#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eax s VAL 17 N 0.00 5.28 -0.48 2.52 1.01 0.24 -4.16 120.40 124.81 1eax s VAL 17 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1eax s VAL 17 Cb 0.00 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1eax s VAL 17 CO 0.00 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1eax n GLY 18 N 2.10 0.72 0.00 4.51 0.00 -1.23 -1.99 105.19 109.30 1eax n GLY 18 Ca -0.16 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1eax n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eax n GLY 19 N -2.16 2.10 3.16 -0.02 0.00 -1.26 -4.81 105.19 102.20 1eax n GLY 19 Ca -0.05 -2.08 -0.10 0.00 0.00 0.00 0.00 46.02 43.80 1eax n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1eax s THR 20 N 1.56 0.30 0.26 2.61 -4.23 -0.40 -4.93 115.64 110.81 1eax s THR 20 Ca 0.00 -1.91 -0.30 0.00 -1.18 0.00 0.00 61.69 58.30 1eax s THR 20 Cb 0.00 -1.96 -0.10 0.00 1.34 0.00 0.00 72.50 71.78 1eax s THR 20 CO 0.00 -0.58 1.49 -1.81 -0.54 0.00 0.00 174.62 173.18 1eax s ASP 21 N -3.06 6.57 0.67 3.99 1.01 -1.26 -1.09 116.67 123.49 1eax s ASP 21 Ca 0.21 2.76 -0.11 0.00 0.71 0.00 0.00 52.55 56.11 1eax s ASP 21 Cb 0.07 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1eax s ASP 21 CO 0.00 -0.77 1.05 0.00 0.21 0.00 0.00 175.17 175.66 1eax s ALA 22 N -0.02 2.83 0.47 5.23 0.00 -0.06 -4.80 121.76 125.41 1eax s ALA 22 Ca 0.60 0.03 -0.19 0.00 0.00 0.00 0.00 51.96 52.40 1eax s ALA 22 Cb -0.44 -3.14 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 1eax s ALA 22 CO 0.45 -1.02 0.97 -0.51 0.00 0.00 0.00 175.76 175.65 1eax s ASP 23 N -3.91 6.73 0.21 0.00 1.01 -1.26 -4.91 116.67 114.54 1eax s ASP 23 Ca 0.57 1.67 -0.32 0.00 0.71 0.00 0.00 52.55 55.19 1eax s ASP 23 Cb -0.13 -2.53 -0.11 0.00 1.01 0.00 0.00 42.92 41.16 1eax s ASP 23 CO 0.54 -0.51 1.66 -0.70 0.21 0.00 0.00 175.17 176.37 1eax s GLU 24 N -3.55 4.15 0.00 8.23 2.12 -1.26 -1.77 118.70 126.63 1eax s GLU 24 Ca 0.61 2.53 0.00 0.00 0.36 0.00 0.00 54.97 58.48 1eax s GLU 24 Cb -0.10 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.20 1eax s GLU 24 CO 0.21 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.65 1eax n GLY 25 N 3.59 0.44 0.18 -1.50 0.00 -1.26 -4.92 105.19 101.72 1eax n GLY 25 Ca 0.14 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.20 1eax n GLY 25 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1eax h GLU 26 N 0.95 0.00 -2.23 1.61 4.81 -1.72 -3.34 114.58 114.66 1eax h GLU 26 Ca 0.00 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.64 1eax h GLU 26 Cb 0.18 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 29.16 1eax h GLU 26 CO 0.00 0.41 -0.83 0.91 -0.73 0.00 0.00 179.01 178.77 1eax n TRP 27 N -3.74 1.59 0.33 0.92 7.02 -1.26 -4.96 117.44 117.34 1eax n TRP 27 Ca -0.01 -3.86 0.04 0.00 -1.02 0.00 0.00 57.50 52.65 1eax n TRP 27 Cb 0.49 -0.40 0.18 0.00 -2.42 0.00 0.00 31.31 29.16 1eax n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1eax n PRO 28 N 1.38 0.08 0.00 -0.99 -0.04 -1.25 -1.21 135.00 132.97 1eax n PRO 28 Ca 0.25 0.25 0.11 0.00 -0.04 0.00 0.00 63.50 64.07 1eax n PRO 28 Cb 0.46 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.50 1eax n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1eax n TRP 29 N -1.33 0.00 -2.52 0.54 2.14 -1.04 -1.79 117.44 113.43 1eax n TRP 29 Ca 0.03 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.19 1eax n TRP 29 Cb 0.07 -0.13 -0.03 0.00 -0.81 0.00 0.00 31.31 30.41 1eax n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1eax s GLN 30 N -2.96 4.52 0.08 -2.67 2.00 -0.35 -1.11 119.66 119.16 1eax s GLN 30 Ca 0.10 1.67 0.08 0.00 -2.00 0.00 0.00 55.36 55.21 1eax s GLN 30 Cb 0.17 -3.35 -0.03 0.00 0.80 0.00 0.00 33.01 30.59 1eax s GLN 30 CO 0.76 -0.10 -0.21 0.08 -0.50 0.00 0.00 175.29 175.32 1eax s VAL 31 N 0.64 1.74 -0.18 1.34 1.01 -0.34 -4.33 120.40 120.28 1eax s VAL 31 Ca 0.54 -1.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 1eax s VAL 31 Cb -0.27 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1eax s VAL 31 CO 0.31 0.06 -0.02 -0.55 0.00 0.00 0.00 175.10 174.90 1eax s SER 32 N -1.63 4.82 -0.23 3.32 0.15 -0.72 -2.03 113.70 117.38 1eax s SER 32 Ca 0.07 -0.17 -0.07 0.00 0.70 0.00 0.00 55.95 56.48 1eax s SER 32 Cb -0.10 -1.81 -0.03 0.00 -1.71 0.00 0.00 66.02 62.38 1eax s SER 32 CO 0.03 0.11 0.05 -0.76 1.20 0.00 0.00 173.24 173.87 1eax s LEU 33 N 0.74 3.41 -0.10 3.45 2.01 0.05 -0.56 118.68 127.69 1eax s LEU 33 Ca -0.01 -0.19 -0.01 0.00 0.01 0.00 0.00 54.13 53.93 1eax s LEU 33 Cb -0.14 -1.90 -0.03 0.00 0.01 0.00 0.00 46.19 44.13 1eax s LEU 33 CO 0.02 -0.00 -0.04 -1.00 1.01 0.00 0.00 176.35 176.34 1eax s HIS 34 N 1.41 3.01 -0.09 0.29 3.76 0.18 -1.14 115.29 122.71 1eax s HIS 34 Ca 0.05 -0.02 -0.14 0.00 -0.15 0.00 0.00 55.06 54.80 1eax s HIS 34 Cb -0.15 -1.79 -0.05 0.00 1.11 0.00 0.00 32.58 31.70 1eax s HIS 34 CO 0.03 0.27 0.34 0.00 -0.85 0.00 0.00 174.74 174.53 1eax s ALA 35 N -0.52 3.65 -0.09 -1.40 0.00 -0.97 -0.94 121.76 121.49 1eax s ALA 35 Ca 0.08 -0.35 -0.35 0.00 0.00 0.00 0.00 51.96 51.34 1eax s ALA 35 Cb -0.12 -2.37 -0.12 0.00 0.00 0.00 0.00 23.12 20.50 1eax s ALA 35 CO 0.02 0.29 1.84 -0.11 0.00 0.00 0.00 175.76 177.80 1eax n LEU 36 N 2.75 3.27 0.00 0.00 7.94 0.18 -0.47 117.00 130.67 1eax n LEU 36 Ca -0.13 0.99 0.00 0.00 -1.11 0.00 0.00 56.01 55.76 1eax n LEU 36 Cb 0.52 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 43.13 1eax n LEU 36 CO 0.38 -0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.15 1eax n GLY 37 N 4.29 0.74 0.00 -3.96 0.00 -1.26 -4.87 105.19 100.13 1eax n GLY 37 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1eax n GLY 37 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1eax n GLN 38 N -2.46 4.84 0.00 1.61 6.02 0.38 -5.13 117.38 122.64 1eax n GLN 38 Ca 0.00 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1eax n GLN 38 Cb 0.00 -0.52 0.00 0.00 1.02 0.00 0.00 30.24 30.74 1eax n GLN 38 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1eax n GLY 39 N 0.71 -2.00 3.70 1.08 0.00 -1.18 -4.83 105.19 102.68 1eax n GLY 39 Ca 0.00 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 1eax n GLY 39 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1eax s HIS 40 N 0.00 2.60 -0.08 1.61 5.65 -1.26 -2.29 115.29 121.51 1eax s HIS 40 Ca 0.00 0.32 -0.02 0.00 0.25 0.00 0.00 55.06 55.61 1eax s HIS 40 Cb 0.00 -4.04 -0.05 0.00 -1.18 0.00 0.00 32.58 27.32 1eax s HIS 40 CO 0.00 -4.08 -0.09 -0.89 -0.65 0.00 0.00 174.74 169.03 1eax n ILE 41 N 4.41 0.46 -3.95 0.89 2.08 -0.30 -4.95 119.36 118.01 1eax n ILE 41 Ca 0.16 -0.15 -0.10 0.00 0.56 0.00 0.00 62.75 63.22 1eax n ILE 41 Cb 0.38 -1.15 -0.03 0.00 -0.75 0.00 0.00 39.64 38.09 1eax n ILE 41 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1eax s GLY 43 N -3.05 1.87 0.30 0.00 0.00 0.71 -0.77 107.32 106.39 1eax s GLY 43 Ca 0.20 -1.92 -0.20 0.00 0.00 0.00 0.00 44.72 42.80 1eax s GLY 43 CO 0.11 -1.66 0.75 0.00 0.00 0.00 0.00 173.10 172.30 1eax s ALA 44 N -2.57 -1.15 -0.01 3.20 0.00 -0.86 -3.63 121.76 116.74 1eax s ALA 44 Ca 0.57 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 52.19 1eax s ALA 44 Cb -0.06 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 1eax s ALA 44 CO 0.35 -1.03 -0.14 -1.54 0.00 0.00 0.00 175.76 173.40 1eax s SER 45 N -2.96 1.65 -0.10 0.00 1.04 0.01 -1.20 113.70 112.14 1eax s SER 45 Ca 0.12 -0.26 -0.28 0.00 0.48 0.00 0.00 55.95 56.01 1eax s SER 45 Cb -0.06 -0.18 -0.02 0.00 0.10 0.00 0.00 66.02 65.87 1eax s SER 45 CO 0.08 0.17 0.95 -0.22 0.98 0.00 0.00 173.24 175.20 1eax s LEU 46 N -0.35 4.25 -0.00 2.42 2.96 -0.27 -0.85 118.68 126.85 1eax s LEU 46 Ca 0.05 1.46 0.03 0.00 -0.22 0.00 0.00 54.13 55.45 1eax s LEU 46 Cb -0.05 -3.47 -0.03 0.00 0.50 0.00 0.00 46.19 43.13 1eax s LEU 46 CO -0.00 -0.39 0.11 2.30 -1.32 0.00 0.00 176.35 177.04 1eax n ILE 47 N 4.45 0.00 -3.85 6.68 -5.35 -0.57 -1.31 119.36 119.41 1eax n ILE 47 Ca 0.07 -0.36 -0.05 0.00 -0.27 0.00 0.00 62.75 62.14 1eax n ILE 47 Cb 0.49 0.89 0.02 0.00 -1.74 0.00 0.00 39.64 39.30 1eax n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1eax s SER 48 N -1.48 -0.00 0.54 7.28 1.04 -1.19 -4.79 113.70 115.09 1eax s SER 48 Ca 0.01 -0.83 0.28 0.00 0.48 0.00 0.00 55.95 55.89 1eax s SER 48 Cb 0.02 0.62 1.54 0.00 0.10 0.00 0.00 66.02 68.30 1eax s SER 48 CO 0.11 -1.23 2.12 -0.65 0.98 0.00 0.00 173.24 174.57 1eax h PRO 49 N 2.00 0.00 -0.01 4.02 0.11 -1.98 -3.22 132.00 132.92 1eax h PRO 49 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1eax h PRO 49 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1eax h PRO 49 CO 0.37 0.09 -0.16 0.09 -0.21 0.00 0.00 178.00 178.18 1eax n ASN 50 N -3.70 1.09 -4.05 -2.05 4.13 -1.26 -0.62 115.26 108.80 1eax n ASN 50 Ca -0.02 -1.04 -0.16 0.00 1.68 0.00 0.00 54.58 55.03 1eax n ASN 50 Cb 0.20 0.45 -0.13 0.00 -1.54 0.00 0.00 39.78 38.76 1eax n ASN 50 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1eax s TRP 51 N -1.15 0.78 0.13 3.10 0.52 -1.22 -0.62 118.94 120.48 1eax s TRP 51 Ca 0.07 -0.30 0.09 0.00 0.02 0.00 0.00 56.10 55.98 1eax s TRP 51 Cb 0.06 -0.47 -0.04 0.00 -1.15 0.00 0.00 33.47 31.87 1eax s TRP 51 CO 0.19 -0.02 -0.22 -0.51 0.02 0.00 0.00 176.95 176.42 1eax s LEU 52 N -0.86 2.35 -0.10 2.99 1.43 -0.06 -1.51 118.68 122.92 1eax s LEU 52 Ca -0.02 -0.76 -0.02 0.00 -1.03 0.00 0.00 54.13 52.30 1eax s LEU 52 Cb -0.06 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 1eax s LEU 52 CO 0.00 0.06 -0.01 -0.69 0.23 0.00 0.00 176.35 175.95 1eax s VAL 53 N -1.41 4.24 0.00 -1.59 1.01 -0.03 -0.82 120.40 121.81 1eax s VAL 53 Ca 0.11 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.83 1eax s VAL 53 Cb -0.09 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.50 1eax s VAL 53 CO 0.06 0.58 0.00 -0.24 0.00 0.00 0.00 175.10 175.50 1eax n SER 54 N 2.39 0.00 -4.70 3.32 2.88 0.06 -0.81 113.62 116.76 1eax n SER 54 Ca -0.18 -0.71 -0.35 0.00 -1.33 0.00 0.00 58.87 56.30 1eax n SER 54 Cb 0.53 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.91 1eax n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1eax s ALA 55 N -1.52 3.51 0.44 -1.46 0.00 -1.26 -0.91 121.76 120.57 1eax s ALA 55 Ca 0.00 -0.73 0.11 0.00 0.00 0.00 0.00 51.96 51.35 1eax s ALA 55 Cb 0.00 -1.90 1.00 0.00 0.00 0.00 0.00 23.12 22.22 1eax s ALA 55 CO 0.00 0.31 2.05 0.00 0.00 0.00 0.00 175.76 178.12 1eax h ALA 56 N 6.17 1.88 0.00 0.00 0.00 -1.73 -2.47 119.26 123.11 1eax h ALA 56 Ca -0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1eax h ALA 56 Cb 1.18 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1eax h ALA 56 CO 0.67 0.06 0.00 1.12 0.00 0.00 0.00 179.25 181.10 1eax h HIS 57 N 0.39 0.00 0.00 0.00 2.07 -1.92 -2.15 115.15 113.54 1eax h HIS 57 Ca 0.17 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.69 1eax h HIS 57 Cb 0.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.15 1eax h HIS 57 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1eax n TYR 59 N -2.09 2.27 -1.72 0.00 4.01 -0.81 -4.88 117.16 113.95 1eax n TYR 59 Ca 0.05 -2.18 0.00 0.00 -0.16 0.00 0.00 57.90 55.61 1eax n TYR 59 Cb 0.36 -0.53 0.00 0.00 -0.31 0.00 0.00 39.34 38.87 1eax n TYR 59 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1eax n ILE 60 N -0.85 0.00 -3.73 -0.72 5.41 -1.25 -2.82 119.36 115.40 1eax n ILE 60 Ca 0.43 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 64.15 1eax n ILE 60 Cb 0.90 -0.36 -0.01 0.00 -0.71 0.00 0.00 39.64 39.46 1eax n ILE 60 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 1eax s ASP 60 N -0.51 -0.14 0.60 4.38 1.47 -0.58 -4.34 116.67 117.55 1eax s ASP 60 Ca 0.00 -0.36 0.29 0.00 1.18 0.00 0.00 52.55 53.66 1eax s ASP 60 Cb 0.00 0.41 1.56 0.00 -0.34 0.00 0.00 42.92 44.55 1eax s ASP 60 CO 0.00 -0.76 1.98 0.08 0.68 0.00 0.00 175.17 177.14 1eax h ARG 60 N 2.00 0.00 -0.01 2.11 0.11 -2.09 -2.76 114.38 113.75 1eax h ARG 60 Ca -0.26 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.82 1eax h ARG 60 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1eax h ARG 60 CO 0.27 0.00 -0.24 0.41 0.10 0.00 0.00 179.97 180.50 1eax n GLY 60 N -1.44 -0.09 3.49 0.08 0.00 -1.26 -5.00 105.19 100.97 1eax n GLY 60 Ca 0.05 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.58 1eax n GLY 60 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1eax s PHE 60 N -1.59 -0.80 -1.25 1.61 2.19 -1.04 -5.08 117.98 112.01 1eax s PHE 60 Ca 0.12 1.73 -0.13 0.00 0.33 0.00 0.00 56.93 58.98 1eax s PHE 60 Cb 0.11 0.40 0.16 0.00 -1.31 0.00 0.00 43.02 42.38 1eax s PHE 60 CO 0.31 -0.41 1.63 0.54 1.83 0.00 0.00 175.22 179.13 1eax n ARG 60 N 3.79 3.43 0.26 10.12 1.74 -1.26 -1.52 116.66 133.21 1eax n ARG 60 Ca -0.19 -3.67 0.18 0.00 -0.77 0.00 0.00 57.85 53.40 1eax n ARG 60 Cb 0.57 -3.04 0.91 0.00 -1.02 0.00 0.00 32.46 29.88 1eax n ARG 60 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1eax h TYR 60 N 6.66 0.00 0.00 -1.55 0.05 -1.86 -2.03 116.97 118.24 1eax h TYR 60 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.14 1eax h TYR 60 Cb 0.78 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.52 1eax h TYR 60 CO 1.18 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 177.16 1eax n SER 60 N -2.77 0.00 -4.58 3.88 3.41 -1.13 -4.50 113.62 107.94 1eax n SER 60 Ca -0.02 0.38 -0.42 0.00 -0.26 0.00 0.00 58.87 58.55 1eax n SER 60 Cb 0.10 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 63.55 1eax n SER 60 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1eax s ASP 60 N -2.92 6.55 0.55 4.04 -1.08 -0.77 -4.88 116.67 118.17 1eax s ASP 60 Ca 0.17 0.34 0.26 0.00 -0.52 0.00 0.00 52.55 52.80 1eax s ASP 60 Cb 0.19 -2.40 1.45 0.00 -1.46 0.00 0.00 42.92 40.70 1eax s ASP 60 CO 0.51 -0.76 2.00 1.55 0.52 0.00 0.00 175.17 178.99 1eax h PRO 61 N 8.52 0.00 0.00 4.34 0.13 -1.88 -1.63 132.00 141.47 1eax h PRO 61 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1eax h PRO 61 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1eax h PRO 61 CO 0.92 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.94 1eax n THR 62 N -4.18 0.70 1.14 1.56 -2.24 -1.26 -2.63 114.28 107.37 1eax n THR 62 Ca 0.08 0.18 0.10 0.00 -2.27 0.00 0.00 64.05 62.14 1eax n THR 62 Cb 0.56 -0.89 0.35 0.00 -2.10 0.00 0.00 70.33 68.25 1eax n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1eax n GLN 63 N -1.41 1.80 -4.43 -0.78 1.13 -0.61 -4.94 117.38 108.13 1eax n GLN 63 Ca 0.06 -1.20 -0.25 0.00 -1.94 0.00 0.00 57.00 53.66 1eax n GLN 63 Cb 0.17 -1.40 -0.10 0.00 0.11 0.00 0.00 30.24 29.02 1eax n GLN 63 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 1eax s TRP 64 N -1.76 2.35 -0.02 1.08 0.52 -1.08 -0.65 118.94 119.38 1eax s TRP 64 Ca 0.32 -0.32 0.01 0.00 0.02 0.00 0.00 56.10 56.13 1eax s TRP 64 Cb 0.18 -1.09 0.02 0.00 -1.15 0.00 0.00 33.47 31.43 1eax s TRP 64 CO 0.26 0.61 -0.01 0.99 0.02 0.00 0.00 176.95 178.83 1eax s THR 65 N -2.11 0.19 -0.15 2.01 2.01 -0.12 -4.30 115.64 113.17 1eax s THR 65 Ca 0.26 0.03 -0.05 0.00 0.31 0.00 0.00 61.69 62.24 1eax s THR 65 Cb -0.07 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.15 1eax s THR 65 CO 0.13 0.13 0.03 0.00 -0.69 0.00 0.00 174.62 174.22 1eax s ALA 66 N 0.76 3.32 -0.23 7.40 0.00 0.41 -0.65 121.76 132.77 1eax s ALA 66 Ca -0.08 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.07 1eax s ALA 66 Cb -0.11 -1.75 -0.01 0.00 0.00 0.00 0.00 23.12 21.25 1eax s ALA 66 CO -0.01 0.29 -0.02 -0.06 0.00 0.00 0.00 175.76 175.96 1eax s PHE 67 N 0.04 3.00 0.03 0.00 0.40 0.27 -0.93 117.98 120.79 1eax s PHE 67 Ca 0.04 -0.92 0.01 0.00 -0.60 0.00 0.00 56.93 55.46 1eax s PHE 67 Cb -0.13 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.23 1eax s PHE 67 CO 0.01 -0.54 0.08 -0.51 0.70 0.00 0.00 175.22 174.96 1eax s LEU 68 N 1.49 3.86 -0.54 -0.37 1.02 0.16 -1.75 118.68 122.55 1eax s LEU 68 Ca 0.05 0.09 0.00 0.00 0.02 0.00 0.00 54.13 54.29 1eax s LEU 68 Cb -0.15 -2.35 0.00 0.00 0.02 0.00 0.00 46.19 43.71 1eax s LEU 68 CO -0.02 0.24 0.00 0.61 0.02 0.00 0.00 176.35 177.20 1eax n GLY 69 N 0.92 0.75 3.79 -3.19 0.00 -1.25 -0.27 105.19 105.95 1eax n GLY 69 Ca -0.11 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 1eax n GLY 69 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1eax s LEU 70 N -1.15 4.33 0.03 0.99 2.96 -1.26 -4.30 118.68 120.27 1eax s LEU 70 Ca 0.00 1.72 0.00 0.00 -0.22 0.00 0.00 54.13 55.63 1eax s LEU 70 Cb 0.00 -3.91 0.00 0.00 0.50 0.00 0.00 46.19 42.78 1eax s LEU 70 CO 0.00 -0.05 0.00 1.57 -1.32 0.00 0.00 176.35 176.55 1eax n HIS 71 N 0.58 -0.04 -4.38 5.38 -0.00 -1.26 -4.91 115.22 110.59 1eax n HIS 71 Ca 0.01 0.01 -0.33 0.00 -0.00 0.00 0.00 57.72 57.40 1eax n HIS 71 Cb 0.50 0.03 -0.15 0.00 -0.00 0.00 0.00 29.99 30.37 1eax n HIS 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1eax s ASP 72 N -5.26 3.54 0.64 0.26 3.68 -1.26 -1.41 116.67 116.85 1eax s ASP 72 Ca 0.00 -0.52 0.37 0.00 2.13 0.00 0.00 52.55 54.53 1eax s ASP 72 Cb 0.00 -1.55 2.10 0.00 -1.45 0.00 0.00 42.92 42.02 1eax s ASP 72 CO 0.00 0.05 2.27 1.56 0.13 0.00 0.00 175.17 179.18 1eax h GLN 73 N 7.56 0.00 -0.01 4.34 1.08 -1.21 -0.57 115.11 126.30 1eax h GLN 73 Ca -0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1eax h GLN 73 Cb 1.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 1eax h GLN 73 CO 0.59 0.00 -0.09 -1.13 -0.95 0.00 0.00 178.83 177.25 1eax n SER 74 N -3.37 1.07 -3.13 1.46 3.41 -1.26 -4.28 113.62 107.50 1eax n SER 74 Ca -0.02 -1.14 -0.22 0.00 -0.26 0.00 0.00 58.87 57.22 1eax n SER 74 Cb 0.13 0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 1eax n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1eax n GLN 75 N -0.34 1.75 0.00 4.33 1.13 -0.22 -4.91 117.38 119.13 1eax n GLN 75 Ca 0.17 -3.92 0.14 0.00 -1.94 0.00 0.00 57.00 51.45 1eax n GLN 75 Cb 0.32 -1.85 0.69 0.00 0.11 0.00 0.00 30.24 29.51 1eax n GLN 75 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1eax n ARG 76 N 0.32 0.34 -0.26 -1.09 1.74 -1.25 -2.74 116.66 113.71 1eax n ARG 76 Ca 0.27 0.02 0.07 0.00 -0.77 0.00 0.00 57.85 57.44 1eax n ARG 76 Cb 0.54 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.67 1eax n ARG 76 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1eax n SER 77 N -1.32 3.27 -4.70 0.55 7.64 -1.26 -4.85 113.62 112.95 1eax n SER 77 Ca 0.12 -2.24 -0.33 0.00 1.01 0.00 0.00 58.87 57.43 1eax n SER 77 Cb 0.24 -0.33 0.12 0.00 -1.01 0.00 0.00 64.21 63.23 1eax n SER 77 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1eax s ALA 77 N -1.44 1.88 0.26 -0.43 0.00 -1.11 -4.88 121.76 116.05 1eax s ALA 77 Ca 0.30 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.73 1eax s ALA 77 Cb 0.18 -3.47 -0.13 0.00 0.00 0.00 0.00 23.12 19.71 1eax s ALA 77 CO 0.15 -2.22 1.37 -2.30 0.00 0.00 0.00 175.76 172.77 1eax n PRO 78 N -3.30 2.03 0.00 0.00 -0.02 -1.26 -1.89 135.00 130.56 1eax n PRO 78 Ca 0.13 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1eax n PRO 78 Cb 0.51 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1eax n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1eax n GLY 79 N 1.86 2.70 3.74 -1.23 0.00 -1.26 -5.03 105.19 105.97 1eax n GLY 79 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1eax n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eax s VAL 80 N -2.21 4.07 -0.10 1.61 1.01 -0.79 -4.61 120.40 119.39 1eax s VAL 80 Ca 0.00 1.78 0.03 0.00 0.00 0.00 0.00 61.98 63.79 1eax s VAL 80 Cb 0.00 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1eax s VAL 80 CO 0.00 0.30 -0.18 -1.10 0.00 0.00 0.00 175.10 174.12 1eax s GLN 81 N -0.29 3.04 -0.15 2.72 -0.21 0.63 -4.91 119.66 120.48 1eax s GLN 81 Ca 0.48 -0.78 -0.06 0.00 0.02 0.00 0.00 55.36 55.03 1eax s GLN 81 Cb -0.27 -2.43 -0.04 0.00 1.00 0.00 0.00 33.01 31.27 1eax s GLN 81 CO 0.33 0.29 0.04 -2.00 -2.12 0.00 0.00 175.29 171.83 1eax s GLU 82 N 0.11 3.64 0.01 2.91 2.12 -1.26 -0.66 118.70 125.57 1eax s GLU 82 Ca -0.09 -0.36 -0.01 0.00 0.36 0.00 0.00 54.97 54.88 1eax s GLU 82 Cb -0.15 -3.07 -0.01 0.00 0.26 0.00 0.00 34.13 31.15 1eax s GLU 82 CO 0.06 0.43 -0.01 1.03 -0.54 0.00 0.00 175.26 176.22 1eax s ARG 83 N -0.09 0.26 0.50 4.30 1.81 -0.11 -4.99 118.95 120.63 1eax s ARG 83 Ca 0.06 -0.47 0.03 0.00 -1.72 0.00 0.00 55.73 53.63 1eax s ARG 83 Cb -0.12 0.10 0.02 0.00 -0.45 0.00 0.00 34.95 34.50 1eax s ARG 83 CO 0.01 -0.04 0.70 1.03 -0.68 0.00 0.00 175.30 176.32 1eax s ARG 84 N -1.16 2.67 -0.04 3.54 0.52 -1.26 -0.44 118.95 122.78 1eax s ARG 84 Ca -0.13 -0.91 0.00 0.00 -0.52 0.00 0.00 55.73 54.17 1eax s ARG 84 Cb -0.08 -2.58 -0.03 0.00 0.52 0.00 0.00 34.95 32.77 1eax s ARG 84 CO -0.01 -0.53 -0.00 -0.51 0.02 0.00 0.00 175.30 174.27 1eax s LEU 85 N -4.61 3.51 -0.16 2.53 1.43 -1.26 -0.48 118.68 119.63 1eax s LEU 85 Ca 0.56 0.05 0.16 0.00 -1.03 0.00 0.00 54.13 53.87 1eax s LEU 85 Cb -0.10 -1.91 -0.24 0.00 0.03 0.00 0.00 46.19 43.96 1eax s LEU 85 CO 0.36 0.32 0.21 1.17 0.23 0.00 0.00 176.35 178.65 1eax n LYS 86 N 1.75 0.67 -3.49 1.70 3.00 0.49 -4.43 118.16 117.86 1eax n LYS 86 Ca -0.16 0.07 -0.16 0.00 -0.00 0.00 0.00 58.31 58.06 1eax n LYS 86 Cb 0.53 -1.59 -0.05 0.00 0.00 0.00 0.00 35.03 33.92 1eax n LYS 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1eax s ARG 87 N -2.52 1.12 -0.14 1.64 3.52 -1.23 -4.92 118.95 116.42 1eax s ARG 87 Ca -0.09 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.55 1eax s ARG 87 Cb 0.07 0.52 0.02 0.00 -1.56 0.00 0.00 34.95 34.00 1eax s ARG 87 CO 0.82 -0.40 -0.12 0.42 -0.81 0.00 0.00 175.30 175.21 1eax s ILE 88 N -1.96 1.45 -0.42 4.11 1.01 -1.26 -1.37 121.20 122.76 1eax s ILE 88 Ca -0.07 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 59.93 1eax s ILE 88 Cb -0.00 -1.39 0.09 0.00 0.01 0.00 0.00 42.46 41.17 1eax s ILE 88 CO 0.03 0.41 0.24 -0.63 0.00 0.00 0.00 174.94 174.99 1eax s ILE 89 N 1.53 3.88 0.18 2.92 1.01 0.76 -4.97 121.20 126.52 1eax s ILE 89 Ca 0.05 -1.64 -0.19 0.00 0.00 0.00 0.00 60.65 58.86 1eax s ILE 89 Cb -0.13 -3.47 -0.08 0.00 0.01 0.00 0.00 42.46 38.79 1eax s ILE 89 CO -0.10 -0.57 0.68 -0.44 0.00 0.00 0.00 174.94 174.50 1eax s SER 90 N 2.08 7.05 0.24 3.58 0.01 -1.26 -0.76 113.70 124.65 1eax s SER 90 Ca 0.04 1.36 -0.31 0.00 1.31 0.00 0.00 55.95 58.35 1eax s SER 90 Cb -0.23 -2.40 -0.13 0.00 0.21 0.00 0.00 66.02 63.47 1eax s SER 90 CO -0.00 0.10 1.47 1.57 0.41 0.00 0.00 173.24 176.78 1eax n HIS 91 N 0.96 2.32 0.32 2.43 -0.00 -0.68 -4.83 115.22 115.75 1eax n HIS 91 Ca -0.04 0.37 0.20 0.00 0.46 0.00 0.00 57.72 58.71 1eax n HIS 91 Cb 0.51 -2.50 1.12 0.00 -0.12 0.00 0.00 29.99 29.00 1eax n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1eax h PRO 92 N 4.54 0.00 -0.51 1.57 0.13 -1.92 -1.58 132.00 134.23 1eax h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1eax h PRO 92 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1eax h PRO 92 CO 0.78 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.74 1eax n PHE 93 N -3.32 0.67 -1.72 1.56 0.99 -1.26 -4.97 117.46 109.41 1eax n PHE 93 Ca -0.03 -0.33 -0.43 0.00 -0.00 0.00 0.00 57.45 56.66 1eax n PHE 93 Cb 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.54 1eax n PHE 93 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1eax n PHE 94 N 1.43 2.66 -3.97 1.38 7.35 -0.60 -4.62 117.46 121.09 1eax n PHE 94 Ca 0.21 0.22 -0.34 0.00 -0.76 0.00 0.00 57.45 56.78 1eax n PHE 94 Cb 0.58 -2.59 -0.14 0.00 0.35 0.00 0.00 39.48 37.67 1eax n PHE 94 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1eax s ASN 95 N 0.69 4.45 0.00 -2.13 3.84 -0.84 -5.00 114.94 115.95 1eax s ASN 95 Ca 0.69 -1.08 0.17 0.00 0.21 0.00 0.00 52.86 52.85 1eax s ASN 95 Cb -0.54 -1.65 0.82 0.00 -0.55 0.00 0.00 41.25 39.33 1eax s ASN 95 CO 0.43 -0.17 1.52 -0.67 -2.79 0.00 0.00 177.10 175.41 1eax n ASP 96 N 4.61 0.00 -0.12 -4.21 4.64 -1.26 0.33 116.55 120.54 1eax n ASP 96 Ca -0.15 0.19 -0.25 0.00 -1.38 0.00 0.00 54.79 53.20 1eax n ASP 96 Cb 0.45 -0.36 -0.11 0.00 -1.04 0.00 0.00 41.12 40.06 1eax n ASP 96 CO 0.00 0.00 0.00 0.33 -0.82 0.00 0.00 177.20 176.71 1eax n PHE 97 N -1.36 0.55 0.21 -0.67 -0.00 -1.26 -4.54 117.46 110.40 1eax n PHE 97 Ca 0.07 0.22 0.12 0.00 -0.00 0.00 0.00 57.45 57.86 1eax n PHE 97 Cb 0.16 -1.06 0.03 0.00 -0.00 0.00 0.00 39.48 38.60 1eax n PHE 97 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1eax n THR 98 N -4.25 0.53 -1.33 -2.13 -2.24 -1.21 -4.95 114.28 98.70 1eax n THR 98 Ca -0.43 -0.48 -0.11 0.00 -2.27 0.00 0.00 64.05 60.76 1eax n THR 98 Cb 0.80 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.73 1eax n THR 98 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1eax n PHE 99 N -2.52 0.00 -2.00 4.78 3.01 0.15 -5.00 117.46 115.88 1eax n PHE 99 Ca 0.01 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.10 1eax n PHE 99 Cb 0.52 -2.20 0.03 0.00 -0.01 0.00 0.00 39.48 37.83 1eax n PHE 99 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1eax s ASP 100 N -2.77 5.18 -1.37 4.37 3.68 -1.24 -3.19 116.67 121.33 1eax s ASP 100 Ca 0.00 2.42 -0.05 0.00 2.13 0.00 0.00 52.55 57.04 1eax s ASP 100 Cb 0.00 -2.60 0.03 0.00 -1.45 0.00 0.00 42.92 38.90 1eax s ASP 100 CO 0.00 -1.60 0.89 -1.22 0.13 0.00 0.00 175.17 173.37 1eax n TYR 101 N -1.56 -2.19 -2.74 -5.34 4.02 -1.26 -1.99 117.16 106.11 1eax n TYR 101 Ca 0.14 0.90 -0.43 0.00 -0.01 0.00 0.00 57.90 58.49 1eax n TYR 101 Cb 0.49 -4.43 -0.00 0.00 -0.02 0.00 0.00 39.34 35.38 1eax n TYR 101 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1eax s ASP 102 N -3.91 6.94 -0.12 7.72 2.15 -1.19 -4.15 116.67 124.12 1eax s ASP 102 Ca 0.28 -2.69 -0.18 0.00 0.43 0.00 0.00 52.55 50.39 1eax s ASP 102 Cb -0.14 -2.50 0.04 0.00 -0.30 0.00 0.00 42.92 40.02 1eax s ASP 102 CO 0.80 -0.99 0.46 -0.51 -0.17 0.00 0.00 175.17 174.76 1eax s ILE 103 N 3.09 0.02 0.05 4.11 2.07 -1.26 -4.18 121.20 125.09 1eax s ILE 103 Ca 0.49 -0.13 -0.05 0.00 -1.41 0.00 0.00 60.65 59.55 1eax s ILE 103 Cb 0.01 -0.70 -0.02 0.00 0.13 0.00 0.00 42.46 41.89 1eax s ILE 103 CO 0.05 -0.07 0.09 0.00 -1.91 0.00 0.00 174.94 173.09 1eax s ALA 104 N -0.38 0.02 -0.11 1.50 0.00 -0.08 -1.68 121.76 121.03 1eax s ALA 104 Ca -0.05 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.24 1eax s ALA 104 Cb -0.03 0.29 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 1eax s ALA 104 CO 0.03 -0.35 -0.17 -0.51 0.00 0.00 0.00 175.76 174.75 1eax s LEU 105 N -2.37 2.50 -0.16 0.00 1.43 0.06 -0.76 118.68 119.38 1eax s LEU 105 Ca -0.01 -0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1eax s LEU 105 Cb 0.01 -1.53 -0.00 0.00 0.03 0.00 0.00 46.19 44.70 1eax s LEU 105 CO -0.07 0.19 -0.15 -0.76 0.23 0.00 0.00 176.35 175.79 1eax s LEU 106 N 0.21 2.48 -0.27 1.79 1.43 0.00 -0.17 118.68 124.15 1eax s LEU 106 Ca -0.11 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.37 1eax s LEU 106 Cb -0.16 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1eax s LEU 106 CO 0.06 0.07 0.38 -0.70 0.23 0.00 0.00 176.35 176.39 1eax s GLU 107 N 0.90 4.02 0.42 1.70 2.12 -0.47 -0.88 118.70 126.50 1eax s GLU 107 Ca -0.04 0.05 -0.25 0.00 0.36 0.00 0.00 54.97 55.10 1eax s GLU 107 Cb -0.15 -3.66 -0.08 0.00 0.26 0.00 0.00 34.13 30.50 1eax s GLU 107 CO -0.01 -0.28 1.20 -0.51 -0.54 0.00 0.00 175.26 175.11 1eax s LEU 108 N 2.08 4.16 0.28 2.70 1.43 0.21 -0.38 118.68 129.16 1eax s LEU 108 Ca 0.15 2.40 0.12 0.00 -1.03 0.00 0.00 54.13 55.77 1eax s LEU 108 Cb -0.16 -4.05 0.35 0.00 0.03 0.00 0.00 46.19 42.36 1eax s LEU 108 CO 0.10 -0.77 1.59 -0.08 0.23 0.00 0.00 176.35 177.42 1eax h GLU 109 N 2.51 0.00 -4.20 1.70 4.22 -1.07 -3.42 114.58 114.32 1eax h GLU 109 Ca -0.49 0.00 -0.29 0.00 0.08 0.00 0.00 59.36 58.66 1eax h GLU 109 Cb 1.24 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 30.22 1eax h GLU 109 CO 0.62 0.61 -0.74 0.21 -2.18 0.00 0.00 179.01 177.53 1eax s LYS 110 N -3.50 0.34 0.60 1.92 2.20 -1.26 -4.97 119.74 115.07 1eax s LYS 110 Ca -0.01 -0.27 -0.20 0.00 -0.36 0.00 0.00 55.97 55.14 1eax s LYS 110 Cb 0.12 -0.27 -0.03 0.00 -1.51 0.00 0.00 37.83 36.14 1eax s LYS 110 CO 0.75 0.07 1.31 -2.14 -0.36 0.00 0.00 175.35 174.98 1eax s PRO 111 N -0.42 2.87 0.54 4.03 0.02 -1.26 -4.94 135.00 135.84 1eax s PRO 111 Ca -0.02 2.11 -0.19 0.00 0.02 0.00 0.00 61.00 62.93 1eax s PRO 111 Cb -0.03 -2.04 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 1eax s PRO 111 CO -0.00 -1.37 1.10 0.00 -0.33 0.00 0.00 177.00 176.40 1eax s ALA 112 N -1.37 2.72 -0.31 -1.55 0.00 0.21 -5.02 121.76 116.45 1eax s ALA 112 Ca 0.77 0.70 -0.10 0.00 0.00 0.00 0.00 51.96 53.33 1eax s ALA 112 Cb -0.38 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.41 1eax s ALA 112 CO 0.42 -0.70 0.16 -2.00 0.00 0.00 0.00 175.76 173.64 1eax s GLU 113 N -3.43 3.43 0.36 0.00 2.12 -1.26 -4.85 118.70 115.07 1eax s GLU 113 Ca 0.70 -0.66 -0.28 0.00 0.36 0.00 0.00 54.97 55.09 1eax s GLU 113 Cb -0.21 -3.57 -0.10 0.00 0.26 0.00 0.00 34.13 30.51 1eax s GLU 113 CO 0.27 -0.38 1.37 0.71 -0.54 0.00 0.00 175.26 176.69 1eax s TYR 114 N 1.63 2.85 0.22 5.30 4.12 -1.26 -4.76 117.35 125.45 1eax s TYR 114 Ca 0.05 1.33 -0.06 0.00 0.02 0.00 0.00 57.07 58.41 1eax s TYR 114 Cb -0.17 -3.79 0.02 0.00 -1.52 0.00 0.00 41.96 36.50 1eax s TYR 114 CO 0.07 -2.28 0.40 -1.13 0.02 0.00 0.00 175.55 172.63 1eax n SER 115 N 0.56 -1.16 0.26 2.29 3.41 -0.14 -4.95 113.62 113.90 1eax n SER 115 Ca 0.01 -1.99 0.13 0.00 -0.26 0.00 0.00 58.87 56.76 1eax n SER 115 Cb 0.41 1.98 0.73 0.00 -0.26 0.00 0.00 64.21 67.07 1eax n SER 115 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1eax h SER 116 N 1.15 0.00 0.11 4.04 4.64 -1.99 -2.74 113.55 118.76 1eax h SER 116 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1eax h SER 116 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1eax h SER 116 CO 0.24 0.11 -0.90 0.23 -0.87 0.00 0.00 176.83 175.64 1eax n MET 117 N -3.61 0.01 -3.76 4.77 2.81 -1.26 -4.84 117.12 111.23 1eax n MET 117 Ca -0.02 -0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.60 1eax n MET 117 Cb 0.24 -1.50 -0.17 0.00 -0.71 0.00 0.00 33.22 31.08 1eax n MET 117 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1eax s VAL 118 N -3.01 0.59 -0.17 2.03 1.01 -1.03 -3.81 120.40 116.02 1eax s VAL 118 Ca 0.08 -0.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.43 1eax s VAL 118 Cb 0.16 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.60 1eax s VAL 118 CO 0.83 -0.08 0.48 -0.60 0.00 0.00 0.00 175.10 175.74 1eax s ARG 119 N 1.84 0.59 0.55 2.72 3.52 -0.74 -0.96 118.95 126.46 1eax s ARG 119 Ca 0.00 0.62 -0.18 0.00 -0.13 0.00 0.00 55.73 56.05 1eax s ARG 119 Cb -0.16 0.29 -0.06 0.00 -1.56 0.00 0.00 34.95 33.46 1eax s ARG 119 CO -0.07 -0.08 1.05 -1.25 -0.81 0.00 0.00 175.30 174.14 1eax s PRO 120 N 0.13 3.52 0.37 5.12 0.04 -1.26 -2.50 135.00 140.42 1eax s PRO 120 Ca -0.01 1.28 -0.08 0.00 0.04 0.00 0.00 61.00 62.23 1eax s PRO 120 Cb -0.03 -2.06 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 1eax s PRO 120 CO 0.01 -0.66 0.70 -1.50 0.04 0.00 0.00 177.00 175.59 1eax s ILE 121 N -2.24 4.87 0.24 0.56 -1.16 -0.42 -4.87 121.20 118.18 1eax s ILE 121 Ca 0.65 0.40 -0.25 0.00 -0.51 0.00 0.00 60.65 60.94 1eax s ILE 121 Cb -0.16 -3.74 -0.09 0.00 0.61 0.00 0.00 42.46 39.08 1eax s ILE 121 CO 0.30 -0.47 0.84 0.00 -2.81 0.00 0.00 174.94 172.80 1eax s LEU 123 N -1.62 4.40 0.33 0.00 1.43 -1.26 -0.73 118.68 121.23 1eax s LEU 123 Ca 0.43 0.68 -0.23 0.00 -1.03 0.00 0.00 54.13 53.98 1eax s LEU 123 Cb -0.21 -2.33 -0.10 0.00 0.03 0.00 0.00 46.19 43.58 1eax s LEU 123 CO 0.25 0.33 0.89 -2.16 0.23 0.00 0.00 176.35 175.89 1eax s PRO 124 N -0.82 4.38 0.72 1.29 0.04 -1.26 -4.95 135.00 134.40 1eax s PRO 124 Ca 0.19 1.14 -0.14 0.00 0.04 0.00 0.00 61.00 62.22 1eax s PRO 124 Cb -0.14 -2.61 0.03 0.00 0.04 0.00 0.00 34.50 31.82 1eax s PRO 124 CO 0.08 0.20 1.16 -0.51 0.04 0.00 0.00 177.00 177.97 1eax s ASP 125 N -1.83 4.46 0.48 6.66 -0.00 -1.26 -4.63 116.67 120.55 1eax s ASP 125 Ca 0.52 2.17 0.19 0.00 -0.00 0.00 0.00 52.55 55.44 1eax s ASP 125 Cb -0.15 -2.57 1.21 0.00 -0.00 0.00 0.00 42.92 41.42 1eax s ASP 125 CO 0.20 -2.08 1.99 0.00 -0.00 0.00 0.00 175.17 175.28 1eax h ALA 126 N -0.36 2.25 -0.00 5.23 0.00 -1.94 -1.59 119.26 122.84 1eax h ALA 126 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1eax h ALA 126 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1eax h ALA 126 CO 0.51 -0.40 -0.12 -1.13 0.00 0.00 0.00 179.25 178.11 1eax n SER 127 N -4.44 0.46 -4.73 0.00 3.41 -1.26 -4.57 113.62 102.49 1eax n SER 127 Ca 0.10 -0.54 -0.41 0.00 -0.26 0.00 0.00 58.87 57.76 1eax n SER 127 Cb 0.49 -0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1eax n SER 127 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1eax s HIS 128 N -2.50 3.56 -0.21 7.33 5.04 -0.60 -5.02 115.29 122.88 1eax s HIS 128 Ca 0.28 1.54 -0.06 0.00 -1.54 0.00 0.00 55.06 55.28 1eax s HIS 128 Cb 0.20 -3.31 -0.03 0.00 0.04 0.00 0.00 32.58 29.49 1eax s HIS 128 CO 0.48 -0.75 0.02 0.08 -2.34 0.00 0.00 174.74 172.24 1eax s VAL 129 N 0.03 4.11 -0.47 0.89 1.01 -1.26 -4.83 120.40 119.88 1eax s VAL 129 Ca 0.51 -0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 1eax s VAL 129 Cb -0.29 -2.87 0.03 0.00 0.00 0.00 0.00 36.38 33.24 1eax s VAL 129 CO 0.34 0.41 0.74 -0.36 0.00 0.00 0.00 175.10 176.23 1eax s PHE 130 N 1.13 2.99 0.51 5.22 0.08 -1.26 -5.02 117.98 121.62 1eax s PHE 130 Ca 0.03 -0.04 -0.22 0.00 0.12 0.00 0.00 56.93 56.83 1eax s PHE 130 Cb -0.14 -3.62 -0.06 0.00 -0.57 0.00 0.00 43.02 38.63 1eax s PHE 130 CO 0.02 -1.02 1.20 -1.25 -0.10 0.00 0.00 175.22 174.07 1eax s PRO 131 N 3.16 3.46 0.31 0.24 0.04 -1.26 -4.97 135.00 135.97 1eax s PRO 131 Ca 0.26 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 62.85 1eax s PRO 131 Cb -0.14 -2.24 -0.12 0.00 0.04 0.00 0.00 34.50 32.04 1eax s PRO 131 CO 0.19 -0.82 1.42 0.00 0.04 0.00 0.00 177.00 177.83 1eax n ALA 132 N -0.88 1.66 0.00 8.56 0.00 -1.26 -1.75 120.51 126.84 1eax n ALA 132 Ca 0.10 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1eax n ALA 132 Cb 0.48 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1eax n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eax n GLY 133 N 1.45 2.27 3.76 0.00 0.00 0.56 -4.95 105.19 108.28 1eax n GLY 133 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1eax n GLY 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1eax s LYS 134 N -0.72 4.45 0.08 1.61 2.20 -0.72 -4.59 119.74 122.06 1eax s LYS 134 Ca 0.00 2.04 -0.30 0.00 -0.36 0.00 0.00 55.97 57.35 1eax s LYS 134 Cb 0.00 -3.15 -0.05 0.00 -1.51 0.00 0.00 37.83 33.12 1eax s LYS 134 CO 0.00 -0.09 1.03 0.00 -0.36 0.00 0.00 175.35 175.94 1eax s ALA 135 N -0.75 3.27 0.16 3.13 0.00 -1.26 -1.50 121.76 124.80 1eax s ALA 135 Ca 0.50 0.66 -0.02 0.00 0.00 0.00 0.00 51.96 53.09 1eax s ALA 135 Cb -0.36 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.39 1eax s ALA 135 CO 0.45 -0.19 0.12 0.96 0.00 0.00 0.00 175.76 177.11 1eax s ILE 136 N 0.41 0.06 -0.05 0.00 -0.00 0.61 -4.67 121.20 117.56 1eax s ILE 136 Ca 0.51 -1.85 0.04 0.00 -0.00 0.00 0.00 60.65 59.35 1eax s ILE 136 Cb -0.25 -2.16 -0.02 0.00 -0.00 0.00 0.00 42.46 40.02 1eax s ILE 136 CO 0.30 -0.28 -0.16 0.26 -0.00 0.00 0.00 174.94 175.06 1eax s TRP 137 N -4.07 2.66 -0.00 1.37 0.52 0.11 -0.66 118.94 118.87 1eax s TRP 137 Ca 0.28 -0.22 0.05 0.00 0.02 0.00 0.00 56.10 56.23 1eax s TRP 137 Cb 0.06 -1.62 -0.03 0.00 -1.15 0.00 0.00 33.47 30.73 1eax s TRP 137 CO 0.05 0.14 -0.15 0.54 0.02 0.00 0.00 176.95 177.55 1eax s VAL 138 N -0.67 3.02 0.04 4.03 0.11 -0.15 -0.75 120.40 126.02 1eax s VAL 138 Ca 0.10 -0.94 0.01 0.00 -2.93 0.00 0.00 61.98 58.23 1eax s VAL 138 Cb -0.11 -2.24 -0.02 0.00 -1.53 0.00 0.00 36.38 32.48 1eax s VAL 138 CO 0.01 0.45 -0.06 0.42 -3.33 0.00 0.00 175.10 172.59 1eax s THR 139 N -0.86 0.38 0.00 5.04 -4.23 -1.26 -0.84 115.64 113.88 1eax s THR 139 Ca 0.14 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1eax s THR 139 Cb -0.11 -0.58 0.00 0.00 1.34 0.00 0.00 72.50 73.15 1eax s THR 139 CO 0.04 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 1eax n GLY 140 N 1.37 0.13 1.20 3.99 0.00 -0.67 -4.73 105.19 106.48 1eax n GLY 140 Ca -0.22 -1.10 0.08 0.00 0.00 0.00 0.00 46.02 44.77 1eax n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1eax n TRP 141 N -0.61 1.22 -0.99 1.61 8.01 -1.26 -1.54 117.44 123.88 1eax n TRP 141 Ca 0.00 -0.75 -0.19 0.00 -1.31 0.00 0.00 57.50 55.25 1eax n TRP 141 Cb 0.00 -0.31 0.15 0.00 -2.01 0.00 0.00 31.31 29.15 1eax n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1eax n GLY 142 N 0.16 -2.41 3.66 6.99 0.00 -1.25 -2.24 105.19 110.09 1eax n GLY 142 Ca 0.22 -1.52 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 1eax n GLY 142 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1eax n HIS 143 N -3.85 1.66 1.08 1.61 8.25 0.46 -2.68 115.22 121.76 1eax n HIS 143 Ca 0.10 0.50 0.12 0.00 -0.26 0.00 0.00 57.72 58.19 1eax n HIS 143 Cb 0.37 -2.30 0.20 0.00 1.12 0.00 0.00 29.99 29.39 1eax n HIS 143 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1eax n THR 144 N -0.58 0.02 -3.64 1.59 -2.24 -0.82 -1.08 114.28 107.54 1eax n THR 144 Ca 0.09 -0.45 -0.16 0.00 -2.27 0.00 0.00 64.05 61.26 1eax n THR 144 Cb 0.41 1.25 -0.07 0.00 -2.10 0.00 0.00 70.33 69.82 1eax n THR 144 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1eax s GLN 145 N -1.98 0.85 0.22 -0.78 -0.21 -1.26 -4.33 119.66 112.17 1eax s GLN 145 Ca 0.31 0.19 -0.31 0.00 0.02 0.00 0.00 55.36 55.57 1eax s GLN 145 Cb 0.20 0.39 -0.11 0.00 1.00 0.00 0.00 33.01 34.49 1eax s GLN 145 CO 0.31 -0.23 1.64 -0.47 -2.12 0.00 0.00 175.29 174.42 1eax s TYR 146 N -0.96 2.90 0.00 0.91 5.04 -1.26 0.10 117.35 124.08 1eax s TYR 146 Ca -0.10 0.56 0.00 0.00 -2.44 0.00 0.00 57.07 55.09 1eax s TYR 146 Cb -0.03 -4.06 0.00 0.00 0.35 0.00 0.00 41.96 38.23 1eax s TYR 146 CO 0.06 -3.84 0.00 0.41 -1.34 0.00 0.00 175.55 170.85 1eax n GLY 147 N 3.34 0.42 0.00 8.97 0.00 -1.26 -4.98 105.19 111.68 1eax n GLY 147 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1eax n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eax n GLY 148 N -1.76 1.38 3.33 -0.02 0.00 0.12 -5.11 105.19 103.13 1eax n GLY 148 Ca 0.00 -1.62 -0.24 0.00 0.00 0.00 0.00 46.02 44.17 1eax n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1eax s THR 150 N 1.86 1.89 0.85 2.61 -4.23 -1.26 -4.90 115.64 112.46 1eax s THR 150 Ca 0.00 -1.80 -0.10 0.00 -1.18 0.00 0.00 61.69 58.61 1eax s THR 150 Cb 0.00 -1.80 0.11 0.00 1.34 0.00 0.00 72.50 72.14 1eax s THR 150 CO 0.00 -0.17 1.12 -0.83 -0.54 0.00 0.00 174.62 174.20 1eax s GLY 151 N -2.37 1.69 -0.10 3.99 0.00 -1.26 -1.94 107.32 107.33 1eax s GLY 151 Ca 0.13 0.46 -0.12 0.00 0.00 0.00 0.00 44.72 45.19 1eax s GLY 151 CO 0.06 0.84 0.29 0.00 0.00 0.00 0.00 173.10 174.30 1eax s ALA 152 N -2.75 3.70 0.06 3.20 0.00 -0.95 -4.84 121.76 120.18 1eax s ALA 152 Ca 0.64 -0.42 -0.16 0.00 0.00 0.00 0.00 51.96 52.02 1eax s ALA 152 Cb -0.20 -2.28 -0.18 0.00 0.00 0.00 0.00 23.12 20.46 1eax s ALA 152 CO 0.57 0.35 1.24 -0.07 0.00 0.00 0.00 175.76 177.86 1eax h LEU 153 N 5.60 0.71 -9.37 0.00 3.38 -1.94 -3.44 115.31 110.24 1eax h LEU 153 Ca -0.48 -0.64 -0.58 0.00 0.09 0.00 0.00 57.88 56.26 1eax h LEU 153 Cb 1.20 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.66 1eax h LEU 153 CO 0.67 1.24 -0.20 -0.63 0.09 0.00 0.00 178.44 179.60 1eax s ILE 154 N -3.68 5.19 0.12 1.22 -1.09 -1.26 -0.68 121.20 121.03 1eax s ILE 154 Ca -0.12 0.83 -0.35 0.00 -2.23 0.00 0.00 60.65 58.77 1eax s ILE 154 Cb 0.06 -3.75 -0.16 0.00 -1.58 0.00 0.00 42.46 37.03 1eax s ILE 154 CO 0.85 0.38 1.33 -0.11 -1.23 0.00 0.00 174.94 176.16 1eax n LEU 155 N 3.36 1.88 -4.79 2.97 7.94 -0.50 -4.84 117.00 123.01 1eax n LEU 155 Ca -0.09 1.12 -0.27 0.00 -1.11 0.00 0.00 56.01 55.66 1eax n LEU 155 Cb 0.52 -1.24 -0.06 0.00 0.53 0.00 0.00 43.42 43.17 1eax n LEU 155 CO 0.41 -0.98 -0.23 -1.10 -1.11 0.00 0.00 177.39 174.38 1eax s GLN 156 N 0.29 2.87 0.05 1.96 -1.52 -0.59 -0.88 119.66 121.84 1eax s GLN 156 Ca 0.80 -0.85 0.04 0.00 -1.95 0.00 0.00 55.36 53.39 1eax s GLN 156 Cb -0.88 -2.64 -0.03 0.00 -0.22 0.00 0.00 33.01 29.24 1eax s GLN 156 CO 0.47 0.50 -0.11 -1.59 -0.25 0.00 0.00 175.29 174.30 1eax s LYS 157 N -2.99 0.69 -0.09 2.91 -2.85 -0.25 -1.67 119.74 115.50 1eax s LYS 157 Ca 0.30 -0.83 -0.11 0.00 -1.00 0.00 0.00 55.97 54.33 1eax s LYS 157 Cb -0.10 -0.60 0.03 0.00 -2.06 0.00 0.00 37.83 35.10 1eax s LYS 157 CO 0.23 0.13 0.29 0.20 0.10 0.00 0.00 175.35 176.30 1eax s GLY 158 N -1.58 -0.19 -0.19 0.59 0.00 -0.02 -1.28 107.32 104.65 1eax s GLY 158 Ca -0.05 0.68 -0.13 0.00 0.00 0.00 0.00 44.72 45.22 1eax s GLY 158 CO 0.01 0.55 0.26 1.85 0.00 0.00 0.00 173.10 175.77 1eax s GLU 159 N -0.22 4.19 0.20 2.90 2.12 -1.26 -0.98 118.70 125.65 1eax s GLU 159 Ca -0.03 -0.02 0.01 0.00 0.36 0.00 0.00 54.97 55.29 1eax s GLU 159 Cb -0.03 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 1eax s GLU 159 CO 0.01 0.15 0.04 0.96 -0.54 0.00 0.00 175.26 175.88 1eax s ILE 160 N 0.75 0.59 0.06 -3.70 -4.36 0.17 -4.94 121.20 109.77 1eax s ILE 160 Ca 0.14 -1.98 0.08 0.00 -0.26 0.00 0.00 60.65 58.62 1eax s ILE 160 Cb -0.13 -2.29 -0.03 0.00 1.25 0.00 0.00 42.46 41.27 1eax s ILE 160 CO 0.04 -0.31 -0.21 -0.13 0.24 0.00 0.00 174.94 174.56 1eax s ARG 161 N -3.97 1.36 0.24 0.37 0.52 -1.06 -0.29 118.95 116.12 1eax s ARG 161 Ca 0.29 -1.01 -0.30 0.00 -0.52 0.00 0.00 55.73 54.18 1eax s ARG 161 Cb 0.07 -1.52 -0.10 0.00 0.52 0.00 0.00 34.95 33.91 1eax s ARG 161 CO 0.07 0.38 1.51 0.08 0.02 0.00 0.00 175.30 177.36 1eax s VAL 162 N -0.89 2.52 -0.02 3.52 1.01 -0.57 -0.88 120.40 125.10 1eax s VAL 162 Ca 0.08 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.47 1eax s VAL 162 Cb -0.09 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 1eax s VAL 162 CO 0.02 0.06 0.04 -0.63 0.00 0.00 0.00 175.10 174.59 1eax s ILE 163 N 0.29 4.44 0.21 2.22 1.01 -0.44 -0.32 121.20 128.60 1eax s ILE 163 Ca 0.63 -0.46 -0.32 0.00 0.00 0.00 0.00 60.65 60.50 1eax s ILE 163 Cb -0.44 -2.98 -0.14 0.00 0.01 0.00 0.00 42.46 38.91 1eax s ILE 163 CO 0.41 0.40 1.33 -3.20 0.00 0.00 0.00 174.94 173.88 1eax n ASN 164 N 1.43 2.27 -0.25 3.58 2.85 -1.26 -4.57 115.26 119.30 1eax n ASN 164 Ca -0.15 1.14 -0.02 0.00 -0.11 0.00 0.00 54.58 55.44 1eax n ASN 164 Cb 0.53 -1.35 0.17 0.00 1.24 0.00 0.00 39.78 40.36 1eax n ASN 164 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 1eax h GLN 165 N 4.01 1.08 -0.54 1.20 5.75 -1.97 -0.85 115.11 123.78 1eax h GLN 165 Ca -0.44 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 57.91 1eax h GLN 165 Cb 1.30 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.61 1eax h GLN 165 CO 0.74 0.79 0.24 1.15 -2.65 0.00 0.00 178.83 179.10 1eax h THR 166 N 1.08 1.21 -0.38 2.39 2.02 -1.99 0.15 112.91 117.40 1eax h THR 166 Ca 0.27 -0.63 0.01 0.00 0.77 0.00 0.00 66.41 66.83 1eax h THR 166 Cb 0.03 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1eax h THR 166 CO -0.04 0.24 0.24 0.74 0.37 0.00 0.00 175.52 177.07 1eax h THR 167 N 0.73 1.08 -0.07 3.16 2.02 -1.83 -1.56 112.91 116.45 1eax h THR 167 Ca 0.18 -0.17 0.03 0.00 0.77 0.00 0.00 66.41 67.23 1eax h THR 167 Cb 0.16 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 1eax h THR 167 CO -0.02 0.09 -0.14 0.00 0.37 0.00 0.00 175.52 175.82 1eax h GLU 169 N -0.21 0.91 0.00 0.00 5.08 -0.76 -2.00 114.58 117.60 1eax h GLU 169 Ca 0.07 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 1eax h GLU 169 Cb 0.31 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1eax h GLU 169 CO -0.19 0.60 -0.58 -0.91 -1.00 0.00 0.00 179.01 176.94 1eax h ASN 170 N 0.94 0.00 0.71 1.42 2.35 -0.67 -2.95 115.58 117.37 1eax h ASN 170 Ca 0.36 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.96 1eax h ASN 170 Cb 0.21 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1eax h ASN 170 CO -0.13 0.58 -0.72 -0.07 -1.65 0.00 0.00 177.43 175.44 1eax h LEU 171 N 0.00 0.01 -6.23 1.61 3.38 -0.46 -3.36 115.31 110.27 1eax h LEU 171 Ca -0.01 -0.01 -0.58 0.00 0.09 0.00 0.00 57.88 57.37 1eax h LEU 171 Cb 1.19 -0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.53 1eax h LEU 171 CO 0.07 0.73 -0.85 0.18 0.09 0.00 0.00 178.44 178.67 1eax n LEU 172 N -3.68 1.70 -4.66 1.67 4.77 -0.94 -4.96 117.00 110.89 1eax n LEU 172 Ca -0.01 -4.98 -0.45 0.00 -0.03 0.00 0.00 56.01 50.54 1eax n LEU 172 Cb 0.70 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.77 1eax n LEU 172 CO 0.44 2.01 0.97 -0.81 -1.33 0.00 0.00 177.39 178.67 1eax n PRO 173 N 1.43 1.94 -1.75 3.23 -0.04 -1.12 -2.27 135.00 136.43 1eax n PRO 173 Ca 0.25 0.69 -0.18 0.00 -0.04 0.00 0.00 63.50 64.22 1eax n PRO 173 Cb 0.46 -2.32 -0.06 0.00 -0.04 0.00 0.00 33.50 31.54 1eax n PRO 173 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1eax n GLN 174 N 1.92 -1.30 0.00 0.54 1.13 -1.26 -4.83 117.38 113.58 1eax n GLN 174 Ca 0.12 1.06 0.00 0.00 -1.94 0.00 0.00 57.00 56.24 1eax n GLN 174 Cb 0.31 -5.39 0.00 0.00 0.11 0.00 0.00 30.24 25.27 1eax n GLN 174 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1eax n GLN 175 N -2.55 3.23 -3.60 -1.09 6.02 -0.96 -5.04 117.38 113.39 1eax n GLN 175 Ca -0.19 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.41 1eax n GLN 175 Cb 0.61 -0.54 -0.11 0.00 1.02 0.00 0.00 30.24 31.21 1eax n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1eax s ILE 176 N -0.84 5.06 0.40 5.09 1.01 -1.24 -5.01 121.20 125.66 1eax s ILE 176 Ca 0.00 -0.12 0.08 0.00 0.00 0.00 0.00 60.65 60.61 1eax s ILE 176 Cb 0.00 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.97 1eax s ILE 176 CO 0.00 0.13 0.55 0.42 0.00 0.00 0.00 174.94 176.04 1eax s THR 177 N 1.70 3.21 -0.74 2.92 -4.23 -1.26 -4.94 115.64 112.30 1eax s THR 177 Ca 0.06 -1.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.71 1eax s THR 177 Cb -0.17 -3.08 0.13 0.00 1.34 0.00 0.00 72.50 70.73 1eax s THR 177 CO 0.09 -0.03 1.42 -2.65 -0.54 0.00 0.00 174.62 172.91 1eax n PRO 178 N -1.81 0.07 0.01 3.99 -0.02 -1.26 -1.02 135.00 134.96 1eax n PRO 178 Ca 0.06 0.43 0.14 0.00 -2.02 0.00 0.00 63.50 62.11 1eax n PRO 178 Cb 0.59 -1.67 0.57 0.00 -0.02 0.00 0.00 33.50 32.97 1eax n PRO 178 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1eax n ARG 179 N -1.80 0.02 -4.07 -0.52 3.00 -1.26 -4.88 116.66 107.15 1eax n ARG 179 Ca 0.01 0.01 -0.24 0.00 -0.01 0.00 0.00 57.85 57.62 1eax n ARG 179 Cb 0.11 -1.52 -0.05 0.00 0.00 0.00 0.00 32.46 31.00 1eax n ARG 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.63 175.99 1eax s MET 180 N -3.01 3.01 -0.07 5.56 -1.94 -0.19 -0.71 119.30 121.95 1eax s MET 180 Ca 0.13 -0.89 -0.04 0.00 -1.71 0.00 0.00 55.69 53.18 1eax s MET 180 Cb 0.18 -2.67 0.03 0.00 2.01 0.00 0.00 34.83 34.38 1eax s MET 180 CO 0.55 0.46 0.17 1.41 -0.01 0.00 0.00 175.02 177.60 1eax s MET 181 N -3.42 0.14 0.03 2.03 1.75 0.19 -4.83 119.30 115.19 1eax s MET 181 Ca 0.32 0.34 -0.21 0.00 -1.25 0.00 0.00 55.69 54.88 1eax s MET 181 Cb -0.09 -0.07 -0.06 0.00 2.84 0.00 0.00 34.83 37.45 1eax s MET 181 CO 0.25 -0.11 0.63 0.00 -0.65 0.00 0.00 175.02 175.14 1eax s VAL 183 N -0.35 -0.05 -0.53 0.00 1.01 -0.72 -1.33 120.40 118.43 1eax s VAL 183 Ca 0.32 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1eax s VAL 183 Cb -0.19 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.06 1eax s VAL 183 CO 0.19 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1eax n GLY 184 N 4.04 -0.05 2.92 4.51 0.00 -0.06 -3.24 105.19 113.31 1eax n GLY 184 Ca -0.25 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1eax n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1eax s PHE 184 N -4.00 -0.05 0.48 1.61 0.08 -1.26 -2.56 117.98 112.28 1eax s PHE 184 Ca 0.00 0.12 0.24 0.00 0.12 0.00 0.00 56.93 57.41 1eax s PHE 184 Cb 0.00 0.02 1.46 0.00 -0.57 0.00 0.00 43.02 43.92 1eax s PHE 184 CO 0.00 -0.02 2.12 -0.07 -0.10 0.00 0.00 175.22 177.14 1eax h LEU 185 N 6.08 0.00 -0.06 -0.37 3.38 -1.97 -0.97 115.31 121.40 1eax h LEU 185 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1eax h LEU 185 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1eax h LEU 185 CO 0.48 0.09 -0.02 -1.54 0.09 0.00 0.00 178.44 177.54 1eax n SER 186 N -3.92 0.12 0.00 -0.43 3.41 -1.26 0.21 113.62 111.75 1eax n SER 186 Ca -0.02 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.18 1eax n SER 186 Cb 0.18 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1eax n SER 186 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1eax n GLY 186 N 1.23 -0.31 1.88 5.00 0.00 -0.37 -4.31 105.19 108.31 1eax n GLY 186 Ca 0.16 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1eax n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eax n GLY 187 N 0.00 2.37 3.10 -0.02 0.00 -0.73 -4.58 105.19 105.33 1eax n GLY 187 Ca 0.00 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 1eax n GLY 187 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eax s VAL 188 N 0.00 1.49 0.02 1.61 1.01 -1.26 -3.57 120.40 119.70 1eax s VAL 188 Ca 0.00 -0.69 -0.28 0.00 0.00 0.00 0.00 61.98 61.01 1eax s VAL 188 Cb 0.00 -1.32 0.10 0.00 0.00 0.00 0.00 36.38 35.15 1eax s VAL 188 CO 0.00 0.43 0.94 -0.62 0.00 0.00 0.00 175.10 175.85 1eax s ASP 189 N 0.53 -0.29 0.76 3.32 2.15 -0.84 -4.51 116.67 117.78 1eax s ASP 189 Ca -0.16 -0.10 -0.09 0.00 0.43 0.00 0.00 52.55 52.62 1eax s ASP 189 Cb -0.17 0.39 0.07 0.00 -0.30 0.00 0.00 42.92 42.91 1eax s ASP 189 CO 0.06 -0.65 1.10 -0.94 -0.17 0.00 0.00 175.17 174.56 1eax s SER 190 N -2.59 4.67 0.34 -0.34 1.04 -1.26 -0.59 113.70 114.97 1eax s SER 190 Ca 0.07 0.63 -0.09 0.00 0.48 0.00 0.00 55.95 57.04 1eax s SER 190 Cb -0.01 -1.20 0.04 0.00 0.10 0.00 0.00 66.02 64.94 1eax s SER 190 CO -0.06 -1.75 0.61 0.00 0.98 0.00 0.00 173.24 173.03 1eax n GLN 192 N -0.50 0.93 0.00 0.00 7.27 -1.26 -0.89 117.38 122.92 1eax n GLN 192 Ca -0.05 0.34 0.00 0.00 0.07 0.00 0.00 57.00 57.36 1eax n GLN 192 Cb 0.54 -1.96 0.00 0.00 2.41 0.00 0.00 30.24 31.23 1eax n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1eax n GLY 193 N 2.48 1.91 0.09 1.69 0.00 -1.26 -0.40 105.19 109.69 1eax n GLY 193 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1eax n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1eax h ASP 194 N 0.00 0.00 -2.01 1.61 3.32 -1.31 -3.34 116.42 114.69 1eax h ASP 194 Ca 0.00 -0.15 -0.63 0.00 0.02 0.00 0.00 57.03 56.27 1eax h ASP 194 Cb 0.00 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.66 1eax h ASP 194 CO 0.00 0.07 -0.02 -1.20 -1.72 0.00 0.00 179.24 176.37 1eax n SER 195 N -2.29 0.64 0.00 6.45 7.64 -1.26 -1.88 113.62 122.91 1eax n SER 195 Ca 0.03 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.07 1eax n SER 195 Cb 0.47 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.48 1eax n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1eax n GLY 196 N 1.52 3.23 3.79 0.23 0.00 -0.08 -0.21 105.19 113.67 1eax n GLY 196 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1eax n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1eax s GLY 197 N -2.12 1.61 0.23 -0.02 0.00 -0.79 -3.43 107.32 102.79 1eax s GLY 197 Ca 0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 44.72 44.31 1eax s GLY 197 CO 0.00 0.19 0.59 2.56 0.00 0.00 0.00 173.10 176.44 1eax s PRO 198 N -5.17 3.90 -0.11 2.90 0.04 -1.26 -1.07 135.00 134.23 1eax s PRO 198 Ca 0.62 0.42 -0.21 0.00 0.04 0.00 0.00 61.00 61.87 1eax s PRO 198 Cb -0.15 -2.68 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 1eax s PRO 198 CO 0.54 0.33 0.61 -0.51 0.04 0.00 0.00 177.00 178.01 1eax s LEU 199 N -2.62 4.27 -0.22 -3.56 1.43 -0.37 -4.15 118.68 113.46 1eax s LEU 199 Ca 0.46 0.98 -0.07 0.00 -1.03 0.00 0.00 54.13 54.47 1eax s LEU 199 Cb -0.12 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 1eax s LEU 199 CO 0.20 -0.11 0.07 -0.44 0.23 0.00 0.00 176.35 176.30 1eax s SER 200 N 0.82 5.40 -0.14 2.29 0.01 0.07 -1.20 113.70 120.95 1eax s SER 200 Ca 0.32 -0.06 0.03 0.00 1.31 0.00 0.00 55.95 57.54 1eax s SER 200 Cb -0.16 -1.95 0.01 0.00 0.21 0.00 0.00 66.02 64.13 1eax s SER 200 CO 0.14 0.07 -0.22 -0.55 0.41 0.00 0.00 173.24 173.09 1eax s SER 201 N 0.99 3.11 -0.22 2.44 0.15 0.09 -0.71 113.70 119.55 1eax s SER 201 Ca 0.04 -0.60 -0.29 0.00 0.70 0.00 0.00 55.95 55.80 1eax s SER 201 Cb -0.14 -1.44 -0.00 0.00 -1.71 0.00 0.00 66.02 62.73 1eax s SER 201 CO 0.03 0.08 1.18 -0.69 1.20 0.00 0.00 173.24 175.04 1eax s VAL 202 N 0.80 4.42 0.00 4.45 1.01 -1.26 -1.13 120.40 128.68 1eax s VAL 202 Ca -0.07 1.69 0.00 0.00 0.00 0.00 0.00 61.98 63.60 1eax s VAL 202 Cb -0.16 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.06 1eax s VAL 202 CO -0.02 -0.23 0.00 -0.62 0.00 0.00 0.00 175.10 174.23 1eax n GLU 203 N 6.63 1.49 0.11 2.72 -0.58 -0.15 -4.92 120.64 125.95 1eax n GLU 203 Ca 0.13 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 57.03 1eax n GLU 203 Cb 0.46 0.00 0.69 0.00 -0.57 0.00 0.00 31.44 32.02 1eax n GLU 203 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1eax h ALA 204 N -0.22 2.24 -0.21 0.62 0.00 -1.96 -1.33 119.26 118.40 1eax h ALA 204 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1eax h ALA 204 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1eax h ALA 204 CO 0.00 -0.39 0.00 -0.40 0.00 0.00 0.00 179.25 178.46 1eax n ASP 204 N -4.35 3.40 0.00 0.00 3.85 -1.26 -4.96 116.55 113.23 1eax n ASP 204 Ca 0.04 -2.87 0.00 0.00 -0.71 0.00 0.00 54.79 51.25 1eax n ASP 204 Cb 0.40 -0.46 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 1eax n ASP 204 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1eax n GLY 205 N -0.57 1.80 3.77 6.12 0.00 -0.50 -5.04 105.19 110.76 1eax n GLY 205 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 1eax n GLY 205 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1eax s ARG 206 N -0.59 3.73 -0.18 1.61 0.52 -1.26 -4.57 118.95 118.21 1eax s ARG 206 Ca 0.00 1.90 -0.11 0.00 -0.52 0.00 0.00 55.73 56.99 1eax s ARG 206 Cb 0.00 -2.46 -0.05 0.00 0.52 0.00 0.00 34.95 32.96 1eax s ARG 206 CO 0.00 -0.61 0.19 0.42 0.02 0.00 0.00 175.30 175.32 1eax s ILE 207 N -1.46 5.37 0.10 1.52 1.01 -1.26 -0.98 121.20 125.50 1eax s ILE 207 Ca 0.63 0.33 0.07 0.00 0.00 0.00 0.00 60.65 61.69 1eax s ILE 207 Cb -0.32 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1eax s ILE 207 CO 0.39 0.43 -0.13 -0.36 0.00 0.00 0.00 174.94 175.27 1eax s PHE 208 N 0.35 2.67 -0.18 3.97 0.40 -0.28 -2.13 117.98 122.79 1eax s PHE 208 Ca 0.12 -0.19 -0.26 0.00 -0.60 0.00 0.00 56.93 55.99 1eax s PHE 208 Cb -0.12 -1.41 -0.01 0.00 0.51 0.00 0.00 43.02 41.99 1eax s PHE 208 CO 0.00 0.40 0.89 -1.14 0.70 0.00 0.00 175.22 176.08 1eax s GLN 209 N -2.12 4.30 -0.04 0.44 0.74 0.09 -0.73 119.66 122.34 1eax s GLN 209 Ca 0.20 1.12 0.18 0.00 0.05 0.00 0.00 55.36 56.91 1eax s GLN 209 Cb -0.11 -3.59 -0.21 0.00 1.10 0.00 0.00 33.01 30.21 1eax s GLN 209 CO 0.12 -0.39 0.54 0.00 -0.55 0.00 0.00 175.29 175.01 1eax n ALA 210 N 5.45 1.93 -3.63 1.58 0.00 -0.34 -4.41 120.51 121.08 1eax n ALA 210 Ca 0.06 -0.78 0.08 0.00 0.00 0.00 0.00 53.44 52.81 1eax n ALA 210 Cb 0.48 -0.69 0.01 0.00 0.00 0.00 0.00 19.45 19.25 1eax n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eax n GLY 211 N 1.48 0.61 3.16 0.00 0.00 -1.26 -2.40 105.19 106.78 1eax n GLY 211 Ca -0.16 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 1eax n GLY 211 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eax s VAL 212 N -2.15 1.76 0.15 1.61 1.01 -0.20 -1.23 120.40 121.34 1eax s VAL 212 Ca 0.18 -0.85 -0.32 0.00 0.00 0.00 0.00 61.98 60.99 1eax s VAL 212 Cb -0.01 -1.53 -0.11 0.00 0.00 0.00 0.00 36.38 34.72 1eax s VAL 212 CO 0.02 0.49 1.80 0.52 0.00 0.00 0.00 175.10 177.93 1eax n VAL 213 N 3.55 0.26 0.03 2.92 0.31 -0.23 -0.89 118.33 124.27 1eax n VAL 213 Ca -0.20 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1eax n VAL 213 Cb 0.53 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 1eax n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1eax n SER 214 N 5.14 0.44 -3.44 4.52 2.88 -0.94 -0.90 113.62 121.32 1eax n SER 214 Ca 0.17 0.08 -0.08 0.00 -1.33 0.00 0.00 58.87 57.72 1eax n SER 214 Cb 0.36 -0.11 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1eax n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1eax s TRP 215 N -1.45 -0.05 0.08 0.66 1.48 -0.78 -4.91 118.94 113.96 1eax s TRP 215 Ca 0.00 -0.50 -0.27 0.00 -1.06 0.00 0.00 56.10 54.27 1eax s TRP 215 Cb 0.00 0.77 0.08 0.00 -1.16 0.00 0.00 33.47 33.16 1eax s TRP 215 CO 0.00 -1.36 0.90 0.20 -4.06 0.00 0.00 176.95 172.62 1eax s GLY 216 N -3.00 -0.37 -0.56 3.67 0.00 -1.26 -0.28 107.32 105.53 1eax s GLY 216 Ca 0.13 0.57 -0.19 0.00 0.00 0.00 0.00 44.72 45.23 1eax s GLY 216 CO 0.09 0.17 0.67 -0.35 0.00 0.00 0.00 173.10 173.68 1eax s ASP 217 N -2.71 6.20 0.60 1.64 -1.08 -1.26 -4.91 116.67 115.15 1eax s ASP 217 Ca 0.08 -1.22 0.00 0.00 -0.52 0.00 0.00 52.55 50.89 1eax s ASP 217 Cb -0.01 -2.30 0.00 0.00 -1.46 0.00 0.00 42.92 39.15 1eax s ASP 217 CO -0.04 -1.02 0.00 0.61 0.52 0.00 0.00 175.17 175.24 1eax n GLY 219 N 5.24 -0.15 2.92 2.66 0.00 -1.26 -4.76 105.19 109.84 1eax n GLY 219 Ca -0.08 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 1eax n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1eax n ALA 221 N 4.20 -0.18 -1.92 0.00 0.00 -1.26 -4.62 120.51 116.72 1eax n ALA 221 Ca -0.26 0.19 -0.33 0.00 0.00 0.00 0.00 53.44 53.04 1eax n ALA 221 Cb 0.52 -1.55 -0.06 0.00 0.00 0.00 0.00 19.45 18.36 1eax n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1eax s GLN 221 N -2.90 4.14 0.32 0.00 -0.21 -1.26 -1.77 119.66 117.98 1eax s GLN 221 Ca 0.00 0.96 -0.29 0.00 0.02 0.00 0.00 55.36 56.05 1eax s GLN 221 Cb 0.00 -2.25 -0.12 0.00 1.00 0.00 0.00 33.01 31.63 1eax s GLN 221 CO 0.00 0.01 1.40 -2.13 -2.12 0.00 0.00 175.29 172.45 1eax n ARG 222 N -0.63 2.30 -1.39 2.91 0.63 -1.26 -2.19 116.66 117.03 1eax n ARG 222 Ca 0.06 0.81 -0.13 0.00 -0.92 0.00 0.00 57.85 57.67 1eax n ARG 222 Cb 0.54 -2.47 -0.06 0.00 0.45 0.00 0.00 32.46 30.92 1eax n ARG 222 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1eax n ASN 223 N 1.28 -5.46 -3.19 6.15 3.02 0.13 -4.90 115.26 112.29 1eax n ASN 223 Ca 0.06 0.33 -0.23 0.00 -0.03 0.00 0.00 54.58 54.72 1eax n ASN 223 Cb 0.36 -4.14 -0.05 0.00 -0.61 0.00 0.00 39.78 35.33 1eax n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1eax n LYS 224 N -1.47 1.44 -1.56 3.52 5.02 -0.93 -4.86 118.16 119.32 1eax n LYS 224 Ca -0.13 -3.73 -0.32 0.00 -2.02 0.00 0.00 58.31 52.10 1eax n LYS 224 Cb 0.58 -1.69 0.06 0.00 -0.02 0.00 0.00 35.03 33.97 1eax n LYS 224 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1eax s PRO 225 N -2.14 2.58 0.68 1.97 0.04 -1.26 -4.38 135.00 132.49 1eax s PRO 225 Ca 0.40 1.31 -0.15 0.00 0.04 0.00 0.00 61.00 62.59 1eax s PRO 225 Cb 0.25 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.87 1eax s PRO 225 CO -0.09 -1.41 1.16 0.20 0.04 0.00 0.00 177.00 176.90 1eax s GLY 226 N -2.89 2.29 -0.11 0.56 0.00 -1.20 -4.74 107.32 101.24 1eax s GLY 226 Ca 0.65 0.74 -0.00 0.00 0.00 0.00 0.00 44.72 46.10 1eax s GLY 226 CO 0.47 1.12 -0.10 0.14 0.00 0.00 0.00 173.10 174.73 1eax s VAL 227 N -2.11 3.38 0.06 1.40 1.01 0.61 -1.75 120.40 123.00 1eax s VAL 227 Ca 0.71 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.18 1eax s VAL 227 Cb -0.25 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 1eax s VAL 227 CO 0.42 0.55 -0.15 -0.31 0.00 0.00 0.00 175.10 175.61 1eax s TYR 228 N -0.09 1.27 0.04 5.22 1.51 0.22 -1.87 117.35 123.64 1eax s TYR 228 Ca -0.00 -0.41 -0.29 0.00 -1.01 0.00 0.00 57.07 55.36 1eax s TYR 228 Cb -0.13 -0.73 -0.04 0.00 -0.11 0.00 0.00 41.96 40.94 1eax s TYR 228 CO 0.03 0.06 0.93 0.99 -1.11 0.00 0.00 175.55 176.45 1eax s THR 229 N -1.07 4.74 0.46 -0.71 2.01 -0.07 -0.64 115.64 120.37 1eax s THR 229 Ca 0.00 1.98 -0.22 0.00 0.31 0.00 0.00 61.69 63.76 1eax s THR 229 Cb -0.09 -4.28 -0.08 0.00 0.01 0.00 0.00 72.50 68.06 1eax s THR 229 CO 0.02 0.24 1.10 -0.13 -0.69 0.00 0.00 174.62 175.16 1eax s ARG 230 N 0.55 3.81 -0.21 4.92 0.52 0.11 -1.03 118.95 127.62 1eax s ARG 230 Ca 0.48 1.59 -0.04 0.00 -0.52 0.00 0.00 55.73 57.23 1eax s ARG 230 Cb -0.21 -2.31 -0.20 0.00 0.52 0.00 0.00 34.95 32.74 1eax s ARG 230 CO 0.27 -0.46 0.00 1.28 0.02 0.00 0.00 175.30 176.42 1eax n LEU 231 N -0.61 2.68 -0.33 2.53 7.99 -1.01 -4.55 117.00 123.70 1eax n LEU 231 Ca 0.08 0.07 0.15 0.00 -0.01 0.00 0.00 56.01 56.30 1eax n LEU 231 Cb 0.50 -0.98 0.38 0.00 -0.11 0.00 0.00 43.42 43.20 1eax n LEU 231 CO 0.44 0.83 1.20 -0.65 -1.51 0.00 0.00 177.39 177.70 1eax h PRO 232 N -0.14 0.63 -0.09 3.23 0.11 -1.82 -0.08 132.00 133.84 1eax h PRO 232 Ca -0.52 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.58 1eax h PRO 232 Cb 1.88 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.85 1eax h PRO 232 CO -0.07 0.42 0.11 -0.07 -0.21 0.00 0.00 178.00 178.19 1eax h LEU 233 N 0.65 0.00 -2.53 2.35 3.38 -1.81 -2.03 115.31 115.32 1eax h LEU 233 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 1eax h LEU 233 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1eax h LEU 233 CO -0.35 0.00 0.00 0.49 0.09 0.00 0.00 178.44 178.67 1eax n PHE 234 N -3.74 0.59 -0.20 1.13 3.72 -0.05 -4.63 117.46 114.26 1eax n PHE 234 Ca -0.01 -0.37 -0.01 0.00 -0.05 0.00 0.00 57.45 57.01 1eax n PHE 234 Cb 0.21 -0.01 0.10 0.00 -0.94 0.00 0.00 39.48 38.84 1eax n PHE 234 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1eax h ARG 235 N 3.50 0.49 -0.36 -1.08 9.65 -1.30 0.24 114.38 125.53 1eax h ARG 235 Ca 0.00 -0.03 -0.15 0.00 -1.10 0.00 0.00 59.98 58.70 1eax h ARG 235 Cb 0.87 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.33 1eax h ARG 235 CO 0.00 0.33 -0.39 -0.44 2.80 0.00 0.00 179.97 182.27 1eax h ASP 236 N 0.51 0.92 -0.71 -3.80 3.45 -1.82 -1.63 116.42 113.34 1eax h ASP 236 Ca 0.29 -0.42 -0.02 0.00 0.43 0.00 0.00 57.03 57.31 1eax h ASP 236 Cb 0.28 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 38.76 1eax h ASP 236 CO -0.24 1.19 0.37 -0.25 -1.57 0.00 0.00 179.24 178.74 1eax h TRP 237 N 0.70 0.99 -0.26 4.55 7.01 -1.73 0.95 115.95 128.16 1eax h TRP 237 Ca 0.06 -0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.01 1eax h TRP 237 Cb 0.96 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 27.70 1eax h TRP 237 CO 0.06 0.71 0.11 0.82 -2.79 0.00 0.00 178.44 177.35 1eax h ILE 238 N 0.98 1.17 -0.49 2.65 2.04 -0.81 -1.80 117.51 121.24 1eax h ILE 238 Ca 0.25 -0.50 0.02 0.00 1.00 0.00 0.00 64.86 65.62 1eax h ILE 238 Cb 0.07 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1eax h ILE 238 CO -0.04 0.17 0.30 0.50 0.00 0.00 0.00 178.15 179.09 1eax h LYS 239 N 0.27 0.59 -0.74 2.37 1.63 -0.91 -0.85 116.57 118.93 1eax h LYS 239 Ca 0.09 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.83 1eax h LYS 239 Cb 0.17 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1eax h LYS 239 CO -0.01 0.39 0.37 0.93 -3.45 0.00 0.00 179.45 177.68 1eax h GLU 240 N 0.61 1.04 0.00 1.90 3.07 -0.67 0.54 114.58 121.08 1eax h GLU 240 Ca 0.19 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1eax h GLU 240 Cb -0.01 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.70 1eax h GLU 240 CO -0.08 0.79 -0.94 0.09 -1.40 0.00 0.00 179.01 177.48 1eax n ASN 241 N -4.33 0.74 0.00 1.42 3.02 -0.69 -4.57 115.26 110.85 1eax n ASN 241 Ca 0.07 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.79 1eax n ASN 241 Cb 0.13 0.48 0.00 0.00 -0.61 0.00 0.00 39.78 39.77 1eax n ASN 241 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1eax n THR 242 N -2.39 0.00 -0.04 3.41 -2.24 -0.34 -5.01 114.28 107.66 1eax n THR 242 Ca 0.01 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1eax n THR 242 Cb 0.50 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 1eax n THR 242 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1eax n GLY 243 N 1.62 1.70 0.03 3.38 0.00 0.18 -5.04 105.19 107.06 1eax n GLY 243 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 1eax n GLY 243 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70