#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mld s LYS 2 N 0.00 3.50 -0.07 0.00 1.02 -1.26 -0.74 119.74 122.19 1mld s LYS 2 Ca 0.00 -0.62 0.03 0.00 0.02 0.00 0.00 55.97 55.40 1mld s LYS 2 Cb 0.00 -3.62 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 1mld s LYS 2 CO 0.00 -0.37 -0.17 0.08 -0.92 0.00 0.00 175.35 173.97 1mld s VAL 3 N 1.66 1.51 -0.11 3.17 1.01 0.10 -0.93 120.40 126.81 1mld s VAL 3 Ca 0.05 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.32 1mld s VAL 3 Cb -0.17 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 1mld s VAL 3 CO 0.08 0.44 -0.10 0.00 0.00 0.00 0.00 175.10 175.51 1mld s ALA 4 N 0.39 2.78 -0.21 5.51 0.00 -0.81 -1.20 121.76 128.22 1mld s ALA 4 Ca -0.13 -0.89 -0.05 0.00 0.00 0.00 0.00 51.96 50.90 1mld s ALA 4 Cb -0.15 -1.25 -0.02 0.00 0.00 0.00 0.00 23.12 21.69 1mld s ALA 4 CO 0.05 0.35 -0.01 0.08 0.00 0.00 0.00 175.76 176.23 1mld s VAL 5 N -0.03 3.75 -0.41 0.00 1.01 -0.14 -1.16 120.40 123.42 1mld s VAL 5 Ca -0.02 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 1mld s VAL 5 Cb -0.14 -2.71 0.09 0.00 0.00 0.00 0.00 36.38 33.63 1mld s VAL 5 CO 0.03 0.41 0.22 -0.76 0.00 0.00 0.00 175.10 175.00 1mld s LEU 6 N 1.27 5.11 0.00 3.92 1.43 -0.65 -1.44 118.68 128.32 1mld s LEU 6 Ca 0.04 -1.74 0.00 0.00 -1.03 0.00 0.00 54.13 51.39 1mld s LEU 6 Cb -0.15 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.18 1mld s LEU 6 CO 0.00 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 176.67 1mld n GLY 7 N 4.75 1.01 0.00 -3.19 0.00 0.10 -2.71 105.19 105.16 1mld n GLY 7 Ca -0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1mld n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mld n ALA 8 N -0.00 2.19 0.34 4.61 0.00 -0.64 -3.35 120.51 123.66 1mld n ALA 8 Ca 0.00 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1mld n ALA 8 Cb 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 19.45 18.09 1mld n ALA 8 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mld n SER 9 N -1.50 0.74 -2.33 0.00 7.64 -1.26 -2.80 113.62 114.11 1mld n SER 9 Ca 0.06 0.15 -0.01 0.00 1.01 0.00 0.00 58.87 60.08 1mld n SER 9 Cb 0.30 0.45 0.01 0.00 -1.01 0.00 0.00 64.21 63.97 1mld n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mld n GLY 10 N 1.27 -1.81 0.33 0.23 0.00 -1.21 -4.60 105.19 99.40 1mld n GLY 10 Ca 0.01 -1.56 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 1mld n GLY 10 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1mld h GLY 11 N -0.35 -0.50 1.42 -0.02 0.00 -1.94 -2.12 103.07 99.57 1mld h GLY 11 Ca -0.02 0.39 -0.28 0.00 0.00 0.00 0.00 47.33 47.41 1mld h GLY 11 CO 0.01 -0.23 -1.22 -2.22 0.00 0.00 0.00 176.54 172.88 1mld h ILE 12 N -0.45 1.37 -0.51 2.60 2.04 -1.88 -3.39 117.51 117.28 1mld h ILE 12 Ca 0.07 -2.67 0.04 0.00 1.00 0.00 0.00 64.86 63.30 1mld h ILE 12 Cb 0.55 2.77 -0.04 0.00 -0.74 0.00 0.00 36.82 39.36 1mld h ILE 12 CO -0.29 0.80 0.26 1.23 0.00 0.00 0.00 178.15 180.15 1mld h GLY 13 N 0.85 0.72 0.46 5.37 0.00 -1.63 -1.84 103.07 107.00 1mld h GLY 13 Ca -0.16 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1mld h GLY 13 CO 0.22 0.12 -0.01 1.46 0.00 0.00 0.00 176.54 178.32 1mld h GLN 14 N 0.51 0.02 -0.95 4.80 4.20 -1.22 -1.22 115.11 121.25 1mld h GLN 14 Ca 0.23 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.96 1mld h GLN 14 Cb 0.13 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.86 1mld h GLN 14 CO -0.16 0.57 0.62 -1.00 -0.67 0.00 0.00 178.83 178.19 1mld h PRO 15 N -0.53 1.17 -0.30 1.46 0.13 -1.77 -2.07 132.00 130.08 1mld h PRO 15 Ca 0.00 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 65.04 1mld h PRO 15 Cb 0.56 -0.26 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 1mld h PRO 15 CO 0.00 0.77 0.13 1.25 -0.23 0.00 0.00 178.00 179.92 1mld h LEU 16 N 1.20 0.42 -1.94 1.56 5.85 -1.34 -1.46 115.31 119.60 1mld h LEU 16 Ca 0.37 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.96 1mld h LEU 16 Cb -0.01 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1mld h LEU 16 CO -0.11 0.46 0.11 0.28 -0.34 0.00 0.00 178.44 178.84 1mld h SER 17 N 0.35 0.07 -0.05 1.25 0.02 -0.96 -1.95 113.55 112.29 1mld h SER 17 Ca 0.10 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1mld h SER 17 Cb 0.17 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 1mld h SER 17 CO -0.01 0.05 -0.04 0.25 -1.14 0.00 0.00 176.83 175.94 1mld h LEU 18 N 0.08 0.13 -0.61 5.07 5.85 -0.58 -1.78 115.31 123.47 1mld h LEU 18 Ca 0.07 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.34 1mld h LEU 18 Cb 0.18 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1mld h LEU 18 CO -0.01 0.56 0.39 -0.07 -0.34 0.00 0.00 178.44 178.98 1mld h LEU 19 N -0.31 0.67 -0.48 2.25 4.07 -1.07 0.06 115.31 120.50 1mld h LEU 19 Ca 0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.92 1mld h LEU 19 Cb 0.53 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 1mld h LEU 19 CO 0.01 0.48 0.17 -0.07 -1.08 0.00 0.00 178.44 177.95 1mld h LEU 20 N 0.79 0.68 -1.22 1.67 4.07 -1.38 -2.56 115.31 117.37 1mld h LEU 20 Ca 0.23 -0.19 -0.07 0.00 0.08 0.00 0.00 57.88 57.93 1mld h LEU 20 Cb -0.06 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.49 1mld h LEU 20 CO -0.07 0.69 -0.21 0.50 -1.08 0.00 0.00 178.44 178.27 1mld h LYS 21 N 0.64 0.27 0.00 1.13 1.63 -0.69 -2.26 116.57 117.29 1mld h LYS 21 Ca 0.16 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1mld h LYS 21 Cb 0.24 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.84 1mld h LYS 21 CO -0.01 0.48 0.00 -0.91 -3.45 0.00 0.00 179.45 175.56 1mld h ASN 22 N 0.25 0.00 -3.45 4.20 2.35 -0.61 -3.42 115.58 114.89 1mld h ASN 22 Ca 0.04 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.25 1mld h ASN 22 Cb 0.52 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.86 1mld h ASN 22 CO 0.04 0.00 0.19 -0.55 -1.65 0.00 0.00 177.43 175.46 1mld s SER 23 N -5.54 7.27 0.64 5.81 0.15 -0.85 -4.96 113.70 116.21 1mld s SER 23 Ca 0.02 1.51 0.42 0.00 0.70 0.00 0.00 55.95 58.61 1mld s SER 23 Cb 0.09 -2.49 2.24 0.00 -1.71 0.00 0.00 66.02 64.15 1mld s SER 23 CO 0.53 0.01 2.29 -0.65 1.20 0.00 0.00 173.24 176.63 1mld h PRO 24 N 5.59 0.00 0.00 5.44 0.11 -1.87 -2.88 132.00 138.39 1mld h PRO 24 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1mld h PRO 24 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1mld h PRO 24 CO 0.71 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 178.43 1mld h LEU 25 N 0.00 0.00 -9.19 2.35 3.38 -1.93 -3.44 115.31 106.49 1mld h LEU 25 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1mld h LEU 25 Cb 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.70 1mld h LEU 25 CO 0.00 0.00 -0.48 -0.69 0.09 0.00 0.00 178.44 177.36 1mld s VAL 26 N -3.36 5.38 -0.20 1.22 1.01 -1.09 0.10 120.40 123.46 1mld s VAL 26 Ca 0.05 0.22 0.12 0.00 0.00 0.00 0.00 61.98 62.37 1mld s VAL 26 Cb 0.08 -3.50 -0.20 0.00 0.00 0.00 0.00 36.38 32.75 1mld s VAL 26 CO 0.59 0.39 -0.02 -1.54 0.00 0.00 0.00 175.10 174.53 1mld n SER 27 N 3.89 0.98 -3.69 3.32 3.41 0.08 -3.71 113.62 117.91 1mld n SER 27 Ca -0.15 -0.04 -0.12 0.00 -0.26 0.00 0.00 58.87 58.30 1mld n SER 27 Cb 0.52 0.56 -0.12 0.00 -0.26 0.00 0.00 64.21 64.90 1mld n SER 27 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1mld s ARG 28 N -2.45 0.24 -0.15 4.33 3.00 -1.16 -1.27 118.95 121.49 1mld s ARG 28 Ca -0.16 0.75 0.02 0.00 -1.00 0.00 0.00 55.73 55.34 1mld s ARG 28 Cb 0.06 0.01 0.01 0.00 0.00 0.00 0.00 34.95 35.03 1mld s ARG 28 CO 0.69 -0.22 -0.21 -1.17 0.00 0.00 0.00 175.30 174.39 1mld s LEU 29 N 1.96 2.06 -0.13 -0.88 2.96 0.41 -0.72 118.68 124.33 1mld s LEU 29 Ca -0.04 -0.59 0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1mld s LEU 29 Cb -0.11 -1.41 -0.01 0.00 0.50 0.00 0.00 46.19 45.17 1mld s LEU 29 CO -0.10 0.05 -0.17 0.42 -1.32 0.00 0.00 176.35 175.23 1mld s THR 30 N 0.97 2.61 -0.13 3.68 -4.23 -0.34 -1.41 115.64 116.79 1mld s THR 30 Ca -0.04 -0.81 -0.02 0.00 -1.18 0.00 0.00 61.69 59.64 1mld s THR 30 Cb -0.15 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.60 1mld s THR 30 CO -0.05 0.53 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.73 1mld s LEU 31 N 0.53 3.10 -0.01 4.79 1.43 0.02 -0.97 118.68 127.57 1mld s LEU 31 Ca -0.11 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1mld s LEU 31 Cb -0.16 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 1mld s LEU 31 CO 0.04 0.21 -0.14 -0.47 0.23 0.00 0.00 176.35 176.22 1mld s TYR 32 N 0.13 1.27 0.22 0.29 5.04 -0.52 0.37 117.35 124.16 1mld s TYR 32 Ca -0.03 -0.25 -0.23 0.00 -2.44 0.00 0.00 57.07 54.13 1mld s TYR 32 Cb -0.14 -0.82 0.04 0.00 0.35 0.00 0.00 41.96 41.39 1mld s TYR 32 CO 0.03 -0.03 0.82 0.34 -1.34 0.00 0.00 175.55 175.37 1mld s ASP 33 N -0.30 -0.23 0.00 4.32 -1.08 -1.11 0.02 116.67 118.29 1mld s ASP 33 Ca 0.05 -0.51 0.28 0.00 -0.52 0.00 0.00 52.55 51.85 1mld s ASP 33 Cb -0.06 0.63 1.15 0.00 -1.46 0.00 0.00 42.92 43.18 1mld s ASP 33 CO -0.00 -1.15 1.80 2.30 0.52 0.00 0.00 175.17 178.63 1mld n ILE 34 N -0.46 0.00 -3.49 4.11 -5.35 -1.26 -2.08 119.36 110.83 1mld n ILE 34 Ca -0.05 -0.19 -0.14 0.00 -0.27 0.00 0.00 62.75 62.09 1mld n ILE 34 Cb 0.60 0.32 -0.04 0.00 -1.74 0.00 0.00 39.64 38.78 1mld n ILE 34 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1mld s ALA 35 N -2.07 -1.57 0.00 -1.28 0.00 -1.26 -4.60 121.76 110.97 1mld s ALA 35 Ca 0.38 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.08 1mld s ALA 35 Cb 0.21 0.51 0.00 0.00 0.00 0.00 0.00 23.12 23.84 1mld s ALA 35 CO 0.36 -0.59 0.00 0.72 0.00 0.00 0.00 175.76 176.25 1mld n HIS 36 N 0.17 0.00 0.02 0.00 8.25 -1.26 -4.69 115.22 117.72 1mld n HIS 36 Ca -0.18 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.37 1mld n HIS 36 Cb 0.62 -1.00 0.52 0.00 1.12 0.00 0.00 29.99 31.24 1mld n HIS 36 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1mld h THR 37 N 0.00 0.98 -0.73 1.59 1.35 -1.87 -2.30 112.91 111.93 1mld h THR 37 Ca 0.00 -0.12 0.15 0.00 -0.55 0.00 0.00 66.41 65.89 1mld h THR 37 Cb 0.00 0.60 -0.10 0.00 -1.73 0.00 0.00 68.15 66.92 1mld h THR 37 CO 0.00 0.06 0.23 -0.65 -0.25 0.00 0.00 175.52 174.91 1mld h PRO 38 N 0.35 0.33 -0.17 4.72 0.11 -1.87 -1.45 132.00 134.03 1mld h PRO 38 Ca 0.17 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.04 1mld h PRO 38 Cb 0.24 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 31.28 1mld h PRO 38 CO -0.04 0.22 -0.74 0.78 -0.21 0.00 0.00 178.00 178.01 1mld h GLY 39 N 0.34 0.87 0.95 -0.55 0.00 -1.83 -2.05 103.07 100.79 1mld h GLY 39 Ca 0.40 -1.19 -0.01 0.00 0.00 0.00 0.00 47.33 46.53 1mld h GLY 39 CO -0.45 1.06 0.17 -2.08 0.00 0.00 0.00 176.54 175.24 1mld h VAL 40 N 0.55 1.17 -0.83 4.60 2.07 -1.38 -2.19 116.25 120.23 1mld h VAL 40 Ca -0.04 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1mld h VAL 40 Cb 1.37 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 1mld h VAL 40 CO 0.15 0.18 0.45 0.00 0.02 0.00 0.00 177.57 178.37 1mld h ALA 41 N 1.02 1.22 -0.11 1.67 0.00 -1.30 -2.05 119.26 119.71 1mld h ALA 41 Ca 0.12 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1mld h ALA 41 Cb 0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1mld h ALA 41 CO -0.01 0.63 -0.11 0.00 0.00 0.00 0.00 179.25 179.75 1mld h ALA 42 N 1.32 -0.02 0.61 0.00 0.00 -1.20 -1.19 119.26 118.78 1mld h ALA 42 Ca 0.29 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 1mld h ALA 42 Cb 0.04 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1mld h ALA 42 CO -0.05 -0.56 -0.47 0.22 0.00 0.00 0.00 179.25 178.39 1mld h ASP 43 N -0.13 -1.25 -0.36 0.00 1.82 -1.33 -3.16 116.42 112.01 1mld h ASP 43 Ca 0.08 0.09 0.02 0.00 -0.39 0.00 0.00 57.03 56.82 1mld h ASP 43 Cb 0.25 0.39 -0.02 0.00 0.68 0.00 0.00 39.33 40.63 1mld h ASP 43 CO -0.19 -0.67 0.24 -0.07 -1.61 0.00 0.00 179.24 176.93 1mld h LEU 44 N -1.05 0.36 -0.27 2.28 3.38 -1.37 -1.74 115.31 116.91 1mld h LEU 44 Ca -0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1mld h LEU 44 Cb 0.87 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1mld h LEU 44 CO 0.02 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 177.26 1mld n SER 45 N -4.49 0.21 0.00 -0.43 3.41 -0.45 -2.08 113.62 109.80 1mld n SER 45 Ca 0.03 0.56 0.14 0.00 -0.26 0.00 0.00 58.87 59.34 1mld n SER 45 Cb 0.12 -0.60 0.61 0.00 -0.26 0.00 0.00 64.21 64.07 1mld n SER 45 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1mld n HIS 46 N -1.74 0.00 -2.58 7.33 8.25 -0.65 -4.86 115.22 120.96 1mld n HIS 46 Ca 0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.08 1mld n HIS 46 Cb 0.16 -0.50 -0.05 0.00 1.12 0.00 0.00 29.99 30.72 1mld n HIS 46 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1mld s ILE 47 N -3.00 3.74 0.00 1.59 1.01 -0.88 -4.93 121.20 118.74 1mld s ILE 47 Ca 0.14 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.52 1mld s ILE 47 Cb 0.19 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.56 1mld s ILE 47 CO 0.52 0.40 1.06 -1.84 0.00 0.00 0.00 174.94 175.08 1mld n GLU 48 N 1.43 0.75 -3.83 2.79 0.28 -1.26 -4.80 120.64 116.00 1mld n GLU 48 Ca -0.01 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.74 1mld n GLU 48 Cb 0.46 -1.13 -0.02 0.00 1.43 0.00 0.00 31.44 32.18 1mld n GLU 48 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1mld s THR 49 N 0.35 1.96 0.04 3.84 -4.23 -1.26 -5.07 115.64 111.27 1mld s THR 49 Ca 0.00 -1.47 -0.24 0.00 -1.18 0.00 0.00 61.69 58.79 1mld s THR 49 Cb 0.00 -2.43 -0.17 0.00 1.34 0.00 0.00 72.50 71.23 1mld s THR 49 CO 0.00 0.00 1.51 -0.09 -0.54 0.00 0.00 174.62 175.50 1mld h ARG 50 N 0.88 0.01 -6.46 3.99 2.43 -1.87 -3.46 114.38 109.90 1mld h ARG 50 Ca -0.38 -0.00 -0.61 0.00 -0.81 0.00 0.00 59.98 58.18 1mld h ARG 50 Cb 1.29 -0.00 0.06 0.00 -0.42 0.00 0.00 29.97 30.90 1mld h ARG 50 CO 0.58 0.25 0.64 0.00 -1.51 0.00 0.00 179.97 179.93 1mld n ALA 51 N -2.22 0.62 -2.69 2.80 0.00 -1.24 -4.92 120.51 112.86 1mld n ALA 51 Ca -0.08 0.46 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 1mld n ALA 51 Cb 0.14 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 1mld n ALA 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mld s THR 52 N 0.50 4.84 -0.17 0.00 2.01 -0.39 -4.86 115.64 117.57 1mld s THR 52 Ca 0.77 1.94 -0.05 0.00 0.31 0.00 0.00 61.69 64.66 1mld s THR 52 Cb -0.75 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 67.47 1mld s THR 52 CO 0.44 0.06 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.73 1mld s VAL 53 N 1.74 4.14 -0.01 3.82 1.01 -1.26 -0.45 120.40 129.38 1mld s VAL 53 Ca 0.47 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 62.19 1mld s VAL 53 Cb -0.19 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1mld s VAL 53 CO 0.19 0.48 -0.04 -0.54 0.00 0.00 0.00 175.10 175.18 1mld s LYS 54 N 0.45 0.46 0.03 2.72 1.02 -0.50 -4.92 119.74 119.00 1mld s LYS 54 Ca -0.02 -0.14 0.08 0.00 0.02 0.00 0.00 55.97 55.91 1mld s LYS 54 Cb -0.14 -0.47 -0.03 0.00 -0.52 0.00 0.00 37.83 36.67 1mld s LYS 54 CO 0.02 0.05 -0.23 0.20 -0.92 0.00 0.00 175.35 174.48 1mld s GLY 55 N 0.16 1.46 0.05 -3.33 0.00 -1.26 -0.79 107.32 103.60 1mld s GLY 55 Ca -0.02 -1.21 0.05 0.00 0.00 0.00 0.00 44.72 43.54 1mld s GLY 55 CO -0.00 -1.08 -0.14 -0.19 0.00 0.00 0.00 173.10 171.69 1mld s TYR 56 N -0.82 1.18 -0.04 1.90 2.02 0.16 -4.77 117.35 116.97 1mld s TYR 56 Ca 0.12 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.43 1mld s TYR 56 Cb -0.10 -0.69 0.03 0.00 -0.40 0.00 0.00 41.96 40.80 1mld s TYR 56 CO 0.03 0.04 -0.01 -1.17 -1.57 0.00 0.00 175.55 172.86 1mld s LEU 57 N -1.36 1.04 0.00 -1.29 1.98 -1.26 -2.74 118.68 115.06 1mld s LEU 57 Ca -0.00 -0.06 0.00 0.00 -2.89 0.00 0.00 54.13 51.17 1mld s LEU 57 Cb -0.09 -0.33 0.00 0.00 0.66 0.00 0.00 46.19 46.43 1mld s LEU 57 CO 0.02 -0.11 0.00 0.61 -1.89 0.00 0.00 176.35 174.97 1mld n GLY 58 N 4.39 -2.45 0.29 7.98 0.00 -0.88 -3.98 105.19 110.53 1mld n GLY 58 Ca -0.21 -1.40 0.07 0.00 0.00 0.00 0.00 46.02 44.48 1mld n GLY 58 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1mld h PRO 59 N 0.00 0.47 -0.40 1.61 0.11 -1.98 0.20 132.00 132.02 1mld h PRO 59 Ca 0.00 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1mld h PRO 59 Cb 0.00 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 30.98 1mld h PRO 59 CO 0.00 0.31 0.23 1.05 -0.21 0.00 0.00 178.00 179.38 1mld h GLU 60 N 0.49 0.53 -0.01 1.05 9.09 -2.02 -2.77 114.58 120.94 1mld h GLU 60 Ca 0.45 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.82 1mld h GLU 60 Cb 0.71 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 27.69 1mld h GLU 60 CO -0.41 0.38 -0.21 1.04 0.05 0.00 0.00 179.01 179.85 1mld n GLN 61 N -4.45 1.00 -0.17 1.06 6.02 0.67 -4.46 117.38 117.06 1mld n GLN 61 Ca 0.03 -0.60 -0.08 0.00 -0.01 0.00 0.00 57.00 56.35 1mld n GLN 61 Cb 0.09 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.87 1mld n GLN 61 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1mld h LEU 62 N 1.45 0.63 -0.84 1.08 6.46 -1.28 -2.89 115.31 119.92 1mld h LEU 62 Ca 0.00 -0.10 0.17 0.00 -0.12 0.00 0.00 57.88 57.83 1mld h LEU 62 Cb 0.51 -0.16 -0.10 0.00 -0.73 0.00 0.00 40.66 40.18 1mld h LEU 62 CO 0.00 0.55 0.39 1.55 -0.62 0.00 0.00 178.44 180.31 1mld h PRO 63 N 0.66 0.49 0.00 5.25 0.13 -1.79 -1.86 132.00 134.88 1mld h PRO 63 Ca 0.17 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.20 1mld h PRO 63 Cb 0.07 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.08 1mld h PRO 63 CO -0.03 0.32 -0.33 -0.44 -0.23 0.00 0.00 178.00 177.29 1mld h ASP 64 N 0.50 0.00 -0.25 1.44 3.32 -1.86 -0.12 116.42 119.45 1mld h ASP 64 Ca 0.49 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.36 1mld h ASP 64 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1mld h ASP 64 CO -0.43 0.33 -0.54 0.00 -1.72 0.00 0.00 179.24 176.88 1mld n LEU 66 N -4.06 0.57 -4.58 0.00 4.77 -0.79 -4.85 117.00 108.07 1mld n LEU 66 Ca -0.05 0.12 -0.41 0.00 -0.03 0.00 0.00 56.01 55.64 1mld n LEU 66 Cb 0.62 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 1mld n LEU 66 CO 0.50 0.04 1.92 1.17 -1.33 0.00 0.00 177.39 179.68 1mld n LYS 67 N -1.79 1.60 -0.49 3.23 3.00 -0.11 -3.01 118.16 120.58 1mld n LYS 67 Ca 0.04 0.33 0.00 0.00 -0.00 0.00 0.00 58.31 58.68 1mld n LYS 67 Cb 0.39 -3.29 0.00 0.00 0.00 0.00 0.00 35.03 32.13 1mld n LYS 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mld n GLY 68 N 5.89 0.75 3.77 3.14 0.00 -1.26 -5.02 105.19 112.46 1mld n GLY 68 Ca 0.33 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.96 1mld n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mld n ASP 70 N -0.01 1.71 -3.96 0.00 8.00 -0.11 -4.43 116.55 117.76 1mld n ASP 70 Ca 0.05 0.20 -0.19 0.00 0.71 0.00 0.00 54.79 55.56 1mld n ASP 70 Cb 0.48 -0.53 -0.15 0.00 -0.02 0.00 0.00 41.12 40.89 1mld n ASP 70 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1mld s VAL 71 N -2.56 0.63 -0.10 2.53 1.01 -1.00 -1.39 120.40 119.51 1mld s VAL 71 Ca -0.19 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.55 1mld s VAL 71 Cb 0.07 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.89 1mld s VAL 71 CO 0.77 0.21 -0.18 -0.69 0.00 0.00 0.00 175.10 175.21 1mld s VAL 72 N 0.31 1.64 -0.09 2.92 1.01 0.52 -1.92 120.40 124.79 1mld s VAL 72 Ca -0.04 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1mld s VAL 72 Cb -0.09 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1mld s VAL 72 CO 0.00 0.47 -0.21 0.54 0.00 0.00 0.00 175.10 175.90 1mld s VAL 73 N 0.77 1.79 -0.59 2.92 0.11 -0.31 -0.36 120.40 124.73 1mld s VAL 73 Ca -0.11 -0.86 0.01 0.00 -2.93 0.00 0.00 61.98 58.09 1mld s VAL 73 Cb -0.16 -1.56 0.15 0.00 -1.53 0.00 0.00 36.38 33.28 1mld s VAL 73 CO 0.02 0.50 0.37 -0.63 -3.33 0.00 0.00 175.10 172.02 1mld s ILE 74 N 0.43 3.16 -1.90 7.04 1.01 0.32 -1.63 121.20 129.63 1mld s ILE 74 Ca -0.18 -3.25 0.29 0.00 0.00 0.00 0.00 60.65 57.52 1mld s ILE 74 Cb -0.17 -3.11 0.53 0.00 0.01 0.00 0.00 42.46 39.72 1mld s ILE 74 CO 0.07 -0.86 1.87 -0.81 0.00 0.00 0.00 174.94 175.22 1mld n PRO 75 N 3.17 0.96 -1.71 2.79 -0.04 -1.23 -1.01 135.00 137.94 1mld n PRO 75 Ca 0.08 -0.38 -0.42 0.00 -0.04 0.00 0.00 63.50 62.74 1mld n PRO 75 Cb 0.35 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 1mld n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mld n ALA 76 N -0.69 1.50 0.00 0.55 0.00 -1.10 -4.51 120.51 116.27 1mld n ALA 76 Ca 0.17 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1mld n ALA 76 Cb 0.27 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1mld n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mld n GLY 77 N 0.92 2.28 3.82 0.00 0.00 -1.26 -4.43 105.19 106.52 1mld n GLY 77 Ca 0.05 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 1mld n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mld s VAL 78 N -1.92 4.90 0.54 1.61 0.11 -1.26 -4.99 120.40 119.38 1mld s VAL 78 Ca 0.00 1.00 -0.16 0.00 -2.93 0.00 0.00 61.98 59.89 1mld s VAL 78 Cb 0.00 -3.79 -0.07 0.00 -1.53 0.00 0.00 36.38 30.99 1mld s VAL 78 CO 0.00 0.57 1.00 -2.16 -3.33 0.00 0.00 175.10 171.18 1mld s PRO 79 N -1.09 3.81 0.65 1.54 0.04 -1.26 -4.91 135.00 133.78 1mld s PRO 79 Ca 0.26 0.99 -0.16 0.00 0.04 0.00 0.00 61.00 62.13 1mld s PRO 79 Cb -0.18 -2.11 -0.00 0.00 0.04 0.00 0.00 34.50 32.25 1mld s PRO 79 CO 0.16 -0.39 1.15 1.03 0.04 0.00 0.00 177.00 178.98 1mld s ARG 80 N -4.15 2.73 0.26 4.56 0.52 -1.26 -4.98 118.95 116.63 1mld s ARG 80 Ca 0.59 1.56 0.07 0.00 -0.52 0.00 0.00 55.73 57.44 1mld s ARG 80 Cb -0.11 -1.93 -0.03 0.00 0.52 0.00 0.00 34.95 33.40 1mld s ARG 80 CO 0.34 -1.34 0.22 0.15 0.02 0.00 0.00 175.30 174.69 1mld s LYS 81 N -3.85 2.94 0.29 3.54 -0.14 -1.26 -4.50 119.74 116.76 1mld s LYS 81 Ca 0.71 -1.06 -0.30 0.00 -1.36 0.00 0.00 55.97 53.97 1mld s LYS 81 Cb -0.24 -2.58 -0.13 0.00 -1.68 0.00 0.00 37.83 33.20 1mld s LYS 81 CO 0.39 0.37 1.33 -2.30 -0.76 0.00 0.00 175.35 174.39 1mld n PRO 82 N -1.21 2.04 0.00 -1.68 -0.02 -1.26 -2.25 135.00 130.61 1mld n PRO 82 Ca -0.07 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1mld n PRO 82 Cb 0.58 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1mld n PRO 82 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mld n GLY 83 N 1.49 1.58 3.88 -1.23 0.00 -1.26 -5.03 105.19 104.61 1mld n GLY 83 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1mld n GLY 83 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1mld s MET 84 N -0.57 3.72 0.60 1.61 0.00 -0.96 -5.11 119.30 118.59 1mld s MET 84 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 55.69 55.84 1mld s MET 84 Cb 0.00 -2.88 0.08 0.00 0.00 0.00 0.00 34.83 32.03 1mld s MET 84 CO 0.00 0.48 0.83 0.95 0.00 0.00 0.00 175.02 177.28 1mld s THR 85 N -1.57 2.34 -0.07 10.11 -4.23 -1.26 -4.85 115.64 116.11 1mld s THR 85 Ca 0.39 -0.81 0.18 0.00 -1.18 0.00 0.00 61.69 60.26 1mld s THR 85 Cb -0.13 -2.53 0.12 0.00 1.34 0.00 0.00 72.50 71.30 1mld s THR 85 CO 0.21 0.00 1.57 0.03 -0.54 0.00 0.00 174.62 175.89 1mld h ARG 86 N -0.02 0.00 0.00 3.99 3.08 -1.99 -2.95 114.38 116.49 1mld h ARG 86 Ca -0.35 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.64 1mld h ARG 86 Cb 1.28 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.32 1mld h ARG 86 CO 0.43 0.41 -0.27 0.22 -1.07 0.00 0.00 179.97 179.68 1mld h ASP 87 N 0.00 0.00 0.20 7.04 3.58 -1.97 -2.22 116.42 123.05 1mld h ASP 87 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 1mld h ASP 87 Cb 1.17 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.22 1mld h ASP 87 CO 0.05 0.27 -0.06 0.44 -2.88 0.00 0.00 179.24 177.07 1mld h ASP 88 N 0.00 0.00 0.64 2.28 3.32 -1.91 -1.71 116.42 119.04 1mld h ASP 88 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1mld h ASP 88 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1mld h ASP 88 CO 0.04 0.06 -0.03 0.18 -1.72 0.00 0.00 179.24 177.76 1mld n LEU 89 N -3.65 0.07 0.09 1.55 4.32 -0.84 -4.40 117.00 114.14 1mld n LEU 89 Ca -0.02 0.29 -0.12 0.00 -0.02 0.00 0.00 56.01 56.14 1mld n LEU 89 Cb 0.16 -0.32 -0.06 0.00 -1.62 0.00 0.00 43.42 41.58 1mld n LEU 89 CO 0.28 0.01 0.79 0.15 -1.22 0.00 0.00 177.39 177.40 1mld h PHE 90 N 0.06 -0.29 -0.50 -1.77 3.57 -1.41 -1.13 116.94 115.47 1mld h PHE 90 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1mld h PHE 90 Cb 0.35 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1mld h PHE 90 CO 0.00 -0.17 0.27 -0.91 -2.23 0.00 0.00 178.31 175.26 1mld h ASN 91 N -0.23 0.61 0.47 0.41 2.35 -1.81 0.50 115.58 117.87 1mld h ASN 91 Ca 0.02 -0.04 -0.30 0.00 -0.55 0.00 0.00 56.30 55.42 1mld h ASN 91 Cb 0.24 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.46 1mld h ASN 91 CO -0.06 0.50 -1.42 0.00 -1.65 0.00 0.00 177.43 174.80 1mld h THR 92 N 0.69 1.30 0.00 2.81 1.03 -1.83 -3.39 112.91 113.53 1mld h THR 92 Ca 0.18 -2.87 -0.22 0.00 -0.01 0.00 0.00 66.41 63.49 1mld h THR 92 Cb 0.03 2.89 -0.04 0.00 -1.07 0.00 0.00 68.15 69.96 1mld h THR 92 CO -0.03 0.85 -1.35 0.78 -0.01 0.00 0.00 175.52 175.76 1mld h ASN 93 N 0.09 0.00 -0.38 0.00 4.21 -0.77 -3.33 115.58 115.39 1mld h ASN 93 Ca -0.21 0.00 0.05 0.00 1.21 0.00 0.00 56.30 57.35 1mld h ASN 93 Cb 2.04 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 39.19 1mld h ASN 93 CO 0.20 0.81 0.10 0.00 -1.29 0.00 0.00 177.43 177.26 1mld h ALA 94 N 1.19 0.42 -0.98 -0.83 0.00 -1.10 -1.41 119.26 116.55 1mld h ALA 94 Ca -0.17 0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1mld h ALA 94 Cb 1.77 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.57 1mld h ALA 94 CO 0.08 -0.30 0.63 1.15 0.00 0.00 0.00 179.25 180.81 1mld h THR 95 N 0.23 1.14 0.39 0.00 2.02 -1.75 0.63 112.91 115.57 1mld h THR 95 Ca 0.18 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.93 1mld h THR 95 Cb 0.19 -0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.44 1mld h THR 95 CO -0.22 0.22 -0.19 0.40 0.37 0.00 0.00 175.52 176.11 1mld h ILE 96 N 1.20 0.62 -0.17 3.11 1.08 -1.53 -1.55 117.51 120.27 1mld h ILE 96 Ca 0.40 -0.23 0.01 0.00 -0.39 0.00 0.00 64.86 64.65 1mld h ILE 96 Cb 0.06 0.74 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 1mld h ILE 96 CO -0.14 0.04 0.09 0.58 -0.69 0.00 0.00 178.15 178.04 1mld h VAL 97 N -0.65 1.01 -0.20 1.67 2.07 -1.11 -1.57 116.25 117.47 1mld h VAL 97 Ca -0.05 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1mld h VAL 97 Cb 0.47 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1mld h VAL 97 CO 0.09 0.04 0.08 0.00 0.02 0.00 0.00 177.57 177.79 1mld h ALA 98 N 1.08 1.77 0.00 1.67 0.00 -0.81 0.46 119.26 123.44 1mld h ALA 98 Ca 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1mld h ALA 98 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1mld h ALA 98 CO -0.04 0.19 -0.00 1.15 0.00 0.00 0.00 179.25 180.55 1mld h THR 99 N 0.28 1.40 -0.13 0.00 2.02 -0.97 -3.05 112.91 112.45 1mld h THR 99 Ca 0.07 -1.19 -0.17 0.00 0.77 0.00 0.00 66.41 65.89 1mld h THR 99 Cb 0.06 2.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 1mld h THR 99 CO -0.01 0.31 -0.63 -0.07 0.37 0.00 0.00 175.52 175.49 1mld h LEU 100 N -0.51 0.54 -0.46 2.58 3.38 -0.88 -3.06 115.31 116.89 1mld h LEU 100 Ca -0.00 -0.31 -0.17 0.00 0.09 0.00 0.00 57.88 57.48 1mld h LEU 100 Cb 0.51 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1mld h LEU 100 CO 0.00 1.03 -0.75 0.71 0.09 0.00 0.00 178.44 179.53 1mld h THR 101 N 0.34 1.45 -0.86 0.22 1.35 -1.04 -2.57 112.91 111.80 1mld h THR 101 Ca -0.01 -2.32 0.04 0.00 -0.55 0.00 0.00 66.41 63.57 1mld h THR 101 Cb 1.18 2.25 -0.05 0.00 -1.73 0.00 0.00 68.15 69.80 1mld h THR 101 CO 0.11 0.68 0.57 0.00 -0.25 0.00 0.00 175.52 176.63 1mld h ALA 102 N 1.09 1.48 -0.09 6.62 0.00 -1.52 0.19 119.26 127.03 1mld h ALA 102 Ca -0.03 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 1mld h ALA 102 Cb 1.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1mld h ALA 102 CO 0.11 0.43 -0.67 0.00 0.00 0.00 0.00 179.25 179.12 1mld h ALA 103 N 1.50 0.70 -0.29 0.00 0.00 -1.43 -1.18 119.26 118.56 1mld h ALA 103 Ca 0.35 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1mld h ALA 103 Cb 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1mld h ALA 103 CO -0.11 0.75 0.12 0.00 0.00 0.00 0.00 179.25 180.01 1mld h ALA 105 N 0.97 1.40 0.09 0.00 0.00 -0.93 0.87 119.26 121.66 1mld h ALA 105 Ca 0.10 -0.05 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 1mld h ALA 105 Cb 0.16 -0.34 0.02 0.00 0.00 0.00 0.00 17.79 17.64 1mld h ALA 105 CO -0.01 0.53 -1.18 1.96 0.00 0.00 0.00 179.25 180.55 1mld h GLN 106 N 1.17 0.59 0.00 0.00 4.20 -0.99 -3.37 115.11 116.72 1mld h GLN 106 Ca 0.35 -0.75 0.00 0.00 0.06 0.00 0.00 58.65 58.30 1mld h GLN 106 Cb -0.05 0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1mld h GLN 106 CO -0.09 1.33 -1.41 0.72 -0.67 0.00 0.00 178.83 178.71 1mld n HIS 107 N -3.78 0.00 -2.89 2.96 8.25 0.10 -4.71 115.22 115.16 1mld n HIS 107 Ca -0.12 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.22 1mld n HIS 107 Cb 0.96 -0.25 0.04 0.00 1.12 0.00 0.00 29.99 31.86 1mld n HIS 107 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mld h PRO 109 N 2.86 0.00 -0.01 0.00 0.13 -1.65 -2.17 132.00 131.16 1mld h PRO 109 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1mld h PRO 109 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1mld h PRO 109 CO 0.30 0.00 -0.17 -0.25 -0.23 0.00 0.00 178.00 177.65 1mld n ASP 110 N -2.33 1.53 -4.81 1.44 8.00 -1.26 -4.93 116.55 114.18 1mld n ASP 110 Ca 0.00 -1.30 -0.32 0.00 0.71 0.00 0.00 54.79 53.89 1mld n ASP 110 Cb 0.15 0.12 0.03 0.00 -0.02 0.00 0.00 41.12 41.39 1mld n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mld s ALA 111 N -2.27 2.72 0.10 2.24 0.00 -0.82 -5.02 121.76 118.71 1mld s ALA 111 Ca 0.29 0.24 -0.29 0.00 0.00 0.00 0.00 51.96 52.20 1mld s ALA 111 Cb 0.20 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 20.06 1mld s ALA 111 CO 0.44 -1.00 0.90 -1.64 0.00 0.00 0.00 175.76 174.46 1mld s MET 112 N -4.55 4.65 -0.13 0.00 1.00 -0.49 -4.89 119.30 114.89 1mld s MET 112 Ca 0.61 1.34 0.01 0.00 0.00 0.00 0.00 55.69 57.65 1mld s MET 112 Cb -0.15 -3.36 -0.00 0.00 0.00 0.00 0.00 34.83 31.31 1mld s MET 112 CO 0.46 0.26 -0.18 0.42 0.00 0.00 0.00 175.02 175.98 1mld s ILE 113 N -0.11 2.56 -0.24 2.53 -1.09 -0.63 -0.36 121.20 123.87 1mld s ILE 113 Ca 0.44 -0.83 0.02 0.00 -2.23 0.00 0.00 60.65 58.05 1mld s ILE 113 Cb -0.23 -2.05 0.06 0.00 -1.58 0.00 0.00 42.46 38.66 1mld s ILE 113 CO 0.28 0.53 -0.08 0.00 -1.23 0.00 0.00 174.94 174.45 1mld s ILE 115 N 1.30 5.12 -0.15 0.00 -1.09 0.47 -0.52 121.20 126.32 1mld s ILE 115 Ca -0.07 0.71 0.15 0.00 -2.23 0.00 0.00 60.65 59.21 1mld s ILE 115 Cb -0.19 -3.78 -0.21 0.00 -1.58 0.00 0.00 42.46 36.71 1mld s ILE 115 CO -0.06 0.10 0.08 -0.38 -1.23 0.00 0.00 174.94 173.45 1mld n ILE 116 N 5.15 1.06 -1.69 2.92 5.41 -0.18 -1.43 119.36 130.60 1mld n ILE 116 Ca -0.06 -0.68 -0.60 0.00 1.00 0.00 0.00 62.75 62.41 1mld n ILE 116 Cb 0.50 -0.52 -0.08 0.00 -0.71 0.00 0.00 39.64 38.83 1mld n ILE 116 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1mld n SER 117 N -2.58 1.87 -4.77 4.38 7.64 -1.07 -4.73 113.62 114.36 1mld n SER 117 Ca -0.25 1.11 -0.40 0.00 1.01 0.00 0.00 58.87 60.34 1mld n SER 117 Cb 1.00 -1.07 -0.00 0.00 -1.01 0.00 0.00 64.21 63.13 1mld n SER 117 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1mld s ASN 118 N 2.84 6.28 -0.26 6.43 0.01 -1.26 -2.92 114.94 126.07 1mld s ASN 118 Ca 0.98 2.78 -0.19 0.00 -0.71 0.00 0.00 52.86 55.71 1mld s ASN 118 Cb -1.17 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 37.82 1mld s ASN 118 CO 0.67 -0.88 0.58 -2.16 -1.51 0.00 0.00 177.10 173.80 1mld s PRO 119 N -2.20 4.09 0.56 -0.60 0.04 -1.26 -4.75 135.00 130.87 1mld s PRO 119 Ca 0.56 0.46 0.25 0.00 0.04 0.00 0.00 61.00 62.30 1mld s PRO 119 Cb -0.41 -3.65 1.50 0.00 0.04 0.00 0.00 34.50 31.98 1mld s PRO 119 CO 0.53 -0.39 2.09 0.28 0.04 0.00 0.00 177.00 179.55 1mld h VAL 120 N 5.41 0.68 0.00 -0.36 2.07 -1.81 0.57 116.25 122.81 1mld h VAL 120 Ca -0.28 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1mld h VAL 120 Cb 1.13 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1mld h VAL 120 CO 0.75 0.00 -0.00 0.78 0.02 0.00 0.00 177.57 179.12 1mld h ASN 121 N 0.00 0.00 0.00 0.57 2.35 -1.90 -2.05 115.58 114.55 1mld h ASN 121 Ca 0.11 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.69 1mld h ASN 121 Cb 0.48 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.82 1mld h ASN 121 CO -0.00 0.00 -1.69 -1.20 -1.65 0.00 0.00 177.43 172.89 1mld n SER 122 N -3.09 2.41 0.18 5.81 7.64 0.04 -3.70 113.62 122.90 1mld n SER 122 Ca -0.02 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.91 1mld n SER 122 Cb 0.16 0.87 0.32 0.00 -1.01 0.00 0.00 64.21 64.55 1mld n SER 122 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1mld h THR 123 N 0.00 0.96 0.03 0.44 2.02 -0.78 -2.20 112.91 113.37 1mld h THR 123 Ca -0.24 -1.59 -0.13 0.00 0.77 0.00 0.00 66.41 65.22 1mld h THR 123 Cb 1.48 1.95 0.01 0.00 -1.74 0.00 0.00 68.15 69.85 1mld h THR 123 CO 0.01 0.40 -0.53 0.40 0.37 0.00 0.00 175.52 176.17 1mld h ILE 124 N 0.00 1.49 -0.88 3.11 1.08 -1.65 -1.59 117.51 119.07 1mld h ILE 124 Ca -0.00 -2.15 0.22 0.00 -0.39 0.00 0.00 64.86 62.54 1mld h ILE 124 Cb 0.92 2.80 -0.13 0.00 -3.07 0.00 0.00 36.82 37.34 1mld h ILE 124 CO 0.05 0.61 0.34 -0.65 -0.69 0.00 0.00 178.15 177.81 1mld h PRO 125 N -0.30 0.34 -0.32 2.37 0.11 -1.79 0.21 132.00 132.62 1mld h PRO 125 Ca -0.07 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 1mld h PRO 125 Cb 1.29 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1mld h PRO 125 CO 0.10 0.22 0.16 0.82 -0.21 0.00 0.00 178.00 179.09 1mld h ILE 126 N 0.35 1.16 -0.66 4.15 2.04 -1.29 -1.89 117.51 121.37 1mld h ILE 126 Ca 0.54 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 1mld h ILE 126 Cb 1.04 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1mld h ILE 126 CO -0.55 0.16 0.26 0.74 0.00 0.00 0.00 178.15 178.76 1mld h THR 127 N 0.39 1.23 -0.01 -0.27 2.02 -0.54 -1.62 112.91 114.11 1mld h THR 127 Ca 0.11 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.56 1mld h THR 127 Cb 0.12 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1mld h THR 127 CO -0.01 0.29 0.00 0.00 0.37 0.00 0.00 175.52 176.17 1mld h ALA 128 N 1.33 0.01 -0.19 6.16 0.00 -0.59 -1.95 119.26 124.03 1mld h ALA 128 Ca 0.22 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1mld h ALA 128 Cb 0.19 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1mld h ALA 128 CO -0.02 -0.38 -0.24 0.93 0.00 0.00 0.00 179.25 179.54 1mld h GLU 129 N -0.20 0.34 -0.05 0.00 4.39 -1.29 0.81 114.58 118.58 1mld h GLU 129 Ca 0.00 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1mld h GLU 129 Cb 0.22 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1mld h GLU 129 CO -0.00 0.56 0.02 0.28 -1.16 0.00 0.00 179.01 178.71 1mld h VAL 130 N 0.31 1.14 -0.47 3.13 2.07 -1.27 -0.62 116.25 120.53 1mld h VAL 130 Ca 0.05 -0.42 -0.07 0.00 0.82 0.00 0.00 66.70 67.08 1mld h VAL 130 Cb 0.59 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1mld h VAL 130 CO 0.04 0.12 0.02 -0.26 0.02 0.00 0.00 177.57 177.51 1mld h PHE 131 N -0.08 0.81 -0.55 1.57 -1.00 -0.71 -2.10 116.94 114.88 1mld h PHE 131 Ca 0.02 -0.10 -0.02 0.00 2.81 0.00 0.00 57.97 60.67 1mld h PHE 131 Cb 0.17 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.48 1mld h PHE 131 CO -0.02 0.74 0.26 0.87 -1.61 0.00 0.00 178.31 178.55 1mld h LYS 132 N 0.72 0.79 -0.58 1.51 1.57 -0.73 -1.26 116.57 118.59 1mld h LYS 132 Ca 0.15 -0.12 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 1mld h LYS 132 Cb 0.41 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1mld h LYS 132 CO 0.01 0.65 0.39 0.87 -0.57 0.00 0.00 179.45 180.81 1mld h LYS 133 N 0.74 0.45 -0.19 3.15 1.57 -0.69 0.18 116.57 121.78 1mld h LYS 133 Ca 0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1mld h LYS 133 Cb 0.13 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1mld h LYS 133 CO -0.02 0.30 0.00 0.72 -0.57 0.00 0.00 179.45 179.87 1mld n HIS 134 N -4.47 0.23 -2.43 -1.35 8.25 -0.53 -4.93 115.22 109.98 1mld n HIS 134 Ca 0.09 -0.12 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 1mld n HIS 134 Cb 0.31 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1mld n HIS 134 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1mld n GLY 135 N 1.21 -0.24 0.03 -1.41 0.00 0.63 -4.89 105.19 100.52 1mld n GLY 135 Ca 0.17 -0.21 0.01 0.00 0.00 0.00 0.00 46.02 45.98 1mld n GLY 135 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1mld n VAL 136 N -4.06 0.64 -2.47 1.61 3.14 -0.97 -5.03 118.33 111.20 1mld n VAL 136 Ca -0.15 -0.67 -0.43 0.00 -2.96 0.00 0.00 64.34 60.12 1mld n VAL 136 Cb 0.62 0.63 -0.02 0.00 -1.06 0.00 0.00 33.84 34.01 1mld n VAL 136 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 1mld s TYR 137 N -0.72 2.83 -0.27 1.45 5.04 -1.21 -4.94 117.35 119.53 1mld s TYR 137 Ca 0.02 0.99 0.03 0.00 -2.44 0.00 0.00 57.07 55.67 1mld s TYR 137 Cb 0.02 -3.72 0.06 0.00 0.35 0.00 0.00 41.96 38.68 1mld s TYR 137 CO 0.00 -1.51 -0.08 1.21 -1.34 0.00 0.00 175.55 173.83 1mld s ASN 138 N 2.30 4.53 0.04 4.32 3.04 -1.26 -4.96 114.94 122.94 1mld s ASN 138 Ca 0.54 -1.47 0.03 0.00 0.04 0.00 0.00 52.86 51.99 1mld s ASN 138 Cb -0.17 -1.57 0.16 0.00 -1.54 0.00 0.00 41.25 38.12 1mld s ASN 138 CO 0.18 -0.22 1.10 -0.81 -3.04 0.00 0.00 177.10 174.31 1mld n PRO 139 N 4.43 0.02 0.00 0.43 -0.04 -1.26 -1.80 135.00 136.77 1mld n PRO 139 Ca -0.12 0.50 0.14 0.00 -0.04 0.00 0.00 63.50 63.98 1mld n PRO 139 Cb 0.42 -1.55 0.56 0.00 -0.04 0.00 0.00 33.50 32.89 1mld n PRO 139 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1mld n ASN 140 N -1.58 0.14 -0.16 3.54 5.03 -1.26 -3.86 115.26 117.10 1mld n ASN 140 Ca 0.00 0.20 0.02 0.00 0.87 0.00 0.00 54.58 55.67 1mld n ASN 140 Cb 0.01 -0.29 0.03 0.00 -1.02 0.00 0.00 39.78 38.51 1mld n ASN 140 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1mld n LYS 141 N -1.44 1.69 -4.58 3.52 5.02 -0.75 -1.52 118.16 120.10 1mld n LYS 141 Ca 0.08 -1.31 -0.33 0.00 -2.02 0.00 0.00 58.31 54.73 1mld n LYS 141 Cb 0.33 -1.07 -0.14 0.00 -0.02 0.00 0.00 35.03 34.12 1mld n LYS 141 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1mld s ILE 142 N -0.73 3.02 -0.09 -0.18 1.01 -1.25 -1.61 121.20 121.37 1mld s ILE 142 Ca 0.06 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 60.06 1mld s ILE 142 Cb 0.03 -2.29 0.02 0.00 0.01 0.00 0.00 42.46 40.23 1mld s ILE 142 CO 0.04 0.51 -0.12 -0.36 0.00 0.00 0.00 174.94 175.01 1mld s PHE 143 N 0.62 1.62 -0.48 3.97 0.08 0.09 -4.75 117.98 119.13 1mld s PHE 143 Ca -0.07 -0.69 -0.27 0.00 0.12 0.00 0.00 56.93 56.03 1mld s PHE 143 Cb -0.15 -1.21 0.03 0.00 -0.57 0.00 0.00 43.02 41.12 1mld s PHE 143 CO 0.03 -0.38 1.01 0.20 -0.10 0.00 0.00 175.22 175.98 1mld s GLY 144 N 0.94 1.39 -0.59 4.36 0.00 -0.05 -0.39 107.32 112.98 1mld s GLY 144 Ca -0.09 -0.73 -0.28 0.00 0.00 0.00 0.00 44.72 43.62 1mld s GLY 144 CO 0.00 2.19 1.37 0.14 0.00 0.00 0.00 173.10 176.80 1mld s VAL 145 N 4.07 3.80 -2.03 1.40 1.01 -0.51 -1.61 120.40 126.53 1mld s VAL 145 Ca 0.40 0.66 0.19 0.00 0.00 0.00 0.00 61.98 63.24 1mld s VAL 145 Cb -0.09 -4.54 0.37 0.00 0.00 0.00 0.00 36.38 32.12 1mld s VAL 145 CO 0.28 -1.28 1.31 0.35 0.00 0.00 0.00 175.10 175.75 1mld n THR 146 N 6.77 0.55 -0.11 3.92 -2.24 -1.26 -4.73 114.28 117.19 1mld n THR 146 Ca 0.11 -0.78 0.19 0.00 -2.27 0.00 0.00 64.05 61.30 1mld n THR 146 Cb 0.49 0.91 0.60 0.00 -2.10 0.00 0.00 70.33 70.23 1mld n THR 146 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1mld h THR 147 N 3.75 0.74 -0.17 4.28 2.02 -1.87 -0.70 112.91 120.95 1mld h THR 147 Ca 0.00 -0.07 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1mld h THR 147 Cb 0.88 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1mld h THR 147 CO 0.00 0.04 0.12 0.25 0.37 0.00 0.00 175.52 176.30 1mld h LEU 148 N 0.21 0.08 -0.69 2.58 5.85 -1.86 -0.56 115.31 120.93 1mld h LEU 148 Ca 0.34 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.95 1mld h LEU 148 Cb 1.03 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 1mld h LEU 148 CO -0.07 0.06 -0.12 0.44 -0.34 0.00 0.00 178.44 178.41 1mld h ASP 149 N 0.10 0.89 -0.09 1.25 3.32 -1.51 -0.55 116.42 119.83 1mld h ASP 149 Ca 0.08 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1mld h ASP 149 Cb 0.19 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 1mld h ASP 149 CO -0.01 1.02 -0.04 0.40 -1.72 0.00 0.00 179.24 178.89 1mld h ILE 150 N 0.79 1.31 -0.33 0.35 5.03 -1.26 -1.30 117.51 122.10 1mld h ILE 150 Ca 0.13 -1.03 0.06 0.00 -0.12 0.00 0.00 64.86 63.90 1mld h ILE 150 Cb 0.65 1.81 -0.06 0.00 -3.03 0.00 0.00 36.82 36.19 1mld h ILE 150 CO 0.05 0.29 -0.04 0.58 -0.68 0.00 0.00 178.15 178.35 1mld h VAL 151 N -0.17 0.71 -0.19 1.67 2.07 -1.12 0.12 116.25 119.34 1mld h VAL 151 Ca 0.02 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1mld h VAL 151 Cb 0.47 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1mld h VAL 151 CO 0.01 0.01 0.10 0.03 0.02 0.00 0.00 177.57 177.75 1mld h ARG 152 N 0.05 0.22 -0.57 1.57 3.08 -1.03 -1.17 114.38 116.52 1mld h ARG 152 Ca 0.16 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.22 1mld h ARG 152 Cb 0.23 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 1mld h ARG 152 CO -0.30 0.14 0.35 0.00 -1.07 0.00 0.00 179.97 179.09 1mld h ALA 153 N 1.09 0.74 -0.76 0.04 0.00 -0.65 0.65 119.26 120.36 1mld h ALA 153 Ca 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1mld h ALA 153 Cb 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1mld h ALA 153 CO -0.04 0.07 0.27 -0.91 0.00 0.00 0.00 179.25 178.64 1mld h ASN 154 N 0.69 1.08 -0.28 0.00 -0.26 -0.39 -0.11 115.58 116.31 1mld h ASN 154 Ca 0.23 -0.19 -0.09 0.00 -0.56 0.00 0.00 56.30 55.68 1mld h ASN 154 Cb 0.02 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 36.99 1mld h ASN 154 CO -0.10 0.98 -0.19 0.00 -1.06 0.00 0.00 177.43 177.06 1mld h ALA 155 N 1.14 0.40 -0.09 -0.83 0.00 -0.80 0.54 119.26 119.62 1mld h ALA 155 Ca 0.25 -0.35 -0.24 0.00 0.00 0.00 0.00 54.91 54.57 1mld h ALA 155 Cb 0.26 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1mld h ALA 155 CO -0.01 0.33 -0.87 0.74 0.00 0.00 0.00 179.25 179.43 1mld h PHE 156 N 0.35 1.05 -0.35 0.00 0.04 -0.70 -2.04 116.94 115.30 1mld h PHE 156 Ca 0.05 -0.51 -0.12 0.00 2.80 0.00 0.00 57.97 60.20 1mld h PHE 156 Cb 0.73 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.72 1mld h PHE 156 CO 0.07 1.34 -0.27 0.28 -0.60 0.00 0.00 178.31 179.13 1mld h VAL 157 N 0.46 1.28 -0.75 -0.55 2.07 -1.06 -2.93 116.25 114.76 1mld h VAL 157 Ca -0.08 -1.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 1mld h VAL 157 Cb 1.51 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 1mld h VAL 157 CO 0.18 0.46 0.33 0.00 0.02 0.00 0.00 177.57 178.55 1mld h ALA 158 N 1.08 1.16 -0.05 1.67 0.00 -0.82 -2.78 119.26 119.53 1mld h ALA 158 Ca 0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1mld h ALA 158 Cb 0.77 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1mld h ALA 158 CO 0.06 0.62 -0.10 1.05 0.00 0.00 0.00 179.25 180.88 1mld h GLU 159 N 1.08 0.15 -0.26 0.00 4.11 -1.28 -1.07 114.58 117.31 1mld h GLU 159 Ca 0.26 -0.10 0.08 0.00 0.07 0.00 0.00 59.36 59.66 1mld h GLU 159 Cb 0.16 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1mld h GLU 159 CO -0.03 0.69 0.20 -0.07 0.07 0.00 0.00 179.01 179.87 1mld h LEU 160 N -0.37 0.00 -2.85 3.06 3.38 -1.58 -1.90 115.31 115.04 1mld h LEU 160 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1mld h LEU 160 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1mld h LEU 160 CO 0.02 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.84 1mld n LYS 161 N -4.35 2.84 -2.56 1.13 4.76 -1.05 -4.97 118.16 113.96 1mld n LYS 161 Ca 0.03 -2.25 -0.20 0.00 -2.87 0.00 0.00 58.31 53.02 1mld n LYS 161 Cb 0.36 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.18 1mld n LYS 161 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mld n GLY 162 N 0.85 -0.43 3.91 0.72 0.00 -0.72 -4.99 105.19 104.52 1mld n GLY 162 Ca 0.16 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1mld n GLY 162 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mld s LEU 163 N -5.78 4.16 -0.12 0.99 1.02 -0.48 -5.05 118.68 113.43 1mld s LEU 163 Ca 0.09 0.60 -0.30 0.00 0.02 0.00 0.00 54.13 54.54 1mld s LEU 163 Cb -0.04 -3.37 -0.02 0.00 0.02 0.00 0.00 46.19 42.77 1mld s LEU 163 CO 0.11 -0.09 1.25 -0.62 0.02 0.00 0.00 176.35 177.03 1mld s ASP 164 N -2.96 6.98 0.31 2.29 -1.08 -1.26 -4.62 116.67 116.33 1mld s ASP 164 Ca 0.42 1.76 0.08 0.00 -0.52 0.00 0.00 52.55 54.29 1mld s ASP 164 Cb -0.11 -2.55 0.83 0.00 -1.46 0.00 0.00 42.92 39.63 1mld s ASP 164 CO 0.28 -0.69 1.73 -0.65 0.52 0.00 0.00 175.17 176.35 1mld h PRO 165 N 7.93 0.56 -0.01 4.34 0.11 -1.90 0.16 132.00 143.19 1mld h PRO 165 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1mld h PRO 165 Cb 1.13 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1mld h PRO 165 CO 0.93 0.37 0.08 0.00 -0.21 0.00 0.00 178.00 179.17 1mld h ALA 166 N 1.71 1.13 -0.00 -0.75 0.00 -1.94 -1.38 119.26 118.03 1mld h ALA 166 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.53 1mld h ALA 166 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1mld h ALA 166 CO -0.47 -0.08 -0.43 0.54 0.00 0.00 0.00 179.25 178.81 1mld n ARG 167 N -3.11 0.22 -4.15 0.00 1.74 0.05 -4.94 116.66 106.47 1mld n ARG 167 Ca -0.03 -0.12 -0.34 0.00 -0.77 0.00 0.00 57.85 56.59 1mld n ARG 167 Cb 0.15 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.01 1mld n ARG 167 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1mld s VAL 168 N -2.87 4.65 -0.23 1.55 1.01 -0.52 -4.08 120.40 119.90 1mld s VAL 168 Ca 0.15 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 1mld s VAL 168 Cb 0.18 -3.09 0.12 0.00 0.00 0.00 0.00 36.38 33.59 1mld s VAL 168 CO 0.65 0.41 0.32 -0.55 0.00 0.00 0.00 175.10 175.93 1mld s SER 169 N -1.52 0.77 -0.12 3.32 0.15 0.51 -4.88 113.70 111.92 1mld s SER 169 Ca 0.20 -0.03 0.01 0.00 0.70 0.00 0.00 55.95 56.83 1mld s SER 169 Cb -0.12 0.80 0.02 0.00 -1.71 0.00 0.00 66.02 65.01 1mld s SER 169 CO 0.11 -0.32 -0.13 0.54 1.20 0.00 0.00 173.24 174.64 1mld s VAL 170 N 2.45 1.39 0.25 4.45 0.11 -1.26 -1.17 120.40 126.63 1mld s VAL 170 Ca 0.10 -0.55 -0.30 0.00 -2.93 0.00 0.00 61.98 58.31 1mld s VAL 170 Cb -0.15 -1.31 -0.09 0.00 -1.53 0.00 0.00 36.38 33.29 1mld s VAL 170 CO -0.16 0.43 1.13 -2.16 -3.33 0.00 0.00 175.10 171.00 1mld s PRO 171 N 1.32 4.59 -0.06 1.54 0.04 -1.26 -4.79 135.00 136.38 1mld s PRO 171 Ca -0.00 1.83 0.04 0.00 0.04 0.00 0.00 61.00 62.91 1mld s PRO 171 Cb -0.14 -3.20 -0.00 0.00 0.04 0.00 0.00 34.50 31.20 1mld s PRO 171 CO -0.06 0.12 -0.19 0.08 0.04 0.00 0.00 177.00 176.99 1mld s VAL 172 N -0.84 1.61 0.41 -0.36 1.01 -1.26 -0.82 120.40 120.15 1mld s VAL 172 Ca 0.47 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1mld s VAL 172 Cb -0.32 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1mld s VAL 172 CO 0.40 0.46 0.08 0.27 0.00 0.00 0.00 175.10 176.31 1mld s ILE 173 N 0.10 0.95 0.00 2.22 -4.36 0.10 -4.70 121.20 115.51 1mld s ILE 173 Ca -0.07 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.32 1mld s ILE 173 Cb -0.13 -2.45 0.00 0.00 1.25 0.00 0.00 42.46 41.13 1mld s ILE 173 CO 0.03 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.82 1mld n GLY 174 N -0.95 1.09 0.00 6.27 0.00 -0.92 -0.93 105.19 109.75 1mld n GLY 174 Ca -0.08 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1mld n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mld n GLY 175 N 0.00 2.92 2.38 -0.02 0.00 0.02 -0.77 105.19 109.72 1mld n GLY 175 Ca 0.00 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 44.98 1mld n GLY 175 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1mld n HIS 176 N 0.00 2.50 -3.47 1.61 -0.00 -1.26 -3.69 115.22 110.92 1mld n HIS 176 Ca 0.00 -3.98 0.01 0.00 0.46 0.00 0.00 57.72 54.21 1mld n HIS 176 Cb 0.00 -0.50 -0.04 0.00 -0.12 0.00 0.00 29.99 29.33 1mld n HIS 176 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1mld s ALA 177 N -2.18 -2.57 0.00 1.57 0.00 -1.26 -4.71 121.76 112.61 1mld s ALA 177 Ca 0.39 2.11 0.00 0.00 0.00 0.00 0.00 51.96 54.46 1mld s ALA 177 Cb 0.17 -1.97 0.00 0.00 0.00 0.00 0.00 23.12 21.32 1mld s ALA 177 CO -0.05 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.28 1mld n GLY 178 N 4.81 3.62 0.33 0.00 0.00 -1.26 -1.75 105.19 110.94 1mld n GLY 178 Ca -0.11 0.04 0.21 0.00 0.00 0.00 0.00 46.02 46.16 1mld n GLY 178 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mld h LYS 179 N 0.00 0.00 0.00 1.61 1.57 -1.99 -2.23 116.57 115.53 1mld h LYS 179 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1mld h LYS 179 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1mld h LYS 179 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.13 1mld n THR 180 N -3.23 0.74 -2.76 -0.16 -2.24 -0.71 -4.51 114.28 101.41 1mld n THR 180 Ca -0.03 0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.42 1mld n THR 180 Cb 0.09 -0.95 -0.04 0.00 -2.10 0.00 0.00 70.33 67.33 1mld n THR 180 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1mld s ILE 181 N -3.20 4.28 -0.40 2.28 1.01 -0.84 -0.80 121.20 123.54 1mld s ILE 181 Ca 0.07 0.53 -0.06 0.00 0.00 0.00 0.00 60.65 61.20 1mld s ILE 181 Cb 0.11 -4.58 0.09 0.00 0.01 0.00 0.00 42.46 38.08 1mld s ILE 181 CO 0.43 -1.15 0.20 -0.63 0.00 0.00 0.00 174.94 173.80 1mld s ILE 182 N 4.23 3.69 0.03 2.92 1.01 -0.11 -4.82 121.20 128.16 1mld s ILE 182 Ca 0.35 -1.65 -0.30 0.00 0.00 0.00 0.00 60.65 59.05 1mld s ILE 182 Cb -0.11 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 1mld s ILE 182 CO 0.22 -0.52 1.01 -2.16 0.00 0.00 0.00 174.94 173.49 1mld s PRO 183 N 1.29 4.57 -1.04 2.79 0.04 -1.26 -0.73 135.00 140.66 1mld s PRO 183 Ca 0.04 1.48 -0.11 0.00 0.04 0.00 0.00 61.00 62.45 1mld s PRO 183 Cb -0.23 -3.43 0.26 0.00 0.04 0.00 0.00 34.50 31.15 1mld s PRO 183 CO -0.01 -0.03 1.04 -0.51 0.04 0.00 0.00 177.00 177.53 1mld s LEU 184 N 0.79 6.40 0.29 -3.56 1.43 0.00 -4.80 118.68 119.24 1mld s LEU 184 Ca 0.52 -3.33 0.08 0.00 -1.03 0.00 0.00 54.13 50.37 1mld s LEU 184 Cb -0.23 -2.22 0.44 0.00 0.03 0.00 0.00 46.19 44.22 1mld s LEU 184 CO 0.29 -0.38 1.68 0.40 0.23 0.00 0.00 176.35 178.56 1mld h ILE 185 N 4.00 1.35 -0.00 -0.59 1.08 -1.93 -2.27 117.51 119.15 1mld h ILE 185 Ca 0.17 -1.70 0.00 0.00 -0.39 0.00 0.00 64.86 62.94 1mld h ILE 185 Cb 0.92 1.85 -0.00 0.00 -3.07 0.00 0.00 36.82 36.52 1mld h ILE 185 CO 0.96 0.50 0.05 0.77 -0.69 0.00 0.00 178.15 179.73 1mld h SER 186 N 0.11 0.00 -0.60 1.72 4.64 -1.93 0.12 113.55 117.61 1mld h SER 186 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mld h SER 186 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1mld h SER 186 CO 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.03 1mld n GLN 187 N -3.05 4.32 -2.16 4.77 6.02 -0.85 -4.98 117.38 121.45 1mld n GLN 187 Ca -0.03 -3.04 -0.41 0.00 -0.01 0.00 0.00 57.00 53.52 1mld n GLN 187 Cb 0.12 -2.09 -0.02 0.00 1.02 0.00 0.00 30.24 29.27 1mld n GLN 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mld s THR 189 N -0.78 3.79 0.96 0.00 2.01 -0.31 -3.69 115.64 117.62 1mld s THR 189 Ca 0.51 -0.36 -0.15 0.00 0.31 0.00 0.00 61.69 62.00 1mld s THR 189 Cb -0.39 -2.72 0.18 0.00 0.01 0.00 0.00 72.50 69.59 1mld s THR 189 CO 0.48 0.42 1.24 -2.16 -0.69 0.00 0.00 174.62 173.91 1mld s PRO 190 N 1.19 0.67 0.07 4.92 0.04 -1.26 -0.36 135.00 140.27 1mld s PRO 190 Ca 0.03 -0.16 -0.10 0.00 0.04 0.00 0.00 61.00 60.81 1mld s PRO 190 Cb -0.15 -1.83 0.03 0.00 0.04 0.00 0.00 34.50 32.60 1mld s PRO 190 CO 0.01 -2.43 0.60 0.36 0.04 0.00 0.00 177.00 175.57 1mld n LYS 191 N -3.84 -0.13 -0.82 4.56 2.85 -1.24 -4.97 118.16 114.57 1mld n LYS 191 Ca 0.12 0.59 0.00 0.00 -1.05 0.00 0.00 58.31 57.97 1mld n LYS 191 Cb 0.60 -0.87 0.00 0.00 -0.65 0.00 0.00 35.03 34.11 1mld n LYS 191 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 1mld n VAL 192 N -4.52 0.00 -4.66 0.58 0.24 -1.26 -4.69 118.33 104.02 1mld n VAL 192 Ca 0.02 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 61.99 1mld n VAL 192 Cb 0.13 -0.27 -0.11 0.00 -1.47 0.00 0.00 33.84 32.11 1mld n VAL 192 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1mld s ASP 193 N -0.01 4.56 0.02 -1.34 1.11 -1.26 -4.98 116.67 114.78 1mld s ASP 193 Ca 0.00 -0.05 0.02 0.00 0.18 0.00 0.00 52.55 52.70 1mld s ASP 193 Cb 0.00 -1.12 -0.02 0.00 1.07 0.00 0.00 42.92 42.85 1mld s ASP 193 CO 0.00 0.36 -0.07 -0.36 1.18 0.00 0.00 175.17 176.28 1mld s PHE 194 N -0.80 0.59 0.41 4.23 0.08 -1.26 -5.14 117.98 116.08 1mld s PHE 194 Ca 0.12 -0.31 -0.26 0.00 0.12 0.00 0.00 56.93 56.60 1mld s PHE 194 Cb -0.11 -0.36 -0.09 0.00 -0.57 0.00 0.00 43.02 41.89 1mld s PHE 194 CO 0.01 -0.05 1.33 -2.14 -0.10 0.00 0.00 175.22 174.28 1mld s PRO 195 N -0.93 3.94 0.50 0.24 0.02 -1.26 -4.79 135.00 132.72 1mld s PRO 195 Ca -0.05 2.22 0.16 0.00 0.02 0.00 0.00 61.00 63.36 1mld s PRO 195 Cb -0.06 -2.76 1.22 0.00 0.02 0.00 0.00 34.50 32.91 1mld s PRO 195 CO 0.00 -0.53 2.09 0.37 -0.33 0.00 0.00 177.00 178.60 1mld h GLN 196 N 2.66 0.11 -0.55 5.54 5.75 -2.01 0.27 115.11 126.90 1mld h GLN 196 Ca -0.50 -0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.03 1mld h GLN 196 Cb 1.25 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.73 1mld h GLN 196 CO 0.62 0.08 0.32 0.38 -2.65 0.00 0.00 178.83 177.58 1mld h ASP 197 N 0.12 0.50 1.38 -0.69 2.03 -1.99 0.19 116.42 117.95 1mld h ASP 197 Ca 0.10 0.01 -0.09 0.00 -0.73 0.00 0.00 57.03 56.33 1mld h ASP 197 Cb 0.25 -0.09 -0.01 0.00 -0.83 0.00 0.00 39.33 38.65 1mld h ASP 197 CO -0.01 0.34 -0.40 1.56 -1.03 0.00 0.00 179.24 179.70 1mld h GLN 198 N 0.62 0.00 0.13 4.15 4.20 -1.11 -2.60 115.11 120.51 1mld h GLN 198 Ca 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.93 1mld h GLN 198 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1mld h GLN 198 CO -0.12 0.40 -0.06 1.25 -0.67 0.00 0.00 178.83 179.63 1mld h LEU 199 N 0.00 -0.15 -0.71 1.46 5.85 0.10 -0.91 115.31 120.95 1mld h LEU 199 Ca -0.00 -0.32 0.10 0.00 0.84 0.00 0.00 57.88 58.50 1mld h LEU 199 Cb 1.20 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.20 1mld h LEU 199 CO 0.05 0.27 0.33 0.28 -0.34 0.00 0.00 178.44 179.03 1mld h SER 200 N -0.61 0.40 -0.44 1.25 0.02 -0.66 -0.86 113.55 112.65 1mld h SER 200 Ca -0.02 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1mld h SER 200 Cb 0.47 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1mld h SER 200 CO 0.03 0.22 0.19 0.74 -1.14 0.00 0.00 176.83 176.87 1mld h THR 201 N 0.55 1.19 -0.68 -2.27 2.02 -1.37 -0.57 112.91 111.78 1mld h THR 201 Ca 0.36 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 1mld h THR 201 Cb 0.42 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1mld h THR 201 CO -0.30 0.22 0.32 0.25 0.37 0.00 0.00 175.52 176.38 1mld h LEU 202 N 0.56 0.89 -0.26 2.58 6.46 -0.77 0.24 115.31 125.01 1mld h LEU 202 Ca 0.15 -0.14 -0.11 0.00 -0.12 0.00 0.00 57.88 57.66 1mld h LEU 202 Cb 0.16 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 39.86 1mld h LEU 202 CO -0.01 0.78 -0.28 0.71 -0.62 0.00 0.00 178.44 179.01 1mld h THR 203 N 0.94 1.31 -0.59 1.05 1.35 -0.71 -1.88 112.91 114.38 1mld h THR 203 Ca 0.23 -1.46 0.11 0.00 -0.55 0.00 0.00 66.41 64.75 1mld h THR 203 Cb 0.13 1.65 -0.09 0.00 -1.73 0.00 0.00 68.15 68.11 1mld h THR 203 CO -0.03 0.46 0.12 1.23 -0.25 0.00 0.00 175.52 177.05 1mld h GLY 204 N 0.38 0.75 1.56 5.82 0.00 -0.89 0.27 103.07 110.95 1mld h GLY 204 Ca 0.04 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 1mld h GLY 204 CO 0.07 -0.12 -0.28 -0.09 0.00 0.00 0.00 176.54 176.12 1mld h ARG 205 N 0.25 0.51 -0.01 4.80 2.43 -0.36 -0.35 114.38 121.65 1mld h ARG 205 Ca 0.31 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1mld h ARG 205 Cb 0.46 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1mld h ARG 205 CO -0.40 0.74 0.00 0.82 -1.51 0.00 0.00 179.97 179.62 1mld h ILE 206 N 0.44 1.20 -0.84 1.20 2.04 -0.90 -1.52 117.51 119.13 1mld h ILE 206 Ca 0.06 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 1mld h ILE 206 Cb 0.72 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 38.35 1mld h ILE 206 CO 0.06 0.16 0.47 1.56 0.00 0.00 0.00 178.15 180.39 1mld h GLN 207 N -0.23 1.17 -0.45 2.37 4.20 -0.66 -3.05 115.11 118.45 1mld h GLN 207 Ca 0.00 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.58 1mld h GLN 207 Cb 0.25 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1mld h GLN 207 CO 0.00 0.85 0.00 0.39 -0.67 0.00 0.00 178.83 179.40 1mld n GLU 208 N -4.39 2.51 -0.27 1.46 4.71 -0.17 -4.43 120.64 120.06 1mld n GLU 208 Ca 0.08 -2.30 0.28 0.00 -0.01 0.00 0.00 57.16 55.22 1mld n GLU 208 Cb 0.09 -1.52 0.65 0.00 -1.01 0.00 0.00 31.44 29.65 1mld n GLU 208 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1mld h ALA 209 N 4.46 2.69 0.02 0.62 0.00 -1.16 -0.75 119.26 125.14 1mld h ALA 209 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.66 1mld h ALA 209 Cb 0.96 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.81 1mld h ALA 209 CO 0.00 -1.02 -1.02 0.78 0.00 0.00 0.00 179.25 177.99 1mld h GLY 210 N 0.16 0.54 1.29 0.00 0.00 -1.82 -2.70 103.07 100.54 1mld h GLY 210 Ca 0.52 -1.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.77 1mld h GLY 210 CO -0.11 0.88 -0.04 -0.84 0.00 0.00 0.00 176.54 176.43 1mld h THR 211 N 0.26 1.25 -0.57 4.70 2.02 -1.51 -2.40 112.91 116.67 1mld h THR 211 Ca -0.11 -1.10 -0.09 0.00 0.77 0.00 0.00 66.41 65.88 1mld h THR 211 Cb 1.67 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1mld h THR 211 CO 0.18 0.39 0.01 -0.33 0.37 0.00 0.00 175.52 176.14 1mld h GLU 212 N 0.78 0.97 -0.27 6.66 4.39 -1.22 -1.33 114.58 124.56 1mld h GLU 212 Ca 0.14 -0.29 -0.12 0.00 0.34 0.00 0.00 59.36 59.43 1mld h GLU 212 Cb 0.53 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1mld h GLU 212 CO 0.03 0.95 -0.34 0.28 -1.16 0.00 0.00 179.01 178.77 1mld h VAL 213 N 0.90 1.29 -0.22 3.13 2.07 -1.26 0.01 116.25 122.16 1mld h VAL 213 Ca 0.17 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.24 1mld h VAL 213 Cb 0.52 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1mld h VAL 213 CO 0.03 0.47 0.09 0.58 0.02 0.00 0.00 177.57 178.75 1mld h VAL 214 N 0.49 0.97 -0.42 2.57 2.07 -1.31 0.28 116.25 120.90 1mld h VAL 214 Ca 0.05 -0.07 0.01 0.00 0.82 0.00 0.00 66.70 67.51 1mld h VAL 214 Cb 0.82 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1mld h VAL 214 CO 0.07 0.04 0.27 0.11 0.02 0.00 0.00 177.57 178.08 1mld h LYS 215 N 0.20 0.54 -0.48 1.57 1.57 -0.65 -2.16 116.57 117.16 1mld h LYS 215 Ca 0.09 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1mld h LYS 215 Cb 0.05 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1mld h LYS 215 CO -0.08 0.36 0.08 0.00 -0.57 0.00 0.00 179.45 179.24 1mld h ALA 216 N 1.15 1.25 0.00 3.86 0.00 -0.64 -1.98 119.26 122.91 1mld h ALA 216 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1mld h ALA 216 Cb -0.06 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1mld h ALA 216 CO -0.04 0.52 0.00 1.63 0.00 0.00 0.00 179.25 181.36 1mld n LYS 217 N -4.27 0.24 -4.06 0.00 5.02 0.95 -4.92 118.16 111.13 1mld n LYS 217 Ca 0.03 0.30 -0.28 0.00 -2.02 0.00 0.00 58.31 56.34 1mld n LYS 217 Cb 0.24 -1.84 -0.04 0.00 -0.02 0.00 0.00 35.03 33.37 1mld n LYS 217 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mld n ALA 218 N -1.79 -1.91 0.00 7.82 0.00 -0.75 -1.15 120.51 122.74 1mld n ALA 218 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1mld n ALA 218 Cb 0.35 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1mld n ALA 218 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mld n GLY 219 N -2.02 2.00 0.43 0.00 0.00 -1.26 -4.93 105.19 99.41 1mld n GLY 219 Ca -0.26 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.77 1mld n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mld n ALA 220 N -1.82 2.58 0.00 4.61 0.00 -0.30 -4.98 120.51 120.60 1mld n ALA 220 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1mld n ALA 220 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1mld n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mld n GLY 221 N 0.37 0.65 0.00 0.00 0.00 -1.26 -5.05 105.19 99.90 1mld n GLY 221 Ca 0.03 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.89 1mld n GLY 221 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mld n SER 222 N 0.15 1.69 -4.50 1.61 3.41 -1.26 -4.49 113.62 110.24 1mld n SER 222 Ca 0.00 -0.96 -0.58 0.00 -0.26 0.00 0.00 58.87 57.07 1mld n SER 222 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 1mld n SER 222 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mld n ALA 223 N -3.00 0.17 -0.02 7.33 0.00 -1.26 -4.82 120.51 118.91 1mld n ALA 223 Ca 0.00 0.21 -0.04 0.00 0.00 0.00 0.00 53.44 53.61 1mld n ALA 223 Cb 0.00 -2.24 -0.01 0.00 0.00 0.00 0.00 19.45 17.20 1mld n ALA 223 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mld n THR 224 N 5.88 0.19 -0.04 0.00 -2.24 -1.26 -4.37 114.28 112.44 1mld n THR 224 Ca 0.40 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.99 1mld n THR 224 Cb 0.08 -1.37 -0.08 0.00 -2.10 0.00 0.00 70.33 66.86 1mld n THR 224 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1mld h LEU 225 N -0.10 0.32 -0.65 3.22 3.38 -1.87 0.58 115.31 120.19 1mld h LEU 225 Ca -0.09 -0.52 -0.15 0.00 0.09 0.00 0.00 57.88 57.22 1mld h LEU 225 Cb 1.09 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1mld h LEU 225 CO -0.05 0.77 -0.59 0.77 0.09 0.00 0.00 178.44 179.44 1mld h SER 226 N -0.12 0.32 -0.62 -0.43 4.64 -1.98 -1.97 113.55 113.39 1mld h SER 226 Ca 0.01 -0.18 -0.08 0.00 -0.47 0.00 0.00 61.79 61.07 1mld h SER 226 Cb 0.70 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 1mld h SER 226 CO 0.04 0.84 0.06 -0.03 -0.87 0.00 0.00 176.83 176.87 1mld h MET 227 N 0.21 1.05 -0.51 4.77 1.85 -1.75 -0.65 114.93 119.90 1mld h MET 227 Ca -0.00 -0.30 0.06 0.00 -0.61 0.00 0.00 59.70 58.84 1mld h MET 227 Cb 1.09 -0.11 -0.05 0.00 0.43 0.00 0.00 31.60 32.96 1mld h MET 227 CO 0.09 1.00 0.22 0.00 -0.40 0.00 0.00 176.91 177.82 1mld h ALA 228 N 1.01 0.64 0.31 0.39 0.00 -0.66 -0.35 119.26 120.61 1mld h ALA 228 Ca 0.18 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1mld h ALA 228 Cb 0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1mld h ALA 228 CO 0.02 -0.16 -0.36 -0.92 0.00 0.00 0.00 179.25 177.82 1mld h TYR 229 N 0.42 -0.99 -0.30 0.00 3.20 -0.99 -1.17 116.97 117.14 1mld h TYR 229 Ca 0.24 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.13 1mld h TYR 229 Cb 0.21 0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1mld h TYR 229 CO -0.14 -0.50 0.18 0.00 -1.64 0.00 0.00 178.16 176.06 1mld h ALA 230 N -0.25 0.37 0.07 1.82 0.00 -0.94 -0.04 119.26 120.28 1mld h ALA 230 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1mld h ALA 230 Cb 0.67 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1mld h ALA 230 CO -0.10 -0.19 -0.03 0.78 0.00 0.00 0.00 179.25 179.71 1mld h GLY 231 N 0.36 -0.09 1.52 0.00 0.00 -1.07 -0.85 103.07 102.94 1mld h GLY 231 Ca 0.11 0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 1mld h GLY 231 CO -0.05 -0.03 0.20 0.00 0.00 0.00 0.00 176.54 176.65 1mld h ALA 232 N 0.82 1.51 0.49 3.60 0.00 -1.03 -2.30 119.26 122.35 1mld h ALA 232 Ca -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1mld h ALA 232 Cb 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1mld h ALA 232 CO 0.02 0.39 -0.23 -0.09 0.00 0.00 0.00 179.25 179.33 1mld h ARG 233 N 0.63 -0.63 -0.69 0.00 1.12 -0.46 0.23 114.38 114.58 1mld h ARG 233 Ca 0.16 0.04 0.10 0.00 -1.11 0.00 0.00 59.98 59.17 1mld h ARG 233 Cb 0.10 0.14 -0.07 0.00 -0.01 0.00 0.00 29.97 30.12 1mld h ARG 233 CO -0.02 -0.38 0.31 0.35 -3.11 0.00 0.00 179.97 177.12 1mld h PHE 234 N -0.73 0.56 -0.83 2.20 3.57 -1.03 -1.59 116.94 119.08 1mld h PHE 234 Ca -0.07 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1mld h PHE 234 Cb 0.54 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 1mld h PHE 234 CO -0.02 0.17 0.48 0.28 -2.23 0.00 0.00 178.31 176.98 1mld h VAL 235 N 0.53 1.24 -0.35 1.41 2.07 -1.10 -1.30 116.25 118.74 1mld h VAL 235 Ca 0.35 -0.57 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 1mld h VAL 235 Cb 0.41 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1mld h VAL 235 CO -0.30 0.26 -0.04 -0.26 0.02 0.00 0.00 177.57 177.25 1mld h PHE 236 N 1.15 0.72 -0.39 1.57 0.04 -0.04 -1.20 116.94 118.80 1mld h PHE 236 Ca 0.30 -0.14 0.08 0.00 2.80 0.00 0.00 57.97 61.01 1mld h PHE 236 Cb -0.00 -0.18 -0.08 0.00 2.20 0.00 0.00 35.95 37.88 1mld h PHE 236 CO 0.00 0.78 -0.20 0.77 -0.60 0.00 0.00 178.31 179.07 1mld h SER 237 N 0.45 -0.68 -0.67 2.17 0.02 -1.21 -0.35 113.55 113.28 1mld h SER 237 Ca 0.09 0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 1mld h SER 237 Cb 0.53 0.36 -0.04 0.00 0.14 0.00 0.00 62.40 63.39 1mld h SER 237 CO 0.03 -0.23 0.43 0.25 -1.14 0.00 0.00 176.83 176.17 1mld h LEU 238 N -0.13 0.73 -0.22 5.07 5.85 -0.93 -1.17 115.31 124.51 1mld h LEU 238 Ca 0.19 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1mld h LEU 238 Cb 0.43 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1mld h LEU 238 CO -0.47 0.52 -0.02 0.58 -0.34 0.00 0.00 178.44 178.71 1mld h VAL 239 N 0.87 1.27 -0.04 1.05 2.07 -0.89 -0.03 116.25 120.55 1mld h VAL 239 Ca 0.26 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.86 1mld h VAL 239 Cb -0.05 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1mld h VAL 239 CO -0.08 0.29 -0.13 0.44 0.02 0.00 0.00 177.57 178.11 1mld h ASP 240 N 0.16 -0.39 -0.88 0.57 3.32 -0.91 0.28 116.42 118.58 1mld h ASP 240 Ca 0.06 0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.22 1mld h ASP 240 Cb 0.44 0.17 -0.06 0.00 0.22 0.00 0.00 39.33 40.11 1mld h ASP 240 CO 0.01 -0.18 0.56 0.00 -1.72 0.00 0.00 179.24 177.91 1mld h ALA 241 N 0.79 1.18 -0.33 3.45 0.00 -1.18 -0.52 119.26 122.65 1mld h ALA 241 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1mld h ALA 241 Cb 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1mld h ALA 241 CO -0.16 0.36 0.06 0.52 0.00 0.00 0.00 179.25 180.04 1mld h MET 242 N 1.05 0.48 0.00 0.00 2.86 -0.31 -1.31 114.93 117.70 1mld h MET 242 Ca 0.36 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 1mld h MET 242 Cb 0.08 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1mld h MET 242 CO -0.14 0.46 0.00 0.09 1.06 0.00 0.00 176.91 178.38 1mld n ASN 243 N -4.34 0.00 0.00 1.22 3.02 0.92 -4.74 115.26 111.34 1mld n ASN 243 Ca 0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 1mld n ASN 243 Cb 0.19 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1mld n ASN 243 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mld n GLY 244 N 0.84 0.80 3.69 7.41 0.00 -0.50 -5.04 105.19 112.39 1mld n GLY 244 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1mld n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mld s LYS 245 N -0.42 4.27 0.45 1.61 -0.14 -0.31 -4.97 119.74 120.23 1mld s LYS 245 Ca 0.00 2.06 -0.21 0.00 -1.36 0.00 0.00 55.97 56.46 1mld s LYS 245 Cb 0.00 -3.54 -0.10 0.00 -1.68 0.00 0.00 37.83 32.51 1mld s LYS 245 CO 0.00 -0.60 0.99 -1.21 -0.76 0.00 0.00 175.35 173.77 1mld s GLU 246 N 2.31 4.08 -0.69 1.68 0.41 -1.26 -4.17 118.70 121.06 1mld s GLU 246 Ca 0.66 1.23 0.00 0.00 -0.41 0.00 0.00 54.97 56.45 1mld s GLU 246 Cb -0.34 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1mld s GLU 246 CO 0.28 -0.17 0.00 0.41 -0.49 0.00 0.00 175.26 175.29 1mld n GLY 247 N -0.44 0.87 3.60 -1.39 0.00 -1.26 -4.99 105.19 101.58 1mld n GLY 247 Ca 0.08 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 1mld n GLY 247 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mld s VAL 248 N -2.19 3.92 0.01 1.61 1.01 -1.26 -5.00 120.40 118.50 1mld s VAL 248 Ca 0.00 0.91 0.08 0.00 0.00 0.00 0.00 61.98 62.97 1mld s VAL 248 Cb 0.00 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 1mld s VAL 248 CO 0.00 -0.86 -0.25 0.68 0.00 0.00 0.00 175.10 174.67 1mld s VAL 249 N 5.44 1.97 -0.07 2.92 -7.23 -1.26 -1.14 120.40 121.03 1mld s VAL 249 Ca 0.58 -1.20 -0.05 0.00 -1.81 0.00 0.00 61.98 59.51 1mld s VAL 249 Cb -0.12 -1.67 0.03 0.00 0.56 0.00 0.00 36.38 35.18 1mld s VAL 249 CO 0.31 0.43 0.17 -1.61 -0.31 0.00 0.00 175.10 174.10 1mld s GLU 250 N -0.91 0.17 0.39 4.82 0.41 -0.42 -4.92 118.70 118.25 1mld s GLU 250 Ca 0.10 0.30 -0.24 0.00 -0.41 0.00 0.00 54.97 54.72 1mld s GLU 250 Cb -0.10 0.01 -0.09 0.00 -1.78 0.00 0.00 34.13 32.17 1mld s GLU 250 CO 0.01 -0.07 1.01 0.00 -0.49 0.00 0.00 175.26 175.72 1mld s SER 252 N -1.67 -0.63 -0.26 0.00 0.15 -1.10 -4.58 113.70 105.62 1mld s SER 252 Ca 0.57 0.75 -0.27 0.00 0.70 0.00 0.00 55.95 57.69 1mld s SER 252 Cb -0.19 0.62 0.01 0.00 -1.71 0.00 0.00 66.02 64.74 1mld s SER 252 CO 0.25 -0.56 0.97 0.12 1.20 0.00 0.00 173.24 175.22 1mld s PHE 253 N -1.03 3.28 0.14 3.44 5.36 -0.63 -2.96 117.98 125.58 1mld s PHE 253 Ca -0.10 1.26 -0.14 0.00 -0.96 0.00 0.00 56.93 57.00 1mld s PHE 253 Cb -0.01 -3.30 0.02 0.00 -0.34 0.00 0.00 43.02 39.39 1mld s PHE 253 CO 0.09 -0.53 0.37 0.54 -1.46 0.00 0.00 175.22 174.23 1mld s VAL 254 N 3.18 0.07 0.17 3.12 0.11 -0.98 -0.87 120.40 125.21 1mld s VAL 254 Ca 0.41 -0.90 -0.32 0.00 -2.93 0.00 0.00 61.98 58.24 1mld s VAL 254 Cb -0.14 -1.44 -0.10 0.00 -1.53 0.00 0.00 36.38 33.16 1mld s VAL 254 CO 0.09 -0.32 1.62 -0.75 -3.33 0.00 0.00 175.10 172.41 1mld s LYS 255 N -3.87 4.19 0.04 1.54 2.20 -1.26 -2.22 119.74 120.37 1mld s LYS 255 Ca 0.08 2.43 -0.00 0.00 -0.36 0.00 0.00 55.97 58.12 1mld s LYS 255 Cb 0.02 -3.16 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 1mld s LYS 255 CO -0.07 -0.66 -0.04 0.45 -0.36 0.00 0.00 175.35 174.68 1mld s SER 256 N 1.24 0.49 0.00 1.43 0.15 -0.31 -4.90 113.70 111.81 1mld s SER 256 Ca 0.72 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 56.54 1mld s SER 256 Cb -0.45 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 1mld s SER 256 CO 0.32 -0.48 0.34 0.00 1.20 0.00 0.00 173.24 174.62 1mld n GLN 257 N 0.62 0.13 0.24 5.44 0.00 -1.26 -4.41 117.38 118.14 1mld n GLN 257 Ca -0.17 -0.37 0.14 0.00 0.00 0.00 0.00 57.00 56.59 1mld n GLN 257 Cb 0.59 -0.55 0.34 0.00 0.00 0.00 0.00 30.24 30.62 1mld n GLN 257 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1mld h GLU 258 N 0.00 0.00 0.00 2.61 4.39 -1.96 -3.46 114.58 116.16 1mld h GLU 258 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1mld h GLU 258 Cb 0.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 1mld h GLU 258 CO 0.00 0.00 0.00 2.41 -1.16 0.00 0.00 179.01 180.26 1mld n THR 259 N -3.09 0.00 0.34 1.13 -1.04 -1.26 -4.96 114.28 105.40 1mld n THR 259 Ca 0.03 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.10 1mld n THR 259 Cb 0.46 0.00 0.21 0.00 -1.82 0.00 0.00 70.33 69.18 1mld n THR 259 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1mld n ASP 260 N -2.24 2.87 -4.57 8.00 5.75 -1.26 -4.76 116.55 120.33 1mld n ASP 260 Ca 0.00 -2.19 -0.36 0.00 -0.01 0.00 0.00 54.79 52.23 1mld n ASP 260 Cb 0.00 -0.40 -0.11 0.00 -1.03 0.00 0.00 41.12 39.58 1mld n ASP 260 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1mld h PRO 262 N 7.56 0.00 -4.18 0.00 0.13 -1.86 -3.41 132.00 130.24 1mld h PRO 262 Ca -0.37 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.40 1mld h PRO 262 Cb 1.17 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.00 1mld h PRO 262 CO 0.63 0.03 -0.76 0.71 -0.23 0.00 0.00 178.00 178.38 1mld s TYR 263 N -4.19 0.54 -0.10 1.56 2.02 -1.26 -1.16 117.35 114.76 1mld s TYR 263 Ca -0.04 -0.11 -0.30 0.00 -0.37 0.00 0.00 57.07 56.25 1mld s TYR 263 Cb 0.13 -0.43 0.10 0.00 -0.40 0.00 0.00 41.96 41.36 1mld s TYR 263 CO 0.49 -0.07 0.85 0.12 -1.57 0.00 0.00 175.55 175.37 1mld s PHE 264 N 0.31 -0.50 -0.12 2.71 5.36 -0.94 -4.88 117.98 119.92 1mld s PHE 264 Ca -0.03 0.83 -0.06 0.00 -0.96 0.00 0.00 56.93 56.71 1mld s PHE 264 Cb -0.07 0.44 -0.04 0.00 -0.34 0.00 0.00 43.02 43.01 1mld s PHE 264 CO -0.00 -0.47 0.10 0.45 -1.46 0.00 0.00 175.22 173.84 1mld s SER 265 N -1.21 6.05 0.22 6.13 0.15 0.05 -2.31 113.70 122.78 1mld s SER 265 Ca -0.05 0.36 -0.16 0.00 0.70 0.00 0.00 55.95 56.79 1mld s SER 265 Cb -0.00 -1.91 0.02 0.00 -1.71 0.00 0.00 66.02 62.41 1mld s SER 265 CO 0.05 0.38 0.53 -0.89 1.20 0.00 0.00 173.24 174.50 1mld s THR 266 N -0.86 0.02 0.23 6.45 2.01 -1.16 -2.17 115.64 120.16 1mld s THR 266 Ca 0.14 -0.98 -0.31 0.00 0.31 0.00 0.00 61.69 60.85 1mld s THR 266 Cb -0.12 -1.78 -0.10 0.00 0.01 0.00 0.00 72.50 70.51 1mld s THR 266 CO 0.03 -0.09 1.52 -2.84 -0.69 0.00 0.00 174.62 172.56 1mld s PRO 267 N -3.92 4.22 -0.03 4.92 0.02 -1.26 -2.69 135.00 136.27 1mld s PRO 267 Ca 0.13 2.38 0.03 0.00 0.02 0.00 0.00 61.00 63.56 1mld s PRO 267 Cb -0.01 -3.11 -0.00 0.00 0.02 0.00 0.00 34.50 31.40 1mld s PRO 267 CO 0.01 -0.53 -0.12 -0.51 -0.33 0.00 0.00 177.00 175.51 1mld s LEU 268 N 0.19 1.89 -0.20 -5.54 2.01 -0.53 -0.49 118.68 116.02 1mld s LEU 268 Ca 0.64 -0.25 -0.24 0.00 0.01 0.00 0.00 54.13 54.30 1mld s LEU 268 Cb -0.44 -0.70 -0.02 0.00 0.01 0.00 0.00 46.19 45.05 1mld s LEU 268 CO 0.39 0.12 0.77 -0.22 1.01 0.00 0.00 176.35 178.42 1mld s LEU 269 N -0.00 4.14 0.02 1.79 2.96 0.46 -1.30 118.68 126.74 1mld s LEU 269 Ca -0.01 1.04 -0.04 0.00 -0.22 0.00 0.00 54.13 54.90 1mld s LEU 269 Cb -0.08 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 1mld s LEU 269 CO 0.01 -0.39 0.23 -0.76 -1.32 0.00 0.00 176.35 174.12 1mld s LEU 270 N 2.25 4.36 0.00 -0.68 1.43 -0.29 -1.49 118.68 124.25 1mld s LEU 270 Ca 0.35 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1mld s LEU 270 Cb -0.16 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.32 1mld s LEU 270 CO 0.11 0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.53 1mld n GLY 271 N 0.86 5.15 0.25 -3.19 0.00 0.29 -4.48 105.19 104.06 1mld n GLY 271 Ca -0.10 -1.44 0.13 0.00 0.00 0.00 0.00 46.02 44.62 1mld n GLY 271 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mld h LYS 272 N 0.00 0.00 -0.27 1.61 1.57 -1.85 -2.59 116.57 115.05 1mld h LYS 272 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1mld h LYS 272 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1mld h LYS 272 CO 0.00 0.12 -0.00 1.17 -0.57 0.00 0.00 179.45 180.17 1mld n LYS 273 N -3.28 2.67 0.00 3.15 4.81 -1.26 -4.70 118.16 119.55 1mld n LYS 273 Ca 0.00 -2.88 0.00 0.00 -0.87 0.00 0.00 58.31 54.56 1mld n LYS 273 Cb 0.37 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.59 1mld n LYS 273 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mld n GLY 274 N -0.66 0.78 3.69 3.14 0.00 -0.98 -4.70 105.19 106.47 1mld n GLY 274 Ca 0.23 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 1mld n GLY 274 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1mld s ILE 275 N 0.00 3.72 -0.20 -0.61 2.07 -0.58 -0.55 121.20 125.05 1mld s ILE 275 Ca 0.00 1.14 -0.01 0.00 -1.41 0.00 0.00 60.65 60.36 1mld s ILE 275 Cb 0.00 -3.73 -0.21 0.00 0.13 0.00 0.00 42.46 38.65 1mld s ILE 275 CO 0.00 0.02 0.04 -0.62 -1.91 0.00 0.00 174.94 172.47 1mld n GLU 276 N 5.02 0.70 -3.67 3.50 4.71 -0.56 -4.86 120.64 125.48 1mld n GLU 276 Ca 0.12 0.20 -0.11 0.00 -0.01 0.00 0.00 57.16 57.36 1mld n GLU 276 Cb 0.44 -1.60 -0.11 0.00 -1.01 0.00 0.00 31.44 29.15 1mld n GLU 276 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1mld s LYS 277 N -2.54 0.26 -0.33 3.49 2.20 -0.81 -5.01 119.74 117.01 1mld s LYS 277 Ca -0.29 0.85 -0.26 0.00 -0.36 0.00 0.00 55.97 55.91 1mld s LYS 277 Cb 0.08 0.11 0.01 0.00 -1.51 0.00 0.00 37.83 36.52 1mld s LYS 277 CO 0.68 -0.24 0.94 1.21 -0.36 0.00 0.00 175.35 177.58 1mld s ASN 278 N 2.26 6.77 0.00 1.43 3.84 -1.26 -0.41 114.94 127.57 1mld s ASN 278 Ca -0.02 0.78 0.28 0.00 0.21 0.00 0.00 52.86 54.11 1mld s ASN 278 Cb -0.11 -2.48 1.59 0.00 -0.55 0.00 0.00 41.25 39.70 1mld s ASN 278 CO -0.11 -0.80 2.00 0.18 -2.79 0.00 0.00 177.10 175.58 1mld n LEU 279 N 6.65 0.00 -0.46 3.21 4.32 0.35 -4.97 117.00 126.10 1mld n LEU 279 Ca 0.08 0.08 0.06 0.00 -0.02 0.00 0.00 56.01 56.21 1mld n LEU 279 Cb 0.48 -0.08 -0.02 0.00 -1.62 0.00 0.00 43.42 42.18 1mld n LEU 279 CO 0.56 -0.01 -0.10 0.61 -1.22 0.00 0.00 177.39 177.23 1mld n GLY 280 N 0.82 -1.64 0.14 -0.72 0.00 -1.26 -4.53 105.19 98.01 1mld n GLY 280 Ca 0.19 -1.41 -0.09 0.00 0.00 0.00 0.00 46.02 44.71 1mld n GLY 280 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1mld h ILE 281 N -0.43 1.46 -0.25 -0.61 2.04 -1.94 -3.38 117.51 114.40 1mld h ILE 281 Ca 0.00 -2.52 0.00 0.00 1.00 0.00 0.00 64.86 63.35 1mld h ILE 281 Cb 0.42 2.41 -0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1mld h ILE 281 CO 0.01 0.74 -0.01 0.61 0.00 0.00 0.00 178.15 179.50 1mld n GLY 282 N 0.83 -2.00 3.66 5.37 0.00 -1.26 -4.75 105.19 107.04 1mld n GLY 282 Ca -0.04 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.19 1mld n GLY 282 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mld s LYS 283 N -0.12 4.22 0.08 1.61 2.20 -1.26 -5.02 119.74 121.45 1mld s LYS 283 Ca 0.00 0.68 0.06 0.00 -0.36 0.00 0.00 55.97 56.34 1mld s LYS 283 Cb 0.00 -3.58 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1mld s LYS 283 CO 0.00 -0.26 -0.05 -1.50 -0.36 0.00 0.00 175.35 173.17 1mld s ILE 284 N 1.98 3.68 0.70 5.43 1.10 -1.26 -4.85 121.20 127.97 1mld s ILE 284 Ca 0.30 -1.07 -0.11 0.00 -0.51 0.00 0.00 60.65 59.26 1mld s ILE 284 Cb -0.16 -2.71 0.02 0.00 0.15 0.00 0.00 42.46 39.76 1mld s ILE 284 CO 0.11 0.16 1.08 -0.94 -2.11 0.00 0.00 174.94 173.24 1mld s SER 285 N -2.11 5.38 0.47 4.50 1.04 -1.26 -4.86 113.70 116.86 1mld s SER 285 Ca 0.22 1.06 0.14 0.00 0.48 0.00 0.00 55.95 57.85 1mld s SER 285 Cb -0.11 -1.85 1.09 0.00 0.10 0.00 0.00 66.02 65.26 1mld s SER 285 CO 0.14 -1.36 2.07 -0.65 0.98 0.00 0.00 173.24 174.42 1mld h PRO 286 N -0.64 0.09 0.26 4.02 0.11 -2.01 0.21 132.00 134.05 1mld h PRO 286 Ca -0.45 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1mld h PRO 286 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1mld h PRO 286 CO 0.64 0.13 -0.13 0.35 -0.21 0.00 0.00 178.00 178.78 1mld h PHE 287 N 0.10 -0.33 -0.44 0.65 3.57 -2.00 -1.06 116.94 117.43 1mld h PHE 287 Ca 0.02 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.42 1mld h PHE 287 Cb 0.12 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1mld h PHE 287 CO 0.00 -0.07 -0.10 0.93 -2.23 0.00 0.00 178.31 176.84 1mld h GLU 288 N -0.55 0.79 -0.75 1.11 5.08 -1.83 -1.88 114.58 116.55 1mld h GLU 288 Ca -0.04 -0.26 0.08 0.00 -1.00 0.00 0.00 59.36 58.14 1mld h GLU 288 Cb 0.40 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 1mld h GLU 288 CO 0.06 0.86 0.42 1.49 -1.00 0.00 0.00 179.01 180.84 1mld h GLU 289 N 0.72 0.71 -0.04 2.33 4.81 -0.82 -0.82 114.58 121.48 1mld h GLU 289 Ca 0.12 -0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.12 1mld h GLU 289 Cb 0.58 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1mld h GLU 289 CO 0.04 0.47 -0.79 0.87 -0.73 0.00 0.00 179.01 178.87 1mld h LYS 290 N 0.73 0.30 -0.57 1.92 1.79 -0.73 -2.71 116.57 117.29 1mld h LYS 290 Ca 0.35 -0.28 0.02 0.00 -2.18 0.00 0.00 60.65 58.57 1mld h LYS 290 Cb 0.29 0.07 -0.04 0.00 -1.58 0.00 0.00 32.23 30.97 1mld h LYS 290 CO -0.22 0.95 0.35 0.52 -1.08 0.00 0.00 179.45 179.96 1mld h MET 291 N 0.19 0.67 -0.83 3.15 2.86 -0.48 -0.22 114.93 120.28 1mld h MET 291 Ca -0.04 -0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.64 1mld h MET 291 Cb 1.38 -0.15 -0.07 0.00 0.06 0.00 0.00 31.60 32.83 1mld h MET 291 CO 0.13 0.44 0.49 0.82 1.06 0.00 0.00 176.91 179.86 1mld h ILE 292 N 0.69 0.98 -0.70 -1.22 2.04 -1.10 -2.07 117.51 116.13 1mld h ILE 292 Ca 0.23 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1mld h ILE 292 Cb 0.01 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.09 1mld h ILE 292 CO -0.10 0.16 0.30 0.00 0.00 0.00 0.00 178.15 178.52 1mld h ALA 293 N 1.42 0.91 0.00 1.87 0.00 -1.04 -2.16 119.26 120.26 1mld h ALA 293 Ca 0.38 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1mld h ALA 293 Cb 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1mld h ALA 293 CO -0.21 0.50 -0.25 1.05 0.00 0.00 0.00 179.25 180.35 1mld h GLU 294 N 0.99 0.00 0.00 0.00 -0.00 -0.64 -3.29 114.58 111.64 1mld h GLU 294 Ca 0.24 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 59.46 1mld h GLU 294 Cb 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 28.90 1mld h GLU 294 CO -0.02 0.25 -0.83 0.00 -0.00 0.00 0.00 179.01 178.40 1mld h ALA 295 N 1.75 0.64 -0.33 1.06 0.00 -0.77 -3.41 119.26 118.20 1mld h ALA 295 Ca -0.00 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 1mld h ALA 295 Cb 0.85 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1mld h ALA 295 CO 0.03 0.77 0.11 0.82 0.00 0.00 0.00 179.25 180.98 1mld h ILE 296 N 0.00 1.20 -0.96 0.00 2.04 -1.51 -2.13 117.51 116.16 1mld h ILE 296 Ca -0.05 -0.66 0.12 0.00 1.00 0.00 0.00 64.86 65.26 1mld h ILE 296 Cb 1.48 1.01 -0.08 0.00 -0.74 0.00 0.00 36.82 38.50 1mld h ILE 296 CO 0.07 0.23 0.61 1.55 0.00 0.00 0.00 178.15 180.60 1mld h PRO 297 N 0.38 0.89 -0.48 2.37 0.13 -1.81 0.17 132.00 133.64 1mld h PRO 297 Ca 0.11 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.13 1mld h PRO 297 Cb 0.24 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.15 1mld h PRO 297 CO -0.00 0.59 0.10 1.49 -0.23 0.00 0.00 178.00 179.94 1mld h GLU 298 N 0.92 0.79 -0.13 0.86 4.81 -1.73 -2.45 114.58 117.64 1mld h GLU 298 Ca 0.47 -0.20 -0.13 0.00 -0.13 0.00 0.00 59.36 59.37 1mld h GLU 298 Cb 0.51 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1mld h GLU 298 CO -0.23 0.78 -0.42 1.25 -0.73 0.00 0.00 179.01 179.66 1mld h LEU 299 N 0.67 0.60 -1.02 1.64 5.85 -1.02 -2.94 115.31 119.09 1mld h LEU 299 Ca 0.15 -0.60 0.01 0.00 0.84 0.00 0.00 57.88 58.27 1mld h LEU 299 Cb 0.36 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.16 1mld h LEU 299 CO 0.01 1.10 0.66 0.11 -0.34 0.00 0.00 178.44 179.98 1mld h LYS 300 N 0.13 1.32 -0.51 1.25 1.57 -0.57 -1.62 116.57 118.13 1mld h LYS 300 Ca -0.02 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1mld h LYS 300 Cb 1.05 -0.30 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 1mld h LYS 300 CO 0.09 0.87 0.27 0.00 -0.57 0.00 0.00 179.45 180.11 1mld h ALA 301 N 1.38 0.66 -0.41 3.86 0.00 -1.44 -1.27 119.26 122.03 1mld h ALA 301 Ca 0.37 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1mld h ALA 301 Cb -0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1mld h ALA 301 CO -0.08 0.19 0.10 0.77 0.00 0.00 0.00 179.25 180.23 1mld h SER 302 N 0.68 0.57 0.49 0.00 0.02 -1.21 -0.81 113.55 113.29 1mld h SER 302 Ca 0.18 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1mld h SER 302 Cb 0.07 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.47 1mld h SER 302 CO -0.03 0.57 -0.24 0.40 -1.14 0.00 0.00 176.83 176.40 1mld h ILE 303 N 0.60 0.39 -0.56 3.27 2.04 -1.14 -2.27 117.51 119.84 1mld h ILE 303 Ca 0.14 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.59 1mld h ILE 303 Cb 0.24 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1mld h ILE 303 CO -0.00 0.06 0.37 0.11 0.00 0.00 0.00 178.15 178.69 1mld h LYS 304 N -0.96 0.69 -0.67 2.37 6.56 -1.05 -1.36 116.57 122.15 1mld h LYS 304 Ca -0.07 -0.04 0.05 0.00 -1.06 0.00 0.00 60.65 59.54 1mld h LYS 304 Cb 0.60 -0.16 -0.05 0.00 -0.57 0.00 0.00 32.23 32.05 1mld h LYS 304 CO 0.11 0.46 0.38 -0.22 -2.06 0.00 0.00 179.45 178.12 1mld h LYS 305 N 0.71 0.69 -0.05 3.15 3.64 -1.09 -0.77 116.57 122.86 1mld h LYS 305 Ca 0.22 -0.04 -0.21 0.00 -1.27 0.00 0.00 60.65 59.34 1mld h LYS 305 Cb -0.01 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1mld h LYS 305 CO -0.05 0.46 -0.84 0.78 -2.27 0.00 0.00 179.45 177.52 1mld h GLY 306 N 0.71 0.53 0.68 5.01 0.00 -0.67 -3.06 103.07 106.27 1mld h GLY 306 Ca 0.30 -0.83 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 1mld h GLY 306 CO -0.17 0.74 -0.10 0.83 0.00 0.00 0.00 176.54 177.84 1mld h GLU 307 N 0.30 -0.27 -0.75 4.80 5.08 -0.83 -3.09 114.58 119.82 1mld h GLU 307 Ca -0.06 0.02 0.18 0.00 -1.00 0.00 0.00 59.36 58.49 1mld h GLU 307 Cb 1.46 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.72 1mld h GLU 307 CO 0.15 0.05 0.51 0.93 -1.00 0.00 0.00 179.01 179.65 1mld h GLU 308 N -0.61 0.24 -0.54 2.33 4.39 -1.25 -1.38 114.58 117.77 1mld h GLU 308 Ca -0.03 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 1mld h GLU 308 Cb 0.44 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1mld h GLU 308 CO 0.05 0.16 0.27 0.35 -1.16 0.00 0.00 179.01 178.68 1mld h PHE 309 N 0.25 0.76 0.00 4.33 3.57 -1.45 -2.46 116.94 121.94 1mld h PHE 309 Ca 0.37 -0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.70 1mld h PHE 309 Cb 1.08 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.56 1mld h PHE 309 CO -0.00 0.58 -0.65 0.28 -2.23 0.00 0.00 178.31 176.29 1mld h VAL 310 N 0.72 1.46 0.00 1.41 2.07 -1.29 -2.31 116.25 118.31 1mld h VAL 310 Ca 0.19 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.48 1mld h VAL 310 Cb 0.09 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1mld h VAL 310 CO -0.03 0.64 0.00 0.29 0.02 0.00 0.00 177.57 178.49 1mld n LYS 311 N -3.76 0.41 0.06 1.57 5.02 -0.83 -1.85 118.16 118.77 1mld n LYS 311 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1mld n LYS 311 Cb 0.64 -1.09 0.00 0.00 -0.02 0.00 0.00 35.03 34.56 1mld n LYS 311 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1mld n ASN 312 N -0.13 0.60 0.00 4.39 5.03 -1.07 -5.03 115.26 119.05 1mld n ASN 312 Ca 0.00 0.17 0.00 0.00 0.87 0.00 0.00 54.58 55.62 1mld n ASN 312 Cb 0.05 -0.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.69 1mld n ASN 312 CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.26 176.58