#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oyr s ILE 3 N 0.00 0.00 -0.42 -0.18 2.07 -0.83 -4.91 121.20 116.94 2oyr s ILE 3 Ca 0.00 0.00 -0.28 0.00 -1.41 0.00 0.00 60.65 58.96 2oyr s ILE 3 Cb 0.00 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.61 2oyr s ILE 3 CO 0.00 0.00 1.06 0.00 -1.91 0.00 0.00 174.94 174.09 2oyr s LEU 5 N 4.01 4.08 -0.07 0.00 1.43 -1.26 -0.30 118.68 126.57 2oyr s LEU 5 Ca 0.44 0.67 0.05 0.00 -1.03 0.00 0.00 54.13 54.26 2oyr s LEU 5 Cb -0.09 -2.78 -0.01 0.00 0.03 0.00 0.00 46.19 43.34 2oyr s LEU 5 CO 0.25 -0.30 -0.24 -0.63 0.23 0.00 0.00 176.35 175.66 2oyr s ILE 6 N 2.21 2.00 -0.33 -0.59 1.01 -0.30 -4.97 121.20 120.23 2oyr s ILE 6 Ca 0.25 -1.01 -0.08 0.00 0.00 0.00 0.00 60.65 59.80 2oyr s ILE 6 Cb -0.16 -1.71 0.02 0.00 0.01 0.00 0.00 42.46 40.63 2oyr s ILE 6 CO 0.09 0.55 0.14 -0.62 0.00 0.00 0.00 174.94 175.10 2oyr s ASP 7 N 0.06 5.43 -0.25 3.58 -1.08 -1.26 -1.12 116.67 122.03 2oyr s ASP 7 Ca -0.10 -0.89 0.09 0.00 -0.52 0.00 0.00 52.55 51.13 2oyr s ASP 7 Cb -0.15 -1.94 0.44 0.00 -1.46 0.00 0.00 42.92 39.81 2oyr s ASP 7 CO 0.06 -0.29 1.21 -0.62 0.52 0.00 0.00 175.17 176.05 2oyr n GLU 8 N 4.91 2.62 -0.04 4.34 1.02 0.26 -4.71 120.64 129.03 2oyr n GLU 8 Ca -0.13 -3.74 0.03 0.00 -0.02 0.00 0.00 57.16 53.30 2oyr n GLU 8 Cb 0.47 -1.96 -0.15 0.00 -0.02 0.00 0.00 31.44 29.77 2oyr n GLU 8 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2oyr n THR 9 N -0.91 0.48 -1.07 2.62 -2.24 -1.21 -3.90 114.28 108.05 2oyr n THR 9 Ca 0.32 -0.59 -0.02 0.00 -2.27 0.00 0.00 64.05 61.49 2oyr n THR 9 Cb 0.83 -0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 68.89 2oyr n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oyr n GLY 10 N 1.53 0.36 0.09 3.38 0.00 -1.26 -4.86 105.19 104.43 2oyr n GLY 10 Ca -0.14 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.66 2oyr n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyr h ALA 11 N 0.00 0.03 -0.06 4.61 0.00 -1.98 -3.48 119.26 118.38 2oyr h ALA 11 Ca -0.05 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.13 2oyr h ALA 11 Cb 0.76 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2oyr h ALA 11 CO 0.07 0.28 -0.02 0.41 0.00 0.00 0.00 179.25 179.99 2oyr n GLY 12 N 1.62 0.50 0.32 0.00 0.00 -1.26 -4.91 105.19 101.46 2oyr n GLY 12 Ca -0.15 -0.36 0.14 0.00 0.00 0.00 0.00 46.02 45.64 2oyr n GLY 12 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oyr n ASP 13 N 0.49 1.00 0.00 1.61 5.68 -1.26 -4.91 116.55 119.15 2oyr n ASP 13 Ca -0.01 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 2oyr n ASP 13 Cb 0.09 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 2oyr n ASP 13 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oyr n GLY 14 N 1.09 0.54 0.20 6.12 0.00 -1.26 -4.96 105.19 106.92 2oyr n GLY 14 Ca 0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 2oyr n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyr h ALA 15 N 0.00 0.51 -0.77 4.61 0.00 -1.99 0.38 119.26 122.00 2oyr h ALA 15 Ca 0.00 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2oyr h ALA 15 Cb 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2oyr h ALA 15 CO 0.00 -0.35 0.30 1.25 0.00 0.00 0.00 179.25 180.45 2oyr h LEU 16 N 0.18 1.07 -0.65 0.00 6.46 -1.98 -0.27 115.31 120.11 2oyr h LEU 16 Ca 0.25 -0.18 -0.09 0.00 -0.12 0.00 0.00 57.88 57.74 2oyr h LEU 16 Cb 0.35 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 39.98 2oyr h LEU 16 CO -0.36 0.95 0.07 0.28 -0.62 0.00 0.00 178.44 178.77 2oyr h SER 17 N 1.11 1.07 -0.70 1.25 0.02 -1.78 -0.61 113.55 113.92 2oyr h SER 17 Ca 0.25 -0.28 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 2oyr h SER 17 Cb 0.22 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 2oyr h SER 17 CO -0.02 1.08 0.15 0.58 -1.14 0.00 0.00 176.83 177.47 2oyr h VAL 18 N 1.02 1.26 -0.52 2.27 2.07 -0.62 -1.86 116.25 119.87 2oyr h VAL 18 Ca 0.19 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 2oyr h VAL 18 Cb 0.48 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2oyr h VAL 18 CO 0.02 0.38 0.10 0.25 0.02 0.00 0.00 177.57 178.34 2oyr h LEU 19 N 1.07 0.81 -0.56 2.57 6.46 -0.68 -0.34 115.31 124.64 2oyr h LEU 19 Ca 0.22 -0.25 -0.05 0.00 -0.12 0.00 0.00 57.88 57.67 2oyr h LEU 19 Cb 0.41 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.10 2oyr h LEU 19 CO 0.01 0.85 0.14 0.00 -0.62 0.00 0.00 178.44 178.82 2oyr h ALA 20 N 0.99 0.73 -0.13 1.25 0.00 -0.98 -1.52 119.26 119.60 2oyr h ALA 20 Ca 0.16 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2oyr h ALA 20 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2oyr h ALA 20 CO 0.01 0.43 0.05 0.00 0.00 0.00 0.00 179.25 179.74 2oyr h ALA 21 N 1.02 0.18 -0.69 0.00 0.00 -1.15 0.56 119.26 119.17 2oyr h ALA 21 Ca 0.18 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2oyr h ALA 21 Cb 0.34 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2oyr h ALA 21 CO 0.00 -0.23 0.40 -0.09 0.00 0.00 0.00 179.25 179.34 2oyr h ARG 22 N 0.05 0.73 -0.29 0.00 2.43 -0.93 -2.58 114.38 113.80 2oyr h ARG 22 Ca 0.04 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2oyr h ARG 22 Cb 0.19 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2oyr h ARG 22 CO -0.00 0.48 0.00 0.91 -1.51 0.00 0.00 179.97 179.85 2oyr n TRP 23 N -4.74 0.36 -3.28 2.20 7.02 -0.59 -4.97 117.44 113.45 2oyr n TRP 23 Ca 0.09 -0.18 -0.19 0.00 -1.02 0.00 0.00 57.50 56.20 2oyr n TRP 23 Cb 0.15 0.00 0.06 0.00 -2.42 0.00 0.00 31.31 29.10 2oyr n TRP 23 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2oyr n GLY 24 N 1.39 -0.24 3.84 6.99 0.00 0.13 -4.81 105.19 112.50 2oyr n GLY 24 Ca 0.18 0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 2oyr n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oyr s LEU 25 N -5.89 4.40 -0.17 0.99 1.43 0.15 -4.90 118.68 114.69 2oyr s LEU 25 Ca 0.43 1.04 -0.01 0.00 -1.03 0.00 0.00 54.13 54.55 2oyr s LEU 25 Cb -0.19 -3.02 -0.01 0.00 0.03 0.00 0.00 46.19 43.00 2oyr s LEU 25 CO 0.53 0.19 -0.10 -0.70 0.23 0.00 0.00 176.35 176.49 2oyr s GLU 26 N -1.63 3.32 0.19 1.70 2.12 -1.26 -4.65 118.70 118.50 2oyr s GLU 26 Ca 0.33 -0.68 -0.31 0.00 0.36 0.00 0.00 54.97 54.67 2oyr s GLU 26 Cb -0.16 -2.78 -0.10 0.00 0.26 0.00 0.00 34.13 31.35 2oyr s GLU 26 CO 0.18 -0.02 1.51 -1.58 -0.54 0.00 0.00 175.26 174.81 2oyr s HIS 27 N 0.96 3.05 -0.37 5.30 5.65 -1.26 -1.96 115.29 126.67 2oyr s HIS 27 Ca -0.02 0.80 0.00 0.00 0.25 0.00 0.00 55.06 56.10 2oyr s HIS 27 Cb -0.15 -3.87 0.12 0.00 -1.18 0.00 0.00 32.58 27.50 2oyr s HIS 27 CO -0.01 -3.07 0.17 0.34 -0.65 0.00 0.00 174.74 171.52 2oyr s ASP 28 N 0.84 3.76 0.32 9.88 2.15 0.24 -4.80 116.67 129.05 2oyr s ASP 28 Ca 0.65 -2.10 0.09 0.00 0.43 0.00 0.00 52.55 51.62 2oyr s ASP 28 Cb -0.43 -0.89 0.92 0.00 -0.30 0.00 0.00 42.92 42.23 2oyr s ASP 28 CO 0.36 -0.34 1.65 -0.33 -0.17 0.00 0.00 175.17 176.33 2oyr h GLU 29 N 7.42 0.24 -0.59 4.34 4.39 -1.93 -0.61 114.58 127.84 2oyr h GLU 29 Ca -0.06 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2oyr h GLU 29 Cb 0.97 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 2oyr h GLU 29 CO 0.45 0.16 0.00 -0.25 -1.16 0.00 0.00 179.01 178.21 2oyr n ASP 30 N -5.16 5.72 -4.76 1.42 8.00 -1.26 -4.94 116.55 115.57 2oyr n ASP 30 Ca 0.27 -2.91 -0.37 0.00 0.71 0.00 0.00 54.79 52.49 2oyr n ASP 30 Cb 0.86 -0.68 0.01 0.00 -0.02 0.00 0.00 41.12 41.29 2oyr n ASP 30 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2oyr s ASN 31 N -0.78 5.66 0.00 -2.24 3.84 -0.24 -5.08 114.94 116.10 2oyr s ASN 31 Ca 0.55 2.42 0.00 0.00 0.21 0.00 0.00 52.86 56.04 2oyr s ASN 31 Cb 0.41 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 38.51 2oyr s ASN 31 CO 0.16 -1.28 0.34 0.18 -2.79 0.00 0.00 177.10 173.72 2oyr n LEU 32 N -0.97 0.77 -3.64 3.21 4.77 -1.26 -4.77 117.00 115.10 2oyr n LEU 32 Ca 0.10 -0.39 -0.05 0.00 -0.03 0.00 0.00 56.01 55.64 2oyr n LEU 32 Cb 0.48 -0.29 -0.07 0.00 -2.33 0.00 0.00 43.42 41.21 2oyr n LEU 32 CO 0.47 0.17 0.98 0.00 -1.33 0.00 0.00 177.39 177.69 2oyr s ALA 34 N -0.75 -2.14 -0.28 -1.18 0.00 -0.51 -2.24 121.76 114.65 2oyr s ALA 34 Ca 0.00 1.77 -0.04 0.00 0.00 0.00 0.00 51.96 53.70 2oyr s ALA 34 Cb 0.00 -1.65 0.03 0.00 0.00 0.00 0.00 23.12 21.49 2oyr s ALA 34 CO 0.00 -0.16 0.02 -1.17 0.00 0.00 0.00 175.76 174.44 2oyr s LEU 35 N 0.16 3.67 -0.15 0.00 2.96 0.59 -0.51 118.68 125.40 2oyr s LEU 35 Ca 0.05 -0.93 -0.01 0.00 -0.22 0.00 0.00 54.13 53.02 2oyr s LEU 35 Cb -0.05 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 2oyr s LEU 35 CO -0.12 -0.20 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.92 2oyr s VAL 36 N 1.37 3.20 -0.37 1.68 1.01 -0.18 -1.15 120.40 125.96 2oyr s VAL 36 Ca -0.00 -0.59 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 2oyr s VAL 36 Cb -0.18 -2.38 0.00 0.00 0.00 0.00 0.00 36.38 33.83 2oyr s VAL 36 CO -0.01 0.50 0.48 -0.22 0.00 0.00 0.00 175.10 175.85 2oyr s LEU 37 N 0.61 4.47 0.48 3.92 2.96 -0.27 -1.22 118.68 129.62 2oyr s LEU 37 Ca -0.06 -0.21 0.07 0.00 -0.22 0.00 0.00 54.13 53.71 2oyr s LEU 37 Cb -0.15 -2.51 0.01 0.00 0.50 0.00 0.00 46.19 44.03 2oyr s LEU 37 CO 0.03 -0.49 0.39 0.42 -1.32 0.00 0.00 176.35 175.38 2oyr s THR 38 N 2.30 2.19 -0.26 3.68 -4.23 0.17 -0.58 115.64 118.93 2oyr s THR 38 Ca 0.16 -1.42 0.27 0.00 -1.18 0.00 0.00 61.69 59.52 2oyr s THR 38 Cb -0.16 -2.61 0.29 0.00 1.34 0.00 0.00 72.50 71.36 2oyr s THR 38 CO 0.13 0.00 1.80 -0.65 -0.54 0.00 0.00 174.62 175.37 2oyr h PRO 39 N 0.91 0.00 0.01 3.99 0.11 -1.90 -3.13 132.00 131.99 2oyr h PRO 39 Ca -0.39 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.35 2oyr h PRO 39 Cb 1.28 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 2oyr h PRO 39 CO 0.58 0.00 -2.38 0.39 -0.21 0.00 0.00 178.00 176.38 2oyr n GLU 40 N -2.49 0.67 -3.97 1.05 -0.58 -1.26 -5.09 120.64 108.98 2oyr n GLU 40 Ca 0.01 0.09 0.03 0.00 -0.42 0.00 0.00 57.16 56.87 2oyr n GLU 40 Cb 0.22 -1.54 0.01 0.00 -0.57 0.00 0.00 31.44 29.56 2oyr n GLU 40 CO 0.00 0.00 0.00 -3.38 -0.48 0.00 0.00 177.13 173.27 2oyr s HIS 41 N -2.51 0.02 -0.21 -0.32 -3.43 -1.19 -5.12 115.29 102.53 2oyr s HIS 41 Ca -0.22 -0.13 -0.12 0.00 -0.80 0.00 0.00 55.06 53.79 2oyr s HIS 41 Cb 0.07 0.55 -0.05 0.00 -1.43 0.00 0.00 32.58 31.73 2oyr s HIS 41 CO 0.72 -0.25 0.24 -1.17 -2.00 0.00 0.00 174.74 172.29 2oyr s LEU 42 N -3.76 4.15 0.24 5.38 2.96 -1.26 -0.65 118.68 125.74 2oyr s LEU 42 Ca 0.29 0.29 0.05 0.00 -0.22 0.00 0.00 54.13 54.54 2oyr s LEU 42 Cb -0.00 -2.26 -0.05 0.00 0.50 0.00 0.00 46.19 44.38 2oyr s LEU 42 CO -0.01 0.04 -0.04 -1.83 -1.32 0.00 0.00 176.35 173.19 2oyr s GLU 43 N 0.98 1.39 -0.12 1.98 -1.05 -0.36 -4.60 118.70 116.93 2oyr s GLU 43 Ca 0.12 -1.69 -0.00 0.00 -0.15 0.00 0.00 54.97 53.24 2oyr s GLU 43 Cb -0.13 -0.84 -0.02 0.00 -0.44 0.00 0.00 34.13 32.69 2oyr s GLU 43 CO 0.05 -0.02 -0.11 -1.17 0.95 0.00 0.00 175.26 174.96 2oyr s LEU 44 N -3.35 2.87 0.12 1.83 2.96 0.43 -1.01 118.68 122.53 2oyr s LEU 44 Ca 0.28 -0.24 0.08 0.00 -0.22 0.00 0.00 54.13 54.02 2oyr s LEU 44 Cb 0.04 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 2oyr s LEU 44 CO 0.09 0.21 -0.19 -0.13 -1.32 0.00 0.00 176.35 175.01 2oyr s ARG 45 N 0.10 1.13 -0.69 1.98 0.52 0.34 -1.23 118.95 121.09 2oyr s ARG 45 Ca -0.05 -1.21 -0.09 0.00 -0.52 0.00 0.00 55.73 53.86 2oyr s ARG 45 Cb -0.14 -1.28 0.18 0.00 0.52 0.00 0.00 34.95 34.22 2oyr s ARG 45 CO 0.04 0.28 0.58 0.21 0.02 0.00 0.00 175.30 176.44 2oyr s LYS 46 N -2.18 3.04 0.46 3.54 2.20 -1.26 -1.43 119.74 124.12 2oyr s LYS 46 Ca 0.08 -2.37 0.33 0.00 -0.36 0.00 0.00 55.97 53.65 2oyr s LYS 46 Cb -0.08 -4.10 1.45 0.00 -1.51 0.00 0.00 37.83 33.59 2oyr s LYS 46 CO 0.05 -1.24 1.65 0.00 -0.36 0.00 0.00 175.35 175.45 2oyr h ARG 47 N 7.62 0.10 -0.00 4.03 3.08 -1.79 0.26 114.38 127.67 2oyr h ARG 47 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2oyr h ARG 47 Cb 1.01 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.04 2oyr h ARG 47 CO 0.76 0.06 -0.15 -0.40 -1.07 0.00 0.00 179.97 179.18 2oyr n ASP 48 N -4.51 0.39 -3.26 7.04 5.75 -1.26 -4.33 116.55 116.37 2oyr n ASP 48 Ca 0.36 -0.33 -0.25 0.00 -0.01 0.00 0.00 54.79 54.56 2oyr n ASP 48 Cb 1.44 -0.10 -0.08 0.00 -1.03 0.00 0.00 41.12 41.35 2oyr n ASP 48 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2oyr n GLU 49 N -1.14 0.86 0.12 0.11 1.02 0.90 -4.96 120.64 117.57 2oyr n GLU 49 Ca 0.12 -3.40 0.11 0.00 -0.02 0.00 0.00 57.16 53.97 2oyr n GLU 49 Cb 0.30 -1.42 0.62 0.00 -0.02 0.00 0.00 31.44 30.92 2oyr n GLU 49 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2oyr h PRO 50 N 4.28 0.09 -0.03 3.49 0.11 -1.75 -1.77 132.00 136.41 2oyr h PRO 50 Ca 0.11 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.23 2oyr h PRO 50 Cb 0.86 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 2oyr h PRO 50 CO 0.50 0.06 0.06 0.87 -0.21 0.00 0.00 178.00 179.28 2oyr h LYS 51 N 0.10 0.00 0.00 1.05 6.56 -1.92 0.14 116.57 122.49 2oyr h LYS 51 Ca 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.71 2oyr h LYS 51 Cb 0.34 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2oyr h LYS 51 CO -0.01 0.00 0.00 -0.07 -2.06 0.00 0.00 179.45 177.31 2oyr h LEU 52 N 0.00 0.00 0.00 2.94 3.38 -1.68 -3.49 115.31 116.45 2oyr h LEU 52 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2oyr h LEU 52 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2oyr h LEU 52 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2oyr n GLY 53 N 0.66 -1.47 3.71 0.83 0.00 0.48 -4.74 105.19 104.66 2oyr n GLY 53 Ca 0.03 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 2oyr n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oyr s GLY 54 N -2.92 1.74 0.02 -0.02 0.00 -1.26 -4.49 107.32 100.39 2oyr s GLY 54 Ca 0.00 -1.30 0.07 0.00 0.00 0.00 0.00 44.72 43.49 2oyr s GLY 54 CO 0.00 -1.32 -0.21 -0.26 0.00 0.00 0.00 173.10 171.31 2oyr s ILE 55 N -1.72 2.54 0.08 0.90 -4.36 -0.37 -4.89 121.20 113.38 2oyr s ILE 55 Ca 0.29 -1.17 -0.13 0.00 -0.26 0.00 0.00 60.65 59.38 2oyr s ILE 55 Cb -0.10 -2.01 0.02 0.00 1.25 0.00 0.00 42.46 41.62 2oyr s ILE 55 CO 0.20 0.42 0.30 0.72 0.24 0.00 0.00 174.94 176.82 2oyr s PHE 56 N -0.82 -0.07 -0.19 1.37 -0.71 -1.26 -0.43 117.98 115.87 2oyr s PHE 56 Ca 0.13 -0.20 -0.24 0.00 -1.04 0.00 0.00 56.93 55.58 2oyr s PHE 56 Cb -0.10 0.10 -0.02 0.00 -1.21 0.00 0.00 43.02 41.79 2oyr s PHE 56 CO 0.03 -0.57 0.76 0.08 -1.34 0.00 0.00 175.22 174.18 2oyr s VAL 57 N -3.27 4.92 -0.24 -2.49 1.01 -1.26 -5.03 120.40 114.04 2oyr s VAL 57 Ca 0.00 1.46 -0.03 0.00 0.00 0.00 0.00 61.98 63.41 2oyr s VAL 57 Cb 0.02 -4.07 0.08 0.00 0.00 0.00 0.00 36.38 32.41 2oyr s VAL 57 CO -0.08 0.03 0.09 -0.62 0.00 0.00 0.00 175.10 174.53 2oyr s ASP 58 N 1.22 3.19 0.32 3.32 2.15 -1.26 -4.18 116.67 121.42 2oyr s ASP 58 Ca 0.34 -1.08 0.21 0.00 0.43 0.00 0.00 52.55 52.46 2oyr s ASP 58 Cb -0.16 -0.47 0.16 0.00 -0.30 0.00 0.00 42.92 42.15 2oyr s ASP 58 CO 0.11 -0.38 1.36 -0.26 -0.17 0.00 0.00 175.17 175.83 2oyr h PHE 59 N 8.32 0.00 0.19 -5.34 0.04 -1.96 -3.36 116.94 114.83 2oyr h PHE 59 Ca -0.17 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.27 2oyr h PHE 59 Cb 1.07 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.24 2oyr h PHE 59 CO 0.27 0.14 -1.56 0.28 -0.60 0.00 0.00 178.31 176.84 2oyr h VAL 60 N 0.00 1.16 -1.55 -0.55 2.07 -1.93 -3.40 116.25 112.06 2oyr h VAL 60 Ca -0.01 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 64.81 2oyr h VAL 60 Cb 1.12 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.77 2oyr h VAL 60 CO 0.02 0.84 0.00 0.61 0.02 0.00 0.00 177.57 179.05 2oyr n GLY 61 N 1.74 6.10 7.00 2.17 0.00 -1.26 -4.65 105.19 116.29 2oyr n GLY 61 Ca -0.19 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2oyr n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oyr n GLY 62 N 2.14 1.37 1.13 -0.02 0.00 -1.26 -2.64 105.19 105.91 2oyr n GLY 62 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2oyr n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyr n ALA 63 N 5.31 1.27 0.00 4.61 0.00 -1.26 -2.03 120.51 128.40 2oyr n ALA 63 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2oyr n ALA 63 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2oyr n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oyr n ALA 65 N 0.98 0.00 -0.09 0.00 0.00 -1.08 -1.37 120.51 118.95 2oyr n ALA 65 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2oyr n ALA 65 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2oyr n ALA 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2oyr h HIS 66 N 0.00 0.59 -0.57 0.00 -0.00 -1.69 -2.48 115.15 111.00 2oyr h HIS 66 Ca 0.00 -0.13 -0.05 0.00 -0.00 0.00 0.00 60.37 60.19 2oyr h HIS 66 Cb 0.00 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 27.24 2oyr h HIS 66 CO 0.00 0.74 0.16 -0.09 -0.00 0.00 0.00 177.93 178.73 2oyr h ARG 67 N 0.27 0.86 -0.58 5.26 2.43 -1.50 0.12 114.38 121.25 2oyr h ARG 67 Ca 0.07 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2oyr h ARG 67 Cb 0.55 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2oyr h ARG 67 CO 0.03 0.76 0.18 -0.09 -1.51 0.00 0.00 179.97 179.34 2oyr h ARG 68 N 0.83 0.88 0.08 0.20 2.43 -1.79 1.07 114.38 118.09 2oyr h ARG 68 Ca 0.19 -0.16 -0.30 0.00 -0.81 0.00 0.00 59.98 58.89 2oyr h ARG 68 Cb 0.27 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 2oyr h ARG 68 CO -0.01 0.76 -1.58 -0.22 -1.51 0.00 0.00 179.97 177.41 2oyr h LYS 69 N 0.85 0.17 -0.01 0.20 3.64 -0.99 -3.40 116.57 117.04 2oyr h LYS 69 Ca 0.19 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2oyr h LYS 69 Cb 0.25 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2oyr h LYS 69 CO -0.01 0.98 -0.15 1.19 -2.27 0.00 0.00 179.45 179.20 2oyr n PHE 70 N -3.36 0.00 0.17 1.91 3.72 0.39 -4.67 117.46 115.61 2oyr n PHE 70 Ca -0.17 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.24 2oyr n PHE 70 Cb 1.04 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 39.86 2oyr n PHE 70 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2oyr h GLY 71 N 1.52 0.00 0.00 1.37 0.00 0.11 -3.48 103.07 102.59 2oyr h GLY 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2oyr h GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2oyr n GLY 72 N -0.14 1.57 7.00 4.60 0.00 -1.26 -4.40 105.19 112.56 2oyr n GLY 72 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2oyr n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oyr n GLY 73 N -0.84 2.62 0.29 -0.02 0.00 -1.26 -0.72 105.19 105.26 2oyr n GLY 73 Ca 0.00 0.31 0.19 0.00 0.00 0.00 0.00 46.02 46.53 2oyr n GLY 73 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2oyr h ARG 74 N 0.00 0.00 -0.00 1.61 0.11 -1.93 0.86 114.38 115.03 2oyr h ARG 74 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2oyr h ARG 74 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2oyr h ARG 74 CO 0.00 0.00 -0.10 0.41 0.10 0.00 0.00 179.97 180.38 2oyr n GLY 75 N -1.14 -1.14 3.76 0.08 0.00 0.10 -4.21 105.19 102.63 2oyr n GLY 75 Ca -0.03 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2oyr n GLY 75 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oyr s GLU 76 N -2.62 3.01 0.24 1.61 2.02 0.30 -4.86 118.70 118.38 2oyr s GLU 76 Ca 0.25 1.70 -0.07 0.00 0.02 0.00 0.00 54.97 56.87 2oyr s GLU 76 Cb 0.20 -1.95 0.25 0.00 0.10 0.00 0.00 34.13 32.73 2oyr s GLU 76 CO 0.50 -1.15 1.89 0.00 0.02 0.00 0.00 175.26 176.53 2oyr h ALA 77 N 0.79 1.17 -0.18 5.21 0.00 -1.90 -1.14 119.26 123.20 2oyr h ALA 77 Ca -0.50 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.25 2oyr h ALA 77 Cb 1.28 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2oyr h ALA 77 CO 0.55 0.48 -0.39 -0.24 0.00 0.00 0.00 179.25 179.64 2oyr h VAL 78 N 1.16 1.30 -0.37 0.00 3.04 -1.94 -1.65 116.25 117.80 2oyr h VAL 78 Ca 0.35 -1.52 -0.12 0.00 -1.01 0.00 0.00 66.70 64.39 2oyr h VAL 78 Cb -0.05 1.59 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2oyr h VAL 78 CO -0.10 0.47 -0.26 0.00 -1.01 0.00 0.00 177.57 176.67 2oyr h ALA 79 N 1.24 0.85 -0.02 3.17 0.00 -1.64 -2.00 119.26 120.86 2oyr h ALA 79 Ca 0.03 -0.39 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 2oyr h ALA 79 Cb 0.84 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2oyr h ALA 79 CO 0.07 0.64 -0.72 0.87 0.00 0.00 0.00 179.25 180.11 2oyr h LYS 80 N 0.65 0.11 -0.47 0.00 1.57 -1.08 -2.27 116.57 115.09 2oyr h LYS 80 Ca 0.08 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 2oyr h LYS 80 Cb 0.77 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 2oyr h LYS 80 CO 0.06 0.78 0.02 0.00 -0.57 0.00 0.00 179.45 179.74 2oyr h ALA 81 N 1.19 0.63 0.00 3.86 0.00 -1.04 -2.44 119.26 121.47 2oyr h ALA 81 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2oyr h ALA 81 Cb 1.27 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2oyr h ALA 81 CO 0.10 0.41 0.00 1.33 0.00 0.00 0.00 179.25 181.09 2oyr n VAL 82 N -4.38 0.96 0.00 0.00 0.24 -0.77 -4.86 118.33 109.51 2oyr n VAL 82 Ca 0.00 0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.59 2oyr n VAL 82 Cb 0.29 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 2oyr n VAL 82 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oyr n GLY 83 N -0.16 0.70 3.67 7.63 0.00 -0.92 -4.94 105.19 111.18 2oyr n GLY 83 Ca 0.02 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.56 2oyr n GLY 83 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2oyr n ILE 84 N -1.85 0.31 -3.64 -0.61 5.41 -0.86 -4.95 119.36 113.17 2oyr n ILE 84 Ca 0.00 -0.06 -0.07 0.00 1.00 0.00 0.00 62.75 63.62 2oyr n ILE 84 Cb 0.00 -1.62 -0.07 0.00 -0.71 0.00 0.00 39.64 37.24 2oyr n ILE 84 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2oyr s LYS 85 N 2.64 0.71 7.22 0.38 2.20 -1.16 -4.70 119.74 127.02 2oyr s LYS 85 Ca 0.88 1.22 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 2oyr s LYS 85 Cb -0.74 0.14 0.00 0.00 -1.51 0.00 0.00 37.83 35.72 2oyr s LYS 85 CO 0.48 -0.15 0.00 0.41 -0.36 0.00 0.00 175.35 175.73 2oyr n GLY 86 N 4.30 3.70 1.18 5.54 0.00 -1.26 -0.82 105.19 117.82 2oyr n GLY 86 Ca -0.20 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 45.89 2oyr n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2oyr n ASP 87 N 5.59 3.43 -4.55 1.61 9.92 -1.26 -4.84 116.55 126.45 2oyr n ASP 87 Ca 0.00 -2.15 -0.43 0.00 -0.53 0.00 0.00 54.79 51.68 2oyr n ASP 87 Cb 0.00 -0.44 -0.04 0.00 -0.64 0.00 0.00 41.12 39.99 2oyr n ASP 87 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 2oyr s TYR 88 N -1.47 2.92 -0.53 1.24 5.04 -0.00 -4.96 117.35 119.59 2oyr s TYR 88 Ca 0.39 0.29 0.04 0.00 -2.44 0.00 0.00 57.07 55.35 2oyr s TYR 88 Cb 0.23 -3.92 0.15 0.00 0.35 0.00 0.00 41.96 38.77 2oyr s TYR 88 CO 0.23 -1.11 0.33 -0.51 -1.34 0.00 0.00 175.55 173.16 2oyr s LEU 89 N 3.67 3.41 0.61 6.97 1.43 -1.26 -2.98 118.68 130.53 2oyr s LEU 89 Ca 0.35 -3.11 -0.19 0.00 -1.03 0.00 0.00 54.13 50.15 2oyr s LEU 89 Cb -0.11 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.86 2oyr s LEU 89 CO 0.25 -0.19 1.28 -2.16 0.23 0.00 0.00 176.35 175.75 2oyr s PRO 90 N -0.32 2.79 0.16 1.29 0.04 -1.26 -4.70 135.00 133.00 2oyr s PRO 90 Ca 0.22 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.98 2oyr s PRO 90 Cb -0.15 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 2oyr s PRO 90 CO -0.07 -1.40 1.10 -0.51 0.04 0.00 0.00 177.00 176.16 2oyr s ASP 91 N -1.37 7.26 0.08 6.66 1.01 -1.26 -4.04 116.67 125.00 2oyr s ASP 91 Ca 0.79 2.06 0.08 0.00 0.71 0.00 0.00 52.55 56.19 2oyr s ASP 91 Cb -0.36 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 40.94 2oyr s ASP 91 CO 0.39 -0.24 -0.21 -0.69 0.21 0.00 0.00 175.17 174.62 2oyr s VAL 92 N -0.06 1.73 -0.20 -1.27 1.01 -0.11 -1.87 120.40 119.64 2oyr s VAL 92 Ca 0.50 -1.41 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2oyr s VAL 92 Cb -0.29 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 34.58 2oyr s VAL 92 CO 0.34 0.07 -0.16 -0.69 0.00 0.00 0.00 175.10 174.66 2oyr s VAL 93 N -1.00 1.96 -0.61 2.92 1.01 -0.77 -1.35 120.40 122.56 2oyr s VAL 93 Ca 0.07 -1.07 -0.19 0.00 0.00 0.00 0.00 61.98 60.79 2oyr s VAL 93 Cb -0.09 -1.88 0.10 0.00 0.00 0.00 0.00 36.38 34.50 2oyr s VAL 93 CO 0.03 0.35 0.74 -0.62 0.00 0.00 0.00 175.10 175.60 2oyr s ASP 94 N 1.29 6.20 0.00 3.32 -1.08 0.07 -0.79 116.67 125.68 2oyr s ASP 94 Ca 0.01 -1.42 0.20 0.00 -0.52 0.00 0.00 52.55 50.82 2oyr s ASP 94 Cb -0.15 -2.31 0.94 0.00 -1.46 0.00 0.00 42.92 39.94 2oyr s ASP 94 CO -0.10 -1.14 1.63 0.00 0.52 0.00 0.00 175.17 176.07 2oyr n ALA 95 N 6.45 1.99 -3.19 3.66 0.00 -0.84 -0.52 120.51 128.06 2oyr n ALA 95 Ca -0.08 -0.08 -0.19 0.00 0.00 0.00 0.00 53.44 53.08 2oyr n ALA 95 Cb 0.43 -1.32 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 2oyr n ALA 95 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2oyr n THR 96 N -1.36 -0.20 -0.38 0.00 -2.24 -1.25 -4.53 114.28 104.33 2oyr n THR 96 Ca 0.08 -4.52 -0.01 0.00 -2.27 0.00 0.00 64.05 57.33 2oyr n THR 96 Cb 0.18 -0.52 0.04 0.00 -2.10 0.00 0.00 70.33 67.93 2oyr n THR 96 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oyr h ALA 97 N 3.15 0.15 -0.95 6.98 0.00 -1.15 -3.43 119.26 124.01 2oyr h ALA 97 Ca 0.10 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2oyr h ALA 97 Cb 0.95 1.00 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2oyr h ALA 97 CO 0.50 -0.62 0.00 0.41 0.00 0.00 0.00 179.25 179.53 2oyr n GLY 98 N -1.47 3.87 0.17 0.00 0.00 -1.26 -0.58 105.19 105.92 2oyr n GLY 98 Ca 0.10 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 2oyr n GLY 98 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oyr n LEU 99 N 0.00 0.61 -0.71 0.99 4.77 -1.26 -4.84 117.00 116.56 2oyr n LEU 99 Ca 0.00 -0.10 -0.09 0.00 -0.03 0.00 0.00 56.01 55.79 2oyr n LEU 99 Cb 0.00 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 2oyr n LEU 99 CO 0.00 0.11 -0.09 0.61 -1.33 0.00 0.00 177.39 176.69 2oyr n GLY 100 N 1.23 1.09 0.06 -0.72 0.00 0.26 -4.94 105.19 102.16 2oyr n GLY 100 Ca 0.16 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 2oyr n GLY 100 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2oyr h ARG 101 N 0.02 -0.04 -0.43 1.61 3.08 -1.92 -0.69 114.38 116.01 2oyr h ARG 101 Ca -0.19 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.73 2oyr h ARG 101 Cb 0.62 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 2oyr h ARG 101 CO 0.28 0.19 -0.25 -0.44 -1.07 0.00 0.00 179.97 178.69 2oyr h ASP 102 N -0.26 0.93 -0.44 7.04 3.32 -1.92 -2.78 116.42 122.31 2oyr h ASP 102 Ca -0.00 -0.36 0.03 0.00 0.02 0.00 0.00 57.03 56.72 2oyr h ASP 102 Cb 0.25 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2oyr h ASP 102 CO 0.01 1.13 0.23 0.00 -1.72 0.00 0.00 179.24 178.89 2oyr h ALA 103 N 0.94 0.55 -0.89 3.45 0.00 -1.89 -2.05 119.26 119.36 2oyr h ALA 103 Ca 0.10 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2oyr h ALA 103 Cb 0.80 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 2oyr h ALA 103 CO 0.07 -0.11 0.58 0.35 0.00 0.00 0.00 179.25 180.13 2oyr h PHE 104 N 0.47 1.13 0.19 0.00 3.57 -1.01 -1.22 116.94 120.07 2oyr h PHE 104 Ca 0.18 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 2oyr h PHE 104 Cb 0.07 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.43 2oyr h PHE 104 CO -0.09 0.72 -0.10 0.28 -2.23 0.00 0.00 178.31 176.89 2oyr h VAL 105 N 1.21 0.78 -0.65 1.41 2.07 -1.17 0.10 116.25 120.01 2oyr h VAL 105 Ca 0.32 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.88 2oyr h VAL 105 Cb -0.12 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 2oyr h VAL 105 CO -0.07 0.00 0.39 -0.07 0.02 0.00 0.00 177.57 177.84 2oyr h LEU 106 N -0.28 0.61 -1.06 2.57 3.38 -1.09 -1.66 115.31 117.79 2oyr h LEU 106 Ca -0.02 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2oyr h LEU 106 Cb 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2oyr h LEU 106 CO 0.03 0.42 -0.25 0.00 0.09 0.00 0.00 178.44 178.73 2oyr h ALA 107 N 1.30 1.21 -0.04 1.53 0.00 -1.00 -1.93 119.26 120.34 2oyr h ALA 107 Ca 0.27 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2oyr h ALA 107 Cb 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2oyr h ALA 107 CO -0.13 0.51 -0.44 0.77 0.00 0.00 0.00 179.25 179.96 2oyr h SER 108 N 0.33 0.08 0.30 0.00 0.02 -0.07 -2.84 113.55 111.38 2oyr h SER 108 Ca 0.05 -0.04 -0.16 0.00 -0.84 0.00 0.00 61.79 60.80 2oyr h SER 108 Cb 0.61 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 2oyr h SER 108 CO 0.04 0.52 -0.65 0.58 -1.14 0.00 0.00 176.83 176.18 2oyr h VAL 109 N 0.07 1.38 0.00 2.27 2.07 -1.05 -3.47 116.25 117.52 2oyr h VAL 109 Ca 0.00 -2.05 0.00 0.00 0.82 0.00 0.00 66.70 65.48 2oyr h VAL 109 Cb 0.81 2.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2oyr h VAL 109 CO 0.06 0.61 0.00 0.61 0.02 0.00 0.00 177.57 178.87 2oyr n GLY 110 N 0.39 -0.76 3.81 2.17 0.00 -1.07 -4.98 105.19 104.75 2oyr n GLY 110 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 2oyr n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oyr s ARG 112 N -3.68 3.78 -0.05 0.00 0.52 -1.26 -4.22 118.95 114.04 2oyr s ARG 112 Ca 0.63 -0.18 0.06 0.00 -0.52 0.00 0.00 55.73 55.72 2oyr s ARG 112 Cb -0.13 -3.74 -0.02 0.00 0.52 0.00 0.00 34.95 31.58 2oyr s ARG 112 CO 0.27 -0.43 -0.22 0.08 0.02 0.00 0.00 175.30 175.02 2oyr s VAL 113 N 2.09 2.36 0.41 3.52 1.01 0.12 -0.94 120.40 128.98 2oyr s VAL 113 Ca 0.14 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2oyr s VAL 113 Cb -0.16 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.37 2oyr s VAL 113 CO 0.11 0.58 0.12 0.54 0.00 0.00 0.00 175.10 176.45 2oyr n ARG 114 N 2.65 0.96 -3.64 2.72 1.74 -0.46 -1.83 116.66 118.81 2oyr n ARG 114 Ca -0.17 -2.83 -0.08 0.00 -0.77 0.00 0.00 57.85 53.99 2oyr n ARG 114 Cb 0.52 0.59 -0.07 0.00 -1.02 0.00 0.00 32.46 32.48 2oyr n ARG 114 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2oyr s LEU 116 N 0.00 -0.49 -0.16 0.55 1.02 0.32 -0.75 118.68 119.17 2oyr s LEU 116 Ca 0.09 0.92 -0.07 0.00 0.02 0.00 0.00 54.13 55.09 2oyr s LEU 116 Cb -0.01 1.91 0.07 0.00 0.02 0.00 0.00 46.19 48.18 2oyr s LEU 116 CO 0.06 -0.16 0.36 -0.70 0.02 0.00 0.00 176.35 175.93 2oyr s GLU 117 N 0.44 0.29 0.00 1.70 2.56 -0.75 -0.96 118.70 121.99 2oyr s GLU 117 Ca 0.01 0.81 0.22 0.00 0.00 0.00 0.00 54.97 56.01 2oyr s GLU 117 Cb -0.05 0.06 -0.29 0.00 2.00 0.00 0.00 34.13 35.85 2oyr s GLU 117 CO -0.07 -0.21 0.57 2.89 -0.56 0.00 0.00 175.26 177.87 2oyr n ARG 118 N 4.80 0.64 -2.49 4.30 1.85 -1.16 -2.36 116.66 122.25 2oyr n ARG 118 Ca -0.16 -0.15 -0.43 0.00 -1.00 0.00 0.00 57.85 56.11 2oyr n ARG 118 Cb 0.52 -1.56 -0.02 0.00 -1.05 0.00 0.00 32.46 30.34 2oyr n ARG 118 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 2oyr s ASN 119 N -4.62 6.78 0.31 2.89 3.84 -1.26 -4.91 114.94 117.97 2oyr s ASN 119 Ca -0.07 1.22 0.03 0.00 0.21 0.00 0.00 52.86 54.25 2oyr s ASN 119 Cb 0.13 -2.54 0.62 0.00 -0.55 0.00 0.00 41.25 38.91 2oyr s ASN 119 CO 0.89 -0.98 1.87 1.55 -2.79 0.00 0.00 177.10 177.64 2oyr h PRO 120 N 8.79 0.90 -0.18 0.43 0.13 -1.89 0.57 132.00 140.75 2oyr h PRO 120 Ca -0.24 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 64.77 2oyr h PRO 120 Cb 1.09 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 32.01 2oyr h PRO 120 CO 1.03 0.60 -0.12 0.28 -0.23 0.00 0.00 178.00 179.55 2oyr h VAL 121 N 0.93 1.32 -0.36 1.56 2.07 -1.91 -0.94 116.25 118.92 2oyr h VAL 121 Ca 0.45 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2oyr h VAL 121 Cb 0.46 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 2oyr h VAL 121 CO -0.21 0.37 0.24 0.58 0.02 0.00 0.00 177.57 178.56 2oyr h VAL 122 N 0.08 1.10 -0.95 2.57 2.07 -1.83 -1.57 116.25 117.72 2oyr h VAL 122 Ca 0.04 -0.18 0.02 0.00 0.82 0.00 0.00 66.70 67.39 2oyr h VAL 122 Cb 0.63 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2oyr h VAL 122 CO 0.03 0.09 0.63 0.00 0.02 0.00 0.00 177.57 178.35 2oyr h ALA 123 N 1.13 1.34 -0.57 1.67 0.00 -0.84 0.24 119.26 122.21 2oyr h ALA 123 Ca 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2oyr h ALA 123 Cb -0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.34 2oyr h ALA 123 CO -0.03 0.61 0.23 0.00 0.00 0.00 0.00 179.25 180.05 2oyr h ALA 124 N 1.42 0.75 -0.58 0.00 0.00 -0.69 0.12 119.26 120.27 2oyr h ALA 124 Ca 0.36 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2oyr h ALA 124 Cb -0.11 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2oyr h ALA 124 CO -0.08 0.36 0.04 -0.07 0.00 0.00 0.00 179.25 179.50 2oyr h LEU 125 N 0.79 0.95 -0.24 0.00 3.38 -0.56 -2.02 115.31 117.61 2oyr h LEU 125 Ca 0.19 -0.24 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 2oyr h LEU 125 Cb 0.21 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2oyr h LEU 125 CO -0.02 0.98 -0.34 -0.07 0.09 0.00 0.00 178.44 179.09 2oyr h LEU 126 N 0.91 0.72 -1.26 1.67 3.38 -0.68 -2.49 115.31 117.56 2oyr h LEU 126 Ca 0.17 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2oyr h LEU 126 Cb 0.48 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2oyr h LEU 126 CO 0.02 1.09 0.36 -0.78 0.09 0.00 0.00 178.44 179.22 2oyr h ASP 127 N 0.37 0.77 -0.41 -0.43 3.58 -0.64 0.21 116.42 119.87 2oyr h ASP 127 Ca 0.03 -0.05 -0.15 0.00 0.42 0.00 0.00 57.03 57.28 2oyr h ASP 127 Cb 0.93 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 2oyr h ASP 127 CO 0.08 0.61 -0.33 -0.78 -2.88 0.00 0.00 179.24 175.94 2oyr h ASP 128 N 0.88 0.99 -0.18 2.28 3.58 -1.32 -0.64 116.42 122.00 2oyr h ASP 128 Ca 0.23 -0.45 -0.11 0.00 0.42 0.00 0.00 57.03 57.12 2oyr h ASP 128 Cb -0.00 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.76 2oyr h ASP 128 CO -0.04 1.23 -0.25 1.23 -2.88 0.00 0.00 179.24 178.53 2oyr h GLY 129 N 0.76 0.70 1.21 -0.78 0.00 -0.91 -2.28 103.07 101.78 2oyr h GLY 129 Ca 0.07 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.69 2oyr h GLY 129 CO 0.09 0.54 -0.15 -2.00 0.00 0.00 0.00 176.54 175.02 2oyr h LEU 130 N 0.57 0.92 -0.65 3.11 5.85 -0.41 0.21 115.31 124.90 2oyr h LEU 130 Ca 0.08 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 2oyr h LEU 130 Cb 0.72 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2oyr h LEU 130 CO 0.06 1.06 0.29 0.00 -0.34 0.00 0.00 178.44 179.51 2oyr h ALA 131 N 1.01 0.84 -0.18 1.25 0.00 -0.88 0.30 119.26 121.61 2oyr h ALA 131 Ca 0.12 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2oyr h ALA 131 Cb 0.69 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2oyr h ALA 131 CO 0.05 0.43 -0.53 0.00 0.00 0.00 0.00 179.25 179.20 2oyr h ARG 132 N 0.91 0.51 -0.02 0.00 3.08 -1.17 -2.77 114.38 114.92 2oyr h ARG 132 Ca 0.22 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 2oyr h ARG 132 Cb 0.16 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 2oyr h ARG 132 CO -0.02 0.92 0.00 0.78 -1.07 0.00 0.00 179.97 180.57 2oyr h GLY 133 N 1.11 0.04 1.79 0.04 0.00 -0.02 -2.73 103.07 103.28 2oyr h GLY 133 Ca 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.34 2oyr h GLY 133 CO 0.10 0.02 0.08 -0.97 0.00 0.00 0.00 176.54 175.77 2oyr h TYR 134 N -0.26 0.02 0.00 5.60 0.05 -0.43 -1.59 116.97 120.37 2oyr h TYR 134 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2oyr h TYR 134 Cb 0.30 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2oyr h TYR 134 CO 0.03 0.01 0.00 0.00 -1.05 0.00 0.00 178.16 177.15 2oyr h ALA 135 N 1.94 1.00 -2.58 3.88 0.00 -1.28 -3.40 119.26 118.82 2oyr h ALA 135 Ca 0.05 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.44 2oyr h ALA 135 Cb 0.18 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.02 2oyr h ALA 135 CO -0.00 0.00 1.03 0.34 0.00 0.00 0.00 179.25 180.62 2oyr s ASP 136 N -5.51 6.44 0.59 0.00 2.15 -0.60 -4.88 116.67 114.86 2oyr s ASP 136 Ca 0.06 2.77 0.36 0.00 0.43 0.00 0.00 52.55 56.17 2oyr s ASP 136 Cb 0.08 -2.58 1.78 0.00 -0.30 0.00 0.00 42.92 41.90 2oyr s ASP 136 CO 0.60 -0.96 2.15 0.00 -0.17 0.00 0.00 175.17 176.79 2oyr h ALA 137 N 7.56 1.07 0.00 3.66 0.00 -1.88 0.25 119.26 129.91 2oyr h ALA 137 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2oyr h ALA 137 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2oyr h ALA 137 CO 0.95 0.04 -0.39 -1.91 0.00 0.00 0.00 179.25 177.94 2oyr n GLU 138 N -3.22 0.34 0.00 0.00 2.13 -1.26 -4.65 120.64 113.97 2oyr n GLU 138 Ca -0.01 0.46 0.11 0.00 0.66 0.00 0.00 57.16 58.38 2oyr n GLU 138 Cb 0.20 -1.46 0.10 0.00 0.27 0.00 0.00 31.44 30.56 2oyr n GLU 138 CO 0.00 0.00 0.00 0.44 -0.41 0.00 0.00 177.13 177.16 2oyr n ILE 139 N -4.03 0.00 -0.32 6.31 -5.35 -1.25 -4.44 119.36 110.29 2oyr n ILE 139 Ca -0.05 -0.05 0.07 0.00 -0.27 0.00 0.00 62.75 62.44 2oyr n ILE 139 Cb 0.20 0.67 0.22 0.00 -1.74 0.00 0.00 39.64 39.00 2oyr n ILE 139 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2oyr h GLY 140 N 4.97 1.46 0.49 3.28 0.00 -0.98 0.04 103.07 112.33 2oyr h GLY 140 Ca 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 2oyr h GLY 140 CO 0.00 0.05 -0.34 -1.33 0.00 0.00 0.00 176.54 174.92 2oyr h GLY 141 N 0.76 -1.03 2.00 4.60 0.00 -1.78 -2.51 103.07 105.12 2oyr h GLY 141 Ca 0.47 0.44 -0.07 0.00 0.00 0.00 0.00 47.33 48.17 2oyr h GLY 141 CO -0.31 -0.34 -0.32 0.11 0.00 0.00 0.00 176.54 175.67 2oyr h TRP 142 N -0.78 0.00 -0.42 5.60 5.08 -1.84 -3.17 115.95 120.41 2oyr h TRP 142 Ca -0.07 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.88 2oyr h TRP 142 Cb 0.64 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.78 2oyr h TRP 142 CO -0.08 0.32 0.19 1.25 -1.28 0.00 0.00 178.44 178.84 2oyr h LEU 143 N 0.00 0.57 -1.71 0.11 5.85 -0.94 0.11 115.31 119.30 2oyr h LEU 143 Ca -0.00 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 2oyr h LEU 143 Cb 0.83 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2oyr h LEU 143 CO 0.04 0.56 -0.18 -0.61 -0.34 0.00 0.00 178.44 177.92 2oyr h GLN 144 N 0.54 0.00 0.07 1.25 4.15 -1.42 0.43 115.11 120.13 2oyr h GLN 144 Ca 0.14 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.26 2oyr h GLN 144 Cb 0.16 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.83 2oyr h GLN 144 CO -0.01 0.18 -1.61 1.49 -1.93 0.00 0.00 178.83 176.94 2oyr h GLU 145 N 0.00 0.16 -0.06 1.69 4.81 -1.40 -3.39 114.58 116.38 2oyr h GLU 145 Ca -0.00 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2oyr h GLU 145 Cb 0.39 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2oyr h GLU 145 CO 0.02 0.94 0.00 0.54 -0.73 0.00 0.00 179.01 179.78 2oyr n ARG 146 N -3.33 1.46 -3.56 1.92 1.74 0.32 -4.86 116.66 110.35 2oyr n ARG 146 Ca -0.18 -1.57 -0.25 0.00 -0.77 0.00 0.00 57.85 55.09 2oyr n ARG 146 Cb 1.04 -1.33 -0.15 0.00 -1.02 0.00 0.00 32.46 30.99 2oyr n ARG 146 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2oyr s LEU 147 N -1.38 0.26 0.08 0.55 2.96 0.13 0.15 118.68 121.43 2oyr s LEU 147 Ca 0.21 -0.70 0.09 0.00 -0.22 0.00 0.00 54.13 53.51 2oyr s LEU 147 Cb 0.14 -0.10 -0.03 0.00 0.50 0.00 0.00 46.19 46.70 2oyr s LEU 147 CO 0.21 -0.37 -0.24 -1.10 -1.32 0.00 0.00 176.35 173.53 2oyr s GLN 148 N 2.18 1.46 -0.13 1.98 -0.21 -0.76 -4.62 119.66 119.57 2oyr s GLN 148 Ca 0.05 -1.16 -0.03 0.00 0.02 0.00 0.00 55.36 54.23 2oyr s GLN 148 Cb -0.16 -1.75 -0.03 0.00 1.00 0.00 0.00 33.01 32.07 2oyr s GLN 148 CO -0.18 0.43 -0.00 -1.17 -2.12 0.00 0.00 175.29 172.25 2oyr s LEU 149 N -1.62 3.49 -0.12 2.90 2.96 -1.26 -4.35 118.68 120.68 2oyr s LEU 149 Ca 0.11 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 54.07 2oyr s LEU 149 Cb -0.10 -1.83 0.01 0.00 0.50 0.00 0.00 46.19 44.78 2oyr s LEU 149 CO 0.04 0.27 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.54 2oyr s ILE 150 N -0.22 1.65 -0.65 6.68 1.01 -1.26 -5.02 121.20 123.39 2oyr s ILE 150 Ca 0.05 -0.72 -0.23 0.00 0.00 0.00 0.00 60.65 59.75 2oyr s ILE 150 Cb -0.12 -1.50 0.07 0.00 0.01 0.00 0.00 42.46 40.92 2oyr s ILE 150 CO 0.02 0.47 0.96 -2.28 0.00 0.00 0.00 174.94 174.11 2oyr s HIS 151 N 1.01 2.69 0.11 3.97 5.65 -1.26 -1.80 115.29 125.66 2oyr s HIS 151 Ca -0.05 -0.52 -0.26 0.00 0.25 0.00 0.00 55.06 54.49 2oyr s HIS 151 Cb -0.15 -4.27 0.08 0.00 -1.18 0.00 0.00 32.58 27.07 2oyr s HIS 151 CO -0.03 -1.62 1.07 0.00 -0.65 0.00 0.00 174.74 173.51 2oyr s ALA 152 N 4.03 -1.81 -0.27 1.58 0.00 -0.99 -4.94 121.76 119.35 2oyr s ALA 152 Ca 0.22 0.14 -0.10 0.00 0.00 0.00 0.00 51.96 52.23 2oyr s ALA 152 Cb -0.17 0.61 -0.04 0.00 0.00 0.00 0.00 23.12 23.53 2oyr s ALA 152 CO 0.11 -1.06 0.15 0.45 0.00 0.00 0.00 175.76 175.41 2oyr s SER 153 N -3.10 5.69 0.60 0.00 0.15 -1.26 -2.99 113.70 112.78 2oyr s SER 153 Ca 0.16 -0.10 0.40 0.00 0.70 0.00 0.00 55.95 57.11 2oyr s SER 153 Cb -0.00 -2.05 2.18 0.00 -1.71 0.00 0.00 66.02 64.44 2oyr s SER 153 CO 0.01 -0.05 2.23 0.28 1.20 0.00 0.00 173.24 176.91 2oyr h SER 154 N 8.32 0.00 0.25 5.45 0.02 -1.95 0.14 113.55 125.78 2oyr h SER 154 Ca -0.36 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 2oyr h SER 154 Cb 1.18 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 2oyr h SER 154 CO 0.56 0.00 -0.14 -0.07 -1.14 0.00 0.00 176.83 176.05 2oyr h LEU 155 N 0.00 0.00 -0.02 5.07 3.38 -1.92 -3.10 115.31 118.72 2oyr h LEU 155 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oyr h LEU 155 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2oyr h LEU 155 CO 0.00 0.14 0.00 0.35 0.09 0.00 0.00 178.44 179.02 2oyr n THR 156 N -3.95 0.00 0.05 0.22 -2.24 -0.63 -4.81 114.28 102.92 2oyr n THR 156 Ca -0.02 -0.21 0.11 0.00 -2.27 0.00 0.00 64.05 61.66 2oyr n THR 156 Cb 0.23 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.37 2oyr n THR 156 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oyr n ALA 157 N -0.41 2.73 -0.30 6.98 0.00 0.40 -4.38 120.51 125.52 2oyr n ALA 157 Ca 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 53.44 53.01 2oyr n ALA 157 Cb 0.01 -0.88 0.14 0.00 0.00 0.00 0.00 19.45 18.72 2oyr n ALA 157 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2oyr h LEU 158 N 0.00 1.04 -0.41 0.00 4.07 -1.74 -3.21 115.31 115.05 2oyr h LEU 158 Ca 0.00 -0.06 0.07 0.00 0.08 0.00 0.00 57.88 57.97 2oyr h LEU 158 Cb 0.99 -0.26 -0.07 0.00 1.08 0.00 0.00 40.66 42.40 2oyr h LEU 158 CO 0.00 0.80 0.01 0.74 -1.08 0.00 0.00 178.44 178.92 2oyr h THR 159 N 1.20 0.70 -0.68 0.22 2.02 -1.85 -2.59 112.91 111.92 2oyr h THR 159 Ca 0.31 -0.04 -0.36 0.00 0.77 0.00 0.00 66.41 67.09 2oyr h THR 159 Cb -0.04 0.57 -0.21 0.00 -1.74 0.00 0.00 68.15 66.72 2oyr h THR 159 CO -0.06 0.02 0.46 0.47 0.37 0.00 0.00 175.52 176.78 2oyr n ASP 160 N -5.18 3.76 -4.68 4.18 8.00 -1.21 -4.92 116.55 116.48 2oyr n ASP 160 Ca 0.03 -3.11 -0.41 0.00 0.71 0.00 0.00 54.79 52.01 2oyr n ASP 160 Cb 0.21 -0.75 -0.04 0.00 -0.02 0.00 0.00 41.12 40.53 2oyr n ASP 160 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oyr s ILE 161 N -2.31 4.88 -0.06 0.53 -1.09 -0.98 -5.03 121.20 117.13 2oyr s ILE 161 Ca 0.39 1.73 -0.04 0.00 -2.23 0.00 0.00 60.65 60.50 2oyr s ILE 161 Cb 0.33 -4.18 0.03 0.00 -1.58 0.00 0.00 42.46 37.05 2oyr s ILE 161 CO 0.07 0.06 0.15 0.28 -1.23 0.00 0.00 174.94 174.27 2oyr s THR 162 N 1.86 -0.02 0.57 2.92 -1.32 -1.26 -3.91 115.64 114.48 2oyr s THR 162 Ca 0.41 0.08 -0.17 0.00 -1.21 0.00 0.00 61.69 60.80 2oyr s THR 162 Cb -0.17 -0.24 -0.04 0.00 -1.51 0.00 0.00 72.50 70.54 2oyr s THR 162 CO 0.15 0.03 1.07 -2.16 -2.21 0.00 0.00 174.62 171.51 2oyr s PRO 163 N 0.57 3.35 0.25 7.08 0.04 -1.26 -5.10 135.00 139.93 2oyr s PRO 163 Ca -0.04 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.01 2oyr s PRO 163 Cb -0.06 -2.03 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 2oyr s PRO 163 CO -0.03 -0.80 1.55 1.03 0.04 0.00 0.00 177.00 178.79 2oyr s ARG 164 N -3.79 4.19 0.52 4.56 0.52 -1.25 -5.00 118.95 118.70 2oyr s ARG 164 Ca 0.66 2.44 -0.09 0.00 -0.52 0.00 0.00 55.73 58.22 2oyr s ARG 164 Cb -0.18 -3.08 -0.05 0.00 0.52 0.00 0.00 34.95 32.16 2oyr s ARG 164 CO 0.33 -0.56 0.89 -1.25 0.02 0.00 0.00 175.30 174.72 2oyr s PRO 165 N 0.00 3.64 0.21 3.54 0.04 -1.26 -4.91 135.00 136.26 2oyr s PRO 165 Ca 0.64 0.51 0.11 0.00 0.04 0.00 0.00 61.00 62.30 2oyr s PRO 165 Cb -0.45 -2.25 0.08 0.00 0.04 0.00 0.00 34.50 31.92 2oyr s PRO 165 CO 0.42 -0.32 1.44 1.96 0.04 0.00 0.00 177.00 180.54 2oyr h GLN 166 N 0.26 0.00 -4.57 4.56 7.50 -1.72 -2.32 115.11 118.82 2oyr h GLN 166 Ca -0.46 0.00 -0.30 0.00 0.50 0.00 0.00 58.65 58.39 2oyr h GLN 166 Cb 1.19 0.00 -0.24 0.00 0.05 0.00 0.00 27.48 28.49 2oyr h GLN 166 CO 0.62 0.75 -0.75 0.08 -1.50 0.00 0.00 178.83 178.04 2oyr s VAL 167 N -3.07 0.56 -0.10 -0.54 1.01 -1.04 -0.67 120.40 116.54 2oyr s VAL 167 Ca 0.01 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.19 2oyr s VAL 167 Cb 0.10 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 35.92 2oyr s VAL 167 CO 0.78 -0.20 -0.19 -0.69 0.00 0.00 0.00 175.10 174.79 2oyr s VAL 168 N -0.97 1.76 -0.18 2.92 1.01 -0.57 -1.84 120.40 122.52 2oyr s VAL 168 Ca -0.05 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.03 2oyr s VAL 168 Cb -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2oyr s VAL 168 CO 0.00 0.49 0.04 -0.47 0.00 0.00 0.00 175.10 175.17 2oyr s TYR 169 N 0.63 3.19 -0.13 5.22 5.04 0.03 -1.06 117.35 130.28 2oyr s TYR 169 Ca -0.13 -0.05 0.01 0.00 -2.44 0.00 0.00 57.07 54.47 2oyr s TYR 169 Cb -0.16 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.10 2oyr s TYR 169 CO 0.04 0.07 -0.16 -0.51 -1.34 0.00 0.00 175.55 173.65 2oyr s LEU 170 N 0.47 1.76 -0.39 6.97 1.43 0.11 -1.99 118.68 127.05 2oyr s LEU 170 Ca 0.02 -0.47 0.11 0.00 -1.03 0.00 0.00 54.13 52.75 2oyr s LEU 170 Cb -0.13 -1.17 0.34 0.00 0.03 0.00 0.00 46.19 45.26 2oyr s LEU 170 CO 0.01 -0.00 0.81 -0.67 0.23 0.00 0.00 176.35 176.73 2oyr n ASP 171 N 4.39 0.12 0.00 2.29 2.03 -1.26 -0.74 116.55 123.37 2oyr n ASP 171 Ca -0.18 -3.15 0.00 0.00 0.52 0.00 0.00 54.79 51.98 2oyr n ASP 171 Cb 0.51 -0.07 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 2oyr n ASP 171 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2oyr n PRO 172 N 0.34 0.00 -3.66 -0.67 -0.04 -1.26 -4.93 135.00 124.78 2oyr n PRO 172 Ca 0.21 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.52 2oyr n PRO 172 Cb 0.66 -0.08 -0.07 0.00 -0.04 0.00 0.00 33.50 33.97 2oyr n PRO 172 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2oyr s PHE 174 N 0.00 -0.38 -1.12 0.54 5.36 -1.26 -4.94 117.98 116.18 2oyr s PHE 174 Ca 0.00 0.61 -0.21 0.00 -0.96 0.00 0.00 56.93 56.37 2oyr s PHE 174 Cb 0.00 0.23 -0.07 0.00 -0.34 0.00 0.00 43.02 42.84 2oyr s PHE 174 CO 0.00 -0.48 1.92 -2.30 -1.46 0.00 0.00 175.22 172.90 2oyr n PRO 175 N 1.10 1.99 -2.07 10.12 -0.02 -1.26 -4.72 135.00 140.15 2oyr n PRO 175 Ca -0.20 -2.47 -0.42 0.00 -2.02 0.00 0.00 63.50 58.39 2oyr n PRO 175 Cb 0.56 -3.43 -0.03 0.00 -0.02 0.00 0.00 33.50 30.59 2oyr n PRO 175 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2oyr s HIS 176 N 7.41 3.15 -0.11 6.00 3.76 -1.26 -4.92 115.29 129.32 2oyr s HIS 176 Ca 0.61 0.80 0.02 0.00 -0.15 0.00 0.00 55.06 56.34 2oyr s HIS 176 Cb 0.06 -3.79 -0.08 0.00 1.11 0.00 0.00 32.58 29.88 2oyr s HIS 176 CO 0.10 -2.84 -0.09 1.63 -0.85 0.00 0.00 174.74 172.70 2oyr n LYS 177 N 4.02 0.59 0.00 1.40 4.01 -1.26 -5.13 118.16 121.79 2oyr n LYS 177 Ca 0.13 0.06 0.00 0.00 -0.51 0.00 0.00 58.31 57.98 2oyr n LYS 177 Cb 0.41 -1.23 0.00 0.00 -0.51 0.00 0.00 35.03 33.69 2oyr n LYS 177 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2oyr n GLN 178 N -2.77 0.00 -0.63 1.97 6.02 -1.26 -5.35 117.38 115.35 2oyr n GLN 178 Ca -0.20 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.51 2oyr n GLN 178 Cb 0.73 0.00 0.25 0.00 1.02 0.00 0.00 30.24 32.24 2oyr n GLN 178 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2oyr s LYS 184 N 0.00 -1.05 0.17 -1.09 -0.14 -1.26 -5.33 119.74 111.05 2oyr s LYS 184 Ca 0.00 0.66 -0.17 0.00 -1.36 0.00 0.00 55.97 55.10 2oyr s LYS 184 Cb 0.00 -1.55 0.12 0.00 -1.68 0.00 0.00 37.83 34.72 2oyr s LYS 184 CO 0.00 -3.76 1.65 0.87 -0.76 0.00 0.00 175.35 173.35 2oyr h LYS 185 N -2.64 -0.04 0.00 1.68 1.57 -2.00 -1.89 116.57 113.25 2oyr h LYS 185 Ca -0.60 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 2oyr h LYS 185 Cb 1.34 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.66 2oyr h LYS 185 CO 0.50 -0.03 0.00 0.39 -0.57 0.00 0.00 179.45 179.74 2oyr n GLU 186 N -5.35 0.00 0.00 3.15 4.71 -1.26 -1.46 120.64 120.43 2oyr n GLU 186 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.18 2oyr n GLU 186 Cb 0.26 -0.83 0.00 0.00 -1.01 0.00 0.00 31.44 29.85 2oyr n GLU 186 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 2oyr n ARG 188 N 0.03 0.00 0.00 3.49 0.63 -0.71 -1.30 116.66 118.81 2oyr n ARG 188 Ca 0.00 0.00 -0.13 0.00 -0.92 0.00 0.00 57.85 56.80 2oyr n ARG 188 Cb 0.00 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 32.82 2oyr n ARG 188 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2oyr h VAL 189 N 0.00 1.29 -0.84 5.15 2.07 -1.53 -2.49 116.25 119.89 2oyr h VAL 189 Ca 0.00 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.58 2oyr h VAL 189 Cb 0.00 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 2oyr h VAL 189 CO 0.00 0.24 0.56 0.15 0.02 0.00 0.00 177.57 178.54 2oyr h PHE 190 N -0.44 1.06 0.00 1.57 3.04 -1.46 -2.26 116.94 118.46 2oyr h PHE 190 Ca -0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2oyr h PHE 190 Cb 0.42 -0.36 0.00 0.00 2.56 0.00 0.00 35.95 38.57 2oyr h PHE 190 CO 0.07 0.66 0.00 1.96 -2.02 0.00 0.00 178.31 178.97 2oyr h GLN 191 N 1.13 0.00 0.00 1.11 4.20 -1.79 -0.08 115.11 119.68 2oyr h GLN 191 Ca 0.31 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 2oyr h GLN 191 Cb -0.12 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 2oyr h GLN 191 CO -0.07 0.00 -0.05 0.77 -0.67 0.00 0.00 178.83 178.81 2oyr h SER 192 N 0.00 0.00 0.00 1.46 0.02 -0.92 -3.29 113.55 110.82 2oyr h SER 192 Ca 0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 2oyr h SER 192 Cb 0.57 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.06 2oyr h SER 192 CO 0.00 0.05 -1.71 -0.11 -1.14 0.00 0.00 176.83 173.92 2oyr n LEU 193 N -3.13 1.90 -4.41 5.07 7.94 -0.81 -4.85 117.00 118.71 2oyr n LEU 193 Ca 0.02 0.40 -0.44 0.00 -1.11 0.00 0.00 56.01 54.88 2oyr n LEU 193 Cb 0.43 -0.88 -0.06 0.00 0.53 0.00 0.00 43.42 43.44 2oyr n LEU 193 CO 0.31 0.29 0.30 -0.69 -1.11 0.00 0.00 177.39 176.49 2oyr s VAL 194 N -2.46 4.93 0.44 1.96 1.01 -0.11 -5.06 120.40 121.11 2oyr s VAL 194 Ca -0.32 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 60.81 2oyr s VAL 194 Cb 0.09 -4.34 0.10 0.00 0.00 0.00 0.00 36.38 32.23 2oyr s VAL 194 CO 0.50 -0.88 0.60 0.61 0.00 0.00 0.00 175.10 175.93 2oyr n GLY 195 N 5.22 -0.52 3.70 4.51 0.00 -1.26 -4.54 105.19 112.29 2oyr n GLY 195 Ca -0.09 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.69 2oyr n GLY 195 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2oyr n PRO 196 N -2.21 2.19 -2.80 1.61 -0.02 -1.26 -4.89 135.00 127.62 2oyr n PRO 196 Ca 0.08 0.77 -0.43 0.00 -2.02 0.00 0.00 63.50 61.91 2oyr n PRO 196 Cb 0.29 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.32 2oyr n PRO 196 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2oyr s ASP 197 N -0.01 6.26 0.55 2.55 1.01 -1.26 -4.89 116.67 120.88 2oyr s ASP 197 Ca 0.61 -1.10 0.25 0.00 0.71 0.00 0.00 52.55 53.02 2oyr s ASP 197 Cb -0.58 -2.45 1.45 0.00 1.01 0.00 0.00 42.92 42.35 2oyr s ASP 197 CO 0.56 -1.45 2.03 -0.07 0.21 0.00 0.00 175.17 176.46 2oyr h LEU 198 N 11.56 0.00 -3.50 1.23 3.38 -2.03 -2.16 115.31 123.80 2oyr h LEU 198 Ca -0.19 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.64 2oyr h LEU 198 Cb 1.06 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.72 2oyr h LEU 198 CO 1.20 0.00 0.11 -0.90 0.09 0.00 0.00 178.44 178.95 2oyr n ASP 199 N -4.21 4.03 -0.21 -0.43 5.68 -1.26 -4.70 116.55 115.45 2oyr n ASP 199 Ca 0.06 -3.28 -0.03 0.00 -0.50 0.00 0.00 54.79 51.04 2oyr n ASP 199 Cb 0.48 -0.66 0.15 0.00 -1.14 0.00 0.00 41.12 39.95 2oyr n ASP 199 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2oyr h ALA 200 N 2.02 1.18 -0.01 2.12 0.00 -1.80 -2.53 119.26 120.24 2oyr h ALA 200 Ca 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oyr h ALA 200 Cb 1.91 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 2oyr h ALA 200 CO 0.50 0.59 0.22 -0.44 0.00 0.00 0.00 179.25 180.12 2oyr h ASP 201 N 0.99 0.00 0.18 0.00 3.32 -1.84 0.04 116.42 119.10 2oyr h ASP 201 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2oyr h ASP 201 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2oyr h ASP 201 CO -0.02 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.11 2oyr n GLY 202 N -1.19 -1.09 0.08 2.75 0.00 -0.95 -3.74 105.19 101.06 2oyr n GLY 202 Ca -0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.77 2oyr n GLY 202 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oyr h LEU 203 N 0.00 0.00 0.05 0.99 4.07 -1.16 -3.39 115.31 115.87 2oyr h LEU 203 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 2oyr h LEU 203 Cb 0.09 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 2oyr h LEU 203 CO 0.00 0.86 -0.12 0.25 -1.08 0.00 0.00 178.44 178.35 2oyr h LEU 204 N 0.00 -0.34 0.22 1.67 5.85 -1.76 -1.44 115.31 119.52 2oyr h LEU 204 Ca -0.10 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.67 2oyr h LEU 204 Cb 1.74 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.87 2oyr h LEU 204 CO 0.09 -0.18 -0.46 -0.08 -0.34 0.00 0.00 178.44 177.48 2oyr h GLU 205 N -0.23 -0.73 0.00 1.25 4.57 -1.83 -0.65 114.58 116.97 2oyr h GLU 205 Ca 0.03 0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.21 2oyr h GLU 205 Cb 0.26 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 2oyr h GLU 205 CO -0.09 -0.49 -0.21 -1.00 -1.18 0.00 0.00 179.01 176.04 2oyr h PRO 206 N -0.76 0.00 -0.29 0.92 0.13 -1.75 -2.76 132.00 127.50 2oyr h PRO 206 Ca -0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 2oyr h PRO 206 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 2oyr h PRO 206 CO -0.20 0.21 -0.04 0.00 -0.23 0.00 0.00 178.00 177.73 2oyr h ALA 207 N 1.79 0.39 0.00 -0.56 0.00 -0.65 -2.04 119.26 118.19 2oyr h ALA 207 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2oyr h ALA 207 Cb 0.40 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2oyr h ALA 207 CO 0.03 0.18 -0.03 0.00 0.00 0.00 0.00 179.25 179.43 2oyr h ARG 208 N 0.31 0.00 0.10 0.00 3.08 -0.95 -1.48 114.38 115.43 2oyr h ARG 208 Ca 0.08 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.84 2oyr h ARG 208 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2oyr h ARG 208 CO 0.02 0.03 -1.38 -0.07 -1.07 0.00 0.00 179.97 177.50 2oyr h LEU 209 N 0.00 0.33 0.00 3.04 3.38 -1.30 -2.53 115.31 118.23 2oyr h LEU 209 Ca -0.00 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.52 2oyr h LEU 209 Cb 0.50 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2oyr h LEU 209 CO 0.00 1.34 -0.14 0.25 0.09 0.00 0.00 178.44 179.98 2oyr h LEU 210 N 0.06 0.12 -9.90 1.67 5.85 -1.08 -3.42 115.31 108.61 2oyr h LEU 210 Ca -0.18 -0.80 -0.53 0.00 0.84 0.00 0.00 57.88 57.21 2oyr h LEU 210 Cb 1.97 -0.04 0.08 0.00 0.37 0.00 0.00 40.66 43.04 2oyr h LEU 210 CO 0.17 0.90 0.70 0.00 -0.34 0.00 0.00 178.44 179.86 2oyr s ALA 211 N -3.03 3.53 -0.13 1.25 0.00 -0.58 -4.41 121.76 118.39 2oyr s ALA 211 Ca -0.17 1.38 0.19 0.00 0.00 0.00 0.00 51.96 53.36 2oyr s ALA 211 Cb -0.00 -3.53 -0.18 0.00 0.00 0.00 0.00 23.12 19.41 2oyr s ALA 211 CO 0.72 -0.80 0.65 0.25 0.00 0.00 0.00 175.76 176.58 2oyr n THR 212 N 0.74 0.88 -0.03 0.00 -2.24 -0.87 0.07 114.28 112.83 2oyr n THR 212 Ca 0.01 -0.66 -0.07 0.00 -2.27 0.00 0.00 64.05 61.06 2oyr n THR 212 Cb 0.41 -0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.14 2oyr n THR 212 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2oyr n LYS 213 N -2.70 0.16 -3.55 -0.78 4.76 0.15 -3.04 118.16 113.16 2oyr n LYS 213 Ca -0.11 0.07 -0.11 0.00 -2.87 0.00 0.00 58.31 55.29 2oyr n LYS 213 Cb 0.79 -0.77 -0.03 0.00 -1.84 0.00 0.00 35.03 33.17 2oyr n LYS 213 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2oyr s ARG 214 N -2.17 1.17 -0.09 1.97 3.52 0.13 -2.33 118.95 121.15 2oyr s ARG 214 Ca -0.10 -0.62 0.01 0.00 -0.13 0.00 0.00 55.73 54.88 2oyr s ARG 214 Cb 0.03 0.52 0.02 0.00 -1.56 0.00 0.00 34.95 33.97 2oyr s ARG 214 CO 0.13 -0.49 -0.09 0.08 -0.81 0.00 0.00 175.30 174.13 2oyr s VAL 215 N -3.79 1.03 -0.13 7.11 1.01 -0.74 -1.51 120.40 123.38 2oyr s VAL 215 Ca 0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 2oyr s VAL 215 Cb 0.01 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2oyr s VAL 215 CO -0.12 0.35 -0.09 -0.69 0.00 0.00 0.00 175.10 174.56 2oyr s VAL 216 N 1.26 3.45 -0.14 2.92 1.01 -0.22 -0.72 120.40 127.95 2oyr s VAL 216 Ca -0.03 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2oyr s VAL 216 Cb -0.14 -2.47 0.02 0.00 0.00 0.00 0.00 36.38 33.79 2oyr s VAL 216 CO -0.03 0.52 -0.18 -0.69 0.00 0.00 0.00 175.10 174.72 2oyr s VAL 217 N 0.25 1.78 0.06 2.92 1.01 -0.13 0.08 120.40 126.38 2oyr s VAL 217 Ca -0.06 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 2oyr s VAL 217 Cb -0.15 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2oyr s VAL 217 CO 0.04 0.50 0.96 -0.75 0.00 0.00 0.00 175.10 175.85 2oyr s LYS 218 N 1.14 4.63 -0.02 2.72 2.20 0.08 -0.46 119.74 130.03 2oyr s LYS 218 Ca -0.01 1.42 -0.01 0.00 -0.36 0.00 0.00 55.97 57.01 2oyr s LYS 218 Cb -0.14 -3.41 0.02 0.00 -1.51 0.00 0.00 37.83 32.78 2oyr s LYS 218 CO -0.06 0.09 0.05 1.03 -0.36 0.00 0.00 175.35 176.10 2oyr s ARG 219 N 0.46 0.02 0.88 4.03 1.81 0.00 -4.79 118.95 121.37 2oyr s ARG 219 Ca 0.49 0.14 -0.12 0.00 -1.72 0.00 0.00 55.73 54.52 2oyr s ARG 219 Cb -0.22 -0.10 0.12 0.00 -0.45 0.00 0.00 34.95 34.30 2oyr s ARG 219 CO 0.29 -0.08 1.11 -1.25 -0.68 0.00 0.00 175.30 174.68 2oyr s PRO 220 N 0.53 1.36 0.29 3.54 0.04 -1.26 -0.16 135.00 139.33 2oyr s PRO 220 Ca -0.04 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.26 2oyr s PRO 220 Cb -0.06 -1.84 -0.12 0.00 0.04 0.00 0.00 34.50 32.52 2oyr s PRO 220 CO -0.02 -2.11 1.56 -0.25 0.04 0.00 0.00 177.00 176.23 2oyr n ASP 221 N -3.75 3.66 0.00 6.66 8.00 -0.11 -1.96 116.55 129.06 2oyr n ASP 221 Ca 0.07 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.71 2oyr n ASP 221 Cb 0.57 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.10 2oyr n ASP 221 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2oyr n TYR 222 N 2.06 0.00 -2.09 1.24 4.01 -1.26 -4.99 117.16 116.13 2oyr n TYR 222 Ca 0.09 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.42 2oyr n TYR 222 Cb 0.36 -0.27 -0.02 0.00 -0.31 0.00 0.00 39.34 39.09 2oyr n TYR 222 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2oyr s ALA 223 N -2.41 3.55 0.68 -0.72 0.00 -0.83 -4.97 121.76 117.05 2oyr s ALA 223 Ca 0.00 1.26 -0.16 0.00 0.00 0.00 0.00 51.96 53.07 2oyr s ALA 223 Cb 0.00 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.62 2oyr s ALA 223 CO 0.00 -0.66 1.17 -2.14 0.00 0.00 0.00 175.76 174.13 2oyr s PRO 224 N -1.07 2.54 0.69 0.00 0.02 -1.26 -4.87 135.00 131.05 2oyr s PRO 224 Ca 0.54 1.64 -0.16 0.00 0.02 0.00 0.00 61.00 63.04 2oyr s PRO 224 Cb -0.40 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.24 2oyr s PRO 224 CO 0.48 -1.50 1.18 -1.25 -0.33 0.00 0.00 177.00 175.58 2oyr s PRO 225 N -3.85 2.43 0.21 5.54 0.04 -1.26 -4.90 135.00 133.21 2oyr s PRO 225 Ca 0.72 1.68 -0.32 0.00 0.04 0.00 0.00 61.00 63.13 2oyr s PRO 225 Cb -0.26 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.28 2oyr s PRO 225 CO 0.41 -1.59 1.70 -1.17 0.04 0.00 0.00 177.00 176.39 2oyr s LEU 226 N -4.90 4.37 -1.57 -3.56 2.96 -1.26 -1.38 118.68 113.33 2oyr s LEU 226 Ca 0.73 2.86 0.00 0.00 -0.22 0.00 0.00 54.13 57.50 2oyr s LEU 226 Cb -0.27 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.81 2oyr s LEU 226 CO 0.42 -0.96 0.00 0.00 -1.32 0.00 0.00 176.35 174.49 2oyr n ALA 227 N 3.81 -0.23 -1.68 5.97 0.00 -1.26 -2.48 120.51 124.64 2oyr n ALA 227 Ca 0.15 0.24 -0.20 0.00 0.00 0.00 0.00 53.44 53.63 2oyr n ALA 227 Cb 0.36 -1.69 -0.08 0.00 0.00 0.00 0.00 19.45 18.04 2oyr n ALA 227 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2oyr n ASN 228 N -0.74 -5.30 -4.44 0.00 5.03 -0.48 -4.93 115.26 104.41 2oyr n ASN 228 Ca -0.15 0.43 -0.44 0.00 0.87 0.00 0.00 54.58 55.30 2oyr n ASN 228 Cb 0.54 -4.66 -0.05 0.00 -1.02 0.00 0.00 39.78 34.58 2oyr n ASN 228 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2oyr s VAL 229 N -2.73 4.71 0.57 2.41 1.01 -1.03 -4.95 120.40 120.39 2oyr s VAL 229 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 61.27 2oyr s VAL 229 Cb 0.00 -4.45 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 2oyr s VAL 229 CO 0.00 -1.04 1.17 0.00 0.00 0.00 0.00 175.10 175.23 2oyr s ALA 230 N 3.04 2.62 -0.07 5.51 0.00 -1.26 -4.65 121.76 126.95 2oyr s ALA 230 Ca 0.17 0.91 -0.06 0.00 0.00 0.00 0.00 51.96 52.98 2oyr s ALA 230 Cb -0.19 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.54 2oyr s ALA 230 CO 0.11 -0.96 0.18 -0.08 0.00 0.00 0.00 175.76 175.00 2oyr s THR 231 N -1.70 -0.01 -0.59 0.00 -1.32 -1.26 -5.05 115.64 105.72 2oyr s THR 231 Ca 0.75 0.02 0.25 0.00 -1.21 0.00 0.00 61.69 61.50 2oyr s THR 231 Cb -0.27 -0.26 0.31 0.00 -1.51 0.00 0.00 72.50 70.77 2oyr s THR 231 CO 0.30 0.01 1.71 1.55 -2.21 0.00 0.00 174.62 175.98 2oyr h PRO 232 N 6.02 0.00 -5.42 7.08 0.13 -1.97 -3.45 132.00 134.39 2oyr h PRO 232 Ca -0.27 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.23 2oyr h PRO 232 Cb 1.19 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.20 2oyr h PRO 232 CO 0.40 0.00 -0.52 -0.80 -0.23 0.00 0.00 178.00 176.85 2oyr s ASN 233 N -5.22 5.99 -0.22 1.44 0.01 -1.26 -5.07 114.94 110.61 2oyr s ASN 233 Ca 0.09 0.23 -0.29 0.00 -0.71 0.00 0.00 52.86 52.18 2oyr s ASN 233 Cb 0.09 -2.00 0.15 0.00 0.41 0.00 0.00 41.25 39.91 2oyr s ASN 233 CO 0.62 0.25 1.13 0.00 -1.51 0.00 0.00 177.10 177.59 2oyr s ALA 234 N -0.06 -2.01 -0.25 0.60 0.00 -1.26 -0.77 121.76 118.01 2oyr s ALA 234 Ca 0.08 1.71 -0.12 0.00 0.00 0.00 0.00 51.96 53.64 2oyr s ALA 234 Cb -0.12 -1.11 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 2oyr s ALA 234 CO 0.00 -0.26 0.22 0.08 0.00 0.00 0.00 175.76 175.81 2oyr s VAL 235 N -0.78 5.31 -0.15 0.00 1.01 -0.44 -4.89 120.40 120.45 2oyr s VAL 235 Ca 0.02 0.30 -0.06 0.00 0.00 0.00 0.00 61.98 62.24 2oyr s VAL 235 Cb -0.02 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2oyr s VAL 235 CO -0.03 0.29 0.07 -0.69 0.00 0.00 0.00 175.10 174.74 2oyr s VAL 236 N 1.35 4.86 0.40 2.92 1.01 -1.26 -0.22 120.40 129.45 2oyr s VAL 236 Ca 0.10 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.11 2oyr s VAL 236 Cb -0.14 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 2oyr s VAL 236 CO 0.07 0.52 0.19 0.41 0.00 0.00 0.00 175.10 176.29 2oyr n THR 237 N 2.95 0.00 -2.43 3.92 -1.04 -0.64 -5.02 114.28 112.01 2oyr n THR 237 Ca -0.18 -2.49 -0.42 0.00 -2.04 0.00 0.00 64.05 58.92 2oyr n THR 237 Cb 0.53 1.00 -0.03 0.00 -1.82 0.00 0.00 70.33 70.01 2oyr n THR 237 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2oyr s LYS 238 N -3.55 4.31 0.00 -2.82 2.20 -1.26 -3.50 119.74 115.12 2oyr s LYS 238 Ca 0.27 1.69 0.00 0.00 -0.36 0.00 0.00 55.97 57.57 2oyr s LYS 238 Cb 0.01 -3.62 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 2oyr s LYS 238 CO 0.19 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 175.06 2oyr n GLY 239 N 3.46 2.68 3.48 5.54 0.00 -1.26 -4.98 105.19 114.11 2oyr n GLY 239 Ca 0.12 -0.41 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 2oyr n GLY 239 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2oyr s HIS 240 N -1.28 0.88 0.15 1.61 -3.43 -1.23 -0.93 115.29 111.06 2oyr s HIS 240 Ca 0.00 -1.15 0.00 0.00 -0.80 0.00 0.00 55.06 53.11 2oyr s HIS 240 Cb 0.00 -0.06 -0.04 0.00 -1.43 0.00 0.00 32.58 31.04 2oyr s HIS 240 CO 0.00 -1.04 0.04 -0.98 -2.00 0.00 0.00 174.74 170.76 2oyr s ARG 241 N -3.44 1.01 -0.32 -0.38 1.70 0.77 -1.63 118.95 116.66 2oyr s ARG 241 Ca 0.29 -1.49 0.03 0.00 -0.47 0.00 0.00 55.73 54.10 2oyr s ARG 241 Cb 0.00 0.05 0.09 0.00 -0.57 0.00 0.00 34.95 34.52 2oyr s ARG 241 CO 0.16 -0.22 0.02 -0.06 -1.08 0.00 0.00 175.30 174.12 2oyr s PHE 242 N -3.90 3.54 0.27 5.89 0.08 0.70 -0.82 117.98 123.73 2oyr s PHE 242 Ca 0.25 -2.78 -0.29 0.00 0.12 0.00 0.00 56.93 54.22 2oyr s PHE 242 Cb 0.07 -2.64 -0.09 0.00 -0.57 0.00 0.00 43.02 39.79 2oyr s PHE 242 CO 0.03 -0.93 1.26 -0.51 -0.10 0.00 0.00 175.22 174.97 2oyr s ASP 243 N 0.99 6.94 -0.18 1.36 1.01 0.40 -1.33 116.67 125.85 2oyr s ASP 243 Ca 0.06 2.48 -0.00 0.00 0.71 0.00 0.00 52.55 55.80 2oyr s ASP 243 Cb -0.19 -2.63 0.01 0.00 1.01 0.00 0.00 42.92 41.12 2oyr s ASP 243 CO -0.08 -0.44 -0.15 -0.63 0.21 0.00 0.00 175.17 174.08 2oyr s ILE 244 N -0.64 2.58 0.30 0.77 1.01 0.05 -0.96 121.20 124.32 2oyr s ILE 244 Ca 0.51 -0.77 0.11 0.00 0.00 0.00 0.00 60.65 60.50 2oyr s ILE 244 Cb -0.37 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 2oyr s ILE 244 CO 0.44 0.50 -0.15 -0.31 0.00 0.00 0.00 174.94 175.43 2oyr s TYR 245 N 1.18 2.36 0.33 3.97 1.51 0.10 -4.44 117.35 122.37 2oyr s TYR 245 Ca 0.02 -0.37 -0.17 0.00 -1.01 0.00 0.00 57.07 55.54 2oyr s TYR 245 Cb -0.14 -1.12 -0.09 0.00 -0.11 0.00 0.00 41.96 40.49 2oyr s TYR 245 CO -0.06 0.67 0.78 0.00 -1.11 0.00 0.00 175.55 175.82 2oyr s ALA 246 N -2.52 3.28 0.27 3.71 0.00 -1.26 -1.79 121.76 123.46 2oyr s ALA 246 Ca 0.31 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2oyr s ALA 246 Cb -0.03 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 20.24 2oyr s ALA 246 CO 0.16 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.62 2oyr n GLY 247 N -0.26 1.51 2.89 0.00 0.00 -0.98 -4.66 105.19 103.69 2oyr n GLY 247 Ca 0.03 -1.83 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 2oyr n GLY 247 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oyr s THR 248 N 1.97 1.93 0.49 2.61 2.01 0.11 -4.88 115.64 119.87 2oyr s THR 248 Ca 0.00 -2.43 -0.21 0.00 0.31 0.00 0.00 61.69 59.36 2oyr s THR 248 Cb 0.00 -2.40 -0.10 0.00 0.01 0.00 0.00 72.50 70.01 2oyr s THR 248 CO 0.00 -0.71 0.64 -2.65 -0.69 0.00 0.00 174.62 171.20 2oyr n PRO 249 N 3.97 0.70 0.00 4.92 -0.02 -1.17 -4.36 135.00 139.04 2oyr n PRO 249 Ca 0.04 0.26 0.10 0.00 -2.02 0.00 0.00 63.50 61.88 2oyr n PRO 249 Cb 0.38 -1.71 0.60 0.00 -0.02 0.00 0.00 33.50 32.76 2oyr n PRO 249 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81