#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 4.40 -0.16 0.53 1.01 -1.26 -4.97 121.20 120.74 1moe s ILE 2 Ca 0.00 -1.04 -0.24 0.00 0.00 0.00 0.00 60.65 59.37 1moe s ILE 2 Cb 0.00 -3.53 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 1moe s ILE 2 CO 0.00 -0.31 0.78 -0.69 0.00 0.00 0.00 174.94 174.72 1moe s VAL 3 N 1.50 4.93 -0.10 2.92 1.01 -1.26 -4.69 120.40 124.70 1moe s VAL 3 Ca 0.02 1.54 -0.04 0.00 0.00 0.00 0.00 61.98 63.49 1moe s VAL 3 Cb -0.20 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1moe s VAL 3 CO 0.05 0.07 0.06 -0.76 0.00 0.00 0.00 175.10 174.52 1moe s LEU 4 N 1.93 3.94 -0.19 3.92 1.43 -1.26 -1.66 118.68 126.78 1moe s LEU 4 Ca 0.37 0.28 -0.01 0.00 -1.03 0.00 0.00 54.13 53.74 1moe s LEU 4 Cb -0.17 -1.93 0.05 0.00 0.03 0.00 0.00 46.19 44.17 1moe s LEU 4 CO 0.13 0.39 -0.02 -0.89 0.23 0.00 0.00 176.35 176.18 1moe s THR 5 N -0.91 1.03 0.30 5.49 2.01 -0.52 -4.34 115.64 118.70 1moe s THR 5 Ca 0.14 -0.75 -0.08 0.00 0.31 0.00 0.00 61.69 61.31 1moe s THR 5 Cb -0.12 -1.33 -0.06 0.00 0.01 0.00 0.00 72.50 71.01 1moe s THR 5 CO 0.03 -0.03 0.61 -1.10 -0.69 0.00 0.00 174.62 173.43 1moe s GLN 6 N 1.64 3.71 -0.16 4.92 -0.21 -1.26 -1.14 119.66 127.17 1moe s GLN 6 Ca -0.01 0.19 -0.29 0.00 0.02 0.00 0.00 55.36 55.27 1moe s GLN 6 Cb -0.17 -2.58 0.10 0.00 1.00 0.00 0.00 33.01 31.36 1moe s GLN 6 CO -0.07 0.18 0.87 -1.54 -2.12 0.00 0.00 175.29 172.61 1moe s SER 7 N -2.96 -0.52 1.19 5.90 1.04 -0.62 -4.64 113.70 113.09 1moe s SER 7 Ca 0.47 0.72 -0.19 0.00 0.48 0.00 0.00 55.95 57.43 1moe s SER 7 Cb -0.11 0.64 0.28 0.00 0.10 0.00 0.00 66.02 66.93 1moe s SER 7 CO 0.28 -0.38 1.13 -2.16 0.98 0.00 0.00 173.24 173.09 1moe s PRO 8 N -0.69 -1.16 0.40 4.02 0.04 -1.26 -1.00 135.00 135.35 1moe s PRO 8 Ca -0.03 -0.12 0.15 0.00 0.04 0.00 0.00 61.00 61.04 1moe s PRO 8 Cb -0.02 -1.61 0.85 0.00 0.04 0.00 0.00 34.50 33.77 1moe s PRO 8 CO 0.03 -3.66 1.88 0.00 0.04 0.00 0.00 177.00 175.28 1moe h ALA 9 N -2.54 1.40 -1.71 8.56 0.00 -1.86 -3.41 119.26 119.69 1moe h ALA 9 Ca -0.44 -0.28 0.14 0.00 0.00 0.00 0.00 54.91 54.33 1moe h ALA 9 Cb 1.29 -0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.83 1moe h ALA 9 CO 0.33 0.39 0.63 -1.54 0.00 0.00 0.00 179.25 179.06 1moe s SER 10 N -6.82 -0.28 0.14 0.00 1.04 -1.26 -2.20 113.70 104.33 1moe s SER 10 Ca -0.03 0.16 -0.10 0.00 0.48 0.00 0.00 55.95 56.45 1moe s SER 10 Cb 0.14 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1moe s SER 10 CO 0.70 -0.37 0.29 -1.48 0.98 0.00 0.00 173.24 173.36 1moe s LEU 11 N -1.76 0.94 -0.03 2.42 2.34 -0.41 -4.92 118.68 117.27 1moe s LEU 11 Ca 0.04 -0.73 0.05 0.00 0.06 0.00 0.00 54.13 53.55 1moe s LEU 11 Cb -0.01 1.30 -0.01 0.00 -0.56 0.00 0.00 46.19 46.92 1moe s LEU 11 CO -0.04 -0.86 -0.17 0.00 -1.06 0.00 0.00 176.35 174.22 1moe s ALA 12 N -3.92 1.45 0.01 1.48 0.00 -1.26 -2.68 121.76 116.84 1moe s ALA 12 Ca 0.12 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1moe s ALA 12 Cb 0.03 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1moe s ALA 12 CO -0.04 0.31 -0.02 0.08 0.00 0.00 0.00 175.76 176.08 1moe s VAL 13 N -0.17 0.13 0.41 0.00 1.01 -0.78 -4.82 120.40 116.18 1moe s VAL 13 Ca 0.01 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.26 1moe s VAL 13 Cb -0.09 -0.20 -0.10 0.00 0.00 0.00 0.00 36.38 35.99 1moe s VAL 13 CO 0.01 -0.24 0.98 -0.44 0.00 0.00 0.00 175.10 175.40 1moe s SER 14 N -0.78 6.90 0.31 3.32 0.01 -1.26 -1.40 113.70 120.80 1moe s SER 14 Ca -0.08 1.81 -0.29 0.00 1.31 0.00 0.00 55.95 58.70 1moe s SER 14 Cb -0.05 -2.56 -0.13 0.00 0.21 0.00 0.00 66.02 63.49 1moe s SER 14 CO -0.00 -0.38 1.22 0.18 0.41 0.00 0.00 173.24 174.66 1moe n LEU 15 N -0.36 2.92 0.00 2.44 4.77 -1.26 -1.73 117.00 123.78 1moe n LEU 15 Ca 0.06 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.23 1moe n LEU 15 Cb 0.52 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1moe n LEU 15 CO 0.40 -0.77 0.00 0.61 -1.33 0.00 0.00 177.39 176.30 1moe n GLY 16 N 1.13 1.38 3.98 -0.72 0.00 0.33 -3.71 105.19 107.59 1moe n GLY 16 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.15 2.57 0.14 1.61 -0.21 -0.71 -4.55 119.66 118.36 1moe s GLN 17 Ca 0.00 -0.91 -0.24 0.00 0.02 0.00 0.00 55.36 54.24 1moe s GLN 17 Cb 0.00 -2.54 -0.08 0.00 1.00 0.00 0.00 33.01 31.39 1moe s GLN 17 CO 0.00 -0.65 0.72 0.50 -2.12 0.00 0.00 175.29 173.74 1moe s ARG 18 N -4.69 4.47 -0.04 2.91 3.52 -1.26 -1.65 118.95 122.22 1moe s ARG 18 Ca 0.57 1.05 0.04 0.00 -0.13 0.00 0.00 55.73 57.26 1moe s ARG 18 Cb -0.10 -3.26 -0.00 0.00 -1.56 0.00 0.00 34.95 30.03 1moe s ARG 18 CO 0.37 0.59 -0.15 0.00 -0.81 0.00 0.00 175.30 175.30 1moe s ALA 19 N -1.12 1.36 -0.06 6.12 0.00 -0.26 -4.99 121.76 122.81 1moe s ALA 19 Ca 0.34 -0.59 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 1moe s ALA 19 Cb -0.22 -0.48 0.04 0.00 0.00 0.00 0.00 23.12 22.46 1moe s ALA 19 CO 0.24 0.23 0.14 0.95 0.00 0.00 0.00 175.76 177.32 1moe s THR 20 N 0.14 -0.05 0.10 0.00 -4.23 -1.26 -0.92 115.64 109.41 1moe s THR 20 Ca -0.05 0.19 0.06 0.00 -1.18 0.00 0.00 61.69 60.71 1moe s THR 20 Cb -0.11 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.47 1moe s THR 20 CO 0.02 0.08 -0.16 0.00 -0.54 0.00 0.00 174.62 174.02 1moe s MET 21 N 1.18 0.97 0.39 3.99 0.23 -0.59 -4.84 119.30 120.63 1moe s MET 21 Ca -0.09 -1.11 0.08 0.00 -1.03 0.00 0.00 55.69 53.54 1moe s MET 21 Cb -0.12 -1.01 -0.06 0.00 -1.53 0.00 0.00 34.83 32.12 1moe s MET 21 CO -0.06 0.22 0.12 -1.54 -2.03 0.00 0.00 175.02 171.73 1moe s SER 22 N -2.03 4.30 -0.21 -1.18 1.04 -0.17 -0.46 113.70 114.99 1moe s SER 22 Ca 0.04 -1.09 -0.04 0.00 0.48 0.00 0.00 55.95 55.34 1moe s SER 22 Cb -0.08 -0.49 0.11 0.00 0.10 0.00 0.00 66.02 65.65 1moe s SER 22 CO 0.03 -0.45 0.36 0.00 0.98 0.00 0.00 173.24 174.16 1moe s ARG 24 N 2.53 3.20 -0.05 0.00 0.52 -0.29 -1.43 118.95 123.42 1moe s ARG 24 Ca 0.07 -0.68 -0.14 0.00 -0.52 0.00 0.00 55.73 54.47 1moe s ARG 24 Cb -0.14 -2.59 -0.05 0.00 0.52 0.00 0.00 34.95 32.69 1moe s ARG 24 CO -0.14 0.31 0.35 0.00 0.02 0.00 0.00 175.30 175.85 1moe s ALA 25 N 0.09 3.69 -1.37 2.13 0.00 0.10 -1.44 121.76 124.97 1moe s ALA 25 Ca -0.05 -0.32 0.23 0.00 0.00 0.00 0.00 51.96 51.81 1moe s ALA 25 Cb -0.15 -2.34 1.13 0.00 0.00 0.00 0.00 23.12 21.76 1moe s ALA 25 CO 0.04 0.40 1.74 0.41 0.00 0.00 0.00 175.76 178.36 1moe n GLY 26 N 2.21 -1.07 3.25 0.00 0.00 -0.66 -4.71 105.19 104.21 1moe n GLY 26 Ca -0.14 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1moe n GLY 26 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1moe s GLU 27 N -2.63 0.65 0.56 1.61 2.12 -1.26 -4.97 118.70 114.77 1moe s GLU 27 Ca 0.20 -0.08 -0.20 0.00 0.36 0.00 0.00 54.97 55.25 1moe s GLU 27 Cb 0.15 0.29 -0.06 0.00 0.26 0.00 0.00 34.13 34.78 1moe s GLU 27 CO 0.36 -0.17 1.06 0.45 -0.54 0.00 0.00 175.26 176.41 1moe n SER 28 N 1.48 1.27 -0.06 -1.70 2.88 -1.26 -4.79 113.62 111.44 1moe n SER 28 Ca -0.20 0.88 0.03 0.00 -1.33 0.00 0.00 58.87 58.25 1moe n SER 28 Cb 0.56 -1.42 0.04 0.00 -0.75 0.00 0.00 64.21 62.64 1moe n SER 28 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1moe n VAL 29 N -1.36 0.98 -3.35 2.46 0.24 -0.13 -5.01 118.33 112.16 1moe n VAL 29 Ca 0.12 -1.08 -0.37 0.00 -2.04 0.00 0.00 64.34 60.97 1moe n VAL 29 Cb 0.45 0.39 -0.06 0.00 -1.47 0.00 0.00 33.84 33.15 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 -1.33 6.90 -0.29 -1.34 -1.08 -1.26 -2.36 116.67 115.91 1moe s ASP 30 Ca 0.08 1.12 -0.03 0.00 -0.52 0.00 0.00 52.55 53.20 1moe s ASP 30 Cb 0.07 -2.30 0.10 0.00 -1.46 0.00 0.00 42.92 39.33 1moe s ASP 30 CO 0.01 0.19 0.11 -0.63 0.52 0.00 0.00 175.17 175.37 1moe s ILE 31 N -1.30 0.28 -1.18 4.11 1.01 -0.36 -4.86 121.20 118.89 1moe s ILE 31 Ca 0.33 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 60.04 1moe s ILE 31 Cb -0.17 -1.19 -0.00 0.00 0.01 0.00 0.00 42.46 41.11 1moe s ILE 31 CO 0.18 -0.66 0.98 0.49 0.00 0.00 0.00 174.94 175.93 1moe n PHE 32 N 5.11 -2.17 -0.72 3.97 0.99 -1.26 -2.64 117.46 120.74 1moe n PHE 32 Ca -0.05 0.92 0.00 0.00 -0.00 0.00 0.00 57.45 58.32 1moe n PHE 32 Cb 0.43 -5.01 0.00 0.00 -1.00 0.00 0.00 39.48 33.90 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 -1.13 1.40 3.52 1.37 0.00 -1.26 -5.01 105.19 104.08 1moe n GLY 33 Ca -0.28 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 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 -3.55 4.78 -0.40 1.61 1.01 -1.08 -5.03 120.40 117.73 1moe s VAL 34 Ca 0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 61.98 61.75 1moe s VAL 34 Cb 0.00 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1moe s VAL 34 CO 0.00 0.31 0.69 -0.83 0.00 0.00 0.00 175.10 175.27 1moe s GLY 35 N 1.61 1.69 -1.36 4.51 0.00 -1.26 -1.23 107.32 111.28 1moe s GLY 35 Ca 0.07 -0.96 -0.07 0.00 0.00 0.00 0.00 44.72 43.76 1moe s GLY 35 CO 0.07 1.61 2.38 0.69 0.00 0.00 0.00 173.10 177.84 1moe n PHE 36 N 6.31 2.63 -5.08 1.90 3.72 -0.99 -1.81 117.46 124.14 1moe n PHE 36 Ca 0.00 -2.85 -0.32 0.00 -0.05 0.00 0.00 57.45 54.23 1moe n PHE 36 Cb 0.48 -1.94 -0.16 0.00 -0.94 0.00 0.00 39.48 36.93 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 -1.51 2.33 0.15 4.37 2.96 -1.26 -1.81 118.68 123.91 1moe s LEU 37 Ca 0.54 -0.43 0.11 0.00 -0.22 0.00 0.00 54.13 54.12 1moe s LEU 37 Cb 0.17 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 45.36 1moe s LEU 37 CO -0.08 0.22 -0.25 -1.00 -1.32 0.00 0.00 176.35 173.93 1moe s HIS 38 N -0.02 2.20 -0.10 5.38 3.76 0.22 -0.15 115.29 126.58 1moe s HIS 38 Ca -0.06 -0.38 0.03 0.00 -0.15 0.00 0.00 55.06 54.49 1moe s HIS 38 Cb -0.15 -1.16 -0.01 0.00 1.11 0.00 0.00 32.58 32.38 1moe s HIS 38 CO 0.05 0.37 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.52 1moe s TRP 39 N -1.33 2.61 0.02 1.40 0.52 0.22 -0.72 118.94 121.66 1moe s TRP 39 Ca 0.15 -0.84 0.05 0.00 0.02 0.00 0.00 56.10 55.48 1moe s TRP 39 Cb -0.09 -1.72 -0.02 0.00 -1.15 0.00 0.00 33.47 30.49 1moe s TRP 39 CO 0.07 -0.30 -0.14 0.71 0.02 0.00 0.00 176.95 177.31 1moe s TYR 40 N 0.20 1.27 0.01 -1.98 1.51 -0.10 -0.32 117.35 117.94 1moe s TYR 40 Ca -0.13 -0.30 -0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1moe s TYR 40 Cb -0.16 -0.78 -0.04 0.00 -0.11 0.00 0.00 41.96 40.87 1moe s TYR 40 CO 0.07 0.01 0.11 -1.14 -1.11 0.00 0.00 175.55 173.49 1moe s GLN 41 N -0.77 3.13 -0.13 -0.62 0.74 -0.39 -0.01 119.66 121.61 1moe s GLN 41 Ca 0.04 -0.49 -0.06 0.00 0.05 0.00 0.00 55.36 54.90 1moe s GLN 41 Cb -0.07 -2.89 0.06 0.00 1.10 0.00 0.00 33.01 31.21 1moe s GLN 41 CO 0.00 0.64 0.29 -1.14 -0.55 0.00 0.00 175.29 174.53 1moe s GLN 42 N -1.92 0.22 0.23 1.67 0.74 0.54 0.00 119.66 121.14 1moe s GLN 42 Ca 0.25 0.67 0.08 0.00 0.05 0.00 0.00 55.36 56.41 1moe s GLN 42 Cb -0.12 -0.05 -0.04 0.00 1.10 0.00 0.00 33.01 33.90 1moe s GLN 42 CO 0.17 -0.21 0.08 0.15 -0.55 0.00 0.00 175.29 174.93 1moe s LYS 43 N 1.75 2.59 0.01 1.67 1.02 -1.26 -1.13 119.74 124.39 1moe s LYS 43 Ca -0.05 -1.18 -0.36 0.00 0.02 0.00 0.00 55.97 54.40 1moe s LYS 43 Cb -0.11 -2.39 -0.14 0.00 -0.52 0.00 0.00 37.83 34.67 1moe s LYS 43 CO -0.09 0.41 1.62 -0.35 -0.92 0.00 0.00 175.35 176.01 1moe n PRO 44 N -0.79 1.74 0.00 -1.68 -0.04 -1.26 -1.95 135.00 131.02 1moe n PRO 44 Ca -0.08 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.01 1moe n PRO 44 Cb 0.57 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1moe n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1moe n GLY 45 N 3.56 3.06 3.85 0.55 0.00 -1.26 -5.04 105.19 109.92 1moe n GLY 45 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1moe n GLY 45 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1moe s GLN 46 N -0.29 3.09 1.06 1.61 -0.21 -0.82 -5.12 119.66 118.98 1moe s GLN 46 Ca 0.00 -0.80 -0.17 0.00 0.02 0.00 0.00 55.36 54.41 1moe s GLN 46 Cb 0.00 -2.74 0.23 0.00 1.00 0.00 0.00 33.01 31.49 1moe s GLN 46 CO 0.00 0.48 1.19 -1.25 -2.12 0.00 0.00 175.29 173.59 1moe s PRO 47 N -3.27 -0.12 0.53 2.91 0.04 -1.26 -4.45 135.00 129.38 1moe s PRO 47 Ca 0.32 -0.10 -0.21 0.00 0.04 0.00 0.00 61.00 61.06 1moe s PRO 47 Cb -0.10 -1.73 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 1moe s PRO 47 CO 0.25 -2.97 1.24 -2.14 0.04 0.00 0.00 177.00 173.42 1moe s PRO 48 N -5.53 3.29 -0.20 0.56 0.02 -1.26 -4.65 135.00 127.23 1moe s PRO 48 Ca 0.70 1.93 0.01 0.00 0.02 0.00 0.00 61.00 63.67 1moe s PRO 48 Cb -0.09 -2.19 0.04 0.00 0.02 0.00 0.00 34.50 32.29 1moe s PRO 48 CO 0.55 -0.98 -0.12 0.21 -0.33 0.00 0.00 177.00 176.33 1moe s LYS 49 N -2.99 2.21 0.21 5.54 2.20 0.10 -4.95 119.74 122.06 1moe s LYS 49 Ca 0.71 -0.92 -0.32 0.00 -0.36 0.00 0.00 55.97 55.08 1moe s LYS 49 Cb -0.33 -2.51 -0.13 0.00 -1.51 0.00 0.00 37.83 33.35 1moe s LYS 49 CO 0.38 -0.41 1.53 -0.11 -0.36 0.00 0.00 175.35 176.37 1moe n LEU 50 N 4.64 3.31 0.01 5.43 7.94 -1.26 -1.26 117.00 135.81 1moe n LEU 50 Ca -0.16 1.11 -0.03 0.00 -1.11 0.00 0.00 56.01 55.83 1moe n LEU 50 Cb 0.46 -1.46 -0.01 0.00 0.53 0.00 0.00 43.42 42.95 1moe n LEU 50 CO 0.21 -0.28 -0.24 0.18 -1.11 0.00 0.00 177.39 176.15 1moe n LEU 51 N 2.84 1.19 -4.08 -1.96 4.77 0.56 -4.88 117.00 115.45 1moe n LEU 51 Ca 0.14 0.17 -0.25 0.00 -0.03 0.00 0.00 56.01 56.04 1moe n LEU 51 Cb 0.31 -0.40 -0.16 0.00 -2.33 0.00 0.00 43.42 40.84 1moe n LEU 51 CO 0.63 -0.53 -0.48 -0.63 -1.33 0.00 0.00 177.39 175.05 1moe s ILE 52 N -2.20 1.26 0.09 -0.08 -1.09 -0.90 -1.35 121.20 116.92 1moe s ILE 52 Ca -0.07 -0.59 0.10 0.00 -2.23 0.00 0.00 60.65 57.86 1moe s ILE 52 Cb 0.01 -1.11 -0.04 0.00 -1.58 0.00 0.00 42.46 39.75 1moe s ILE 52 CO 0.10 0.37 -0.26 -0.72 -1.23 0.00 0.00 174.94 173.21 1moe s TYR 53 N 0.32 2.34 -1.11 3.97 -0.85 -0.38 -0.61 117.35 121.04 1moe s TYR 53 Ca -0.09 -0.38 -0.14 0.00 -0.52 0.00 0.00 57.07 55.95 1moe s TYR 53 Cb -0.13 -1.33 -0.03 0.00 0.38 0.00 0.00 41.96 40.85 1moe s TYR 53 CO 0.03 0.25 0.84 0.54 -1.52 0.00 0.00 175.55 175.69 1moe n ARG 54 N 1.29 -1.84 0.00 -3.49 1.74 -1.11 -1.31 116.66 111.94 1moe n ARG 54 Ca -0.17 0.63 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 1moe n ARG 54 Cb 0.52 -4.87 0.00 0.00 -1.02 0.00 0.00 32.46 27.09 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 -3.80 0.00 -2.57 7.54 0.00 0.79 -4.06 120.51 118.40 1moe n ALA 55 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.35 1moe n ALA 55 Cb 0.61 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.09 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 1.54 0.73 -4.36 0.00 3.41 -1.24 -2.43 113.62 111.27 1moe n SER 56 Ca 0.00 -2.03 -0.39 0.00 -0.26 0.00 0.00 58.87 56.19 1moe n SER 56 Cb 0.00 -0.20 -0.12 0.00 -0.26 0.00 0.00 64.21 63.63 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 -2.43 5.52 -0.03 4.04 0.02 -0.42 -4.69 114.94 116.94 1moe s ASN 57 Ca 0.25 -0.92 -0.30 0.00 -1.02 0.00 0.00 52.86 50.88 1moe s ASN 57 Cb 0.33 -1.96 -0.07 0.00 0.02 0.00 0.00 41.25 39.56 1moe s ASN 57 CO -0.10 -0.32 1.84 -0.22 0.02 0.00 0.00 177.10 178.32 1moe s LEU 58 N 1.52 4.28 0.29 0.60 2.96 -1.26 -1.25 118.68 125.82 1moe s LEU 58 Ca 0.02 2.37 -0.29 0.00 -0.22 0.00 0.00 54.13 56.01 1moe s LEU 58 Cb -0.19 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 1moe s LEU 58 CO 0.05 -1.08 1.28 -0.70 -1.32 0.00 0.00 176.35 174.57 1moe s GLU 59 N 4.45 4.41 -0.31 1.98 2.56 -0.46 -4.89 118.70 126.43 1moe s GLU 59 Ca 0.82 2.11 -0.42 0.00 0.00 0.00 0.00 54.97 57.49 1moe s GLU 59 Cb -0.37 -3.12 -0.17 0.00 2.00 0.00 0.00 34.13 32.47 1moe s GLU 59 CO 0.36 -0.14 1.69 0.45 -0.56 0.00 0.00 175.26 177.05 1moe n SER 60 N 1.35 2.05 0.00 -1.70 2.88 -1.26 -1.19 113.62 115.75 1moe n SER 60 Ca 0.01 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1moe n SER 60 Cb 0.42 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.81 1moe n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1moe n GLY 61 N 4.04 0.43 3.85 0.46 0.00 -1.26 -5.07 105.19 107.64 1moe n GLY 61 Ca 0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.16 4.90 0.46 -0.61 -1.09 -0.33 -5.05 121.20 117.33 1moe s ILE 62 Ca 0.00 0.74 -0.24 0.00 -2.23 0.00 0.00 60.65 58.92 1moe s ILE 62 Cb 0.00 -3.71 -0.07 0.00 -1.58 0.00 0.00 42.46 37.10 1moe s ILE 62 CO 0.00 0.22 1.30 -2.84 -1.23 0.00 0.00 174.94 172.39 1moe s PRO 63 N -2.04 3.65 0.66 2.79 0.02 -1.26 -4.90 135.00 133.92 1moe s PRO 63 Ca 0.38 2.11 0.43 0.00 0.02 0.00 0.00 61.00 63.95 1moe s PRO 63 Cb -0.14 -2.52 2.34 0.00 0.02 0.00 0.00 34.50 34.20 1moe s PRO 63 CO 0.19 -0.74 2.34 0.28 -0.33 0.00 0.00 177.00 178.75 1moe h VAL 64 N 2.01 0.03 0.00 3.83 2.07 -1.98 -2.44 116.25 119.76 1moe h VAL 64 Ca -0.50 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1moe h VAL 64 Cb 1.26 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1moe h VAL 64 CO 0.60 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 176.08 1moe n ARG 65 N -3.12 0.48 -3.82 1.57 1.85 -1.26 -4.58 116.66 107.78 1moe n ARG 65 Ca -0.03 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.46 1moe n ARG 65 Cb 0.09 -1.39 -0.12 0.00 -1.05 0.00 0.00 32.46 29.99 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 -2.00 3.14 -0.04 2.89 0.08 -0.92 -0.17 117.98 120.96 1moe s PHE 66 Ca 0.18 -0.22 0.04 0.00 0.12 0.00 0.00 56.93 57.06 1moe s PHE 66 Cb 0.08 -2.21 -0.00 0.00 -0.57 0.00 0.00 43.02 40.32 1moe s PHE 66 CO 0.14 -0.19 -0.17 -1.12 -0.10 0.00 0.00 175.22 173.78 1moe s SER 67 N 1.28 2.17 -0.00 1.36 0.01 0.23 -4.94 113.70 113.81 1moe s SER 67 Ca 0.05 -0.35 -0.03 0.00 1.31 0.00 0.00 55.95 56.93 1moe s SER 67 Cb -0.15 -0.58 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 1moe s SER 67 CO 0.04 0.16 0.20 -0.83 0.41 0.00 0.00 173.24 173.22 1moe s GLY 68 N 0.00 2.19 -0.04 3.44 0.00 -1.26 -0.05 107.32 111.60 1moe s GLY 68 Ca -0.03 -0.73 -0.26 0.00 0.00 0.00 0.00 44.72 43.69 1moe s GLY 68 CO 0.02 -0.61 0.57 -1.59 0.00 0.00 0.00 173.10 171.48 1moe s THR 69 N -1.33 0.02 0.00 0.90 2.01 0.42 -4.49 115.64 113.16 1moe s THR 69 Ca 0.28 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 62.14 1moe s THR 69 Cb -0.13 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.50 1moe s THR 69 CO 0.19 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 1moe n GLY 70 N 1.04 2.41 3.32 4.40 0.00 -1.26 0.58 105.19 115.68 1moe n GLY 70 Ca -0.20 -2.09 -0.14 0.00 0.00 0.00 0.00 46.02 43.59 1moe n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1moe s SER 71 N 0.00 -0.39 0.00 1.61 1.04 -0.79 -4.93 113.70 110.24 1moe s SER 71 Ca 0.00 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1moe s SER 71 Cb 0.00 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1moe s SER 71 CO 0.00 -0.31 0.00 -1.14 0.98 0.00 0.00 173.24 172.77 1moe n ARG 72 N 2.05 0.00 0.00 4.02 0.63 -1.26 -2.69 116.66 119.41 1moe n ARG 72 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 1moe n ARG 72 Cb 0.57 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.48 1moe n ARG 72 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1moe n THR 73 N 0.00 0.00 -4.05 5.15 -2.24 -1.26 -0.96 114.28 110.92 1moe n THR 73 Ca 0.00 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.41 1moe n THR 73 Cb 0.00 0.49 -0.15 0.00 -2.10 0.00 0.00 70.33 68.57 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 -0.26 3.65 0.04 3.42 -0.00 -1.09 0.03 116.67 122.45 1moe s ASP 74 Ca 0.00 -0.73 0.05 0.00 -0.00 0.00 0.00 52.55 51.87 1moe s ASP 74 Cb 0.00 -1.56 -0.02 0.00 -0.00 0.00 0.00 42.92 41.34 1moe s ASP 74 CO 0.00 -0.04 -0.14 -0.36 -0.00 0.00 0.00 175.17 174.63 1moe s PHE 75 N 1.30 1.18 0.02 4.23 0.40 -0.52 -1.88 117.98 122.72 1moe s PHE 75 Ca 0.03 -0.35 0.06 0.00 -0.60 0.00 0.00 56.93 56.07 1moe s PHE 75 Cb -0.15 -0.70 -0.02 0.00 0.51 0.00 0.00 43.02 42.66 1moe s PHE 75 CO -0.09 0.03 -0.17 0.99 0.70 0.00 0.00 175.22 176.67 1moe s THR 76 N -0.83 1.39 -0.13 0.64 2.01 0.20 -0.59 115.64 118.32 1moe s THR 76 Ca 0.01 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 61.03 1moe s THR 76 Cb -0.08 -1.20 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 1moe s THR 76 CO 0.01 0.21 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.82 1moe s LEU 77 N -0.89 2.86 -0.11 4.42 2.96 0.39 -0.44 118.68 127.87 1moe s LEU 77 Ca 0.05 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.73 1moe s LEU 77 Cb -0.08 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.97 1moe s LEU 77 CO 0.01 0.18 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.39 1moe s ILE 78 N 0.26 1.79 -0.23 6.68 1.01 0.93 -1.55 121.20 130.10 1moe s ILE 78 Ca -0.08 -0.84 -0.00 0.00 0.00 0.00 0.00 60.65 59.73 1moe s ILE 78 Cb -0.15 -1.59 0.03 0.00 0.01 0.00 0.00 42.46 40.76 1moe s ILE 78 CO 0.05 0.50 -0.11 -0.63 0.00 0.00 0.00 174.94 174.75 1moe s ILE 79 N 0.68 2.58 -0.23 2.92 1.01 -0.10 0.74 121.20 128.79 1moe s ILE 79 Ca -0.12 -1.06 -0.05 0.00 0.00 0.00 0.00 60.65 59.42 1moe s ILE 79 Cb -0.16 -2.27 0.12 0.00 0.01 0.00 0.00 42.46 40.15 1moe s ILE 79 CO 0.03 0.27 0.45 -0.62 0.00 0.00 0.00 174.94 175.07 1moe s ASP 80 N 1.29 -0.32 0.32 3.58 -1.08 0.76 -1.11 116.67 120.12 1moe s ASP 80 Ca 0.01 0.83 -0.11 0.00 -0.52 0.00 0.00 52.55 52.75 1moe s ASP 80 Cb -0.16 1.46 -0.07 0.00 -1.46 0.00 0.00 42.92 42.69 1moe s ASP 80 CO -0.07 -0.25 0.68 -2.16 0.52 0.00 0.00 175.17 173.89 1moe s PRO 81 N 2.65 3.85 0.13 4.34 0.04 -1.26 -4.55 135.00 140.19 1moe s PRO 81 Ca 0.04 0.44 -0.31 0.00 0.04 0.00 0.00 61.00 61.21 1moe s PRO 81 Cb -0.13 -2.50 -0.08 0.00 0.04 0.00 0.00 34.50 31.83 1moe s PRO 81 CO -0.15 0.15 1.28 0.08 0.04 0.00 0.00 177.00 178.41 1moe s VAL 82 N -2.06 3.52 0.23 -0.36 1.01 -0.66 -4.78 120.40 117.31 1moe s VAL 82 Ca 0.50 1.16 0.09 0.00 0.00 0.00 0.00 61.98 63.74 1moe s VAL 82 Cb -0.11 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1moe s VAL 82 CO 0.24 0.13 -0.06 -1.61 0.00 0.00 0.00 175.10 173.80 1moe s GLU 83 N 0.56 2.16 0.56 2.72 8.01 -1.26 -0.51 118.70 130.94 1moe s GLU 83 Ca 0.59 -1.37 0.29 0.00 0.01 0.00 0.00 54.97 54.49 1moe s GLU 83 Cb -0.34 -2.14 1.64 0.00 -4.31 0.00 0.00 34.13 28.98 1moe s GLU 83 CO 0.33 0.39 2.16 0.00 0.01 0.00 0.00 175.26 178.16 1moe h ALA 84 N 2.36 1.38 0.00 5.21 0.00 -2.00 -1.15 119.26 125.06 1moe h ALA 84 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1moe h ALA 84 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1moe h ALA 84 CO 0.58 0.08 0.00 -3.47 0.00 0.00 0.00 179.25 176.44 1moe n ASP 85 N -3.72 0.23 0.03 0.00 2.03 -1.26 -2.64 116.55 111.22 1moe n ASP 85 Ca -0.02 0.57 0.13 0.00 0.52 0.00 0.00 54.79 55.98 1moe n ASP 85 Cb 0.16 -0.61 0.39 0.00 -0.72 0.00 0.00 41.12 40.34 1moe n ASP 85 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1moe n ASP 86 N -1.76 0.41 -4.64 1.67 8.00 -0.44 -4.85 116.55 114.94 1moe n ASP 86 Ca 0.02 0.22 -0.42 0.00 0.71 0.00 0.00 54.79 55.31 1moe n ASP 86 Cb 0.14 -0.20 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 1moe n ASP 86 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1moe s VAL 87 N -3.05 3.16 -0.29 2.53 1.01 -1.08 -4.82 120.40 117.86 1moe s VAL 87 Ca 0.11 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1moe s VAL 87 Cb 0.16 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.40 1moe s VAL 87 CO 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 175.10 175.69 1moe n ALA 88 N 8.49 0.00 -2.98 5.51 0.00 -1.10 -4.91 120.51 125.52 1moe n ALA 88 Ca 0.22 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.33 1moe n ALA 88 Cb 0.43 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 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 -3.00 2.93 -0.13 0.00 2.01 -0.28 -1.60 115.64 115.57 1moe s THR 89 Ca 0.00 -0.72 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 1moe s THR 89 Cb 0.00 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 1moe s THR 89 CO 0.00 0.54 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.11 1moe s TYR 90 N 0.15 3.01 0.19 4.92 1.51 0.24 -0.34 117.35 127.03 1moe s TYR 90 Ca -0.08 -0.21 0.11 0.00 -1.01 0.00 0.00 57.07 55.88 1moe s TYR 90 Cb -0.15 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 1moe s TYR 90 CO 0.05 0.07 -0.19 0.71 -1.11 0.00 0.00 175.55 175.08 1moe s TYR 91 N 0.01 2.41 -0.01 2.71 1.51 0.98 -1.33 117.35 123.62 1moe s TYR 91 Ca 0.00 -0.31 0.08 0.00 -1.01 0.00 0.00 57.07 55.82 1moe s TYR 91 Cb -0.13 -1.18 -0.02 0.00 -0.11 0.00 0.00 41.96 40.51 1moe s TYR 91 CO 0.03 0.51 -0.24 0.00 -1.11 0.00 0.00 175.55 174.74 1moe s GLN 93 N -0.63 0.82 -0.08 0.00 0.74 0.10 -0.47 119.66 120.14 1moe s GLN 93 Ca 0.09 -0.65 0.04 0.00 0.05 0.00 0.00 55.36 54.90 1moe s GLN 93 Cb -0.09 -0.78 -0.01 0.00 1.10 0.00 0.00 33.01 33.22 1moe s GLN 93 CO -0.01 0.20 -0.20 1.14 -0.55 0.00 0.00 175.29 175.87 1moe s GLN 94 N -0.97 2.78 -0.50 1.67 1.03 -0.75 0.70 119.66 123.62 1moe s GLN 94 Ca 0.00 -0.81 0.07 0.00 0.04 0.00 0.00 55.36 54.66 1moe s GLN 94 Cb -0.07 -2.33 0.37 0.00 0.03 0.00 0.00 33.01 31.02 1moe s GLN 94 CO 0.01 0.38 0.98 0.25 -2.54 0.00 0.00 175.29 174.36 1moe n THR 95 N 3.00 2.36 -0.01 3.63 -2.24 -0.75 -3.74 114.28 116.53 1moe n THR 95 Ca -0.18 -5.11 0.04 0.00 -2.27 0.00 0.00 64.05 56.54 1moe n THR 95 Cb 0.52 -1.09 -0.13 0.00 -2.10 0.00 0.00 70.33 67.53 1moe n THR 95 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1moe n ASN 96 N -0.25 0.27 -3.56 3.42 2.85 -1.26 -4.93 115.26 111.81 1moe n ASN 96 Ca 0.31 0.11 -0.10 0.00 -0.11 0.00 0.00 54.58 54.80 1moe n ASN 96 Cb 0.53 1.23 -0.04 0.00 1.24 0.00 0.00 39.78 42.74 1moe n ASN 96 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 1moe s GLU 97 N -3.16 0.66 0.12 1.20 -1.05 -1.26 -5.10 118.70 110.10 1moe s GLU 97 Ca -0.07 0.04 -0.16 0.00 -0.15 0.00 0.00 54.97 54.63 1moe s GLU 97 Cb 0.11 0.31 -0.07 0.00 -0.44 0.00 0.00 34.13 34.03 1moe s GLU 97 CO 0.86 -0.23 0.56 0.16 0.95 0.00 0.00 175.26 177.56 1moe s ASP 98 N -1.47 6.93 0.32 0.83 1.47 -1.26 -3.63 116.67 119.86 1moe s ASP 98 Ca -0.00 1.16 -0.28 0.00 1.18 0.00 0.00 52.55 54.61 1moe s ASP 98 Cb -0.01 -2.32 -0.10 0.00 -0.34 0.00 0.00 42.92 40.16 1moe s ASP 98 CO -0.01 0.17 1.17 -2.16 0.68 0.00 0.00 175.17 175.03 1moe s PRO 99 N -1.61 4.44 -1.24 2.11 0.04 -1.26 -5.06 135.00 132.43 1moe s PRO 99 Ca 0.34 1.92 -0.19 0.00 0.04 0.00 0.00 61.00 63.11 1moe s PRO 99 Cb -0.17 -3.05 -0.00 0.00 0.04 0.00 0.00 34.50 31.32 1moe s PRO 99 CO 0.19 -0.01 1.88 0.66 0.04 0.00 0.00 177.00 179.76 1moe n TYR 100 N 0.84 3.68 -0.81 0.56 0.53 -1.24 -4.78 117.16 115.95 1moe n TYR 100 Ca 0.00 -2.35 -0.32 0.00 -1.02 0.00 0.00 57.90 54.21 1moe n TYR 100 Cb 0.44 -2.54 0.15 0.00 -1.03 0.00 0.00 39.34 36.36 1moe n TYR 100 CO 0.00 0.00 0.00 0.25 -1.02 0.00 0.00 176.86 176.09 1moe n THR 101 N 6.61 0.48 -4.33 -0.72 -2.24 -1.25 -4.68 114.28 108.15 1moe n THR 101 Ca 0.48 -0.10 -0.18 0.00 -2.27 0.00 0.00 64.05 61.98 1moe n THR 101 Cb 0.45 -0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 67.63 1moe n THR 101 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1moe s PHE 102 N -2.46 1.67 0.63 4.78 0.40 -1.26 -1.82 117.98 119.93 1moe s PHE 102 Ca 0.66 -0.58 -0.00 0.00 -0.60 0.00 0.00 56.93 56.41 1moe s PHE 102 Cb -0.24 -0.79 0.07 0.00 0.51 0.00 0.00 43.02 42.57 1moe s PHE 102 CO 0.59 0.33 0.89 0.20 0.70 0.00 0.00 175.22 177.92 1moe s GLY 103 N -3.21 1.79 0.50 4.36 0.00 0.38 -4.52 107.32 106.62 1moe s GLY 103 Ca 0.21 -1.47 0.28 0.00 0.00 0.00 0.00 44.72 43.74 1moe s GLY 103 CO 0.06 -1.06 1.97 -1.33 0.00 0.00 0.00 173.10 172.75 1moe h GLY 104 N -0.23 0.00 0.00 0.20 0.00 -1.90 -3.44 103.07 97.71 1moe h GLY 104 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1moe h GLY 104 CO 0.48 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.63 1moe n GLY 105 N -0.22 -0.38 3.27 4.60 0.00 -1.26 -5.03 105.19 106.16 1moe n GLY 105 Ca -0.01 -1.50 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 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 -2.86 1.82 -0.28 2.61 2.01 -0.45 -4.78 115.64 113.72 1moe s THR 106 Ca 0.00 -1.05 -0.08 0.00 0.31 0.00 0.00 61.69 60.87 1moe s THR 106 Cb 0.00 -1.53 -0.01 0.00 0.01 0.00 0.00 72.50 70.97 1moe s THR 106 CO 0.00 0.46 0.10 -0.54 -0.69 0.00 0.00 174.62 173.94 1moe s LYS 107 N -0.70 3.36 -0.01 4.92 1.02 -0.93 -0.59 119.74 126.81 1moe s LYS 107 Ca 0.09 -0.68 -0.02 0.00 0.02 0.00 0.00 55.97 55.37 1moe s LYS 107 Cb -0.09 -3.41 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 1moe s LYS 107 CO -0.00 -0.35 0.17 -1.17 -0.92 0.00 0.00 175.35 173.09 1moe s LEU 108 N 1.57 4.33 -0.24 3.17 0.20 -0.63 -1.29 118.68 125.79 1moe s LEU 108 Ca 0.05 0.33 -0.24 0.00 0.69 0.00 0.00 54.13 54.95 1moe s LEU 108 Cb -0.16 -2.59 0.07 0.00 -0.43 0.00 0.00 46.19 43.07 1moe s LEU 108 CO 0.04 0.26 0.68 -1.83 -0.29 0.00 0.00 176.35 175.21 1moe s GLU 109 N -1.94 0.82 0.38 1.98 -1.05 -1.09 -2.72 118.70 115.07 1moe s GLU 109 Ca 0.27 0.90 -0.27 0.00 -0.15 0.00 0.00 54.97 55.72 1moe s GLU 109 Cb -0.13 0.40 -0.10 0.00 -0.44 0.00 0.00 34.13 33.87 1moe s GLU 109 CO 0.19 -0.11 1.36 0.42 0.95 0.00 0.00 175.26 178.06 1moe s ILE 110 N 0.25 2.45 0.26 1.83 -1.09 -1.26 -1.86 121.20 121.78 1moe s ILE 110 Ca -0.01 0.43 0.09 0.00 -2.23 0.00 0.00 60.65 58.94 1moe s ILE 110 Cb -0.04 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.53 1moe s ILE 110 CO 0.02 0.09 -0.02 -1.59 -1.23 0.00 0.00 174.94 172.20 1moe s LYS 111 N -2.09 2.26 -0.67 2.79 -2.85 -0.49 -4.75 119.74 113.94 1moe s LYS 111 Ca 0.54 -1.40 -0.34 0.00 -1.00 0.00 0.00 55.97 53.77 1moe s LYS 111 Cb -0.41 -2.16 -0.17 0.00 -2.06 0.00 0.00 37.83 33.04 1moe s LYS 111 CO 0.54 0.37 2.43 0.41 0.10 0.00 0.00 175.35 179.20 1moe n GLY 112 N -0.77 -0.09 3.11 0.59 0.00 -1.26 -4.34 105.19 102.42 1moe n GLY 112 Ca -0.07 1.02 -0.33 0.00 0.00 0.00 0.00 46.02 46.64 1moe n GLY 112 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1moe s GLY 113 N 8.57 1.42 0.00 -0.02 0.00 -1.26 -4.88 107.32 111.14 1moe s GLY 113 Ca 1.21 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 44.64 1moe s GLY 113 CO 0.49 0.34 0.33 0.61 0.00 0.00 0.00 173.10 174.86 1moe n GLY 114 N 4.60 0.51 0.00 0.20 0.00 -1.26 -4.75 105.19 104.48 1moe n GLY 114 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1moe n GLY 114 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1moe n SER 115 N 0.07 0.00 0.00 1.61 7.64 -1.26 -5.11 113.62 116.57 1moe n SER 115 Ca 0.00 -0.89 0.00 0.00 1.01 0.00 0.00 58.87 58.99 1moe n SER 115 Cb 0.10 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1moe n SER 115 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1moe n GLY 116 N 0.00 -0.74 2.75 0.23 0.00 -1.24 -4.30 105.19 101.88 1moe n GLY 116 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1moe n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1moe n GLY 117 N 0.00 0.00 2.25 -0.02 0.00 -1.26 -4.54 105.19 101.62 1moe n GLY 117 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1moe n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1moe n GLY 118 N 1.88 0.78 3.73 -0.02 0.00 -1.26 -5.02 105.19 105.28 1moe n GLY 118 Ca 0.00 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1moe n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1moe n GLY 119 N -0.90 1.37 3.54 -0.02 0.00 -1.26 -4.96 105.19 102.96 1moe n GLY 119 Ca -0.11 0.52 -0.29 0.00 0.00 0.00 0.00 46.02 46.13 1moe n GLY 119 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1moe n GLU 120 N 2.74 -1.72 -2.41 1.61 0.28 -1.26 -4.37 120.64 115.52 1moe n GLU 120 Ca 0.11 -0.46 -0.43 0.00 -0.16 0.00 0.00 57.16 56.23 1moe n GLU 120 Cb 0.36 -2.23 -0.02 0.00 1.43 0.00 0.00 31.44 30.97 1moe n GLU 120 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1moe s VAL 121 N -2.49 4.01 -0.01 3.84 1.01 -1.26 -4.14 120.40 121.36 1moe s VAL 121 Ca 0.68 1.06 0.05 0.00 0.00 0.00 0.00 61.98 63.77 1moe s VAL 121 Cb -0.24 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.86 1moe s VAL 121 CO 0.63 -0.73 -0.17 0.00 0.00 0.00 0.00 175.10 174.83 1moe s GLN 122 N 4.67 1.39 -0.21 2.72 -2.07 -0.17 -5.00 119.66 120.99 1moe s GLN 122 Ca 0.58 -0.61 -0.04 0.00 -1.82 0.00 0.00 55.36 53.47 1moe s GLN 122 Cb -0.13 -1.34 -0.01 0.00 -1.09 0.00 0.00 33.01 30.43 1moe s GLN 122 CO 0.30 0.37 -0.03 -0.51 -1.32 0.00 0.00 175.29 174.09 1moe s LEU 123 N -0.40 2.97 -0.22 2.60 2.01 -1.26 -2.34 118.68 122.04 1moe s LEU 123 Ca 0.06 -0.35 0.01 0.00 0.01 0.00 0.00 54.13 53.86 1moe s LEU 123 Cb -0.07 -1.75 0.03 0.00 0.01 0.00 0.00 46.19 44.41 1moe s LEU 123 CO -0.01 0.00 -0.13 -1.58 1.01 0.00 0.00 176.35 175.64 1moe s GLN 124 N 1.36 2.77 0.13 1.70 2.00 0.91 -4.06 119.66 124.46 1moe s GLN 124 Ca 0.04 -1.00 0.04 0.00 -2.00 0.00 0.00 55.36 52.45 1moe s GLN 124 Cb -0.14 -2.79 -0.04 0.00 0.80 0.00 0.00 33.01 30.84 1moe s GLN 124 CO -0.02 -0.36 0.09 -0.65 -0.50 0.00 0.00 175.29 173.85 1moe s GLN 125 N 1.26 2.80 1.12 1.67 -0.21 -1.26 0.54 119.66 125.59 1moe s GLN 125 Ca 0.00 -0.82 -0.18 0.00 0.02 0.00 0.00 55.36 54.38 1moe s GLN 125 Cb -0.16 -2.64 0.14 0.00 1.00 0.00 0.00 33.01 31.35 1moe s GLN 125 CO -0.08 0.52 0.12 -1.13 -2.12 0.00 0.00 175.29 172.60 1moe n SER 126 N 0.08 -2.58 -4.90 5.90 3.41 -1.08 -4.94 113.62 109.50 1moe n SER 126 Ca -0.09 -0.23 -0.29 0.00 -0.26 0.00 0.00 58.87 58.00 1moe n SER 126 Cb 0.53 -0.92 0.06 0.00 -0.26 0.00 0.00 64.21 63.62 1moe n SER 126 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1moe s GLY 127 N -1.94 1.62 0.35 5.00 0.00 -1.26 -4.67 107.32 106.42 1moe s GLY 127 Ca 0.53 -0.53 -0.26 0.00 0.00 0.00 0.00 44.72 44.47 1moe s GLY 127 CO 0.59 -0.14 0.86 0.00 0.00 0.00 0.00 173.10 174.41 1moe n ALA 128 N -3.00 -0.62 -3.19 3.20 0.00 -1.26 -4.78 120.51 110.86 1moe n ALA 128 Ca 0.07 0.29 -0.32 0.00 0.00 0.00 0.00 53.44 53.48 1moe n ALA 128 Cb 0.58 -1.95 -0.17 0.00 0.00 0.00 0.00 19.45 17.92 1moe n ALA 128 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1moe s GLU 129 N -1.65 2.92 -0.21 0.00 0.41 -0.09 -5.00 118.70 115.08 1moe s GLU 129 Ca 0.61 -0.86 0.00 0.00 -0.41 0.00 0.00 54.97 54.32 1moe s GLU 129 Cb -0.65 -2.23 0.05 0.00 -1.78 0.00 0.00 34.13 29.51 1moe s GLU 129 CO 0.58 0.19 -0.07 -0.51 -0.49 0.00 0.00 175.26 174.97 1moe s LEU 130 N 0.31 2.22 0.00 1.80 1.43 -1.26 0.10 118.68 123.28 1moe s LEU 130 Ca -0.17 -0.95 0.06 0.00 -1.03 0.00 0.00 54.13 52.03 1moe s LEU 130 Cb -0.17 -1.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.90 1moe s LEU 130 CO 0.08 -0.20 0.20 1.33 0.23 0.00 0.00 176.35 178.00 1moe n VAL 131 N 4.73 0.00 -3.73 -1.59 0.24 -0.31 -5.00 118.33 112.67 1moe n VAL 131 Ca -0.13 -2.43 -0.30 0.00 -2.04 0.00 0.00 64.34 59.44 1moe n VAL 131 Cb 0.46 1.01 -0.04 0.00 -1.47 0.00 0.00 33.84 33.80 1moe n VAL 131 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1moe s GLU 132 N -3.50 3.54 0.27 7.34 -1.05 -1.26 -3.28 118.70 120.77 1moe s GLU 132 Ca 0.28 -0.26 -0.30 0.00 -0.15 0.00 0.00 54.97 54.54 1moe s GLU 132 Cb 0.01 -2.88 -0.11 0.00 -0.44 0.00 0.00 34.13 30.71 1moe s GLU 132 CO 0.20 0.47 1.54 -1.25 0.95 0.00 0.00 175.26 177.17 1moe s PRO 133 N -2.89 4.18 0.00 -4.83 0.04 -1.26 -1.71 135.00 128.53 1moe s PRO 133 Ca 0.39 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.90 1moe s PRO 133 Cb -0.12 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.36 1moe s PRO 133 CO 0.27 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.16 1moe n GLY 134 N 2.27 2.26 3.75 0.56 0.00 -0.74 -4.88 105.19 108.40 1moe n GLY 134 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.42 1.98 -0.19 4.61 0.00 -0.69 -3.34 121.76 121.70 1moe s ALA 135 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1moe s ALA 135 Cb 0.00 -3.26 0.04 0.00 0.00 0.00 0.00 23.12 19.91 1moe s ALA 135 CO 0.00 -2.01 -0.08 -1.54 0.00 0.00 0.00 175.76 172.12 1moe s SER 136 N -3.36 3.28 0.67 0.00 1.04 -1.26 0.39 113.70 114.47 1moe s SER 136 Ca 0.62 -0.85 -0.02 0.00 0.48 0.00 0.00 55.95 56.18 1moe s SER 136 Cb -0.18 -1.14 0.09 0.00 0.10 0.00 0.00 66.02 64.89 1moe s SER 136 CO 0.56 -0.17 0.94 0.68 0.98 0.00 0.00 173.24 176.24 1moe s VAL 137 N 1.46 2.33 -0.16 5.02 -7.23 -0.88 -4.93 120.40 116.01 1moe s VAL 137 Ca -0.01 -0.52 -0.05 0.00 -1.81 0.00 0.00 61.98 59.59 1moe s VAL 137 Cb -0.16 -2.81 0.08 0.00 0.56 0.00 0.00 36.38 34.04 1moe s VAL 137 CO -0.08 0.00 0.29 -0.75 -0.31 0.00 0.00 175.10 174.25 1moe s LYS 138 N -5.08 0.19 0.19 4.82 2.20 -1.26 -2.72 119.74 118.09 1moe s LYS 138 Ca 0.62 0.70 -0.01 0.00 -0.36 0.00 0.00 55.97 56.93 1moe s LYS 138 Cb -0.08 -0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.03 1moe s LYS 138 CO 0.43 -0.36 0.38 -0.51 -0.36 0.00 0.00 175.35 174.93 1moe s LEU 139 N 2.44 4.24 0.25 5.43 1.43 -0.22 -4.95 118.68 127.31 1moe s LEU 139 Ca 0.03 0.39 0.10 0.00 -1.03 0.00 0.00 54.13 53.62 1moe s LEU 139 Cb -0.13 -3.16 -0.05 0.00 0.03 0.00 0.00 46.19 42.89 1moe s LEU 139 CO -0.10 -0.03 -0.18 -0.94 0.23 0.00 0.00 176.35 175.33 1moe s SER 140 N -3.11 3.20 -0.24 2.29 1.04 -1.26 -1.68 113.70 113.94 1moe s SER 140 Ca 0.38 -1.02 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 1moe s SER 140 Cb -0.11 -0.24 0.11 0.00 0.10 0.00 0.00 66.02 65.89 1moe s SER 140 CO 0.29 -0.04 0.27 0.00 0.98 0.00 0.00 173.24 174.74 1moe s THR 142 N 2.37 4.71 0.36 0.00 2.01 0.19 -1.18 115.64 124.10 1moe s THR 142 Ca 0.09 -0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.08 1moe s THR 142 Cb -0.15 -3.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.13 1moe s THR 142 CO -0.20 0.31 0.54 0.00 -0.69 0.00 0.00 174.62 174.58 1moe s ALA 143 N 1.62 3.94 -0.28 7.40 0.00 -1.12 -0.06 121.76 133.26 1moe s ALA 143 Ca 0.06 -1.20 -0.20 0.00 0.00 0.00 0.00 51.96 50.63 1moe s ALA 143 Cb -0.15 -1.92 0.13 0.00 0.00 0.00 0.00 23.12 21.18 1moe s ALA 143 CO 0.06 -0.11 0.96 -1.54 0.00 0.00 0.00 175.76 175.13 1moe s SER 144 N -4.14 -0.54 0.00 0.00 1.04 -0.99 -4.90 113.70 104.18 1moe s SER 144 Ca 0.44 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.79 1moe s SER 144 Cb -0.10 1.10 0.00 0.00 0.10 0.00 0.00 66.02 67.12 1moe s SER 144 CO 0.34 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 175.02 1moe n GLY 145 N 3.13 1.40 3.51 7.32 0.00 -1.26 -1.00 105.19 118.30 1moe n GLY 145 Ca -0.16 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 -2.07 -0.42 -0.25 1.61 -0.71 -1.26 -4.68 117.98 110.19 1moe s PHE 146 Ca 0.00 0.46 -0.17 0.00 -1.04 0.00 0.00 56.93 56.18 1moe s PHE 146 Cb 0.00 0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 1moe s PHE 146 CO 0.00 -0.54 0.49 -0.80 -1.34 0.00 0.00 175.22 173.02 1moe s ASN 147 N -1.99 6.41 0.00 1.98 0.01 -1.26 -4.90 114.94 115.20 1moe s ASN 147 Ca 0.00 0.50 0.01 0.00 -0.71 0.00 0.00 52.86 52.66 1moe s ASN 147 Cb -0.01 -2.27 0.06 0.00 0.41 0.00 0.00 41.25 39.45 1moe s ASN 147 CO -0.04 -0.25 0.51 2.30 -1.51 0.00 0.00 177.10 178.11 1moe n ILE 148 N 5.05 0.00 0.42 0.60 -5.35 -1.26 -1.72 119.36 117.11 1moe n ILE 148 Ca -0.05 0.00 0.12 0.00 -0.27 0.00 0.00 62.75 62.55 1moe n ILE 148 Cb 0.50 -0.93 0.26 0.00 -1.74 0.00 0.00 39.64 37.73 1moe n ILE 148 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1moe h LYS 149 N 0.00 0.00 -0.68 6.28 3.64 -1.90 -3.34 116.57 120.57 1moe h LYS 149 Ca 0.00 0.00 -0.42 0.00 -1.27 0.00 0.00 60.65 58.96 1moe h LYS 149 Cb 0.00 0.00 -0.24 0.00 -0.41 0.00 0.00 32.23 31.58 1moe h LYS 149 CO 0.00 0.00 0.13 -0.25 -2.27 0.00 0.00 179.45 177.06 1moe n ASP 150 N -2.62 4.23 -2.34 4.20 9.92 -0.70 -4.31 116.55 124.94 1moe n ASP 150 Ca 0.04 -3.76 -0.01 0.00 -0.53 0.00 0.00 54.79 50.53 1moe n ASP 150 Cb 0.48 -0.70 0.01 0.00 -0.64 0.00 0.00 41.12 40.27 1moe n ASP 150 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1moe n THR 151 N -1.02 0.00 -4.08 -3.53 5.66 -1.25 -2.37 114.28 107.69 1moe n THR 151 Ca 0.46 -0.31 -0.35 0.00 -3.05 0.00 0.00 64.05 60.80 1moe n THR 151 Cb 1.06 0.44 -0.09 0.00 -1.55 0.00 0.00 70.33 70.20 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 -3.68 3.33 -0.25 1.09 4.12 -1.25 -4.28 117.35 116.42 1moe s TYR 152 Ca 0.13 0.25 -0.11 0.00 0.02 0.00 0.00 57.07 57.36 1moe s TYR 152 Cb -0.02 -1.95 -0.05 0.00 -1.52 0.00 0.00 41.96 38.43 1moe s TYR 152 CO 0.03 0.43 0.18 -1.64 0.02 0.00 0.00 175.55 174.57 1moe s MET 153 N -0.44 4.04 0.18 -0.62 -1.94 -0.61 -1.34 119.30 118.57 1moe s MET 153 Ca 0.10 -0.26 0.08 0.00 -1.71 0.00 0.00 55.69 53.89 1moe s MET 153 Cb -0.12 -3.58 -0.04 0.00 2.01 0.00 0.00 34.83 33.10 1moe s MET 153 CO 0.02 -0.02 -0.01 -1.01 -0.01 0.00 0.00 175.02 173.99 1moe s HIS 154 N 1.28 2.81 -0.04 -0.03 0.09 -0.72 -1.92 115.29 116.76 1moe s HIS 154 Ca 0.08 -0.15 0.06 0.00 -0.00 0.00 0.00 55.06 55.04 1moe s HIS 154 Cb -0.14 -1.35 -0.01 0.00 -0.00 0.00 0.00 32.58 31.08 1moe s HIS 154 CO 0.07 0.53 -0.21 -1.58 -0.00 0.00 0.00 174.74 173.54 1moe s TRP 155 N -1.78 2.02 -0.05 1.40 0.52 -0.89 -0.48 118.94 119.69 1moe s TRP 155 Ca 0.27 -0.52 0.03 0.00 0.02 0.00 0.00 56.10 55.90 1moe s TRP 155 Cb -0.09 -1.33 0.00 0.00 -1.15 0.00 0.00 33.47 30.90 1moe s TRP 155 CO 0.18 -0.14 -0.14 0.08 0.02 0.00 0.00 176.95 176.96 1moe s VAL 156 N -0.21 1.18 -0.15 4.03 1.01 0.26 -1.51 120.40 125.01 1moe s VAL 156 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 1moe s VAL 156 Cb -0.11 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 1moe s VAL 156 CO 0.02 0.35 -0.04 -0.75 0.00 0.00 0.00 175.10 174.68 1moe s LYS 157 N 0.26 3.63 -0.34 2.72 2.20 -0.06 -0.84 119.74 127.30 1moe s LYS 157 Ca -0.07 -0.53 -0.00 0.00 -0.36 0.00 0.00 55.97 55.02 1moe s LYS 157 Cb -0.12 -2.89 0.11 0.00 -1.51 0.00 0.00 37.83 33.42 1moe s LYS 157 CO 0.02 0.26 0.13 -1.14 -0.36 0.00 0.00 175.35 174.26 1moe s GLN 158 N 0.30 0.84 0.80 4.03 0.74 0.05 0.93 119.66 127.34 1moe s GLN 158 Ca -0.04 -1.29 -0.12 0.00 0.05 0.00 0.00 55.36 53.96 1moe s GLN 158 Cb -0.14 -2.06 0.08 0.00 1.10 0.00 0.00 33.01 31.98 1moe s GLN 158 CO 0.03 -1.03 1.13 1.03 -0.55 0.00 0.00 175.29 175.91 1moe s ARG 159 N 1.33 1.89 -0.48 1.67 0.52 -1.26 -1.61 118.95 121.00 1moe s ARG 159 Ca 0.12 1.44 -0.44 0.00 -0.52 0.00 0.00 55.73 56.32 1moe s ARG 159 Cb -0.19 -1.84 -0.19 0.00 0.52 0.00 0.00 34.95 33.26 1moe s ARG 159 CO -0.19 -1.96 1.96 -2.30 0.02 0.00 0.00 175.30 172.83 1moe n PRO 160 N -3.46 0.10 -3.52 3.54 -0.02 -1.26 -1.50 135.00 128.88 1moe n PRO 160 Ca 0.11 0.03 -0.19 0.00 -2.02 0.00 0.00 63.50 61.44 1moe n PRO 160 Cb 0.52 -1.57 0.07 0.00 -0.02 0.00 0.00 33.50 32.50 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 6.35 -6.08 -3.77 -0.52 -0.58 -1.26 -5.00 120.64 109.77 1moe n GLU 161 Ca 0.46 0.77 -0.14 0.00 -0.42 0.00 0.00 57.16 57.83 1moe n GLU 161 Cb -0.03 -5.64 -0.03 0.00 -0.57 0.00 0.00 31.44 25.17 1moe n GLU 161 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1moe n GLN 162 N -4.20 0.59 0.00 3.49 6.02 -0.56 -5.17 117.38 117.55 1moe n GLN 162 Ca -0.29 -2.58 0.00 0.00 -0.01 0.00 0.00 57.00 54.12 1moe n GLN 162 Cb 0.67 2.42 0.00 0.00 1.02 0.00 0.00 30.24 34.35 1moe n GLN 162 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1moe n GLY 163 N -0.53 -3.42 3.33 1.08 0.00 -1.26 -4.69 105.19 99.70 1moe n GLY 163 Ca 0.02 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1moe n GLY 163 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1moe s LEU 164 N 0.00 2.23 -0.27 0.99 2.01 -1.26 -4.17 118.68 118.21 1moe s LEU 164 Ca 0.00 -0.43 -0.01 0.00 0.01 0.00 0.00 54.13 53.71 1moe s LEU 164 Cb 0.00 -1.41 0.04 0.00 0.01 0.00 0.00 46.19 44.83 1moe s LEU 164 CO 0.00 0.29 -0.05 -1.61 1.01 0.00 0.00 176.35 175.98 1moe s GLU 165 N -0.40 2.61 -0.09 1.70 2.02 0.26 -4.91 118.70 119.90 1moe s GLU 165 Ca 0.04 -1.13 -0.29 0.00 0.02 0.00 0.00 54.97 53.60 1moe s GLU 165 Cb -0.12 -3.02 -0.05 0.00 0.10 0.00 0.00 34.13 31.04 1moe s GLU 165 CO 0.02 -0.50 1.66 -0.46 0.02 0.00 0.00 175.26 176.00 1moe s TRP 166 N 1.26 1.98 -0.17 1.61 -0.00 -1.26 -0.89 118.94 121.48 1moe s TRP 166 Ca -0.03 0.27 -0.20 0.00 -0.00 0.00 0.00 56.10 56.13 1moe s TRP 166 Cb -0.18 -3.92 -0.22 0.00 -0.00 0.00 0.00 33.47 29.14 1moe s TRP 166 CO -0.04 -3.69 0.38 0.82 -0.00 0.00 0.00 176.95 174.42 1moe h ILE 167 N 5.71 1.04 0.00 5.86 2.04 -1.65 -3.43 117.51 127.08 1moe h ILE 167 Ca -0.38 -2.26 0.00 0.00 1.00 0.00 0.00 64.86 63.22 1moe h ILE 167 Cb 1.17 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 39.77 1moe h ILE 167 CO 0.96 0.48 0.00 0.61 0.00 0.00 0.00 178.15 180.20 1moe n GLY 168 N 1.57 -1.76 3.17 5.37 0.00 -1.24 -0.46 105.19 111.82 1moe n GLY 168 Ca -0.27 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 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 0.97 -0.03 1.61 1.70 0.73 -2.09 118.95 120.16 1moe s ARG 169 Ca 0.00 -1.46 -0.06 0.00 -0.47 0.00 0.00 55.73 53.74 1moe s ARG 169 Cb 0.00 0.13 0.01 0.00 -0.57 0.00 0.00 34.95 34.52 1moe s ARG 169 CO 0.00 -0.23 0.14 -1.50 -1.08 0.00 0.00 175.30 172.63 1moe s ILE 170 N -3.97 0.04 -0.54 4.99 2.07 -0.81 -0.04 121.20 122.94 1moe s ILE 170 Ca 0.24 -0.29 -0.15 0.00 -1.41 0.00 0.00 60.65 59.04 1moe s ILE 170 Cb 0.07 -0.31 0.13 0.00 0.13 0.00 0.00 42.46 42.49 1moe s ILE 170 CO 0.02 -0.16 0.48 -0.62 -1.91 0.00 0.00 174.94 172.75 1moe s ASP 171 N -0.53 6.12 0.23 4.50 3.68 0.15 -1.58 116.67 129.24 1moe s ASP 171 Ca -0.06 -1.86 0.09 0.00 2.13 0.00 0.00 52.55 52.86 1moe s ASP 171 Cb -0.04 -2.17 0.52 0.00 -1.45 0.00 0.00 42.92 39.78 1moe s ASP 171 CO 0.01 -0.81 1.16 -2.65 0.13 0.00 0.00 175.17 173.01 1moe n PRO 172 N 5.12 0.07 -0.39 4.34 -0.02 -1.26 -1.52 135.00 141.33 1moe n PRO 172 Ca -0.12 0.49 0.04 0.00 -2.02 0.00 0.00 63.50 61.90 1moe n PRO 172 Cb 0.40 -1.98 0.20 0.00 -0.02 0.00 0.00 33.50 32.10 1moe n PRO 172 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1moe n ALA 173 N -1.49 3.03 0.00 3.55 0.00 -1.26 -4.38 120.51 119.95 1moe n ALA 173 Ca -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1moe n ALA 173 Cb 0.28 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1moe n ALA 173 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1moe n ASN 174 N 0.38 0.00 0.00 0.00 2.04 -0.61 -4.97 115.26 112.09 1moe n ASN 174 Ca 0.14 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.28 1moe n ASN 174 Cb 0.63 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.88 1moe n ASN 174 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1moe n GLY 175 N 0.00 0.89 3.56 4.83 0.00 -0.58 -4.92 105.19 108.97 1moe n GLY 175 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1moe n GLY 175 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1moe n ASN 176 N 0.00 2.61 -4.64 1.61 5.15 -1.22 -4.69 115.26 114.08 1moe n ASN 176 Ca 0.00 -0.11 -0.29 0.00 -0.60 0.00 0.00 54.58 53.58 1moe n ASN 176 Cb 0.00 -1.52 -0.09 0.00 -0.53 0.00 0.00 39.78 37.64 1moe n ASN 176 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1moe s SER 177 N 10.06 4.74 -0.03 1.20 1.04 -1.26 0.29 113.70 129.75 1moe s SER 177 Ca 1.02 -0.30 0.01 0.00 0.48 0.00 0.00 55.95 57.16 1moe s SER 177 Cb -0.35 -1.03 0.02 0.00 0.10 0.00 0.00 66.02 64.77 1moe s SER 177 CO 0.33 0.16 -0.02 -0.75 0.98 0.00 0.00 173.24 173.94 1moe s LYS 178 N -2.39 0.45 0.13 4.02 2.20 0.95 -4.97 119.74 120.13 1moe s LYS 178 Ca 0.24 -0.03 0.07 0.00 -0.36 0.00 0.00 55.97 55.90 1moe s LYS 178 Cb -0.11 -0.54 -0.04 0.00 -1.51 0.00 0.00 37.83 35.63 1moe s LYS 178 CO 0.17 -0.07 -0.17 0.71 -0.36 0.00 0.00 175.35 175.64 1moe s TYR 179 N 0.72 1.60 0.27 4.03 1.51 -1.26 -0.19 117.35 124.03 1moe s TYR 179 Ca -0.08 -0.50 -0.30 0.00 -1.01 0.00 0.00 57.07 55.19 1moe s TYR 179 Cb -0.11 -0.83 -0.10 0.00 -0.11 0.00 0.00 41.96 40.81 1moe s TYR 179 CO -0.01 0.22 1.39 0.08 -1.11 0.00 0.00 175.55 176.12 1moe s VAL 180 N -1.92 2.69 0.26 0.71 1.01 0.39 -4.87 120.40 118.66 1moe s VAL 180 Ca 0.10 0.61 -0.10 0.00 0.00 0.00 0.00 61.98 62.60 1moe s VAL 180 Cb -0.06 -3.39 0.39 0.00 0.00 0.00 0.00 36.38 33.32 1moe s VAL 180 CO 0.04 0.11 1.57 -0.65 0.00 0.00 0.00 175.10 176.18 1moe h PRO 181 N 4.50 -0.00 0.00 2.72 0.11 -1.98 0.29 132.00 137.63 1moe h PRO 181 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1moe h PRO 181 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1moe h PRO 181 CO 0.74 -0.00 0.07 0.36 -0.21 0.00 0.00 178.00 178.96 1moe n LYS 182 N -5.57 0.00 -0.20 1.05 2.85 -1.26 -1.22 118.16 113.81 1moe n LYS 182 Ca 0.14 0.42 0.10 0.00 -1.05 0.00 0.00 58.31 57.91 1moe n LYS 182 Cb 0.45 -1.57 0.18 0.00 -0.65 0.00 0.00 35.03 33.44 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 -1.42 0.32 0.28 5.58 3.01 0.10 -4.88 117.46 120.46 1moe n PHE 183 Ca 0.00 -0.96 -0.11 0.00 1.01 0.00 0.00 57.45 57.39 1moe n PHE 183 Cb 0.07 -0.21 -0.05 0.00 -0.01 0.00 0.00 39.48 39.28 1moe n PHE 183 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1moe h GLN 184 N 0.61 -0.71 -0.95 -1.08 4.15 -1.18 -2.25 115.11 113.70 1moe h GLN 184 Ca 0.00 0.05 -0.18 0.00 0.77 0.00 0.00 58.65 59.29 1moe h GLN 184 Cb 1.15 0.16 -0.11 0.00 0.21 0.00 0.00 27.48 28.89 1moe h GLN 184 CO 0.08 -0.47 0.23 0.41 -1.93 0.00 0.00 178.83 177.14 1moe n GLY 185 N -0.94 2.90 0.00 2.39 0.00 -1.26 -3.88 105.19 104.39 1moe n GLY 185 Ca -0.09 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.12 1.58 -4.24 1.61 3.00 -1.23 -4.94 118.16 113.82 1moe n LYS 186 Ca 0.24 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 58.25 1moe n LYS 186 Cb 0.95 -0.70 -0.10 0.00 0.00 0.00 0.00 35.03 35.18 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 -1.41 3.03 -0.09 3.14 0.00 -0.85 -2.48 121.76 123.10 1moe s ALA 187 Ca 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 51.96 50.73 1moe s ALA 187 Cb 0.00 -0.98 0.05 0.00 0.00 0.00 0.00 23.12 22.19 1moe s ALA 187 CO 0.00 0.65 0.20 0.99 0.00 0.00 0.00 175.76 177.60 1moe s THR 188 N -1.21 -0.16 -0.12 0.00 2.01 -0.03 -4.81 115.64 111.31 1moe s THR 188 Ca 0.22 0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.46 1moe s THR 188 Cb -0.11 -0.33 -0.01 0.00 0.01 0.00 0.00 72.50 72.06 1moe s THR 188 CO 0.14 0.10 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.36 1moe s ILE 189 N 1.69 2.62 0.08 1.82 1.01 -1.26 -0.32 121.20 126.84 1moe s ILE 189 Ca -0.04 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.80 1moe s ILE 189 Cb -0.11 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1moe s ILE 189 CO -0.07 0.54 -0.06 0.42 0.00 0.00 0.00 174.94 175.77 1moe s THR 190 N 0.43 0.55 -0.26 2.92 -4.23 -0.45 -4.86 115.64 109.74 1moe s THR 190 Ca -0.13 -1.84 -0.14 0.00 -1.18 0.00 0.00 61.69 58.40 1moe s THR 190 Cb -0.17 -1.56 0.08 0.00 1.34 0.00 0.00 72.50 72.20 1moe s THR 190 CO 0.06 -0.88 0.62 0.00 -0.54 0.00 0.00 174.62 173.88 1moe s ALA 191 N -3.55 -1.71 -0.22 3.99 0.00 -1.26 1.00 121.76 120.00 1moe s ALA 191 Ca 0.09 2.22 -0.22 0.00 0.00 0.00 0.00 51.96 54.05 1moe s ALA 191 Cb 0.05 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.78 1moe s ALA 191 CO -0.06 -0.43 0.68 0.34 0.00 0.00 0.00 175.76 176.29 1moe s ASP 192 N 1.76 6.69 0.15 0.00 -1.08 -0.57 -4.90 116.67 118.72 1moe s ASP 192 Ca -0.09 0.85 -0.17 0.00 -0.52 0.00 0.00 52.55 52.61 1moe s ASP 192 Cb -0.07 -2.37 0.03 0.00 -1.46 0.00 0.00 42.92 39.06 1moe s ASP 192 CO -0.18 -0.35 1.73 0.00 0.52 0.00 0.00 175.17 176.88 1moe h THR 193 N 5.30 0.85 -0.02 1.71 1.03 -1.86 -0.17 112.91 119.74 1moe h THR 193 Ca -0.28 -0.06 -0.01 0.00 -0.01 0.00 0.00 66.41 66.05 1moe h THR 193 Cb 1.13 0.67 -0.00 0.00 -1.07 0.00 0.00 68.15 68.88 1moe h THR 193 CO 0.79 0.03 -0.03 0.77 -0.01 0.00 0.00 175.52 177.08 1moe h SER 194 N 0.16 0.06 0.13 0.00 4.64 -1.97 -2.94 113.55 113.63 1moe h SER 194 Ca 0.14 -0.51 -0.01 0.00 -0.47 0.00 0.00 61.79 60.94 1moe h SER 194 Cb 0.15 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1moe h SER 194 CO -0.19 0.56 -0.03 0.77 -0.87 0.00 0.00 176.83 177.07 1moe h SER 195 N -0.44 0.00 -5.74 4.97 4.64 -1.97 -3.46 113.55 111.55 1moe h SER 195 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 1moe h SER 195 Cb 0.54 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 62.78 1moe h SER 195 CO 0.01 0.03 -0.81 -3.20 -0.87 0.00 0.00 176.83 171.98 1moe n ASN 196 N -3.60 -3.00 -3.80 4.97 2.85 -0.09 -4.88 115.26 107.72 1moe n ASN 196 Ca -0.03 -0.71 -0.13 0.00 -0.11 0.00 0.00 54.58 53.61 1moe n ASN 196 Cb 0.13 -4.80 -0.10 0.00 1.24 0.00 0.00 39.78 36.25 1moe n ASN 196 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1moe s THR 197 N -3.45 0.05 0.09 -0.44 2.01 -1.16 -2.78 115.64 109.98 1moe s THR 197 Ca 0.12 -0.44 0.08 0.00 0.31 0.00 0.00 61.69 61.76 1moe s THR 197 Cb -0.02 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 1moe s THR 197 CO 0.76 -0.24 -0.15 0.00 -0.69 0.00 0.00 174.62 174.30 1moe s ALA 198 N -1.04 2.78 -0.02 7.40 0.00 -0.33 -1.51 121.76 129.04 1moe s ALA 198 Ca -0.11 -1.27 0.06 0.00 0.00 0.00 0.00 51.96 50.63 1moe s ALA 198 Cb -0.05 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.28 1moe s ALA 198 CO 0.03 0.61 -0.19 0.71 0.00 0.00 0.00 175.76 176.91 1moe s TYR 199 N -1.12 1.76 -0.11 0.00 1.51 0.28 -0.88 117.35 118.77 1moe s TYR 199 Ca 0.18 -0.37 -0.01 0.00 -1.01 0.00 0.00 57.07 55.86 1moe s TYR 199 Cb -0.11 -1.14 -0.03 0.00 -0.11 0.00 0.00 41.96 40.58 1moe s TYR 199 CO 0.10 -0.06 -0.07 -1.17 -1.11 0.00 0.00 175.55 173.25 1moe s LEU 200 N -0.36 3.13 -0.07 -1.29 2.96 -0.68 -1.34 118.68 121.04 1moe s LEU 200 Ca 0.05 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1moe s LEU 200 Cb -0.08 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.91 1moe s LEU 200 CO -0.00 0.25 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.63 1moe s GLN 201 N -0.14 1.19 -0.09 1.98 0.74 0.56 -1.05 119.66 122.84 1moe s GLN 201 Ca 0.02 -0.20 0.04 0.00 0.05 0.00 0.00 55.36 55.27 1moe s GLN 201 Cb -0.13 -1.16 -0.00 0.00 1.10 0.00 0.00 33.01 32.82 1moe s GLN 201 CO 0.03 -0.11 -0.23 -0.51 -0.55 0.00 0.00 175.29 173.92 1moe s LEU 202 N 1.10 2.16 0.33 3.68 1.43 -1.10 -0.85 118.68 125.43 1moe s LEU 202 Ca -0.07 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.57 1moe s LEU 202 Cb -0.14 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 1moe s LEU 202 CO -0.01 0.18 0.35 0.42 0.23 0.00 0.00 176.35 177.52 1moe s THR 203 N 0.23 3.85 -0.61 5.49 -4.23 -1.03 -2.08 115.64 117.27 1moe s THR 203 Ca -0.15 -1.22 -0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1moe s THR 203 Cb -0.17 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.37 1moe s THR 203 CO 0.08 -0.18 0.43 -1.54 -0.54 0.00 0.00 174.62 172.87 1moe n SER 204 N -1.46 -3.41 -4.49 3.99 3.41 -1.16 -4.82 113.62 105.67 1moe n SER 204 Ca -0.02 -0.72 -0.30 0.00 -0.26 0.00 0.00 58.87 57.56 1moe n SER 204 Cb 0.59 -1.14 0.20 0.00 -0.26 0.00 0.00 64.21 63.59 1moe n SER 204 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1moe n LEU 205 N -2.14 0.10 -3.82 1.04 4.77 0.16 -4.50 117.00 112.61 1moe n LEU 205 Ca -0.23 0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 55.75 1moe n LEU 205 Cb 0.50 -1.27 -0.05 0.00 -2.33 0.00 0.00 43.42 40.26 1moe n LEU 205 CO 0.46 -2.96 0.13 -0.89 -1.33 0.00 0.00 177.39 172.80 1moe s THR 206 N -2.45 0.05 0.36 -5.08 2.01 -1.26 -1.79 115.64 107.47 1moe s THR 206 Ca 0.64 -1.01 0.11 0.00 0.31 0.00 0.00 61.69 61.74 1moe s THR 206 Cb -0.22 -1.62 0.34 0.00 0.01 0.00 0.00 72.50 71.00 1moe s THR 206 CO 0.63 -0.23 1.82 -1.28 -0.69 0.00 0.00 174.62 174.87 1moe h SER 207 N 2.37 0.62 -0.17 3.53 0.87 -1.97 0.31 113.55 119.12 1moe h SER 207 Ca -0.31 0.07 -0.07 0.00 -1.23 0.00 0.00 61.79 60.25 1moe h SER 207 Cb 1.25 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 63.12 1moe h SER 207 CO 0.43 0.25 0.08 -1.84 -0.53 0.00 0.00 176.83 175.22 1moe n GLU 208 N -4.63 1.46 -0.00 2.24 0.28 -1.26 -2.25 120.64 116.48 1moe n GLU 208 Ca 0.21 -0.63 0.01 0.00 -0.16 0.00 0.00 57.16 56.59 1moe n GLU 208 Cb 0.61 -1.40 -0.01 0.00 1.43 0.00 0.00 31.44 32.07 1moe n GLU 208 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1moe n ASP 209 N 0.15 2.76 -4.62 -1.84 10.43 0.11 -4.95 116.55 118.59 1moe n ASP 209 Ca 0.10 -0.22 -0.43 0.00 2.57 0.00 0.00 54.79 56.80 1moe n ASP 209 Cb 0.63 1.04 -0.03 0.00 1.84 0.00 0.00 41.12 44.60 1moe n ASP 209 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1moe n THR 210 N -1.34 0.51 -3.61 -3.53 -1.04 -0.95 -4.84 114.28 99.48 1moe n THR 210 Ca -0.00 -0.32 -0.02 0.00 -2.04 0.00 0.00 64.05 61.67 1moe n THR 210 Cb 0.03 -2.41 -0.02 0.00 -1.82 0.00 0.00 70.33 66.11 1moe n THR 210 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1moe s ALA 211 N 6.69 -2.17 0.05 2.41 0.00 -0.22 -4.31 121.76 124.21 1moe s ALA 211 Ca 0.97 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 54.19 1moe s ALA 211 Cb -0.41 -0.08 -0.06 0.00 0.00 0.00 0.00 23.12 22.57 1moe s ALA 211 CO 0.39 -0.70 0.65 0.08 0.00 0.00 0.00 175.76 176.19 1moe s VAL 212 N -2.29 4.76 -0.07 0.00 1.01 -0.64 -1.52 120.40 121.66 1moe s VAL 212 Ca 0.11 1.39 0.05 0.00 0.00 0.00 0.00 61.98 63.54 1moe s VAL 212 Cb 0.01 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 1moe s VAL 212 CO -0.04 0.45 -0.24 -0.31 0.00 0.00 0.00 175.10 174.96 1moe s TYR 213 N -0.47 2.50 0.25 5.22 1.51 0.22 -0.77 117.35 125.80 1moe s TYR 213 Ca 0.33 -0.76 0.11 0.00 -1.01 0.00 0.00 57.07 55.74 1moe s TYR 213 Cb -0.20 -1.64 -0.05 0.00 -0.11 0.00 0.00 41.96 39.97 1moe s TYR 213 CO 0.20 -0.24 -0.20 0.71 -1.11 0.00 0.00 175.55 174.91 1moe s TYR 214 N -0.05 2.21 0.10 2.71 1.51 -0.02 0.30 117.35 124.11 1moe s TYR 214 Ca -0.07 -0.37 0.10 0.00 -1.01 0.00 0.00 57.07 55.72 1moe s TYR 214 Cb -0.15 -1.00 -0.04 0.00 -0.11 0.00 0.00 41.96 40.67 1moe s TYR 214 CO 0.05 0.61 -0.24 0.00 -1.11 0.00 0.00 175.55 174.85 1moe s ALA 216 N -1.04 -1.47 -0.34 0.00 0.00 0.37 -1.82 121.76 117.46 1moe s ALA 216 Ca 0.11 1.86 -0.29 0.00 0.00 0.00 0.00 51.96 53.64 1moe s ALA 216 Cb -0.10 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 1moe s ALA 216 CO 0.05 -0.66 1.64 -1.25 0.00 0.00 0.00 175.76 175.54 1moe s PRO 217 N 2.34 3.49 -0.21 0.00 0.04 -1.26 -1.76 135.00 137.65 1moe s PRO 217 Ca -0.05 1.32 -0.02 0.00 0.04 0.00 0.00 61.00 62.29 1moe s PRO 217 Cb -0.10 -4.11 0.06 0.00 0.04 0.00 0.00 34.50 30.38 1moe s PRO 217 CO -0.15 -1.66 0.01 0.12 0.04 0.00 0.00 177.00 175.35 1moe s PHE 218 N 6.13 1.48 0.00 0.56 5.36 -0.45 -4.04 117.98 127.02 1moe s PHE 218 Ca 0.73 -1.16 0.00 0.00 -0.96 0.00 0.00 56.93 55.54 1moe s PHE 218 Cb -0.20 -1.21 0.00 0.00 -0.34 0.00 0.00 43.02 41.27 1moe s PHE 218 CO 0.33 -0.67 0.00 0.41 -1.46 0.00 0.00 175.22 173.83 1moe n GLY 219 N 4.92 3.68 7.00 13.12 0.00 -1.10 -3.89 105.19 128.92 1moe n GLY 219 Ca -0.10 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1moe n GLY 219 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1moe n TYR 220 N -1.15 0.00 -0.97 1.61 4.02 -1.26 -3.32 117.16 116.08 1moe n TYR 220 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.92 1moe n TYR 220 Cb 0.00 0.00 0.36 0.00 -0.02 0.00 0.00 39.34 39.68 1moe n TYR 220 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1moe n TYR 221 N 0.00 2.07 0.07 -0.72 4.02 -1.00 -4.40 117.16 117.21 1moe n TYR 221 Ca 0.00 -0.92 0.00 0.00 -0.01 0.00 0.00 57.90 56.97 1moe n TYR 221 Cb 0.00 -0.55 0.00 0.00 -0.02 0.00 0.00 39.34 38.77 1moe n TYR 221 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1moe n VAL 222 N 0.21 0.46 -2.84 -0.72 0.31 -1.21 -4.98 118.33 109.57 1moe n VAL 222 Ca 0.32 0.15 -0.11 0.00 -0.01 0.00 0.00 64.34 64.69 1moe n VAL 222 Cb 1.23 -1.06 0.04 0.00 -0.91 0.00 0.00 33.84 33.15 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 -3.28 -0.27 0.00 4.52 2.88 -1.26 -4.93 113.62 111.28 1moe n SER 223 Ca 0.00 -2.96 0.03 0.00 -1.33 0.00 0.00 58.87 54.61 1moe n SER 223 Cb 0.08 0.31 0.18 0.00 -0.75 0.00 0.00 64.21 64.03 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 0.02 0.00 -0.00 -3.46 3.85 -1.26 -2.70 116.55 112.99 1moe n ASP 224 Ca 0.10 -0.09 0.04 0.00 -0.71 0.00 0.00 54.79 54.13 1moe n ASP 224 Cb 0.75 -0.08 -0.06 0.00 -1.35 0.00 0.00 41.12 40.38 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 -1.08 0.00 -3.86 2.11 0.18 -1.26 -4.77 117.16 108.48 1moe n TYR 225 Ca 0.04 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.83 1moe n TYR 225 Cb 0.03 -0.18 0.00 0.00 -0.38 0.00 0.00 39.34 38.81 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 -1.78 -0.51 -3.42 -3.48 0.00 -1.16 -5.09 120.51 105.07 1moe n ALA 226 Ca -0.02 -0.12 -0.44 0.00 0.00 0.00 0.00 53.44 52.87 1moe n ALA 226 Cb 0.21 0.02 -0.06 0.00 0.00 0.00 0.00 19.45 19.63 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 -2.00 2.94 0.00 0.00 -1.94 -1.26 -4.71 119.30 112.32 1moe s MET 227 Ca 0.04 -1.95 0.14 0.00 -1.71 0.00 0.00 55.69 52.22 1moe s MET 227 Cb -0.00 -4.18 -0.19 0.00 2.01 0.00 0.00 34.83 32.47 1moe s MET 227 CO -0.00 -1.27 0.73 0.00 -0.01 0.00 0.00 175.02 174.47 1moe n ALA 228 N 4.74 1.68 -2.56 3.03 0.00 -1.26 -4.90 120.51 121.24 1moe n ALA 228 Ca -0.05 -0.67 -0.33 0.00 0.00 0.00 0.00 53.44 52.40 1moe n ALA 228 Cb 0.42 -0.90 -0.11 0.00 0.00 0.00 0.00 19.45 18.86 1moe n ALA 228 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1moe s TYR 229 N -2.74 2.85 0.05 0.00 1.51 -1.26 -5.12 117.35 112.64 1moe s TYR 229 Ca -0.04 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 55.98 1moe s TYR 229 Cb 0.08 -1.63 -0.03 0.00 -0.11 0.00 0.00 41.96 40.27 1moe s TYR 229 CO 0.82 0.32 -0.06 -1.58 -1.11 0.00 0.00 175.55 173.94 1moe s TRP 230 N -0.89 0.65 0.96 2.71 0.52 -1.26 -4.34 118.94 117.29 1moe s TRP 230 Ca 0.15 -0.64 -0.16 0.00 0.02 0.00 0.00 56.10 55.46 1moe s TRP 230 Cb -0.11 -0.39 0.20 0.00 -1.15 0.00 0.00 33.47 32.02 1moe s TRP 230 CO 0.04 -0.14 1.32 0.20 0.02 0.00 0.00 176.95 178.39 1moe s GLY 231 N -2.00 1.78 0.46 0.98 0.00 -0.75 -4.48 107.32 103.30 1moe s GLY 231 Ca -0.05 -1.19 0.25 0.00 0.00 0.00 0.00 44.72 43.74 1moe s GLY 231 CO -0.02 -0.42 1.69 1.46 0.00 0.00 0.00 173.10 175.81 1moe h GLN 232 N -1.66 0.00 0.00 2.90 1.08 -1.92 -3.45 115.11 112.07 1moe h GLN 232 Ca -0.44 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 1moe h GLN 232 Cb 1.24 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.67 1moe h GLN 232 CO 0.38 0.03 0.00 0.41 -0.95 0.00 0.00 178.83 178.70 1moe n GLY 233 N 0.84 1.01 3.57 3.46 0.00 -1.25 -5.01 105.19 107.80 1moe n GLY 233 Ca 0.03 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.62 1moe n GLY 233 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1moe s THR 234 N 0.00 4.51 -0.14 2.61 2.01 0.15 -4.76 115.64 120.02 1moe s THR 234 Ca 0.00 0.74 -0.29 0.00 0.31 0.00 0.00 61.69 62.45 1moe s THR 234 Cb 0.00 -4.41 -0.01 0.00 0.01 0.00 0.00 72.50 68.10 1moe s THR 234 CO 0.00 -0.79 1.01 -0.55 -0.69 0.00 0.00 174.62 173.60 1moe s SER 235 N 2.21 7.20 -0.09 3.53 0.15 -1.26 -0.61 113.70 124.82 1moe s SER 235 Ca 0.36 1.48 0.04 0.00 0.70 0.00 0.00 55.95 58.52 1moe s SER 235 Cb -0.11 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1moe s SER 235 CO 0.25 -0.50 -0.22 -0.69 1.20 0.00 0.00 173.24 173.28 1moe s VAL 236 N 2.31 1.87 0.04 4.45 1.01 -0.58 -0.92 120.40 128.59 1moe s VAL 236 Ca 0.47 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.59 1moe s VAL 236 Cb -0.17 -1.63 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 1moe s VAL 236 CO 0.15 0.52 -0.14 -0.89 0.00 0.00 0.00 175.10 174.74 1moe s THR 237 N 0.40 1.09 -0.15 3.92 2.01 0.12 -1.05 115.64 121.98 1moe s THR 237 Ca -0.18 -1.00 -0.03 0.00 0.31 0.00 0.00 61.69 60.79 1moe s THR 237 Cb -0.18 -0.99 0.05 0.00 0.01 0.00 0.00 72.50 71.39 1moe s THR 237 CO 0.08 -0.01 0.04 -0.69 -0.69 0.00 0.00 174.62 173.34 1moe s VAL 238 N -0.87 0.33 -0.06 3.82 1.01 -1.26 -1.16 120.40 122.20 1moe s VAL 238 Ca 0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1moe s VAL 238 Cb -0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 1moe s VAL 238 CO 0.01 -0.07 -0.08 -0.24 0.00 0.00 0.00 175.10 174.73 1moe n SER 239 N 5.14 1.39 0.00 3.32 2.88 -1.20 -4.62 113.62 120.52 1moe n SER 239 Ca -0.08 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1moe n SER 239 Cb 0.48 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 1moe n SER 239 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27