#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1moe s ILE 2 N 0.00 4.11 -0.12 2.12 1.01 -1.26 -4.87 121.20 122.19 1moe s ILE 2 Ca 0.00 -0.90 -0.20 0.00 0.00 0.00 0.00 60.65 59.55 1moe s ILE 2 Cb 0.00 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 1moe s ILE 2 CO 0.00 -0.12 0.56 -0.69 0.00 0.00 0.00 174.94 174.69 1moe s VAL 3 N 1.48 5.12 -0.18 2.92 1.01 -1.26 -4.61 120.40 124.89 1moe s VAL 3 Ca 0.01 1.12 -0.06 0.00 0.00 0.00 0.00 61.98 63.05 1moe s VAL 3 Cb -0.19 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 1moe s VAL 3 CO 0.04 0.27 0.02 -0.76 0.00 0.00 0.00 175.10 174.67 1moe s LEU 4 N 0.90 3.53 -0.13 3.92 1.02 -1.26 -0.68 118.68 125.97 1moe s LEU 4 Ca 0.29 -0.04 0.02 0.00 0.02 0.00 0.00 54.13 54.42 1moe s LEU 4 Cb -0.16 -1.88 0.01 0.00 0.02 0.00 0.00 46.19 44.18 1moe s LEU 4 CO 0.12 0.15 -0.19 -0.89 0.02 0.00 0.00 176.35 175.56 1moe s THR 5 N 0.49 1.85 0.16 5.49 2.01 0.47 -4.18 115.64 121.92 1moe s THR 5 Ca 0.00 -0.85 0.05 0.00 0.31 0.00 0.00 61.69 61.20 1moe s THR 5 Cb -0.13 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 1moe s THR 5 CO 0.02 0.51 0.13 -1.10 -0.69 0.00 0.00 174.62 173.49 1moe s GLN 6 N 0.94 2.89 -0.18 4.92 -0.21 -1.26 0.32 119.66 127.07 1moe s GLN 6 Ca -0.06 -0.86 -0.21 0.00 0.02 0.00 0.00 55.36 54.25 1moe s GLN 6 Cb -0.15 -2.64 0.05 0.00 1.00 0.00 0.00 33.01 31.27 1moe s GLN 6 CO -0.03 0.49 0.56 -1.54 -2.12 0.00 0.00 175.29 172.65 1moe s SER 7 N -3.06 -0.57 0.98 5.90 1.04 -0.87 -4.59 113.70 112.53 1moe s SER 7 Ca 0.31 1.01 -0.14 0.00 0.48 0.00 0.00 55.95 57.61 1moe s SER 7 Cb -0.10 1.02 0.18 0.00 0.10 0.00 0.00 66.02 67.22 1moe s SER 7 CO 0.23 -0.27 1.14 -2.16 0.98 0.00 0.00 173.24 173.16 1moe s PRO 8 N -0.01 0.56 -0.07 4.02 0.04 -1.26 -1.38 135.00 136.90 1moe s PRO 8 Ca -0.02 0.20 -0.24 0.00 0.04 0.00 0.00 61.00 60.99 1moe s PRO 8 Cb -0.04 -1.78 -0.30 0.00 0.04 0.00 0.00 34.50 32.43 1moe s PRO 8 CO 0.02 -2.57 0.87 0.00 0.04 0.00 0.00 177.00 175.36 1moe h ALA 9 N -1.77 -0.07 -4.17 8.56 0.00 -1.84 -3.39 119.26 116.58 1moe h ALA 9 Ca -0.50 -0.65 -0.69 0.00 0.00 0.00 0.00 54.91 53.07 1moe h ALA 9 Cb 1.32 0.07 -0.29 0.00 0.00 0.00 0.00 17.79 18.89 1moe h ALA 9 CO 0.55 0.29 -0.86 -1.12 0.00 0.00 0.00 179.25 178.10 1moe s SER 10 N -6.79 3.27 -0.03 0.00 0.01 -1.26 -0.79 113.70 108.11 1moe s SER 10 Ca -0.15 -0.44 -0.01 0.00 1.31 0.00 0.00 55.95 56.67 1moe s SER 10 Cb 0.00 -0.72 0.03 0.00 0.21 0.00 0.00 66.02 65.53 1moe s SER 10 CO 0.80 0.28 0.06 -0.22 0.41 0.00 0.00 173.24 174.57 1moe s LEU 11 N -0.37 1.13 -0.07 2.44 1.98 0.21 -4.90 118.68 119.09 1moe s LEU 11 Ca 0.03 0.11 0.02 0.00 -2.89 0.00 0.00 54.13 51.39 1moe s LEU 11 Cb -0.12 0.07 0.02 0.00 0.66 0.00 0.00 46.19 46.82 1moe s LEU 11 CO 0.02 -0.11 -0.10 0.00 -1.89 0.00 0.00 176.35 174.26 1moe s ALA 12 N 0.91 1.20 0.05 5.97 0.00 -1.26 -0.94 121.76 127.69 1moe s ALA 12 Ca -0.07 -0.40 0.04 0.00 0.00 0.00 0.00 51.96 51.53 1moe s ALA 12 Cb -0.10 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.37 1moe s ALA 12 CO -0.03 -0.01 -0.12 0.14 0.00 0.00 0.00 175.76 175.74 1moe s VAL 13 N 0.91 0.95 0.63 0.00 -7.23 -0.75 -4.85 120.40 110.05 1moe s VAL 13 Ca -0.10 -1.04 -0.16 0.00 -1.81 0.00 0.00 61.98 58.86 1moe s VAL 13 Cb -0.15 -0.90 -0.02 0.00 0.56 0.00 0.00 36.38 35.87 1moe s VAL 13 CO 0.01 -0.13 1.12 -0.44 -0.31 0.00 0.00 175.10 175.36 1moe s SER 14 N -1.31 5.26 0.46 4.85 0.01 -1.26 -1.18 113.70 120.53 1moe s SER 14 Ca -0.02 2.08 -0.25 0.00 1.31 0.00 0.00 55.95 59.07 1moe s SER 14 Cb -0.08 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.51 1moe s SER 14 CO 0.01 -1.53 1.35 -0.22 0.41 0.00 0.00 173.24 173.27 1moe s LEU 15 N -4.54 4.08 0.00 2.44 2.96 -1.26 -2.61 118.68 119.76 1moe s LEU 15 Ca 0.69 2.76 0.00 0.00 -0.22 0.00 0.00 54.13 57.36 1moe s LEU 15 Cb -0.22 -4.02 0.00 0.00 0.50 0.00 0.00 46.19 42.45 1moe s LEU 15 CO 0.37 -1.13 0.00 0.61 -1.32 0.00 0.00 176.35 174.88 1moe n GLY 16 N 0.63 0.50 3.96 7.98 0.00 -0.04 -4.93 105.19 113.29 1moe n GLY 16 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1moe n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1moe s GLN 17 N -0.44 2.45 -0.02 1.61 -1.52 -1.07 -4.43 119.66 116.23 1moe s GLN 17 Ca 0.00 -1.63 -0.22 0.00 -1.95 0.00 0.00 55.36 51.57 1moe s GLN 17 Cb 0.00 -2.47 -0.05 0.00 -0.22 0.00 0.00 33.01 30.27 1moe s GLN 17 CO 0.00 -0.53 0.63 0.50 -0.25 0.00 0.00 175.29 175.65 1moe s ARG 18 N -4.38 4.37 0.11 2.91 3.52 -1.26 -0.71 118.95 123.51 1moe s ARG 18 Ca 0.51 0.79 0.08 0.00 -0.13 0.00 0.00 55.73 56.98 1moe s ARG 18 Cb -0.05 -3.37 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 1moe s ARG 18 CO 0.31 0.28 -0.14 0.00 -0.81 0.00 0.00 175.30 174.94 1moe s ALA 19 N 0.08 2.83 -0.17 6.12 0.00 -0.47 -4.99 121.76 125.16 1moe s ALA 19 Ca 0.33 -1.29 -0.04 0.00 0.00 0.00 0.00 51.96 50.96 1moe s ALA 19 Cb -0.18 -0.78 0.08 0.00 0.00 0.00 0.00 23.12 22.24 1moe s ALA 19 CO 0.18 0.62 0.23 0.99 0.00 0.00 0.00 175.76 177.78 1moe s THR 20 N -1.18 -0.35 0.08 0.00 2.01 -1.26 -2.71 115.64 112.22 1moe s THR 20 Ca 0.20 0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.34 1moe s THR 20 Cb -0.11 -0.56 -0.03 0.00 0.01 0.00 0.00 72.50 71.81 1moe s THR 20 CO 0.12 -0.05 -0.19 0.00 -0.69 0.00 0.00 174.62 173.81 1moe s MET 21 N 2.36 1.09 0.36 4.92 0.23 -0.88 -4.64 119.30 122.74 1moe s MET 21 Ca 0.05 -1.02 0.09 0.00 -1.03 0.00 0.00 55.69 53.77 1moe s MET 21 Cb -0.14 -1.24 -0.07 0.00 -1.53 0.00 0.00 34.83 31.85 1moe s MET 21 CO -0.10 0.29 -0.06 -1.54 -2.03 0.00 0.00 175.02 171.58 1moe s SER 22 N -1.63 3.79 -0.10 -1.18 1.04 -0.48 -0.45 113.70 114.69 1moe s SER 22 Ca 0.04 -1.24 -0.03 0.00 0.48 0.00 0.00 55.95 55.20 1moe s SER 22 Cb -0.09 -0.37 0.05 0.00 0.10 0.00 0.00 66.02 65.71 1moe s SER 22 CO 0.03 -0.28 0.15 0.00 0.98 0.00 0.00 173.24 174.12 1moe s ARG 24 N 2.27 3.35 0.01 0.00 3.52 0.15 -1.26 118.95 126.99 1moe s ARG 24 Ca 0.04 -0.65 -0.11 0.00 -0.13 0.00 0.00 55.73 54.89 1moe s ARG 24 Cb -0.13 -2.95 -0.05 0.00 -1.56 0.00 0.00 34.95 30.26 1moe s ARG 24 CO -0.06 -0.17 0.34 0.00 -0.81 0.00 0.00 175.30 174.60 1moe s ALA 25 N 1.39 3.76 0.10 6.12 0.00 -0.74 -0.40 121.76 131.99 1moe s ALA 25 Ca 0.05 -0.39 -0.24 0.00 0.00 0.00 0.00 51.96 51.37 1moe s ALA 25 Cb -0.14 -2.23 -0.13 0.00 0.00 0.00 0.00 23.12 20.62 1moe s ALA 25 CO -0.04 0.56 1.70 0.78 0.00 0.00 0.00 175.76 178.77 1moe h GLY 26 N 4.27 -0.18 -0.66 0.00 0.00 -1.23 -3.45 103.07 101.82 1moe h GLY 26 Ca -0.51 0.10 -0.26 0.00 0.00 0.00 0.00 47.33 46.67 1moe h GLY 26 CO 0.63 -0.10 -0.07 1.18 0.00 0.00 0.00 176.54 178.19 1moe n GLU 27 N -5.21 0.91 -3.20 4.80 1.02 -1.26 -5.02 120.64 112.68 1moe n GLU 27 Ca -0.07 -1.61 -0.39 0.00 -0.02 0.00 0.00 57.16 55.07 1moe n GLU 27 Cb 0.13 -0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.49 1moe n GLU 27 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1moe s SER 28 N -2.71 6.71 -0.01 1.62 0.15 -1.26 -4.58 113.70 113.62 1moe s SER 28 Ca 0.24 0.85 0.20 0.00 0.70 0.00 0.00 55.95 57.95 1moe s SER 28 Cb -0.02 -2.33 0.59 0.00 -1.71 0.00 0.00 66.02 62.55 1moe s SER 28 CO 0.16 -0.14 1.49 1.33 1.20 0.00 0.00 173.24 177.28 1moe n VAL 29 N 4.17 1.05 -2.97 4.45 0.24 -0.40 -4.94 118.33 119.93 1moe n VAL 29 Ca -0.04 -1.02 -0.40 0.00 -2.04 0.00 0.00 64.34 60.85 1moe n VAL 29 Cb 0.51 0.47 -0.06 0.00 -1.47 0.00 0.00 33.84 33.30 1moe n VAL 29 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1moe s ASP 30 N -1.00 7.35 -0.23 -1.34 2.15 -1.25 -1.09 116.67 121.26 1moe s ASP 30 Ca 0.44 1.60 -0.04 0.00 0.43 0.00 0.00 52.55 54.99 1moe s ASP 30 Cb 0.24 -2.49 0.08 0.00 -0.30 0.00 0.00 42.92 40.44 1moe s ASP 30 CO 0.30 0.14 0.09 -0.63 -0.17 0.00 0.00 175.17 174.90 1moe s ILE 31 N -0.80 0.20 -1.66 4.11 -1.09 0.14 -4.87 121.20 117.25 1moe s ILE 31 Ca 0.37 -0.60 -0.03 0.00 -2.23 0.00 0.00 60.65 58.16 1moe s ILE 31 Cb -0.22 -0.96 0.00 0.00 -1.58 0.00 0.00 42.46 39.70 1moe s ILE 31 CO 0.26 -0.45 0.38 0.49 -1.23 0.00 0.00 174.94 174.38 1moe n PHE 32 N 5.15 -1.60 0.00 3.97 0.99 -1.26 -2.32 117.46 122.39 1moe n PHE 32 Ca -0.07 0.32 0.00 0.00 -0.00 0.00 0.00 57.45 57.71 1moe n PHE 32 Cb 0.46 -4.32 0.00 0.00 -1.00 0.00 0.00 39.48 34.62 1moe n PHE 32 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1moe n GLY 33 N -1.33 3.11 3.68 1.37 0.00 -1.26 -5.03 105.19 105.72 1moe n GLY 33 Ca -0.17 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 1moe n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1moe s VAL 34 N -0.25 3.80 -0.22 1.61 1.01 -0.98 -4.98 120.40 120.39 1moe s VAL 34 Ca 0.00 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.90 1moe s VAL 34 Cb 0.00 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1moe s VAL 34 CO 0.00 -0.03 0.65 -0.83 0.00 0.00 0.00 175.10 174.90 1moe s GLY 35 N 2.04 1.96 -1.42 4.51 0.00 -1.26 0.28 107.32 113.42 1moe s GLY 35 Ca 0.63 -0.29 -0.09 0.00 0.00 0.00 0.00 44.72 44.97 1moe s GLY 35 CO 0.25 1.40 2.45 0.69 0.00 0.00 0.00 173.10 177.89 1moe n PHE 36 N 5.31 2.72 -4.55 1.90 3.72 -0.25 -2.97 117.46 123.34 1moe n PHE 36 Ca -0.00 -2.92 -0.22 0.00 -0.05 0.00 0.00 57.45 54.26 1moe n PHE 36 Cb 0.49 -2.15 -0.15 0.00 -0.94 0.00 0.00 39.48 36.73 1moe n PHE 36 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1moe s LEU 37 N -0.53 1.91 0.21 4.37 2.96 -1.26 -1.58 118.68 124.75 1moe s LEU 37 Ca 0.55 -0.24 0.09 0.00 -0.22 0.00 0.00 54.13 54.32 1moe s LEU 37 Cb 0.16 -0.67 -0.05 0.00 0.50 0.00 0.00 46.19 46.13 1moe s LEU 37 CO -0.07 0.12 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.91 1moe s HIS 38 N -0.04 1.88 -0.09 5.38 3.76 0.95 0.44 115.29 127.57 1moe s HIS 38 Ca 0.00 -0.48 0.04 0.00 -0.15 0.00 0.00 55.06 54.47 1moe s HIS 38 Cb -0.08 -0.88 -0.00 0.00 1.11 0.00 0.00 32.58 32.73 1moe s HIS 38 CO 0.00 0.43 -0.24 -1.58 -0.85 0.00 0.00 174.74 172.51 1moe s TRP 39 N -2.56 2.49 -0.03 1.40 0.52 0.82 -1.41 118.94 120.17 1moe s TRP 39 Ca 0.22 -0.97 0.07 0.00 0.02 0.00 0.00 56.10 55.44 1moe s TRP 39 Cb -0.03 -1.66 -0.02 0.00 -1.15 0.00 0.00 33.47 30.61 1moe s TRP 39 CO 0.09 -0.38 -0.24 0.71 0.02 0.00 0.00 176.95 177.14 1moe s TYR 40 N 0.26 2.22 -0.11 -1.98 1.51 0.13 -1.58 117.35 117.81 1moe s TYR 40 Ca -0.16 -0.47 -0.02 0.00 -1.01 0.00 0.00 57.07 55.41 1moe s TYR 40 Cb -0.17 -1.44 -0.03 0.00 -0.11 0.00 0.00 41.96 40.21 1moe s TYR 40 CO 0.08 -0.07 -0.01 -1.14 -1.11 0.00 0.00 175.55 173.29 1moe s GLN 41 N -0.49 3.19 -0.19 -0.62 0.74 -0.40 -0.25 119.66 121.63 1moe s GLN 41 Ca 0.07 -0.45 -0.02 0.00 0.05 0.00 0.00 55.36 55.01 1moe s GLN 41 Cb -0.10 -2.82 0.05 0.00 1.10 0.00 0.00 33.01 31.24 1moe s GLN 41 CO -0.00 0.55 -0.00 -1.14 -0.55 0.00 0.00 175.29 174.15 1moe s GLN 42 N -0.47 1.01 0.43 1.67 0.74 -0.34 0.40 119.66 123.10 1moe s GLN 42 Ca 0.08 -0.53 -0.23 0.00 0.05 0.00 0.00 55.36 54.73 1moe s GLN 42 Cb -0.12 -2.13 -0.09 0.00 1.10 0.00 0.00 33.01 31.77 1moe s GLN 42 CO 0.02 -0.57 1.05 0.15 -0.55 0.00 0.00 175.29 175.39 1moe s LYS 43 N 1.72 4.02 -0.03 1.67 -0.14 -1.26 -1.96 119.74 123.75 1moe s LYS 43 Ca -0.01 1.47 -0.39 0.00 -1.36 0.00 0.00 55.97 55.67 1moe s LYS 43 Cb -0.17 -2.38 -0.18 0.00 -1.68 0.00 0.00 37.83 33.42 1moe s LYS 43 CO -0.07 -0.26 1.27 -2.30 -0.76 0.00 0.00 175.35 173.22 1moe n PRO 44 N -0.41 0.50 -3.76 -1.68 -0.02 -1.26 -1.26 135.00 127.12 1moe n PRO 44 Ca 0.07 0.18 -0.24 0.00 -2.02 0.00 0.00 63.50 61.49 1moe n PRO 44 Cb 0.51 -1.75 0.03 0.00 -0.02 0.00 0.00 33.50 32.27 1moe n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1moe n GLY 45 N 2.30 -0.34 3.22 -1.23 0.00 -1.26 -4.99 105.19 102.89 1moe n GLY 45 Ca 0.21 0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.28 1moe n GLY 45 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1moe s GLN 46 N -6.15 0.89 0.75 1.61 0.74 -0.39 -5.15 119.66 111.96 1moe s GLN 46 Ca 0.16 -0.99 -0.11 0.00 0.05 0.00 0.00 55.36 54.48 1moe s GLN 46 Cb -0.08 0.35 0.04 0.00 1.10 0.00 0.00 33.01 34.42 1moe s GLN 46 CO 0.82 -0.29 1.08 -1.25 -0.55 0.00 0.00 175.29 175.10 1moe s PRO 47 N -3.88 2.49 0.26 1.67 0.04 -1.26 -4.63 135.00 129.69 1moe s PRO 47 Ca 0.07 1.02 -0.29 0.00 0.04 0.00 0.00 61.00 61.83 1moe s PRO 47 Cb 0.05 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.56 1moe s PRO 47 CO -0.09 -1.44 1.23 -2.14 0.04 0.00 0.00 177.00 174.60 1moe s PRO 48 N -4.98 4.47 -0.22 0.56 0.02 -1.26 -4.47 135.00 129.11 1moe s PRO 48 Ca 0.60 2.00 -0.04 0.00 0.02 0.00 0.00 61.00 63.58 1moe s PRO 48 Cb -0.16 -3.16 -0.01 0.00 0.02 0.00 0.00 34.50 31.19 1moe s PRO 48 CO 0.56 -0.07 -0.02 0.21 -0.33 0.00 0.00 177.00 177.34 1moe s LYS 49 N -1.00 3.45 0.19 5.54 2.20 0.16 -4.93 119.74 125.34 1moe s LYS 49 Ca 0.50 -0.59 -0.31 0.00 -0.36 0.00 0.00 55.97 55.21 1moe s LYS 49 Cb -0.36 -3.05 -0.10 0.00 -1.51 0.00 0.00 37.83 32.81 1moe s LYS 49 CO 0.43 -0.16 1.59 -1.17 -0.36 0.00 0.00 175.35 175.68 1moe s LEU 50 N 1.41 4.37 -0.07 5.43 2.96 -1.26 -1.28 118.68 130.23 1moe s LEU 50 Ca 0.05 2.69 -0.01 0.00 -0.22 0.00 0.00 54.13 56.64 1moe s LEU 50 Cb -0.14 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 1moe s LEU 50 CO -0.01 -0.85 -0.08 0.18 -1.32 0.00 0.00 176.35 174.27 1moe n LEU 51 N 3.73 2.24 -3.74 -0.68 4.77 -0.62 -4.79 117.00 117.91 1moe n LEU 51 Ca 0.13 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.97 1moe n LEU 51 Cb 0.38 -0.25 -0.15 0.00 -2.33 0.00 0.00 43.42 41.07 1moe n LEU 51 CO 0.62 0.48 -0.24 -0.63 -1.33 0.00 0.00 177.39 176.29 1moe s ILE 52 N -2.15 -0.07 -0.02 -0.08 1.01 -1.08 -0.81 121.20 118.00 1moe s ILE 52 Ca -0.10 0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.79 1moe s ILE 52 Cb 0.03 -0.23 -0.03 0.00 0.01 0.00 0.00 42.46 42.24 1moe s ILE 52 CO 0.16 0.08 -0.11 -0.72 0.00 0.00 0.00 174.94 174.35 1moe s TYR 53 N 1.26 2.77 -1.09 3.97 1.13 -0.31 -0.13 117.35 124.96 1moe s TYR 53 Ca -0.08 -0.11 -0.05 0.00 -1.41 0.00 0.00 57.07 55.42 1moe s TYR 53 Cb -0.12 -1.61 0.01 0.00 -1.10 0.00 0.00 41.96 39.14 1moe s TYR 53 CO -0.06 0.28 0.94 0.54 -2.51 0.00 0.00 175.55 174.74 1moe n ARG 54 N 1.94 -6.28 0.00 -3.49 1.74 -0.82 -2.51 116.66 107.24 1moe n ARG 54 Ca -0.17 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 1moe n ARG 54 Cb 0.52 -5.32 0.00 0.00 -1.02 0.00 0.00 32.46 26.65 1moe n ARG 54 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1moe n ALA 55 N -4.26 0.00 -0.04 7.54 0.00 0.17 -4.22 120.51 119.69 1moe n ALA 55 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1moe n ALA 55 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1moe n ALA 55 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1moe n SER 56 N 2.07 0.01 -4.59 0.00 3.41 -1.24 -2.30 113.62 110.98 1moe n SER 56 Ca 0.00 -0.15 -0.43 0.00 -0.26 0.00 0.00 58.87 58.03 1moe n SER 56 Cb 0.00 0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.12 1moe n SER 56 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1moe s ASN 57 N -0.21 6.60 0.21 4.04 -0.87 -1.04 -4.49 114.94 119.18 1moe s ASN 57 Ca 0.00 0.37 -0.30 0.00 -1.57 0.00 0.00 52.86 51.35 1moe s ASN 57 Cb 0.00 -2.47 -0.10 0.00 -0.02 0.00 0.00 41.25 38.66 1moe s ASN 57 CO 0.00 -1.00 1.43 -0.76 -2.57 0.00 0.00 177.10 174.20 1moe s LEU 58 N 3.74 4.39 0.52 0.60 1.43 -1.26 -1.16 118.68 126.93 1moe s LEU 58 Ca 0.39 2.57 -0.19 0.00 -1.03 0.00 0.00 54.13 55.88 1moe s LEU 58 Cb -0.10 -3.61 -0.07 0.00 0.03 0.00 0.00 46.19 42.43 1moe s LEU 58 CO 0.24 -0.68 1.04 -0.70 0.23 0.00 0.00 176.35 176.48 1moe s GLU 59 N 0.03 3.65 0.19 1.70 2.56 0.01 -4.91 118.70 121.93 1moe s GLU 59 Ca 0.61 1.30 -0.33 0.00 0.00 0.00 0.00 54.97 56.56 1moe s GLU 59 Cb -0.40 -2.08 -0.15 0.00 2.00 0.00 0.00 34.13 33.50 1moe s GLU 59 CO 0.39 -0.55 1.28 0.43 -0.56 0.00 0.00 175.26 176.26 1moe n SER 60 N -1.32 1.96 0.00 -1.70 7.64 -1.26 -1.39 113.62 117.55 1moe n SER 60 Ca 0.09 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.11 1moe n SER 60 Cb 0.53 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1moe n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1moe n GLY 61 N 2.17 3.25 3.68 0.23 0.00 -1.26 -5.03 105.19 108.24 1moe n GLY 61 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1moe n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1moe s ILE 62 N -2.38 4.55 0.69 -0.61 -1.09 -0.49 -5.02 121.20 116.85 1moe s ILE 62 Ca 0.00 1.84 -0.13 0.00 -2.23 0.00 0.00 60.65 60.13 1moe s ILE 62 Cb 0.00 -4.19 0.01 0.00 -1.58 0.00 0.00 42.46 36.71 1moe s ILE 62 CO 0.00 -0.03 1.10 -2.16 -1.23 0.00 0.00 174.94 172.61 1moe s PRO 63 N 2.34 2.70 0.00 2.79 0.04 -1.26 -4.83 135.00 136.79 1moe s PRO 63 Ca 0.51 1.27 0.13 0.00 0.04 0.00 0.00 61.00 62.95 1moe s PRO 63 Cb -0.20 -1.95 0.78 0.00 0.04 0.00 0.00 34.50 33.17 1moe s PRO 63 CO 0.18 -1.31 1.21 1.33 0.04 0.00 0.00 177.00 178.44 1moe n VAL 64 N -2.76 0.00 1.23 -0.36 0.24 -1.26 -2.58 118.33 112.84 1moe n VAL 64 Ca 0.10 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.50 1moe n VAL 64 Cb 0.52 -0.76 0.61 0.00 -1.47 0.00 0.00 33.84 32.74 1moe n VAL 64 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1moe n ARG 65 N -0.98 0.52 -3.72 7.34 1.85 -1.26 -4.47 116.66 115.95 1moe n ARG 65 Ca 0.10 0.04 -0.38 0.00 -1.00 0.00 0.00 57.85 56.61 1moe n ARG 65 Cb 0.05 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 29.83 1moe n ARG 65 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1moe s PHE 66 N -2.26 3.17 -0.14 2.89 0.08 -1.07 -0.98 117.98 119.69 1moe s PHE 66 Ca 0.28 -0.91 -0.02 0.00 0.12 0.00 0.00 56.93 56.40 1moe s PHE 66 Cb 0.15 -2.30 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 1moe s PHE 66 CO 0.29 -0.57 -0.08 -1.12 -0.10 0.00 0.00 175.22 173.64 1moe s SER 67 N 1.53 4.43 -0.18 1.36 0.01 0.39 -4.95 113.70 116.29 1moe s SER 67 Ca 0.03 -0.21 -0.00 0.00 1.31 0.00 0.00 55.95 57.07 1moe s SER 67 Cb -0.18 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.41 1moe s SER 67 CO 0.04 0.18 -0.14 -0.83 0.41 0.00 0.00 173.24 172.90 1moe s GLY 68 N 0.26 1.48 0.11 3.44 0.00 -1.26 -1.18 107.32 110.17 1moe s GLY 68 Ca -0.06 -1.12 -0.09 0.00 0.00 0.00 0.00 44.72 43.45 1moe s GLY 68 CO 0.04 0.18 0.23 -0.51 0.00 0.00 0.00 173.10 173.04 1moe s THR 69 N 1.09 0.12 0.00 0.90 -4.23 -0.82 -3.74 115.64 108.97 1moe s THR 69 Ca 0.00 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 1moe s THR 69 Cb -0.14 -1.49 0.00 0.00 1.34 0.00 0.00 72.50 72.21 1moe s THR 69 CO -0.04 -0.53 0.00 0.61 -0.54 0.00 0.00 174.62 174.11 1moe n GLY 70 N -0.11 3.06 0.00 3.99 0.00 -1.26 0.05 105.19 110.92 1moe n GLY 70 Ca -0.13 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1moe n GLY 70 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1moe n SER 71 N 0.00 0.00 -0.09 1.61 7.64 -0.72 -4.93 113.62 117.14 1moe n SER 71 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.79 1moe n SER 71 Cb 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.07 1moe n SER 71 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1moe n ARG 72 N 0.00 1.13 0.00 1.43 1.74 -1.26 -4.60 116.66 115.10 1moe n ARG 72 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1moe n ARG 72 Cb 0.00 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 1moe n ARG 72 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1moe n THR 73 N -2.67 0.00 -3.91 0.55 -2.24 -1.26 -1.28 114.28 103.46 1moe n THR 73 Ca -0.29 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 1moe n THR 73 Cb 1.05 1.19 -0.16 0.00 -2.10 0.00 0.00 70.33 70.31 1moe n THR 73 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1moe s ASP 74 N 0.00 3.71 0.12 3.42 1.01 -1.26 -1.78 116.67 121.88 1moe s ASP 74 Ca 0.00 -1.12 0.11 0.00 0.71 0.00 0.00 52.55 52.25 1moe s ASP 74 Cb 0.00 -1.10 -0.04 0.00 1.01 0.00 0.00 42.92 42.79 1moe s ASP 74 CO 0.00 -0.24 -0.26 -0.36 0.21 0.00 0.00 175.17 174.51 1moe s PHE 75 N 1.46 2.33 -0.03 4.23 0.40 -0.39 -1.75 117.98 124.23 1moe s PHE 75 Ca -0.05 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.93 1moe s PHE 75 Cb -0.19 -1.28 0.00 0.00 0.51 0.00 0.00 43.02 42.07 1moe s PHE 75 CO -0.06 0.31 -0.09 0.99 0.70 0.00 0.00 175.22 177.06 1moe s THR 76 N -1.02 0.81 -0.15 0.64 2.01 0.11 -0.47 115.64 117.56 1moe s THR 76 Ca 0.14 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 61.77 1moe s THR 76 Cb -0.10 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 1moe s THR 76 CO 0.06 0.26 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.91 1moe s LEU 77 N 0.26 2.78 -0.01 4.42 2.96 0.40 -1.94 118.68 127.55 1moe s LEU 77 Ca -0.04 -0.33 0.07 0.00 -0.22 0.00 0.00 54.13 53.61 1moe s LEU 77 Cb -0.09 -1.64 -0.02 0.00 0.50 0.00 0.00 46.19 44.93 1moe s LEU 77 CO 0.01 0.13 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.32 1moe s ILE 78 N 0.56 1.70 -0.21 6.68 1.01 -0.32 -2.08 121.20 128.54 1moe s ILE 78 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.62 1moe s ILE 78 Cb -0.15 -1.42 0.05 0.00 0.01 0.00 0.00 42.46 40.95 1moe s ILE 78 CO 0.03 0.44 -0.05 -0.63 0.00 0.00 0.00 174.94 174.74 1moe s ILE 79 N -0.55 1.32 -0.21 2.92 1.01 -1.10 -0.46 121.20 124.13 1moe s ILE 79 Ca 0.08 -0.98 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 1moe s ILE 79 Cb -0.08 -1.58 0.11 0.00 0.01 0.00 0.00 42.46 40.92 1moe s ILE 79 CO -0.00 -0.04 0.30 -0.62 0.00 0.00 0.00 174.94 174.59 1moe s ASP 80 N 1.51 0.65 0.66 3.58 -1.08 -0.15 -1.37 116.67 120.47 1moe s ASP 80 Ca -0.03 0.17 -0.06 0.00 -0.52 0.00 0.00 52.55 52.10 1moe s ASP 80 Cb -0.18 0.80 0.04 0.00 -1.46 0.00 0.00 42.92 42.12 1moe s ASP 80 CO -0.07 -0.30 0.97 -2.16 0.52 0.00 0.00 175.17 174.14 1moe s PRO 81 N 2.45 2.47 0.10 4.34 0.04 -1.26 -4.57 135.00 138.57 1moe s PRO 81 Ca 0.08 -0.16 -0.19 0.00 0.04 0.00 0.00 61.00 60.76 1moe s PRO 81 Cb -0.15 -2.21 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 1moe s PRO 81 CO -0.13 -1.04 0.60 0.08 0.04 0.00 0.00 177.00 176.55 1moe s VAL 82 N -3.15 4.70 0.38 -0.36 1.01 0.11 -4.89 120.40 118.20 1moe s VAL 82 Ca 0.58 1.23 0.08 0.00 0.00 0.00 0.00 61.98 63.87 1moe s VAL 82 Cb -0.11 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1moe s VAL 82 CO 0.45 0.49 0.10 -1.61 0.00 0.00 0.00 175.10 174.53 1moe s GLU 83 N -1.27 2.15 0.26 2.72 2.02 -1.26 -0.86 118.70 122.46 1moe s GLU 83 Ca 0.32 -1.84 -0.02 0.00 0.02 0.00 0.00 54.97 53.44 1moe s GLU 83 Cb -0.19 -1.92 0.54 0.00 0.10 0.00 0.00 34.13 32.65 1moe s GLU 83 CO 0.20 -0.01 1.69 0.00 0.02 0.00 0.00 175.26 177.16 1moe h ALA 84 N 1.61 1.10 -0.46 5.21 0.00 -1.89 -2.21 119.26 122.63 1moe h ALA 84 Ca -0.43 0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.39 1moe h ALA 84 Cb 1.25 0.19 -0.14 0.00 0.00 0.00 0.00 17.79 19.09 1moe h ALA 84 CO 0.70 -0.32 0.31 -0.40 0.00 0.00 0.00 179.25 179.55 1moe n ASP 85 N -5.11 3.61 -0.11 0.00 3.85 -1.26 -3.99 116.55 113.53 1moe n ASP 85 Ca 0.16 -2.77 0.11 0.00 -0.71 0.00 0.00 54.79 51.59 1moe n ASP 85 Cb 0.51 -0.69 0.08 0.00 -1.35 0.00 0.00 41.12 39.67 1moe n ASP 85 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1moe n ASP 86 N -0.21 1.02 -4.64 -1.12 9.92 -0.83 -4.87 116.55 115.82 1moe n ASP 86 Ca 0.28 -0.84 -0.42 0.00 -0.53 0.00 0.00 54.79 53.28 1moe n ASP 86 Cb 1.01 0.57 -0.03 0.00 -0.64 0.00 0.00 41.12 42.03 1moe n ASP 86 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1moe s VAL 87 N -2.85 3.03 -0.47 2.53 1.01 -1.26 -4.82 120.40 117.58 1moe s VAL 87 Ca 0.13 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1moe s VAL 87 Cb 0.17 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.53 1moe s VAL 87 CO 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 175.10 175.82 1moe n ALA 88 N 9.15 0.00 -3.58 5.51 0.00 -0.98 -4.74 120.51 125.87 1moe n ALA 88 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.34 1moe n ALA 88 Cb 0.43 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 1moe n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1moe s THR 89 N -2.51 2.65 -0.28 0.00 2.01 -0.83 -0.30 115.64 116.38 1moe s THR 89 Ca 0.00 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.12 1moe s THR 89 Cb 0.00 -2.13 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 1moe s THR 89 CO 0.00 0.51 0.22 -0.31 -0.69 0.00 0.00 174.62 174.35 1moe s TYR 90 N 0.99 3.23 0.10 4.92 1.51 -0.83 -1.20 117.35 126.07 1moe s TYR 90 Ca -0.02 0.17 0.07 0.00 -1.01 0.00 0.00 57.07 56.29 1moe s TYR 90 Cb -0.15 -2.41 -0.04 0.00 -0.11 0.00 0.00 41.96 39.25 1moe s TYR 90 CO -0.03 -0.17 -0.12 0.71 -1.11 0.00 0.00 175.55 174.83 1moe s TYR 91 N 1.80 2.68 0.01 2.71 1.51 0.65 -1.59 117.35 125.11 1moe s TYR 91 Ca 0.08 -0.19 0.04 0.00 -1.01 0.00 0.00 57.07 56.00 1moe s TYR 91 Cb -0.16 -1.41 -0.03 0.00 -0.11 0.00 0.00 41.96 40.24 1moe s TYR 91 CO 0.11 0.41 -0.10 0.00 -1.11 0.00 0.00 175.55 174.85 1moe s GLN 93 N -1.40 0.64 -0.08 0.00 0.74 -0.50 -0.34 119.66 118.72 1moe s GLN 93 Ca 0.16 -0.63 0.03 0.00 0.05 0.00 0.00 55.36 54.97 1moe s GLN 93 Cb -0.11 -0.55 -0.02 0.00 1.10 0.00 0.00 33.01 33.44 1moe s GLN 93 CO 0.07 0.13 -0.16 1.14 -0.55 0.00 0.00 175.29 175.91 1moe s GLN 94 N -1.10 2.85 0.00 1.67 1.03 -0.65 -0.03 119.66 123.42 1moe s GLN 94 Ca -0.03 -0.74 0.07 0.00 0.04 0.00 0.00 55.36 54.70 1moe s GLN 94 Cb -0.07 -2.43 0.19 0.00 0.03 0.00 0.00 33.01 30.73 1moe s GLN 94 CO 0.01 0.42 1.16 2.41 -2.54 0.00 0.00 175.29 176.75 1moe n THR 95 N 2.90 1.00 -0.36 3.63 -1.04 -0.62 -3.54 114.28 116.26 1moe n THR 95 Ca -0.18 -1.00 0.00 0.00 -2.04 0.00 0.00 64.05 60.84 1moe n THR 95 Cb 0.52 0.50 0.14 0.00 -1.82 0.00 0.00 70.33 69.67 1moe n THR 95 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 1moe h ASN 96 N 1.29 1.04 -5.01 8.00 -1.24 -1.84 -3.44 115.58 114.38 1moe h ASN 96 Ca 0.00 -0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.94 1moe h ASN 96 Cb 0.65 -0.23 -0.17 0.00 0.73 0.00 0.00 38.32 39.29 1moe h ASN 96 CO 0.00 0.70 0.02 -1.83 -1.29 0.00 0.00 177.43 175.04 1moe s GLU 97 N -6.08 0.99 0.14 6.67 -1.05 -1.26 -5.13 118.70 112.98 1moe s GLU 97 Ca -0.13 -0.15 0.01 0.00 -0.15 0.00 0.00 54.97 54.56 1moe s GLU 97 Cb 0.19 0.45 -0.04 0.00 -0.44 0.00 0.00 34.13 34.29 1moe s GLU 97 CO 0.81 -0.34 0.30 0.16 0.95 0.00 0.00 175.26 177.14 1moe s ASP 98 N -1.76 6.36 0.30 0.83 -4.77 -1.26 -3.57 116.67 112.80 1moe s ASP 98 Ca -0.07 0.25 -0.30 0.00 -3.30 0.00 0.00 52.55 49.13 1moe s ASP 98 Cb -0.01 -1.95 -0.12 0.00 -1.09 0.00 0.00 42.92 39.75 1moe s ASP 98 CO 0.01 0.05 1.53 -0.81 0.70 0.00 0.00 175.17 176.66 1moe n PRO 99 N -0.40 2.56 -2.38 2.11 -0.04 -1.26 -4.98 135.00 130.62 1moe n PRO 99 Ca -0.06 0.91 -0.42 0.00 -0.04 0.00 0.00 63.50 63.88 1moe n PRO 99 Cb 0.53 -2.65 -0.03 0.00 -0.04 0.00 0.00 33.50 31.32 1moe n PRO 99 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1moe s TYR 100 N -0.23 2.96 0.25 0.54 4.12 -1.23 -4.64 117.35 119.11 1moe s TYR 100 Ca 0.63 1.02 0.07 0.00 0.02 0.00 0.00 57.07 58.81 1moe s TYR 100 Cb -0.52 -3.52 -0.03 0.00 -1.52 0.00 0.00 41.96 36.36 1moe s TYR 100 CO 0.52 -1.79 0.23 0.95 0.02 0.00 0.00 175.55 175.48 1moe s THR 101 N 2.70 4.60 0.42 -0.71 -4.23 -1.23 -4.94 115.64 112.24 1moe s THR 101 Ca 0.58 -1.32 0.07 0.00 -1.18 0.00 0.00 61.69 59.83 1moe s THR 101 Cb -0.26 -3.49 -0.06 0.00 1.34 0.00 0.00 72.50 70.03 1moe s THR 101 CO 0.21 -0.34 0.07 -0.36 -0.54 0.00 0.00 174.62 173.66 1moe s PHE 102 N -2.10 2.48 0.58 3.99 0.40 -1.26 -1.64 117.98 120.43 1moe s PHE 102 Ca 0.33 -0.67 0.07 0.00 -0.60 0.00 0.00 56.93 56.07 1moe s PHE 102 Cb -0.08 -1.83 0.07 0.00 0.51 0.00 0.00 43.02 41.69 1moe s PHE 102 CO 0.26 0.33 0.62 0.20 0.70 0.00 0.00 175.22 177.32 1moe s GLY 103 N -3.79 2.06 0.29 4.36 0.00 0.54 -4.41 107.32 106.36 1moe s GLY 103 Ca 0.35 -1.67 0.07 0.00 0.00 0.00 0.00 44.72 43.46 1moe s GLY 103 CO 0.18 -1.84 1.70 -1.33 0.00 0.00 0.00 173.10 171.81 1moe h GLY 104 N 0.41 0.25 0.00 0.20 0.00 -1.90 -3.44 103.07 98.59 1moe h GLY 104 Ca -0.32 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1moe h GLY 104 CO 0.49 0.22 0.00 0.61 0.00 0.00 0.00 176.54 177.86 1moe n GLY 105 N -0.16 -1.04 3.43 4.60 0.00 -1.26 -4.97 105.19 105.79 1moe n GLY 105 Ca -0.02 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.28 1moe n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1moe s THR 106 N -2.00 4.35 -0.45 2.61 2.01 -0.62 -4.72 115.64 116.81 1moe s THR 106 Ca 0.00 -0.31 -0.29 0.00 0.31 0.00 0.00 61.69 61.40 1moe s THR 106 Cb 0.00 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.42 1moe s THR 106 CO 0.00 0.23 1.25 -0.54 -0.69 0.00 0.00 174.62 174.87 1moe s LYS 107 N 1.60 3.67 -0.12 4.92 1.02 0.03 -1.98 119.74 128.87 1moe s LYS 107 Ca 0.05 0.72 -0.13 0.00 0.02 0.00 0.00 55.97 56.64 1moe s LYS 107 Cb -0.16 -3.95 -0.05 0.00 -0.52 0.00 0.00 37.83 33.15 1moe s LYS 107 CO 0.04 -1.45 0.29 -1.17 -0.92 0.00 0.00 175.35 172.14 1moe s LEU 108 N 4.85 4.31 0.01 3.17 0.20 0.59 -0.62 118.68 131.19 1moe s LEU 108 Ca 0.53 0.58 0.00 0.00 0.69 0.00 0.00 54.13 55.94 1moe s LEU 108 Cb -0.10 -2.36 -0.01 0.00 -0.43 0.00 0.00 46.19 43.29 1moe s LEU 108 CO 0.32 0.19 -0.02 -1.83 -0.29 0.00 0.00 176.35 174.72 1moe s GLU 109 N -0.06 0.16 0.10 1.98 -1.05 -0.11 -2.32 118.70 117.39 1moe s GLU 109 Ca 0.17 -0.28 -0.27 0.00 -0.15 0.00 0.00 54.97 54.44 1moe s GLU 109 Cb -0.13 0.02 -0.06 0.00 -0.44 0.00 0.00 34.13 33.52 1moe s GLU 109 CO 0.06 -0.02 0.84 0.42 0.95 0.00 0.00 175.26 177.51 1moe s ILE 110 N -0.65 4.56 -1.20 1.83 -1.09 -1.26 -1.81 121.20 121.59 1moe s ILE 110 Ca -0.07 1.82 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 1moe s ILE 110 Cb -0.05 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.63 1moe s ILE 110 CO -0.00 0.38 0.91 0.29 -1.23 0.00 0.00 174.94 175.28 1moe n LYS 111 N 2.56 0.00 0.00 2.79 5.02 -0.32 -2.00 118.16 126.20 1moe n LYS 111 Ca -0.01 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 1moe n LYS 111 Cb 0.49 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1moe n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1moe n GLY 112 N -1.39 -0.14 0.79 0.72 0.00 -1.26 -4.85 105.19 99.06 1moe n GLY 112 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1moe n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1moe n GLY 113 N -1.06 -2.13 0.00 -0.02 0.00 -0.85 -5.09 105.19 96.04 1moe n GLY 113 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1moe n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1moe n GLY 114 N -3.29 2.10 0.20 -0.02 0.00 -1.26 -4.96 105.19 97.97 1moe n GLY 114 Ca -0.01 -0.91 0.04 0.00 0.00 0.00 0.00 46.02 45.14 1moe n GLY 114 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1moe h SER 115 N 0.00 0.00 -0.69 1.61 4.64 -1.99 -3.44 113.55 113.68 1moe h SER 115 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1moe h SER 115 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1moe h SER 115 CO 0.00 0.29 -0.19 -0.83 -0.87 0.00 0.00 176.83 175.23 1moe s GLY 116 N -4.26 2.02 0.37 -0.77 0.00 -1.26 -5.01 107.32 98.40 1moe s GLY 116 Ca -0.03 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1moe s GLY 116 CO 0.70 -1.80 0.00 0.61 0.00 0.00 0.00 173.10 172.61 1moe n GLY 117 N -2.03 -5.12 2.87 0.20 0.00 -1.26 -4.96 105.19 94.89 1moe n GLY 117 Ca 0.08 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1moe n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1moe s GLY 118 N -1.88 1.98 0.00 -0.02 0.00 -1.26 -5.00 107.32 101.14 1moe s GLY 118 Ca 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 44.72 41.96 1moe s GLY 118 CO 0.00 1.21 0.00 0.61 0.00 0.00 0.00 173.10 174.92 1moe n GLY 119 N 3.65 3.44 3.58 0.20 0.00 -1.26 -4.88 105.19 109.92 1moe n GLY 119 Ca 0.05 0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.98 1moe n GLY 119 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1moe n GLU 120 N 9.99 -1.72 -2.38 1.61 2.13 -1.26 -4.63 120.64 124.38 1moe n GLU 120 Ca 0.00 1.14 -0.40 0.00 0.66 0.00 0.00 57.16 58.55 1moe n GLU 120 Cb 0.00 -2.66 -0.04 0.00 0.27 0.00 0.00 31.44 29.01 1moe n GLU 120 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1moe s VAL 121 N -2.42 3.28 0.11 6.31 1.01 -1.26 -4.73 120.40 122.70 1moe s VAL 121 Ca 0.16 1.28 -0.11 0.00 0.00 0.00 0.00 61.98 63.31 1moe s VAL 121 Cb -0.02 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.56 1moe s VAL 121 CO 0.87 0.30 0.27 0.00 0.00 0.00 0.00 175.10 176.54 1moe s GLN 122 N -1.58 0.94 -0.03 2.72 -2.07 -0.98 -5.04 119.66 113.62 1moe s GLN 122 Ca 0.46 -0.89 0.04 0.00 -1.82 0.00 0.00 55.36 53.16 1moe s GLN 122 Cb -0.34 0.39 -0.00 0.00 -1.09 0.00 0.00 33.01 31.97 1moe s GLN 122 CO 0.44 -0.33 -0.16 -0.51 -1.32 0.00 0.00 175.29 173.41 1moe s LEU 123 N -2.85 1.92 -0.27 2.60 1.43 -1.26 -2.69 118.68 117.56 1moe s LEU 123 Ca 0.05 -0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 1moe s LEU 123 Cb 0.04 -0.89 0.03 0.00 0.03 0.00 0.00 46.19 45.41 1moe s LEU 123 CO -0.11 0.15 -0.04 -1.10 0.23 0.00 0.00 176.35 175.49 1moe s GLN 124 N -0.02 2.69 0.24 1.70 -0.21 -0.42 -4.20 119.66 119.44 1moe s GLN 124 Ca -0.02 -1.08 -0.11 0.00 0.02 0.00 0.00 55.36 54.16 1moe s GLN 124 Cb -0.10 -3.07 -0.08 0.00 1.00 0.00 0.00 33.01 30.77 1moe s GLN 124 CO 0.01 -0.48 0.59 -0.65 -2.12 0.00 0.00 175.29 172.64 1moe s GLN 125 N 1.30 3.87 1.12 2.91 -1.52 -1.26 -1.10 119.66 124.99 1moe s GLN 125 Ca -0.02 0.39 -0.14 0.00 -1.95 0.00 0.00 55.36 53.65 1moe s GLN 125 Cb -0.18 -2.64 0.25 0.00 -0.22 0.00 0.00 33.01 30.23 1moe s GLN 125 CO -0.03 0.30 1.05 -1.54 -0.25 0.00 0.00 175.29 174.83 1moe s SER 126 N -2.25 1.47 0.78 5.90 1.04 -1.03 -4.92 113.70 114.70 1moe s SER 126 Ca 0.48 1.25 -0.11 0.00 0.48 0.00 0.00 55.95 58.04 1moe s SER 126 Cb -0.12 -1.93 0.07 0.00 0.10 0.00 0.00 66.02 64.14 1moe s SER 126 CO 0.20 -3.86 1.10 -0.83 0.98 0.00 0.00 173.24 170.84 1moe s GLY 127 N -3.05 1.74 0.37 7.32 0.00 -1.26 -4.55 107.32 107.89 1moe s GLY 127 Ca 0.67 0.36 -0.28 0.00 0.00 0.00 0.00 44.72 45.47 1moe s GLY 127 CO 0.61 0.72 1.50 0.00 0.00 0.00 0.00 173.10 175.92 1moe s ALA 128 N -2.79 3.59 0.32 3.20 0.00 -1.26 -4.75 121.76 120.07 1moe s ALA 128 Ca 0.63 1.59 0.10 0.00 0.00 0.00 0.00 51.96 54.28 1moe s ALA 128 Cb -0.19 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.26 1moe s ALA 128 CO 0.55 -1.07 -0.13 -1.21 0.00 0.00 0.00 175.76 173.90 1moe s GLU 129 N -2.01 1.78 -0.37 0.00 2.02 0.38 -4.98 118.70 115.52 1moe s GLU 129 Ca 0.53 -1.88 0.00 0.00 0.02 0.00 0.00 54.97 53.64 1moe s GLU 129 Cb -0.47 -1.73 0.14 0.00 0.10 0.00 0.00 34.13 32.17 1moe s GLU 129 CO 0.63 0.20 0.21 -0.51 0.02 0.00 0.00 175.26 175.81 1moe s LEU 130 N -3.58 1.50 0.56 1.80 1.43 -1.26 -2.23 118.68 116.89 1moe s LEU 130 Ca 0.32 -2.25 0.05 0.00 -1.03 0.00 0.00 54.13 51.21 1moe s LEU 130 Cb 0.00 -0.60 0.05 0.00 0.03 0.00 0.00 46.19 45.67 1moe s LEU 130 CO 0.16 -0.31 0.40 0.68 0.23 0.00 0.00 176.35 177.52 1moe s VAL 131 N 0.93 1.52 0.27 -1.59 -7.23 -0.60 -5.02 120.40 108.68 1moe s VAL 131 Ca 0.17 -1.51 0.06 0.00 -1.81 0.00 0.00 61.98 58.89 1moe s VAL 131 Cb -0.23 -2.03 -0.06 0.00 0.56 0.00 0.00 36.38 34.62 1moe s VAL 131 CO -0.02 0.00 -0.03 -1.61 -0.31 0.00 0.00 175.10 173.13 1moe s GLU 132 N -4.30 1.52 0.26 4.82 2.02 -1.26 -2.69 118.70 119.07 1moe s GLU 132 Ca 0.31 -1.78 -0.30 0.00 0.02 0.00 0.00 54.97 53.22 1moe s GLU 132 Cb -0.02 -1.00 -0.13 0.00 0.10 0.00 0.00 34.13 33.07 1moe s GLU 132 CO 0.20 -0.02 1.35 -2.30 0.02 0.00 0.00 175.26 174.51 1moe n PRO 133 N -0.56 2.00 0.00 0.39 -0.02 -1.26 -0.96 135.00 134.59 1moe n PRO 133 Ca -0.05 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1moe n PRO 133 Cb 0.64 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1moe n PRO 133 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1moe n GLY 134 N 1.77 2.01 3.70 -1.23 0.00 -1.04 -4.92 105.19 105.48 1moe n GLY 134 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1moe n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1moe s ALA 135 N -2.40 1.15 -0.09 4.61 0.00 -0.13 -4.42 121.76 120.47 1moe s ALA 135 Ca 0.00 -0.68 -0.07 0.00 0.00 0.00 0.00 51.96 51.21 1moe s ALA 135 Cb 0.00 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 20.16 1moe s ALA 135 CO 0.00 -2.91 0.23 -1.54 0.00 0.00 0.00 175.76 171.54 1moe s SER 136 N -3.88 -0.25 0.21 0.00 1.04 -1.26 -0.49 113.70 109.08 1moe s SER 136 Ca 0.68 0.48 0.11 0.00 0.48 0.00 0.00 55.95 57.70 1moe s SER 136 Cb -0.13 0.45 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 1moe s SER 136 CO 0.56 -0.10 -0.20 0.68 0.98 0.00 0.00 173.24 175.15 1moe s VAL 137 N 0.43 2.56 -0.35 5.02 -7.23 -0.32 -4.99 120.40 115.51 1moe s VAL 137 Ca -0.02 -2.05 -0.00 0.00 -1.81 0.00 0.00 61.98 58.09 1moe s VAL 137 Cb -0.04 -2.27 0.14 0.00 0.56 0.00 0.00 36.38 34.77 1moe s VAL 137 CO -0.02 -0.19 0.21 -0.75 -0.31 0.00 0.00 175.10 174.04 1moe s LYS 138 N -2.92 0.60 0.51 4.82 2.20 -1.26 -1.03 119.74 122.66 1moe s LYS 138 Ca 0.24 -1.33 -0.18 0.00 -0.36 0.00 0.00 55.97 54.33 1moe s LYS 138 Cb -0.07 -1.40 -0.07 0.00 -1.51 0.00 0.00 37.83 34.77 1moe s LYS 138 CO 0.12 -1.19 1.02 -0.51 -0.36 0.00 0.00 175.35 174.43 1moe s LEU 139 N 1.08 3.72 0.39 5.43 1.43 -0.84 -4.83 118.68 125.05 1moe s LEU 139 Ca 0.17 1.77 0.06 0.00 -1.03 0.00 0.00 54.13 55.10 1moe s LEU 139 Cb -0.23 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.39 1moe s LEU 139 CO -0.02 -0.77 0.03 -0.94 0.23 0.00 0.00 176.35 174.88 1moe s SER 140 N -2.49 3.42 -0.30 2.29 1.04 -1.26 -1.08 113.70 115.33 1moe s SER 140 Ca 0.63 -1.39 -0.02 0.00 0.48 0.00 0.00 55.95 55.65 1moe s SER 140 Cb -0.13 -0.25 0.19 0.00 0.10 0.00 0.00 66.02 65.93 1moe s SER 140 CO 0.26 -0.52 0.74 0.00 0.98 0.00 0.00 173.24 174.70 1moe s THR 142 N 2.88 4.97 -0.08 0.00 2.01 -0.25 -0.93 115.64 124.24 1moe s THR 142 Ca 0.15 0.94 -0.01 0.00 0.31 0.00 0.00 61.69 63.08 1moe s THR 142 Cb -0.10 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.61 1moe s THR 142 CO -0.21 0.56 -0.03 0.00 -0.69 0.00 0.00 174.62 174.24 1moe s ALA 143 N -0.98 3.13 0.01 7.40 0.00 -0.96 -1.31 121.76 129.05 1moe s ALA 143 Ca 0.25 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.38 1moe s ALA 143 Cb -0.17 -1.36 -0.01 0.00 0.00 0.00 0.00 23.12 21.57 1moe s ALA 143 CO 0.15 0.57 -0.07 -1.54 0.00 0.00 0.00 175.76 174.86 1moe s SER 144 N -0.80 0.79 0.00 0.00 1.04 -1.10 -4.81 113.70 108.82 1moe s SER 144 Ca 0.12 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.32 1moe s SER 144 Cb -0.11 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 65.95 1moe s SER 144 CO 0.02 0.01 0.00 0.61 0.98 0.00 0.00 173.24 174.86 1moe n GLY 145 N 2.54 1.95 3.29 7.32 0.00 -1.26 -2.31 105.19 116.71 1moe n GLY 145 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 1moe n GLY 145 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1moe s PHE 146 N -2.09 -0.14 0.09 1.61 -0.12 -1.26 -4.87 117.98 111.20 1moe s PHE 146 Ca 0.00 -0.07 -0.27 0.00 -0.05 0.00 0.00 56.93 56.54 1moe s PHE 146 Cb 0.00 0.16 -0.06 0.00 -0.63 0.00 0.00 43.02 42.49 1moe s PHE 146 CO 0.00 -0.60 0.84 1.21 -0.05 0.00 0.00 175.22 176.62 1moe s ASN 147 N -2.42 7.35 0.00 1.98 3.84 -1.26 -4.94 114.94 119.49 1moe s ASN 147 Ca -0.01 1.61 0.18 0.00 0.21 0.00 0.00 52.86 54.85 1moe s ASN 147 Cb 0.01 -2.52 0.80 0.00 -0.55 0.00 0.00 41.25 38.99 1moe s ASN 147 CO -0.07 0.02 1.57 2.30 -2.79 0.00 0.00 177.10 178.14 1moe n ILE 148 N 2.57 0.71 0.19 -5.21 -5.35 -1.26 -2.18 119.36 108.83 1moe n ILE 148 Ca -0.01 0.18 0.08 0.00 -0.27 0.00 0.00 62.75 62.73 1moe n ILE 148 Cb 0.49 -0.87 0.23 0.00 -1.74 0.00 0.00 39.64 37.76 1moe n ILE 148 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1moe h LYS 149 N 0.00 0.00 -0.96 6.28 1.57 -1.92 -3.18 116.57 118.36 1moe h LYS 149 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1moe h LYS 149 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1moe h LYS 149 CO 0.00 0.25 0.00 -0.25 -0.57 0.00 0.00 179.45 178.88 1moe n ASP 150 N -3.23 1.13 -0.55 0.86 8.00 -0.93 -4.36 116.55 117.47 1moe n ASP 150 Ca 0.02 -2.03 0.00 0.00 0.71 0.00 0.00 54.79 53.49 1moe n ASP 150 Cb 0.56 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 1moe n ASP 150 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1moe n THR 151 N 0.01 0.00 -5.27 -3.53 5.66 -1.20 -1.64 114.28 108.31 1moe n THR 151 Ca 0.01 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.70 1moe n THR 151 Cb 0.27 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.89 1moe n THR 151 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1moe s TYR 152 N -4.00 2.33 -0.23 1.09 1.51 -1.25 -4.33 117.35 112.47 1moe s TYR 152 Ca 0.00 -0.55 -0.10 0.00 -1.01 0.00 0.00 57.07 55.42 1moe s TYR 152 Cb 0.00 -1.51 -0.05 0.00 -0.11 0.00 0.00 41.96 40.29 1moe s TYR 152 CO 0.00 -0.11 0.13 -1.64 -1.11 0.00 0.00 175.55 172.82 1moe s MET 153 N -0.41 4.03 0.13 -0.62 -1.94 -0.87 -0.76 119.30 118.86 1moe s MET 153 Ca 0.04 -0.30 0.07 0.00 -1.71 0.00 0.00 55.69 53.79 1moe s MET 153 Cb -0.11 -3.45 -0.04 0.00 2.01 0.00 0.00 34.83 33.23 1moe s MET 153 CO 0.01 0.10 -0.03 -1.01 -0.01 0.00 0.00 175.02 174.08 1moe s HIS 154 N 0.93 2.85 -0.04 -0.03 3.76 -0.25 -1.82 115.29 120.70 1moe s HIS 154 Ca 0.07 -0.11 0.05 0.00 -0.15 0.00 0.00 55.06 54.91 1moe s HIS 154 Cb -0.13 -1.43 -0.01 0.00 1.11 0.00 0.00 32.58 32.12 1moe s HIS 154 CO 0.03 0.48 -0.19 -1.58 -0.85 0.00 0.00 174.74 172.64 1moe s TRP 155 N -1.48 1.80 0.01 1.40 0.52 -0.80 -0.96 118.94 119.43 1moe s TRP 155 Ca 0.25 -0.47 0.04 0.00 0.02 0.00 0.00 56.10 55.93 1moe s TRP 155 Cb -0.10 -1.19 -0.01 0.00 -1.15 0.00 0.00 33.47 31.01 1moe s TRP 155 CO 0.17 -0.14 -0.11 0.08 0.02 0.00 0.00 176.95 176.97 1moe s VAL 156 N -0.11 0.88 0.12 4.03 1.01 0.20 -1.43 120.40 125.10 1moe s VAL 156 Ca -0.01 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1moe s VAL 156 Cb -0.11 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1moe s VAL 156 CO 0.02 0.12 0.10 -0.75 0.00 0.00 0.00 175.10 174.59 1moe s LYS 157 N -0.60 2.87 -0.26 2.72 2.20 -0.87 -0.45 119.74 125.35 1moe s LYS 157 Ca 0.02 -0.79 -0.03 0.00 -0.36 0.00 0.00 55.97 54.82 1moe s LYS 157 Cb -0.06 -2.68 0.15 0.00 -1.51 0.00 0.00 37.83 33.74 1moe s LYS 157 CO 0.00 0.53 0.46 -1.14 -0.36 0.00 0.00 175.35 174.84 1moe s GLN 158 N -2.72 0.42 0.39 4.03 0.74 -0.50 -1.37 119.66 120.65 1moe s GLN 158 Ca 0.30 0.75 -0.21 0.00 0.05 0.00 0.00 55.36 56.25 1moe s GLN 158 Cb -0.11 -0.05 -0.10 0.00 1.10 0.00 0.00 33.01 33.84 1moe s GLN 158 CO 0.22 -0.60 0.91 1.03 -0.55 0.00 0.00 175.29 176.30 1moe s ARG 159 N 2.66 4.26 -0.95 1.67 0.52 -1.26 -1.61 118.95 124.24 1moe s ARG 159 Ca 0.14 1.08 -0.29 0.00 -0.52 0.00 0.00 55.73 56.13 1moe s ARG 159 Cb -0.15 -2.35 -0.21 0.00 0.52 0.00 0.00 34.95 32.76 1moe s ARG 159 CO -0.17 0.07 2.64 -2.30 0.02 0.00 0.00 175.30 175.56 1moe n PRO 160 N -0.33 0.11 -1.31 3.54 -0.02 -1.26 0.63 135.00 136.35 1moe n PRO 160 Ca 0.05 -0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1moe n PRO 160 Cb 0.53 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 1moe n PRO 160 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1moe n GLU 161 N 8.42 0.00 -4.20 -0.52 1.02 -1.26 -5.08 120.64 119.02 1moe n GLU 161 Ca 0.63 0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 57.75 1moe n GLU 161 Cb 0.09 -2.76 -0.10 0.00 -0.02 0.00 0.00 31.44 28.65 1moe n GLU 161 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1moe s GLN 162 N -2.80 0.92 1.07 3.49 -0.21 0.20 -5.15 119.66 117.19 1moe s GLN 162 Ca 0.00 -1.36 -0.12 0.00 0.02 0.00 0.00 55.36 53.91 1moe s GLN 162 Cb 0.00 -0.41 0.23 0.00 1.00 0.00 0.00 33.01 33.83 1moe s GLN 162 CO 0.00 0.03 1.07 0.20 -2.12 0.00 0.00 175.29 174.48 1moe s GLY 163 N -3.01 1.60 0.42 3.09 0.00 -1.26 -4.37 107.32 103.80 1moe s GLY 163 Ca 0.13 0.19 -0.21 0.00 0.00 0.00 0.00 44.72 44.83 1moe s GLY 163 CO -0.02 0.79 0.94 1.08 0.00 0.00 0.00 173.10 175.89 1moe s LEU 164 N -7.01 3.95 -0.27 0.66 2.01 -1.26 -4.43 118.68 112.34 1moe s LEU 164 Ca 0.68 1.67 -0.03 0.00 0.01 0.00 0.00 54.13 56.47 1moe s LEU 164 Cb -0.24 -4.52 0.09 0.00 0.01 0.00 0.00 46.19 41.53 1moe s LEU 164 CO 0.62 -0.35 0.09 -0.70 1.01 0.00 0.00 176.35 177.02 1moe s GLU 165 N -3.16 0.47 0.31 1.70 2.12 -0.47 -4.98 118.70 114.69 1moe s GLU 165 Ca 0.62 -0.67 -0.27 0.00 0.36 0.00 0.00 54.97 55.01 1moe s GLU 165 Cb -0.09 -1.73 -0.14 0.00 0.26 0.00 0.00 34.13 32.43 1moe s GLU 165 CO 0.13 -0.89 0.99 1.87 -0.54 0.00 0.00 175.26 176.82 1moe n TRP 166 N 5.06 1.20 -0.08 5.30 -0.00 -1.26 -2.06 117.44 125.60 1moe n TRP 166 Ca -0.05 0.69 -0.17 0.00 -0.00 0.00 0.00 57.50 57.97 1moe n TRP 166 Cb 0.44 -2.24 -0.06 0.00 -0.00 0.00 0.00 31.31 29.45 1moe n TRP 166 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 1moe n ILE 167 N 0.12 1.11 -1.17 5.87 5.41 -0.52 -4.81 119.36 125.37 1moe n ILE 167 Ca 0.10 -0.15 0.00 0.00 1.00 0.00 0.00 62.75 63.70 1moe n ILE 167 Cb 0.33 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 1moe n ILE 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1moe n GLY 168 N 1.91 -1.79 3.29 7.39 0.00 -1.22 -1.32 105.19 113.45 1moe n GLY 168 Ca -0.30 -1.12 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 1moe n GLY 168 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1moe s ARG 169 N -1.67 1.67 -0.17 1.61 1.70 -0.45 -1.90 118.95 119.74 1moe s ARG 169 Ca 0.00 -1.92 -0.18 0.00 -0.47 0.00 0.00 55.73 53.16 1moe s ARG 169 Cb 0.00 0.33 0.05 0.00 -0.57 0.00 0.00 34.95 34.76 1moe s ARG 169 CO 0.00 -0.62 0.51 -1.50 -1.08 0.00 0.00 175.30 172.61 1moe s ILE 170 N -3.54 0.00 -0.42 4.99 -1.16 -0.76 -2.10 121.20 118.22 1moe s ILE 170 Ca 0.39 -0.03 -0.13 0.00 -0.51 0.00 0.00 60.65 60.38 1moe s ILE 170 Cb 0.03 -0.72 0.05 0.00 0.61 0.00 0.00 42.46 42.43 1moe s ILE 170 CO 0.24 -0.02 0.29 -0.62 -2.81 0.00 0.00 174.94 172.03 1moe s ASP 171 N 0.09 5.90 0.59 4.50 2.15 0.13 -2.04 116.67 127.99 1moe s ASP 171 Ca -0.01 -1.21 0.36 0.00 0.43 0.00 0.00 52.55 52.12 1moe s ASP 171 Cb -0.03 -2.08 1.79 0.00 -0.30 0.00 0.00 42.92 42.29 1moe s ASP 171 CO 0.01 -0.51 2.16 -0.65 -0.17 0.00 0.00 175.17 176.01 1moe h PRO 172 N 8.56 0.00 -0.16 4.34 0.11 -1.77 0.28 132.00 143.36 1moe h PRO 172 Ca -0.26 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.77 1moe h PRO 172 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1moe h PRO 172 CO 0.76 0.03 -0.28 0.00 -0.21 0.00 0.00 178.00 178.31 1moe h ALA 173 N 1.97 1.23 0.00 -0.75 0.00 -1.84 -3.36 119.26 116.50 1moe h ALA 173 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1moe h ALA 173 Cb 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1moe h ALA 173 CO 0.00 0.51 0.00 0.27 0.00 0.00 0.00 179.25 180.03 1moe n ASN 174 N -4.13 0.03 0.00 0.00 0.23 -1.13 -5.04 115.26 105.22 1moe n ASN 174 Ca -0.01 -1.01 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 1moe n ASN 174 Cb 0.39 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1moe n ASN 174 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1moe n GLY 175 N -0.01 2.28 3.74 4.83 0.00 0.97 -5.03 105.19 111.98 1moe n GLY 175 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1moe n GLY 175 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1moe s ASN 176 N -3.31 6.51 0.22 1.61 0.01 -1.22 -4.67 114.94 114.09 1moe s ASN 176 Ca 0.00 2.80 0.08 0.00 -0.71 0.00 0.00 52.86 55.02 1moe s ASN 176 Cb 0.00 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 38.99 1moe s ASN 176 CO 0.00 -0.82 -0.14 -0.94 -1.51 0.00 0.00 177.10 173.69 1moe s SER 177 N 0.55 2.67 -0.14 -1.22 1.04 -1.26 0.22 113.70 115.56 1moe s SER 177 Ca 0.63 -1.05 -0.10 0.00 0.48 0.00 0.00 55.95 55.91 1moe s SER 177 Cb -0.45 -0.15 0.05 0.00 0.10 0.00 0.00 66.02 65.56 1moe s SER 177 CO 0.43 -0.18 0.36 -0.54 0.98 0.00 0.00 173.24 174.29 1moe s LYS 178 N -3.65 0.37 0.21 4.02 1.02 -0.89 -4.99 119.74 115.83 1moe s LYS 178 Ca 0.24 0.61 0.07 0.00 0.02 0.00 0.00 55.97 56.91 1moe s LYS 178 Cb -0.00 0.06 -0.05 0.00 -0.52 0.00 0.00 37.83 37.32 1moe s LYS 178 CO 0.08 -0.11 -0.13 0.71 -0.92 0.00 0.00 175.35 174.99 1moe s TYR 179 N 0.81 1.72 0.04 3.18 1.51 -1.26 -1.34 117.35 122.01 1moe s TYR 179 Ca -0.05 -0.61 -0.30 0.00 -1.01 0.00 0.00 57.07 55.10 1moe s TYR 179 Cb -0.06 -0.83 -0.05 0.00 -0.11 0.00 0.00 41.96 40.91 1moe s TYR 179 CO -0.06 0.33 1.19 0.08 -1.11 0.00 0.00 175.55 175.98 1moe s VAL 180 N -3.00 4.10 0.27 0.71 1.01 -0.43 -4.89 120.40 118.16 1moe s VAL 180 Ca 0.23 1.50 0.13 0.00 0.00 0.00 0.00 61.98 63.84 1moe s VAL 180 Cb 0.00 -3.96 0.27 0.00 0.00 0.00 0.00 36.38 32.69 1moe s VAL 180 CO 0.07 0.10 1.18 -2.65 0.00 0.00 0.00 175.10 173.80 1moe n PRO 181 N 4.10 -0.05 0.08 2.72 -0.02 -1.26 0.68 135.00 141.25 1moe n PRO 181 Ca 0.09 1.05 0.10 0.00 -2.02 0.00 0.00 63.50 62.72 1moe n PRO 181 Cb 0.47 -1.84 0.42 0.00 -0.02 0.00 0.00 33.50 32.52 1moe n PRO 181 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1moe n LYS 182 N -4.76 0.12 -0.22 -0.52 2.85 -1.26 -2.69 118.16 111.67 1moe n LYS 182 Ca 0.26 0.37 0.06 0.00 -1.05 0.00 0.00 58.31 57.96 1moe n LYS 182 Cb 0.88 -1.73 0.16 0.00 -0.65 0.00 0.00 35.03 33.70 1moe n LYS 182 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1moe n PHE 183 N -1.95 0.49 0.38 5.58 3.72 0.22 -4.83 117.46 121.07 1moe n PHE 183 Ca 0.02 -0.70 -0.18 0.00 -0.05 0.00 0.00 57.45 56.55 1moe n PHE 183 Cb 0.19 -0.15 -0.09 0.00 -0.94 0.00 0.00 39.48 38.50 1moe n PHE 183 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1moe h GLN 184 N 1.34 -1.05 -0.76 -1.08 3.07 -1.52 -2.76 115.11 112.36 1moe h GLN 184 Ca 0.00 0.07 -0.40 0.00 0.09 0.00 0.00 58.65 58.41 1moe h GLN 184 Cb 0.98 0.24 -0.24 0.00 0.08 0.00 0.00 27.48 28.54 1moe h GLN 184 CO 0.08 -0.70 0.37 0.41 0.09 0.00 0.00 178.83 179.08 1moe n GLY 185 N -1.57 4.70 0.79 0.06 0.00 -1.26 -4.31 105.19 103.60 1moe n GLY 185 Ca -0.13 -1.18 -0.04 0.00 0.00 0.00 0.00 46.02 44.67 1moe n GLY 185 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1moe n LYS 186 N -1.13 0.07 -4.53 1.61 0.00 -1.23 -4.95 118.16 108.00 1moe n LYS 186 Ca 0.50 0.03 -0.32 0.00 0.00 0.00 0.00 58.31 58.52 1moe n LYS 186 Cb 1.41 -0.68 -0.11 0.00 0.00 0.00 0.00 35.03 35.66 1moe n LYS 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1moe s ALA 187 N -2.06 2.94 -0.14 3.14 0.00 -1.04 -1.40 121.76 123.20 1moe s ALA 187 Ca -0.05 -1.02 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 1moe s ALA 187 Cb 0.02 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 22.11 1moe s ALA 187 CO 0.06 0.60 0.10 -0.08 0.00 0.00 0.00 175.76 176.44 1moe s THR 188 N -0.95 -0.12 -0.03 0.00 -1.32 0.90 -4.62 115.64 109.51 1moe s THR 188 Ca 0.16 -0.01 -0.15 0.00 -1.21 0.00 0.00 61.69 60.48 1moe s THR 188 Cb -0.11 -0.48 -0.05 0.00 -1.51 0.00 0.00 72.50 70.35 1moe s THR 188 CO 0.06 -0.16 0.39 -0.63 -2.21 0.00 0.00 174.62 172.08 1moe s ILE 189 N 2.17 5.09 0.25 5.08 1.01 -1.26 -1.33 121.20 132.20 1moe s ILE 189 Ca 0.03 0.80 -0.01 0.00 0.00 0.00 0.00 60.65 61.48 1moe s ILE 189 Cb -0.15 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 1moe s ILE 189 CO -0.08 0.54 0.23 0.42 0.00 0.00 0.00 174.94 176.05 1moe s THR 190 N -0.78 0.00 -0.23 2.92 -4.23 -0.48 -4.94 115.64 107.91 1moe s THR 190 Ca 0.23 -1.90 -0.18 0.00 -1.18 0.00 0.00 61.69 58.66 1moe s THR 190 Cb -0.16 -2.48 0.06 0.00 1.34 0.00 0.00 72.50 71.26 1moe s THR 190 CO 0.12 0.00 0.58 0.00 -0.54 0.00 0.00 174.62 174.78 1moe s ALA 191 N -3.89 -1.48 -0.47 3.99 0.00 -1.26 0.08 121.76 118.73 1moe s ALA 191 Ca 0.37 1.79 -0.13 0.00 0.00 0.00 0.00 51.96 53.99 1moe s ALA 191 Cb 0.05 -1.05 0.09 0.00 0.00 0.00 0.00 23.12 22.20 1moe s ALA 191 CO 0.16 -0.30 0.36 0.34 0.00 0.00 0.00 175.76 176.33 1moe s ASP 192 N 0.73 5.95 0.53 0.00 3.68 -0.08 -4.93 116.67 122.55 1moe s ASP 192 Ca -0.03 -1.51 0.28 0.00 2.13 0.00 0.00 52.55 53.41 1moe s ASP 192 Cb -0.05 -2.11 1.49 0.00 -1.45 0.00 0.00 42.92 40.81 1moe s ASP 192 CO -0.05 -0.65 2.09 0.71 0.13 0.00 0.00 175.17 177.40 1moe h THR 193 N 5.92 0.56 -0.10 1.71 1.35 -1.91 0.29 112.91 120.73 1moe h THR 193 Ca -0.26 -0.47 -0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1moe h THR 193 Cb 1.10 1.30 -0.00 0.00 -1.73 0.00 0.00 68.15 68.81 1moe h THR 193 CO 0.86 0.10 0.05 0.28 -0.25 0.00 0.00 175.52 176.56 1moe h SER 194 N 0.00 0.13 -0.14 5.36 0.02 -1.97 -3.09 113.55 113.86 1moe h SER 194 Ca -0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1moe h SER 194 Cb 0.29 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.80 1moe h SER 194 CO 0.01 0.20 0.00 -1.54 -1.14 0.00 0.00 176.83 174.37 1moe n SER 195 N -4.96 2.53 -3.52 3.07 3.41 -0.91 -4.96 113.62 108.29 1moe n SER 195 Ca -0.06 -1.83 -0.25 0.00 -0.26 0.00 0.00 58.87 56.47 1moe n SER 195 Cb 0.09 -0.08 0.06 0.00 -0.26 0.00 0.00 64.21 64.01 1moe n SER 195 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1moe n ASN 196 N 0.93 -6.00 -4.53 4.04 5.15 0.96 -4.81 115.26 111.01 1moe n ASN 196 Ca 0.17 -0.52 -0.31 0.00 -0.60 0.00 0.00 54.58 53.32 1moe n ASN 196 Cb 0.50 -4.76 -0.11 0.00 -0.53 0.00 0.00 39.78 34.88 1moe n ASN 196 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1moe s THR 197 N -3.27 3.23 -0.16 -0.44 2.01 -0.78 -2.26 115.64 113.96 1moe s THR 197 Ca 0.53 -1.07 -0.02 0.00 0.31 0.00 0.00 61.69 61.44 1moe s THR 197 Cb -0.24 -2.42 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 1moe s THR 197 CO 0.66 0.30 -0.07 0.00 -0.69 0.00 0.00 174.62 174.82 1moe s ALA 198 N -1.02 2.82 0.11 7.40 0.00 -0.10 -0.90 121.76 130.06 1moe s ALA 198 Ca 0.17 -0.94 0.10 0.00 0.00 0.00 0.00 51.96 51.29 1moe s ALA 198 Cb -0.11 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1moe s ALA 198 CO 0.08 0.04 -0.24 0.71 0.00 0.00 0.00 175.76 176.36 1moe s TYR 199 N 0.67 2.39 -0.26 0.00 1.51 0.11 -1.10 117.35 120.67 1moe s TYR 199 Ca -0.04 -0.34 -0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1moe s TYR 199 Cb -0.15 -1.31 0.08 0.00 -0.11 0.00 0.00 41.96 40.47 1moe s TYR 199 CO 0.02 0.32 0.04 -1.17 -1.11 0.00 0.00 175.55 173.66 1moe s LEU 200 N -1.94 2.20 -0.20 -1.29 2.96 -0.24 -1.38 118.68 118.81 1moe s LEU 200 Ca 0.15 -1.36 -0.15 0.00 -0.22 0.00 0.00 54.13 52.55 1moe s LEU 200 Cb -0.10 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.63 1moe s LEU 200 CO 0.07 -0.34 0.36 -1.58 -1.32 0.00 0.00 176.35 173.53 1moe s GLN 201 N 1.58 4.18 -0.18 1.98 0.74 -0.44 -1.99 119.66 125.53 1moe s GLN 201 Ca 0.03 0.15 0.00 0.00 0.05 0.00 0.00 55.36 55.59 1moe s GLN 201 Cb -0.18 -3.52 0.01 0.00 1.10 0.00 0.00 33.01 30.43 1moe s GLN 201 CO -0.15 0.02 -0.16 -0.51 -0.55 0.00 0.00 175.29 173.94 1moe s LEU 202 N 1.13 2.35 0.43 3.68 1.43 -0.20 -0.07 118.68 127.43 1moe s LEU 202 Ca 0.18 -0.56 0.08 0.00 -1.03 0.00 0.00 54.13 52.80 1moe s LEU 202 Cb -0.14 -1.54 0.01 0.00 0.03 0.00 0.00 46.19 44.55 1moe s LEU 202 CO 0.07 0.02 0.58 0.42 0.23 0.00 0.00 176.35 177.67 1moe s THR 203 N 1.19 2.94 -0.11 5.49 -4.23 -0.49 -1.17 115.64 119.26 1moe s THR 203 Ca 0.02 -1.01 -0.07 0.00 -1.18 0.00 0.00 61.69 59.45 1moe s THR 203 Cb -0.14 -2.95 0.01 0.00 1.34 0.00 0.00 72.50 70.76 1moe s THR 203 CO -0.07 0.00 0.13 -1.54 -0.54 0.00 0.00 174.62 172.60 1moe n SER 204 N -1.86 -1.08 -4.71 3.99 3.41 -1.13 -4.81 113.62 107.41 1moe n SER 204 Ca 0.08 -0.07 -0.31 0.00 -0.26 0.00 0.00 58.87 58.31 1moe n SER 204 Cb 0.59 -0.32 0.13 0.00 -0.26 0.00 0.00 64.21 64.35 1moe n SER 204 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1moe s LEU 205 N -0.91 2.94 0.06 1.04 1.43 0.36 -4.73 118.68 118.86 1moe s LEU 205 Ca 0.06 2.05 -0.03 0.00 -1.03 0.00 0.00 54.13 55.19 1moe s LEU 205 Cb -0.01 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.63 1moe s LEU 205 CO 0.18 -2.65 0.02 -0.89 0.23 0.00 0.00 176.35 173.23 1moe s THR 206 N -2.72 0.20 -0.68 5.49 2.01 -1.26 -2.49 115.64 116.19 1moe s THR 206 Ca 0.65 -1.62 0.14 0.00 0.31 0.00 0.00 61.69 61.17 1moe s THR 206 Cb -0.21 -1.40 0.13 0.00 0.01 0.00 0.00 72.50 71.03 1moe s THR 206 CO 0.57 -0.89 1.42 -1.54 -0.69 0.00 0.00 174.62 173.48 1moe n SER 207 N 0.17 0.29 0.00 3.53 3.41 -1.26 0.18 113.62 119.94 1moe n SER 207 Ca -0.15 0.61 0.13 0.00 -0.26 0.00 0.00 58.87 59.20 1moe n SER 207 Cb 0.61 -0.65 0.58 0.00 -0.26 0.00 0.00 64.21 64.48 1moe n SER 207 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1moe n GLU 208 N -1.86 0.03 0.00 4.33 -0.58 -1.26 -2.97 120.64 118.33 1moe n GLU 208 Ca 0.01 0.04 0.12 0.00 -0.42 0.00 0.00 57.16 56.90 1moe n GLU 208 Cb 0.09 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.56 1moe n GLU 208 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1moe n ASP 209 N -1.48 1.65 -4.68 1.62 8.00 0.13 -4.89 116.55 116.88 1moe n ASP 209 Ca 0.07 -1.28 -0.43 0.00 0.71 0.00 0.00 54.79 53.87 1moe n ASP 209 Cb 0.31 0.42 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 1moe n ASP 209 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1moe n THR 210 N -0.34 0.50 0.00 -3.53 -1.04 -1.16 -4.86 114.28 103.85 1moe n THR 210 Ca 0.10 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1moe n THR 210 Cb 0.42 -2.17 0.00 0.00 -1.82 0.00 0.00 70.33 66.76 1moe n THR 210 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1moe n ALA 211 N 6.25 0.00 -2.80 2.41 0.00 0.07 -4.67 120.51 121.77 1moe n ALA 211 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.28 1moe n ALA 211 Cb 0.38 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 1moe n ALA 211 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1moe s VAL 212 N -2.00 4.96 -0.18 0.00 1.01 -0.63 -0.78 120.40 122.78 1moe s VAL 212 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.97 1moe s VAL 212 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1moe s VAL 212 CO 0.00 0.48 -0.06 -0.31 0.00 0.00 0.00 175.10 175.21 1moe s TYR 213 N 0.14 2.95 0.14 5.22 1.51 -0.88 -1.42 117.35 125.01 1moe s TYR 213 Ca 0.06 -0.66 0.06 0.00 -1.01 0.00 0.00 57.07 55.52 1moe s TYR 213 Cb -0.12 -2.00 -0.04 0.00 -0.11 0.00 0.00 41.96 39.69 1moe s TYR 213 CO 0.00 -0.31 0.03 0.71 -1.11 0.00 0.00 175.55 174.87 1moe s TYR 214 N 0.89 2.97 -0.05 2.71 1.51 0.40 -1.63 117.35 124.16 1moe s TYR 214 Ca -0.01 -0.07 0.06 0.00 -1.01 0.00 0.00 57.07 56.04 1moe s TYR 214 Cb -0.15 -1.47 -0.02 0.00 -0.11 0.00 0.00 41.96 40.21 1moe s TYR 214 CO 0.01 0.50 -0.22 0.00 -1.11 0.00 0.00 175.55 174.74 1moe s ALA 216 N -0.47 -0.70 0.35 0.00 0.00 -0.14 -0.36 121.76 120.45 1moe s ALA 216 Ca 0.06 1.13 -0.25 0.00 0.00 0.00 0.00 51.96 52.89 1moe s ALA 216 Cb -0.12 -0.85 -0.10 0.00 0.00 0.00 0.00 23.12 22.06 1moe s ALA 216 CO 0.01 -0.37 0.98 -1.25 0.00 0.00 0.00 175.76 175.13 1moe s PRO 217 N 1.70 4.45 0.00 0.00 0.04 -1.25 -1.09 135.00 138.84 1moe s PRO 217 Ca -0.06 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.37 1moe s PRO 217 Cb -0.11 -2.70 0.00 0.00 0.04 0.00 0.00 34.50 31.73 1moe s PRO 217 CO -0.10 0.14 0.00 0.34 0.04 0.00 0.00 177.00 177.42 1moe n PHE 218 N 0.33 0.00 0.00 0.56 -0.00 0.06 -4.49 117.46 113.93 1moe n PHE 218 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.48 1moe n PHE 218 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.98 1moe n PHE 218 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1moe n GLY 219 N 0.00 0.98 0.00 7.13 0.00 -1.22 -3.90 105.19 108.17 1moe n GLY 219 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1moe n GLY 219 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1moe n TYR 220 N 0.00 0.00 0.82 1.61 9.36 -1.26 -4.77 117.16 122.92 1moe n TYR 220 Ca 0.00 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.30 1moe n TYR 220 Cb 0.00 0.00 0.25 0.00 -0.63 0.00 0.00 39.34 38.96 1moe n TYR 220 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1moe n TYR 221 N 0.00 0.44 -0.02 2.98 4.01 -0.65 -4.31 117.16 119.61 1moe n TYR 221 Ca 0.00 -0.22 -0.04 0.00 -0.16 0.00 0.00 57.90 57.48 1moe n TYR 221 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 1moe n TYR 221 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1moe n VAL 222 N 0.66 0.23 -2.83 -0.72 0.31 -1.25 -4.61 118.33 110.11 1moe n VAL 222 Ca 0.15 -0.06 -0.11 0.00 -0.01 0.00 0.00 64.34 64.31 1moe n VAL 222 Cb 0.37 -1.46 0.06 0.00 -0.91 0.00 0.00 33.84 31.90 1moe n VAL 222 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1moe n SER 223 N -3.13 -1.47 0.00 4.52 2.88 -1.26 -4.85 113.62 110.32 1moe n SER 223 Ca -0.08 -3.43 0.12 0.00 -1.33 0.00 0.00 58.87 54.15 1moe n SER 223 Cb 0.56 1.20 0.72 0.00 -0.75 0.00 0.00 64.21 65.94 1moe n SER 223 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1moe n ASP 224 N 0.26 0.00 -0.12 -3.46 3.85 -1.26 -3.37 116.55 112.44 1moe n ASP 224 Ca 0.10 -0.85 0.07 0.00 -0.71 0.00 0.00 54.79 53.39 1moe n ASP 224 Cb 0.70 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.42 1moe n ASP 224 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1moe n TYR 225 N -0.97 0.00 -3.70 2.11 0.18 -1.26 -4.78 117.16 108.74 1moe n TYR 225 Ca 0.18 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.96 1moe n TYR 225 Cb 0.08 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.04 1moe n TYR 225 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1moe n ALA 226 N -0.91 0.00 -3.54 -3.48 0.00 -1.22 -5.05 120.51 106.31 1moe n ALA 226 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.08 1moe n ALA 226 Cb 0.26 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.66 1moe n ALA 226 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1moe s MET 227 N -1.40 3.36 0.13 0.00 -1.94 -1.26 -4.77 119.30 113.43 1moe s MET 227 Ca 0.00 -2.97 0.07 0.00 -1.71 0.00 0.00 55.69 51.08 1moe s MET 227 Cb 0.00 -4.11 -0.19 0.00 2.01 0.00 0.00 34.83 32.54 1moe s MET 227 CO 0.00 -1.24 1.29 0.00 -0.01 0.00 0.00 175.02 175.05 1moe h ALA 228 N 6.65 0.37 -3.01 3.03 0.00 -1.89 -3.43 119.26 120.99 1moe h ALA 228 Ca 0.12 -0.89 -0.67 0.00 0.00 0.00 0.00 54.91 53.47 1moe h ALA 228 Cb 0.89 -0.16 -0.26 0.00 0.00 0.00 0.00 17.79 18.27 1moe h ALA 228 CO 0.84 1.22 -0.63 0.71 0.00 0.00 0.00 179.25 181.38 1moe s TYR 229 N -2.72 3.12 -0.03 0.00 1.51 -1.26 -5.10 117.35 112.87 1moe s TYR 229 Ca 0.01 -0.88 0.07 0.00 -1.01 0.00 0.00 57.07 55.26 1moe s TYR 229 Cb 0.10 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.69 1moe s TYR 229 CO 0.82 -0.54 -0.24 -1.58 -1.11 0.00 0.00 175.55 172.89 1moe s TRP 230 N 1.52 2.22 0.67 2.71 0.52 -1.26 -3.86 118.94 121.46 1moe s TRP 230 Ca 0.03 -0.46 -0.12 0.00 0.02 0.00 0.00 56.10 55.57 1moe s TRP 230 Cb -0.17 -1.44 -0.00 0.00 -1.15 0.00 0.00 33.47 30.72 1moe s TRP 230 CO 0.02 -0.07 1.06 0.20 0.02 0.00 0.00 176.95 178.18 1moe s GLY 231 N -0.50 1.77 0.00 0.98 0.00 0.52 -4.71 107.32 105.38 1moe s GLY 231 Ca 0.07 0.15 0.09 0.00 0.00 0.00 0.00 44.72 45.03 1moe s GLY 231 CO -0.00 0.46 1.22 -1.06 0.00 0.00 0.00 173.10 173.72 1moe n GLN 232 N -2.88 0.05 -1.00 2.90 1.13 -1.26 -4.64 117.38 111.68 1moe n GLN 232 Ca 0.08 0.29 0.00 0.00 -1.94 0.00 0.00 57.00 55.43 1moe n GLN 232 Cb 0.53 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.38 1moe n GLN 232 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1moe n GLY 233 N -0.60 -4.26 3.63 1.08 0.00 -1.26 -4.96 105.19 98.83 1moe n GLY 233 Ca 0.03 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 1moe n GLY 233 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1moe s THR 234 N -0.92 5.28 0.18 2.61 -1.32 -0.64 -4.81 115.64 116.02 1moe s THR 234 Ca 0.00 0.16 -0.30 0.00 -1.21 0.00 0.00 61.69 60.34 1moe s THR 234 Cb 0.00 -3.48 -0.08 0.00 -1.51 0.00 0.00 72.50 67.43 1moe s THR 234 CO 0.00 0.31 1.11 -0.55 -2.21 0.00 0.00 174.62 173.28 1moe s SER 235 N 1.31 7.25 -0.11 8.08 0.15 -1.26 -2.08 113.70 127.04 1moe s SER 235 Ca 0.07 2.10 0.01 0.00 0.70 0.00 0.00 55.95 58.83 1moe s SER 235 Cb -0.14 -2.60 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 1moe s SER 235 CO 0.07 -0.23 -0.12 -0.69 1.20 0.00 0.00 173.24 173.47 1moe s VAL 236 N -0.25 1.25 -0.15 4.45 1.01 0.04 -0.47 120.40 126.29 1moe s VAL 236 Ca 0.49 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1moe s VAL 236 Cb -0.30 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1moe s VAL 236 CO 0.35 0.40 -0.19 -0.89 0.00 0.00 0.00 175.10 174.77 1moe s THR 237 N 1.27 2.33 -0.59 3.92 2.01 -0.95 -0.75 115.64 122.88 1moe s THR 237 Ca -0.02 -0.88 -0.09 0.00 0.31 0.00 0.00 61.69 61.01 1moe s THR 237 Cb -0.14 -1.96 0.15 0.00 0.01 0.00 0.00 72.50 70.56 1moe s THR 237 CO -0.04 0.53 0.46 -0.69 -0.69 0.00 0.00 174.62 174.19 1moe s VAL 238 N 0.85 4.40 -0.15 3.82 1.01 -1.26 -1.56 120.40 127.51 1moe s VAL 238 Ca -0.06 -2.24 -0.01 0.00 0.00 0.00 0.00 61.98 59.67 1moe s VAL 238 Cb -0.15 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 1moe s VAL 238 CO -0.02 -0.86 -0.10 -0.55 0.00 0.00 0.00 175.10 173.57 1moe s SER 239 N 2.06 4.15 0.00 3.32 0.15 -1.10 -4.52 113.70 117.76 1moe s SER 239 Ca 0.11 -0.32 0.29 0.00 0.70 0.00 0.00 55.95 56.74 1moe s SER 239 Cb -0.21 -1.65 1.32 0.00 -1.71 0.00 0.00 66.02 63.77 1moe s SER 239 CO -0.03 0.13 1.90 -0.24 1.20 0.00 0.00 173.24 176.20