLU 229 Cb 0.11 -1.43 -0.03 0.00 -0.57 0.00 0.00 31.44 29.52 2pdn n GLU 229 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2pdn s ASP 230 N -1.32 6.29 0.54 1.62 -1.08 -0.70 -4.88 116.67 117.14 2pdn s ASP 230 Ca 0.32 1.61 0.26 0.00 -0.52 0.00 0.00 52.55 54.22 2pdn s ASP 230 Cb 0.19 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.66 2pdn s ASP 230 CO 0.27 -1.34 2.15 1.55 0.52 0.00 0.00 175.17 178.32 2pdn h PRO 231 N 11.14 0.00 -0.13 4.34 0.13 -1.91 -0.59 132.00 144.98 2pdn h PRO 231 Ca -0.34 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.69 2pdn h PRO 231 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2pdn h PRO 231 CO 1.00 0.07 -0.37 0.00 -0.23 0.00 0.00 178.00 178.47 2pdn h ARG 232 N 0.00 0.27 0.19 0.86 3.08 -1.97 -0.25 114.38 116.56 2pdn h ARG 232 Ca -0.00 -0.12 -0.34 0.00 0.07 0.00 0.00 59.98 59.59 2pdn h ARG 232 Cb 0.16 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.22 2pdn h ARG 232 CO 0.01 0.61 -1.61 0.82 -1.07 0.00 0.00 179.97 178.73 2pdn h ILE 233 N 0.23 1.10 -0.89 2.04 2.04 -1.53 -2.82 117.51 117.68 2pdn h ILE 233 Ca 0.03 -2.65 0.16 0.00 1.00 0.00 0.00 64.86 63.40 2pdn h ILE 233 Cb 0.76 2.85 -0.07 0.00 -0.74 0.00 0.00 36.82 39.62 2pdn h ILE 233 CO 0.06 0.84 0.58 0.11 0.00 0.00 0.00 178.15 179.73 2pdn h LYS 234 N 0.11 0.61 -0.38 2.37 1.57 -1.00 0.73 116.57 120.58 2pdn h LYS 234 Ca -0.29 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.34 2pdn h LYS 234 Cb 2.10 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 34.26 2pdn h LYS 234 CO 0.20 0.40 -0.18 0.00 -0.57 0.00 0.00 179.45 179.30 2pdn h ALA 235 N 1.61 0.54 -0.74 3.86 0.00 -1.00 -0.37 119.26 123.16 2pdn h ALA 235 Ca 0.46 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2pdn h ALA 235 Cb 0.83 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2pdn h ALA 235 CO -0.21 0.48 0.47 0.82 0.00 0.00 0.00 179.25 180.81 2pdn h ILE 236 N 0.60 1.20 -0.70 0.00 2.04 -0.99 -2.35 117.51 117.31 2pdn h ILE 236 Ca 0.09 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 2pdn h ILE 236 Cb 0.73 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2pdn h ILE 236 CO 0.06 0.20 0.16 0.00 0.00 0.00 0.00 178.15 178.57 2pdn h ALA 237 N 1.25 0.96 0.00 1.87 0.00 -0.62 -2.88 119.26 119.83 2pdn h ALA 237 Ca 0.27 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2pdn h ALA 237 Cb -0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2pdn h ALA 237 CO -0.05 0.67 -0.27 0.00 0.00 0.00 0.00 179.25 179.59 2pdn h ALA 238 N 1.10 1.52 -0.67 0.00 0.00 -0.71 -1.55 119.26 118.94 2pdn h ALA 238 Ca 0.22 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2pdn h ALA 238 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2pdn h ALA 238 CO 0.00 0.34 0.31 -0.22 0.00 0.00 0.00 179.25 179.68 2pdn h LYS 239 N 0.00 0.96 -0.57 0.00 3.64 -1.21 -2.87 116.57 116.51 2pdn h LYS 239 Ca -0.00 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2pdn h LYS 239 Cb 0.49 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2pdn h LYS 239 CO 0.04 0.75 0.00 0.72 -2.27 0.00 0.00 179.45 178.69 2pdn n HIS 240 N -4.33 0.76 -3.84 1.91 8.25 -0.78 -4.95 115.22 112.23 2pdn n HIS 240 Ca 0.06 -0.38 -0.30 0.00 -0.26 0.00 0.00 57.72 56.84 2pdn n HIS 240 Cb 0.14 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2pdn n HIS 240 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2pdn n ASN 241 N 1.42 -4.17 -4.59 0.41 3.02 -0.67 -4.97 115.26 105.71 2pdn n ASN 241 Ca 0.21 -0.73 -0.27 0.00 -0.03 0.00 0.00 54.58 53.76 2pdn n ASN 241 Cb 0.57 -3.38 -0.11 0.00 -0.61 0.00 0.00 39.78 36.25 2pdn n ASN 241 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2pdn s LYS 242 N -6.53 1.91 0.45 3.52 -0.14 -0.68 -5.03 119.74 113.23 2pdn s LYS 242 Ca 0.62 -2.00 -0.07 0.00 -1.36 0.00 0.00 55.97 53.16 2pdn s LYS 242 Cb -0.32 -1.70 -0.05 0.00 -1.68 0.00 0.00 37.83 34.09 2pdn s LYS 242 CO 0.76 0.05 0.77 0.95 -0.76 0.00 0.00 175.35 177.12 2pdn s THR 243 N -2.65 4.87 0.25 2.17 -4.23 -1.26 -4.12 115.64 110.67 2pdn s THR 243 Ca 0.34 0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 61.15 2pdn s THR 243 Cb 0.06 -3.82 0.23 0.00 1.34 0.00 0.00 72.50 70.31 2pdn s THR 243 CO 0.17 -0.73 1.71 0.74 -0.54 0.00 0.00 174.62 175.97 2pdn h THR 244 N 0.52 0.58 -0.95 3.99 2.02 -1.91 -1.54 112.91 115.63 2pdn h THR 244 Ca -0.47 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 66.59 2pdn h THR 244 Cb 1.20 0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.74 2pdn h THR 244 CO 0.62 0.07 0.62 0.00 0.37 0.00 0.00 175.52 177.21 2pdn h ALA 245 N 1.59 1.31 -0.66 6.16 0.00 -1.93 -0.61 119.26 125.12 2pdn h ALA 245 Ca 0.43 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.19 2pdn h ALA 245 Cb 0.71 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2pdn h ALA 245 CO -0.46 0.63 0.08 1.96 0.00 0.00 0.00 179.25 181.46 2pdn h GLN 246 N 1.29 1.11 -0.37 0.00 4.20 -1.65 0.40 115.11 120.09 2pdn h GLN 246 Ca 0.35 -0.32 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2pdn h GLN 246 Cb -0.14 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2pdn h GLN 246 CO -0.07 1.04 0.17 0.28 -0.67 0.00 0.00 178.83 179.57 2pdn h VAL 247 N 1.03 1.17 0.00 -0.54 2.07 -0.95 0.02 116.25 119.07 2pdn h VAL 247 Ca 0.20 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 2pdn h VAL 247 Cb 0.48 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2pdn h VAL 247 CO 0.02 0.19 -0.25 -0.07 0.02 0.00 0.00 177.57 177.48 2pdn h LEU 248 N 0.45 0.00 0.19 2.57 3.38 -0.46 -1.32 115.31 120.12 2pdn h LEU 248 Ca 0.12 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.84 2pdn h LEU 248 Cb 0.14 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.92 2pdn h LEU 248 CO -0.01 0.25 -1.12 0.40 0.09 0.00 0.00 178.44 178.04 2pdn h ILE 249 N 0.00 1.40 -0.19 1.22 2.04 -0.78 -3.36 117.51 117.84 2pdn h ILE 249 Ca -0.00 -2.59 -0.06 0.00 1.00 0.00 0.00 64.86 63.21 2pdn h ILE 249 Cb 0.47 3.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.63 2pdn h ILE 249 CO 0.03 0.76 -0.13 -0.09 0.00 0.00 0.00 178.15 178.71 2pdn h ARG 250 N -0.10 0.31 0.20 2.37 9.65 -0.80 -3.24 114.38 122.77 2pdn h ARG 250 Ca -0.19 -0.08 0.01 0.00 -1.10 0.00 0.00 59.98 58.62 2pdn h ARG 250 Cb 1.88 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 30.39 2pdn h ARG 250 CO 0.21 0.46 -0.35 0.35 2.80 0.00 0.00 179.97 183.44 2pdn h PHE 251 N 0.30 -0.96 -0.13 2.20 3.57 -1.38 -2.12 116.94 118.41 2pdn h PHE 251 Ca 0.06 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 2pdn h PHE 251 Cb 0.42 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 2pdn h PHE 251 CO 0.01 -0.47 -0.24 -1.00 -2.23 0.00 0.00 178.31 174.38 2pdn h PRO 252 N -0.63 0.22 -0.95 6.41 0.13 -1.74 -2.27 132.00 133.17 2pdn h PRO 252 Ca 0.01 -0.07 0.12 0.00 -0.87 0.00 0.00 66.00 65.19 2pdn h PRO 252 Cb 0.63 -0.02 -0.09 0.00 0.13 0.00 0.00 31.00 31.65 2pdn h PRO 252 CO -0.16 0.46 0.58 0.52 -0.23 0.00 0.00 178.00 179.17 2pdn h MET 253 N 0.20 0.87 -0.04 0.86 2.86 -1.50 -0.60 114.93 117.58 2pdn h MET 253 Ca 0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2pdn h MET 253 Cb 0.55 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.01 2pdn h MET 253 CO 0.04 0.57 0.00 1.04 1.06 0.00 0.00 176.91 179.62 2pdn n GLN 254 N -4.68 1.24 -0.56 1.72 6.02 -0.83 -2.58 117.38 117.71 2pdn n GLN 254 Ca 0.18 -0.36 0.08 0.00 -0.01 0.00 0.00 57.00 56.90 2pdn n GLN 254 Cb 0.36 -1.39 0.31 0.00 1.02 0.00 0.00 30.24 30.55 2pdn n GLN 254 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2pdn n ARG 255 N -0.48 3.62 -3.13 -1.09 1.74 -0.29 -4.95 116.66 112.08 2pdn n ARG 255 Ca 0.18 -2.81 -0.22 0.00 -0.77 0.00 0.00 57.85 54.22 2pdn n ARG 255 Cb 0.17 -1.86 0.04 0.00 -1.02 0.00 0.00 32.46 29.79 2pdn n ARG 255 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2pdn n ASN 256 N 0.50 -6.11 -4.86 0.55 5.15 -1.06 -5.01 115.26 104.41 2pdn n ASN 256 Ca 0.23 -0.34 -0.22 0.00 -0.60 0.00 0.00 54.58 53.65 2pdn n ASN 256 Cb 0.89 -4.88 -0.04 0.00 -0.53 0.00 0.00 39.78 35.22 2pdn n ASN 256 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2pdn s LEU 257 N -6.66 3.96 0.23 1.20 1.43 -0.85 -4.66 118.68 113.32 2pdn s LEU 257 Ca 0.36 -0.14 -0.15 0.00 -1.03 0.00 0.00 54.13 53.17 2pdn s LEU 257 Cb -0.16 -2.50 -0.08 0.00 0.03 0.00 0.00 46.19 43.48 2pdn s LEU 257 CO 0.44 -0.04 0.64 -0.69 0.23 0.00 0.00 176.35 176.94 2pdn s VAL 258 N -2.05 4.76 0.01 -1.59 1.01 -0.06 -4.25 120.40 118.22 2pdn s VAL 258 Ca 0.33 0.90 0.01 0.00 0.00 0.00 0.00 61.98 63.22 2pdn s VAL 258 Cb -0.08 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2pdn s VAL 258 CO 0.26 0.06 -0.05 0.54 0.00 0.00 0.00 175.10 175.91 2pdn s VAL 259 N -1.68 0.36 -0.47 2.92 0.11 0.97 0.22 120.40 122.82 2pdn s VAL 259 Ca 0.45 -0.48 0.08 0.00 -2.93 0.00 0.00 61.98 59.10 2pdn s VAL 259 Cb -0.13 -0.36 0.26 0.00 -1.53 0.00 0.00 36.38 34.62 2pdn s VAL 259 CO 0.20 -0.09 0.63 2.30 -3.33 0.00 0.00 175.10 174.80 2pdn n ILE 260 N 2.45 0.43 -1.98 7.04 -5.35 -1.16 -1.13 119.36 119.67 2pdn n ILE 260 Ca -0.16 -4.50 -0.41 0.00 -0.27 0.00 0.00 62.75 57.41 2pdn n ILE 260 Cb 0.57 -1.82 -0.02 0.00 -1.74 0.00 0.00 39.64 36.63 2pdn n ILE 260 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2pdn s PRO 261 N -1.79 4.25 -0.14 6.28 0.04 -1.21 -3.34 135.00 139.09 2pdn s PRO 261 Ca 0.38 2.35 -0.13 0.00 0.04 0.00 0.00 61.00 63.64 2pdn s PRO 261 Cb 0.19 -3.06 -0.05 0.00 0.04 0.00 0.00 34.50 31.62 2pdn s PRO 261 CO -0.08 -0.39 0.27 0.21 0.04 0.00 0.00 177.00 177.05 2pdn s LYS 262 N -1.16 4.11 -0.04 4.56 2.36 -1.26 -1.44 119.74 126.87 2pdn s LYS 262 Ca 0.55 0.06 -0.28 0.00 -2.55 0.00 0.00 55.97 53.75 2pdn s LYS 262 Cb -0.43 -3.37 0.06 0.00 -1.05 0.00 0.00 37.83 33.04 2pdn s LYS 262 CO 0.51 0.36 0.61 0.45 1.55 0.00 0.00 175.35 178.83 2pdn s SER 263 N 0.11 -0.58 0.00 1.43 0.15 -1.26 -4.94 113.70 108.62 2pdn s SER 263 Ca 0.16 0.60 0.08 0.00 0.70 0.00 0.00 55.95 57.49 2pdn s SER 263 Cb -0.13 0.50 0.12 0.00 -1.71 0.00 0.00 66.02 64.80 2pdn s SER 263 CO 0.04 -0.59 0.89 1.33 1.20 0.00 0.00 173.24 176.12 2pdn n VAL 264 N 0.95 0.33 -3.08 4.45 0.24 -1.26 -4.89 118.33 115.07 2pdn n VAL 264 Ca -0.19 -0.66 -0.43 0.00 -2.04 0.00 0.00 64.34 61.01 2pdn n VAL 264 Cb 0.57 0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 33.82 2pdn n VAL 264 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2pdn s THR 265 N -0.78 4.80 0.32 3.34 2.01 -1.26 -4.69 115.64 119.37 2pdn s THR 265 Ca 0.12 0.19 0.09 0.00 0.31 0.00 0.00 61.69 62.39 2pdn s THR 265 Cb 0.07 -4.22 0.31 0.00 0.01 0.00 0.00 72.50 68.67 2pdn s THR 265 CO 0.10 -0.61 1.75 -0.65 -0.69 0.00 0.00 174.62 174.52 2pdn h PRO 266 N 8.88 0.61 -0.28 4.92 0.11 -1.95 0.02 132.00 144.30 2pdn h PRO 266 Ca -0.25 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 2pdn h PRO 266 Cb 1.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 2pdn h PRO 266 CO 0.90 0.40 0.16 1.49 -0.21 0.00 0.00 178.00 180.75 2pdn h GLU 267 N 0.63 0.39 -0.20 1.05 4.22 -2.00 -2.27 114.58 116.39 2pdn h GLU 267 Ca 0.62 -0.04 -0.09 0.00 0.08 0.00 0.00 59.36 59.92 2pdn h GLU 267 Cb 1.14 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2pdn h GLU 267 CO -0.43 0.33 -0.29 0.00 -2.18 0.00 0.00 179.01 176.44 2pdn h ARG 268 N 0.35 0.39 -0.67 1.92 3.08 -1.52 -1.39 114.38 116.55 2pdn h ARG 268 Ca 0.10 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2pdn h ARG 268 Cb 0.04 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2pdn h ARG 268 CO -0.02 0.65 0.42 0.82 -1.07 0.00 0.00 179.97 180.77 2pdn h ILE 269 N 0.35 1.18 0.01 2.04 2.04 -0.69 0.13 117.51 122.57 2pdn h ILE 269 Ca 0.05 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 2pdn h ILE 269 Cb 0.68 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2pdn h ILE 269 CO 0.05 0.19 -0.00 0.00 0.00 0.00 0.00 178.15 178.38 2pdn h ALA 270 N 1.22 -0.01 -0.33 1.87 0.00 -1.18 -3.04 119.26 117.79 2pdn h ALA 270 Ca 0.24 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2pdn h ALA 270 Cb -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 2pdn h ALA 270 CO -0.05 -0.37 -0.18 1.49 0.00 0.00 0.00 179.25 180.14 2pdn h GLU 271 N -0.27 -0.13 -0.02 0.00 4.81 -0.98 -1.86 114.58 116.13 2pdn h GLU 271 Ca -0.00 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2pdn h GLU 271 Cb 0.27 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 2pdn h GLU 271 CO 0.00 -0.09 0.04 -0.91 -0.73 0.00 0.00 179.01 177.32 2pdn h ASN 272 N -0.13 0.00 1.19 1.04 2.35 -0.95 -1.38 115.58 117.70 2pdn h ASN 272 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2pdn h ASN 272 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2pdn h ASN 272 CO -0.41 0.00 -0.43 0.15 -1.65 0.00 0.00 177.43 175.09 2pdn h PHE 273 N 0.00 0.00 -1.49 1.19 3.57 -1.22 -3.41 116.94 115.58 2pdn h PHE 273 Ca 0.01 0.00 -0.76 0.00 3.53 0.00 0.00 57.97 60.75 2pdn h PHE 273 Cb 0.08 0.00 -0.16 0.00 2.79 0.00 0.00 35.95 38.66 2pdn h PHE 273 CO 0.00 0.00 1.98 1.63 -2.23 0.00 0.00 178.31 179.69 2pdn n LYS 274 N -2.34 3.92 -0.14 1.11 5.02 -0.52 -4.35 118.16 120.86 2pdn n LYS 274 Ca 0.04 -3.63 0.01 0.00 -2.02 0.00 0.00 58.31 52.71 2pdn n LYS 274 Cb 0.46 -2.82 0.02 0.00 -0.02 0.00 0.00 35.03 32.67 2pdn n LYS 274 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2pdn n VAL 275 N 2.77 0.46 0.40 -0.18 0.24 -1.26 -4.74 118.33 116.02 2pdn n VAL 275 Ca 0.43 -0.51 0.10 0.00 -2.04 0.00 0.00 64.34 62.32 2pdn n VAL 275 Cb 0.33 0.60 0.15 0.00 -1.47 0.00 0.00 33.84 33.46 2pdn n VAL 275 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2pdn n PHE 276 N -0.30 0.31 -0.91 6.34 3.72 -1.26 -4.42 117.46 120.94 2pdn n PHE 276 Ca 0.02 -0.19 0.08 0.00 -0.05 0.00 0.00 57.45 57.32 2pdn n PHE 276 Cb 0.52 -0.00 0.27 0.00 -0.94 0.00 0.00 39.48 39.32 2pdn n PHE 276 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 2pdn n ASP 277 N 1.19 4.00 -3.59 4.37 5.75 -1.26 -5.00 116.55 122.00 2pdn n ASP 277 Ca 0.15 -2.92 -0.08 0.00 -0.01 0.00 0.00 54.79 51.93 2pdn n ASP 277 Cb 0.52 -0.53 -0.02 0.00 -1.03 0.00 0.00 41.12 40.06 2pdn n ASP 277 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 2pdn s PHE 278 N -2.66 -0.32 -0.06 2.11 -0.71 -1.26 -5.16 117.98 109.91 2pdn s PHE 278 Ca 0.42 0.08 0.01 0.00 -1.04 0.00 0.00 56.93 56.40 2pdn s PHE 278 Cb 0.33 0.59 0.02 0.00 -1.21 0.00 0.00 43.02 42.76 2pdn s PHE 278 CO 0.10 -0.80 -0.06 -2.00 -1.34 0.00 0.00 175.22 171.13 2pdn s GLU 279 N -3.45 1.05 0.25 1.99 2.12 -1.26 -5.04 118.70 114.36 2pdn s GLU 279 Ca 0.07 -0.16 -0.30 0.00 0.36 0.00 0.00 54.97 54.94 2pdn s GLU 279 Cb -0.02 -1.04 -0.09 0.00 0.26 0.00 0.00 34.13 33.24 2pdn s GLU 279 CO -0.05 -0.10 1.25 -0.51 -0.54 0.00 0.00 175.26 175.31 2pdn s LEU 280 N 1.06 4.45 0.95 2.70 1.43 -1.26 -5.02 118.68 123.00 2pdn s LEU 280 Ca -0.08 2.42 -0.14 0.00 -1.03 0.00 0.00 54.13 55.29 2pdn s LEU 280 Cb -0.14 -3.62 0.17 0.00 0.03 0.00 0.00 46.19 42.63 2pdn s LEU 280 CO -0.01 -0.42 1.20 -0.94 0.23 0.00 0.00 176.35 176.41 2pdn s SER 281 N -0.15 3.16 0.24 2.29 1.04 -1.26 -4.81 113.70 114.20 2pdn s SER 281 Ca 0.52 0.67 -0.06 0.00 0.48 0.00 0.00 55.95 57.55 2pdn s SER 281 Cb -0.36 -1.01 0.33 0.00 0.10 0.00 0.00 66.02 65.08 2pdn s SER 281 CO 0.42 -2.74 1.84 -1.28 0.98 0.00 0.00 173.24 172.46 2pdn h SER 282 N -1.64 0.78 -0.63 7.02 0.87 -2.00 -1.44 113.55 116.52 2pdn h SER 282 Ca -0.47 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.02 2pdn h SER 282 Cb 1.30 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 63.09 2pdn h SER 282 CO 0.51 0.50 0.05 -0.61 -0.53 0.00 0.00 176.83 176.75 2pdn h GLN 283 N 0.91 1.08 -0.40 2.24 5.75 -1.99 -1.42 115.11 121.29 2pdn h GLN 283 Ca 0.37 -0.32 0.05 0.00 -0.15 0.00 0.00 58.65 58.60 2pdn h GLN 283 Cb 0.19 -0.11 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 2pdn h GLN 283 CO -0.18 1.03 0.13 -0.44 -2.65 0.00 0.00 178.83 176.71 2pdn h ASP 284 N 0.99 0.12 -0.37 -0.69 3.32 -1.83 0.38 116.42 118.34 2pdn h ASP 284 Ca 0.19 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.25 2pdn h ASP 284 Cb 0.50 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 2pdn h ASP 284 CO 0.02 0.11 0.10 0.24 -1.72 0.00 0.00 179.24 177.99 2pdn h MET 285 N 0.28 0.59 -0.64 3.56 2.86 -1.00 0.38 114.93 120.96 2pdn h MET 285 Ca 0.19 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2pdn h MET 285 Cb 0.18 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 2pdn h MET 285 CO -0.20 0.62 0.38 1.15 1.06 0.00 0.00 176.91 179.93 2pdn h THR 286 N 0.45 1.19 -0.30 2.22 2.02 -0.90 -0.43 112.91 117.16 2pdn h THR 286 Ca 0.12 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 2pdn h THR 286 Cb 0.29 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 2pdn h THR 286 CO -0.00 0.20 0.11 0.74 0.37 0.00 0.00 175.52 176.94 2pdn h THR 287 N 0.88 1.19 -0.53 3.16 2.02 0.05 -1.74 112.91 117.94 2pdn h THR 287 Ca 0.23 -0.60 -0.08 0.00 0.77 0.00 0.00 66.41 66.73 2pdn h THR 287 Cb -0.01 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2pdn h THR 287 CO -0.04 0.20 0.00 -0.07 0.37 0.00 0.00 175.52 175.98 2pdn h LEU 288 N 0.33 0.87 -1.87 2.58 3.38 -0.69 -1.70 115.31 118.20 2pdn h LEU 288 Ca 0.10 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2pdn h LEU 288 Cb 0.21 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2pdn h LEU 288 CO -0.01 0.93 -0.13 -0.07 0.09 0.00 0.00 178.44 179.25 2pdn h LEU 289 N 0.83 0.00 0.00 1.67 3.38 -0.86 -2.49 115.31 117.84 2pdn h LEU 289 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2pdn h LEU 289 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2pdn h LEU 289 CO 0.02 0.13 0.00 -1.54 0.09 0.00 0.00 178.44 177.14 2pdn n SER 290 N -3.95 0.00 -0.37 -0.43 3.41 -0.64 -2.73 113.62 108.92 2pdn n SER 290 Ca -0.02 0.34 0.08 0.00 -0.26 0.00 0.00 58.87 59.01 2pdn n SER 290 Cb 0.22 -0.44 0.34 0.00 -0.26 0.00 0.00 64.21 64.07 2pdn n SER 290 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2pdn n TYR 291 N -1.44 0.18 -1.69 7.33 4.01 -0.94 -4.90 117.16 119.71 2pdn n TYR 291 Ca 0.07 -0.09 -0.44 0.00 -0.16 0.00 0.00 57.90 57.28 2pdn n TYR 291 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.24 2pdn n TYR 291 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2pdn n ASN 292 N -0.02 3.28 0.00 7.72 5.15 -0.40 -4.12 115.26 126.86 2pdn n ASN 292 Ca 0.13 1.11 0.00 0.00 -0.60 0.00 0.00 54.58 55.22 2pdn n ASN 292 Cb 0.22 -1.49 0.00 0.00 -0.53 0.00 0.00 39.78 37.98 2pdn n ASN 292 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2pdn n ARG 293 N 2.73 -0.19 -3.72 1.20 1.74 -0.79 -4.97 116.66 112.67 2pdn n ARG 293 Ca 0.13 -0.43 -0.27 0.00 -0.77 0.00 0.00 57.85 56.52 2pdn n ARG 293 Cb 0.32 -0.79 0.05 0.00 -1.02 0.00 0.00 32.46 31.03 2pdn n ARG 293 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2pdn n ASN 294 N -0.05 -5.69 -4.54 0.55 3.02 -0.18 -4.96 115.26 103.41 2pdn n ASN 294 Ca 0.00 -0.63 -0.40 0.00 -0.03 0.00 0.00 54.58 53.51 2pdn n ASN 294 Cb 0.15 -4.51 -0.10 0.00 -0.61 0.00 0.00 39.78 34.71 2pdn n ASN 294 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2pdn s TRP 295 N -3.30 3.23 -0.19 3.10 -0.00 -0.65 -4.99 118.94 116.13 2pdn s TRP 295 Ca 0.62 -0.16 -0.08 0.00 -0.00 0.00 0.00 56.10 56.48 2pdn s TRP 295 Cb -0.29 -2.48 -0.04 0.00 -0.00 0.00 0.00 33.47 30.66 2pdn s TRP 295 CO 0.76 -0.34 0.07 1.03 -0.00 0.00 0.00 176.95 178.47 2pdn s ARG 296 N 1.75 3.96 0.09 5.86 0.52 -1.26 -4.27 118.95 125.59 2pdn s ARG 296 Ca 0.07 -0.35 -0.00 0.00 -0.52 0.00 0.00 55.73 54.93 2pdn s ARG 296 Cb -0.17 -3.25 -0.26 0.00 0.52 0.00 0.00 34.95 31.79 2pdn s ARG 296 CO 0.11 0.22 1.18 -0.39 0.02 0.00 0.00 175.30 176.43 2pdn h VAL 297 N 4.93 1.56 -3.51 3.52 -1.51 -1.98 -3.42 116.25 115.84 2pdn h VAL 297 Ca -0.37 -3.18 -0.69 0.00 -1.23 0.00 0.00 66.70 61.23 2pdn h VAL 297 Cb 1.17 2.90 -0.35 0.00 -2.13 0.00 0.00 31.29 32.88 2pdn h VAL 297 CO 0.69 0.92 -0.53 0.00 -1.23 0.00 0.00 177.57 177.42 2pdn n ALA 299 N 4.24 -2.24 -1.78 0.00 0.00 -1.26 -5.06 120.51 114.40 2pdn n ALA 299 Ca 0.01 -0.84 -0.40 0.00 0.00 0.00 0.00 53.44 52.20 2pdn n ALA 299 Cb 0.40 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 17.95 2pdn n ALA 299 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2pdn s LEU 300 N 0.66 3.42 0.30 0.00 2.96 -1.26 -4.84 118.68 119.91 2pdn s LEU 300 Ca 0.29 1.25 0.22 0.00 -0.22 0.00 0.00 54.13 55.67 2pdn s LEU 300 Cb 0.06 -3.09 1.09 0.00 0.50 0.00 0.00 46.19 44.75 2pdn s LEU 300 CO -0.09 -2.19 1.66 0.18 -1.32 0.00 0.00 176.35 174.59 2pdn n LEU 301 N 12.54 0.57 0.00 -0.68 4.77 -1.26 -1.71 117.00 131.24 2pdn n LEU 301 Ca 0.28 0.73 0.06 0.00 -0.03 0.00 0.00 56.01 57.05 2pdn n LEU 301 Cb 0.49 -0.76 0.36 0.00 -2.33 0.00 0.00 43.42 41.18 2pdn n LEU 301 CO 0.69 -0.84 0.61 0.54 -1.33 0.00 0.00 177.39 177.06 2pdn n ARG 302 N -2.23 0.33 0.00 3.23 1.74 -1.26 -2.03 116.66 116.44 2pdn n ARG 302 Ca -0.00 0.05 0.06 0.00 -0.77 0.00 0.00 57.85 57.19 2pdn n ARG 302 Cb 0.08 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.07 2pdn n ARG 302 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pdn n THR 304 N 0.55 0.99 0.78 0.00 -2.24 -0.86 -1.49 114.28 112.01 2pdn n THR 304 Ca 0.07 0.30 0.11 0.00 -2.27 0.00 0.00 64.05 62.26 2pdn n THR 304 Cb 0.31 -1.17 0.04 0.00 -2.10 0.00 0.00 70.33 67.41 2pdn n THR 304 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2pdn n SER 305 N -1.92 0.67 -4.76 3.42 7.64 -1.26 -4.87 113.62 112.54 2pdn n SER 305 Ca 0.02 -0.43 -0.41 0.00 1.01 0.00 0.00 58.87 59.06 2pdn n SER 305 Cb 0.18 0.73 -0.00 0.00 -1.01 0.00 0.00 64.21 64.11 2pdn n SER 305 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2pdn n HIS 306 N -1.72 2.91 0.18 1.43 -0.00 -0.56 -4.88 115.22 112.58 2pdn n HIS 306 Ca 0.03 0.41 0.18 0.00 -0.00 0.00 0.00 57.72 58.34 2pdn n HIS 306 Cb 0.38 -2.54 0.81 0.00 -0.00 0.00 0.00 29.99 28.65 2pdn n HIS 306 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 2pdn h LYS 307 N 3.38 0.00 -0.34 1.57 2.10 -1.92 -1.09 116.57 120.27 2pdn h LYS 307 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2pdn h LYS 307 Cb 1.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 2pdn h LYS 307 CO 0.68 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.88 2pdn n ASP 308 N -3.78 3.03 -4.68 7.07 8.00 -1.26 -4.99 116.55 119.94 2pdn n ASP 308 Ca 0.03 -2.10 -0.45 0.00 0.71 0.00 0.00 54.79 52.97 2pdn n ASP 308 Cb 0.38 -0.26 -0.04 0.00 -0.02 0.00 0.00 41.12 41.18 2pdn n ASP 308 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pdn n TYR 309 N 0.42 2.44 0.22 1.24 9.36 -0.42 -4.40 117.16 126.02 2pdn n TYR 309 Ca 0.13 0.12 0.12 0.00 3.32 0.00 0.00 57.90 61.59 2pdn n TYR 309 Cb 0.48 -2.61 0.21 0.00 -0.63 0.00 0.00 39.34 36.78 2pdn n TYR 309 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 2pdn h PRO 310 N 6.90 0.00 -0.51 2.98 0.13 -1.91 -3.39 132.00 136.20 2pdn h PRO 310 Ca -0.45 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.46 2pdn h PRO 310 Cb 1.24 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 2pdn h PRO 310 CO 0.92 0.00 0.13 1.19 -0.23 0.00 0.00 178.00 180.01 2pdn n PHE 311 N -3.10 1.63 0.07 1.56 3.72 -1.26 -4.13 117.46 115.95 2pdn n PHE 311 Ca 0.04 -1.45 -0.13 0.00 -0.05 0.00 0.00 57.45 55.86 2pdn n PHE 311 Cb 0.51 -0.57 -0.14 0.00 -0.94 0.00 0.00 39.48 38.34 2pdn n PHE 311 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2pdn h HIS 312 N 1.40 0.31 -4.06 1.38 3.86 -1.98 -3.47 115.15 112.60 2pdn h HIS 312 Ca 0.26 -0.23 -0.49 0.00 -1.16 0.00 0.00 60.37 58.75 2pdn h HIS 312 Cb 1.95 -0.01 0.05 0.00 1.06 0.00 0.00 27.41 30.46 2pdn h HIS 312 CO 1.07 1.22 0.43 -2.00 0.86 0.00 0.00 177.93 179.51 2pdn s GLU 313 N -2.65 3.59 0.25 2.45 2.56 -1.26 -4.93 118.70 118.71 2pdn s GLU 313 Ca -0.04 1.56 -0.03 0.00 0.00 0.00 0.00 54.97 56.45 2pdn s GLU 313 Cb 0.08 -2.12 0.52 0.00 2.00 0.00 0.00 34.13 34.60 2pdn s GLU 313 CO 0.85 -0.65 1.69 1.49 -0.56 0.00 0.00 175.26 178.09 2pdn h GLU 314 N 1.50 0.31 0.00 4.30 4.81 -1.93 -3.51 114.58 120.05 2pdn h GLU 314 Ca -0.50 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2pdn h GLU 314 Cb 1.25 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2pdn h GLU 314 CO 0.58 0.20 0.00 1.97 -0.73 0.00 0.00 179.01 181.03