#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2psy s ILE 17 N 0.00 5.08 -1.15 1.39 1.09 0.77 -4.13 121.20 124.26 2psy s ILE 17 Ca 0.00 1.09 -0.06 0.00 -1.10 0.00 0.00 60.65 60.58 2psy s ILE 17 Cb 0.00 -3.90 0.01 0.00 -1.06 0.00 0.00 42.46 37.51 2psy s ILE 17 CO 0.00 0.18 0.81 -3.20 -0.10 0.00 0.00 174.94 172.63 2psy n ASN 18 N 4.65 -5.46 -0.61 3.58 5.15 -1.26 -2.83 115.26 118.48 2psy n ASN 18 Ca -0.03 -0.37 0.00 0.00 -0.60 0.00 0.00 54.58 53.58 2psy n ASN 18 Cb 0.50 -4.14 0.00 0.00 -0.53 0.00 0.00 39.78 35.62 2psy n ASN 18 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2psy n GLY 19 N -1.61 1.85 3.10 8.20 0.00 -1.26 -4.91 105.19 110.55 2psy n GLY 19 Ca -0.02 -2.06 -0.07 0.00 0.00 0.00 0.00 46.02 43.87 2psy n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2psy s SER 20 N -1.00 0.44 0.21 1.61 1.04 -0.51 -4.92 113.70 110.56 2psy s SER 20 Ca 0.00 -0.94 -0.32 0.00 0.48 0.00 0.00 55.95 55.17 2psy s SER 20 Cb 0.00 0.21 -0.13 0.00 0.10 0.00 0.00 66.02 66.20 2psy s SER 20 CO 0.00 -0.59 1.64 0.47 0.98 0.00 0.00 173.24 175.74 2psy n ASP 21 N 0.18 3.63 -4.74 7.02 8.00 -1.26 -0.40 116.55 128.98 2psy n ASP 21 Ca -0.15 1.08 -0.33 0.00 0.71 0.00 0.00 54.79 56.10 2psy n ASP 21 Cb 0.61 -1.52 0.08 0.00 -0.02 0.00 0.00 41.12 40.27 2psy n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2psy s ASP 23 N -2.38 5.70 0.40 0.00 -0.00 -1.26 -4.98 116.67 114.15 2psy s ASP 23 Ca 0.70 1.95 -0.24 0.00 -0.00 0.00 0.00 52.55 54.96 2psy s ASP 23 Cb -0.25 -2.55 -0.09 0.00 -0.00 0.00 0.00 42.92 40.03 2psy s ASP 23 CO 0.45 -1.23 1.04 -0.04 -0.00 0.00 0.00 175.17 175.40 2psy s MET 24 N -3.79 4.17 0.00 8.23 -1.94 -1.26 -3.35 119.30 121.36 2psy s MET 24 Ca 0.67 1.50 0.00 0.00 -1.71 0.00 0.00 55.69 56.15 2psy s MET 24 Cb -0.19 -2.53 0.00 0.00 2.01 0.00 0.00 34.83 34.12 2psy s MET 24 CO 0.33 -0.13 0.00 0.72 -0.01 0.00 0.00 175.02 175.93 2psy n HIS 25 N -0.08 0.00 1.04 -0.03 8.25 -1.26 -4.87 115.22 118.27 2psy n HIS 25 Ca 0.05 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.63 2psy n HIS 25 Cb 0.50 -0.68 0.20 0.00 1.12 0.00 0.00 29.99 31.13 2psy n HIS 25 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2psy n THR 26 N -2.22 0.00 -3.18 1.59 -2.24 -1.21 -4.40 114.28 102.62 2psy n THR 26 Ca 0.00 -0.03 -0.23 0.00 -2.27 0.00 0.00 64.05 61.52 2psy n THR 26 Cb 0.07 0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.67 2psy n THR 26 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2psy n GLN 27 N -1.32 1.73 0.00 -0.78 3.00 -1.26 -4.93 117.38 113.81 2psy n GLN 27 Ca 0.06 -3.93 0.08 0.00 -0.01 0.00 0.00 57.00 53.20 2psy n GLN 27 Cb 0.34 -1.80 0.36 0.00 0.00 0.00 0.00 30.24 29.14 2psy n GLN 27 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2psy n PRO 28 N 0.58 0.05 0.00 -1.09 -0.04 -1.26 -2.40 135.00 130.84 2psy n PRO 28 Ca 0.26 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 64.03 2psy n PRO 28 Cb 0.51 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2psy n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2psy n TRP 29 N -1.46 0.00 -2.17 0.54 2.14 -1.11 -1.50 117.44 113.88 2psy n TRP 29 Ca 0.05 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.21 2psy n TRP 29 Cb 0.18 -0.05 -0.03 0.00 -0.81 0.00 0.00 31.31 30.60 2psy n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2psy s GLN 30 N -2.82 4.38 0.21 -2.67 2.00 -1.01 -0.32 119.66 119.43 2psy s GLN 30 Ca 0.13 2.13 0.04 0.00 -2.00 0.00 0.00 55.36 55.66 2psy s GLN 30 Cb 0.17 -3.13 -0.05 0.00 0.80 0.00 0.00 33.01 30.80 2psy s GLN 30 CO 0.73 -0.21 -0.04 0.00 -0.50 0.00 0.00 175.29 175.28 2psy s ALA 31 N -0.51 1.72 -0.01 1.58 0.00 -0.26 -4.32 121.76 119.96 2psy s ALA 31 Ca 0.53 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.83 2psy s ALA 31 Cb -0.38 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2psy s ALA 31 CO 0.45 -0.19 -0.10 0.00 0.00 0.00 0.00 175.76 175.92 2psy s ALA 32 N -3.37 0.81 -0.20 0.00 0.00 -0.81 -1.82 121.76 116.37 2psy s ALA 32 Ca 0.25 -0.43 -0.06 0.00 0.00 0.00 0.00 51.96 51.72 2psy s ALA 32 Cb 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 2psy s ALA 32 CO 0.06 0.20 0.04 -0.51 0.00 0.00 0.00 175.76 175.55 2psy s LEU 33 N -0.25 3.52 0.08 0.00 1.02 -0.22 -1.34 118.68 121.49 2psy s LEU 33 Ca 0.04 -0.08 0.08 0.00 0.02 0.00 0.00 54.13 54.18 2psy s LEU 33 Cb -0.04 -1.90 -0.03 0.00 0.02 0.00 0.00 46.19 44.24 2psy s LEU 33 CO -0.00 0.09 -0.20 -0.76 0.02 0.00 0.00 176.35 175.50 2psy s LEU 34 N 0.84 2.25 -0.48 1.79 1.43 0.16 -1.69 118.68 122.97 2psy s LEU 34 Ca 0.02 -0.62 0.08 0.00 -1.03 0.00 0.00 54.13 52.59 2psy s LEU 34 Cb -0.14 -0.90 0.32 0.00 0.03 0.00 0.00 46.19 45.50 2psy s LEU 34 CO 0.02 0.09 0.78 0.00 0.23 0.00 0.00 176.35 177.48 2psy n LEU 35 N 1.40 2.41 -1.62 1.79 -0.00 -1.11 0.96 117.00 120.83 2psy n LEU 35 Ca -0.19 -5.26 0.00 0.00 -0.00 0.00 0.00 56.01 50.56 2psy n LEU 35 Cb 0.53 0.09 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 2psy n LEU 35 CO 0.23 2.26 -0.11 0.54 -0.00 0.00 0.00 177.39 180.30 2psy n ARG 36 N 0.31 -1.26 0.14 1.47 3.00 -1.26 -4.74 116.66 114.32 2psy n ARG 36 Ca 0.27 0.89 -0.06 0.00 -0.01 0.00 0.00 57.85 58.94 2psy n ARG 36 Cb 0.52 -1.36 -0.03 0.00 0.00 0.00 0.00 32.46 31.58 2psy n ARG 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2psy h PRO 37 N 2.88 -0.38 -0.97 5.56 0.11 -2.06 -3.42 132.00 133.73 2psy h PRO 37 Ca 0.00 0.03 -0.35 0.00 0.11 0.00 0.00 66.00 65.78 2psy h PRO 37 Cb 0.00 0.09 -0.30 0.00 0.11 0.00 0.00 31.00 30.90 2psy h PRO 37 CO 0.00 -0.26 -0.89 0.09 -0.21 0.00 0.00 178.00 176.74 2psy n ASN 38 N -3.90 -0.21 -4.49 -2.05 4.13 -1.26 -5.07 115.26 102.41 2psy n ASN 38 Ca -0.05 -3.01 -0.43 0.00 1.68 0.00 0.00 54.58 52.76 2psy n ASN 38 Cb 0.16 0.27 -0.07 0.00 -1.54 0.00 0.00 39.78 38.59 2psy n ASN 38 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 2psy s GLN 39 N -1.54 3.19 -0.31 3.52 2.00 -1.26 -4.87 119.66 120.39 2psy s GLN 39 Ca 0.30 -0.61 -0.29 0.00 -2.00 0.00 0.00 55.36 52.76 2psy s GLN 39 Cb 0.37 -4.00 0.01 0.00 0.80 0.00 0.00 33.01 30.19 2psy s GLN 39 CO -0.05 -1.06 1.15 -1.17 -0.50 0.00 0.00 175.29 173.66 2psy s LEU 40 N 2.66 3.93 -0.01 3.68 0.20 -1.26 -2.74 118.68 125.14 2psy s LEU 40 Ca 0.18 1.12 0.15 0.00 0.69 0.00 0.00 54.13 56.27 2psy s LEU 40 Cb -0.16 -3.54 -0.20 0.00 -0.43 0.00 0.00 46.19 41.86 2psy s LEU 40 CO 0.16 -0.93 0.51 0.00 -0.29 0.00 0.00 176.35 175.80 2psy n TYR 41 N 7.07 0.00 -3.52 5.38 4.11 -0.68 -5.02 117.16 124.49 2psy n TYR 41 Ca 0.13 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.94 2psy n TYR 41 Cb 0.47 -0.16 -0.02 0.00 -0.00 0.00 0.00 39.34 39.63 2psy n TYR 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2psy s GLY 43 N -2.63 1.93 0.29 0.00 0.00 0.11 -1.06 107.32 105.97 2psy s GLY 43 Ca 0.05 -1.62 -0.12 0.00 0.00 0.00 0.00 44.72 43.03 2psy s GLY 43 CO -0.08 -1.43 0.53 0.00 0.00 0.00 0.00 173.10 172.12 2psy s ALA 44 N -2.41 -0.17 -0.04 3.20 0.00 -0.75 -3.68 121.76 117.91 2psy s ALA 44 Ca 0.55 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.57 2psy s ALA 44 Cb -0.10 1.02 0.02 0.00 0.00 0.00 0.00 23.12 24.07 2psy s ALA 44 CO 0.34 -0.87 -0.04 0.08 0.00 0.00 0.00 175.76 175.27 2psy s VAL 45 N -3.61 0.49 -0.37 0.00 1.01 0.52 -1.10 120.40 117.33 2psy s VAL 45 Ca 0.22 -0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 2psy s VAL 45 Cb -0.02 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.86 2psy s VAL 45 CO 0.11 0.21 1.20 -0.22 0.00 0.00 0.00 175.10 176.40 2psy s LEU 46 N 0.92 3.79 0.00 3.92 2.96 0.57 -0.44 118.68 130.39 2psy s LEU 46 Ca -0.11 0.89 0.04 0.00 -0.22 0.00 0.00 54.13 54.73 2psy s LEU 46 Cb -0.14 -3.54 0.07 0.00 0.50 0.00 0.00 46.19 43.08 2psy s LEU 46 CO -0.00 -1.11 0.85 1.33 -1.32 0.00 0.00 176.35 176.10 2psy n VAL 47 N 6.40 0.47 -3.57 1.68 0.24 -0.46 -1.21 118.33 121.88 2psy n VAL 47 Ca 0.13 -0.74 -0.13 0.00 -2.04 0.00 0.00 64.34 61.57 2psy n VAL 47 Cb 0.48 0.81 -0.06 0.00 -1.47 0.00 0.00 33.84 33.60 2psy n VAL 47 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2psy s HIS 48 N -0.66 -0.48 0.63 6.34 5.65 -1.09 -4.59 115.29 121.09 2psy s HIS 48 Ca 0.07 0.87 0.19 0.00 0.25 0.00 0.00 55.06 56.44 2psy s HIS 48 Cb 0.04 0.42 0.83 0.00 -1.18 0.00 0.00 32.58 32.69 2psy s HIS 48 CO 0.06 -0.40 1.40 -1.35 -0.65 0.00 0.00 174.74 173.79 2psy h PRO 49 N 2.95 0.00 0.00 2.88 0.11 -1.96 -0.75 132.00 135.24 2psy h PRO 49 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2psy h PRO 49 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2psy h PRO 49 CO 0.30 0.00 -0.16 0.94 -0.21 0.00 0.00 178.00 178.87 2psy n GLN 50 N -3.03 0.73 -4.23 1.05 7.27 -1.26 -0.46 117.38 117.46 2psy n GLN 50 Ca 0.10 -1.17 -0.17 0.00 0.07 0.00 0.00 57.00 55.83 2psy n GLN 50 Cb 1.05 -0.75 -0.15 0.00 2.41 0.00 0.00 30.24 32.81 2psy n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2psy s TRP 51 N -0.64 0.59 0.29 3.69 0.52 -0.29 -1.44 118.94 121.66 2psy s TRP 51 Ca 0.05 -0.11 0.09 0.00 0.02 0.00 0.00 56.10 56.15 2psy s TRP 51 Cb 0.04 -0.39 -0.04 0.00 -1.15 0.00 0.00 33.47 31.93 2psy s TRP 51 CO 0.00 -0.02 0.04 -0.51 0.02 0.00 0.00 176.95 176.48 2psy s LEU 52 N -0.08 3.21 -0.03 2.99 1.43 0.18 -1.36 118.68 125.02 2psy s LEU 52 Ca 0.02 -0.70 0.04 0.00 -1.03 0.00 0.00 54.13 52.46 2psy s LEU 52 Cb -0.03 -1.71 -0.00 0.00 0.03 0.00 0.00 46.19 44.48 2psy s LEU 52 CO -0.00 -0.10 -0.14 -0.22 0.23 0.00 0.00 176.35 176.11 2psy s LEU 53 N -3.73 1.89 0.33 1.79 2.96 0.42 -1.19 118.68 121.15 2psy s LEU 53 Ca 0.33 -0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 53.87 2psy s LEU 53 Cb -0.05 -0.83 0.02 0.00 0.50 0.00 0.00 46.19 45.83 2psy s LEU 53 CO 0.21 0.13 0.56 0.28 -1.32 0.00 0.00 176.35 176.21 2psy s THR 54 N 0.05 0.00 0.38 3.68 -1.32 -0.45 -0.36 115.64 117.63 2psy s THR 54 Ca -0.03 -1.39 -0.25 0.00 -1.21 0.00 0.00 61.69 58.81 2psy s THR 54 Cb -0.10 -2.61 -0.09 0.00 -1.51 0.00 0.00 72.50 68.19 2psy s THR 54 CO 0.01 0.00 1.05 0.00 -2.21 0.00 0.00 174.62 173.48 2psy s ALA 55 N -3.06 3.12 0.49 11.08 0.00 -1.26 0.45 121.76 132.57 2psy s ALA 55 Ca 0.25 0.72 0.15 0.00 0.00 0.00 0.00 51.96 53.07 2psy s ALA 55 Cb -0.02 -3.28 1.14 0.00 0.00 0.00 0.00 23.12 20.97 2psy s ALA 55 CO 0.16 -0.20 2.09 0.00 0.00 0.00 0.00 175.76 177.80 2psy h ALA 56 N 2.65 1.87 0.00 0.00 0.00 -1.72 -1.42 119.26 120.65 2psy h ALA 56 Ca -0.48 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2psy h ALA 56 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2psy h ALA 56 CO 0.63 0.10 0.00 -2.39 0.00 0.00 0.00 179.25 177.59 2psy n HIS 57 N -4.46 0.00 -0.01 0.00 1.44 -1.26 -2.50 115.22 108.42 2psy n HIS 57 Ca -0.02 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.78 2psy n HIS 57 Cb 0.14 0.00 0.28 0.00 0.12 0.00 0.00 29.99 30.53 2psy n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2psy s ARG 59 N -1.26 4.27 -0.06 0.00 3.52 -1.04 -5.01 118.95 119.37 2psy s ARG 59 Ca 0.42 2.29 -0.12 0.00 -0.13 0.00 0.00 55.73 58.18 2psy s ARG 59 Cb 0.22 -3.12 0.03 0.00 -1.56 0.00 0.00 34.95 30.52 2psy s ARG 59 CO 0.27 -0.43 0.30 0.21 -0.81 0.00 0.00 175.30 174.85 2psy s LYS 60 N -0.17 0.51 0.00 5.12 2.47 -1.26 -5.09 119.74 121.32 2psy s LYS 60 Ca 0.60 0.10 -0.24 0.00 -1.56 0.00 0.00 55.97 54.87 2psy s LYS 60 Cb -0.42 0.23 -0.15 0.00 -1.46 0.00 0.00 37.83 36.04 2psy s LYS 60 CO 0.41 -0.11 1.08 0.87 0.16 0.00 0.00 175.35 177.77 2psy h LYS 61 N 4.76 -0.61 -5.32 4.03 1.79 -2.01 -3.44 116.57 115.77 2psy h LYS 61 Ca -0.28 0.04 -0.63 0.00 -2.18 0.00 0.00 60.65 57.60 2psy h LYS 61 Cb 1.18 0.14 -0.20 0.00 -1.58 0.00 0.00 32.23 31.77 2psy h LYS 61 CO 0.35 -0.31 -0.65 0.08 -1.08 0.00 0.00 179.45 177.85 2psy s VAL 62 N -4.43 4.06 -0.01 0.50 1.01 -1.26 -5.04 120.40 115.23 2psy s VAL 62 Ca -0.13 -0.30 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 2psy s VAL 62 Cb 0.02 -2.79 0.11 0.00 0.00 0.00 0.00 36.38 33.72 2psy s VAL 62 CO 0.45 0.49 1.22 0.72 0.00 0.00 0.00 175.10 177.98 2psy s PHE 63 N 0.32 -0.07 0.18 5.22 -0.12 -1.26 -4.78 117.98 117.47 2psy s PHE 63 Ca -0.03 -0.05 0.09 0.00 -0.05 0.00 0.00 56.93 56.89 2psy s PHE 63 Cb -0.14 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.77 2psy s PHE 63 CO 0.02 -0.35 -0.18 1.03 -0.05 0.00 0.00 175.22 175.69 2psy s ARG 64 N -2.57 1.32 -0.15 1.99 0.52 0.27 -4.26 118.95 116.07 2psy s ARG 64 Ca 0.13 -1.46 -0.01 0.00 -0.52 0.00 0.00 55.73 53.87 2psy s ARG 64 Cb 0.03 -1.36 -0.01 0.00 0.52 0.00 0.00 34.95 34.13 2psy s ARG 64 CO -0.03 0.27 -0.12 0.08 0.02 0.00 0.00 175.30 175.52 2psy s VAL 65 N -2.18 3.03 -0.15 3.52 1.01 -0.66 -0.67 120.40 124.30 2psy s VAL 65 Ca 0.18 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2psy s VAL 65 Cb -0.05 -2.30 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 2psy s VAL 65 CO 0.07 0.51 -0.17 -0.60 0.00 0.00 0.00 175.10 174.91 2psy s ARG 66 N 0.64 3.18 0.26 2.72 3.52 -0.45 -0.52 118.95 128.31 2psy s ARG 66 Ca -0.07 -0.77 0.10 0.00 -0.13 0.00 0.00 55.73 54.87 2psy s ARG 66 Cb -0.15 -2.58 -0.05 0.00 -1.56 0.00 0.00 34.95 30.60 2psy s ARG 66 CO 0.03 0.03 -0.17 -0.51 -0.81 0.00 0.00 175.30 173.86 2psy s LEU 67 N 0.78 2.58 -1.39 -0.88 1.43 -0.40 -1.92 118.68 118.88 2psy s LEU 67 Ca -0.06 -1.04 -0.05 0.00 -1.03 0.00 0.00 54.13 51.95 2psy s LEU 67 Cb -0.15 -0.93 0.03 0.00 0.03 0.00 0.00 46.19 45.16 2psy s LEU 67 CO 0.00 -0.06 0.79 0.61 0.23 0.00 0.00 176.35 177.93 2psy n GLY 69 N -0.55 -0.36 2.72 -3.19 0.00 -1.26 -1.59 105.19 100.97 2psy n GLY 69 Ca -0.06 0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 2psy n GLY 69 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2psy s HIS 70 N -3.55 0.63 0.03 1.61 5.04 -1.26 -1.70 115.29 116.08 2psy s HIS 70 Ca 0.23 -0.35 -0.19 0.00 -1.54 0.00 0.00 55.06 53.21 2psy s HIS 70 Cb -0.11 -0.82 -0.21 0.00 0.04 0.00 0.00 32.58 31.48 2psy s HIS 70 CO 0.82 -0.43 1.16 -0.92 -2.34 0.00 0.00 174.74 173.04 2psy h TYR 71 N 8.33 0.67 -3.93 3.88 3.20 -1.96 -3.47 116.97 123.69 2psy h TYR 71 Ca -0.17 -0.33 -0.49 0.00 3.14 0.00 0.00 58.73 60.88 2psy h TYR 71 Cb 1.13 -0.09 0.06 0.00 1.54 0.00 0.00 36.73 39.36 2psy h TYR 71 CO 0.37 1.13 0.25 -1.54 -1.64 0.00 0.00 178.16 176.73 2psy s SER 72 N -6.73 5.85 -0.09 -2.11 1.04 -1.26 -0.96 113.70 109.45 2psy s SER 72 Ca -0.13 0.98 -0.22 0.00 0.48 0.00 0.00 55.95 57.07 2psy s SER 72 Cb 0.05 -2.03 -0.18 0.00 0.10 0.00 0.00 66.02 63.95 2psy s SER 72 CO 0.83 -0.96 0.75 0.25 0.98 0.00 0.00 173.24 175.09 2psy h LEU 73 N -0.20 -0.06-10.26 2.42 6.46 -1.22 -3.46 115.31 108.99 2psy h LEU 73 Ca -0.45 -0.58 -0.52 0.00 -0.12 0.00 0.00 57.88 56.20 2psy h LEU 73 Cb 1.23 0.02 0.17 0.00 -0.73 0.00 0.00 40.66 41.34 2psy h LEU 73 CO 0.62 0.66 0.29 -0.44 -0.62 0.00 0.00 178.44 178.95 2psy s SER 74 N -5.81 3.73 0.00 1.25 0.01 -1.26 -4.85 113.70 106.76 2psy s SER 74 Ca -0.14 2.12 0.00 0.00 1.31 0.00 0.00 55.95 59.24 2psy s SER 74 Cb -0.01 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2psy s SER 74 CO 0.52 -2.56 0.39 -0.81 0.41 0.00 0.00 173.24 171.19 2psy n PRO 74 N -3.63 0.54 -1.68 12.44 -0.04 -1.26 -4.86 135.00 136.50 2psy n PRO 74 Ca 0.11 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 63.12 2psy n PRO 74 Cb 0.52 -1.25 -0.04 0.00 -0.04 0.00 0.00 33.50 32.69 2psy n PRO 74 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2psy n VAL 75 N 0.46 0.22 -1.78 0.52 0.31 -1.26 -4.88 118.33 111.92 2psy n VAL 75 Ca 0.00 -0.04 -0.41 0.00 -0.01 0.00 0.00 64.34 63.88 2psy n VAL 75 Cb 0.20 -1.83 -0.01 0.00 -0.91 0.00 0.00 33.84 31.28 2psy n VAL 75 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2psy s TYR 76 N 2.11 2.66 0.02 3.52 6.14 -1.26 -4.95 117.35 125.59 2psy s TYR 76 Ca 0.82 0.95 0.03 0.00 0.64 0.00 0.00 57.07 59.51 2psy s TYR 76 Cb -0.60 -4.06 -0.02 0.00 0.42 0.00 0.00 41.96 37.71 2psy s TYR 76 CO 0.40 -3.35 -0.08 -1.21 0.64 0.00 0.00 175.55 171.94 2psy s GLU 77 N -1.24 0.60 0.18 4.97 2.02 -1.26 -5.06 118.70 118.91 2psy s GLU 77 Ca 0.59 -0.53 -0.12 0.00 0.02 0.00 0.00 54.97 54.93 2psy s GLU 77 Cb -0.47 -0.52 0.09 0.00 0.10 0.00 0.00 34.13 33.33 2psy s GLU 77 CO 0.55 0.13 1.76 0.66 0.02 0.00 0.00 175.26 178.38 2psy h SER 78 N 5.23 0.81 0.58 -0.19 4.64 -1.95 -2.77 113.55 119.90 2psy h SER 78 Ca -0.33 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2psy h SER 78 Cb 1.19 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2psy h SER 78 CO 0.45 0.71 0.00 0.61 -0.87 0.00 0.00 176.83 177.74 2psy n GLY 79 N -0.94 -1.09 3.65 -0.77 0.00 -1.26 -4.87 105.19 99.91 2psy n GLY 79 Ca 0.04 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2psy n GLY 79 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2psy n GLN 80 N -1.66 1.42 -3.57 1.61 7.27 -0.69 -4.48 117.38 117.28 2psy n GLN 80 Ca 0.03 0.52 -0.11 0.00 0.07 0.00 0.00 57.00 57.51 2psy n GLN 80 Cb 0.19 -2.21 -0.10 0.00 2.41 0.00 0.00 30.24 30.53 2psy n GLN 80 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2psy s GLN 81 N -2.32 0.27 0.07 3.69 -0.21 -0.62 -4.98 119.66 115.56 2psy s GLN 81 Ca 0.66 0.78 -0.04 0.00 0.02 0.00 0.00 55.36 56.78 2psy s GLN 81 Cb -0.50 -0.06 -0.05 0.00 1.00 0.00 0.00 33.01 33.40 2psy s GLN 81 CO 0.54 -0.38 0.29 -1.64 -2.12 0.00 0.00 175.29 171.98 2psy s MET 82 N 2.53 3.55 0.28 2.91 -1.94 -1.26 -1.27 119.30 124.10 2psy s MET 82 Ca 0.03 -0.18 -0.01 0.00 -1.71 0.00 0.00 55.69 53.82 2psy s MET 82 Cb -0.13 -2.99 -0.02 0.00 2.01 0.00 0.00 34.83 33.70 2psy s MET 82 CO -0.12 0.58 0.32 -0.06 -0.01 0.00 0.00 175.02 175.73 2psy s PHE 83 N -1.47 1.15 -0.02 -0.03 0.40 0.33 -4.99 117.98 113.35 2psy s PHE 83 Ca 0.34 -1.32 0.05 0.00 -0.60 0.00 0.00 56.93 55.40 2psy s PHE 83 Cb -0.13 -0.34 -0.01 0.00 0.51 0.00 0.00 43.02 43.05 2psy s PHE 83 CO 0.22 -0.90 -0.18 -0.65 0.70 0.00 0.00 175.22 174.41 2psy s GLN 84 N -3.64 1.55 -0.35 0.44 -1.52 -1.26 -1.66 119.66 113.22 2psy s GLN 84 Ca 0.34 -0.64 -0.23 0.00 -1.95 0.00 0.00 55.36 52.88 2psy s GLN 84 Cb 0.02 -1.45 0.01 0.00 -0.22 0.00 0.00 33.01 31.37 2psy s GLN 84 CO 0.18 0.36 0.79 0.20 -0.25 0.00 0.00 175.29 176.56 2psy s GLY 85 N -0.32 1.67 0.08 3.09 0.00 -1.26 -0.66 107.32 109.91 2psy s GLY 85 Ca 0.04 -0.59 0.15 0.00 0.00 0.00 0.00 44.72 44.32 2psy s GLY 85 CO -0.00 1.76 0.92 -0.39 0.00 0.00 0.00 173.10 175.39 2psy h VAL 86 N 5.72 0.70 -2.95 1.40 -1.51 -0.90 -3.47 116.25 115.24 2psy h VAL 86 Ca -0.25 -2.26 -0.17 0.00 -1.23 0.00 0.00 66.70 62.79 2psy h VAL 86 Cb 1.09 2.22 -0.28 0.00 -2.13 0.00 0.00 31.29 32.19 2psy h VAL 86 CO 0.91 0.40 -0.43 -0.75 -1.23 0.00 0.00 177.57 176.47 2psy s LYS 87 N -2.85 0.27 -0.20 5.19 2.20 -1.22 -4.97 119.74 118.16 2psy s LYS 87 Ca -0.02 0.56 -0.01 0.00 -0.36 0.00 0.00 55.97 56.14 2psy s LYS 87 Cb 0.08 -0.05 0.01 0.00 -1.51 0.00 0.00 37.83 36.36 2psy s LYS 87 CO 0.80 -0.14 -0.13 -1.12 -0.36 0.00 0.00 175.35 174.41 2psy s SER 88 N 1.09 3.70 -0.34 1.43 0.01 -1.26 -0.30 113.70 118.03 2psy s SER 88 Ca -0.08 -0.52 0.02 0.00 1.31 0.00 0.00 55.95 56.69 2psy s SER 88 Cb -0.08 -1.60 0.10 0.00 0.21 0.00 0.00 66.02 64.65 2psy s SER 88 CO -0.08 -0.00 0.09 -0.63 0.41 0.00 0.00 173.24 173.03 2psy s ILE 89 N 1.33 1.73 0.47 1.44 1.01 0.11 -4.98 121.20 122.31 2psy s ILE 89 Ca 0.04 -2.05 -0.19 0.00 0.00 0.00 0.00 60.65 58.45 2psy s ILE 89 Cb -0.14 -2.28 -0.10 0.00 0.01 0.00 0.00 42.46 39.95 2psy s ILE 89 CO -0.08 -0.65 0.97 -2.16 0.00 0.00 0.00 174.94 173.02 2psy s PRO 90 N 1.08 4.10 0.33 2.79 0.04 -1.26 -0.70 135.00 141.39 2psy s PRO 90 Ca 0.11 1.06 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 2psy s PRO 90 Cb -0.19 -2.16 -0.11 0.00 0.04 0.00 0.00 34.50 32.08 2psy s PRO 90 CO -0.14 -0.14 1.55 1.58 0.04 0.00 0.00 177.00 179.89 2psy n HIS 91 N -1.04 2.93 0.23 0.56 -0.00 -0.57 -4.85 115.22 112.47 2psy n HIS 91 Ca 0.07 0.34 0.15 0.00 0.46 0.00 0.00 57.72 58.74 2psy n HIS 91 Cb 0.54 -2.57 0.81 0.00 -0.12 0.00 0.00 29.99 28.65 2psy n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2psy h PRO 92 N 3.96 0.00 -0.00 1.57 0.11 -1.92 -2.17 132.00 133.55 2psy h PRO 92 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2psy h PRO 92 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2psy h PRO 92 CO 0.72 0.00 -0.04 0.41 -0.21 0.00 0.00 178.00 178.88 2psy n GLY 93 N -1.42 -0.97 3.75 -0.55 0.00 -1.26 -4.89 105.19 99.84 2psy n GLY 93 Ca -0.00 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 2psy n GLY 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2psy s TYR 94 N -2.33 2.89 0.05 1.61 5.04 -0.82 -4.64 117.35 119.15 2psy s TYR 94 Ca 0.35 0.87 -0.18 0.00 -2.44 0.00 0.00 57.07 55.67 2psy s TYR 94 Cb 0.21 -3.95 0.04 0.00 0.35 0.00 0.00 41.96 38.60 2psy s TYR 94 CO 0.43 -3.18 0.41 0.45 -1.34 0.00 0.00 175.55 172.32 2psy s SER 95 N 0.48 -0.28 -0.04 4.32 0.15 -1.25 -5.01 113.70 112.08 2psy s SER 95 Ca 0.62 -0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.26 2psy s SER 95 Cb -0.45 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.26 2psy s SER 95 CO 0.45 -0.68 -0.03 -2.28 1.20 0.00 0.00 173.24 171.90 2psy s HIS 96 N -2.57 3.03 -2.14 3.44 2.46 -1.26 0.64 115.29 118.89 2psy s HIS 96 Ca -0.05 0.07 0.19 0.00 0.47 0.00 0.00 55.06 55.75 2psy s HIS 96 Cb -0.01 -1.70 0.52 0.00 -0.13 0.00 0.00 32.58 31.27 2psy s HIS 96 CO -0.03 0.42 1.44 -0.35 -2.47 0.00 0.00 174.74 173.74 2psy n PRO 97 N 1.79 2.28 -0.07 2.88 -0.05 -1.26 -4.87 135.00 135.70 2psy n PRO 97 Ca -0.16 -1.98 -0.11 0.00 -0.05 0.00 0.00 63.50 61.20 2psy n PRO 97 Cb 0.53 -1.45 -0.04 0.00 -0.05 0.00 0.00 33.50 32.48 2psy n PRO 97 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 175.50 176.23 2psy h GLY 98 N 4.74 0.40 -0.60 0.55 0.00 -1.97 -3.47 103.07 102.72 2psy h GLY 98 Ca 0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 2psy h GLY 98 CO 0.00 0.24 -0.14 1.42 0.00 0.00 0.00 176.54 178.06 2psy n HIS 99 N -4.73 -0.15 -1.54 5.60 8.25 0.21 -4.96 115.22 117.90 2psy n HIS 99 Ca -0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.12 2psy n HIS 99 Cb 0.18 -1.66 0.06 0.00 1.12 0.00 0.00 29.99 29.68 2psy n HIS 99 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2psy s SER 100 N -2.82 5.15 -1.33 0.41 0.01 -1.26 -3.79 113.70 110.07 2psy s SER 100 Ca 0.00 1.59 -0.00 0.00 1.31 0.00 0.00 55.95 58.85 2psy s SER 100 Cb 0.00 -2.43 -0.00 0.00 0.21 0.00 0.00 66.02 63.80 2psy s SER 100 CO 0.00 -1.59 0.62 0.59 0.41 0.00 0.00 173.24 173.27 2psy n ASN 101 N -3.22 -0.99 -3.76 2.44 4.13 -1.26 -3.74 115.26 108.86 2psy n ASN 101 Ca 0.08 -0.88 -0.42 0.00 1.68 0.00 0.00 54.58 55.04 2psy n ASN 101 Cb 0.54 -3.77 0.00 0.00 -1.54 0.00 0.00 39.78 35.01 2psy n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2psy n ASP 102 N -3.03 4.93 -3.84 6.41 2.03 -1.25 -4.05 116.55 117.75 2psy n ASP 102 Ca -0.30 -2.98 -0.10 0.00 0.52 0.00 0.00 54.79 51.93 2psy n ASP 102 Cb 0.68 -1.55 -0.08 0.00 -0.72 0.00 0.00 41.12 39.45 2psy n ASP 102 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2psy s LEU 103 N 0.68 1.34 -0.14 -2.67 2.34 -1.26 -3.99 118.68 114.98 2psy s LEU 103 Ca 0.45 -0.41 -0.19 0.00 0.06 0.00 0.00 54.13 54.04 2psy s LEU 103 Cb 0.12 1.00 0.05 0.00 -0.56 0.00 0.00 46.19 46.80 2psy s LEU 103 CO -0.04 -0.60 0.50 -0.32 -1.06 0.00 0.00 176.35 174.83 2psy s MET 104 N -2.82 0.67 -0.06 1.48 1.75 0.17 -1.52 119.30 118.97 2psy s MET 104 Ca -0.03 0.50 -0.12 0.00 -1.25 0.00 0.00 55.69 54.79 2psy s MET 104 Cb 0.00 0.32 -0.05 0.00 2.84 0.00 0.00 34.83 37.94 2psy s MET 104 CO -0.05 -0.12 0.31 -0.51 -0.65 0.00 0.00 175.02 173.99 2psy s LEU 105 N -0.18 4.42 -0.09 4.11 1.43 0.12 -1.34 118.68 127.16 2psy s LEU 105 Ca -0.04 0.75 0.02 0.00 -1.03 0.00 0.00 54.13 53.83 2psy s LEU 105 Cb -0.03 -2.40 0.01 0.00 0.03 0.00 0.00 46.19 43.80 2psy s LEU 105 CO 0.02 0.32 -0.13 -0.63 0.23 0.00 0.00 176.35 176.17 2psy s ILE 106 N -0.87 1.26 -0.15 -0.59 1.01 -0.33 0.07 121.20 121.60 2psy s ILE 106 Ca 0.20 -0.52 -0.15 0.00 0.00 0.00 0.00 60.65 60.18 2psy s ILE 106 Cb -0.15 -1.17 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 2psy s ILE 106 CO 0.09 0.39 0.34 -0.75 0.00 0.00 0.00 174.94 175.01 2psy s LYS 107 N 0.91 4.28 0.53 2.79 2.20 0.59 -0.65 119.74 130.39 2psy s LYS 107 Ca -0.09 0.19 -0.15 0.00 -0.36 0.00 0.00 55.97 55.55 2psy s LYS 107 Cb -0.15 -3.43 -0.07 0.00 -1.51 0.00 0.00 37.83 32.67 2psy s LYS 107 CO 0.00 0.22 0.99 -0.51 -0.36 0.00 0.00 175.35 175.69 2psy s LEU 108 N 0.51 3.56 0.45 5.43 1.43 -0.52 -0.27 118.68 129.26 2psy s LEU 108 Ca 0.19 1.52 0.20 0.00 -1.03 0.00 0.00 54.13 55.01 2psy s LEU 108 Cb -0.13 -4.48 1.08 0.00 0.03 0.00 0.00 46.19 42.68 2psy s LEU 108 CO 0.05 -0.63 1.95 -0.55 0.23 0.00 0.00 176.35 177.40 2psy h ASN 109 N 0.69 0.00 -5.23 2.29 -1.07 -1.24 -3.43 115.58 107.59 2psy h ASN 109 Ca -0.46 0.00 -0.10 0.00 0.07 0.00 0.00 56.30 55.81 2psy h ASN 109 Cb 1.19 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 37.31 2psy h ASN 109 CO 0.62 0.23 -0.34 0.00 0.07 0.00 0.00 177.43 178.01 2psy s ARG 110 N -4.20 1.06 0.56 4.14 1.70 -1.26 -5.05 118.95 115.90 2psy s ARG 110 Ca -0.03 -1.11 -0.18 0.00 -0.47 0.00 0.00 55.73 53.95 2psy s ARG 110 Cb 0.14 0.37 -0.05 0.00 -0.57 0.00 0.00 34.95 34.83 2psy s ARG 110 CO 0.65 -0.38 1.07 1.03 -1.08 0.00 0.00 175.30 176.60 2psy s ARG 111 N -3.94 3.41 0.55 3.89 0.52 -1.26 -4.79 118.95 117.33 2psy s ARG 111 Ca 0.14 1.36 -0.18 0.00 -0.52 0.00 0.00 55.73 56.52 2psy s ARG 111 Cb 0.04 -2.04 -0.06 0.00 0.52 0.00 0.00 34.95 33.42 2psy s ARG 111 CO -0.03 -0.75 1.08 0.96 0.02 0.00 0.00 175.30 176.57 2psy s ILE 112 N -2.15 3.53 -0.55 1.52 -5.25 0.40 -4.99 121.20 113.72 2psy s ILE 112 Ca 0.67 0.87 -0.19 0.00 -0.99 0.00 0.00 60.65 61.01 2psy s ILE 112 Cb -0.18 -3.34 0.07 0.00 2.95 0.00 0.00 42.46 41.96 2psy s ILE 112 CO 0.30 -0.28 0.68 -0.60 -1.79 0.00 0.00 174.94 173.25 2psy s ARG 113 N -3.53 3.10 0.20 0.37 3.52 -1.26 -5.01 118.95 116.33 2psy s ARG 113 Ca 0.68 -1.02 -0.33 0.00 -0.13 0.00 0.00 55.73 54.93 2psy s ARG 113 Cb -0.19 -4.16 -0.14 0.00 -1.56 0.00 0.00 34.95 28.90 2psy s ARG 113 CO 0.28 -1.38 1.51 -0.35 -0.81 0.00 0.00 175.30 174.56 2psy n PRO 114 N 6.35 2.12 -3.94 5.12 -0.04 -1.26 -4.78 135.00 138.56 2psy n PRO 114 Ca -0.07 0.76 -0.11 0.00 -0.04 0.00 0.00 63.50 64.03 2psy n PRO 114 Cb 0.44 -2.48 -0.01 0.00 -0.04 0.00 0.00 33.50 31.41 2psy n PRO 114 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2psy s THR 115 N 0.49 0.00 -0.08 0.52 -4.23 -0.83 -4.98 115.64 106.52 2psy s THR 115 Ca 0.74 -1.29 0.30 0.00 -1.18 0.00 0.00 61.69 60.26 2psy s THR 115 Cb -0.66 -2.72 0.32 0.00 1.34 0.00 0.00 72.50 70.78 2psy s THR 115 CO 0.43 0.00 1.89 0.07 -0.54 0.00 0.00 174.62 176.47 2psy h LYS 116 N 2.06 0.00 0.11 3.99 -0.00 -1.99 -3.08 116.57 117.66 2psy h LYS 116 Ca -0.30 0.00 -0.37 0.00 -0.00 0.00 0.00 60.65 59.99 2psy h LYS 116 Cb 1.25 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.45 2psy h LYS 116 CO 0.39 0.00 -2.03 -0.25 -0.00 0.00 0.00 179.45 177.56 2psy n ASP 117 N -2.66 2.11 -4.17 7.07 8.00 -1.26 -4.76 116.55 120.89 2psy n ASP 117 Ca 0.00 0.19 -0.34 0.00 0.71 0.00 0.00 54.79 55.35 2psy n ASP 117 Cb 0.21 -0.83 -0.15 0.00 -0.02 0.00 0.00 41.12 40.33 2psy n ASP 117 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2psy s VAL 118 N -2.55 2.60 -0.20 2.53 1.01 -1.16 -4.15 120.40 118.47 2psy s VAL 118 Ca -0.24 -1.08 -0.13 0.00 0.00 0.00 0.00 61.98 60.53 2psy s VAL 118 Cb 0.07 -2.30 0.06 0.00 0.00 0.00 0.00 36.38 34.21 2psy s VAL 118 CO 0.75 0.24 0.50 -0.60 0.00 0.00 0.00 175.10 176.00 2psy s ARG 119 N 1.29 0.52 0.85 2.72 3.52 -0.56 -1.97 118.95 125.31 2psy s ARG 119 Ca -0.00 0.88 -0.11 0.00 -0.13 0.00 0.00 55.73 56.36 2psy s ARG 119 Cb -0.16 0.09 0.10 0.00 -1.56 0.00 0.00 34.95 33.42 2psy s ARG 119 CO -0.06 -0.13 1.09 -1.25 -0.81 0.00 0.00 175.30 174.13 2psy s PRO 120 N 1.18 1.65 0.04 5.12 0.04 -1.26 -2.75 135.00 139.02 2psy s PRO 120 Ca -0.07 0.81 0.05 0.00 0.04 0.00 0.00 61.00 61.82 2psy s PRO 120 Cb -0.06 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 2psy s PRO 120 CO -0.11 -1.96 -0.13 -1.50 0.04 0.00 0.00 177.00 173.33 2psy s ILE 121 N -3.00 1.05 0.44 0.56 2.07 -0.35 -4.90 121.20 117.07 2psy s ILE 121 Ca 0.62 -1.04 -0.21 0.00 -1.41 0.00 0.00 60.65 58.61 2psy s ILE 121 Cb -0.17 -0.98 -0.11 0.00 0.13 0.00 0.00 42.46 41.34 2psy s ILE 121 CO 0.56 -0.06 0.96 0.20 -1.91 0.00 0.00 174.94 174.69 2psy s ASN 122 N -1.26 6.87 -0.23 4.50 -0.87 -1.26 -4.40 114.94 118.29 2psy s ASN 122 Ca 0.00 1.70 -0.14 0.00 -1.57 0.00 0.00 52.86 52.86 2psy s ASN 122 Cb -0.08 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.56 2psy s ASN 122 CO 0.01 -0.41 0.30 -0.69 -2.57 0.00 0.00 177.10 173.75 2psy s VAL 123 N -2.19 5.26 0.45 1.60 1.01 -1.26 -0.62 120.40 124.64 2psy s VAL 123 Ca 0.62 0.47 -0.24 0.00 0.00 0.00 0.00 61.98 62.83 2psy s VAL 123 Cb -0.10 -3.63 -0.08 0.00 0.00 0.00 0.00 36.38 32.58 2psy s VAL 123 CO 0.15 0.26 1.19 -0.94 0.00 0.00 0.00 175.10 175.76 2psy s SER 124 N 1.21 6.20 -0.02 3.32 1.04 -0.94 -4.88 113.70 119.64 2psy s SER 124 Ca 0.14 2.37 0.21 0.00 0.48 0.00 0.00 55.95 59.15 2psy s SER 124 Cb -0.15 -2.61 -0.28 0.00 0.10 0.00 0.00 66.02 63.08 2psy s SER 124 CO 0.07 -0.90 0.65 -1.54 0.98 0.00 0.00 173.24 172.50 2psy n SER 125 N -0.34 0.50 -4.66 7.02 3.41 -1.26 -3.91 113.62 114.38 2psy n SER 125 Ca 0.06 -0.43 -0.41 0.00 -0.26 0.00 0.00 58.87 57.84 2psy n SER 125 Cb 0.47 1.55 -0.05 0.00 -0.26 0.00 0.00 64.21 65.91 2psy n SER 125 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2psy s HIS 128 N -3.25 3.37 0.48 7.33 3.76 -1.26 -4.80 115.29 120.92 2psy s HIS 128 Ca -0.01 1.00 -0.22 0.00 -0.15 0.00 0.00 55.06 55.68 2psy s HIS 128 Cb 0.14 -2.87 -0.07 0.00 1.11 0.00 0.00 32.58 30.90 2psy s HIS 128 CO 0.87 -0.22 1.14 0.00 -0.85 0.00 0.00 174.74 175.68 2psy s PRO 130 N -2.84 4.43 0.23 0.00 0.04 -1.26 -5.04 135.00 130.56 2psy s PRO 130 Ca 0.65 2.01 0.06 0.00 0.04 0.00 0.00 61.00 63.76 2psy s PRO 130 Cb -0.26 -3.19 -0.03 0.00 0.04 0.00 0.00 34.50 31.05 2psy s PRO 130 CO 0.32 -0.17 0.22 -1.54 0.04 0.00 0.00 177.00 175.87 2psy s SER 131 N 0.12 5.71 0.16 6.66 1.04 -1.26 -5.03 113.70 121.09 2psy s SER 131 Ca 0.54 -0.16 -0.34 0.00 0.48 0.00 0.00 55.95 56.48 2psy s SER 131 Cb -0.35 -1.52 -0.14 0.00 0.10 0.00 0.00 66.02 64.10 2psy s SER 131 CO 0.39 -0.03 1.48 0.00 0.98 0.00 0.00 173.24 176.07 2psy n ALA 132 N -1.08 0.78 0.00 5.32 0.00 -1.26 -2.17 120.51 122.11 2psy n ALA 132 Ca -0.08 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.81 2psy n ALA 132 Cb 0.57 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2psy n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2psy n GLY 133 N 2.94 3.11 3.69 0.00 0.00 0.12 -4.99 105.19 110.06 2psy n GLY 133 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2psy n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2psy s THR 134 N -2.73 2.63 -0.03 2.61 2.01 -0.92 -4.68 115.64 114.53 2psy s THR 134 Ca 0.00 0.17 -0.25 0.00 0.31 0.00 0.00 61.69 61.92 2psy s THR 134 Cb 0.00 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.36 2psy s THR 134 CO 0.00 0.00 0.78 -0.75 -0.69 0.00 0.00 174.62 173.96 2psy s LYS 135 N 2.54 4.48 0.14 4.92 2.20 -1.26 -0.95 119.74 131.80 2psy s LYS 135 Ca 0.78 1.04 0.05 0.00 -0.36 0.00 0.00 55.97 57.48 2psy s LYS 135 Cb -0.45 -3.43 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2psy s LYS 135 CO 0.35 0.08 -0.11 0.00 -0.36 0.00 0.00 175.35 175.31 2psy s LEU 137 N -2.96 2.71 -0.06 0.00 0.20 0.13 0.63 118.68 119.32 2psy s LEU 137 Ca 0.14 -0.37 0.04 0.00 0.69 0.00 0.00 54.13 54.64 2psy s LEU 137 Cb 0.00 -1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 44.11 2psy s LEU 137 CO 0.02 0.11 -0.17 0.54 -0.29 0.00 0.00 176.35 176.55 2psy s VAL 138 N 0.68 2.76 0.15 1.68 0.11 0.62 0.06 120.40 126.45 2psy s VAL 138 Ca -0.06 -0.82 0.05 0.00 -2.93 0.00 0.00 61.98 58.22 2psy s VAL 138 Cb -0.15 -2.07 -0.04 0.00 -1.53 0.00 0.00 36.38 32.58 2psy s VAL 138 CO 0.02 0.57 -0.11 -0.94 -3.33 0.00 0.00 175.10 171.31 2psy s SER 139 N -0.40 1.94 0.00 3.54 1.04 -1.14 -1.12 113.70 117.56 2psy s SER 139 Ca 0.04 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2psy s SER 139 Cb -0.12 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2psy s SER 139 CO 0.02 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2psy n GLY 140 N -0.08 0.67 0.84 7.32 0.00 -0.42 -4.35 105.19 109.16 2psy n GLY 140 Ca -0.11 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 45.01 2psy n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2psy n TRP 141 N -0.39 0.75 -0.57 1.61 8.01 -1.26 -1.31 117.44 124.27 2psy n TRP 141 Ca 0.00 -0.64 -0.30 0.00 -1.31 0.00 0.00 57.50 55.25 2psy n TRP 141 Cb 0.00 -0.15 0.27 0.00 -2.01 0.00 0.00 31.31 29.42 2psy n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2psy s GLY 142 N -1.30 1.47 0.51 6.99 0.00 -1.24 -4.51 107.32 109.23 2psy s GLY 142 Ca 0.33 -0.70 -0.23 0.00 0.00 0.00 0.00 44.72 44.13 2psy s GLY 142 CO 0.15 0.22 1.31 -1.08 0.00 0.00 0.00 173.10 173.70 2psy s THR 143 N -2.47 2.39 -2.58 0.90 -1.32 -0.63 -3.57 115.64 108.37 2psy s THR 143 Ca 0.69 0.30 0.23 0.00 -1.21 0.00 0.00 61.69 61.70 2psy s THR 143 Cb -0.15 -3.15 0.38 0.00 -1.51 0.00 0.00 72.50 68.07 2psy s THR 143 CO 0.59 0.00 1.41 0.35 -2.21 0.00 0.00 174.62 174.76 2psy n THR 144 N -0.76 0.31 -4.08 5.08 -2.24 0.95 -1.85 114.28 111.69 2psy n THR 144 Ca 0.09 -0.60 -0.09 0.00 -2.27 0.00 0.00 64.05 61.18 2psy n THR 144 Cb 0.46 0.98 -0.10 0.00 -2.10 0.00 0.00 70.33 69.56 2psy n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2psy s LYS 145 N -1.69 0.59 -0.22 -0.78 1.02 -1.26 -4.28 119.74 113.12 2psy s LYS 145 Ca 0.35 -1.04 -0.15 0.00 0.02 0.00 0.00 55.97 55.15 2psy s LYS 145 Cb 0.21 0.00 0.06 0.00 -0.52 0.00 0.00 37.83 37.59 2psy s LYS 145 CO 0.31 -0.05 0.55 0.45 -0.92 0.00 0.00 175.35 175.69 2psy s SER 146 N -2.42 -0.68 0.00 2.83 0.15 -1.26 -4.42 113.70 107.90 2psy s SER 146 Ca 0.01 1.17 0.27 0.00 0.70 0.00 0.00 55.95 58.10 2psy s SER 146 Cb 0.00 1.09 1.17 0.00 -1.71 0.00 0.00 66.02 66.57 2psy s SER 146 CO -0.05 -0.21 1.88 -0.81 1.20 0.00 0.00 173.24 175.25 2psy n PRO 147 N 3.84 0.00 -2.16 5.44 -0.04 -1.26 -4.72 135.00 136.10 2psy n PRO 147 Ca -0.19 0.03 -0.42 0.00 -0.04 0.00 0.00 63.50 62.87 2psy n PRO 147 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 2psy n PRO 147 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2psy s GLN 148 N -3.00 4.28 0.22 0.54 1.11 -1.26 -4.97 119.66 116.58 2psy s GLN 148 Ca 0.13 2.05 -0.30 0.00 0.01 0.00 0.00 55.36 57.26 2psy s GLN 148 Cb 0.18 -3.48 -0.08 0.00 -1.01 0.00 0.00 33.01 28.61 2psy s GLN 148 CO 0.50 -0.56 1.04 0.08 0.01 0.00 0.00 175.29 176.36 2psy s VAL 149 N 2.06 3.86 -0.30 1.09 1.01 -1.26 -4.17 120.40 122.69 2psy s VAL 149 Ca 0.66 1.75 0.01 0.00 0.00 0.00 0.00 61.98 64.39 2psy s VAL 149 Cb -0.34 -4.11 0.19 0.00 0.00 0.00 0.00 36.38 32.12 2psy s VAL 149 CO 0.28 0.37 0.62 -2.28 0.00 0.00 0.00 175.10 174.09 2psy s HIS 150 N -0.77 -1.65 0.26 5.22 5.04 -1.26 -4.94 115.29 117.18 2psy s HIS 150 Ca 0.45 1.45 -0.19 0.00 -1.54 0.00 0.00 55.06 55.23 2psy s HIS 150 Cb -0.29 0.47 -0.09 0.00 0.04 0.00 0.00 32.58 32.71 2psy s HIS 150 CO 0.36 -0.92 0.75 -0.06 -2.34 0.00 0.00 174.74 172.53 2psy s PHE 151 N 2.85 3.58 0.81 3.88 0.40 -1.26 -0.03 117.98 128.21 2psy s PHE 151 Ca 0.17 1.39 -0.11 0.00 -0.60 0.00 0.00 56.93 57.78 2psy s PHE 151 Cb -0.13 -2.63 0.11 0.00 0.51 0.00 0.00 43.02 40.87 2psy s PHE 151 CO -0.22 0.26 1.15 -1.25 0.70 0.00 0.00 175.22 175.86 2psy s PRO 152 N -2.24 1.71 -0.05 0.24 0.04 -1.26 -4.92 135.00 128.51 2psy s PRO 152 Ca 0.47 -0.20 -0.06 0.00 0.04 0.00 0.00 61.00 61.25 2psy s PRO 152 Cb -0.15 -2.02 -0.28 0.00 0.04 0.00 0.00 34.50 32.09 2psy s PRO 152 CO 0.20 -1.67 0.65 -0.22 0.04 0.00 0.00 177.00 176.00 2psy h LYS 153 N -1.02 0.29 -4.89 4.56 1.63 -1.97 -3.43 116.57 111.73 2psy h LYS 153 Ca -0.45 -0.49 -0.35 0.00 -0.85 0.00 0.00 60.65 58.51 2psy h LYS 153 Cb 1.30 0.18 -0.14 0.00 -0.60 0.00 0.00 32.23 32.97 2psy h LYS 153 CO 0.56 1.17 -0.62 0.14 -3.45 0.00 0.00 179.45 177.25 2psy s VAL 154 N -2.59 0.58 0.11 2.00 -7.23 -1.26 -0.74 120.40 111.27 2psy s VAL 154 Ca -0.15 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 57.67 2psy s VAL 154 Cb 0.06 -2.60 -0.16 0.00 0.56 0.00 0.00 36.38 34.24 2psy s VAL 154 CO 0.83 -0.04 1.28 -0.11 -0.31 0.00 0.00 175.10 176.74 2psy n LEU 155 N -0.45 1.57 -4.77 1.32 7.94 -0.13 -4.87 117.00 117.61 2psy n LEU 155 Ca -0.01 1.13 -0.35 0.00 -1.11 0.00 0.00 56.01 55.68 2psy n LEU 155 Cb 0.66 -1.19 -0.08 0.00 0.53 0.00 0.00 43.42 43.34 2psy n LEU 155 CO 0.37 -1.15 -0.25 -1.10 -1.11 0.00 0.00 177.39 174.15 2psy s GLN 156 N 0.20 3.12 0.05 1.96 -1.52 -0.43 -1.29 119.66 121.75 2psy s GLN 156 Ca 0.81 -0.38 0.08 0.00 -1.95 0.00 0.00 55.36 53.92 2psy s GLN 156 Cb -0.93 -2.91 -0.03 0.00 -0.22 0.00 0.00 33.01 28.92 2psy s GLN 156 CO 0.49 0.70 -0.23 0.00 -0.25 0.00 0.00 175.29 175.99 2psy s LEU 158 N -1.30 -0.05 -0.14 0.00 2.96 -0.28 -1.43 118.68 118.44 2psy s LEU 158 Ca 0.09 1.02 -0.12 0.00 -0.22 0.00 0.00 54.13 54.90 2psy s LEU 158 Cb -0.09 1.68 -0.05 0.00 0.50 0.00 0.00 46.19 48.23 2psy s LEU 158 CO 0.02 -0.18 0.25 0.20 -1.32 0.00 0.00 176.35 175.32 2psy s ASN 159 N 0.70 6.43 0.07 3.68 -0.87 -1.26 -0.28 114.94 123.41 2psy s ASN 159 Ca -0.04 0.50 0.03 0.00 -1.57 0.00 0.00 52.86 51.79 2psy s ASN 159 Cb -0.05 -2.16 -0.03 0.00 -0.02 0.00 0.00 41.25 39.00 2psy s ASN 159 CO -0.05 0.19 -0.10 0.27 -2.57 0.00 0.00 177.10 174.84 2psy s ILE 160 N 0.03 0.83 -0.09 0.60 -4.36 0.20 -4.94 121.20 113.47 2psy s ILE 160 Ca 0.16 -1.31 -0.01 0.00 -0.26 0.00 0.00 60.65 59.22 2psy s ILE 160 Cb -0.13 -0.97 -0.03 0.00 1.25 0.00 0.00 42.46 42.58 2psy s ILE 160 CO 0.04 -0.39 -0.03 -0.44 0.24 0.00 0.00 174.94 174.36 2psy s SER 161 N -1.88 4.92 0.08 4.36 0.01 -1.26 0.76 113.70 120.69 2psy s SER 161 Ca -0.03 0.03 -0.31 0.00 1.31 0.00 0.00 55.95 56.95 2psy s SER 161 Cb -0.08 -1.39 -0.07 0.00 0.21 0.00 0.00 66.02 64.69 2psy s SER 161 CO 0.01 0.34 1.36 -0.69 0.41 0.00 0.00 173.24 174.66 2psy s VAL 162 N -0.66 3.52 0.78 3.43 1.01 -0.13 -1.00 120.40 127.35 2psy s VAL 162 Ca 0.10 1.06 -0.05 0.00 0.00 0.00 0.00 61.98 63.09 2psy s VAL 162 Cb -0.12 -3.68 0.14 0.00 0.00 0.00 0.00 36.38 32.72 2psy s VAL 162 CO 0.02 0.07 1.08 -0.76 0.00 0.00 0.00 175.10 175.50 2psy s LEU 163 N 1.35 2.90 0.42 3.92 1.02 -0.85 0.10 118.68 127.56 2psy s LEU 163 Ca 0.63 -0.10 -0.17 0.00 0.02 0.00 0.00 54.13 54.51 2psy s LEU 163 Cb -0.34 -2.21 -0.09 0.00 0.02 0.00 0.00 46.19 43.56 2psy s LEU 163 CO 0.29 -2.05 0.89 -0.94 0.02 0.00 0.00 176.35 174.57 2psy s SER 164 N -4.75 6.78 0.54 2.29 1.04 -1.26 -4.14 113.70 114.21 2psy s SER 164 Ca 0.67 1.51 0.23 0.00 0.48 0.00 0.00 55.95 58.84 2psy s SER 164 Cb -0.06 -2.47 1.50 0.00 0.10 0.00 0.00 66.02 65.09 2psy s SER 164 CO 0.46 -0.39 2.18 -0.61 0.98 0.00 0.00 173.24 175.86 2psy h GLN 165 N 1.67 0.00 0.11 4.02 5.75 -1.96 -1.58 115.11 123.12 2psy h GLN 165 Ca -0.48 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.01 2psy h GLN 165 Cb 1.18 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.73 2psy h GLN 165 CO 0.62 0.03 -0.05 -0.22 -2.65 0.00 0.00 178.83 176.56 2psy h LYS 166 N 0.00 -0.14 -0.79 1.69 3.64 -2.00 -1.58 116.57 117.40 2psy h LYS 166 Ca -0.00 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2psy h LYS 166 Cb 0.06 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 2psy h LYS 166 CO 0.00 0.13 0.40 0.00 -2.27 0.00 0.00 179.45 177.72 2psy h ARG 167 N -0.41 1.12 -0.21 1.90 3.08 -1.86 -1.59 114.38 116.42 2psy h ARG 167 Ca -0.01 -0.15 0.05 0.00 0.07 0.00 0.00 59.98 59.94 2psy h ARG 167 Cb 0.34 -0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.12 2psy h ARG 167 CO 0.02 0.85 -0.16 0.00 -1.07 0.00 0.00 179.97 179.61 2psy h GLU 169 N -0.16 0.40 -0.38 0.00 5.08 -1.02 -2.68 114.58 115.82 2psy h GLU 169 Ca 0.12 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2psy h GLU 169 Cb 0.35 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2psy h GLU 169 CO -0.31 0.54 -0.03 -0.44 -1.00 0.00 0.00 179.01 177.78 2psy h ASP 170 N 0.37 0.69 -0.36 1.42 3.32 -0.32 -1.54 116.42 120.00 2psy h ASP 170 Ca 0.07 -0.33 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 2psy h ASP 170 Cb 0.48 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 2psy h ASP 170 CO 0.03 0.85 0.18 0.00 -1.72 0.00 0.00 179.24 178.58 2psy h ALA 171 N 0.86 1.58 -2.09 3.45 0.00 -0.75 -3.28 119.26 119.03 2psy h ALA 171 Ca 0.10 -0.09 -0.56 0.00 0.00 0.00 0.00 54.91 54.37 2psy h ALA 171 Cb 0.52 -0.16 -0.40 0.00 0.00 0.00 0.00 17.79 17.74 2psy h ALA 171 CO 0.03 0.34 -0.93 0.66 0.00 0.00 0.00 179.25 179.35 2psy n TYR 172 N -4.41 1.49 -1.59 0.00 4.01 -1.03 -5.08 117.16 110.55 2psy n TYR 172 Ca 0.03 -3.84 -0.49 0.00 -0.16 0.00 0.00 57.90 53.43 2psy n TYR 172 Cb 0.12 -0.44 -0.05 0.00 -0.31 0.00 0.00 39.34 38.66 2psy n TYR 172 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2psy n PRO 173 N 0.72 1.28 -1.17 -0.72 -0.04 -0.59 -2.25 135.00 132.22 2psy n PRO 173 Ca 0.26 0.46 -0.06 0.00 -0.04 0.00 0.00 63.50 64.12 2psy n PRO 173 Cb 0.51 -2.03 -0.03 0.00 -0.04 0.00 0.00 33.50 31.91 2psy n PRO 173 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2psy n ARG 174 N 2.14 -1.28 -0.52 0.54 5.12 -1.26 -4.83 116.66 116.56 2psy n ARG 174 Ca 0.16 0.62 0.04 0.00 -1.93 0.00 0.00 57.85 56.74 2psy n ARG 174 Cb 0.23 -4.72 0.06 0.00 -1.16 0.00 0.00 32.46 26.88 2psy n ARG 174 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2psy n GLN 174 N -1.09 0.49 -3.91 5.56 10.64 -0.96 -5.06 117.38 123.06 2psy n GLN 174 Ca -0.06 -1.77 -0.14 0.00 -1.83 0.00 0.00 57.00 53.20 2psy n GLN 174 Cb 0.41 -0.80 -0.15 0.00 -0.86 0.00 0.00 30.24 28.84 2psy n GLN 174 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2psy s ILE 176 N -1.08 0.09 0.34 -0.39 1.01 -1.25 -5.02 121.20 114.89 2psy s ILE 176 Ca 0.17 0.02 0.05 0.00 0.00 0.00 0.00 60.65 60.89 2psy s ILE 176 Cb 0.16 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.48 2psy s ILE 176 CO -0.02 0.06 0.21 1.51 0.00 0.00 0.00 174.94 176.71 2psy s ASP 177 N 0.37 1.83 0.00 3.58 -4.77 -1.26 -4.99 116.67 111.43 2psy s ASP 177 Ca -0.03 -1.69 0.08 0.00 -3.30 0.00 0.00 52.55 47.61 2psy s ASP 177 Cb -0.05 0.51 0.47 0.00 -1.09 0.00 0.00 42.92 42.76 2psy s ASP 177 CO -0.01 -0.99 0.90 0.47 0.70 0.00 0.00 175.17 176.24 2psy n ASP 178 N -1.31 0.00 -0.19 2.11 8.00 -1.26 -1.78 116.55 122.12 2psy n ASP 178 Ca 0.03 -0.32 0.15 0.00 0.71 0.00 0.00 54.79 55.35 2psy n ASP 178 Cb 0.64 0.00 0.66 0.00 -0.02 0.00 0.00 41.12 42.40 2psy n ASP 178 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2psy n THR 179 N -0.94 0.00 -4.23 -3.53 5.66 -1.26 -4.79 114.28 105.19 2psy n THR 179 Ca 0.06 -0.10 -0.13 0.00 -3.05 0.00 0.00 64.05 60.83 2psy n THR 179 Cb 0.03 -0.01 -0.10 0.00 -1.55 0.00 0.00 70.33 68.69 2psy n THR 179 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2psy s MET 180 N -2.23 1.28 0.04 1.09 0.00 -0.73 -0.68 119.30 118.06 2psy s MET 180 Ca 0.36 -1.68 -0.16 0.00 0.00 0.00 0.00 55.69 54.20 2psy s MET 180 Cb 0.21 0.15 0.03 0.00 0.00 0.00 0.00 34.83 35.22 2psy s MET 180 CO 0.41 -0.38 0.37 -0.59 0.00 0.00 0.00 175.02 174.83 2psy s PHE 181 N -4.03 -0.21 0.11 3.16 -0.12 -0.15 -4.68 117.98 112.06 2psy s PHE 181 Ca 0.39 0.16 0.02 0.00 -0.05 0.00 0.00 56.93 57.44 2psy s PHE 181 Cb 0.07 0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.59 2psy s PHE 181 CO 0.13 -0.53 0.22 0.00 -0.05 0.00 0.00 175.22 174.99 2psy s ALA 183 N -1.62 -1.73 0.00 0.00 0.00 -0.79 -2.00 121.76 115.63 2psy s ALA 183 Ca 0.34 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.81 2psy s ALA 183 Cb -0.12 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.62 2psy s ALA 183 CO 0.27 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.09 2psy n GLY 184 N 1.53 0.78 0.11 0.00 0.00 -0.17 -2.03 105.19 105.40 2psy n GLY 184 Ca -0.17 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 2psy n GLY 184 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2psy h ASP 185 N 0.00 0.16 -2.48 1.61 3.45 -1.89 -3.39 116.42 113.87 2psy h ASP 185 Ca 0.00 -0.72 -0.53 0.00 0.43 0.00 0.00 57.03 56.21 2psy h ASP 185 Cb 0.00 -0.05 0.04 0.00 -0.56 0.00 0.00 39.33 38.76 2psy h ASP 185 CO 0.00 1.51 1.15 -0.54 -1.57 0.00 0.00 179.24 179.79 2psy s LYS 186 N -2.40 4.13 0.58 3.56 -0.14 -1.26 -4.75 119.74 119.46 2psy s LYS 186 Ca -0.24 2.63 -0.18 0.00 -1.36 0.00 0.00 55.97 56.81 2psy s LYS 186 Cb 0.04 -3.71 -0.04 0.00 -1.68 0.00 0.00 37.83 32.44 2psy s LYS 186 CO 0.67 -0.88 1.12 0.00 -0.76 0.00 0.00 175.35 175.51 2psy s ALA 186 N 3.11 2.63 0.00 5.17 0.00 -1.26 -3.04 121.76 128.37 2psy s ALA 186 Ca 0.83 0.73 0.00 0.00 0.00 0.00 0.00 51.96 53.52 2psy s ALA 186 Cb -0.46 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2psy s ALA 186 CO 0.38 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.64 2psy n GLY 187 N -0.08 1.73 3.10 0.00 0.00 -1.24 -5.00 105.19 103.71 2psy n GLY 187 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2psy n GLY 187 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2psy s ARG 188 N -0.21 2.55 0.03 1.61 0.52 -1.17 -4.08 118.95 118.19 2psy s ARG 188 Ca 0.00 -0.68 -0.29 0.00 -0.52 0.00 0.00 55.73 54.24 2psy s ARG 188 Cb 0.00 -2.11 0.10 0.00 0.52 0.00 0.00 34.95 33.46 2psy s ARG 188 CO 0.00 -0.04 1.13 0.34 0.02 0.00 0.00 175.30 176.75 2psy s ASP 189 N 0.91 -0.13 0.68 0.23 2.15 -1.13 -4.81 116.67 114.57 2psy s ASP 189 Ca -0.07 -0.21 -0.03 0.00 0.43 0.00 0.00 52.55 52.67 2psy s ASP 189 Cb -0.15 0.29 0.08 0.00 -0.30 0.00 0.00 42.92 42.84 2psy s ASP 189 CO -0.02 -0.53 0.95 -0.94 -0.17 0.00 0.00 175.17 174.47 2psy s SER 190 N -2.85 4.71 0.00 -0.34 1.04 -1.26 -0.16 113.70 114.84 2psy s SER 190 Ca 0.12 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2psy s SER 190 Cb 0.02 -0.66 0.00 0.00 0.10 0.00 0.00 66.02 65.47 2psy s SER 190 CO -0.02 -1.60 0.00 0.00 0.98 0.00 0.00 173.24 172.59 2psy s GLN 192 N -1.63 4.12 0.00 0.00 1.11 -1.26 -1.90 119.66 120.11 2psy s GLN 192 Ca 0.00 2.60 0.00 0.00 0.01 0.00 0.00 55.36 57.97 2psy s GLN 192 Cb 0.00 -3.06 0.00 0.00 -1.01 0.00 0.00 33.01 28.94 2psy s GLN 192 CO 0.00 -0.72 0.00 0.41 0.01 0.00 0.00 175.29 174.99 2psy n GLY 193 N 3.43 2.86 0.07 3.09 0.00 -1.26 -1.60 105.19 111.78 2psy n GLY 193 Ca 0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2psy n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2psy h ASP 194 N 0.00 0.00 -1.38 1.61 3.32 -1.72 -3.30 116.42 114.94 2psy h ASP 194 Ca 0.00 -0.21 -0.69 0.00 0.02 0.00 0.00 57.03 56.15 2psy h ASP 194 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 2psy h ASP 194 CO 0.00 0.11 -0.12 -1.20 -1.72 0.00 0.00 179.24 176.30 2psy n SER 195 N -2.17 -0.06 0.00 6.45 7.64 -1.26 -0.82 113.62 123.41 2psy n SER 195 Ca 0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2psy n SER 195 Cb 0.45 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 2psy n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2psy n GLY 196 N 1.81 2.33 3.72 0.23 0.00 -0.67 0.10 105.19 112.70 2psy n GLY 196 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2psy n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2psy s GLY 197 N -1.98 1.60 0.33 -0.02 0.00 0.00 -3.23 107.32 104.02 2psy s GLY 197 Ca 0.00 -0.17 -0.12 0.00 0.00 0.00 0.00 44.72 44.43 2psy s GLY 197 CO 0.00 0.35 0.70 2.56 0.00 0.00 0.00 173.10 176.71 2psy s PRO 198 N -4.98 3.86 -0.25 2.90 0.04 -1.26 -1.56 135.00 133.76 2psy s PRO 198 Ca 0.64 0.48 0.00 0.00 0.04 0.00 0.00 61.00 62.16 2psy s PRO 198 Cb -0.18 -2.47 0.07 0.00 0.04 0.00 0.00 34.50 31.96 2psy s PRO 198 CO 0.57 0.12 -0.01 0.08 0.04 0.00 0.00 177.00 177.80 2psy s VAL 199 N -2.09 1.32 -0.15 -0.36 1.01 -0.41 -2.88 120.40 116.83 2psy s VAL 199 Ca 0.51 -1.23 -0.05 0.00 0.00 0.00 0.00 61.98 61.21 2psy s VAL 199 Cb -0.10 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2psy s VAL 199 CO 0.24 -0.25 0.04 -0.69 0.00 0.00 0.00 175.10 174.43 2psy s VAL 200 N 1.47 4.60 -0.02 2.92 1.01 0.11 -1.02 120.40 129.46 2psy s VAL 200 Ca -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.86 2psy s VAL 200 Cb -0.18 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.20 2psy s VAL 200 CO -0.09 0.52 -0.01 0.00 0.00 0.00 0.00 175.10 175.51 2psy n ASN 202 N 3.90 -5.99 0.00 0.00 5.03 -1.26 -1.53 115.26 115.41 2psy n ASN 202 Ca -0.24 -0.35 0.00 0.00 0.87 0.00 0.00 54.58 54.85 2psy n ASN 202 Cb 0.52 -4.82 0.00 0.00 -1.02 0.00 0.00 39.78 34.46 2psy n ASN 202 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2psy n GLY 203 N -1.59 0.33 3.43 7.41 0.00 -1.26 -4.99 105.19 108.52 2psy n GLY 203 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 2psy n GLY 203 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2psy s SER 204 N -2.12 3.40 -0.48 1.61 0.01 -0.58 -4.75 113.70 110.79 2psy s SER 204 Ca 0.00 -0.95 -0.28 0.00 1.31 0.00 0.00 55.95 56.03 2psy s SER 204 Cb 0.00 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 66.00 2psy s SER 204 CO 0.00 0.06 1.11 -0.22 0.41 0.00 0.00 173.24 174.59 2psy s LEU 209 N -3.08 3.69 -0.18 2.44 2.96 0.21 -1.15 118.68 123.56 2psy s LEU 209 Ca 0.25 0.39 0.18 0.00 -0.22 0.00 0.00 54.13 54.73 2psy s LEU 209 Cb -0.06 -3.48 -0.25 0.00 0.50 0.00 0.00 46.19 42.90 2psy s LEU 209 CO 0.12 -1.23 0.12 1.67 -1.32 0.00 0.00 176.35 175.70 2psy n GLN 210 N 7.77 0.69 -3.86 1.98 -0.06 -0.19 -2.22 117.38 121.49 2psy n GLN 210 Ca 0.11 0.00 -0.09 0.00 -2.00 0.00 0.00 57.00 55.02 2psy n GLN 210 Cb 0.49 -1.54 0.00 0.00 -4.06 0.00 0.00 30.24 25.14 2psy n GLN 210 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2psy s GLY 211 N -5.43 0.46 0.05 1.69 0.00 -0.97 -2.41 107.32 100.70 2psy s GLY 211 Ca -0.10 -0.79 0.07 0.00 0.00 0.00 0.00 44.72 43.90 2psy s GLY 211 CO 0.83 -0.38 -0.19 1.08 0.00 0.00 0.00 173.10 174.44 2psy s LEU 212 N -3.07 2.19 0.09 0.66 1.43 -1.18 -1.29 118.68 117.51 2psy s LEU 212 Ca 0.17 -0.53 -0.31 0.00 -1.03 0.00 0.00 54.13 52.43 2psy s LEU 212 Cb -0.04 -0.87 -0.09 0.00 0.03 0.00 0.00 46.19 45.22 2psy s LEU 212 CO 0.12 0.11 1.66 -0.69 0.23 0.00 0.00 176.35 177.78 2psy s VAL 213 N -0.86 2.90 0.05 -1.59 1.01 -0.60 -0.92 120.40 120.39 2psy s VAL 213 Ca 0.06 0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 2psy s VAL 213 Cb -0.09 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.01 2psy s VAL 213 CO 0.02 0.00 -0.01 -0.24 0.00 0.00 0.00 175.10 174.87 2psy n SER 214 N 5.31 0.70 -3.00 3.32 2.88 -1.02 -1.67 113.62 120.15 2psy n SER 214 Ca 0.16 0.09 -0.08 0.00 -1.33 0.00 0.00 58.87 57.71 2psy n SER 214 Cb 0.40 -0.23 0.02 0.00 -0.75 0.00 0.00 64.21 63.65 2psy n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2psy s TRP 215 N -1.63 0.10 0.01 0.66 1.48 -0.81 -4.94 118.94 113.80 2psy s TRP 215 Ca -0.01 -0.75 -0.03 0.00 -1.06 0.00 0.00 56.10 54.25 2psy s TRP 215 Cb 0.00 0.83 0.01 0.00 -1.16 0.00 0.00 33.47 33.15 2psy s TRP 215 CO 0.01 -1.51 0.16 0.41 -4.06 0.00 0.00 176.95 171.96 2psy n GLY 216 N -0.54 0.82 3.90 3.67 0.00 -1.26 0.14 105.19 111.92 2psy n GLY 216 Ca -0.08 -0.89 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2psy n GLY 216 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2psy s ASP 217 N -1.35 5.23 -0.03 1.61 -1.08 -1.26 -5.00 116.67 114.78 2psy s ASP 217 Ca 0.04 0.94 0.01 0.00 -0.52 0.00 0.00 52.55 53.02 2psy s ASP 217 Cb -0.00 -1.69 0.02 0.00 -1.46 0.00 0.00 42.92 39.78 2psy s ASP 217 CO 0.00 -1.43 -0.04 -0.47 0.52 0.00 0.00 175.17 173.74 2psy s TYR 218 N -3.34 0.64 0.89 -5.34 5.04 -1.26 -3.71 117.35 110.27 2psy s TYR 218 Ca 0.58 -0.15 -0.11 0.00 -2.44 0.00 0.00 57.07 54.96 2psy s TYR 218 Cb -0.11 -0.54 0.13 0.00 0.35 0.00 0.00 41.96 41.79 2psy s TYR 218 CO 0.50 -0.13 1.11 -2.14 -1.34 0.00 0.00 175.55 173.55 2psy s PRO 219 N 0.61 1.23 0.63 4.97 0.02 -1.26 -5.09 135.00 136.11 2psy s PRO 219 Ca -0.08 1.24 -0.16 0.00 0.02 0.00 0.00 61.00 62.03 2psy s PRO 219 Cb -0.11 -1.77 -0.01 0.00 0.02 0.00 0.00 34.50 32.62 2psy s PRO 219 CO -0.00 -2.38 1.10 0.00 -0.33 0.00 0.00 177.00 175.38 2psy n ALA 221 N -2.21 -0.31 -1.77 0.00 0.00 -1.26 -4.80 120.51 110.16 2psy n ALA 221 Ca 0.10 0.14 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 2psy n ALA 221 Cb 0.52 -1.50 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 2psy n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2psy s ARG 221 N -4.07 4.44 0.26 0.00 0.52 -1.25 -3.64 118.95 115.21 2psy s ARG 221 Ca 0.00 2.06 -0.31 0.00 -0.52 0.00 0.00 55.73 56.97 2psy s ARG 221 Cb 0.00 -3.10 -0.13 0.00 0.52 0.00 0.00 34.95 32.25 2psy s ARG 221 CO 0.00 -0.06 1.45 -0.35 0.02 0.00 0.00 175.30 176.37 2psy n PRO 222 N 0.90 2.23 -1.58 3.54 -0.04 -1.26 -1.93 135.00 136.86 2psy n PRO 222 Ca -0.00 0.79 -0.15 0.00 -0.04 0.00 0.00 63.50 64.09 2psy n PRO 222 Cb 0.43 -2.48 -0.06 0.00 -0.04 0.00 0.00 33.50 31.35 2psy n PRO 222 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2psy n ASN 223 N 2.09 -4.83 -3.84 3.54 5.03 -1.26 -4.96 115.26 111.03 2psy n ASN 223 Ca 0.10 0.32 -0.30 0.00 0.87 0.00 0.00 54.58 55.58 2psy n ASN 223 Cb 0.33 -3.74 -0.14 0.00 -1.02 0.00 0.00 39.78 35.22 2psy n ASN 223 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2psy s ARG 224 N -3.53 1.38 0.62 3.52 1.81 -0.81 -4.96 118.95 116.97 2psy s ARG 224 Ca 0.00 -1.94 -0.12 0.00 -1.72 0.00 0.00 55.73 51.94 2psy s ARG 224 Cb 0.00 -2.69 -0.04 0.00 -0.45 0.00 0.00 34.95 31.77 2psy s ARG 224 CO 0.00 -1.07 1.03 -1.25 -0.68 0.00 0.00 175.30 173.33 2psy s PRO 225 N 0.57 3.49 0.56 3.54 0.04 -1.26 -4.48 135.00 137.46 2psy s PRO 225 Ca 0.14 0.86 -0.17 0.00 0.04 0.00 0.00 61.00 61.88 2psy s PRO 225 Cb -0.22 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.20 2psy s PRO 225 CO -0.07 -0.65 1.05 0.20 0.04 0.00 0.00 177.00 177.57 2psy s GLY 226 N -3.80 2.25 -0.16 0.56 0.00 -0.86 -4.57 107.32 100.74 2psy s GLY 226 Ca 0.57 0.47 -0.02 0.00 0.00 0.00 0.00 44.72 45.73 2psy s GLY 226 CO 0.49 0.79 -0.07 0.14 0.00 0.00 0.00 173.10 174.45 2psy s VAL 227 N -2.29 3.51 0.16 1.40 1.01 0.12 -1.88 120.40 122.43 2psy s VAL 227 Ca 0.65 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 62.24 2psy s VAL 227 Cb -0.16 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 2psy s VAL 227 CO 0.32 0.49 -0.22 -0.31 0.00 0.00 0.00 175.10 175.38 2psy s TYR 228 N 0.54 2.07 0.08 5.22 1.51 0.43 -1.93 117.35 125.26 2psy s TYR 228 Ca -0.05 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.30 2psy s TYR 228 Cb -0.15 -1.06 -0.07 0.00 -0.11 0.00 0.00 41.96 40.57 2psy s TYR 228 CO 0.03 0.37 1.44 0.99 -1.11 0.00 0.00 175.55 177.27 2psy s THR 229 N -1.61 3.36 -1.13 -0.71 2.01 -0.10 -0.97 115.64 116.49 2psy s THR 229 Ca 0.16 0.90 -0.18 0.00 0.31 0.00 0.00 61.69 62.88 2psy s THR 229 Cb -0.08 -3.58 0.11 0.00 0.01 0.00 0.00 72.50 68.97 2psy s THR 229 CO 0.07 0.04 1.44 0.21 -0.69 0.00 0.00 174.62 175.69 2psy s ASN 230 N 1.53 6.80 0.58 3.53 2.47 0.14 -3.12 114.94 126.87 2psy s ASN 230 Ca 0.66 -2.34 0.28 0.00 0.42 0.00 0.00 52.86 51.87 2psy s ASN 230 Cb -0.36 -2.48 1.65 0.00 -1.45 0.00 0.00 41.25 38.61 2psy s ASN 230 CO 0.29 -1.07 2.13 -0.07 -3.72 0.00 0.00 177.10 174.66 2psy h LEU 231 N 11.18 0.00 -2.48 3.21 3.38 -1.77 -2.57 115.31 126.26 2psy h LEU 231 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2psy h LEU 231 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2psy h LEU 231 CO 1.30 0.00 0.10 0.00 0.09 0.00 0.00 178.44 179.93 2psy n LYS 233 N -2.89 1.47 0.00 0.00 4.76 -0.97 -4.26 118.16 116.27 2psy n LYS 233 Ca -0.02 -0.76 0.00 0.00 -2.87 0.00 0.00 58.31 54.65 2psy n LYS 233 Cb 0.15 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 2psy n LYS 233 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2psy n PHE 234 N -0.10 0.00 -0.18 2.13 3.72 0.21 -4.83 117.46 118.40 2psy n PHE 234 Ca 0.19 -0.32 -0.01 0.00 -0.05 0.00 0.00 57.45 57.26 2psy n PHE 234 Cb 0.32 -0.03 0.09 0.00 -0.94 0.00 0.00 39.48 38.91 2psy n PHE 234 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2psy h THR 235 N 0.86 0.66 -0.59 4.37 1.35 -1.73 0.13 112.91 117.96 2psy h THR 235 Ca 0.00 -0.08 -0.02 0.00 -0.55 0.00 0.00 66.41 65.76 2psy h THR 235 Cb 0.61 0.41 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 2psy h THR 235 CO 0.00 0.04 0.29 0.11 -0.25 0.00 0.00 175.52 175.71 2psy h LYS 236 N 0.24 0.85 -0.33 4.72 1.57 -1.92 -0.84 116.57 120.86 2psy h LYS 236 Ca 0.29 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 2psy h LYS 236 Cb 0.41 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 2psy h LYS 236 CO -0.38 0.69 -0.01 2.35 -0.57 0.00 0.00 179.45 181.53 2psy h TRP 237 N 0.81 0.65 0.05 -1.35 7.01 -1.73 -0.64 115.95 120.74 2psy h TRP 237 Ca 0.20 -0.12 0.01 0.00 2.11 0.00 0.00 58.89 61.10 2psy h TRP 237 Cb 0.11 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 26.98 2psy h TRP 237 CO -0.00 0.72 -0.13 0.82 -2.79 0.00 0.00 178.44 177.06 2psy h ILE 238 N 0.39 0.69 -0.56 2.65 2.04 -0.52 0.09 117.51 122.30 2psy h ILE 238 Ca 0.09 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.86 2psy h ILE 238 Cb 0.46 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 2psy h ILE 238 CO 0.02 0.00 -0.03 -0.61 0.00 0.00 0.00 178.15 177.53 2psy h GLN 239 N -0.24 1.00 -0.34 2.37 5.75 -1.13 -1.63 115.11 120.90 2psy h GLN 239 Ca 0.03 -0.32 -0.12 0.00 -0.15 0.00 0.00 58.65 58.09 2psy h GLN 239 Cb 0.27 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2psy h GLN 239 CO -0.09 1.00 -0.28 1.49 -2.65 0.00 0.00 178.83 178.29 2psy h GLU 240 N 0.91 0.70 -0.41 1.69 4.81 -0.97 -1.61 114.58 119.69 2psy h GLU 240 Ca 0.16 -0.30 -0.14 0.00 -0.13 0.00 0.00 59.36 58.94 2psy h GLU 240 Cb 0.58 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2psy h GLU 240 CO 0.03 0.90 -0.30 1.15 -0.73 0.00 0.00 179.01 180.06 2psy h THR 241 N 0.60 1.27 -0.31 0.32 2.02 -0.79 -0.92 112.91 115.10 2psy h THR 241 Ca 0.07 -1.47 -0.05 0.00 0.77 0.00 0.00 66.41 65.73 2psy h THR 241 Cb 0.79 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 2psy h THR 241 CO 0.06 0.50 -0.00 0.40 0.37 0.00 0.00 175.52 176.85 2psy h ILE 242 N 0.76 1.26 -0.51 3.11 2.04 -1.18 -2.88 117.51 120.12 2psy h ILE 242 Ca 0.08 -0.96 -0.07 0.00 1.00 0.00 0.00 64.86 64.91 2psy h ILE 242 Cb 0.88 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 2psy h ILE 242 CO 0.08 0.31 0.03 1.56 0.00 0.00 0.00 178.15 180.13 2psy h GLN 243 N 0.34 0.83 0.00 2.37 4.20 -1.24 -2.14 115.11 119.48 2psy h GLN 243 Ca 0.09 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2psy h GLN 243 Cb 0.45 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.13 2psy h GLN 243 CO 0.02 0.82 0.00 0.00 -0.67 0.00 0.00 178.83 179.00 2psy n ALA 244 N -2.47 1.52 -2.11 3.87 0.00 -0.36 -2.66 120.51 118.30 2psy n ALA 244 Ca 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 2psy n ALA 244 Cb 0.29 -1.18 0.10 0.00 0.00 0.00 0.00 19.45 18.66 2psy n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2psy n ASN 245 N -1.49 2.10 -0.54 0.00 3.02 -0.82 -5.08 115.26 112.44 2psy n ASN 245 Ca 0.03 -3.08 0.07 0.00 -0.03 0.00 0.00 54.58 51.57 2psy n ASN 245 Cb 0.13 -0.42 0.06 0.00 -0.61 0.00 0.00 39.78 38.93 2psy n ASN 245 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44